A0A077Z1R0_TRITR Loading...

Anion exchange protein

AlphaFold DB , UniProt , Accession A0A077Z1R0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 943 aa.

						>A0A077Z1R0_TRITR|A0A077Z1R0
MSGFVRKISTNFAVSVPRKDTIMSSDFLVDPFVAGQTIHAGQSGEALAERIRSLIESELIVDEEGAEFHPLFCELLSLTENPELGERYFWAEKSRWIKYEETVEEGERWSKPHISLLTMDNLLLLKSALKNCDSNFDFQVSGYVELIECITESWSKQFDISKTEVKSAKAALLARKQHFKKPKLRMSDMTSPESSANIVEQEEGEGQKNSAKAAAKQAHHTLLRKLPKDTEGAAVLIGYIDGISRPLAHFVRLKSALLIDDLLEVFSKVCYKAKDCKDLTYAADEFISQSIIIPAGKWSPSSRLEPADNAVPVKRTIGRTRRQILAQTPPSKKTFQRTGRIFGGLVDDLKAKAPWYVSDFTDGLRGRLTQTIAAAIFLFFANISKIITFGGVMDHVLKKQIGTIENVLAGGVCGIIYALFAGQPLCVLSATGPCLVFEAMMFSFCENQNWDFLCARFWVGFWTSIVLLIFVAFDASVMVSWITRFTEEAFASLISLIFLVKALEEMFAITETNPVLPKITVSLDDHKFFKANGSQSVRMARSLPSESHNFTISECFELGGRVQDDACIIEPNVYLFSVIMIILTAAIAFALKWFRHSSFFSSRVRNVIADFNVTIAIAVMAVLNACLNIHAPCLSVPDRLVVSCFALARSTFNCIAFVLKPTSGRSWFVNPLSIDPWWLSLVAILPALFFSILILMDQNITSVIVNRPDNKLQKGFGYHLDLTVISVLMIVCSLLGIPFYVAATVISLMHLESLRIMSEIAAPGEKPAFLGIKEQRVTALIAHILIGLAVFLTPVMKLVPVPALLGIFIYMGIVSLIGQQFMERVLIIFMPAKHQPDYPWLRMVPLRKIHIFTAVQILSFVLLAIVEEVKVVSMLFPLMLLVLICIRRFLLPLLFSKKELKVLDDELPSWNEVMKPMRRPRRSKAIALSDTTQKVQLLPNSEV
					

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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	37.7	Very low	40.7	Very low	209 Å²	209	123.4 Å²	123.4	100%	1.03	66%	0.658	S	S	*	*				0	-43.5	0	-92.6	-159.3	169.2	0	0	113.9	G3 F4 V5	M1-G3 VanDerWaalsContact C-N 3.29Å; M1-G3 PolarHBondContact O-N 3.36Å; M1-F4 WeakPolarHBondContact O-CB 3.45Å; M1-F4 PolarHBondContact O-N 3.15Å; M1-V5 PolarHBondContact O-N 3.18Å
2	S	36.1	Very low	40.1	Very low	107 Å²	107	126.6 Å²	126.6	75%	0.748	66%	0.662	S	S	*	*	H	α-helix	trans	-57.5	-35.6	177.9	57.7	0	0	0	0	114.2	F4 V5 R6	S2-F4 VanDerWaalsContact C-N 3.34Å; S2-F4 PolarHBondContact O-N 3.11Å; S2-V5 PolarHBondContact O-N 3.4Å; S2-R6 PolarHBondContact O-N 3.11Å; S2-R6 VanDerWaalsContact O-N 3.07Å
3	G	41.7	Very low	39.7	Very low	51 Å²	51	123.1 Å²	123.1	53%	0.526	66%	0.663	S	S	.	*	H	α-helix	trans	-67.4	-28.1	174.5	0	0	0	0	0	114.7	M1 K7	M1-G3 VanDerWaalsContact C-N 3.29Å; M1-G3 PolarHBondContact O-N 3.36Å; G3-K7 PolarHBondContact O-N 3.37Å
4	F	44.9	Very low	39.1	Very low	154 Å²	154	122.8 Å²	122.8	68%	0.675	67%	0.667	S	S	*	*	H	α-helix	trans	-76	-40.2	177.2	-171.6	-102	0	0	0	111	M1 S2 R6 K7 I8	M1-F4 WeakPolarHBondContact O-CB 3.45Å; M1-F4 PolarHBondContact O-N 3.15Å; S2-F4 VanDerWaalsContact C-N 3.34Å; S2-F4 PolarHBondContact O-N 3.11Å; F4-R6 VanDerWaalsContact C-N 3.34Å; F4-R6 PolarHBondContact O-N 3.36Å; F4-K7 PolarHBondContact O-N 2.7Å; F4-I8 HydrophobicContact CD1-CD1 4.1Å; F4-I8 HydrophobicContact CE1-CD1 3.71Å; F4-I8 HydrophobicContact CZ-CD1 4.23Å; F4-I8 PolarHBondContact O-N 3.15Å
5	V	46.1	Very low	38.4	Very low	101 Å²	101	121.1 Å²	121.1	61%	0.612	67%	0.668	S	S	*	*	H	α-helix	trans	-64.3	-39.7	174.1	179.6	0	0	0	0	111.1	M1 S2 K7 I8 S9	M1-V5 PolarHBondContact O-N 3.18Å; S2-V5 PolarHBondContact O-N 3.4Å; V5-K7 PolarHBondContact O-N 3.13Å; V5-I8 PolarHBondContact O-N 3.42Å; V5-S9 PolarHBondContact O-N 2.84Å; V5-S9 VanDerWaalsContact O-N 3.15Å
6	R	36.3	Very low	37.9	Very low	200 Å²	200	121.4 Å²	121.4	76%	0.755	67%	0.674	S	S	*	*	H	α-helix	trans	-66.4	-35.3	178.6	-138.6	175.8	-168.7	177.7	2.9	112.7	S2 F4 S9 T10	S2-R6 PolarHBondContact O-N 3.11Å; S2-R6 VanDerWaalsContact O-N 3.07Å; F4-R6 VanDerWaalsContact C-N 3.34Å; F4-R6 PolarHBondContact O-N 3.36Å; R6-S9 PolarHBondContact O-N 2.72Å; R6-T10 PolarHBondContact O-N 3.24Å; R6-T10 VanDerWaalsContact O-N 3.13Å; R6-T10 PolarHBondContact O-OG1 2.84Å
7	K	39.8	Very low	37.4	Very low	150 Å²	150	120.2 Å²	120.2	65%	0.652	67%	0.673	S	S	*	*	H	α-helix	trans	-69.8	-32.4	178.5	-129.1	176.1	-175.4	-179.9	0	113.1	G3 F4 V5 T10 N11	G3-K7 PolarHBondContact O-N 3.37Å; F4-K7 PolarHBondContact O-N 2.7Å; V5-K7 PolarHBondContact O-N 3.13Å; K7-T10 PolarHBondContact O-OG1 3.29Å; K7-N11 PolarHBondContact O-N 2.91Å
8	I	41.9	Very low	36.7	Very low	90 Å²	90	126.4 Å²	126.4	46%	0.462	68%	0.684	S	S	.	*	H	α-helix	trans	-72.7	-40.8	174.6	-66	174.3	0	0	0	110.6	F4 V5 T10 N11 F12	F4-I8 HydrophobicContact CD1-CD1 4.1Å; F4-I8 HydrophobicContact CE1-CD1 3.71Å; F4-I8 HydrophobicContact CZ-CD1 4.23Å; F4-I8 PolarHBondContact O-N 3.15Å; V5-I8 PolarHBondContact O-N 3.42Å; I8-T10 VanDerWaalsContact C-N 3.35Å; I8-T10 PolarHBondContact O-N 2.81Å; I8-N11 PolarHBondContact O-N 2.89Å; I8-F12 HydrophobicContact CG2-CD2 4.49Å
9	S	42.9	Very low	36.4	Very low	81 Å²	81	129.6 Å²	129.6	57%	0.566	69%	0.691	S	S	*	*	H	α-helix	trans	-62.4	-38.6	176.9	165.5	0	0	0	0	112.8	V5 R6	V5-S9 PolarHBondContact O-N 2.84Å; V5-S9 VanDerWaalsContact O-N 3.15Å; R6-S9 PolarHBondContact O-N 2.72Å
10	T	41.7	Very low	36.1	Very low	83 Å²	83	130.5 Å²	130.5	51%	0.509	70%	0.696	S	S	.	*	H	α-helix	trans	-76.1	-30.1	-179.9	49.2	0	0	0	0	113.7	R6 K7 I8 F12	R6-T10 PolarHBondContact O-N 3.24Å; R6-T10 VanDerWaalsContact O-N 3.13Å; R6-T10 PolarHBondContact O-OG1 2.84Å; K7-T10 PolarHBondContact O-OG1 3.29Å; I8-T10 VanDerWaalsContact C-N 3.35Å; I8-T10 PolarHBondContact O-N 2.81Å; T10-F12 PolarHBondContact O-N 3.38Å
11	N	38.2	Very low	35.8	Very low	131 Å²	131	130.5 Å²	130.5	70%	0.701	70%	0.701	S	S	*	*	H	α-helix	trans	-75.8	-21.7	-177.6	-79.5	-3.5	0	0	0	113.7	K7 I8	K7-N11 PolarHBondContact O-N 2.91Å; I8-N11 PolarHBondContact O-N 2.89Å
12	F	33.9	Very low	35.4	Very low	162 Å²	162	126.7 Å²	126.7	71%	0.711	68%	0.683	S	S	*	*	H	α-helix	trans	-97.6	-11.1	-180	-83.7	-79.7	0	0	0	114.9	I8 T10 V14	I8-F12 HydrophobicContact CG2-CD2 4.49Å; T10-F12 PolarHBondContact O-N 3.38Å; F12-V14 VanDerWaalsContact C-N 3.29Å; F12-V14 PolarHBondContact O-N 2.73Å
13	A	34.9	Very low	35.1	Very low	81 Å²	81	130.1 Å²	130.1	67%	0.669	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	3.5	-175.9	0	0	0	0	0	115.4
14	V	31.3	Very low	34.6	Very low	119 Å²	119	133.4 Å²	133.4	72%	0.721	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.5	10.1	-175	-170.5	0	0	0	0	114.6	F12 V16	F12-V14 VanDerWaalsContact C-N 3.29Å; F12-V14 PolarHBondContact O-N 2.73Å; V14-V16 PolarHBondContact O-N 2.88Å
15	S	28.6	Very low	33.9	Very low	98 Å²	98	130.6 Å²	130.6	69%	0.685	70%	0.704	S	S	*	*			trans	-82.5	71.3	166.1	65.8	0	0	0	0	110.9	P17	S15-P17 VanDerWaalsContact O-CD 3.24Å; S15-P17 WeakPolarHBondContact O-CD 3.46Å
16	V	29.8	Very low	33.4	Very low	126 Å²	126	131.2 Å²	131.2	76%	0.764	70%	0.704	S	S	*	*			trans	-61.6	113.2	163.7	178.5	0	0	0	0	106.6	V14 R18	V14-V16 PolarHBondContact O-N 2.88Å; V16-R18 PolarHBondContact O-N 2.99Å
17	P	29.7	Very low	33.4	Very low	100 Å²	100	125 Å²	125	65%	0.649	68%	0.683	S	S	*	*			trans	-67.4	129.4	-176.9	26	-30.4	0	0	0	109.2	S15 K19	S15-P17 VanDerWaalsContact O-CD 3.24Å; S15-P17 WeakPolarHBondContact O-CD 3.46Å; P17-K19 PolarHBondContact O-N 3.14Å
18	R	25	Very low	33.4	Very low	232 Å²	232	122.7 Å²	122.7	88%	0.875	68%	0.677	S	S	*	*			trans	-48.1	122.7	174.8	-93	178.8	170.4	163.3	-3.3	109.5	V16 D20	V16-R18 PolarHBondContact O-N 2.99Å; R18-D20 VanDerWaalsContact C-N 3.27Å; R18-D20 PolarHBondContact O-N 3.1Å
19	K	31.9	Very low	33.4	Very low	187 Å²	187	120.5 Å²	120.5	81%	0.813	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-4.1	-168.6	-115.8	178.6	177.8	-179.8	0	115.5	P17	P17-K19 PolarHBondContact O-N 3.14Å
20	D	30.2	Very low	32.9	Very low	148 Å²	148	120 Å²	120	79%	0.791	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	16.9	-158.7	-59.7	-23	0	0	0	116.6	R18	R18-D20 VanDerWaalsContact C-N 3.27Å; R18-D20 PolarHBondContact O-N 3.1Å
21	T	29.8	Very low	32.7	Very low	131 Å²	131	118.2 Å²	118.2	80%	0.804	65%	0.648	S	S	*	*	S	Bend	trans	-129.7	9.4	176	23	0	0	0	0	117.2
22	I	29.1	Very low	32.5	Very low	129 Å²	129	120.3 Å²	120.3	66%	0.662	65%	0.651	S	S	*	*			trans	-110.9	5.8	-173.2	-52.8	176.2	0	0	0	113.5	S24	I22-S24 PolarHBondContact O-N 3.44Å
23	M	29	Very low	32.5	Very low	178 Å²	178	118.6 Å²	118.6	88%	0.877	65%	0.654	S	S	*	*	S	Bend	trans	-89.4	26.2	-168.5	-77.5	-103.1	63.9	0	0	116.8
24	S	31.5	Very low	32.5	Very low	121 Å²	121	117.8 Å²	117.8	85%	0.846	65%	0.648	S	S	*	*	S	Bend	trans	-149.8	2	176.5	63.8	0	0	0	0	120.5	I22	I22-S24 PolarHBondContact O-N 3.44Å
25	S	29.6	Very low	32.8	Very low	95 Å²	95	113.2 Å²	113.2	66%	0.664	63%	0.625	S	S	*	*			trans	-117	121.3	178.8	49.8	0	0	0	0	112.7
26	D	36.7	Very low	32.9	Very low	114 Å²	114	116.3 Å²	116.3	61%	0.61	63%	0.628	S	S	*	*			trans	-66.8	127.4	173.5	-151.2	-19.1	0	0	0	109.3	L28 V29	D26-L28 PolarHBondContact O-N 2.88Å; D26-L28 VanDerWaalsContact O-N 3.09Å; D26-V29 HydrophobicContact CB-CG2 4.17Å; D26-V29 PolarHBondContact O-N 3.1Å; D26-V29 VanDerWaalsContact O-N 3.07Å
27	F	36.3	Very low	33.2	Very low	69 Å²	69	114.6 Å²	114.6	30%	0.303	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.4	-22.7	-169.8	175.5	-99.1	0	0	0	113.2	V29 A34 I291 I293	F27-V29 VanDerWaalsContact C-N 3.31Å; F27-V29 PolarHBondContact O-N 2.03Å; F27-A34 HydrophobicContact CD2-CB 4.18Å; F27-A34 HydrophobicContact CE2-CB 4.26Å; F27-I291 HydrophobicContact CZ-CG2 4.32Å; F27-I293 HydrophobicContact CE1-CG1 4.49Å
28	L	39.4	Very low	33.3	Very low	101 Å²	101	114.3 Å²	114.3	53%	0.529	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.6	-18.8	179.3	-66.2	175.5	0	0	0	113.6	D26 L304	D26-L28 PolarHBondContact O-N 2.88Å; D26-L28 VanDerWaalsContact O-N 3.09Å; L28-L304 HydrophobicContact CD2-CD2 4.45Å
29	V	41.3	Very low	33.7	Very low	45 Å²	45	111 Å²	111	27%	0.273	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.4	-34.9	-172.8	-170.9	0	0	0	0	112	D26 F27 D837 R842	D26-V29 HydrophobicContact CB-CG2 4.17Å; D26-V29 PolarHBondContact O-N 3.1Å; D26-V29 VanDerWaalsContact O-N 3.07Å; F27-V29 VanDerWaalsContact C-N 3.31Å; F27-V29 PolarHBondContact O-N 2.03Å; V29-D837 WeakPolarHBondContact CG2-OD1 3.47Å; V29-R842 HydrophobicContact CG1-CG 4.36Å; V29-R842 WeakPolarHBondContact O-CD 3.21Å
30	D	32.8	Very low	34	Very low	71 Å²	71	106.2 Å²	106.2	38%	0.38	60%	0.599	S	S	.	*			trans	-130.8	73.9	-177.2	-93	-31.2	0	0	0	113.5	F32 V33	D30-F32 PolarHBondContact O-N 3.37Å; D30-V33 HydrophobicContact CB-CG2 4.4Å; D30-V33 PolarHBondContact O-N 3.25Å
31	P	36.9	Very low	34.3	Very low	45 Å²	45	101.7 Å²	101.7	29%	0.292	59%	0.588	S	S	.	*	H	α-helix	trans	-60.1	-15.2	175.8	21.6	-30.7	0	0	0	113.7	G35	P31-G35 PolarHBondContact O-N 2.87Å
32	F	35.3	Very low	34.5	Very low	174 Å²	174	105.3 Å²	105.3	76%	0.763	60%	0.595	S	S	*	*	H	α-helix	trans	-81.9	-20.7	-179.7	-75.4	-75.5	0	0	0	115.1	D30	D30-F32 PolarHBondContact O-N 3.37Å
33	V	34.3	Very low	35.1	Very low	126 Å²	126	102.5 Å²	102.5	76%	0.764	59%	0.587	S	S	*	*	H	α-helix	trans	-95.9	-25.2	-174.9	-175.1	0	0	0	0	112.4	D30	D30-V33 HydrophobicContact CB-CG2 4.4Å; D30-V33 PolarHBondContact O-N 3.25Å
34	A	34.6	Very low	36.1	Very low	65 Å²	65	96.7 Å²	96.7	54%	0.537	57%	0.573	S	S	.	*	H	α-helix	trans	-117.6	-11.4	-178.6	0	0	0	0	0	114.7	F27 Q36	F27-A34 HydrophobicContact CD2-CB 4.18Å; F27-A34 HydrophobicContact CE2-CB 4.26Å; A34-Q36 VanDerWaalsContact C-N 3.31Å; A34-Q36 PolarHBondContact O-N 3.1Å
35	G	36.5	Very low	37	Very low	23 Å²	23	99 Å²	99	24%	0.237	57%	0.57	C	S	.	*			trans	-73.1	87.2	168.4	0	0	0	0	0	109.2	P31 T37	P31-G35 PolarHBondContact O-N 2.87Å; G35-T37 VanDerWaalsContact C-N 3.32Å; G35-T37 PolarHBondContact O-N 2.74Å
36	Q	31.9	Very low	38.1	Very low	162 Å²	162	97 Å²	97	76%	0.757	56%	0.561	S	S	*	*			trans	-65	99.1	168.7	-153	175.4	22.6	0	0	106.6	A34 I38	A34-Q36 VanDerWaalsContact C-N 3.31Å; A34-Q36 PolarHBondContact O-N 3.1Å; Q36-I38 VanDerWaalsContact C-N 3.29Å; Q36-I38 PolarHBondContact O-N 2.84Å
37	T	35.2	Very low	39	Very low	90 Å²	90	93 Å²	93	55%	0.552	54%	0.538	S	S	*	.			trans	-61.4	98.7	164.9	39.8	0	0	0	0	106.3	G35 H39	G35-T37 VanDerWaalsContact C-N 3.32Å; G35-T37 PolarHBondContact O-N 2.74Å; T37-H39 PolarHBondContact O-N 2.98Å
38	I	32.3	Very low	40.1	Very low	95 Å²	95	90 Å²	90	49%	0.487	53%	0.527	S	S	.	.			trans	-71.5	105.6	174.4	-59.2	-180	0	0	0	105.7	Q36 A40 I292	Q36-I38 VanDerWaalsContact C-N 3.29Å; Q36-I38 PolarHBondContact O-N 2.84Å; I38-A40 PolarHBondContact O-N 2.81Å; I38-I292 HydrophobicContact CB-CD1 4.49Å; I38-I292 HydrophobicContact CD1-CD1 3.64Å; I38-I292 HydrophobicContact CG1-CD1 4.02Å
39	H	33.7	Very low	41.2	Very low	163 Å²	163	91.1 Å²	91.1	76%	0.755	53%	0.53	S	S	*	.			trans	-67	87	162.4	-72.5	-61.6	0	0	0	107.8	T37 G41	T37-H39 PolarHBondContact O-N 2.98Å; H39-G41 VanDerWaalsContact C-N 3.3Å; H39-G41 PolarHBondContact O-N 3.08Å
40	A	37.9	Very low	42.3	Very low	85 Å²	85	96.1 Å²	96.1	70%	0.702	54%	0.544	S	S	*	.			trans	-71.9	88.8	170.8	0	0	0	0	0	108.5	I38	I38-A40 PolarHBondContact O-N 2.81Å
41	G	35.7	Very low	43.7	Very low	53 Å²	53	93 Å²	93	55%	0.546	53%	0.527	S	S	.	.	S	Bend	trans	107.7	131.3	172.6	0	0	0	0	0	114.8	H39 S43	H39-G41 VanDerWaalsContact C-N 3.3Å; H39-G41 PolarHBondContact O-N 3.08Å; G41-S43 PolarHBondContact O-N 3.13Å
42	Q	33.8	Very low	45	Very low	207 Å²	207	95.5 Å²	95.5	97%	0.967	53%	0.53	S	S	*	.	S	Bend	trans	-73.9	82.7	170.3	-74.7	179.6	-37.8	0	0	110.2
43	S	43	Very low	46.4	Very low	70 Å²	70	90 Å²	90	49%	0.49	51%	0.513	S	S	.	.			trans	-163.2	22.7	168.3	60	0	0	0	0	115	G41 E45 A46 L47	G41-S43 PolarHBondContact O-N 3.13Å; S43-E45 PolarHBondContact O-N 2.87Å; S43-A46 PolarHBondContact O-N 3.47Å; S43-L47 PolarHBondContact O-N 3.41Å
44	G	49.3	Very low	47.6	Very low	57 Å²	57	85.7 Å²	85.7	59%	0.588	49%	0.486	S	S	*	.	H	α-helix	trans	-57.2	-35.4	-165.1	0	0	0	0	0	116.4	A48	G44-A48 WeakPolarHBondContact O-CB 3.35Å; G44-A48 PolarHBondContact O-N 3.45Å
45	E	49.7	Very low	48.9	Very low	168 Å²	168	83.4 Å²	83.4	79%	0.785	47%	0.465	S	S	*	.	H	α-helix	trans	-73.9	-49.1	-178.8	-72.7	-172	157.4	0	0	112.3	S43 L47 A48 E49	S43-E45 PolarHBondContact O-N 2.87Å; E45-L47 VanDerWaalsContact C-N 3.31Å; E45-L47 PolarHBondContact O-N 3.44Å; E45-A48 PolarHBondContact O-N 3Å; E45-E49 WeakPolarHBondContact O-CB 3.02Å; E45-E49 PolarHBondContact O-N 3.16Å
46	A	53.5	Low	49.9	Very low	55 Å²	55	87.7 Å²	87.7	46%	0.455	48%	0.478	S	S	.	.	H	α-helix	trans	-64.4	-34.4	-177.5	0	0	0	0	0	113.1	S43 R50	S43-A46 PolarHBondContact O-N 3.47Å; A46-R50 WeakPolarHBondContact O-CG 3.32Å; A46-R50 PolarHBondContact O-N 3.5Å
47	L	55.6	Low	50.9	Low	28 Å²	28	84.1 Å²	84.1	15%	0.147	47%	0.471	C	S	.	.	H	α-helix	trans	-73.9	-45.6	177.9	-166.2	153.9	0	0	0	111	S43 E45 E49 R50 I51 Y281	S43-L47 PolarHBondContact O-N 3.41Å; E45-L47 VanDerWaalsContact C-N 3.31Å; E45-L47 PolarHBondContact O-N 3.44Å; L47-E49 PolarHBondContact O-N 3.01Å; L47-R50 PolarHBondContact O-N 3.33Å; L47-I51 HydrophobicContact CD2-CD1 3.64Å; L47-I51 HydrophobicContact CD2-CG1 4.34Å; L47-I51 PolarHBondContact O-N 3.28Å; L47-Y281 HydrophobicContact CD1-CD1 3.68Å; L47-Y281 HydrophobicContact CD1-CE1 4.28Å; L47-Y281 HydrophobicContact CD1-CG 4.45Å; L47-Y281 HydrophobicContact CG-CD1 4.01Å; L47-Y281 HydrophobicContact CG-CG 4.35Å
48	A	59.6	Low	51.3	Low	8 Å²	8	86.6 Å²	86.6	7%	0.066	48%	0.477	C	S	.	.	H	α-helix	trans	-61.5	-36.1	174.4	0	0	0	0	0	111.8	G44 E45 I51 R52 I317	G44-A48 WeakPolarHBondContact O-CB 3.35Å; G44-A48 PolarHBondContact O-N 3.45Å; E45-A48 PolarHBondContact O-N 3Å; A48-I51 PolarHBondContact O-N 2.93Å; A48-R52 WeakPolarHBondContact O-CB 3.48Å; A48-R52 WeakPolarHBondContact O-CG 3.18Å; A48-R52 PolarHBondContact O-N 3.12Å; A48-I317 HydrophobicContact CB-CG2 3.95Å
49	E	62.1	Low	51.7	Low	124 Å²	124	87.5 Å²	87.5	58%	0.579	48%	0.482	S	S	*	.	H	α-helix	trans	-71.2	-36.5	178.2	-158.6	156.7	-128.1	0	0	112.1	E45 L47 R52 S53	E45-E49 WeakPolarHBondContact O-CB 3.02Å; E45-E49 PolarHBondContact O-N 3.16Å; L47-E49 PolarHBondContact O-N 3.01Å; E49-R52 PolarHBondContact O-N 3Å; E49-S53 WeakPolarHBondContact O-CB 3.39Å; E49-S53 PolarHBondContact O-N 2.73Å; E49-S53 PolarHBondContact O-OG 3.22Å
50	R	64.3	Low	51.6	Low	150 Å²	150	87.4 Å²	87.4	57%	0.566	49%	0.485	S	S	*	.	H	α-helix	trans	-63.4	-46.1	169.5	-76.6	179.5	-158.8	-130.1	3.9	112.3	A46 L47 R52 S53 L54	A46-R50 WeakPolarHBondContact O-CG 3.32Å; A46-R50 PolarHBondContact O-N 3.5Å; L47-R50 PolarHBondContact O-N 3.33Å; R50-R52 VanDerWaalsContact C-N 3.29Å; R50-R52 PolarHBondContact O-N 2.74Å; R50-S53 WeakPolarHBondContact CA-OG 3.48Å; R50-S53 PolarHBondContact O-N 3.14Å; R50-S53 PolarHBondContact O-OG 3.21Å; R50-L54 VanDerWaalsContact O-CB 3.28Å; R50-L54 WeakPolarHBondContact O-CB 3.43Å; R50-L54 PolarHBondContact O-N 3.09Å
51	I	62.3	Low	51.5	Low	5 Å²	5	89.3 Å²	89.3	3%	0.026	49%	0.488	C	S	.	.	H	α-helix	trans	-60	-43.4	175.6	-69.9	176.7	0	0	0	109.9	L47 A48 L54 I55 V265 V269 E285	L47-I51 HydrophobicContact CD2-CD1 3.64Å; L47-I51 HydrophobicContact CD2-CG1 4.34Å; L47-I51 PolarHBondContact O-N 3.28Å; A48-I51 PolarHBondContact O-N 2.93Å; I51-L54 PolarHBondContact O-N 2.88Å; I51-I55 HydrophobicContact CG2-CD1 3.9Å; I51-I55 WeakPolarHBondContact O-CD1 3.39Å; I51-I55 VanDerWaalsContact O-CG1 3.22Å; I51-I55 WeakPolarHBondContact O-CG1 3.19Å; I51-I55 PolarHBondContact O-N 3.02Å; I51-V265 HydrophobicContact CG2-CG1 4.34Å; I51-V269 HydrophobicContact CG1-CG2 4.42Å; I51-V269 HydrophobicContact CG2-CG2 3.73Å; I51-E285 HydrophobicContact CD1-CB 3.85Å; I51-E285 HydrophobicContact CD1-CG 4.17Å
52	R	63.8	Low	51.3	Low	98 Å²	98	94.3 Å²	94.3	37%	0.37	50%	0.502	S	S	.	.	H	α-helix	trans	-61.4	-47.7	174.3	-76	170.9	-172.9	161.1	4.5	112.1	A48 E49 R50 L54 I55 E56	A48-R52 WeakPolarHBondContact O-CB 3.48Å; A48-R52 WeakPolarHBondContact O-CG 3.18Å; A48-R52 PolarHBondContact O-N 3.12Å; E49-R52 PolarHBondContact O-N 3Å; R50-R52 VanDerWaalsContact C-N 3.29Å; R50-R52 PolarHBondContact O-N 2.74Å; R52-L54 VanDerWaalsContact C-N 3.27Å; R52-L54 PolarHBondContact O-N 2.72Å; R52-I55 CarbonylContact O-C 3.48Å; R52-I55 WeakPolarHBondContact O-CA 3.3Å; R52-I55 WeakPolarHBondContact O-CB 3.49Å; R52-I55 PolarHBondContact O-N 3.47Å; R52-E56 WeakPolarHBondContact O-CB 3.01Å; R52-E56 VanDerWaalsContact O-CG 3.32Å; R52-E56 WeakPolarHBondContact O-CG 3.45Å; R52-E56 PolarHBondContact O-N 2.97Å
53	S	65	Low	51.1	Low	58 Å²	58	92.6 Å²	92.6	41%	0.406	49%	0.494	S	S	.	.	H	α-helix	trans	-62.4	-37.4	-179.5	67.8	0	0	0	0	112	E49 R50 I55 E56 S57	E49-S53 WeakPolarHBondContact O-CB 3.39Å; E49-S53 PolarHBondContact O-N 2.73Å; E49-S53 PolarHBondContact O-OG 3.22Å; R50-S53 WeakPolarHBondContact CA-OG 3.48Å; R50-S53 PolarHBondContact O-N 3.14Å; R50-S53 PolarHBondContact O-OG 3.21Å; S53-I55 VanDerWaalsContact C-N 3.27Å; S53-I55 PolarHBondContact O-N 3.12Å; S53-E56 PolarHBondContact O-N 2.8Å; S53-E56 VanDerWaalsContact O-N 3.09Å; S53-S57 PolarHBondContact O-N 2.96Å
54	L	60.8	Low	50.6	Low	35 Å²	35	99 Å²	99	18%	0.183	52%	0.516	C	S	.	.	H	α-helix	trans	-69.3	-29.8	177.7	-159.1	135.5	0	0	0	111.2	R50 I51 R52 V269 K272 D278	R50-L54 VanDerWaalsContact O-CB 3.28Å; R50-L54 WeakPolarHBondContact O-CB 3.43Å; R50-L54 PolarHBondContact O-N 3.09Å; I51-L54 PolarHBondContact O-N 2.88Å; R52-L54 VanDerWaalsContact C-N 3.27Å; R52-L54 PolarHBondContact O-N 2.72Å; L54-V269 HydrophobicContact CD2-CG1 4.48Å; L54-K272 HydrophobicContact CD2-CB 3.55Å; L54-K272 WeakPolarHBondContact O-CD 3.36Å; L54-D278 HydrophobicContact CD1-CB 4.2Å; L54-D278 WeakPolarHBondContact CD1-OD1 3.44Å; L54-D278 WeakPolarHBondContact CD1-OD2 3.49Å
55	I	61.5	Low	49.8	Very low	18 Å²	18	99.3 Å²	99.3	9%	0.092	52%	0.52	C	S	.	.	H	α-helix	trans	-74.7	-31.8	169.9	-65.9	165.1	0	0	0	111.5	I51 R52 S53 K272	I51-I55 HydrophobicContact CG2-CD1 3.9Å; I51-I55 WeakPolarHBondContact O-CD1 3.39Å; I51-I55 VanDerWaalsContact O-CG1 3.22Å; I51-I55 WeakPolarHBondContact O-CG1 3.19Å; I51-I55 PolarHBondContact O-N 3.02Å; R52-I55 CarbonylContact O-C 3.48Å; R52-I55 WeakPolarHBondContact O-CA 3.3Å; R52-I55 WeakPolarHBondContact O-CB 3.49Å; R52-I55 PolarHBondContact O-N 3.47Å; S53-I55 VanDerWaalsContact C-N 3.27Å; S53-I55 PolarHBondContact O-N 3.12Å; I55-K272 PolarHBondContact O-NZ 3Å
56	E	57.6	Low	49.3	Very low	112 Å²	112	95.5 Å²	95.5	52%	0.523	52%	0.517	S	S	.	.	H	α-helix	trans	-83.2	-34.7	-174.4	-76.8	174.7	178.7	0	0	115.3	R52 S53 E58 L59	R52-E56 WeakPolarHBondContact O-CB 3.01Å; R52-E56 VanDerWaalsContact O-CG 3.32Å; R52-E56 WeakPolarHBondContact O-CG 3.45Å; R52-E56 PolarHBondContact O-N 2.97Å; S53-E56 PolarHBondContact O-N 2.8Å; S53-E56 VanDerWaalsContact O-N 3.09Å; E56-E58 VanDerWaalsContact C-N 3.25Å; E56-E58 PolarHBondContact O-N 3.38Å; E56-L59 PolarHBondContact O-N 3.15Å
57	S	52.5	Low	48.7	Very low	88 Å²	88	100.7 Å²	100.7	62%	0.615	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-7.4	-160.3	66.1	0	0	0	0	117.6	S53	S53-S57 PolarHBondContact O-N 2.96Å
58	E	44.6	Very low	48.4	Very low	141 Å²	141	105.2 Å²	105.2	66%	0.659	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.2	16.5	-179.8	-73.8	176.6	-162.9	0	0	113.9	E56 I60 K274	E56-E58 VanDerWaalsContact C-N 3.25Å; E56-E58 PolarHBondContact O-N 3.38Å; E58-I60 VanDerWaalsContact C-N 3.33Å; E58-I60 PolarHBondContact O-N 2.85Å; E58-K274 IonicContact OE1-NZ 2.7Å; E58-K274 PolarHBondContact OE1-NZ 3.36Å
59	L	39.6	Very low	48	Very low	114 Å²	114	107.2 Å²	107.2	60%	0.597	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	23.1	-174.6	-138.9	105.8	0	0	0	115.9	E56	E56-L59 PolarHBondContact O-N 3.15Å
60	I	32.4	Very low	47.7	Very low	162 Å²	162	103 Å²	103	83%	0.831	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	2.9	-178.8	-61.7	178.3	0	0	0	113.4	E58	E58-I60 VanDerWaalsContact C-N 3.33Å; E58-I60 PolarHBondContact O-N 2.85Å
61	V	34.7	Very low	47.6	Very low	124 Å²	124	96.6 Å²	96.6	75%	0.752	52%	0.518	S	S	*	.	S	Bend	trans	-100.4	106.2	172.2	-170.2	0	0	0	0	109.9	E63	V61-E63 VanDerWaalsContact C-N 3.27Å; V61-E63 PolarHBondContact O-N 3.03Å
62	D	31.8	Very low	47.8	Very low	158 Å²	158	97.1 Å²	97.1	85%	0.845	52%	0.521	S	S	*	.			trans	-63.3	75.2	174.4	-70.4	-47	0	0	0	111.8
63	E	30.4	Very low	48.3	Very low	171 Å²	171	93.2 Å²	93.2	80%	0.799	51%	0.508	S	S	*	.			trans	-99.4	93.5	156.8	-73.7	-155.6	163.6	0	0	109.6	V61 G65	V61-E63 VanDerWaalsContact C-N 3.27Å; V61-E63 PolarHBondContact O-N 3.03Å; E63-G65 VanDerWaalsContact C-N 3.26Å; E63-G65 PolarHBondContact O-N 2.76Å
64	E	30.9	Very low	48.8	Very low	205 Å²	205	91.5 Å²	91.5	96%	0.958	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	87.6	160.2	-68.4	-176.8	149	0	0	109
65	G	33	Very low	49.8	Very low	64 Å²	64	91.3 Å²	91.3	66%	0.66	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	175.3	-9.7	178.4	0	0	0	0	0	118.9	E63 E67	E63-G65 VanDerWaalsContact C-N 3.26Å; E63-G65 PolarHBondContact O-N 2.76Å; G65-E67 PolarHBondContact O-N 3.35Å
66	A	39.2	Very low	50.7	Low	87 Å²	87	90.5 Å²	90.5	72%	0.719	49%	0.488	S	S	*	.			trans	-76.8	70.7	176.7	0	0	0	0	0	111.6
67	E	41.1	Very low	51.9	Low	164 Å²	164	86.3 Å²	86.3	77%	0.766	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-72	120.3	163.2	-73.5	-170.3	155.8	0	0	108.7	G65 H69	G65-E67 PolarHBondContact O-N 3.35Å; E67-H69 PolarHBondContact O-CE1 3.07Å
68	F	49.5	Very low	53.5	Low	124 Å²	124	83.3 Å²	83.3	54%	0.544	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-66.1	132.1	-179.1	-57.2	-86.3	0	0	0	111.2
69	H	52.2	Low	55.3	Low	50 Å²	50	78.7 Å²	78.7	23%	0.231	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-101.7	152.7	-179.9	-40.3	-74.7	0	0	0	111.8	E67 D229 E231 L258 D260 D261	E67-H69 PolarHBondContact O-CE1 3.07Å; H69-D229 HydrophobicContact CB-CB 3.95Å; H69-D229 WeakPolarHBondContact CB-O 3.3Å; H69-D229 VanDerWaalsContact CE1-CB 3.42Å; H69-D229 WeakPolarHBondContact CE1-CB 3.46Å; H69-D229 IonicContact CE1-OD2 2.86Å; H69-D229 VanDerWaalsContact CG-CB 3.47Å; H69-D229 WeakPolarHBondContact ND1-CB 3.07Å; H69-D229 IonicContact ND1-OD2 3.66Å; H69-E231 HydrophobicContact CB-CG 3.9Å; H69-E231 WeakPolarHBondContact CB-OE1 2.9Å; H69-E231 IonicContact CD2-OE1 3.87Å; H69-E231 PolarHBondContact CD2-OE1 2.91Å; H69-E231 IonicContact CG-OE1 3.22Å; H69-L258 VanDerWaalsContact CD2-CD2 3.46Å; H69-L258 WeakPolarHBondContact CD2-CD2 3.13Å; H69-D260 CarbonylContact O-C 3.55Å; H69-D260 VanDerWaalsContact O-C 3.29Å; H69-D261 VanDerWaalsContact O-CB 3.26Å; H69-D261 WeakPolarHBondContact O-CB 3.23Å
70	P	54.2	Low	57	Low	35 Å²	35	77.8 Å²	77.8	23%	0.227	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-74.8	148.9	-172.9	20.8	-23.8	0	0	0	114.1	P227 T230 E231 D260	P70-P227 HydrophobicContact CB-CG 4.36Å; P70-P227 HydrophobicContact CG-CB 3.5Å; P70-P227 HydrophobicContact CG-CG 3.57Å; P70-T230 HydrophobicContact CG-CG2 4.43Å; P70-T230 CarbonylContact O-C 3.55Å; P70-T230 WeakPolarHBondContact O-CA 3.41Å; P70-T230 WeakPolarHBondContact O-CG2 3.33Å; P70-E231 PolarHBondContact O-N 3.24Å; P70-D260 CarbonylContact C-O 3.59Å
71	L	63.5	Low	58.8	Low	16 Å²	16	72.4 Å²	72.4	8%	0.084	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	138	-179.4	-162.9	68	0	0	0	113	C73 E231 A233 I259 D260 D261 L262	L71-C73 HydrophobicContact CD2-CB 4.33Å; L71-E231 CarbonylContact C-O 3.35Å; L71-E231 HydrophobicContact CD1-CB 4.22Å; L71-A233 HydrophobicContact CD1-CB 3.87Å; L71-A233 HydrophobicContact CD2-CB 3.99Å; L71-A233 HydrophobicContact CG-CB 4.15Å; L71-I259 HydrophobicContact CD1-CG2 3.95Å; L71-D260 WeakPolarHBondContact CA-O 3.45Å; L71-D260 WeakPolarHBondContact CB-O 3.22Å; L71-D260 WeakPolarHBondContact CD1-O 3.23Å; L71-D260 PolarHBondContact N-O 3.13Å; L71-D261 HydrophobicContact CB-CB 4.31Å; L71-D261 WeakPolarHBondContact CB-O 3.46Å; L71-L262 HydrophobicContact CD2-CB 4.06Å
72	F	66.1	Low	60.1	Low	16 Å²	16	72.1 Å²	72.1	7%	0.07	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	113.7	161.6	175	-118.5	0	0	0	109.8	E74 R95 W96 I97 L222 L226 T230 E231 G232 A233	F72-E74 HydrophobicContact CD1-CG 4.35Å; F72-E74 HydrophobicContact CE1-CG 3.47Å; F72-E74 VanDerWaalsContact CE1-CG 3.47Å; F72-E74 WeakPolarHBondContact CE1-OE1 3.25Å; F72-E74 HydrophobicContact CE2-CG 4.29Å; F72-E74 HydrophobicContact CZ-CG 3.43Å; F72-E74 VanDerWaalsContact CZ-CG 3.43Å; F72-E74 VanDerWaalsContact CZ-OE1 3.23Å; F72-E74 WeakPolarHBondContact CZ-OE1 3.22Å; F72-R95 HydrophobicContact CE2-CB 3.99Å; F72-R95 HydrophobicContact CE2-CG 4.29Å; F72-R95 HydrophobicContact CZ-CB 4.41Å; F72-W96 CarbonylContact C-O 3.55Å; F72-W96 WeakPolarHBondContact CA-O 3.45Å; F72-I97 HydrophobicContact CD2-CD1 4.32Å; F72-I97 HydrophobicContact CD2-CG1 3.55Å; F72-I97 HydrophobicContact CE2-CG1 4.12Å; F72-L222 HydrophobicContact CD1-CD2 4.44Å; F72-L222 HydrophobicContact CE1-CD2 3.89Å; F72-L222 HydrophobicContact CE2-CD1 4.5Å; F72-L222 HydrophobicContact CE2-CD2 4.01Å; F72-L222 HydrophobicContact CZ-CD1 4.43Å; F72-L222 HydrophobicContact CZ-CD2 3.65Å; F72-L226 HydrophobicContact CB-CD1 3.98Å; F72-L226 HydrophobicContact CB-CD2 4.05Å; F72-L226 HydrophobicContact CD1-CD1 4.17Å; F72-L226 HydrophobicContact CD2-CD2 4.24Å; F72-L226 HydrophobicContact CG-CD1 4.02Å; F72-L226 HydrophobicContact CG-CD2 4.22Å; F72-T230 HydrophobicContact CB-CG2 3.99Å; F72-E231 PolarHBondContact N-O 3.42Å; F72-G232 CarbonylContact O-C 3.54Å; F72-G232 WeakPolarHBondContact O-CA 3.42Å; F72-A233 PolarHBondContact O-N 2.84Å
73	C	73.7	Confident	61.4	Low	16 Å²	16	73.1 Å²	73.1	11%	0.108	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131.9	179.2	-174.8	0	0	0	0	110.8	L71 R95 W96 A233	L71-C73 HydrophobicContact CD2-CB 4.33Å; C73-R95 CarbonylContact O-C 3.56Å; C73-R95 WeakPolarHBondContact O-CA 3.44Å; C73-R95 WeakPolarHBondContact O-CB 3.42Å; C73-W96 HydrophobicContact CB-CB 4.24Å; C73-W96 HydrophobicContact CB-CE3 4Å; C73-W96 PolarHBondContact N-O 2.81Å; C73-W96 PolarHBondContact O-N 3.42Å; C73-A233 CarbonylContact C-O 3.59Å; C73-A233 VanDerWaalsContact CA-O 3.27Å; C73-A233 WeakPolarHBondContact CA-O 3.47Å; C73-A233 HydrophobicContact CB-CB 4.19Å
74	E	75.2	Confident	62.6	Low	22 Å²	22	71.1 Å²	71.1	10%	0.103	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	134.3	171.9	-65	-176.1	168.9	0	0	110.5	F72 H178 A233 A234 V235	F72-E74 HydrophobicContact CD1-CG 4.35Å; F72-E74 HydrophobicContact CE1-CG 3.47Å; F72-E74 VanDerWaalsContact CE1-CG 3.47Å; F72-E74 WeakPolarHBondContact CE1-OE1 3.25Å; F72-E74 HydrophobicContact CE2-CG 4.29Å; F72-E74 HydrophobicContact CZ-CG 3.43Å; F72-E74 VanDerWaalsContact CZ-CG 3.43Å; F72-E74 VanDerWaalsContact CZ-OE1 3.23Å; F72-E74 WeakPolarHBondContact CZ-OE1 3.22Å; E74-H178 IonicContact OE1-ND1 3.72Å; E74-H178 IonicContact OE2-CE1 2.77Å; E74-H178 PolarHBondContact OE2-CE1 2.98Å; E74-H178 IonicContact OE2-ND1 2.71Å; E74-H178 PolarHBondContact OE2-ND1 3.44Å; E74-A233 PolarHBondContact N-O 3.23Å; E74-A234 CarbonylContact O-C 3.56Å; E74-A234 WeakPolarHBondContact O-CA 3.43Å; E74-V235 PolarHBondContact O-N 2.68Å
75	L	82.3	Confident	63.9	Low	30 Å²	30	65 Å²	65	16%	0.157	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	121.7	169.2	168.8	66.7	0	0	0	109.5	K93 S94 W96 V235 I237	L75-K93 PolarHBondContact O-N 2.85Å; L75-S94 PolarHBondContact N-O 3.17Å; L75-S94 PolarHBondContact O-N 3Å; L75-W96 HydrophobicContact CB-CH2 3.39Å; L75-W96 HydrophobicContact CB-CZ3 3.35Å; L75-W96 HydrophobicContact CD2-CH2 3.86Å; L75-W96 HydrophobicContact CG-CH2 4.23Å; L75-V235 WeakPolarHBondContact CA-O 2.91Å; L75-V235 HydrophobicContact CD1-CB 4.18Å; L75-V235 HydrophobicContact CD1-CG1 3.98Å; L75-I237 HydrophobicContact CD1-CB 4.04Å; L75-I237 HydrophobicContact CD1-CD1 3.41Å; L75-I237 VanDerWaalsContact CD1-CD1 3.41Å; L75-I237 HydrophobicContact CD1-CG1 3.5Å
76	L	80.1	Confident	65.3	Low	1 Å²	1	65.9 Å²	65.9	1%	0.005	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	120.9	178.3	-72.3	148.3	0	0	0	108.2	W90 A91 E92 A234 V235 L236 I237	L76-W90 HydrophobicContact CB-CB 4.23Å; L76-W90 HydrophobicContact CB-CE3 4.12Å; L76-W90 HydrophobicContact CD2-CB 4.18Å; L76-W90 WeakPolarHBondContact O-CZ3 3.09Å; L76-A91 CarbonylContact C-O 3.54Å; L76-A91 WeakPolarHBondContact CA-O 3.26Å; L76-E92 HydrophobicContact CD2-CB 4.15Å; L76-A234 HydrophobicContact CD1-CB 4.38Å; L76-V235 PolarHBondContact N-O 3.15Å; L76-L236 HydrophobicContact CB-CD2 3.72Å; L76-L236 HydrophobicContact CD1-CD2 3.8Å; L76-L236 HydrophobicContact CG-CD2 4.4Å; L76-I237 PolarHBondContact O-N 2.91Å
77	S	84.2	Confident	66.7	Low	25 Å²	25	70.1 Å²	70.1	18%	0.175	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	135.1	173.1	70	0	0	0	0	111.1	T79 A91 K93 I237	S77-T79 PolarHBondContact O-N 3.15Å; S77-A91 PolarHBondContact N-O 3.45Å; S77-A91 PolarHBondContact O-N 2.82Å; S77-A91 PolarHBondContact OG-O 3.42Å; S77-K93 WeakPolarHBondContact OG-CE 3.33Å; S77-K93 WeakPolarHBondContact OG-CG 3.43Å; S77-I237 CarbonylContact C-O 3.57Å; S77-I237 VanDerWaalsContact CA-O 3.23Å; S77-I237 WeakPolarHBondContact CA-O 3.41Å
78	L	85.9	Confident	68.7	Low	24 Å²	24	63 Å²	63	13%	0.126	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	128.1	171.3	-166.3	66	0	0	0	109.5	Y88 W90 A171 I237 G238 I240	L78-Y88 HydrophobicContact CD1-CD1 4.29Å; L78-Y88 HydrophobicContact CD1-CG 4.33Å; L78-Y88 HydrophobicContact CD2-CD1 3.9Å; L78-Y88 HydrophobicContact CD2-CE1 4.32Å; L78-Y88 HydrophobicContact CG-CD1 4.16Å; L78-W90 HydrophobicContact CB-CD2 4.49Å; L78-W90 HydrophobicContact CB-CE3 4.04Å; L78-W90 HydrophobicContact CB-CH2 3.91Å; L78-W90 HydrophobicContact CB-CZ2 4.38Å; L78-W90 HydrophobicContact CB-CZ3 3.74Å; L78-W90 HydrophobicContact CD1-CD2 3.92Å; L78-W90 HydrophobicContact CD1-CE3 4.31Å; L78-W90 HydrophobicContact CD1-CG 4.39Å; L78-W90 HydrophobicContact CD1-CH2 4.22Å; L78-W90 HydrophobicContact CD1-CZ2 3.82Å; L78-W90 HydrophobicContact CD1-CZ3 4.45Å; L78-W90 VanDerWaalsContact N-CE3 3.33Å; L78-A171 HydrophobicContact CD1-CB 4.44Å; L78-A171 HydrophobicContact CD2-CB 3.97Å; L78-I237 PolarHBondContact N-O 3.49Å; L78-G238 VanDerWaalsContact CB-CA 3.47Å; L78-I240 HydrophobicContact CD2-CD1 4.29Å; L78-I240 HydrophobicContact CD2-CG1 3.66Å
79	T	80.6	Confident	70.2	Confident	45 Å²	45	58.5 Å²	58.5	28%	0.276	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	140.5	175.2	-52.6	0	0	0	0	108.7	S77 F89	S77-T79 PolarHBondContact O-N 3.15Å; T79-F89 HydrophobicContact CG2-CE1 3.85Å; T79-F89 HydrophobicContact CG2-CE2 4.47Å; T79-F89 HydrophobicContact CG2-CZ 3.61Å; T79-F89 PolarHBondContact N-O 2.77Å; T79-F89 VanDerWaalsContact O-CD1 3.31Å; T79-F89 WeakPolarHBondContact O-CD1 3.42Å; T79-F89 PolarHBondContact O-N 3.03Å
80	E	76.7	Confident	71.6	Confident	95 Å²	95	56.5 Å²	56.5	44%	0.444	30%	0.303	S	S	.	.			trans	-101.8	128.6	174.3	-64.7	-176.6	-167.2	0	0	108.2	Y88	E80-Y88 HydrophobicContact CG-CD1 3.79Å; E80-Y88 HydrophobicContact CG-CE1 3.89Å; E80-Y88 WeakPolarHBondContact OE1-CE1 3.32Å
81	N	69.3	Low	72.8	Confident	49 Å²	49	55.7 Å²	55.7	26%	0.262	30%	0.299	S	S	.	.			trans	-130.7	92.3	170.3	-167.1	-3.5	0	0	0	109.4	E83 L84 F89	N81-E83 PolarHBondContact O-N 3.4Å; N81-E83 VanDerWaalsContact O-N 3.1Å; N81-E83 PolarHBondContact OD1-N 3.05Å; N81-L84 PolarHBondContact O-N 2.92Å; N81-F89 HydrophobicContact CB-CD1 4.4Å; N81-F89 HydrophobicContact CB-CE1 3.62Å; N81-F89 HydrophobicContact CB-CZ 4.44Å
82	P	62.9	Low	73.6	Confident	118 Å²	118	55.7 Å²	55.7	77%	0.766	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-62.1	-20	-175.1	23.5	-32.2	0	0	0	113.3
83	E	57.6	Low	74.3	Confident	178 Å²	178	59.7 Å²	59.7	83%	0.832	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-73.6	-25.6	-176.2	-60.1	-173	165.7	0	0	114.1	N81	N81-E83 PolarHBondContact O-N 3.4Å; N81-E83 VanDerWaalsContact O-N 3.1Å; N81-E83 PolarHBondContact OD1-N 3.05Å
84	L	56	Low	74.8	Confident	130 Å²	130	59.5 Å²	59.5	68%	0.681	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-92.7	2.5	-172.8	-107.3	150.5	0	0	0	114	N81 E86	N81-L84 PolarHBondContact O-N 2.92Å; L84-E86 PolarHBondContact O-N 2.96Å; L84-E86 VanDerWaalsContact O-N 3.09Å
85	G	58.2	Low	75	Confident	76 Å²	76	60 Å²	60	78%	0.784	32%	0.316	S	S	*	.	S	Bend	trans	70.1	-5.8	-176.6	0	0	0	0	0	115
86	E	62.2	Low	74.8	Confident	82 Å²	82	60.7 Å²	60.7	38%	0.383	32%	0.316	S	S	.	.			trans	-93.1	116.6	170.2	-70	-174.1	172.3	0	0	109.2	L84 Y88	L84-E86 PolarHBondContact O-N 2.96Å; L84-E86 VanDerWaalsContact O-N 3.09Å; E86-Y88 VanDerWaalsContact C-N 3.31Å; E86-Y88 PolarHBondContact O-N 3.45Å
87	R	69.8	Low	74	Confident	176 Å²	176	62.1 Å²	62.1	66%	0.664	32%	0.324	S	S	*	.	S	Bend	trans	-63.1	-34.9	-176.6	-172.5	176.1	175.2	168.4	0.3	113.2
88	Y	81.5	Confident	73	Confident	14 Å²	14	65.7 Å²	65.7	6%	0.055	34%	0.336	C	S	.	.			trans	-142.3	142.8	-177.7	-60.7	-63.7	0	0	0	110.2	L78 E80 E86 S167 A171 A174	L78-Y88 HydrophobicContact CD1-CD1 4.29Å; L78-Y88 HydrophobicContact CD1-CG 4.33Å; L78-Y88 HydrophobicContact CD2-CD1 3.9Å; L78-Y88 HydrophobicContact CD2-CE1 4.32Å; L78-Y88 HydrophobicContact CG-CD1 4.16Å; E80-Y88 HydrophobicContact CG-CD1 3.79Å; E80-Y88 HydrophobicContact CG-CE1 3.89Å; E80-Y88 WeakPolarHBondContact OE1-CE1 3.32Å; E86-Y88 VanDerWaalsContact C-N 3.31Å; E86-Y88 PolarHBondContact O-N 3.45Å; Y88-S167 PolarHBondContact OH-OG 2.94Å; Y88-A171 HydrophobicContact CD2-CB 3.98Å; Y88-A171 HydrophobicContact CE2-CB 4.22Å; Y88-A171 HydrophobicContact CG-CB 4.22Å; Y88-A174 WeakPolarHBondContact O-CB 3.4Å
89	F	82.3	Confident	72.3	Confident	31 Å²	31	66.6 Å²	66.6	14%	0.136	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	152.1	163.6	69.8	-77.1	0	0	0	110.4	T79 N81 A91 R175 Q177	T79-F89 HydrophobicContact CG2-CE1 3.85Å; T79-F89 HydrophobicContact CG2-CE2 4.47Å; T79-F89 HydrophobicContact CG2-CZ 3.61Å; T79-F89 PolarHBondContact N-O 2.77Å; T79-F89 VanDerWaalsContact O-CD1 3.31Å; T79-F89 WeakPolarHBondContact O-CD1 3.42Å; T79-F89 PolarHBondContact O-N 3.03Å; N81-F89 HydrophobicContact CB-CD1 4.4Å; N81-F89 HydrophobicContact CB-CE1 3.62Å; N81-F89 HydrophobicContact CB-CZ 4.44Å; F89-A91 HydrophobicContact CD2-CB 4.45Å; F89-A91 HydrophobicContact CE2-CB 4.01Å; F89-R175 WeakPolarHBondContact CA-O 3.19Å; F89-Q177 HydrophobicContact CD2-CB 4.28Å
90	W	81.1	Confident	72.1	Confident	8 Å²	8	66 Å²	66	3%	0.03	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	115.4	179.1	-68.8	96.6	0	0	0	109.8	L76 L78 A171 L172 R175 K176 Q177 L236 I237	L76-W90 HydrophobicContact CB-CB 4.23Å; L76-W90 HydrophobicContact CB-CE3 4.12Å; L76-W90 HydrophobicContact CD2-CB 4.18Å; L76-W90 WeakPolarHBondContact O-CZ3 3.09Å; L78-W90 HydrophobicContact CB-CD2 4.49Å; L78-W90 HydrophobicContact CB-CE3 4.04Å; L78-W90 HydrophobicContact CB-CH2 3.91Å; L78-W90 HydrophobicContact CB-CZ2 4.38Å; L78-W90 HydrophobicContact CB-CZ3 3.74Å; L78-W90 HydrophobicContact CD1-CD2 3.92Å; L78-W90 HydrophobicContact CD1-CE3 4.31Å; L78-W90 HydrophobicContact CD1-CG 4.39Å; L78-W90 HydrophobicContact CD1-CH2 4.22Å; L78-W90 HydrophobicContact CD1-CZ2 3.82Å; L78-W90 HydrophobicContact CD1-CZ3 4.45Å; L78-W90 VanDerWaalsContact N-CE3 3.33Å; W90-A171 PolarHBondContact NE1-O 2.95Å; W90-L172 HydrophobicContact CZ2-CD2 4.5Å; W90-R175 PolarHBondContact N-O 3.34Å; W90-K176 HydrophobicContact CB-CB 4.37Å; W90-K176 HydrophobicContact CB-CG 3.94Å; W90-K176 HydrophobicContact CG-CG 4.18Å; W90-Q177 WeakPolarHBondContact O-CA 3.16Å; W90-Q177 PolarHBondContact O-N 3.35Å; W90-L236 HydrophobicContact CD2-CD2 3.54Å; W90-L236 HydrophobicContact CE3-CB 4.26Å; W90-L236 HydrophobicContact CE3-CD2 3.61Å; W90-L236 HydrophobicContact CG-CD2 3.97Å; W90-L236 HydrophobicContact CH2-CB 3.8Å; W90-L236 HydrophobicContact CH2-CD2 4.4Å; W90-L236 HydrophobicContact CZ2-CB 4.25Å; W90-L236 HydrophobicContact CZ2-CD2 4.34Å; W90-L236 HydrophobicContact CZ3-CB 3.79Å; W90-L236 HydrophobicContact CZ3-CD2 4.04Å; W90-I237 WeakPolarHBondContact CZ3-O 3.24Å
91	A	80.7	Confident	72.2	Confident	17 Å²	17	62.4 Å²	62.4	14%	0.14	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	130.5	177.3	0	0	0	0	0	110.7	L76 S77 F89 K93	L76-A91 CarbonylContact C-O 3.54Å; L76-A91 WeakPolarHBondContact CA-O 3.26Å; S77-A91 PolarHBondContact N-O 3.45Å; S77-A91 PolarHBondContact O-N 2.82Å; S77-A91 PolarHBondContact OG-O 3.42Å; F89-A91 HydrophobicContact CD2-CB 4.45Å; F89-A91 HydrophobicContact CE2-CB 4.01Å; A91-K93 PolarHBondContact O-N 2.73Å
92	E	78.9	Confident	72.8	Confident	16 Å²	16	61.3 Å²	61.3	8%	0.075	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	125	173.7	-166.5	-171.9	168.2	0	0	110.2	L76 W109 Q177 F179	L76-E92 HydrophobicContact CD2-CB 4.15Å; E92-W109 HydrophobicContact CG-CH2 3.95Å; E92-W109 HydrophobicContact CG-CZ2 4.32Å; E92-W109 WeakPolarHBondContact OE1-CH2 3.41Å; E92-W109 WeakPolarHBondContact OE1-CZ2 3.47Å; E92-Q177 PolarHBondContact N-O 2.84Å; E92-F179 PolarHBondContact OE2-N 3.3Å
93	K	81.8	Confident	73.5	Confident	101 Å²	101	57.6 Å²	57.6	44%	0.439	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	-41	-177.9	-74.1	-66.7	-174.7	177.8	0	113.4	L75 S77 A91 T102 V103	L75-K93 PolarHBondContact O-N 2.85Å; S77-K93 WeakPolarHBondContact OG-CE 3.33Å; S77-K93 WeakPolarHBondContact OG-CG 3.43Å; A91-K93 PolarHBondContact O-N 2.73Å; K93-T102 CarbonylContact O-C 3.57Å; K93-T102 WeakPolarHBondContact O-CA 3.4Å; K93-V103 PolarHBondContact O-N 3.41Å
94	S	83.5	Confident	74.3	Confident	11 Å²	11	52.4 Å²	52.4	8%	0.077	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	159.2	-177.9	-54.4	0	0	0	0	110.2	L75 W96 E100 E101 T102	L75-S94 PolarHBondContact N-O 3.17Å; L75-S94 PolarHBondContact O-N 3Å; S94-W96 VanDerWaalsContact CB-CH2 3.48Å; S94-E100 PolarHBondContact OG-OE1 3.4Å; S94-E101 CarbonylContact C-O 3.51Å; S94-E101 VanDerWaalsContact CA-O 3.26Å; S94-E101 WeakPolarHBondContact CA-O 3.37Å; S94-T102 VanDerWaalsContact OG-CG2 3.29Å; S94-T102 WeakPolarHBondContact OG-CG2 3.3Å
95	R	80.3	Confident	74.8	Confident	33 Å²	33	55.8 Å²	55.8	13%	0.125	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	156.3	172.2	69.6	-171.9	-171.3	-156.8	-8.8	111.8	F72 C73 E100 E101 W109	F72-R95 HydrophobicContact CE2-CB 3.99Å; F72-R95 HydrophobicContact CE2-CG 4.29Å; F72-R95 HydrophobicContact CZ-CB 4.41Å; C73-R95 CarbonylContact O-C 3.56Å; C73-R95 WeakPolarHBondContact O-CA 3.44Å; C73-R95 WeakPolarHBondContact O-CB 3.42Å; R95-E100 WeakPolarHBondContact O-CA 3.46Å; R95-E101 HydrophobicContact CG-CB 4.19Å; R95-E101 IonicContact CZ-OE2 3.7Å; R95-E101 PolarHBondContact N-O 2.85Å; R95-E101 IonicContact NE-OE2 2.93Å; R95-E101 PolarHBondContact NE-OE2 3.44Å; R95-E101 IonicContact NH2-OE1 2.81Å; R95-E101 IonicContact NH2-OE2 3.23Å; R95-E101 PolarHBondContact NH2-OE2 3.45Å; R95-E101 PolarHBondContact O-N 3.21Å; R95-W109 HydrophobicContact CB-CH2 4.44Å; R95-W109 HydrophobicContact CG-CH2 4.09Å; R95-W109 HydrophobicContact CG-CZ3 3.99Å; R95-W109 VanDerWaalsContact NH1-CE2 3.3Å
96	W	77.6	Confident	74.9	Confident	44 Å²	44	55.7 Å²	55.7	17%	0.167	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	125	179.7	-56.7	-97.9	0	0	0	110.5	F72 C73 L75 S94 E100	F72-W96 CarbonylContact C-O 3.55Å; F72-W96 WeakPolarHBondContact CA-O 3.45Å; C73-W96 HydrophobicContact CB-CB 4.24Å; C73-W96 HydrophobicContact CB-CE3 4Å; C73-W96 PolarHBondContact N-O 2.81Å; C73-W96 PolarHBondContact O-N 3.42Å; L75-W96 HydrophobicContact CB-CH2 3.39Å; L75-W96 HydrophobicContact CB-CZ3 3.35Å; L75-W96 HydrophobicContact CD2-CH2 3.86Å; L75-W96 HydrophobicContact CG-CH2 4.23Å; S94-W96 VanDerWaalsContact CB-CH2 3.48Å; W96-E100 HydrophobicContact CZ2-CG 4.01Å; W96-E100 PolarHBondContact NE1-OE2 3.03Å
97	I	63.4	Low	75.3	Confident	31 Å²	31	57.2 Å²	57.2	16%	0.159	28%	0.28	C	S	.	.	S	Bend	trans	-107.7	-32.6	162.6	-59.3	164.4	0	0	0	109.3	F72 L226 A762 P763	F72-I97 HydrophobicContact CD2-CD1 4.32Å; F72-I97 HydrophobicContact CD2-CG1 3.55Å; F72-I97 HydrophobicContact CE2-CG1 4.12Å; I97-L226 HydrophobicContact CD1-CD2 3.73Å; I97-L226 HydrophobicContact CG1-CD2 3.79Å; I97-L226 HydrophobicContact CG2-CD2 4.11Å; I97-A762 HydrophobicContact CG2-CB 4.38Å; I97-P763 HydrophobicContact CD1-CG 4.5Å
98	K	62.2	Low	75.3	Confident	100 Å²	100	57.5 Å²	57.5	44%	0.435	28%	0.281	S	S	.	.	S	Bend	trans	-163.4	-40.3	176.9	-177.6	172.3	173.8	179.3	0	109.9	A762 E765	K98-A762 HydrophobicContact CB-CB 4.02Å; K98-A762 HydrophobicContact CD-CB 4.37Å; K98-E765 IonicContact NZ-OE1 3.36Å; K98-E765 PolarHBondContact NZ-OE1 2.96Å; K98-E765 IonicContact NZ-OE2 2.79Å; K98-E765 PolarHBondContact NZ-OE2 3.12Å
99	Y	71.3	Confident	74.9	Confident	44 Å²	44	58.6 Å²	58.6	17%	0.173	29%	0.285	C	S	.	.	S	Bend	trans	-114.4	158.3	172.4	-58	-63.8	0	0	0	109.9	H113 I114 P306 P763 E765	Y99-H113 WeakPolarHBondContact CB-O 3.29Å; Y99-I114 HydrophobicContact CD1-CG1 4.38Å; Y99-I114 HydrophobicContact CE1-CG1 4.41Å; Y99-P306 HydrophobicContact CD1-CB 4.1Å; Y99-P306 HydrophobicContact CD2-CB 4.49Å; Y99-P306 HydrophobicContact CD2-CG 4.49Å; Y99-P306 HydrophobicContact CE1-CB 3.45Å; Y99-P306 VanDerWaalsContact CE1-CB 3.45Å; Y99-P306 HydrophobicContact CE1-CG 4.34Å; Y99-P306 HydrophobicContact CE2-CB 3.88Å; Y99-P306 HydrophobicContact CE2-CG 4.18Å; Y99-P306 WeakPolarHBondContact OH-CB 3.32Å; Y99-P763 WeakPolarHBondContact CD2-O 3.4Å; Y99-E765 HydrophobicContact CE2-CB 4.5Å
100	E	76.9	Confident	74.5	Confident	32 Å²	32	57.4 Å²	57.4	15%	0.15	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	133.1	178.2	-172.6	167.7	177.9	0	0	110.6	S94 R95 W96 T102 P112 H113 S115	S94-E100 PolarHBondContact OG-OE1 3.4Å; R95-E100 WeakPolarHBondContact O-CA 3.46Å; W96-E100 HydrophobicContact CZ2-CG 4.01Å; W96-E100 PolarHBondContact NE1-OE2 3.03Å; E100-T102 HydrophobicContact CG-CG2 3.85Å; E100-T102 WeakPolarHBondContact OE1-CG2 3.27Å; E100-P112 WeakPolarHBondContact O-CA 3.46Å; E100-H113 PolarHBondContact N-O 3.35Å; E100-H113 PolarHBondContact O-CE1 3.38Å; E100-H113 PolarHBondContact O-N 2.63Å; E100-H113 PolarHBondContact O-ND1 3.32Å; E100-S115 WeakPolarHBondContact OE2-CA 3.34Å; E100-S115 VanDerWaalsContact OE2-CB 3.23Å; E100-S115 WeakPolarHBondContact OE2-CB 3.31Å
101	E	78.9	Confident	74	Confident	20 Å²	20	64.7 Å²	64.7	9%	0.093	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	130.4	163.7	-66.8	179.1	132.9	0	0	107.9	S94 R95 W109 P112 P763	S94-E101 CarbonylContact C-O 3.51Å; S94-E101 VanDerWaalsContact CA-O 3.26Å; S94-E101 WeakPolarHBondContact CA-O 3.37Å; R95-E101 HydrophobicContact CG-CB 4.19Å; R95-E101 IonicContact CZ-OE2 3.7Å; R95-E101 PolarHBondContact N-O 2.85Å; R95-E101 IonicContact NE-OE2 2.93Å; R95-E101 PolarHBondContact NE-OE2 3.44Å; R95-E101 IonicContact NH2-OE1 2.81Å; R95-E101 IonicContact NH2-OE2 3.23Å; R95-E101 PolarHBondContact NH2-OE2 3.45Å; R95-E101 PolarHBondContact O-N 3.21Å; E101-W109 HydrophobicContact CB-CE3 3.97Å; E101-W109 WeakPolarHBondContact O-CZ3 3.39Å; E101-P112 HydrophobicContact CG-CB 4.11Å; E101-P112 HydrophobicContact CG-CG 4.05Å; E101-P763 VanDerWaalsContact OE1-CB 3.24Å; E101-P763 WeakPolarHBondContact OE1-CB 3.47Å
102	T	81.8	Confident	73.5	Confident	26 Å²	26	65.1 Å²	65.1	16%	0.16	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	150.6	-179.9	59	0	0	0	0	111	K93 S94 E100 E104 S110	K93-T102 CarbonylContact O-C 3.57Å; K93-T102 WeakPolarHBondContact O-CA 3.4Å; S94-T102 VanDerWaalsContact OG-CG2 3.29Å; S94-T102 WeakPolarHBondContact OG-CG2 3.3Å; E100-T102 HydrophobicContact CG-CG2 3.85Å; E100-T102 WeakPolarHBondContact OE1-CG2 3.27Å; T102-E104 PolarHBondContact O-N 3.25Å; T102-S110 PolarHBondContact N-OG 3.19Å; T102-S110 WeakPolarHBondContact O-CB 3.49Å; T102-S110 PolarHBondContact O-N 2.9Å; T102-S110 PolarHBondContact OG1-OG 3.49Å
103	V	77.8	Confident	73.1	Confident	40 Å²	40	65.3 Å²	65.3	24%	0.242	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	116.3	174.2	-177.6	0	0	0	0	108.8	K93 W109 F179	K93-V103 PolarHBondContact O-N 3.41Å; V103-W109 HydrophobicContact CG2-CD2 4.23Å; V103-W109 HydrophobicContact CG2-CE3 3.86Å; V103-W109 HydrophobicContact CG2-CH2 3.54Å; V103-W109 HydrophobicContact CG2-CZ2 3.91Å; V103-W109 HydrophobicContact CG2-CZ3 3.5Å; V103-F179 HydrophobicContact CG1-CD2 4.08Å; V103-F179 HydrophobicContact CG1-CE2 4.14Å; V103-F179 HydrophobicContact CG2-CD2 4.28Å
104	E	73.8	Confident	72.5	Confident	68 Å²	68	63.4 Å²	63.4	32%	0.318	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	168.3	179	-61.8	-176.1	156.8	0	0	112.7	T102 G106 E107 R108 S110 R303	T102-E104 PolarHBondContact O-N 3.25Å; E104-G106 PolarHBondContact O-N 2.87Å; E104-E107 PolarHBondContact O-N 3.41Å; E104-R108 PolarHBondContact N-O 3.33Å; E104-S110 VanDerWaalsContact OE1-CB 3.26Å; E104-S110 WeakPolarHBondContact OE1-CB 3.42Å; E104-R303 IonicContact OE1-CZ 3.86Å; E104-R303 IonicContact OE1-NH1 3.25Å; E104-R303 PolarHBondContact OE1-NH1 3.03Å; E104-R303 IonicContact OE1-NH2 3.59Å; E104-R303 PolarHBondContact OE1-NH2 3Å
105	E	66.1	Low	72.1	Confident	202 Å²	202	65.2 Å²	65.2	94%	0.944	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	126.8	168.1	-65.8	-178.2	175.8	0	0	110
106	G	62.2	Low	71.7	Confident	74 Å²	74	67.4 Å²	67.4	76%	0.763	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.5	16.3	-172.9	0	0	0	0	0	115.1	E104 R108	E104-G106 PolarHBondContact O-N 2.87Å; G106-R108 PolarHBondContact O-N 3.22Å
107	E	69.1	Low	71.5	Confident	114 Å²	114	70.1 Å²	70.1	53%	0.533	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	50.5	174.1	-70.8	-165.9	169.6	0	0	111.5	E104 F179 P182	E104-E107 PolarHBondContact O-N 3.41Å; E107-F179 VanDerWaalsContact C-CZ 3.42Å; E107-F179 HydrophobicContact CB-CE2 3.58Å; E107-F179 HydrophobicContact CB-CZ 3.68Å; E107-F179 HydrophobicContact CG-CE2 4Å; E107-F179 WeakPolarHBondContact O-CZ 3.47Å; E107-P182 WeakPolarHBondContact OE2-CD 3.18Å; E107-P182 VanDerWaalsContact OE2-CG 3.3Å; E107-P182 WeakPolarHBondContact OE2-CG 3.47Å
108	R	71.1	Confident	72.1	Confident	182 Å²	182	72 Å²	72	69%	0.687	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.6	141.1	179	-173.2	-179.7	173.5	173.8	0.3	110.3	E104 G106	E104-R108 PolarHBondContact N-O 3.33Å; G106-R108 PolarHBondContact O-N 3.22Å
109	W	72.8	Confident	72.6	Confident	37 Å²	37	70.4 Å²	70.4	14%	0.14	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	131.7	169.3	-70.9	105.3	0	0	0	110.7	E92 R95 E101 V103 F179	E92-W109 HydrophobicContact CG-CH2 3.95Å; E92-W109 HydrophobicContact CG-CZ2 4.32Å; E92-W109 WeakPolarHBondContact OE1-CH2 3.41Å; E92-W109 WeakPolarHBondContact OE1-CZ2 3.47Å; R95-W109 HydrophobicContact CB-CH2 4.44Å; R95-W109 HydrophobicContact CG-CH2 4.09Å; R95-W109 HydrophobicContact CG-CZ3 3.99Å; R95-W109 VanDerWaalsContact NH1-CE2 3.3Å; E101-W109 HydrophobicContact CB-CE3 3.97Å; E101-W109 WeakPolarHBondContact O-CZ3 3.39Å; V103-W109 HydrophobicContact CG2-CD2 4.23Å; V103-W109 HydrophobicContact CG2-CE3 3.86Å; V103-W109 HydrophobicContact CG2-CH2 3.54Å; V103-W109 HydrophobicContact CG2-CZ2 3.91Å; V103-W109 HydrophobicContact CG2-CZ3 3.5Å; W109-F179 HydrophobicContact CZ2-CB 3.88Å; W109-F179 HydrophobicContact CZ2-CG 4.3Å; W109-F179 AromaticContact NE1-CD1 3.42Å
110	S	72.5	Confident	72.7	Confident	5 Å²	5	74.1 Å²	74.1	4%	0.035	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-60.1	166.5	173.1	77.8	0	0	0	0	111.3	T102 E104	T102-S110 PolarHBondContact N-OG 3.19Å; T102-S110 WeakPolarHBondContact O-CB 3.49Å; T102-S110 PolarHBondContact O-N 2.9Å; T102-S110 PolarHBondContact OG1-OG 3.49Å; E104-S110 VanDerWaalsContact OE1-CB 3.26Å; E104-S110 WeakPolarHBondContact OE1-CB 3.42Å
111	K	70.5	Confident	72.8	Confident	162 Å²	162	77.2 Å²	77.2	70%	0.704	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-64.3	149.3	162.5	-70	-176.4	-177.3	177.7	0	110	H113	K111-H113 PolarHBondContact O-ND1 3.37Å
112	P	71.9	Confident	72.7	Confident	26 Å²	26	76.8 Å²	76.8	17%	0.169	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-68.7	134.6	179.4	-16.7	33.9	0	0	0	110.3	E100 E101 P763	E100-P112 WeakPolarHBondContact O-CA 3.46Å; E101-P112 HydrophobicContact CG-CB 4.11Å; E101-P112 HydrophobicContact CG-CG 4.05Å; P112-P763 VanDerWaalsContact CB-C 3.42Å; P112-P763 HydrophobicContact CB-CB 3.8Å; P112-P763 WeakPolarHBondContact CB-O 3.42Å; P112-P763 HydrophobicContact CG-CB 3.09Å; P112-P763 WeakPolarHBondContact CG-O 3.39Å
113	H	69	Low	72.6	Confident	20 Å²	20	80 Å²	80	9%	0.093	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-144.3	163.3	-176.8	56.1	-75.3	0	0	0	112	Y99 E100 K111 S115 R303	Y99-H113 WeakPolarHBondContact CB-O 3.29Å; E100-H113 PolarHBondContact N-O 3.35Å; E100-H113 PolarHBondContact O-CE1 3.38Å; E100-H113 PolarHBondContact O-N 2.63Å; E100-H113 PolarHBondContact O-ND1 3.32Å; K111-H113 PolarHBondContact O-ND1 3.37Å; H113-S115 PolarHBondContact O-N 3.32Å; H113-R303 HydrophobicContact CB-CB 3.88Å; H113-R303 HydrophobicContact CB-CG 4.31Å
114	I	70.9	Confident	72.7	Confident	61 Å²	61	83.6 Å²	83.6	31%	0.313	43%	0.431	S	S	.	.			trans	-67.6	130.5	174.7	-60.4	176.4	0	0	0	108.8	Y99 L116 L304	Y99-I114 HydrophobicContact CD1-CG1 4.38Å; Y99-I114 HydrophobicContact CE1-CG1 4.41Å; I114-L116 PolarHBondContact O-N 3.01Å; I114-L304 HydrophobicContact CB-CB 4.05Å; I114-L304 HydrophobicContact CD1-CB 4.15Å; I114-L304 HydrophobicContact CG1-CB 4.35Å; I114-L304 PolarHBondContact N-O 3.42Å
115	S	74.1	Confident	73	Confident	48 Å²	48	84.4 Å²	84.4	34%	0.336	44%	0.438	S	S	.	.			trans	-69.2	128.3	175.7	48.5	0	0	0	0	110.6	E100 H113	E100-S115 WeakPolarHBondContact OE2-CA 3.34Å; E100-S115 VanDerWaalsContact OE2-CB 3.23Å; E100-S115 WeakPolarHBondContact OE2-CB 3.31Å; H113-S115 PolarHBondContact O-N 3.32Å
116	L	72.6	Confident	73.6	Confident	80 Å²	80	77.6 Å²	77.6	42%	0.419	41%	0.405	S	S	.	.			trans	-104.1	119.4	177.8	-68.3	175.6	0	0	0	109	I114 I293 L304	I114-L116 PolarHBondContact O-N 3.01Å; L116-I293 HydrophobicContact CD2-CD1 3.8Å; L116-L304 HydrophobicContact CD2-CD1 3.97Å
117	L	72.8	Confident	74.5	Confident	100 Å²	100	76.8 Å²	76.8	52%	0.524	39%	0.387	S	S	.	.			trans	-106.1	135.3	171.3	-82.2	118.8	0	0	0	110.1	L122	L117-L122 HydrophobicContact CB-CD1 4.31Å; L117-L122 HydrophobicContact CB-CG 4.38Å; L117-L122 HydrophobicContact CD2-CD2 4.05Å; L117-L122 HydrophobicContact CD2-CG 4.24Å
118	T	75	Confident	75	Confident	72 Å²	72	72.8 Å²	72.8	44%	0.442	37%	0.374	S	S	.	.			trans	-79	144.9	169.2	60.9	0	0	0	0	109.6	D120 N121 L122	T118-D120 PolarHBondContact O-N 3.41Å; T118-N121 PolarHBondContact O-N 3.09Å; T118-N121 WeakPolarHBondContact OG1-CB 3.43Å; T118-N121 PolarHBondContact OG1-N 2.87Å; T118-N121 PolarHBondContact OG1-ND2 2.93Å; T118-N121 VanDerWaalsContact OG1-ND2 3.11Å; T118-N121 PolarHBondContact OG1-OD1 3.45Å; T118-L122 PolarHBondContact O-N 3.29Å
119	M	72.7	Confident	75.4	Confident	65 Å²	65	65 Å²	65	32%	0.32	35%	0.346	S	S	.	.	H	α-helix	trans	-59.2	-34.9	176.4	-75.5	-60.7	-61.6	0	0	112	N121 L122 L123 I287 I292	M119-N121 VanDerWaalsContact C-N 3.33Å; M119-N121 PolarHBondContact O-N 3.2Å; M119-L122 PolarHBondContact O-N 3.28Å; M119-L122 HydrophobicContact SD-CD1 4.29Å; M119-L123 WeakPolarHBondContact O-CG 3.49Å; M119-L123 PolarHBondContact O-N 3.36Å; M119-I287 HydrophobicContact CE-CG2 3.88Å; M119-I292 HydrophobicContact SD-CG1 4.49Å
120	D	74.3	Confident	75.8	Confident	123 Å²	123	70.4 Å²	70.4	66%	0.658	37%	0.37	S	S	*	.	H	α-helix	trans	-60.5	-43.5	177.4	-60.2	-24	0	0	0	111.4	T118 L122 L123 L124	T118-D120 PolarHBondContact O-N 3.41Å; D120-L122 VanDerWaalsContact C-N 3.33Å; D120-L122 PolarHBondContact O-N 3.12Å; D120-L123 PolarHBondContact O-N 3.47Å; D120-L124 VanDerWaalsContact O-CB 3.3Å; D120-L124 WeakPolarHBondContact O-CB 3.28Å; D120-L124 PolarHBondContact O-N 2.94Å
121	N	79.2	Confident	76	Confident	96 Å²	96	75.5 Å²	75.5	51%	0.513	40%	0.397	S	S	.	.	H	α-helix	trans	-66.2	-35.9	177.8	-69.2	-5.4	0	0	0	111.7	T118 M119 L124 L125	T118-N121 PolarHBondContact O-N 3.09Å; T118-N121 WeakPolarHBondContact OG1-CB 3.43Å; T118-N121 PolarHBondContact OG1-N 2.87Å; T118-N121 PolarHBondContact OG1-ND2 2.93Å; T118-N121 VanDerWaalsContact OG1-ND2 3.11Å; T118-N121 PolarHBondContact OG1-OD1 3.45Å; M119-N121 VanDerWaalsContact C-N 3.33Å; M119-N121 PolarHBondContact O-N 3.2Å; N121-L124 PolarHBondContact O-N 3.29Å; N121-L125 WeakPolarHBondContact O-CB 3.41Å; N121-L125 PolarHBondContact O-N 3.24Å
122	L	76.8	Confident	76.3	Confident	12 Å²	12	68.4 Å²	68.4	6%	0.063	37%	0.368	C	S	.	.	H	α-helix	trans	-69.1	-41.9	177	-76.4	170.4	0	0	0	112.7	L117 T118 M119 D120 L124 L125 K126 F286 I287	L117-L122 HydrophobicContact CB-CD1 4.31Å; L117-L122 HydrophobicContact CB-CG 4.38Å; L117-L122 HydrophobicContact CD2-CD2 4.05Å; L117-L122 HydrophobicContact CD2-CG 4.24Å; T118-L122 PolarHBondContact O-N 3.29Å; M119-L122 PolarHBondContact O-N 3.28Å; M119-L122 HydrophobicContact SD-CD1 4.29Å; D120-L122 VanDerWaalsContact C-N 3.33Å; D120-L122 PolarHBondContact O-N 3.12Å; L122-L124 VanDerWaalsContact C-N 3.3Å; L122-L125 PolarHBondContact O-N 2.98Å; L122-K126 WeakPolarHBondContact O-CB 3.06Å; L122-K126 PolarHBondContact O-N 3Å; L122-F286 HydrophobicContact CD1-CE1 4.23Å; L122-F286 HydrophobicContact CD2-CD1 3.87Å; L122-F286 HydrophobicContact CD2-CE1 3.62Å; L122-I287 HydrophobicContact CB-CD1 4.34Å; L122-I287 HydrophobicContact CB-CG1 4.33Å; L122-I287 HydrophobicContact CD1-CG1 4.33Å
123	L	79.4	Confident	76.5	Confident	92 Å²	92	68.8 Å²	68.8	48%	0.482	37%	0.368	S	S	.	.	H	α-helix	trans	-66.3	-37	174.7	-68.2	174	0	0	0	111.2	M119 D120 K126 S127	M119-L123 WeakPolarHBondContact O-CG 3.49Å; M119-L123 PolarHBondContact O-N 3.36Å; D120-L123 PolarHBondContact O-N 3.47Å; L123-K126 PolarHBondContact O-N 2.95Å; L123-S127 WeakPolarHBondContact O-CB 3.38Å; L123-S127 PolarHBondContact O-N 2.8Å
124	L	80.4	Confident	76.7	Confident	116 Å²	116	69.1 Å²	69.1	61%	0.607	37%	0.373	S	S	*	.	H	α-helix	trans	-65.8	-45.5	174.8	-168.1	140.7	0	0	0	111.2	D120 N121 L122 K126 S127 A128	D120-L124 VanDerWaalsContact O-CB 3.3Å; D120-L124 WeakPolarHBondContact O-CB 3.28Å; D120-L124 PolarHBondContact O-N 2.94Å; N121-L124 PolarHBondContact O-N 3.29Å; L122-L124 VanDerWaalsContact C-N 3.3Å; L124-K126 VanDerWaalsContact C-N 3.34Å; L124-K126 PolarHBondContact O-N 3.24Å; L124-S127 PolarHBondContact O-N 3.16Å; L124-S127 VanDerWaalsContact O-N 3.15Å; L124-S127 PolarHBondContact O-OG 3Å; L124-A128 WeakPolarHBondContact O-CB 3.29Å; L124-A128 PolarHBondContact O-N 3.49Å
125	L	78.8	Confident	76.8	Confident	85 Å²	85	68.1 Å²	68.1	45%	0.445	37%	0.368	S	S	.	.	H	α-helix	trans	-58.4	-45.5	173.1	177.3	63.5	0	0	0	111.5	N121 L122 S127 A128 L129	N121-L125 WeakPolarHBondContact O-CB 3.41Å; N121-L125 PolarHBondContact O-N 3.24Å; L122-L125 PolarHBondContact O-N 2.98Å; L125-S127 VanDerWaalsContact C-N 3.31Å; L125-S127 PolarHBondContact O-N 3.45Å; L125-A128 WeakPolarHBondContact O-CB 3.41Å; L125-A128 PolarHBondContact O-N 3.31Å; L125-A128 VanDerWaalsContact O-N 3.16Å; L125-L129 HydrophobicContact CD1-CD1 4.3Å; L125-L129 HydrophobicContact CD1-CG 4.23Å; L125-L129 HydrophobicContact CG-CD1 4.13Å; L125-L129 HydrophobicContact CG-CG 4.46Å; L125-L129 WeakPolarHBondContact O-CG 3.31Å; L125-L129 PolarHBondContact O-N 3.38Å
126	K	79.5	Confident	76.9	Confident	59 Å²	59	67.6 Å²	67.6	26%	0.257	36%	0.36	S	S	.	.	H	α-helix	trans	-58.1	-44.5	175.1	-179.3	-175.5	177.6	176.7	0	111.3	L122 L123 L124 A128 L129 K130 D284	L122-K126 WeakPolarHBondContact O-CB 3.06Å; L122-K126 PolarHBondContact O-N 3Å; L123-K126 PolarHBondContact O-N 2.95Å; L124-K126 VanDerWaalsContact C-N 3.34Å; L124-K126 PolarHBondContact O-N 3.24Å; K126-A128 VanDerWaalsContact C-N 3.31Å; K126-A128 PolarHBondContact O-N 3.28Å; K126-L129 PolarHBondContact O-N 2.85Å; K126-K130 WeakPolarHBondContact O-CB 2.9Å; K126-K130 PolarHBondContact O-N 3.02Å; K126-D284 WeakPolarHBondContact CD-OD1 3.46Å; K126-D284 WeakPolarHBondContact CE-OD1 3.04Å; K126-D284 VanDerWaalsContact CE-OD2 3.29Å; K126-D284 WeakPolarHBondContact CE-OD2 3.11Å; K126-D284 IonicContact NZ-OD1 3.57Å; K126-D284 PolarHBondContact NZ-OD1 2.97Å; K126-D284 IonicContact NZ-OD2 3.77Å; K126-D284 PolarHBondContact NZ-OD2 3.36Å
127	S	81.2	Confident	76.9	Confident	57 Å²	57	67.4 Å²	67.4	40%	0.399	36%	0.36	S	S	.	.	H	α-helix	trans	-65	-36.6	177.5	78.7	0	0	0	0	112.2	L123 L124 L125 K130 N131	L123-S127 WeakPolarHBondContact O-CB 3.38Å; L123-S127 PolarHBondContact O-N 2.8Å; L124-S127 PolarHBondContact O-N 3.16Å; L124-S127 VanDerWaalsContact O-N 3.15Å; L124-S127 PolarHBondContact O-OG 3Å; L125-S127 VanDerWaalsContact C-N 3.31Å; L125-S127 PolarHBondContact O-N 3.45Å; S127-K130 PolarHBondContact O-N 3.25Å; S127-N131 PolarHBondContact O-N 3.18Å; S127-N131 PolarHBondContact O-ND2 3.24Å
128	A	79.5	Confident	76.8	Confident	30 Å²	30	65.1 Å²	65.1	25%	0.248	35%	0.345	C	S	.	.	H	α-helix	trans	-66.8	-48.7	175.6	0	0	0	0	0	110.7	L124 L125 K126 K130 N131 C132 A248	L124-A128 WeakPolarHBondContact O-CB 3.29Å; L124-A128 PolarHBondContact O-N 3.49Å; L125-A128 WeakPolarHBondContact O-CB 3.41Å; L125-A128 PolarHBondContact O-N 3.31Å; L125-A128 VanDerWaalsContact O-N 3.16Å; K126-A128 VanDerWaalsContact C-N 3.31Å; K126-A128 PolarHBondContact O-N 3.28Å; A128-K130 VanDerWaalsContact C-N 3.25Å; A128-K130 PolarHBondContact O-N 2.96Å; A128-N131 CarbonylContact O-C 3.58Å; A128-N131 PolarHBondContact O-N 3.4Å; A128-N131 VanDerWaalsContact O-N 3.12Å; A128-C132 WeakPolarHBondContact O-CA 3.5Å; A128-C132 WeakPolarHBondContact O-CB 3.28Å; A128-C132 PolarHBondContact O-N 3.06Å; A128-A248 HydrophobicContact CB-CB 4.24Å
129	L	79.8	Confident	76.6	Confident	18 Å²	18	67.5 Å²	67.5	9%	0.094	35%	0.352	C	S	.	.	H	α-helix	trans	-62.2	-31.9	177	-71.8	173.6	0	0	0	112.9	L125 K126 N131 C132 F266 L279 T280	L125-L129 HydrophobicContact CD1-CD1 4.3Å; L125-L129 HydrophobicContact CD1-CG 4.23Å; L125-L129 HydrophobicContact CG-CD1 4.13Å; L125-L129 HydrophobicContact CG-CG 4.46Å; L125-L129 WeakPolarHBondContact O-CG 3.31Å; L125-L129 PolarHBondContact O-N 3.38Å; K126-L129 PolarHBondContact O-N 2.85Å; L129-N131 VanDerWaalsContact C-N 3.33Å; L129-C132 PolarHBondContact O-SG 2.99Å; L129-C132 VanDerWaalsContact O-SG 3.32Å; L129-F266 HydrophobicContact CD1-CZ 4.38Å; L129-L279 HydrophobicContact CD1-CB 4.39Å; L129-L279 HydrophobicContact CD2-CD1 4.24Å; L129-T280 HydrophobicContact CB-CG2 4.07Å
130	K	80.1	Confident	76.4	Confident	151 Å²	151	66.1 Å²	66.1	66%	0.657	35%	0.347	S	S	*	.	H	α-helix	trans	-69.1	-33.3	176.3	-171.6	179.7	178	-175.5	0	112.6	K126 S127 A128 T280	K126-K130 WeakPolarHBondContact O-CB 2.9Å; K126-K130 PolarHBondContact O-N 3.02Å; S127-K130 PolarHBondContact O-N 3.25Å; A128-K130 VanDerWaalsContact C-N 3.25Å; A128-K130 PolarHBondContact O-N 2.96Å; K130-T280 HydrophobicContact CB-CG2 3.93Å
131	N	77.5	Confident	76.1	Confident	113 Å²	113	65.8 Å²	65.8	60%	0.604	35%	0.354	S	S	*	.	H	α-helix	trans	-106.9	-2.1	-175.2	-64.3	-22.8	0	0	0	113.1	S127 A128 L129	S127-N131 PolarHBondContact O-N 3.18Å; S127-N131 PolarHBondContact O-ND2 3.24Å; A128-N131 CarbonylContact O-C 3.58Å; A128-N131 PolarHBondContact O-N 3.4Å; A128-N131 VanDerWaalsContact O-N 3.12Å; L129-N131 VanDerWaalsContact C-N 3.33Å
132	C	78	Confident	75.5	Confident	13 Å²	13	62.9 Å²	62.9	9%	0.088	35%	0.347	C	S	.	.	S	Bend	trans	-79.1	153.5	-177.5	71.8	0	0	0	0	111	A128 L129 A248 C276	A128-C132 WeakPolarHBondContact O-CA 3.5Å; A128-C132 WeakPolarHBondContact O-CB 3.28Å; A128-C132 PolarHBondContact O-N 3.06Å; L129-C132 PolarHBondContact O-SG 2.99Å; L129-C132 VanDerWaalsContact O-SG 3.32Å; C132-A248 HydrophobicContact CB-CB 3.79Å; C132-C276 PolarHBondContact SG-SG 2.71Å
133	D	74.6	Confident	75.3	Confident	33 Å²	33	66.5 Å²	66.5	18%	0.176	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	145.8	164.7	-156.5	5.3	0	0	0	110	S153 H249 F250	D133-S153 WeakPolarHBondContact OD2-CB 3.46Å; D133-S153 PolarHBondContact OD2-OG 2.89Å; D133-H249 WeakPolarHBondContact O-CA 3.41Å; D133-H249 IonicContact OD2-CE1 2.72Å; D133-H249 PolarHBondContact OD2-CE1 3.41Å; D133-H249 IonicContact OD2-ND1 3.16Å; D133-F250 PolarHBondContact O-N 3.21Å
134	S	73.4	Confident	75.2	Confident	28 Å²	28	65.9 Å²	65.9	20%	0.196	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	125.6	-177.3	55.7	0	0	0	0	112.9	F136 F250 C276	S134-F136 VanDerWaalsContact CB-CE2 3.44Å; S134-F136 VanDerWaalsContact OG-CE2 3.22Å; S134-F136 WeakPolarHBondContact OG-CE2 3.41Å; S134-F250 VanDerWaalsContact CA-O 3.32Å; S134-F250 WeakPolarHBondContact CA-O 3.47Å; S134-C276 WeakPolarHBondContact CB-SG 3.27Å; S134-C276 PolarHBondContact OG-SG 3.2Å
135	N	74.2	Confident	75.2	Confident	39 Å²	39	64 Å²	64	21%	0.209	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	101.7	169.1	-74	-43.3	0	0	0	108.8	F138 H249 F250 V251 R252	N135-F138 HydrophobicContact CB-CB 4.14Å; N135-F138 HydrophobicContact CB-CD2 3.93Å; N135-F138 HydrophobicContact CB-CG 3.99Å; N135-H249 PolarHBondContact ND2-NE2 2.96Å; N135-F250 PolarHBondContact N-O 3.5Å; N135-V251 WeakPolarHBondContact O-CA 3.34Å; N135-R252 PolarHBondContact O-N 3.23Å
136	F	74.8	Confident	75.2	Confident	38 Å²	38	61.4 Å²	61.4	17%	0.167	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	139.4	172.9	-62.1	-80.4	0	0	0	109.9	S134 F138 F250 R252 A273 K274 D275 L279	S134-F136 VanDerWaalsContact CB-CE2 3.44Å; S134-F136 VanDerWaalsContact OG-CE2 3.22Å; S134-F136 WeakPolarHBondContact OG-CE2 3.41Å; F136-F138 VanDerWaalsContact C-N 3.32Å; F136-F138 PolarHBondContact O-N 2.69Å; F136-F250 HydrophobicContact CD1-CD1 4.42Å; F136-F250 HydrophobicContact CD1-CE1 4.04Å; F136-F250 AromaticContact CE1-CD1 3.83Å; F136-F250 HydrophobicContact CE1-CD1 3.83Å; F136-F250 AromaticContact CE1-CE1 3.53Å; F136-F250 HydrophobicContact CE1-CE1 3.53Å; F136-F250 HydrophobicContact CZ-CD1 4.2Å; F136-F250 HydrophobicContact CZ-CE1 4.32Å; F136-R252 HydrophobicContact CD1-CB 4.4Å; F136-A273 HydrophobicContact CD1-CB 4.39Å; F136-A273 WeakPolarHBondContact CD1-O 3.36Å; F136-A273 HydrophobicContact CE1-CB 3.71Å; F136-A273 HydrophobicContact CZ-CB 4.2Å; F136-K274 WeakPolarHBondContact CD2-O 3.45Å; F136-D275 VanDerWaalsContact CZ-C 3.49Å; F136-L279 HydrophobicContact CE1-CD1 4.12Å; F136-L279 HydrophobicContact CE1-CD2 4.49Å; F136-L279 HydrophobicContact CE1-CG 4.4Å; F136-L279 HydrophobicContact CZ-CD1 3.88Å; F136-L279 HydrophobicContact CZ-CG 4.24Å
137	D	72.1	Confident	75.4	Confident	76 Å²	76	58.8 Å²	58.8	41%	0.406	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.6	47.5	179.6	-53.4	-35.6	0	0	0	113.3	R252 K254	D137-R252 WeakPolarHBondContact CA-O 3.43Å; D137-R252 PolarHBondContact N-O 3.3Å; D137-R252 IonicContact OD1-CZ 2.88Å; D137-R252 VanDerWaalsContact OD1-CZ 3.25Å; D137-R252 IonicContact OD1-NE 2.79Å; D137-R252 PolarHBondContact OD1-NE 3.03Å; D137-R252 IonicContact OD1-NH2 3.15Å; D137-R252 PolarHBondContact OD1-NH2 3.34Å; D137-R252 IonicContact OD2-CZ 3.55Å; D137-R252 IonicContact OD2-NH2 3.71Å; D137-R252 PolarHBondContact OD2-NH2 3.43Å; D137-K254 HydrophobicContact CB-CB 4Å; D137-K254 HydrophobicContact CB-CD 4.43Å; D137-K254 HydrophobicContact CB-CG 4.03Å; D137-K254 WeakPolarHBondContact O-CB 3.5Å
138	F	70.7	Confident	75.6	Confident	51 Å²	51	60.2 Å²	60.2	22%	0.224	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	126	-179.5	-153.9	-125.4	0	0	0	110.4	N135 F136 V140 L146 C149 V251 R252 L253 K254	N135-F138 HydrophobicContact CB-CB 4.14Å; N135-F138 HydrophobicContact CB-CD2 3.93Å; N135-F138 HydrophobicContact CB-CG 3.99Å; F136-F138 VanDerWaalsContact C-N 3.32Å; F136-F138 PolarHBondContact O-N 2.69Å; F138-V140 HydrophobicContact CD1-CG2 3.1Å; F138-V140 HydrophobicContact CE1-CG2 3.37Å; F138-V140 HydrophobicContact CG-CG2 4.06Å; F138-V140 HydrophobicContact CZ-CG2 4.49Å; F138-L146 HydrophobicContact CD1-CD1 4.12Å; F138-L146 HydrophobicContact CE1-CD1 4.45Å; F138-C149 HydrophobicContact CE1-CB 3.61Å; F138-C149 HydrophobicContact CZ-CB 3.62Å; F138-V251 HydrophobicContact CB-CG1 4.08Å; F138-V251 HydrophobicContact CD1-CG1 4.41Å; F138-R252 PolarHBondContact N-O 2.88Å; F138-L253 HydrophobicContact CB-CD2 4.33Å; F138-L253 CarbonylContact O-C 3.35Å; F138-L253 WeakPolarHBondContact O-CA 3.33Å; F138-L253 WeakPolarHBondContact O-CD2 3.42Å; F138-K254 PolarHBondContact O-N 3.14Å
139	Q	71	Confident	75.7	Confident	123 Å²	123	60.4 Å²	60.4	58%	0.575	32%	0.323	S	S	*	.			trans	-95.4	116.9	173.9	-83.4	-179.6	-43.5	0	0	109.3	K254	Q139-K254 HydrophobicContact CG-CB 3.6Å; Q139-K254 HydrophobicContact CG-CD 3.75Å; Q139-K254 HydrophobicContact CG-CG 4.18Å
140	V	68.6	Low	75.9	Confident	35 Å²	35	60.4 Å²	60.4	21%	0.212	32%	0.323	C	S	.	.			trans	-134.7	139.8	179.6	-165.5	0	0	0	0	108.9	F138 G142 E145 L146 L253	F138-V140 HydrophobicContact CD1-CG2 3.1Å; F138-V140 HydrophobicContact CE1-CG2 3.37Å; F138-V140 HydrophobicContact CG-CG2 4.06Å; F138-V140 HydrophobicContact CZ-CG2 4.49Å; V140-G142 WeakPolarHBondContact CG1-O 3.5Å; V140-E145 HydrophobicContact CG1-CB 3.58Å; V140-E145 HydrophobicContact CG1-CG 3.63Å; V140-E145 WeakPolarHBondContact CG1-OE2 3.12Å; V140-L146 HydrophobicContact CG1-CB 3.96Å; V140-L146 HydrophobicContact CG2-CB 4.45Å; V140-L146 HydrophobicContact CG2-CD1 4.15Å; V140-L253 HydrophobicContact CB-CD2 4.43Å; V140-L253 HydrophobicContact CG2-CD2 3.98Å
141	S	69.1	Low	76.2	Confident	116 Å²	116	53.7 Å²	53.7	81%	0.811	29%	0.294	S	S	*	.	S	Bend	trans	-83.5	-19.8	179.5	69.7	0	0	0	0	113.4	E145	S141-E145 WeakPolarHBondContact CA-OE2 3.38Å; S141-E145 WeakPolarHBondContact CB-OE2 3.48Å; S141-E145 PolarHBondContact N-OE2 3.25Å; S141-E145 PolarHBondContact OG-OE2 3.31Å
142	G	65.8	Low	76.6	Confident	35 Å²	35	53.2 Å²	53.2	36%	0.361	29%	0.288	S	S	.	.	S	Bend	trans	-165.9	168.8	177.6	0	0	0	0	0	115.6	V140 V144 E145 L146	V140-G142 WeakPolarHBondContact CG1-O 3.5Å; G142-V144 VanDerWaalsContact C-N 3.32Å; G142-V144 PolarHBondContact O-N 3.34Å; G142-E145 PolarHBondContact O-N 2.94Å; G142-L146 PolarHBondContact O-N 2.83Å; G142-L146 VanDerWaalsContact O-N 3.09Å
143	Y	72.3	Confident	76.8	Confident	88 Å²	88	53.8 Å²	53.8	35%	0.345	29%	0.293	S	S	.	.	H	α-helix	trans	-61.5	-36.5	-177.2	-176.5	-106.2	0	0	0	113.4	L146 I147 L172 L173 K176	Y143-L146 HydrophobicContact CD2-CD2 4.4Å; Y143-L146 WeakPolarHBondContact O-CB 3.48Å; Y143-L146 PolarHBondContact O-N 2.96Å; Y143-I147 HydrophobicContact CD1-CG1 4.17Å; Y143-I147 HydrophobicContact CE1-CD1 4.26Å; Y143-I147 HydrophobicContact CE1-CG1 3.78Å; Y143-I147 HydrophobicContact CE2-CD1 3.98Å; Y143-I147 HydrophobicContact CE2-CG1 4.25Å; Y143-I147 WeakPolarHBondContact O-CG1 3.38Å; Y143-I147 PolarHBondContact O-N 3.29Å; Y143-L172 PolarHBondContact OH-O 2.96Å; Y143-L172 VanDerWaalsContact OH-O 3.07Å; Y143-L173 HydrophobicContact CD1-CD2 4.24Å; Y143-L173 HydrophobicContact CE1-CD2 4.21Å; Y143-K176 PolarHBondContact OH-NZ 3.36Å
144	V	78.1	Confident	77.3	Confident	80 Å²	80	53.3 Å²	53.3	49%	0.485	29%	0.289	S	S	.	.	H	α-helix	trans	-65.4	-45.1	-179.5	-178.8	0	0	0	0	110.9	G142 L146 I147 E148 L173	G142-V144 VanDerWaalsContact C-N 3.32Å; G142-V144 PolarHBondContact O-N 3.34Å; V144-L146 VanDerWaalsContact C-N 3.29Å; V144-L146 PolarHBondContact O-N 2.9Å; V144-I147 PolarHBondContact O-N 3.48Å; V144-E148 WeakPolarHBondContact O-CG 3.33Å; V144-E148 PolarHBondContact O-N 3Å; V144-L173 HydrophobicContact CB-CD2 4.48Å; V144-L173 HydrophobicContact CG1-CD2 4.44Å; V144-L173 HydrophobicContact CG2-CD2 4.15Å
145	E	79.5	Confident	77.7	Confident	77 Å²	77	54 Å²	54	36%	0.36	29%	0.293	S	S	.	.	H	α-helix	trans	-61.9	-39.6	175.8	-175.8	-173.5	-168	0	0	110.8	V140 S141 G142 I147 E148 C149	V140-E145 HydrophobicContact CG1-CB 3.58Å; V140-E145 HydrophobicContact CG1-CG 3.63Å; V140-E145 WeakPolarHBondContact CG1-OE2 3.12Å; S141-E145 WeakPolarHBondContact CA-OE2 3.38Å; S141-E145 WeakPolarHBondContact CB-OE2 3.48Å; S141-E145 PolarHBondContact N-OE2 3.25Å; S141-E145 PolarHBondContact OG-OE2 3.31Å; G142-E145 PolarHBondContact O-N 2.94Å; E145-I147 PolarHBondContact O-N 3.28Å; E145-E148 WeakPolarHBondContact O-CB 3.24Å; E145-E148 PolarHBondContact O-N 3.27Å; E145-C149 PolarHBondContact O-N 3.3Å; E145-C149 PolarHBondContact O-SG 3.47Å
146	L	79.7	Confident	78.1	Confident	29 Å²	29	59.4 Å²	59.4	15%	0.152	32%	0.315	C	S	.	.	H	α-helix	trans	-59	-48.9	175.6	175	64.1	0	0	0	111.2	F138 V140 G142 Y143 V144 E148 C149 I150 V251 L253	F138-L146 HydrophobicContact CD1-CD1 4.12Å; F138-L146 HydrophobicContact CE1-CD1 4.45Å; V140-L146 HydrophobicContact CG1-CB 3.96Å; V140-L146 HydrophobicContact CG2-CB 4.45Å; V140-L146 HydrophobicContact CG2-CD1 4.15Å; G142-L146 PolarHBondContact O-N 2.83Å; G142-L146 VanDerWaalsContact O-N 3.09Å; Y143-L146 HydrophobicContact CD2-CD2 4.4Å; Y143-L146 WeakPolarHBondContact O-CB 3.48Å; Y143-L146 PolarHBondContact O-N 2.96Å; V144-L146 VanDerWaalsContact C-N 3.29Å; V144-L146 PolarHBondContact O-N 2.9Å; L146-E148 VanDerWaalsContact C-N 3.3Å; L146-E148 PolarHBondContact O-N 3.28Å; L146-C149 PolarHBondContact O-N 3.49Å; L146-I150 HydrophobicContact CD1-CD1 4.03Å; L146-I150 HydrophobicContact CD1-CG1 4.41Å; L146-I150 HydrophobicContact CG-CD1 3.95Å; L146-I150 VanDerWaalsContact O-CG1 3.29Å; L146-I150 WeakPolarHBondContact O-CG1 3.16Å; L146-I150 PolarHBondContact O-N 2.91Å; L146-V251 HydrophobicContact CD1-CB 4.41Å; L146-V251 HydrophobicContact CD1-CG1 3.82Å; L146-V251 HydrophobicContact CD1-CG2 4.2Å; L146-L253 HydrophobicContact CD1-CD2 4.47Å
147	I	82.5	Confident	78.2	Confident	5 Å²	5	62.2 Å²	62.2	3%	0.026	33%	0.329	C	S	.	.	H	α-helix	trans	-64.2	-38.4	178.4	-62.6	-45.9	0	0	0	110.9	Y143 V144 E145 I150 T151 K169 L172 L173	Y143-I147 HydrophobicContact CD1-CG1 4.17Å; Y143-I147 HydrophobicContact CE1-CD1 4.26Å; Y143-I147 HydrophobicContact CE1-CG1 3.78Å; Y143-I147 HydrophobicContact CE2-CD1 3.98Å; Y143-I147 HydrophobicContact CE2-CG1 4.25Å; Y143-I147 WeakPolarHBondContact O-CG1 3.38Å; Y143-I147 PolarHBondContact O-N 3.29Å; V144-I147 PolarHBondContact O-N 3.48Å; E145-I147 PolarHBondContact O-N 3.28Å; I147-I150 HydrophobicContact CD1-CD1 4.27Å; I147-I150 PolarHBondContact O-N 3.14Å; I147-T151 HydrophobicContact CG2-CG2 4.01Å; I147-T151 WeakPolarHBondContact O-CB 3.41Å; I147-T151 WeakPolarHBondContact O-CG2 3.48Å; I147-T151 PolarHBondContact O-N 3.43Å; I147-T151 PolarHBondContact O-OG1 3.17Å; I147-K169 HydrophobicContact CG2-CG 4.15Å; I147-L172 HydrophobicContact CD1-CB 3.97Å; I147-L172 HydrophobicContact CD1-CD1 4.19Å; I147-L172 HydrophobicContact CD1-CG 4.46Å; I147-L172 HydrophobicContact CG1-CB 4.16Å; I147-L172 HydrophobicContact CG2-CB 3.8Å; I147-L172 HydrophobicContact CG2-CD1 3.96Å; I147-L173 HydrophobicContact CB-CD2 4.12Å; I147-L173 HydrophobicContact CG1-CD2 4Å; I147-L173 HydrophobicContact CG2-CD2 4.3Å; I147-L173 HydrophobicContact CG2-CG 4.2Å
148	E	85.8	Confident	78.3	Confident	86 Å²	86	60.6 Å²	60.6	40%	0.402	32%	0.318	S	S	.	.	H	α-helix	trans	-58.8	-49.7	175.8	-76.7	-178.5	165.2	0	0	111.7	V144 E145 L146 I150 T151 E152 K169	V144-E148 WeakPolarHBondContact O-CG 3.33Å; V144-E148 PolarHBondContact O-N 3Å; E145-E148 WeakPolarHBondContact O-CB 3.24Å; E145-E148 PolarHBondContact O-N 3.27Å; L146-E148 VanDerWaalsContact C-N 3.3Å; L146-E148 PolarHBondContact O-N 3.28Å; E148-I150 PolarHBondContact O-N 3Å; E148-T151 WeakPolarHBondContact CA-OG1 3.44Å; E148-T151 PolarHBondContact O-N 3.09Å; E148-T151 PolarHBondContact O-OG1 3.37Å; E148-E152 WeakPolarHBondContact O-CB 3.46Å; E148-E152 PolarHBondContact O-N 3.08Å; E148-K169 VanDerWaalsContact CG-NZ 3.27Å; E148-K169 IonicContact OE1-NZ 2.74Å; E148-K169 PolarHBondContact OE1-NZ 2.92Å
149	C	82.7	Confident	78.5	Confident	34 Å²	34	64.9 Å²	64.9	23%	0.23	34%	0.343	C	S	.	.	H	α-helix	trans	-60.3	-44.1	176.4	-64.5	0	0	0	0	112.6	F138 E145 L146 T151 E152 S153	F138-C149 HydrophobicContact CE1-CB 3.61Å; F138-C149 HydrophobicContact CZ-CB 3.62Å; E145-C149 PolarHBondContact O-N 3.3Å; E145-C149 PolarHBondContact O-SG 3.47Å; L146-C149 PolarHBondContact O-N 3.49Å; C149-T151 PolarHBondContact O-N 2.88Å; C149-E152 PolarHBondContact O-N 2.92Å; C149-S153 WeakPolarHBondContact O-CB 3.34Å; C149-S153 PolarHBondContact O-N 3.49Å
150	I	84.2	Confident	78.9	Confident	18 Å²	18	59.5 Å²	59.5	9%	0.092	32%	0.318	C	S	.	.	H	α-helix	trans	-61	-47.2	177.6	-67.8	166.9	0	0	0	110.6	L146 I147 E148 E152 S153 W154 H249 V251	L146-I150 HydrophobicContact CD1-CD1 4.03Å; L146-I150 HydrophobicContact CD1-CG1 4.41Å; L146-I150 HydrophobicContact CG-CD1 3.95Å; L146-I150 VanDerWaalsContact O-CG1 3.29Å; L146-I150 WeakPolarHBondContact O-CG1 3.16Å; L146-I150 PolarHBondContact O-N 2.91Å; I147-I150 HydrophobicContact CD1-CD1 4.27Å; I147-I150 PolarHBondContact O-N 3.14Å; E148-I150 PolarHBondContact O-N 3Å; I150-E152 VanDerWaalsContact C-N 3.32Å; I150-E152 PolarHBondContact O-N 2.74Å; I150-S153 WeakPolarHBondContact O-CB 3.24Å; I150-S153 PolarHBondContact O-N 3.29Å; I150-W154 HydrophobicContact CG2-CD2 3.94Å; I150-W154 HydrophobicContact CG2-CE3 4.16Å; I150-W154 HydrophobicContact CG2-CH2 3.86Å; I150-W154 HydrophobicContact CG2-CZ2 3.6Å; I150-W154 HydrophobicContact CG2-CZ3 4.13Å; I150-W154 PolarHBondContact O-N 2.99Å; I150-H249 HydrophobicContact CG2-CB 4Å; I150-V251 HydrophobicContact CD1-CG2 3.89Å; I150-V251 HydrophobicContact CG1-CG2 4.02Å
151	T	85.9	Confident	79.5	Confident	10 Å²	10	60 Å²	60	6%	0.061	32%	0.323	C	S	.	.	H	α-helix	trans	-66.6	-34.4	-178.9	58.4	0	0	0	0	112.5	I147 E148 C149 W154 S155 V165 K169 L172	I147-T151 HydrophobicContact CG2-CG2 4.01Å; I147-T151 WeakPolarHBondContact O-CB 3.41Å; I147-T151 WeakPolarHBondContact O-CG2 3.48Å; I147-T151 PolarHBondContact O-N 3.43Å; I147-T151 PolarHBondContact O-OG1 3.17Å; E148-T151 WeakPolarHBondContact CA-OG1 3.44Å; E148-T151 PolarHBondContact O-N 3.09Å; E148-T151 PolarHBondContact O-OG1 3.37Å; C149-T151 PolarHBondContact O-N 2.88Å; T151-W154 HydrophobicContact CG2-CE3 4.44Å; T151-S155 PolarHBondContact O-N 3.47Å; T151-V165 HydrophobicContact CG2-CG1 4.43Å; T151-K169 HydrophobicContact CG2-CB 3.88Å; T151-K169 HydrophobicContact CG2-CG 4.28Å; T151-L172 HydrophobicContact CG2-CD1 4.5Å
152	E	84.8	Confident	80.1	Confident	103 Å²	103	62.7 Å²	62.7	48%	0.481	32%	0.321	S	S	.	.	H	α-helix	trans	-67.7	-41.5	173.6	-166.7	-176	166.9	0	0	111.3	E148 C149 I150 S155 K156	E148-E152 WeakPolarHBondContact O-CB 3.46Å; E148-E152 PolarHBondContact O-N 3.08Å; C149-E152 PolarHBondContact O-N 2.92Å; I150-E152 VanDerWaalsContact C-N 3.32Å; I150-E152 PolarHBondContact O-N 2.74Å; E152-S155 WeakPolarHBondContact O-CB 3.46Å; E152-S155 PolarHBondContact O-N 2.87Å; E152-K156 HydrophobicContact CG-CD 4.49Å; E152-K156 WeakPolarHBondContact O-CG 3.46Å; E152-K156 PolarHBondContact O-N 2.9Å; E152-K156 WeakPolarHBondContact OE1-CE 3.29Å; E152-K156 IonicContact OE1-NZ 2.78Å; E152-K156 PolarHBondContact OE1-NZ 3.01Å
153	S	83.5	Confident	80.9	Confident	26 Å²	26	66.1 Å²	66.1	18%	0.182	34%	0.335	C	S	.	.	H	α-helix	trans	-60.5	-46.2	175.5	-133.5	0	0	0	0	111.8	D133 C149 I150 S155 K156 Q157	D133-S153 WeakPolarHBondContact OD2-CB 3.46Å; D133-S153 PolarHBondContact OD2-OG 2.89Å; C149-S153 WeakPolarHBondContact O-CB 3.34Å; C149-S153 PolarHBondContact O-N 3.49Å; I150-S153 WeakPolarHBondContact O-CB 3.24Å; I150-S153 PolarHBondContact O-N 3.29Å; S153-S155 VanDerWaalsContact C-N 3.31Å; S153-S155 PolarHBondContact O-N 3.17Å; S153-K156 PolarHBondContact O-N 3.38Å; S153-Q157 WeakPolarHBondContact O-CB 3.44Å; S153-Q157 PolarHBondContact O-N 3.25Å
154	W	84.5	Confident	81.4	Confident	23 Å²	23	63.6 Å²	63.6	9%	0.087	33%	0.326	C	S	.	.	H	α-helix	trans	-60.3	-40.7	174.7	-70.8	-19.2	0	0	0	112.7	I150 T151 K156 F158 I160 A168 L172 L247 H249	I150-W154 HydrophobicContact CG2-CD2 3.94Å; I150-W154 HydrophobicContact CG2-CE3 4.16Å; I150-W154 HydrophobicContact CG2-CH2 3.86Å; I150-W154 HydrophobicContact CG2-CZ2 3.6Å; I150-W154 HydrophobicContact CG2-CZ3 4.13Å; I150-W154 PolarHBondContact O-N 2.99Å; T151-W154 HydrophobicContact CG2-CE3 4.44Å; W154-K156 VanDerWaalsContact C-N 3.33Å; W154-K156 PolarHBondContact O-N 3.32Å; W154-F158 WeakPolarHBondContact O-CB 3.48Å; W154-F158 PolarHBondContact O-N 3.28Å; W154-F158 VanDerWaalsContact O-N 3.12Å; W154-I160 HydrophobicContact CB-CD1 4.06Å; W154-A168 HydrophobicContact CZ3-CB 4.16Å; W154-L172 HydrophobicContact CH2-CD1 3.91Å; W154-L172 HydrophobicContact CZ3-CD1 3.79Å; W154-L247 HydrophobicContact CD2-CB 4.19Å; W154-L247 HydrophobicContact CD2-CD1 4.05Å; W154-L247 HydrophobicContact CE3-CB 4.5Å; W154-L247 HydrophobicContact CE3-CD1 3.81Å; W154-L247 HydrophobicContact CH2-CB 4.27Å; W154-L247 HydrophobicContact CZ2-CB 3.95Å; W154-L247 HydrophobicContact CZ3-CD1 4.15Å; W154-H249 AromaticContact CD1-ND1 3.95Å; W154-H249 HydrophobicContact CZ2-CB 3.91Å; W154-H249 AromaticContact NE1-CG 3.98Å; W154-H249 AromaticContact NE1-ND1 3.61Å
155	S	82.9	Confident	81.7	Confident	42 Å²	42	60.7 Å²	60.7	29%	0.294	31%	0.308	S	S	.	.	H	α-helix	trans	-62.8	-39	176.3	-172	0	0	0	0	112.3	T151 E152 S153 D159	T151-S155 PolarHBondContact O-N 3.47Å; E152-S155 WeakPolarHBondContact O-CB 3.46Å; E152-S155 PolarHBondContact O-N 2.87Å; S153-S155 VanDerWaalsContact C-N 3.31Å; S153-S155 PolarHBondContact O-N 3.17Å; S155-D159 PolarHBondContact O-N 3.23Å
156	K	81.8	Confident	81.9	Confident	153 Å²	153	64.5 Å²	64.5	67%	0.665	32%	0.323	S	S	*	.	H	α-helix	trans	-74.7	-46.4	-178.4	-73.5	174.2	-176.5	165.4	0	112.5	E152 S153 W154	E152-K156 HydrophobicContact CG-CD 4.49Å; E152-K156 WeakPolarHBondContact O-CG 3.46Å; E152-K156 PolarHBondContact O-N 2.9Å; E152-K156 WeakPolarHBondContact OE1-CE 3.29Å; E152-K156 IonicContact OE1-NZ 2.78Å; E152-K156 PolarHBondContact OE1-NZ 3.01Å; S153-K156 PolarHBondContact O-N 3.38Å; W154-K156 VanDerWaalsContact C-N 3.33Å; W154-K156 PolarHBondContact O-N 3.32Å
157	Q	76.6	Confident	82	Confident	97 Å²	97	64 Å²	64	45%	0.453	32%	0.323	S	S	.	.	H	α-helix	trans	-80	-39.4	-171.3	-172.5	-178.4	12.5	0	0	112.6	S153	S153-Q157 WeakPolarHBondContact O-CB 3.44Å; S153-Q157 PolarHBondContact O-N 3.25Å
158	F	74.2	Confident	82.1	Confident	41 Å²	41	63.9 Å²	63.9	18%	0.18	32%	0.323	C	S	.	.	H	α-helix	trans	-102.6	-5.5	-171.2	-65	-69.8	0	0	0	113.2	W154 I160 R245 L247	W154-F158 WeakPolarHBondContact O-CB 3.48Å; W154-F158 PolarHBondContact O-N 3.28Å; W154-F158 VanDerWaalsContact O-N 3.12Å; F158-I160 VanDerWaalsContact C-N 3.26Å; F158-I160 HydrophobicContact CB-CD1 3.58Å; F158-I160 HydrophobicContact CB-CG1 3.59Å; F158-I160 HydrophobicContact CD2-CD1 4.33Å; F158-I160 HydrophobicContact CG-CD1 4.31Å; F158-I160 PolarHBondContact O-N 3.44Å; F158-R245 PolarHBondContact O-NH1 3.06Å; F158-R245 PolarHBondContact O-NH2 3.48Å; F158-L247 HydrophobicContact CD2-CD2 4.26Å
159	D	75.6	Confident	82	Confident	142 Å²	142	62.6 Å²	62.6	76%	0.759	32%	0.315	S	S	*	.			trans	52.7	48.2	-177.8	-158	20.6	0	0	0	111.6	S155 R245	S155-D159 PolarHBondContact O-N 3.23Å; D159-R245 PolarHBondContact O-NH2 3.12Å
160	I	79.2	Confident	82.1	Confident	9 Å²	9	63.5 Å²	63.5	5%	0.046	33%	0.325	C	S	.	.			trans	-84.1	143.2	-179.8	-62.8	159.7	0	0	0	108.7	W154 F158 K162 E164 V165 L247	W154-I160 HydrophobicContact CB-CD1 4.06Å; F158-I160 VanDerWaalsContact C-N 3.26Å; F158-I160 HydrophobicContact CB-CD1 3.58Å; F158-I160 HydrophobicContact CB-CG1 3.59Å; F158-I160 HydrophobicContact CD2-CD1 4.33Å; F158-I160 HydrophobicContact CG-CD1 4.31Å; F158-I160 PolarHBondContact O-N 3.44Å; I160-K162 PolarHBondContact O-N 2.89Å; I160-E164 HydrophobicContact CG2-CB 3.4Å; I160-E164 HydrophobicContact CG2-CG 4.29Å; I160-V165 HydrophobicContact CB-CG2 3.99Å; I160-V165 HydrophobicContact CG2-CG2 3.8Å; I160-L247 HydrophobicContact CD1-CD1 3.93Å; I160-L247 HydrophobicContact CD1-CD2 3.31Å; I160-L247 HydrophobicContact CD1-CG 4.27Å; I160-L247 HydrophobicContact CG1-CD2 4.43Å
161	S	80.8	Confident	82.2	Confident	45 Å²	45	62.6 Å²	62.6	32%	0.315	32%	0.321	S	S	.	.			trans	-57.8	139.2	177.7	73.4	0	0	0	0	111.2	T163 E164 V165	S161-T163 PolarHBondContact O-N 2.93Å; S161-T163 PolarHBondContact OG-OG1 3.19Å; S161-E164 WeakPolarHBondContact CB-OE1 3.34Å; S161-E164 WeakPolarHBondContact O-CB 3.25Å; S161-E164 PolarHBondContact O-N 2.95Å; S161-E164 WeakPolarHBondContact OG-CB 3.45Å; S161-E164 VanDerWaalsContact OG-CD 3.25Å; S161-E164 VanDerWaalsContact OG-CG 3.23Å; S161-E164 WeakPolarHBondContact OG-CG 3.45Å; S161-E164 PolarHBondContact OG-N 3.44Å; S161-E164 PolarHBondContact OG-OE1 2.85Å; S161-V165 PolarHBondContact O-N 3.44Å; S161-V165 VanDerWaalsContact O-N 3.11Å
162	K	81.2	Confident	82	Confident	174 Å²	174	63.4 Å²	63.4	76%	0.757	33%	0.325	S	S	*	.	H	α-helix	trans	-56.5	-25.5	178.7	-71.2	-176.2	179.2	178	0	112.7	I160 K166	I160-K162 PolarHBondContact O-N 2.89Å; K162-K166 WeakPolarHBondContact O-CB 3.36Å; K162-K166 VanDerWaalsContact O-CG 3.29Å; K162-K166 WeakPolarHBondContact O-CG 3.14Å; K162-K166 PolarHBondContact O-N 3.36Å; K162-K166 VanDerWaalsContact O-N 3.17Å
163	T	82.3	Confident	81.9	Confident	107 Å²	107	61.7 Å²	61.7	66%	0.656	32%	0.319	S	S	*	.	H	α-helix	trans	-68.8	-44.5	174.6	38.5	0	0	0	0	112.4	S161 K166 S167	S161-T163 PolarHBondContact O-N 2.93Å; S161-T163 PolarHBondContact OG-OG1 3.19Å; T163-K166 PolarHBondContact O-N 3.08Å; T163-S167 PolarHBondContact O-N 2.87Å; T163-S167 VanDerWaalsContact O-N 3.08Å
164	E	84	Confident	81.8	Confident	35 Å²	35	61 Å²	61	16%	0.164	31%	0.314	C	S	.	.	H	α-helix	trans	-65.5	-45.1	176.4	-79.1	167	-109.8	0	0	111.4	I160 S161 K166 S167 A168 G242 S244	I160-E164 HydrophobicContact CG2-CB 3.4Å; I160-E164 HydrophobicContact CG2-CG 4.29Å; S161-E164 WeakPolarHBondContact CB-OE1 3.34Å; S161-E164 WeakPolarHBondContact O-CB 3.25Å; S161-E164 PolarHBondContact O-N 2.95Å; S161-E164 WeakPolarHBondContact OG-CB 3.45Å; S161-E164 VanDerWaalsContact OG-CD 3.25Å; S161-E164 VanDerWaalsContact OG-CG 3.23Å; S161-E164 WeakPolarHBondContact OG-CG 3.45Å; S161-E164 PolarHBondContact OG-N 3.44Å; S161-E164 PolarHBondContact OG-OE1 2.85Å; E164-K166 VanDerWaalsContact C-N 3.29Å; E164-K166 PolarHBondContact O-N 3.31Å; E164-S167 WeakPolarHBondContact O-CB 2.71Å; E164-S167 PolarHBondContact O-N 3.07Å; E164-S167 VanDerWaalsContact O-N 3.09Å; E164-A168 PolarHBondContact O-N 3.31Å; E164-G242 VanDerWaalsContact CG-O 3.22Å; E164-G242 WeakPolarHBondContact CG-O 3.16Å; E164-S244 PolarHBondContact OE2-N 3.09Å
165	V	83	Confident	81.4	Confident	18 Å²	18	67.8 Å²	67.8	11%	0.109	34%	0.34	C	S	.	.	H	α-helix	trans	-59.7	-40.5	177	-179.7	0	0	0	0	111.2	T151 I160 S161 A168 K169	T151-V165 HydrophobicContact CG2-CG1 4.43Å; I160-V165 HydrophobicContact CB-CG2 3.99Å; I160-V165 HydrophobicContact CG2-CG2 3.8Å; S161-V165 PolarHBondContact O-N 3.44Å; S161-V165 VanDerWaalsContact O-N 3.11Å; V165-A168 PolarHBondContact O-N 2.89Å; V165-K169 WeakPolarHBondContact O-CB 3.39Å; V165-K169 PolarHBondContact O-N 3.41Å
166	K	84	Confident	81	Confident	157 Å²	157	69 Å²	69	68%	0.683	34%	0.34	S	S	*	.	H	α-helix	trans	-63.9	-40.4	174.7	-80.3	179.4	-179.8	-174.7	0	112.5	K162 T163 E164 K169 A170	K162-K166 WeakPolarHBondContact O-CB 3.36Å; K162-K166 VanDerWaalsContact O-CG 3.29Å; K162-K166 WeakPolarHBondContact O-CG 3.14Å; K162-K166 PolarHBondContact O-N 3.36Å; K162-K166 VanDerWaalsContact O-N 3.17Å; T163-K166 PolarHBondContact O-N 3.08Å; E164-K166 VanDerWaalsContact C-N 3.29Å; E164-K166 PolarHBondContact O-N 3.31Å; K166-K169 PolarHBondContact O-N 3.5Å; K166-A170 WeakPolarHBondContact O-CB 3.2Å; K166-A170 PolarHBondContact O-N 2.75Å
167	S	82.9	Confident	80.3	Confident	19 Å²	19	67.1 Å²	67.1	13%	0.133	33%	0.333	C	S	.	.	H	α-helix	trans	-64.1	-46.8	176.5	-164.7	0	0	0	0	111.1	Y88 T163 E164 K169 A170 A171 I240	Y88-S167 PolarHBondContact OH-OG 2.94Å; T163-S167 PolarHBondContact O-N 2.87Å; T163-S167 VanDerWaalsContact O-N 3.08Å; E164-S167 WeakPolarHBondContact O-CB 2.71Å; E164-S167 PolarHBondContact O-N 3.07Å; E164-S167 VanDerWaalsContact O-N 3.09Å; S167-K169 PolarHBondContact O-N 3.48Å; S167-A170 PolarHBondContact O-N 2.89Å; S167-A171 PolarHBondContact O-N 2.85Å; S167-I240 WeakPolarHBondContact OG-CG2 3.42Å
168	A	83.4	Confident	79.8	Confident	3 Å²	3	65.8 Å²	65.8	3%	0.025	33%	0.327	C	S	.	.	H	α-helix	trans	-60.6	-43.2	175.7	0	0	0	0	0	112	W154 E164 V165 A170 A171 L172 I243	W154-A168 HydrophobicContact CZ3-CB 4.16Å; E164-A168 PolarHBondContact O-N 3.31Å; V165-A168 PolarHBondContact O-N 2.89Å; A168-A170 PolarHBondContact O-N 3.15Å; A168-A171 PolarHBondContact O-N 3.47Å; A168-L172 WeakPolarHBondContact O-CG 3.37Å; A168-L172 PolarHBondContact O-N 3.12Å; A168-I243 HydrophobicContact CB-CD1 4.11Å
169	K	85.4	Confident	79.1	Confident	58 Å²	58	66 Å²	66	25%	0.252	33%	0.328	S	S	.	.	H	α-helix	trans	-59.4	-46.4	174.3	-172.9	174.5	-179.4	179.7	0	111.5	I147 E148 T151 V165 K166 S167 A171 L172 L173	I147-K169 HydrophobicContact CG2-CG 4.15Å; E148-K169 VanDerWaalsContact CG-NZ 3.27Å; E148-K169 IonicContact OE1-NZ 2.74Å; E148-K169 PolarHBondContact OE1-NZ 2.92Å; T151-K169 HydrophobicContact CG2-CB 3.88Å; T151-K169 HydrophobicContact CG2-CG 4.28Å; V165-K169 WeakPolarHBondContact O-CB 3.39Å; V165-K169 PolarHBondContact O-N 3.41Å; K166-K169 PolarHBondContact O-N 3.5Å; S167-K169 PolarHBondContact O-N 3.48Å; K169-A171 VanDerWaalsContact C-N 3.33Å; K169-A171 PolarHBondContact O-N 3.27Å; K169-L172 PolarHBondContact O-N 3.27Å; K169-L173 HydrophobicContact CD-CD1 4.5Å; K169-L173 HydrophobicContact CG-CD1 3.88Å; K169-L173 HydrophobicContact CG-CG 4.46Å; K169-L173 WeakPolarHBondContact O-CB 3.48Å; K169-L173 WeakPolarHBondContact O-CG 3.38Å; K169-L173 PolarHBondContact O-N 3.44Å
170	A	84.5	Confident	78	Confident	53 Å²	53	65.8 Å²	65.8	44%	0.438	32%	0.32	S	S	.	.	H	α-helix	trans	-62.6	-40.2	178.9	0	0	0	0	0	112	K166 S167 A168 A174	K166-A170 WeakPolarHBondContact O-CB 3.2Å; K166-A170 PolarHBondContact O-N 2.75Å; S167-A170 PolarHBondContact O-N 2.89Å; A168-A170 PolarHBondContact O-N 3.15Å; A170-A174 PolarHBondContact O-N 2.67Å; A170-A174 VanDerWaalsContact O-N 3.11Å
171	A	84.8	Confident	76.1	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-67.3	-44	175.7	0	0	0	0	0	112.4	L78 Y88 W90 S167 A168 K169 L173 A174 I240	L78-A171 HydrophobicContact CD1-CB 4.44Å; L78-A171 HydrophobicContact CD2-CB 3.97Å; Y88-A171 HydrophobicContact CD2-CB 3.98Å; Y88-A171 HydrophobicContact CE2-CB 4.22Å; Y88-A171 HydrophobicContact CG-CB 4.22Å; W90-A171 PolarHBondContact NE1-O 2.95Å; S167-A171 PolarHBondContact O-N 2.85Å; A168-A171 PolarHBondContact O-N 3.47Å; K169-A171 VanDerWaalsContact C-N 3.33Å; K169-A171 PolarHBondContact O-N 3.27Å; A171-L173 VanDerWaalsContact C-N 3.33Å; A171-L173 PolarHBondContact O-N 3.35Å; A171-A174 WeakPolarHBondContact O-CB 3.48Å; A171-A174 PolarHBondContact O-N 2.91Å; A171-A174 VanDerWaalsContact O-N 3.11Å; A171-I240 HydrophobicContact CB-CD1 3.28Å; A171-I240 HydrophobicContact CB-CG1 4.01Å
172	L	82.5	Confident	73.8	Confident	27 Å²	27	75.4 Å²	75.4	14%	0.141	36%	0.364	C	S	.	.	H	α-helix	trans	-64.7	-37.1	178	-71.6	168.5	0	0	0	112.6	W90 Y143 I147 T151 W154 A168 K169 A174 K176	W90-L172 HydrophobicContact CZ2-CD2 4.5Å; Y143-L172 PolarHBondContact OH-O 2.96Å; Y143-L172 VanDerWaalsContact OH-O 3.07Å; I147-L172 HydrophobicContact CD1-CB 3.97Å; I147-L172 HydrophobicContact CD1-CD1 4.19Å; I147-L172 HydrophobicContact CD1-CG 4.46Å; I147-L172 HydrophobicContact CG1-CB 4.16Å; I147-L172 HydrophobicContact CG2-CB 3.8Å; I147-L172 HydrophobicContact CG2-CD1 3.96Å; T151-L172 HydrophobicContact CG2-CD1 4.5Å; W154-L172 HydrophobicContact CH2-CD1 3.91Å; W154-L172 HydrophobicContact CZ3-CD1 3.79Å; A168-L172 WeakPolarHBondContact O-CG 3.37Å; A168-L172 PolarHBondContact O-N 3.12Å; K169-L172 PolarHBondContact O-N 3.27Å; L172-A174 PolarHBondContact O-N 2.93Å; L172-K176 PolarHBondContact O-NZ 3.03Å
173	L	83.1	Confident	71.4	Confident	67 Å²	67	75.2 Å²	75.2	35%	0.351	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-1.4	175.6	-65.3	177.9	0	0	0	113.7	Y143 V144 I147 K169 A171	Y143-L173 HydrophobicContact CD1-CD2 4.24Å; Y143-L173 HydrophobicContact CE1-CD2 4.21Å; V144-L173 HydrophobicContact CB-CD2 4.48Å; V144-L173 HydrophobicContact CG1-CD2 4.44Å; V144-L173 HydrophobicContact CG2-CD2 4.15Å; I147-L173 HydrophobicContact CB-CD2 4.12Å; I147-L173 HydrophobicContact CG1-CD2 4Å; I147-L173 HydrophobicContact CG2-CD2 4.3Å; I147-L173 HydrophobicContact CG2-CG 4.2Å; K169-L173 HydrophobicContact CD-CD1 4.5Å; K169-L173 HydrophobicContact CG-CD1 3.88Å; K169-L173 HydrophobicContact CG-CG 4.46Å; K169-L173 WeakPolarHBondContact O-CB 3.48Å; K169-L173 WeakPolarHBondContact O-CG 3.38Å; K169-L173 PolarHBondContact O-N 3.44Å; A171-L173 VanDerWaalsContact C-N 3.33Å; A171-L173 PolarHBondContact O-N 3.35Å
174	A	81.1	Confident	68.9	Low	11 Å²	11	78.1 Å²	78.1	9%	0.091	37%	0.374	C	S	.	.	S	Bend	trans	-59.7	154.2	177.7	0	0	0	0	0	112.1	Y88 A170 A171 L172	Y88-A174 WeakPolarHBondContact O-CB 3.4Å; A170-A174 PolarHBondContact O-N 2.67Å; A170-A174 VanDerWaalsContact O-N 3.11Å; A171-A174 WeakPolarHBondContact O-CB 3.48Å; A171-A174 PolarHBondContact O-N 2.91Å; A171-A174 VanDerWaalsContact O-N 3.11Å; L172-A174 PolarHBondContact O-N 2.93Å
175	R	75.4	Confident	66.2	Low	166 Å²	166	87.6 Å²	87.6	63%	0.626	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.2	137.6	-179.2	-176.2	177.9	175	-169.1	-3.8	110.6	F89 W90	F89-R175 WeakPolarHBondContact CA-O 3.19Å; W90-R175 PolarHBondContact N-O 3.34Å
176	K	75	Confident	63.5	Low	67 Å²	67	95.3 Å²	95.3	29%	0.291	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	115.9	176.4	-62.5	166.1	-178.6	65.9	0	109.8	W90 Y143 L172	W90-K176 HydrophobicContact CB-CB 4.37Å; W90-K176 HydrophobicContact CB-CG 3.94Å; W90-K176 HydrophobicContact CG-CG 4.18Å; Y143-K176 PolarHBondContact OH-NZ 3.36Å; L172-K176 PolarHBondContact O-NZ 3.03Å
177	Q	66.8	Low	61	Low	113 Å²	113	92.1 Å²	92.1	53%	0.528	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	99	178.1	-176	171.4	-8	0	0	109	F89 W90 E92	F89-Q177 HydrophobicContact CD2-CB 4.28Å; W90-Q177 WeakPolarHBondContact O-CA 3.16Å; W90-Q177 PolarHBondContact O-N 3.35Å; E92-Q177 PolarHBondContact N-O 2.84Å
178	H	67	Low	58.3	Low	70 Å²	70	98.7 Å²	98.7	32%	0.324	48%	0.477	S	S	.	.			trans	-75.5	145.7	170.4	-57.8	-90.8	0	0	0	109.8	E74 K180	E74-H178 IonicContact OE1-ND1 3.72Å; E74-H178 IonicContact OE2-CE1 2.77Å; E74-H178 PolarHBondContact OE2-CE1 2.98Å; E74-H178 IonicContact OE2-ND1 2.71Å; E74-H178 PolarHBondContact OE2-ND1 3.44Å; H178-K180 PolarHBondContact O-N 3.19Å; H178-K180 VanDerWaalsContact O-N 3.16Å
179	F	58.3	Low	55.5	Low	45 Å²	45	106.4 Å²	106.4	20%	0.197	51%	0.514	C	S	.	.			trans	-62.6	116.5	-173.2	-176.7	-90.1	0	0	0	111.3	E92 V103 E107 W109 K181	E92-F179 PolarHBondContact OE2-N 3.3Å; V103-F179 HydrophobicContact CG1-CD2 4.08Å; V103-F179 HydrophobicContact CG1-CE2 4.14Å; V103-F179 HydrophobicContact CG2-CD2 4.28Å; E107-F179 VanDerWaalsContact C-CZ 3.42Å; E107-F179 HydrophobicContact CB-CE2 3.58Å; E107-F179 HydrophobicContact CB-CZ 3.68Å; E107-F179 HydrophobicContact CG-CE2 4Å; E107-F179 WeakPolarHBondContact O-CZ 3.47Å; W109-F179 HydrophobicContact CZ2-CB 3.88Å; W109-F179 HydrophobicContact CZ2-CG 4.3Å; W109-F179 AromaticContact NE1-CD1 3.42Å; F179-K181 HydrophobicContact CE1-CG 4.14Å
180	K	52.7	Low	52.6	Low	138 Å²	138	110.1 Å²	110.1	60%	0.6	54%	0.542	S	S	*	.			trans	-107.7	121.1	175.6	-107.7	179.1	178.5	176	0	108.5	H178 P182	H178-K180 PolarHBondContact O-N 3.19Å; H178-K180 VanDerWaalsContact O-N 3.16Å; K180-P182 WeakPolarHBondContact O-CD 3.49Å; K180-P182 VanDerWaalsContact O-N 3.17Å
181	K	40.7	Very low	49.9	Very low	175 Å²	175	112.5 Å²	112.5	76%	0.761	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-55.2	122.2	172.2	-73.8	-171.7	175.8	-172.6	0	109.9	F179 K183	F179-K181 HydrophobicContact CE1-CG 4.14Å; K181-K183 PolarHBondContact O-N 3.44Å
182	P	32	Very low	47.4	Very low	80 Å²	80	118.4 Å²	118.4	52%	0.519	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-65.9	127.9	171.1	26.8	-32.8	0	0	0	108.7	E107 K180 L184	E107-P182 WeakPolarHBondContact OE2-CD 3.18Å; E107-P182 VanDerWaalsContact OE2-CG 3.3Å; E107-P182 WeakPolarHBondContact OE2-CG 3.47Å; K180-P182 WeakPolarHBondContact O-CD 3.49Å; K180-P182 VanDerWaalsContact O-N 3.17Å; P182-L184 PolarHBondContact O-N 3.1Å
183	K	31.2	Very low	44.5	Very low	170 Å²	170	126.2 Å²	126.2	74%	0.739	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-64.8	117.2	166.9	-77.4	-173.6	175.5	-176.6	0	106.6	K181 R185	K181-K183 PolarHBondContact O-N 3.44Å; K183-R185 PolarHBondContact O-N 3.09Å; K183-R185 VanDerWaalsContact O-N 3.07Å
184	L	29	Very low	41.7	Very low	169 Å²	169	128.3 Å²	128.3	89%	0.885	65%	0.65	S	S	*	*			trans	-37.7	113.4	175.2	-83	124	0	0	0	110.7	P182 M186	P182-L184 PolarHBondContact O-N 3.1Å; L184-M186 PolarHBondContact O-N 2.93Å
185	R	26.8	Very low	39.1	Very low	233 Å²	233	133 Å²	133	88%	0.879	68%	0.682	S	S	*	*			trans	-71.8	122.3	162.5	-90.9	-176.1	172.1	168.8	-2.4	106.9	K183 S187	K183-R185 PolarHBondContact O-N 3.09Å; K183-R185 VanDerWaalsContact O-N 3.07Å; R185-S187 VanDerWaalsContact C-N 3.32Å; R185-S187 PolarHBondContact O-N 3.44Å
186	M	27.8	Very low	36.7	Very low	181 Å²	181	129.1 Å²	129.1	89%	0.892	69%	0.685	S	S	*	*	S	Bend	trans	-81.2	77.1	-173.7	-163.8	149.6	58.1	0	0	109.4	L184	L184-M186 PolarHBondContact O-N 2.93Å
187	S	30.3	Very low	34.3	Very low	90 Å²	90	133.1 Å²	133.1	63%	0.629	71%	0.71	S	S	*	*			trans	-158.8	85.9	166.3	57.9	0	0	0	0	107.6	R185	R185-S187 VanDerWaalsContact C-N 3.32Å; R185-S187 PolarHBondContact O-N 3.44Å
188	D	25.8	Very low	32.2	Very low	157 Å²	157	134.9 Å²	134.9	84%	0.84	72%	0.721	S	S	*	*			trans	166.1	69.4	151.9	-80.5	-13.2	0	0	0	107
189	M	25.6	Very low	30.2	Very low	164 Å²	164	137.3 Å²	137.3	81%	0.808	74%	0.741	S	S	*	*			trans	-94.6	87.4	171.4	-79.7	-80.7	133.9	0	0	108.1
190	T	24.8	Very low	28.6	Very low	137 Å²	137	144.2 Å²	144.2	84%	0.84	77%	0.774	S	S	*	*			trans	-129.8	72	159.8	50.5	0	0	0	0	109.8
191	S	27.2	Very low	27.1	Very low	103 Å²	103	145.7 Å²	145.7	72%	0.72	78%	0.783	S	S	*	*	S	Bend	trans	-173.7	122.9	143.7	53.5	0	0	0	0	108.5
192	P	32.5	Very low	26.3	Very low	124 Å²	124	146.8 Å²	146.8	81%	0.805	79%	0.791	S	S	*	*			trans	-88.9	121.5	-169.4	33.2	-29	0	0	0	110.5
193	E	22.3	Very low	25.9	Very low	190 Å²	190	152.2 Å²	152.2	89%	0.888	81%	0.809	S	S	*	*			trans	-167	126.6	152.9	-108	164.2	-145.5	0	0	110.5
194	S	24.5	Very low	25.5	Very low	111 Å²	111	147.5 Å²	147.5	78%	0.776	81%	0.808	S	S	*	*			trans	79.8	85.4	171.2	72.2	0	0	0	0	119.6
195	S	24.9	Very low	25.3	Very low	111 Å²	111	149.4 Å²	149.4	78%	0.776	81%	0.813	S	S	*	*			trans	4.4	117.8	131.3	49.5	0	0	0	0	117.4
196	A	25.9	Very low	25.4	Very low	84 Å²	84	140.6 Å²	140.6	69%	0.694	79%	0.794	S	S	*	*				81.5	140.9	72.5	0	0	0	0	0	114.9
197	N	23.9	Very low	25.6	Very low	151 Å²	151	141.1 Å²	141.1	81%	0.807	80%	0.795	S	S	*	*			trans	108.7	129.1	168.5	-61.5	-12	0	0	0	114.7
198	I	24	Very low	25.8	Very low	149 Å²	149	145.9 Å²	145.9	76%	0.764	80%	0.804	S	S	*	*			cis	-151.7	147.8	9.4	-94.3	143.8	0	0	0	108.5
199	V	24.1	Very low	26.2	Very low	122 Å²	122	144.2 Å²	144.2	74%	0.739	80%	0.795	S	S	*	*			trans	-81.1	126.3	174.6	172	0	0	0	0	109.7	Q201	V199-Q201 HydrophobicContact CG1-CG 4.31Å
200	E	24.2	Very low	26.7	Very low	189 Å²	189	139.6 Å²	139.6	88%	0.883	78%	0.779	S	S	*	*			trans	-110.9	113	154.8	-85.6	-179.9	167.2	0	0	107.5
201	Q	22.4	Very low	27.3	Very low	169 Å²	169	136.1 Å²	136.1	79%	0.79	76%	0.764	S	S	*	*			trans	-70.6	132.2	166.2	-80.9	169.7	-69.9	0	0	108.8	V199	V199-Q201 HydrophobicContact CG1-CG 4.31Å
202	E	23.9	Very low	27.7	Very low	199 Å²	199	138.9 Å²	138.9	93%	0.93	76%	0.763	S	S	*	*			trans	-156.9	138.1	135.1	-109.9	175.4	-161.6	0	0	109.1
203	E	22.1	Very low	27.9	Very low	194 Å²	194	135.9 Å²	135.9	91%	0.907	75%	0.749	S	S	*	*			trans	-79.5	160.6	-163.3	-61.3	172.2	143.2	0	0	113
204	G	23.1	Very low	28.5	Very low	70 Å²	70	128.4 Å²	128.4	72%	0.722	72%	0.719	S	S	*	*	S	Bend	trans	112.3	99	154.2	0	0	0	0	0	116.9	G206	G204-G206 PolarHBondContact O-N 3.33Å
205	E	25.5	Very low	29	Very low	209 Å²	209	124.7 Å²	124.7	98%	0.977	70%	0.695	S	S	*	*			trans	30.8	77.6	148.5	-62.7	-171.9	153.3	0	0	118.6
206	G	28.5	Very low	29.5	Very low	48 Å²	48	127.1 Å²	127.1	50%	0.495	69%	0.692	S	S	.	*			trans	-142.7	28.6	179	0	0	0	0	0	115.7	G204 K208 N209	G204-G206 PolarHBondContact O-N 3.33Å; G206-K208 VanDerWaalsContact C-N 3.28Å; G206-K208 PolarHBondContact O-N 3.32Å; G206-N209 PolarHBondContact O-N 3.34Å
207	Q	31.6	Very low	29.9	Very low	192 Å²	192	129.6 Å²	129.6	90%	0.897	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-7.1	-166.5	-127.8	162.4	-3.7	0	0	115.8
208	K	34.3	Very low	30.6	Very low	190 Å²	190	125.4 Å²	125.4	83%	0.826	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-19.3	173.5	-77.8	-178.2	177.9	174.7	0	114.9	G206	G206-K208 VanDerWaalsContact C-N 3.28Å; G206-K208 PolarHBondContact O-N 3.32Å
209	N	35.1	Very low	31.2	Very low	123 Å²	123	122.7 Å²	122.7	66%	0.658	66%	0.659	S	S	*	*	H	α-helix	trans	-89.9	-28.2	-178.1	-78	-14.3	0	0	0	113.7	G206 A211 K212 A213	G206-N209 PolarHBondContact O-N 3.34Å; N209-A211 VanDerWaalsContact C-N 3.32Å; N209-A211 PolarHBondContact O-N 2.89Å; N209-K212 PolarHBondContact O-N 3.04Å; N209-A213 PolarHBondContact O-N 3.34Å
210	S	36.6	Very low	31.8	Very low	67 Å²	67	121.5 Å²	121.5	47%	0.469	65%	0.646	S	S	.	*	H	α-helix	trans	-59.5	-38.9	177.2	174.9	0	0	0	0	113	K212 A213 A214	S210-K212 PolarHBondContact O-N 3.27Å; S210-A213 PolarHBondContact O-N 3.33Å; S210-A214 WeakPolarHBondContact O-CB 3.44Å; S210-A214 PolarHBondContact O-N 3.48Å
211	A	36.3	Very low	33	Very low	64 Å²	64	116.3 Å²	116.3	53%	0.529	63%	0.627	S	S	.	*	H	α-helix	trans	-66.7	-35.2	179.3	0	0	0	0	0	113.1	N209 A215	N209-A211 VanDerWaalsContact C-N 3.32Å; N209-A211 PolarHBondContact O-N 2.89Å; A211-A215 VanDerWaalsContact O-CB 3.24Å; A211-A215 WeakPolarHBondContact O-CB 3.19Å; A211-A215 PolarHBondContact O-N 2.89Å; A211-A215 VanDerWaalsContact O-N 3.12Å
212	K	35.1	Very low	34.5	Very low	161 Å²	161	109.7 Å²	109.7	70%	0.7	60%	0.597	S	S	*	*	H	α-helix	trans	-72.8	-40.8	174.5	-83	-176	176.4	177.5	0	111.8	N209 S210 A215 K216	N209-K212 PolarHBondContact O-N 3.04Å; S210-K212 PolarHBondContact O-N 3.27Å; K212-A215 PolarHBondContact O-N 3.48Å; K212-K216 PolarHBondContact O-N 3.04Å; K212-K216 VanDerWaalsContact O-N 3.09Å
213	A	37.3	Very low	35.8	Very low	60 Å²	60	105 Å²	105	50%	0.496	58%	0.577	S	S	.	*	H	α-helix	trans	-65	-44.9	177.6	0	0	0	0	0	112	N209 S210 K216 Q217	N209-A213 PolarHBondContact O-N 3.34Å; S210-A213 PolarHBondContact O-N 3.33Å; A213-K216 WeakPolarHBondContact O-CB 3.27Å; A213-K216 PolarHBondContact O-N 3.35Å; A213-Q217 PolarHBondContact O-N 2.95Å; A213-Q217 VanDerWaalsContact O-N 3.12Å
214	A	36.2	Very low	37.2	Very low	33 Å²	33	104.2 Å²	104.2	27%	0.273	57%	0.566	S	S	.	*	H	α-helix	trans	-67.1	-36.6	177.4	0	0	0	0	0	112.8	S210 K216 Q217 A218	S210-A214 WeakPolarHBondContact O-CB 3.44Å; S210-A214 PolarHBondContact O-N 3.48Å; A214-K216 VanDerWaalsContact C-N 3.34Å; A214-Q217 PolarHBondContact O-N 3.47Å; A214-Q217 VanDerWaalsContact O-N 3.12Å; A214-A218 PolarHBondContact O-N 3.06Å
215	A	34.1	Very low	38.7	Very low	33 Å²	33	107.2 Å²	107.2	27%	0.273	56%	0.559	S	S	.	*	H	α-helix	trans	-62.3	-41	174.1	0	0	0	0	0	111.8	A211 K212 Q217	A211-A215 VanDerWaalsContact O-CB 3.24Å; A211-A215 WeakPolarHBondContact O-CB 3.19Å; A211-A215 PolarHBondContact O-N 2.89Å; A211-A215 VanDerWaalsContact O-N 3.12Å; K212-A215 PolarHBondContact O-N 3.48Å; A215-Q217 VanDerWaalsContact C-N 3.3Å; A215-Q217 PolarHBondContact O-N 2.91Å
216	K	36.1	Very low	40.2	Very low	162 Å²	162	98.1 Å²	98.1	70%	0.704	52%	0.517	S	S	*	.	H	α-helix	trans	-57.8	-45.1	170.7	-91.2	-175.4	174.3	-177.3	0	110.6	K212 A213 A214 H220	K212-K216 PolarHBondContact O-N 3.04Å; K212-K216 VanDerWaalsContact O-N 3.09Å; A213-K216 WeakPolarHBondContact O-CB 3.27Å; A213-K216 PolarHBondContact O-N 3.35Å; A214-K216 VanDerWaalsContact C-N 3.34Å; K216-H220 WeakPolarHBondContact O-CB 3.42Å; K216-H220 PolarHBondContact O-N 2.98Å
217	Q	34	Very low	41.4	Very low	137 Å²	137	98.2 Å²	98.2	64%	0.64	51%	0.509	S	S	*	.	H	α-helix	trans	-68.5	-40.6	-170.6	-155.2	171.7	7.7	0	0	115.2	A213 A214 A215 H220 T221	A213-Q217 PolarHBondContact O-N 2.95Å; A213-Q217 VanDerWaalsContact O-N 3.12Å; A214-Q217 PolarHBondContact O-N 3.47Å; A214-Q217 VanDerWaalsContact O-N 3.12Å; A215-Q217 VanDerWaalsContact C-N 3.3Å; A215-Q217 PolarHBondContact O-N 2.91Å; Q217-H220 WeakPolarHBondContact O-CB 3.37Å; Q217-H220 PolarHBondContact O-N 3.26Å; Q217-T221 PolarHBondContact O-N 2.87Å; Q217-T221 VanDerWaalsContact O-N 3.1Å; Q217-T221 PolarHBondContact O-OG1 3.35Å
218	A	37.7	Very low	42.5	Very low	62 Å²	62	98 Å²	98	51%	0.512	51%	0.506	S	S	.	.	H	α-helix	trans	-68	-46.7	179.3	0	0	0	0	0	112.1	A214 H220 T221 L222	A214-A218 PolarHBondContact O-N 3.06Å; A218-H220 VanDerWaalsContact C-N 3.28Å; A218-H220 PolarHBondContact O-N 3.4Å; A218-T221 WeakPolarHBondContact O-CB 3.32Å; A218-T221 PolarHBondContact O-N 3.04Å; A218-T221 VanDerWaalsContact O-N 3.12Å; A218-L222 PolarHBondContact O-N 3.36Å
219	H	36.5	Very low	43.5	Very low	92 Å²	92	94 Å²	94	43%	0.426	49%	0.493	S	S	.	.	H	α-helix	trans	-61.7	-39.2	172.6	-138.6	-80.1	0	0	0	110.8	T221 L222 L223	H219-T221 PolarHBondContact O-N 2.82Å; H219-L222 PolarHBondContact O-N 2.83Å; H219-L223 WeakPolarHBondContact O-CB 3.36Å; H219-L223 VanDerWaalsContact O-CG 3.27Å; H219-L223 WeakPolarHBondContact O-CG 3.42Å; H219-L223 PolarHBondContact O-N 2.95Å
220	H	38.1	Very low	44.6	Very low	98 Å²	98	89.6 Å²	89.6	45%	0.454	47%	0.47	S	S	.	.	H	α-helix	trans	-60.8	-26.9	175.7	-134.3	-68.9	0	0	0	113.8	K216 Q217 A218 R224	K216-H220 WeakPolarHBondContact O-CB 3.42Å; K216-H220 PolarHBondContact O-N 2.98Å; Q217-H220 WeakPolarHBondContact O-CB 3.37Å; Q217-H220 PolarHBondContact O-N 3.26Å; A218-H220 VanDerWaalsContact C-N 3.28Å; A218-H220 PolarHBondContact O-N 3.4Å; H220-R224 WeakPolarHBondContact O-CB 3.48Å; H220-R224 VanDerWaalsContact O-CG 3.25Å; H220-R224 WeakPolarHBondContact O-CG 3.34Å; H220-R224 PolarHBondContact O-N 3.04Å; H220-R224 VanDerWaalsContact O-N 3.16Å
221	T	48.4	Very low	45.8	Very low	79 Å²	79	86.9 Å²	86.9	49%	0.485	45%	0.451	S	S	.	.	H	α-helix	trans	-79.1	-38.4	-176.7	-51.8	0	0	0	0	110.9	Q217 A218 H219	Q217-T221 PolarHBondContact O-N 2.87Å; Q217-T221 VanDerWaalsContact O-N 3.1Å; Q217-T221 PolarHBondContact O-OG1 3.35Å; A218-T221 WeakPolarHBondContact O-CB 3.32Å; A218-T221 PolarHBondContact O-N 3.04Å; A218-T221 VanDerWaalsContact O-N 3.12Å; H219-T221 PolarHBondContact O-N 2.82Å
222	L	53.6	Low	46.8	Very low	31 Å²	31	86 Å²	86	16%	0.162	45%	0.447	C	S	.	.	H	α-helix	trans	-71.4	-47.1	173.2	-173.1	131.8	0	0	0	111	F72 A218 H219 R224 K225 L226	F72-L222 HydrophobicContact CD1-CD2 4.44Å; F72-L222 HydrophobicContact CE1-CD2 3.89Å; F72-L222 HydrophobicContact CE2-CD1 4.5Å; F72-L222 HydrophobicContact CE2-CD2 4.01Å; F72-L222 HydrophobicContact CZ-CD1 4.43Å; F72-L222 HydrophobicContact CZ-CD2 3.65Å; A218-L222 PolarHBondContact O-N 3.36Å; H219-L222 PolarHBondContact O-N 2.83Å; L222-R224 PolarHBondContact O-N 3.46Å; L222-R224 VanDerWaalsContact O-N 3.09Å; L222-K225 WeakPolarHBondContact O-CA 3.4Å; L222-K225 WeakPolarHBondContact O-CB 3.48Å; L222-K225 PolarHBondContact O-N 3.44Å; L222-L226 HydrophobicContact CD2-CD1 4.03Å; L222-L226 HydrophobicContact CD2-CG 4.34Å; L222-L226 PolarHBondContact O-N 3.4Å
223	L	50.7	Low	48.2	Very low	99 Å²	99	79.5 Å²	79.5	52%	0.518	42%	0.424	S	S	.	.	H	α-helix	trans	-57.6	-26	175.7	-69.8	171.6	0	0	0	113.1	H219 L226	H219-L223 WeakPolarHBondContact O-CB 3.36Å; H219-L223 VanDerWaalsContact O-CG 3.27Å; H219-L223 WeakPolarHBondContact O-CG 3.42Å; H219-L223 PolarHBondContact O-N 2.95Å; L223-L226 HydrophobicContact CD2-CD1 4.26Å
224	R	51.5	Low	49.6	Very low	178 Å²	178	79.9 Å²	79.9	67%	0.672	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-21.7	173	-88.2	-179.6	173.1	176.8	1.8	114.6	H220 L222	H220-R224 WeakPolarHBondContact O-CB 3.48Å; H220-R224 VanDerWaalsContact O-CG 3.25Å; H220-R224 WeakPolarHBondContact O-CG 3.34Å; H220-R224 PolarHBondContact O-N 3.04Å; H220-R224 VanDerWaalsContact O-N 3.16Å; L222-R224 PolarHBondContact O-N 3.46Å; L222-R224 VanDerWaalsContact O-N 3.09Å
225	K	55.5	Low	51.4	Low	134 Å²	134	81.3 Å²	81.3	58%	0.583	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-17.7	177.8	-70.9	-177.3	178.1	-172.3	0	112.4	L222 I760	L222-K225 WeakPolarHBondContact O-CA 3.4Å; L222-K225 WeakPolarHBondContact O-CB 3.48Å; L222-K225 PolarHBondContact O-N 3.44Å; K225-I760 WeakPolarHBondContact O-CG2 3.41Å
226	L	56.3	Low	53.2	Low	17 Å²	17	82.4 Å²	82.4	9%	0.089	43%	0.433	C	S	.	.	S	Bend	trans	-71.3	134.2	172.6	-64.9	-179.4	0	0	0	108.4	F72 I97 L222 L223 T230	F72-L226 HydrophobicContact CB-CD1 3.98Å; F72-L226 HydrophobicContact CB-CD2 4.05Å; F72-L226 HydrophobicContact CD1-CD1 4.17Å; F72-L226 HydrophobicContact CD2-CD2 4.24Å; F72-L226 HydrophobicContact CG-CD1 4.02Å; F72-L226 HydrophobicContact CG-CD2 4.22Å; I97-L226 HydrophobicContact CD1-CD2 3.73Å; I97-L226 HydrophobicContact CG1-CD2 3.79Å; I97-L226 HydrophobicContact CG2-CD2 4.11Å; L222-L226 HydrophobicContact CD2-CD1 4.03Å; L222-L226 HydrophobicContact CD2-CG 4.34Å; L222-L226 PolarHBondContact O-N 3.4Å; L223-L226 HydrophobicContact CD2-CD1 4.26Å; L226-T230 HydrophobicContact CB-CG2 3.9Å; L226-T230 WeakPolarHBondContact CB-OG1 3.37Å; L226-T230 HydrophobicContact CD1-CG2 4.04Å; L226-T230 HydrophobicContact CD2-CG2 3.98Å; L226-T230 HydrophobicContact CG-CG2 4.15Å
227	P	55	Low	55.4	Low	51 Å²	51	79.5 Å²	79.5	33%	0.331	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-50	160.6	170.8	-27	34.3	0	0	0	112.6	P70 D229 T230	P70-P227 HydrophobicContact CB-CG 4.36Å; P70-P227 HydrophobicContact CG-CB 3.5Å; P70-P227 HydrophobicContact CG-CG 3.57Å; P227-D229 PolarHBondContact O-N 3.49Å; P227-T230 VanDerWaalsContact C-OG1 3.29Å; P227-T230 WeakPolarHBondContact CA-OG1 3.5Å; P227-T230 WeakPolarHBondContact CD-OG1 3.4Å; P227-T230 WeakPolarHBondContact O-CB 3.11Å; P227-T230 PolarHBondContact O-N 3.29Å; P227-T230 PolarHBondContact O-OG1 3.15Å
228	K	53.7	Low	57.5	Low	188 Å²	188	75.1 Å²	75.1	82%	0.817	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	142.2	172	-71.6	-174.3	177.6	-177	0	109.1	T230	K228-T230 PolarHBondContact O-N 2.94Å
229	D	56.4	Low	59.5	Low	104 Å²	104	80.6 Å²	80.6	56%	0.556	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	13.2	-179.7	-45	-43.5	0	0	0	114.7	H69 P227 E231	H69-D229 HydrophobicContact CB-CB 3.95Å; H69-D229 WeakPolarHBondContact CB-O 3.3Å; H69-D229 VanDerWaalsContact CE1-CB 3.42Å; H69-D229 WeakPolarHBondContact CE1-CB 3.46Å; H69-D229 IonicContact CE1-OD2 2.86Å; H69-D229 VanDerWaalsContact CG-CB 3.47Å; H69-D229 WeakPolarHBondContact ND1-CB 3.07Å; H69-D229 IonicContact ND1-OD2 3.66Å; P227-D229 PolarHBondContact O-N 3.49Å; D229-E231 WeakPolarHBondContact O-CG 3.46Å; D229-E231 PolarHBondContact O-N 2.56Å
230	T	56.7	Low	61.5	Low	31 Å²	31	77.3 Å²	77.3	19%	0.19	41%	0.41	C	S	.	.			trans	-57.3	134.7	174.9	-54.6	0	0	0	0	111.5	P70 F72 L226 P227 K228	P70-T230 HydrophobicContact CG-CG2 4.43Å; P70-T230 CarbonylContact O-C 3.55Å; P70-T230 WeakPolarHBondContact O-CA 3.41Å; P70-T230 WeakPolarHBondContact O-CG2 3.33Å; F72-T230 HydrophobicContact CB-CG2 3.99Å; L226-T230 HydrophobicContact CB-CG2 3.9Å; L226-T230 WeakPolarHBondContact CB-OG1 3.37Å; L226-T230 HydrophobicContact CD1-CG2 4.04Å; L226-T230 HydrophobicContact CD2-CG2 3.98Å; L226-T230 HydrophobicContact CG-CG2 4.15Å; P227-T230 VanDerWaalsContact C-OG1 3.29Å; P227-T230 WeakPolarHBondContact CA-OG1 3.5Å; P227-T230 WeakPolarHBondContact CD-OG1 3.4Å; P227-T230 WeakPolarHBondContact O-CB 3.11Å; P227-T230 PolarHBondContact O-N 3.29Å; P227-T230 PolarHBondContact O-OG1 3.15Å; K228-T230 PolarHBondContact O-N 2.94Å
231	E	62.9	Low	63.3	Low	11 Å²	11	77.6 Å²	77.6	5%	0.051	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	148	-168.8	-52.9	-165	-140.6	0	0	110.7	H69 P70 L71 F72 D229 L258 I259 D260	H69-E231 HydrophobicContact CB-CG 3.9Å; H69-E231 WeakPolarHBondContact CB-OE1 2.9Å; H69-E231 IonicContact CD2-OE1 3.87Å; H69-E231 PolarHBondContact CD2-OE1 2.91Å; H69-E231 IonicContact CG-OE1 3.22Å; P70-E231 PolarHBondContact O-N 3.24Å; L71-E231 CarbonylContact C-O 3.35Å; L71-E231 HydrophobicContact CD1-CB 4.22Å; F72-E231 PolarHBondContact N-O 3.42Å; D229-E231 WeakPolarHBondContact O-CG 3.46Å; D229-E231 PolarHBondContact O-N 2.56Å; E231-L258 WeakPolarHBondContact CB-O 3.35Å; E231-L258 HydrophobicContact CG-CB 4.17Å; E231-L258 HydrophobicContact CG-CD2 4.27Å; E231-L258 HydrophobicContact CG-CG 4.46Å; E231-L258 WeakPolarHBondContact OE2-CA 3.39Å; E231-L258 WeakPolarHBondContact OE2-CB 3.21Å; E231-L258 VanDerWaalsContact OE2-CG 3.28Å; E231-L258 WeakPolarHBondContact OE2-CG 3.3Å; E231-I259 VanDerWaalsContact CB-CA 3.49Å; E231-I259 VanDerWaalsContact CD-C 3.45Å; E231-I259 WeakPolarHBondContact OE2-CA 3.46Å; E231-I259 PolarHBondContact OE2-N 2.92Å; E231-D260 VanDerWaalsContact OE1-CB 3.24Å; E231-D260 WeakPolarHBondContact OE1-CB 3.31Å; E231-D260 PolarHBondContact OE2-N 2.94Å
232	G	56.7	Low	64.5	Low	45 Å²	45	76.7 Å²	76.7	46%	0.464	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	120	-169.5	0	0	0	0	0	113.6	F72 I259	F72-G232 CarbonylContact O-C 3.54Å; F72-G232 WeakPolarHBondContact O-CA 3.42Å; G232-I259 WeakPolarHBondContact O-CG1 3.28Å
233	A	65.8	Low	65.6	Low	24 Å²	24	77.3 Å²	77.3	20%	0.198	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	147	171.8	0	0	0	0	0	111.7	L71 F72 C73 E74	L71-A233 HydrophobicContact CD1-CB 3.87Å; L71-A233 HydrophobicContact CD2-CB 3.99Å; L71-A233 HydrophobicContact CG-CB 4.15Å; F72-A233 PolarHBondContact O-N 2.84Å; C73-A233 CarbonylContact C-O 3.59Å; C73-A233 VanDerWaalsContact CA-O 3.27Å; C73-A233 WeakPolarHBondContact CA-O 3.47Å; C73-A233 HydrophobicContact CB-CB 4.19Å; E74-A233 PolarHBondContact N-O 3.23Å
234	A	65.3	Low	66.7	Low	68 Å²	68	76.7 Å²	76.7	56%	0.562	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.2	126.7	174.8	0	0	0	0	0	110.3	E74 L76	E74-A234 CarbonylContact O-C 3.56Å; E74-A234 WeakPolarHBondContact O-CA 3.43Å; L76-A234 HydrophobicContact CD1-CB 4.38Å
235	V	74.6	Confident	67.7	Low	64 Å²	64	72.5 Å²	72.5	39%	0.388	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	121.9	176.2	-177.8	0	0	0	0	108	E74 L75 L76 I237	E74-V235 PolarHBondContact O-N 2.68Å; L75-V235 WeakPolarHBondContact CA-O 2.91Å; L75-V235 HydrophobicContact CD1-CB 4.18Å; L75-V235 HydrophobicContact CD1-CG1 3.98Å; L76-V235 PolarHBondContact N-O 3.15Å; V235-I237 HydrophobicContact CG1-CD1 4.09Å; V235-I237 HydrophobicContact CG1-CG1 3.91Å
236	L	72.5	Confident	68.5	Low	56 Å²	56	72.2 Å²	72.2	29%	0.293	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	114.4	-179.7	-65.3	163.4	0	0	0	108.5	L76 W90	L76-L236 HydrophobicContact CB-CD2 3.72Å; L76-L236 HydrophobicContact CD1-CD2 3.8Å; L76-L236 HydrophobicContact CG-CD2 4.4Å; W90-L236 HydrophobicContact CD2-CD2 3.54Å; W90-L236 HydrophobicContact CE3-CB 4.26Å; W90-L236 HydrophobicContact CE3-CD2 3.61Å; W90-L236 HydrophobicContact CG-CD2 3.97Å; W90-L236 HydrophobicContact CH2-CB 3.8Å; W90-L236 HydrophobicContact CH2-CD2 4.4Å; W90-L236 HydrophobicContact CZ2-CB 4.25Å; W90-L236 HydrophobicContact CZ2-CD2 4.34Å; W90-L236 HydrophobicContact CZ3-CB 3.79Å; W90-L236 HydrophobicContact CZ3-CD2 4.04Å
237	I	80.4	Confident	69.4	Low	101 Å²	101	73.3 Å²	73.3	52%	0.518	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	118.7	178.1	-55.7	-176.4	0	0	0	109.6	L75 L76 S77 L78 W90 V235	L75-I237 HydrophobicContact CD1-CB 4.04Å; L75-I237 HydrophobicContact CD1-CD1 3.41Å; L75-I237 VanDerWaalsContact CD1-CD1 3.41Å; L75-I237 HydrophobicContact CD1-CG1 3.5Å; L76-I237 PolarHBondContact O-N 2.91Å; S77-I237 CarbonylContact C-O 3.57Å; S77-I237 VanDerWaalsContact CA-O 3.23Å; S77-I237 WeakPolarHBondContact CA-O 3.41Å; L78-I237 PolarHBondContact N-O 3.49Å; W90-I237 WeakPolarHBondContact CZ3-O 3.24Å; V235-I237 HydrophobicContact CG1-CD1 4.09Å; V235-I237 HydrophobicContact CG1-CG1 3.91Å
238	G	78.3	Confident	70.4	Confident	44 Å²	44	72.5 Å²	72.5	45%	0.454	43%	0.427	S	S	.	.			trans	-145.1	150.5	-178.3	0	0	0	0	0	112	L78	L78-G238 VanDerWaalsContact CB-CA 3.47Å
239	Y	79.6	Confident	71.5	Confident	178 Å²	178	65.3 Å²	65.3	70%	0.698	40%	0.396	S	S	*	.			trans	-108	135	167.6	-178.7	-104.3	0	0	0	108	D241	Y239-D241 WeakPolarHBondContact CE1-OD1 3.47Å
240	I	79.6	Confident	72.6	Confident	23 Å²	23	62.7 Å²	62.7	12%	0.118	38%	0.38	C	S	.	.			trans	-128.2	120	179.4	-60.9	166	0	0	0	106.9	L78 S167 A171 G242 I243	L78-I240 HydrophobicContact CD2-CD1 4.29Å; L78-I240 HydrophobicContact CD2-CG1 3.66Å; S167-I240 WeakPolarHBondContact OG-CG2 3.42Å; A171-I240 HydrophobicContact CB-CD1 3.28Å; A171-I240 HydrophobicContact CB-CG1 4.01Å; I240-G242 PolarHBondContact O-N 3.37Å; I240-I243 HydrophobicContact CB-CD1 3.81Å; I240-I243 HydrophobicContact CB-CG1 4.16Å; I240-I243 HydrophobicContact CD1-CD1 3.9Å; I240-I243 HydrophobicContact CG1-CD1 4.41Å; I240-I243 HydrophobicContact CG2-CD1 4.16Å; I240-I243 HydrophobicContact CG2-CG1 4.17Å
241	D	75.5	Confident	73.4	Confident	104 Å²	104	63.1 Å²	63.1	56%	0.556	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	128.4	174.3	-81.1	-31.8	0	0	0	110.7	Y239	Y239-D241 WeakPolarHBondContact CE1-OD1 3.47Å
242	G	73.6	Confident	73.9	Confident	59 Å²	59	64.2 Å²	64.2	61%	0.608	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.3	-6.6	174.5	0	0	0	0	0	116.2	E164 I240 S244	E164-G242 VanDerWaalsContact CG-O 3.22Å; E164-G242 WeakPolarHBondContact CG-O 3.16Å; I240-G242 PolarHBondContact O-N 3.37Å; G242-S244 PolarHBondContact O-N 2.86Å
243	I	76.9	Confident	74.4	Confident	45 Å²	45	65.3 Å²	65.3	23%	0.231	38%	0.381	C	S	.	.			trans	-77.9	119	172.5	-55.6	-176.4	0	0	0	109.1	A168 I240 R245 L247	A168-I243 HydrophobicContact CB-CD1 4.11Å; I240-I243 HydrophobicContact CB-CD1 3.81Å; I240-I243 HydrophobicContact CB-CG1 4.16Å; I240-I243 HydrophobicContact CD1-CD1 3.9Å; I240-I243 HydrophobicContact CG1-CD1 4.41Å; I240-I243 HydrophobicContact CG2-CD1 4.16Å; I240-I243 HydrophobicContact CG2-CG1 4.17Å; I243-R245 WeakPolarHBondContact CG2-O 3.35Å; I243-R245 PolarHBondContact O-N 3.28Å; I243-L247 HydrophobicContact CD1-CD1 4.38Å; I243-L247 HydrophobicContact CG2-CD1 3.83Å; I243-L247 HydrophobicContact CG2-CG 3.98Å
244	S	74.3	Confident	74.2	Confident	86 Å²	86	70.1 Å²	70.1	60%	0.601	40%	0.397	S	S	*	.	S	Bend	trans	-71.6	-15.7	-170.7	85.6	0	0	0	0	114.4	E164 G242	E164-S244 PolarHBondContact OE2-N 3.09Å; G242-S244 PolarHBondContact O-N 2.86Å
245	R	72.9	Confident	73.5	Confident	89 Å²	89	70.6 Å²	70.6	34%	0.336	40%	0.396	S	S	.	.	S	Bend	trans	-150.1	149.2	-170.9	67.2	-173.8	81.5	-173.2	17.3	111.3	F158 D159 I243 L247	F158-R245 PolarHBondContact O-NH1 3.06Å; F158-R245 PolarHBondContact O-NH2 3.48Å; D159-R245 PolarHBondContact O-NH2 3.12Å; I243-R245 WeakPolarHBondContact CG2-O 3.35Å; I243-R245 PolarHBondContact O-N 3.28Å; R245-L247 HydrophobicContact CG-CD2 3.78Å; R245-L247 PolarHBondContact O-N 3.48Å
246	P	72.4	Confident	72.2	Confident	128 Å²	128	70.6 Å²	70.6	83%	0.831	40%	0.403	S	S	*	.			trans	-65	129.9	175.4	27.2	-33.6	0	0	0	110.5
247	L	75.1	Confident	70.7	Confident	41 Å²	41	74.6 Å²	74.6	22%	0.215	42%	0.424	C	S	.	.			trans	-108.3	121	178.7	-55.2	-179.8	0	0	0	109.4	W154 F158 I160 I243 R245	W154-L247 HydrophobicContact CD2-CB 4.19Å; W154-L247 HydrophobicContact CD2-CD1 4.05Å; W154-L247 HydrophobicContact CE3-CB 4.5Å; W154-L247 HydrophobicContact CE3-CD1 3.81Å; W154-L247 HydrophobicContact CH2-CB 4.27Å; W154-L247 HydrophobicContact CZ2-CB 3.95Å; W154-L247 HydrophobicContact CZ3-CD1 4.15Å; F158-L247 HydrophobicContact CD2-CD2 4.26Å; I160-L247 HydrophobicContact CD1-CD1 3.93Å; I160-L247 HydrophobicContact CD1-CD2 3.31Å; I160-L247 HydrophobicContact CD1-CG 4.27Å; I160-L247 HydrophobicContact CG1-CD2 4.43Å; I243-L247 HydrophobicContact CD1-CD1 4.38Å; I243-L247 HydrophobicContact CG2-CD1 3.83Å; I243-L247 HydrophobicContact CG2-CG 3.98Å; R245-L247 HydrophobicContact CG-CD2 3.78Å; R245-L247 PolarHBondContact O-N 3.48Å
248	A	75.3	Confident	68.3	Low	33 Å²	33	74.3 Å²	74.3	27%	0.273	42%	0.423	S	S	.	.			trans	-125.6	138.3	174.8	0	0	0	0	0	109	A128 C132	A128-A248 HydrophobicContact CB-CB 4.24Å; C132-A248 HydrophobicContact CB-CB 3.79Å
249	H	77.6	Confident	66.3	Low	38 Å²	38	76.5 Å²	76.5	18%	0.176	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	130.7	176.7	-155.3	100.9	0	0	0	108.6	D133 N135 I150 W154 V251	D133-H249 WeakPolarHBondContact O-CA 3.41Å; D133-H249 IonicContact OD2-CE1 2.72Å; D133-H249 PolarHBondContact OD2-CE1 3.41Å; D133-H249 IonicContact OD2-ND1 3.16Å; N135-H249 PolarHBondContact ND2-NE2 2.96Å; I150-H249 HydrophobicContact CG2-CB 4Å; W154-H249 AromaticContact CD1-ND1 3.95Å; W154-H249 HydrophobicContact CZ2-CB 3.91Å; W154-H249 AromaticContact NE1-CG 3.98Å; W154-H249 AromaticContact NE1-ND1 3.61Å; H249-V251 WeakPolarHBondContact CD2-CG2 3.48Å
250	F	78	Confident	64.2	Low	48 Å²	48	69.4 Å²	69.4	21%	0.211	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	126.2	173.8	-178.4	-91.8	0	0	0	109.2	D133 S134 N135 F136 R252 C270 L279	D133-F250 PolarHBondContact O-N 3.21Å; S134-F250 VanDerWaalsContact CA-O 3.32Å; S134-F250 WeakPolarHBondContact CA-O 3.47Å; N135-F250 PolarHBondContact N-O 3.5Å; F136-F250 HydrophobicContact CD1-CD1 4.42Å; F136-F250 HydrophobicContact CD1-CE1 4.04Å; F136-F250 AromaticContact CE1-CD1 3.83Å; F136-F250 HydrophobicContact CE1-CD1 3.83Å; F136-F250 AromaticContact CE1-CE1 3.53Å; F136-F250 HydrophobicContact CE1-CE1 3.53Å; F136-F250 HydrophobicContact CZ-CD1 4.2Å; F136-F250 HydrophobicContact CZ-CE1 4.32Å; F250-R252 HydrophobicContact CE1-CB 4.18Å; F250-C270 HydrophobicContact CZ-CB 4.43Å; F250-L279 HydrophobicContact CB-CD1 4.33Å; F250-L279 HydrophobicContact CD1-CD1 3.58Å; F250-L279 HydrophobicContact CD2-CD1 3.92Å; F250-L279 HydrophobicContact CE1-CD1 3.77Å; F250-L279 HydrophobicContact CE1-CD2 4.29Å; F250-L279 HydrophobicContact CE2-CD1 4.09Å; F250-L279 HydrophobicContact CE2-CD2 4.45Å; F250-L279 HydrophobicContact CG-CD1 3.65Å; F250-L279 HydrophobicContact CZ-CD1 4.02Å; F250-L279 HydrophobicContact CZ-CD2 4.05Å
251	V	73.9	Confident	61.9	Low	41 Å²	41	71.5 Å²	71.5	25%	0.248	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	128.3	175.7	-173.4	0	0	0	0	110.2	N135 F138 L146 I150 H249 L253	N135-V251 WeakPolarHBondContact O-CA 3.34Å; F138-V251 HydrophobicContact CB-CG1 4.08Å; F138-V251 HydrophobicContact CD1-CG1 4.41Å; L146-V251 HydrophobicContact CD1-CB 4.41Å; L146-V251 HydrophobicContact CD1-CG1 3.82Å; L146-V251 HydrophobicContact CD1-CG2 4.2Å; I150-V251 HydrophobicContact CD1-CG2 3.89Å; I150-V251 HydrophobicContact CG1-CG2 4.02Å; H249-V251 WeakPolarHBondContact CD2-CG2 3.48Å; V251-L253 HydrophobicContact CG1-CD2 4.14Å
252	R	73.8	Confident	59.9	Low	34 Å²	34	70.3 Å²	70.3	13%	0.128	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	127.9	163.3	-176.1	-179	75.3	-145.8	4.3	108.7	N135 F136 D137 F138 F250 C270 Y271 A273	N135-R252 PolarHBondContact O-N 3.23Å; F136-R252 HydrophobicContact CD1-CB 4.4Å; D137-R252 WeakPolarHBondContact CA-O 3.43Å; D137-R252 PolarHBondContact N-O 3.3Å; D137-R252 IonicContact OD1-CZ 2.88Å; D137-R252 VanDerWaalsContact OD1-CZ 3.25Å; D137-R252 IonicContact OD1-NE 2.79Å; D137-R252 PolarHBondContact OD1-NE 3.03Å; D137-R252 IonicContact OD1-NH2 3.15Å; D137-R252 PolarHBondContact OD1-NH2 3.34Å; D137-R252 IonicContact OD2-CZ 3.55Å; D137-R252 IonicContact OD2-NH2 3.71Å; D137-R252 PolarHBondContact OD2-NH2 3.43Å; F138-R252 PolarHBondContact N-O 2.88Å; F250-R252 HydrophobicContact CE1-CB 4.18Å; R252-C270 PolarHBondContact NH1-O 3.04Å; R252-Y271 VanDerWaalsContact NH1-C 3.31Å; R252-Y271 PolarHBondContact NH1-O 2.99Å; R252-A273 PolarHBondContact NH1-O 3.31Å; R252-A273 PolarHBondContact NH2-O 3.44Å; R252-A273 VanDerWaalsContact NH2-O 3.12Å
253	L	67.8	Low	58.6	Low	68 Å²	68	69.8 Å²	69.8	36%	0.356	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	147.5	177.8	-60.3	175.5	0	0	0	111.3	F138 V140 L146 V251	F138-L253 HydrophobicContact CB-CD2 4.33Å; F138-L253 CarbonylContact O-C 3.35Å; F138-L253 WeakPolarHBondContact O-CA 3.33Å; F138-L253 WeakPolarHBondContact O-CD2 3.42Å; V140-L253 HydrophobicContact CB-CD2 4.43Å; V140-L253 HydrophobicContact CG2-CD2 3.98Å; L146-L253 HydrophobicContact CD1-CD2 4.47Å; V251-L253 HydrophobicContact CG1-CD2 4.14Å
254	K	60.4	Low	57.1	Low	125 Å²	125	70.8 Å²	70.8	54%	0.543	39%	0.389	S	S	.	.	S	Bend	trans	-71.2	-40.2	-176.8	-168.9	164.2	167.4	-169.3	0	114.3	D137 F138 Q139	D137-K254 HydrophobicContact CB-CB 4Å; D137-K254 HydrophobicContact CB-CD 4.43Å; D137-K254 HydrophobicContact CB-CG 4.03Å; D137-K254 WeakPolarHBondContact O-CB 3.5Å; F138-K254 PolarHBondContact O-N 3.14Å; Q139-K254 HydrophobicContact CG-CB 3.6Å; Q139-K254 HydrophobicContact CG-CD 3.75Å; Q139-K254 HydrophobicContact CG-CG 4.18Å
255	S	50.4	Low	55.7	Low	77 Å²	77	67.1 Å²	67.1	54%	0.538	36%	0.363	S	S	.	.	S	Bend	trans	-104.5	117.8	175.6	42.6	0	0	0	0	106.7	L257	S255-L257 PolarHBondContact O-N 3.37Å
256	A	47.3	Very low	54.7	Low	65 Å²	65	65.6 Å²	65.6	54%	0.537	36%	0.359	S	S	.	.			trans	-59.6	122	-178.3	0	0	0	0	0	110.3	L258	A256-L258 HydrophobicContact CB-CD1 4.1Å
257	L	40.7	Very low	53.9	Low	140 Å²	140	60.6 Å²	60.6	73%	0.733	33%	0.327	S	S	*	.			trans	-78.5	106.9	135.4	-162.4	84.3	0	0	0	102.8	S255 I259	S255-L257 PolarHBondContact O-N 3.37Å; L257-I259 WeakPolarHBondContact O-CG1 3.42Å; L257-I259 PolarHBondContact O-N 3.47Å; L257-I259 VanDerWaalsContact O-N 3.09Å
258	L	31.7	Very low	53	Low	95 Å²	95	60.6 Å²	60.6	50%	0.497	33%	0.325	S	S	.	.			trans	-49.2	117.6	-166.4	-121.2	80.3	0	0	0	111.2	H69 E231 A256	H69-L258 VanDerWaalsContact CD2-CD2 3.46Å; H69-L258 WeakPolarHBondContact CD2-CD2 3.13Å; E231-L258 WeakPolarHBondContact CB-O 3.35Å; E231-L258 HydrophobicContact CG-CB 4.17Å; E231-L258 HydrophobicContact CG-CD2 4.27Å; E231-L258 HydrophobicContact CG-CG 4.46Å; E231-L258 WeakPolarHBondContact OE2-CA 3.39Å; E231-L258 WeakPolarHBondContact OE2-CB 3.21Å; E231-L258 VanDerWaalsContact OE2-CG 3.28Å; E231-L258 WeakPolarHBondContact OE2-CG 3.3Å; A256-L258 HydrophobicContact CB-CD1 4.1Å
259	I	35.4	Very low	52.4	Low	89 Å²	89	59.1 Å²	59.1	46%	0.456	31%	0.313	S	S	.	.			trans	-128.9	114.9	174.4	-68.1	155.7	0	0	0	109	L71 E231 G232 L257	L71-I259 HydrophobicContact CD1-CG2 3.95Å; E231-I259 VanDerWaalsContact CB-CA 3.49Å; E231-I259 VanDerWaalsContact CD-C 3.45Å; E231-I259 WeakPolarHBondContact OE2-CA 3.46Å; E231-I259 PolarHBondContact OE2-N 2.92Å; G232-I259 WeakPolarHBondContact O-CG1 3.28Å; L257-I259 WeakPolarHBondContact O-CG1 3.42Å; L257-I259 PolarHBondContact O-N 3.47Å; L257-I259 VanDerWaalsContact O-N 3.09Å
260	D	36.5	Very low	51.9	Low	29 Å²	29	58.1 Å²	58.1	16%	0.155	31%	0.31	C	S	.	.			trans	-164.7	154.1	168	-121	-17.2	0	0	0	113.7	H69 P70 L71 E231 S267	H69-D260 CarbonylContact O-C 3.55Å; H69-D260 VanDerWaalsContact O-C 3.29Å; P70-D260 CarbonylContact C-O 3.59Å; L71-D260 WeakPolarHBondContact CA-O 3.45Å; L71-D260 WeakPolarHBondContact CB-O 3.22Å; L71-D260 WeakPolarHBondContact CD1-O 3.23Å; L71-D260 PolarHBondContact N-O 3.13Å; E231-D260 VanDerWaalsContact OE1-CB 3.24Å; E231-D260 WeakPolarHBondContact OE1-CB 3.31Å; E231-D260 PolarHBondContact OE2-N 2.94Å; D260-S267 PolarHBondContact OD1-OG 3.31Å
261	D	29.8	Very low	51.2	Low	67 Å²	67	62.7 Å²	62.7	36%	0.358	33%	0.327	S	S	.	.			trans	86.6	65.9	-179	-85.2	-4.7	0	0	0	121.2	H69 L71	H69-D261 VanDerWaalsContact O-CB 3.26Å; H69-D261 WeakPolarHBondContact O-CB 3.23Å; L71-D261 HydrophobicContact CB-CB 4.31Å; L71-D261 WeakPolarHBondContact CB-O 3.46Å
262	L	33.8	Very low	50.8	Low	79 Å²	79	63.6 Å²	63.6	41%	0.414	33%	0.328	S	S	.	.	S	Bend	trans	-129.7	126.8	136.5	-140.2	101.7	0	0	0	109.5	L71	L71-L262 HydrophobicContact CD2-CB 4.06Å
263	L	46.3	Very low	50.8	Low	49 Å²	49	62 Å²	62	26%	0.257	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	93.7	179.3	-79	94.8	0	0	0	115.8	V265 F266 S267 F286 R315	L263-V265 CarbonylContact O-C 3.56Å; L263-V265 PolarHBondContact O-N 2.98Å; L263-F266 HydrophobicContact CB-CB 4.09Å; L263-F266 PolarHBondContact O-N 2.95Å; L263-S267 PolarHBondContact O-N 3.4Å; L263-F286 HydrophobicContact CD1-CE2 4.42Å; L263-F286 HydrophobicContact CD2-CD2 3Å; L263-F286 HydrophobicContact CD2-CE2 3.12Å; L263-F286 HydrophobicContact CD2-CG 3.96Å; L263-F286 HydrophobicContact CD2-CZ 4.13Å; L263-F286 HydrophobicContact CG-CD2 4.46Å; L263-F286 HydrophobicContact CG-CE2 4.36Å; L263-R315 VanDerWaalsContact CD2-NH1 3.26Å
264	E	45.4	Very low	51.1	Low	65 Å²	65	65.4 Å²	65.4	30%	0.304	33%	0.334	S	S	.	.	H	α-helix	trans	-42.9	-29	-178.1	-168.6	-177.6	169.7	0	0	115.2	K268 R319	E264-K268 VanDerWaalsContact CG-NZ 3.28Å; E264-K268 WeakPolarHBondContact O-CB 3.42Å; E264-K268 WeakPolarHBondContact O-CD 3.28Å; E264-K268 WeakPolarHBondContact O-CE 3.14Å; E264-K268 WeakPolarHBondContact O-CG 3.49Å; E264-K268 IonicContact OE1-NZ 2.92Å; E264-K268 PolarHBondContact OE1-NZ 3.4Å; E264-R319 IonicContact OE1-CZ 3.68Å; E264-R319 IonicContact OE1-NE 3.9Å; E264-R319 IonicContact OE1-NH2 3.63Å; E264-R319 PolarHBondContact OE1-NH2 2.99Å; E264-R319 IonicContact OE2-NH2 2.82Å; E264-R319 PolarHBondContact OE2-NH2 3.42Å
265	V	45.7	Very low	51.8	Low	10 Å²	10	62.7 Å²	62.7	6%	0.061	33%	0.325	C	S	.	.	H	α-helix	trans	-91.5	-45.7	177.6	-173.8	0	0	0	0	112.2	I51 L263 K268 V269 E285 I317	I51-V265 HydrophobicContact CG2-CG1 4.34Å; L263-V265 CarbonylContact O-C 3.56Å; L263-V265 PolarHBondContact O-N 2.98Å; V265-K268 PolarHBondContact O-N 2.68Å; V265-V269 VanDerWaalsContact O-CG2 3.32Å; V265-V269 WeakPolarHBondContact O-CG2 3.38Å; V265-V269 PolarHBondContact O-N 3.44Å; V265-E285 HydrophobicContact CG1-CG 4.08Å; V265-I317 WeakPolarHBondContact CG2-O 3.35Å
266	F	51	Low	53.2	Low	56 Å²	56	59.5 Å²	59.5	25%	0.246	30%	0.303	C	S	.	.	H	α-helix	trans	-67.2	-45.9	-178.4	-168.7	-94.2	0	0	0	110.9	L129 L263 K268 V269 C270 A282 A283	L129-F266 HydrophobicContact CD1-CZ 4.38Å; L263-F266 HydrophobicContact CB-CB 4.09Å; L263-F266 PolarHBondContact O-N 2.95Å; F266-K268 PolarHBondContact O-N 3.21Å; F266-V269 PolarHBondContact O-N 3.38Å; F266-C270 WeakPolarHBondContact CD1-SG 3.49Å; F266-C270 WeakPolarHBondContact CE1-SG 3.41Å; F266-C270 PolarHBondContact O-N 2.88Å; F266-C270 PolarHBondContact O-SG 3.47Å; F266-A282 VanDerWaalsContact CD2-C 3.42Å; F266-A282 HydrophobicContact CD2-CB 3.27Å; F266-A282 WeakPolarHBondContact CD2-O 3.46Å; F266-A282 HydrophobicContact CE2-CB 3.52Å; F266-A282 HydrophobicContact CG-CB 4.16Å; F266-A283 HydrophobicContact CE2-CB 4.1Å
267	S	56.6	Low	54.7	Low	23 Å²	23	62.3 Å²	62.3	16%	0.161	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-47.5	176.2	-168.4	0	0	0	0	111.6	D260 L263 V269 C270 Y271	D260-S267 PolarHBondContact OD1-OG 3.31Å; L263-S267 PolarHBondContact O-N 3.4Å; S267-V269 VanDerWaalsContact C-N 3.27Å; S267-V269 PolarHBondContact O-N 3.27Å; S267-C270 CarbonylContact O-C 3.52Å; S267-C270 WeakPolarHBondContact O-CB 3.46Å; S267-C270 PolarHBondContact O-N 3.21Å; S267-Y271 WeakPolarHBondContact O-CB 3.18Å; S267-Y271 PolarHBondContact O-N 2.84Å
268	K	56.7	Low	56.4	Low	41 Å²	41	56.9 Å²	56.9	18%	0.178	28%	0.275	C	S	.	.	H	α-helix	trans	-56.3	-42.2	177.1	-77.8	178.7	-162	172.4	0	112.3	E264 V265 F266 K272	E264-K268 VanDerWaalsContact CG-NZ 3.28Å; E264-K268 WeakPolarHBondContact O-CB 3.42Å; E264-K268 WeakPolarHBondContact O-CD 3.28Å; E264-K268 WeakPolarHBondContact O-CE 3.14Å; E264-K268 WeakPolarHBondContact O-CG 3.49Å; E264-K268 IonicContact OE1-NZ 2.92Å; E264-K268 PolarHBondContact OE1-NZ 3.4Å; V265-K268 PolarHBondContact O-N 2.68Å; F266-K268 PolarHBondContact O-N 3.21Å; K268-K272 WeakPolarHBondContact O-CB 3.33Å; K268-K272 WeakPolarHBondContact O-CG 3.29Å; K268-K272 PolarHBondContact O-N 3.45Å; K268-K272 VanDerWaalsContact O-N 3.15Å
269	V	61.9	Low	58.5	Low	2 Å²	2	52.4 Å²	52.4	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-70.1	-43.1	176.2	180	0	0	0	0	110.4	I51 L54 V265 F266 S267 Y271 K272 A273 D278 A282	I51-V269 HydrophobicContact CG1-CG2 4.42Å; I51-V269 HydrophobicContact CG2-CG2 3.73Å; L54-V269 HydrophobicContact CD2-CG1 4.48Å; V265-V269 VanDerWaalsContact O-CG2 3.32Å; V265-V269 WeakPolarHBondContact O-CG2 3.38Å; V265-V269 PolarHBondContact O-N 3.44Å; F266-V269 PolarHBondContact O-N 3.38Å; S267-V269 VanDerWaalsContact C-N 3.27Å; S267-V269 PolarHBondContact O-N 3.27Å; V269-Y271 VanDerWaalsContact C-N 3.31Å; V269-Y271 PolarHBondContact O-N 3.16Å; V269-K272 CarbonylContact O-C 3.57Å; V269-K272 PolarHBondContact O-N 3.27Å; V269-A273 VanDerWaalsContact O-CA 3.29Å; V269-A273 WeakPolarHBondContact O-CA 3.35Å; V269-A273 WeakPolarHBondContact O-CB 3.46Å; V269-A273 PolarHBondContact O-N 2.94Å; V269-D278 HydrophobicContact CG1-CB 4.01Å; V269-D278 WeakPolarHBondContact CG1-O 3.41Å; V269-A282 HydrophobicContact CB-CB 3.75Å; V269-A282 HydrophobicContact CG1-CB 3.71Å; V269-A282 HydrophobicContact CG2-CB 4.25Å
270	C	66.4	Low	60.6	Low	18 Å²	18	48.9 Å²	48.9	12%	0.122	23%	0.234	C	C	.	.	H	α-helix	trans	-58.7	-40.7	175.2	-67.9	0	0	0	0	113.1	F250 R252 F266 S267 K272 L279	F250-C270 HydrophobicContact CZ-CB 4.43Å; R252-C270 PolarHBondContact NH1-O 3.04Å; F266-C270 WeakPolarHBondContact CD1-SG 3.49Å; F266-C270 WeakPolarHBondContact CE1-SG 3.41Å; F266-C270 PolarHBondContact O-N 2.88Å; F266-C270 PolarHBondContact O-SG 3.47Å; S267-C270 CarbonylContact O-C 3.52Å; S267-C270 WeakPolarHBondContact O-CB 3.46Å; S267-C270 PolarHBondContact O-N 3.21Å; C270-K272 VanDerWaalsContact C-N 3.34Å; C270-L279 HydrophobicContact CB-CD2 4.07Å; C270-L279 VanDerWaalsContact SG-CD2 3.51Å
271	Y	63.2	Low	62.4	Low	144 Å²	144	50.6 Å²	50.6	57%	0.565	24%	0.238	S	C	*	.	H	α-helix	trans	-67.6	-35.2	179.1	-169.2	-90.2	0	0	0	112.1	R252 S267 V269	R252-Y271 VanDerWaalsContact NH1-C 3.31Å; R252-Y271 PolarHBondContact NH1-O 2.99Å; S267-Y271 WeakPolarHBondContact O-CB 3.18Å; S267-Y271 PolarHBondContact O-N 2.84Å; V269-Y271 VanDerWaalsContact C-N 3.31Å; V269-Y271 PolarHBondContact O-N 3.16Å
272	K	66.5	Low	64.4	Low	60 Å²	60	47.5 Å²	47.5	26%	0.261	22%	0.222	S	C	.	.	H	α-helix	trans	-100.8	-9.3	-177.5	-65.3	-173	176.1	-168.1	0	114.5	L54 I55 K268 V269 C270 K274	L54-K272 HydrophobicContact CD2-CB 3.55Å; L54-K272 WeakPolarHBondContact O-CD 3.36Å; I55-K272 PolarHBondContact O-NZ 3Å; K268-K272 WeakPolarHBondContact O-CB 3.33Å; K268-K272 WeakPolarHBondContact O-CG 3.29Å; K268-K272 PolarHBondContact O-N 3.45Å; K268-K272 VanDerWaalsContact O-N 3.15Å; V269-K272 CarbonylContact O-C 3.57Å; V269-K272 PolarHBondContact O-N 3.27Å; C270-K272 VanDerWaalsContact C-N 3.34Å; K272-K274 PolarHBondContact O-N 3.18Å
273	A	72.7	Confident	66.4	Low	0 Å²	0	44 Å²	44	0%	0	21%	0.205	C	C	.	.			trans	-58.4	135.1	-176.2	0	0	0	0	0	109.8	F136 R252 V269 D278 L279	F136-A273 HydrophobicContact CD1-CB 4.39Å; F136-A273 WeakPolarHBondContact CD1-O 3.36Å; F136-A273 HydrophobicContact CE1-CB 3.71Å; F136-A273 HydrophobicContact CZ-CB 4.2Å; R252-A273 PolarHBondContact NH1-O 3.31Å; R252-A273 PolarHBondContact NH2-O 3.44Å; R252-A273 VanDerWaalsContact NH2-O 3.12Å; V269-A273 VanDerWaalsContact O-CA 3.29Å; V269-A273 WeakPolarHBondContact O-CA 3.35Å; V269-A273 WeakPolarHBondContact O-CB 3.46Å; V269-A273 PolarHBondContact O-N 2.94Å; A273-D278 HydrophobicContact CB-CB 3.68Å; A273-L279 HydrophobicContact CB-CD2 3.93Å; A273-L279 HydrophobicContact CB-CG 4.35Å
274	K	75	Confident	67.7	Low	140 Å²	140	43.8 Å²	43.8	61%	0.609	20%	0.204	S	C	*	.	S	Bend	trans	-106.7	-16.4	172.6	-63.7	-176.9	-179.1	179.9	0	110.8	E58 F136 K272 D278	E58-K274 IonicContact OE1-NZ 2.7Å; E58-K274 PolarHBondContact OE1-NZ 3.36Å; F136-K274 WeakPolarHBondContact CD2-O 3.45Å; K272-K274 PolarHBondContact O-N 3.18Å; K274-D278 PolarHBondContact N-OD2 3.33Å
275	D	75.4	Confident	68.8	Low	67 Å²	67	41.4 Å²	41.4	36%	0.358	19%	0.193	S	C	.	.	S	Bend	trans	-138.2	152.3	-178.6	-168.2	-3.5	0	0	0	110.7	F136 K277 D278	F136-D275 VanDerWaalsContact CZ-C 3.49Å; D275-K277 PolarHBondContact O-N 2.79Å; D275-K277 VanDerWaalsContact O-N 3.12Å; D275-K277 WeakPolarHBondContact OD2-CD 3.39Å; D275-K277 IonicContact OD2-NZ 3.84Å; D275-D278 PolarHBondContact N-OD2 3.4Å; D275-D278 WeakPolarHBondContact O-CB 3.37Å; D275-D278 PolarHBondContact O-N 2.9Å
276	C	78.4	Confident	70	Confident	11 Å²	11	43 Å²	43	7%	0.074	20%	0.199	C	C	.	.	H	α-helix	trans	-53.3	-29.3	171.1	-91.5	0	0	0	0	112.6	C132 S134 D278 L279 T280	C132-C276 PolarHBondContact SG-SG 2.71Å; S134-C276 WeakPolarHBondContact CB-SG 3.27Å; S134-C276 PolarHBondContact OG-SG 3.2Å; C276-D278 VanDerWaalsContact C-N 3.25Å; C276-D278 PolarHBondContact O-N 3.35Å; C276-L279 WeakPolarHBondContact O-CB 3.24Å; C276-L279 PolarHBondContact O-N 2.99Å; C276-L279 VanDerWaalsContact O-N 3.12Å; C276-T280 PolarHBondContact O-N 3.39Å
277	K	78.8	Confident	70.9	Confident	123 Å²	123	41.2 Å²	41.2	54%	0.535	19%	0.192	S	C	.	.	H	α-helix	trans	-58.7	-38.5	176	-68.6	177.2	-169.4	143.2	0	112	D275 L279 T280 Y281	D275-K277 PolarHBondContact O-N 2.79Å; D275-K277 VanDerWaalsContact O-N 3.12Å; D275-K277 WeakPolarHBondContact OD2-CD 3.39Å; D275-K277 IonicContact OD2-NZ 3.84Å; K277-L279 VanDerWaalsContact C-N 3.28Å; K277-L279 PolarHBondContact O-N 3.04Å; K277-T280 WeakPolarHBondContact CA-OG1 3.13Å; K277-T280 PolarHBondContact O-N 2.94Å; K277-T280 VanDerWaalsContact O-N 3.15Å; K277-T280 PolarHBondContact O-OG1 3.48Å; K277-Y281 HydrophobicContact CB-CE2 4.14Å; K277-Y281 WeakPolarHBondContact O-CD2 3.5Å; K277-Y281 PolarHBondContact O-N 3.27Å
278	D	77	Confident	71.3	Confident	27 Å²	27	42 Å²	42	14%	0.144	20%	0.197	C	C	.	.	H	α-helix	trans	-62.8	-40	177.5	-57.2	-31.2	0	0	0	110.7	L54 V269 A273 K274 D275 C276 Y281 A282	L54-D278 HydrophobicContact CD1-CB 4.2Å; L54-D278 WeakPolarHBondContact CD1-OD1 3.44Å; L54-D278 WeakPolarHBondContact CD1-OD2 3.49Å; V269-D278 HydrophobicContact CG1-CB 4.01Å; V269-D278 WeakPolarHBondContact CG1-O 3.41Å; A273-D278 HydrophobicContact CB-CB 3.68Å; K274-D278 PolarHBondContact N-OD2 3.33Å; D275-D278 PolarHBondContact N-OD2 3.4Å; D275-D278 WeakPolarHBondContact O-CB 3.37Å; D275-D278 PolarHBondContact O-N 2.9Å; C276-D278 VanDerWaalsContact C-N 3.25Å; C276-D278 PolarHBondContact O-N 3.35Å; D278-Y281 PolarHBondContact O-N 3.3Å; D278-A282 WeakPolarHBondContact O-CB 3.36Å; D278-A282 PolarHBondContact O-N 3.16Å
279	L	76.9	Confident	71.5	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.9	-40.7	174.7	-54.4	177.4	0	0	0	111.7	L129 F136 F250 C270 A273 C276 K277 A282 A283	L129-L279 HydrophobicContact CD1-CB 4.39Å; L129-L279 HydrophobicContact CD2-CD1 4.24Å; F136-L279 HydrophobicContact CE1-CD1 4.12Å; F136-L279 HydrophobicContact CE1-CD2 4.49Å; F136-L279 HydrophobicContact CE1-CG 4.4Å; F136-L279 HydrophobicContact CZ-CD1 3.88Å; F136-L279 HydrophobicContact CZ-CG 4.24Å; F250-L279 HydrophobicContact CB-CD1 4.33Å; F250-L279 HydrophobicContact CD1-CD1 3.58Å; F250-L279 HydrophobicContact CD2-CD1 3.92Å; F250-L279 HydrophobicContact CE1-CD1 3.77Å; F250-L279 HydrophobicContact CE1-CD2 4.29Å; F250-L279 HydrophobicContact CE2-CD1 4.09Å; F250-L279 HydrophobicContact CE2-CD2 4.45Å; F250-L279 HydrophobicContact CG-CD1 3.65Å; F250-L279 HydrophobicContact CZ-CD1 4.02Å; F250-L279 HydrophobicContact CZ-CD2 4.05Å; C270-L279 HydrophobicContact CB-CD2 4.07Å; C270-L279 VanDerWaalsContact SG-CD2 3.51Å; A273-L279 HydrophobicContact CB-CD2 3.93Å; A273-L279 HydrophobicContact CB-CG 4.35Å; C276-L279 WeakPolarHBondContact O-CB 3.24Å; C276-L279 PolarHBondContact O-N 2.99Å; C276-L279 VanDerWaalsContact O-N 3.12Å; K277-L279 VanDerWaalsContact C-N 3.28Å; K277-L279 PolarHBondContact O-N 3.04Å; L279-A282 WeakPolarHBondContact O-CB 3.44Å; L279-A282 PolarHBondContact O-N 3.01Å; L279-A283 PolarHBondContact O-N 3.34Å
280	T	78.6	Confident	71.6	Confident	15 Å²	15	43 Å²	43	9%	0.092	21%	0.205	C	C	.	.	H	α-helix	trans	-66.7	-36.8	176.1	62.8	0	0	0	0	112.5	L129 K130 C276 K277 A283 D284	L129-T280 HydrophobicContact CB-CG2 4.07Å; K130-T280 HydrophobicContact CB-CG2 3.93Å; C276-T280 PolarHBondContact O-N 3.39Å; K277-T280 WeakPolarHBondContact CA-OG1 3.13Å; K277-T280 PolarHBondContact O-N 2.94Å; K277-T280 VanDerWaalsContact O-N 3.15Å; K277-T280 PolarHBondContact O-OG1 3.48Å; T280-A283 PolarHBondContact O-N 3.29Å; T280-D284 PolarHBondContact O-N 3.02Å
281	Y	74.3	Confident	71.5	Confident	66 Å²	66	47.6 Å²	47.6	26%	0.259	23%	0.227	S	C	.	.	H	α-helix	trans	-67.1	-38.6	173.6	-64.2	-43.1	0	0	0	111.7	L47 K277 D278 A283 D284 E285	L47-Y281 HydrophobicContact CD1-CD1 3.68Å; L47-Y281 HydrophobicContact CD1-CE1 4.28Å; L47-Y281 HydrophobicContact CD1-CG 4.45Å; L47-Y281 HydrophobicContact CG-CD1 4.01Å; L47-Y281 HydrophobicContact CG-CG 4.35Å; K277-Y281 HydrophobicContact CB-CE2 4.14Å; K277-Y281 WeakPolarHBondContact O-CD2 3.5Å; K277-Y281 PolarHBondContact O-N 3.27Å; D278-Y281 PolarHBondContact O-N 3.3Å; Y281-A283 VanDerWaalsContact C-N 3.3Å; Y281-A283 PolarHBondContact O-N 3.21Å; Y281-D284 PolarHBondContact O-N 3Å; Y281-E285 WeakPolarHBondContact O-CB 3.38Å; Y281-E285 PolarHBondContact O-N 2.97Å
282	A	72	Confident	71.7	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-39.4	173.2	0	0	0	0	0	111.4	F266 V269 D278 L279 E285 F286	F266-A282 VanDerWaalsContact CD2-C 3.42Å; F266-A282 HydrophobicContact CD2-CB 3.27Å; F266-A282 WeakPolarHBondContact CD2-O 3.46Å; F266-A282 HydrophobicContact CE2-CB 3.52Å; F266-A282 HydrophobicContact CG-CB 4.16Å; V269-A282 HydrophobicContact CB-CB 3.75Å; V269-A282 HydrophobicContact CG1-CB 3.71Å; V269-A282 HydrophobicContact CG2-CB 4.25Å; D278-A282 WeakPolarHBondContact O-CB 3.36Å; D278-A282 PolarHBondContact O-N 3.16Å; L279-A282 WeakPolarHBondContact O-CB 3.44Å; L279-A282 PolarHBondContact O-N 3.01Å; A282-E285 PolarHBondContact O-N 2.98Å; A282-F286 WeakPolarHBondContact O-CB 3.33Å; A282-F286 PolarHBondContact O-N 3.05Å
283	A	75.1	Confident	71.6	Confident	7 Å²	7	43 Å²	43	6%	0.058	21%	0.214	C	C	.	.	H	α-helix	trans	-65.8	-39.7	176.8	0	0	0	0	0	111.4	F266 L279 T280 Y281 F286 I287	F266-A283 HydrophobicContact CE2-CB 4.1Å; L279-A283 PolarHBondContact O-N 3.34Å; T280-A283 PolarHBondContact O-N 3.29Å; Y281-A283 VanDerWaalsContact C-N 3.3Å; Y281-A283 PolarHBondContact O-N 3.21Å; A283-F286 WeakPolarHBondContact O-CB 3.5Å; A283-F286 PolarHBondContact O-N 3.38Å; A283-I287 VanDerWaalsContact O-CG1 3.29Å; A283-I287 WeakPolarHBondContact O-CG1 3.35Å; A283-I287 PolarHBondContact O-N 3.21Å
284	D	74.4	Confident	71.1	Confident	44 Å²	44	46.7 Å²	46.7	24%	0.235	24%	0.238	C	C	.	.	H	α-helix	trans	-63.8	-41.3	173.6	-81	-25.6	0	0	0	112.4	K126 T280 Y281 F286 I287 S288	K126-D284 WeakPolarHBondContact CD-OD1 3.46Å; K126-D284 WeakPolarHBondContact CE-OD1 3.04Å; K126-D284 VanDerWaalsContact CE-OD2 3.29Å; K126-D284 WeakPolarHBondContact CE-OD2 3.11Å; K126-D284 IonicContact NZ-OD1 3.57Å; K126-D284 PolarHBondContact NZ-OD1 2.97Å; K126-D284 IonicContact NZ-OD2 3.77Å; K126-D284 PolarHBondContact NZ-OD2 3.36Å; T280-D284 PolarHBondContact O-N 3.02Å; Y281-D284 PolarHBondContact O-N 3Å; D284-F286 VanDerWaalsContact C-N 3.29Å; D284-F286 PolarHBondContact O-N 3.32Å; D284-I287 PolarHBondContact O-N 3.33Å; D284-S288 WeakPolarHBondContact O-CB 3.27Å; D284-S288 PolarHBondContact O-N 3.29Å
285	E	68.5	Low	70.4	Confident	14 Å²	14	45 Å²	45	7%	0.065	25%	0.251	C	S	.	.	H	α-helix	trans	-66.7	-33.1	174.1	-176.9	59.5	-171.2	0	0	112	I51 V265 Y281 A282 S288 Q289 I317	I51-E285 HydrophobicContact CD1-CB 3.85Å; I51-E285 HydrophobicContact CD1-CG 4.17Å; V265-E285 HydrophobicContact CG1-CG 4.08Å; Y281-E285 WeakPolarHBondContact O-CB 3.38Å; Y281-E285 PolarHBondContact O-N 2.97Å; A282-E285 PolarHBondContact O-N 2.98Å; E285-S288 PolarHBondContact O-OG 3.4Å; E285-S288 PolarHBondContact OE2-OG 3.33Å; E285-Q289 VanDerWaalsContact O-CG 3.28Å; E285-Q289 WeakPolarHBondContact O-CG 3.38Å; E285-Q289 PolarHBondContact O-N 2.86Å; E285-Q289 PolarHBondContact OE1-NE2 3.08Å; E285-I317 WeakPolarHBondContact OE1-CB 3.36Å; E285-I317 WeakPolarHBondContact OE1-CD1 3.46Å; E285-I317 WeakPolarHBondContact OE1-CG2 3.44Å
286	F	69.9	Low	69.8	Low	44 Å²	44	45.9 Å²	45.9	19%	0.193	28%	0.275	C	S	.	.	H	α-helix	trans	-66.6	-45.1	173.1	174.4	-124.1	0	0	0	111.7	L122 L263 A282 A283 D284 S288 Q289 S290	L122-F286 HydrophobicContact CD1-CE1 4.23Å; L122-F286 HydrophobicContact CD2-CD1 3.87Å; L122-F286 HydrophobicContact CD2-CE1 3.62Å; L263-F286 HydrophobicContact CD1-CE2 4.42Å; L263-F286 HydrophobicContact CD2-CD2 3Å; L263-F286 HydrophobicContact CD2-CE2 3.12Å; L263-F286 HydrophobicContact CD2-CG 3.96Å; L263-F286 HydrophobicContact CD2-CZ 4.13Å; L263-F286 HydrophobicContact CG-CD2 4.46Å; L263-F286 HydrophobicContact CG-CE2 4.36Å; A282-F286 WeakPolarHBondContact O-CB 3.33Å; A282-F286 PolarHBondContact O-N 3.05Å; A283-F286 WeakPolarHBondContact O-CB 3.5Å; A283-F286 PolarHBondContact O-N 3.38Å; D284-F286 VanDerWaalsContact C-N 3.29Å; D284-F286 PolarHBondContact O-N 3.32Å; F286-S288 VanDerWaalsContact C-N 3.33Å; F286-S288 PolarHBondContact O-N 3.27Å; F286-Q289 PolarHBondContact O-N 3.15Å; F286-S290 PolarHBondContact O-N 2.64Å
287	I	71.9	Confident	68.9	Low	19 Å²	19	53.6 Å²	53.6	10%	0.097	31%	0.307	C	S	.	.	H	α-helix	trans	-61.4	-43.6	177.5	-69.3	164.1	0	0	0	110.3	M119 L122 A283 D284 Q289 S290	M119-I287 HydrophobicContact CE-CG2 3.88Å; L122-I287 HydrophobicContact CB-CD1 4.34Å; L122-I287 HydrophobicContact CB-CG1 4.33Å; L122-I287 HydrophobicContact CD1-CG1 4.33Å; A283-I287 VanDerWaalsContact O-CG1 3.29Å; A283-I287 WeakPolarHBondContact O-CG1 3.35Å; A283-I287 PolarHBondContact O-N 3.21Å; D284-I287 PolarHBondContact O-N 3.33Å; I287-Q289 PolarHBondContact O-N 3.37Å; I287-S290 PolarHBondContact O-N 2.97Å; I287-S290 VanDerWaalsContact O-N 3.1Å; I287-S290 PolarHBondContact O-OG 3.23Å
288	S	64.9	Low	68	Low	38 Å²	38	53 Å²	53	27%	0.266	30%	0.302	S	S	.	.	H	α-helix	trans	-61.6	-29.7	180	79.7	0	0	0	0	113	D284 E285 F286	D284-S288 WeakPolarHBondContact O-CB 3.27Å; D284-S288 PolarHBondContact O-N 3.29Å; E285-S288 PolarHBondContact O-OG 3.4Å; E285-S288 PolarHBondContact OE2-OG 3.33Å; F286-S288 VanDerWaalsContact C-N 3.33Å; F286-S288 PolarHBondContact O-N 3.27Å
289	Q	60.2	Low	67	Low	40 Å²	40	54.2 Å²	54.2	19%	0.187	31%	0.312	C	S	.	.	H	α-helix	trans	-94.4	-5.9	178.6	-65.2	179.9	4.1	0	0	113.9	E285 F286 I287	E285-Q289 VanDerWaalsContact O-CG 3.28Å; E285-Q289 WeakPolarHBondContact O-CG 3.38Å; E285-Q289 PolarHBondContact O-N 2.86Å; E285-Q289 PolarHBondContact OE1-NE2 3.08Å; F286-Q289 PolarHBondContact O-N 3.15Å; I287-Q289 PolarHBondContact O-N 3.37Å
290	S	64.6	Low	66	Low	26 Å²	26	60.5 Å²	60.5	18%	0.182	35%	0.353	C	S	.	.			trans	-75.9	141.5	-177.7	70.4	0	0	0	0	111.5	F286 I287	F286-S290 PolarHBondContact O-N 2.64Å; I287-S290 PolarHBondContact O-N 2.97Å; I287-S290 VanDerWaalsContact O-N 3.1Å; I287-S290 PolarHBondContact O-OG 3.23Å
291	I	63.8	Low	65.2	Low	114 Å²	114	64.5 Å²	64.5	59%	0.585	38%	0.381	S	S	*	.			trans	-88.4	115.4	175.3	-59.6	173.9	0	0	0	107.4	F27	F27-I291 HydrophobicContact CZ-CG2 4.32Å
292	I	66.5	Low	64.6	Low	55 Å²	55	63.5 Å²	63.5	28%	0.282	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-86.9	126.6	-178.1	-57.7	172.7	0	0	0	109.5	I38 M119	I38-I292 HydrophobicContact CB-CD1 4.49Å; I38-I292 HydrophobicContact CD1-CD1 3.64Å; I38-I292 HydrophobicContact CG1-CD1 4.02Å; M119-I292 HydrophobicContact SD-CG1 4.49Å
293	I	64.7	Low	64.3	Low	53 Å²	53	68.8 Å²	68.8	27%	0.272	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-93.7	127	173	-56.7	174.7	0	0	0	108.3	F27 L116 W298 L304	F27-I293 HydrophobicContact CE1-CG1 4.49Å; L116-I293 HydrophobicContact CD2-CD1 3.8Å; I293-W298 HydrophobicContact CG2-CG 4.32Å; I293-L304 HydrophobicContact CD1-CD1 3.88Å
294	P	63.2	Low	63.7	Low	76 Å²	76	69.5 Å²	69.5	49%	0.494	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-60.3	136	-179.7	-22	31.2	0	0	0	113.1
295	A	60.1	Low	63.1	Low	106 Å²	106	74.9 Å²	74.9	88%	0.876	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	142.9	178.1	0	0	0	0	0	112.4
296	G	63.2	Low	62.7	Low	84 Å²	84	75.2 Å²	75.2	87%	0.866	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	-9	171.7	0	0	0	0	0	116.7
297	K	58.6	Low	61.9	Low	173 Å²	173	76.2 Å²	76.2	75%	0.752	45%	0.45	S	S	*	.	S	Bend	trans	-93.4	-19.6	174.6	-75.8	-171.1	177.9	-176.4	0	114.3
298	W	59.4	Low	61	Low	112 Å²	112	80 Å²	80	42%	0.424	47%	0.471	S	S	.	.	S	Bend	trans	-127.8	133.8	-170.2	-75.6	62.7	0	0	0	110.1	I293 L304	I293-W298 HydrophobicContact CG2-CG 4.32Å; W298-L304 HydrophobicContact CE3-CD2 4.35Å; W298-L304 HydrophobicContact CE3-CG 4.29Å; W298-L304 HydrophobicContact CH2-CD2 3.13Å; W298-L304 HydrophobicContact CH2-CG 3.94Å; W298-L304 HydrophobicContact CZ2-CD2 4.2Å; W298-L304 HydrophobicContact CZ3-CD1 4.2Å; W298-L304 HydrophobicContact CZ3-CD2 3.21Å; W298-L304 HydrophobicContact CZ3-CG 3.46Å; W298-L304 VanDerWaalsContact CZ3-CG 3.46Å
299	S	56	Low	60	Low	51 Å²	51	83.4 Å²	83.4	36%	0.357	49%	0.486	S	S	.	.			trans	-77.3	142	169.8	78.3	0	0	0	0	109.2	S301 S302	S299-S301 PolarHBondContact O-N 3.47Å; S299-S301 VanDerWaalsContact O-N 3.11Å; S299-S301 PolarHBondContact OG-OG 2.88Å; S299-S302 VanDerWaalsContact O-CB 3.23Å; S299-S302 WeakPolarHBondContact O-CB 3.3Å; S299-S302 PolarHBondContact O-N 3.34Å; S299-S302 PolarHBondContact O-OG 3.23Å; S299-S302 PolarHBondContact OG-N 2.66Å; S299-S302 PolarHBondContact OG-OG 3.3Å
300	P	56.6	Low	59	Low	133 Å²	133	84.6 Å²	84.6	86%	0.864	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-23.1	174.8	-24.5	33.7	0	0	0	113.6	S302	P300-S302 VanDerWaalsContact C-N 3.32Å
301	S	60.8	Low	57.8	Low	98 Å²	98	89.1 Å²	89.1	69%	0.685	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-13.7	173.3	42.9	0	0	0	0	114.3	S299 R303	S299-S301 PolarHBondContact O-N 3.47Å; S299-S301 VanDerWaalsContact O-N 3.11Å; S299-S301 PolarHBondContact OG-OG 2.88Å; S301-R303 PolarHBondContact O-N 2.94Å
302	S	61.7	Low	56.6	Low	45 Å²	45	88.4 Å²	88.4	32%	0.315	53%	0.532	S	S	.	.			trans	-75.2	107.4	178.7	-63.8	0	0	0	0	109.9	S299 P300	S299-S302 VanDerWaalsContact O-CB 3.23Å; S299-S302 WeakPolarHBondContact O-CB 3.3Å; S299-S302 PolarHBondContact O-N 3.34Å; S299-S302 PolarHBondContact O-OG 3.23Å; S299-S302 PolarHBondContact OG-N 2.66Å; S299-S302 PolarHBondContact OG-OG 3.3Å; P300-S302 VanDerWaalsContact C-N 3.32Å
303	R	67	Low	55.3	Low	112 Å²	112	91.4 Å²	91.4	42%	0.423	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-84.8	125.2	179.8	-65.9	-178.7	-175.2	147.5	-7.3	110.9	E104 H113 S301	E104-R303 IonicContact OE1-CZ 3.86Å; E104-R303 IonicContact OE1-NH1 3.25Å; E104-R303 PolarHBondContact OE1-NH1 3.03Å; E104-R303 IonicContact OE1-NH2 3.59Å; E104-R303 PolarHBondContact OE1-NH2 3Å; H113-R303 HydrophobicContact CB-CB 3.88Å; H113-R303 HydrophobicContact CB-CG 4.31Å; S301-R303 PolarHBondContact O-N 2.94Å
304	L	62.6	Low	54	Low	23 Å²	23	94.8 Å²	94.8	12%	0.12	57%	0.565	C	S	.	*	P	Polyproline II helix	trans	-80.9	123.6	173.7	-81.4	170.3	0	0	0	110.3	L28 I114 L116 I293 W298	L28-L304 HydrophobicContact CD2-CD2 4.45Å; I114-L304 HydrophobicContact CB-CB 4.05Å; I114-L304 HydrophobicContact CD1-CB 4.15Å; I114-L304 HydrophobicContact CG1-CB 4.35Å; I114-L304 PolarHBondContact N-O 3.42Å; L116-L304 HydrophobicContact CD2-CD1 3.97Å; I293-L304 HydrophobicContact CD1-CD1 3.88Å; W298-L304 HydrophobicContact CE3-CD2 4.35Å; W298-L304 HydrophobicContact CE3-CG 4.29Å; W298-L304 HydrophobicContact CH2-CD2 3.13Å; W298-L304 HydrophobicContact CH2-CG 3.94Å; W298-L304 HydrophobicContact CZ2-CD2 4.2Å; W298-L304 HydrophobicContact CZ3-CD1 4.2Å; W298-L304 HydrophobicContact CZ3-CD2 3.21Å; W298-L304 HydrophobicContact CZ3-CG 3.46Å; W298-L304 VanDerWaalsContact CZ3-CG 3.46Å
305	E	61.1	Low	53	Low	157 Å²	157	95.1 Å²	95.1	73%	0.734	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-73.7	144.5	171	-65	-168.8	165.3	0	0	110.4
306	P	59.3	Low	52.1	Low	20 Å²	20	94.8 Å²	94.8	13%	0.13	54%	0.543	C	S	.	.	P	Polyproline II helix	trans	-62.1	141.6	176.7	24.5	-32.6	0	0	0	112.4	Y99 G764	Y99-P306 HydrophobicContact CD1-CB 4.1Å; Y99-P306 HydrophobicContact CD2-CB 4.49Å; Y99-P306 HydrophobicContact CD2-CG 4.49Å; Y99-P306 HydrophobicContact CE1-CB 3.45Å; Y99-P306 VanDerWaalsContact CE1-CB 3.45Å; Y99-P306 HydrophobicContact CE1-CG 4.34Å; Y99-P306 HydrophobicContact CE2-CB 3.88Å; Y99-P306 HydrophobicContact CE2-CG 4.18Å; Y99-P306 WeakPolarHBondContact OH-CB 3.32Å; P306-G764 WeakPolarHBondContact CG-O 3.22Å
307	A	53.8	Low	51.1	Low	66 Å²	66	93.1 Å²	93.1	55%	0.545	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-66.8	133.2	179.9	0	0	0	0	0	111.9	N309 A310	A307-N309 VanDerWaalsContact C-N 3.26Å; A307-N309 PolarHBondContact O-N 3.36Å; A307-N309 VanDerWaalsContact O-N 3.08Å; A307-A310 HydrophobicContact CB-CB 3.96Å
308	D	52.2	Low	50.4	Low	98 Å²	98	85.2 Å²	85.2	52%	0.524	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.9	-167.1	-88.6	-20.2	0	0	0	116	K766	D308-K766 WeakPolarHBondContact OD1-CE 3.48Å; D308-K766 IonicContact OD1-NZ 2.74Å; D308-K766 PolarHBondContact OD1-NZ 3.45Å; D308-K766 IonicContact OD2-NZ 2.74Å; D308-K766 PolarHBondContact OD2-NZ 3.48Å
309	N	45.2	Very low	49.6	Very low	109 Å²	109	81.1 Å²	81.1	58%	0.583	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-154.4	26.4	-173.4	-75.7	-50.7	0	0	0	113.2	A307 V311	A307-N309 VanDerWaalsContact C-N 3.26Å; A307-N309 PolarHBondContact O-N 3.36Å; A307-N309 VanDerWaalsContact O-N 3.08Å; N309-V311 PolarHBondContact O-N 3.09Å
310	A	39.1	Very low	49	Very low	65 Å²	65	80.9 Å²	80.9	54%	0.537	46%	0.463	S	S	.	.			trans	-67.9	100	178.1	0	0	0	0	0	109.1	A307 P312	A307-A310 HydrophobicContact CB-CB 3.96Å; A310-P312 VanDerWaalsContact O-CD 3.29Å; A310-P312 WeakPolarHBondContact O-CD 3.47Å
311	V	39.4	Very low	48.2	Very low	121 Å²	121	84.5 Å²	84.5	73%	0.733	46%	0.459	S	S	*	.			trans	-51.9	116.5	159.8	179.5	0	0	0	0	104.7	N309 V313	N309-V311 PolarHBondContact O-N 3.09Å; V311-V313 PolarHBondContact O-N 3.43Å
312	P	38.6	Very low	47.3	Very low	100 Å²	100	90 Å²	90	65%	0.649	47%	0.465	S	S	*	.			trans	-57.5	114.7	179.4	21.3	-30	0	0	0	105.9	A310 K314	A310-P312 VanDerWaalsContact O-CD 3.29Å; A310-P312 WeakPolarHBondContact O-CD 3.47Å; P312-K314 VanDerWaalsContact C-N 3.26Å; P312-K314 PolarHBondContact O-N 2.97Å
313	V	38.7	Very low	46.2	Very low	117 Å²	117	91.7 Å²	91.7	71%	0.709	47%	0.468	S	S	*	.			trans	-59.4	102.2	172.1	176.4	0	0	0	0	104.4	V311 R315	V311-V313 PolarHBondContact O-N 3.43Å; V313-R315 PolarHBondContact O-N 2.89Å
314	K	36.9	Very low	44.7	Very low	124 Å²	124	90.8 Å²	90.8	54%	0.539	47%	0.47	S	S	.	.			trans	-63.6	109.5	-176.7	-70.7	-173.8	175	-172	0	106.5	P312 T316	P312-K314 VanDerWaalsContact C-N 3.26Å; P312-K314 PolarHBondContact O-N 2.97Å; K314-T316 PolarHBondContact O-N 3.45Å
315	R	42.5	Very low	43.5	Very low	83 Å²	83	95.2 Å²	95.2	31%	0.313	49%	0.494	S	S	.	.			trans	-53.5	129.1	-177.1	-69.9	156	173.6	-148.2	13.8	109.2	L263 V313	L263-R315 VanDerWaalsContact CD2-NH1 3.26Å; V313-R315 PolarHBondContact O-N 2.89Å
316	T	41.2	Very low	42.6	Very low	99 Å²	99	91.4 Å²	91.4	61%	0.607	49%	0.489	S	S	*	.			trans	-85.9	-19.3	-166.9	30.4	0	0	0	0	114.1	K314	K314-T316 PolarHBondContact O-N 3.45Å
317	I	42.9	Very low	41.3	Very low	49 Å²	49	94.9 Å²	94.9	25%	0.251	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	123.8	-171.2	-59.4	171.9	0	0	0	109.6	A48 V265 E285	A48-I317 HydrophobicContact CB-CG2 3.95Å; V265-I317 WeakPolarHBondContact CG2-O 3.35Å; E285-I317 WeakPolarHBondContact OE1-CB 3.36Å; E285-I317 WeakPolarHBondContact OE1-CD1 3.46Å; E285-I317 WeakPolarHBondContact OE1-CG2 3.44Å
318	G	43.3	Very low	40.1	Very low	7 Å²	7	96.1 Å²	96.1	7%	0.072	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	104.5	-5.2	-174.3	0	0	0	0	0	115.3
319	R	42.5	Very low	39.3	Very low	26 Å²	26	95.9 Å²	95.9	10%	0.098	51%	0.509	C	S	.	.			trans	-87.8	136.3	176	-76.6	-166.3	173.9	149.7	12.1	112.8	E264 Q323 I324	E264-R319 IonicContact OE1-CZ 3.68Å; E264-R319 IonicContact OE1-NE 3.9Å; E264-R319 IonicContact OE1-NH2 3.63Å; E264-R319 PolarHBondContact OE1-NH2 2.99Å; E264-R319 IonicContact OE2-NH2 2.82Å; E264-R319 PolarHBondContact OE2-NH2 3.42Å; R319-Q323 HydrophobicContact CB-CB 4.4Å; R319-I324 HydrophobicContact CB-CG1 4.23Å
320	T	43.7	Very low	38.7	Very low	47 Å²	47	96.4 Å²	96.4	29%	0.288	52%	0.518	S	S	.	.			trans	-56.6	141.1	173.9	-28.7	0	0	0	0	109.7	R322 Q323 I324	T320-R322 HydrophobicContact CG2-CB 4.21Å; T320-R322 PolarHBondContact O-N 3.45Å; T320-Q323 WeakPolarHBondContact O-CA 3.47Å; T320-Q323 WeakPolarHBondContact O-CB 3.34Å; T320-Q323 PolarHBondContact O-N 3.44Å; T320-I324 PolarHBondContact O-N 3.25Å; T320-I324 VanDerWaalsContact O-N 3.12Å
321	R	40.4	Very low	38.3	Very low	209 Å²	209	98.1 Å²	98.1	79%	0.789	53%	0.526	S	S	*	.	H	α-helix	trans	-52.4	-31.9	172.2	-166.6	176	-175.4	178.4	2.2	111.8	I324 L325	R321-I324 PolarHBondContact O-N 3.43Å; R321-L325 HydrophobicContact CG-CD1 4.07Å; R321-L325 WeakPolarHBondContact O-CD1 3.4Å; R321-L325 PolarHBondContact O-N 3.08Å
322	R	40.6	Very low	38.5	Very low	213 Å²	213	99.1 Å²	99.1	80%	0.804	52%	0.52	S	S	*	.	H	α-helix	trans	-63.2	-39.5	170.8	-85.2	-175.8	175.6	170.7	-0.8	113.8	T320 L325 A326	T320-R322 HydrophobicContact CG2-CB 4.21Å; T320-R322 PolarHBondContact O-N 3.45Å; R322-L325 PolarHBondContact O-N 3.35Å; R322-A326 WeakPolarHBondContact O-CB 3.43Å; R322-A326 PolarHBondContact O-N 3.1Å
323	Q	39.3	Very low	38.9	Very low	81 Å²	81	103.6 Å²	103.6	38%	0.379	53%	0.53	S	S	.	.	H	α-helix	trans	-71.6	-34.1	177.2	-70.9	178	-15.4	0	0	112	R319 T320 A326 Q327	R319-Q323 HydrophobicContact CB-CB 4.4Å; T320-Q323 WeakPolarHBondContact O-CA 3.47Å; T320-Q323 WeakPolarHBondContact O-CB 3.34Å; T320-Q323 PolarHBondContact O-N 3.44Å; Q323-A326 PolarHBondContact O-N 2.8Å; Q323-Q327 WeakPolarHBondContact O-CB 3.41Å; Q323-Q327 VanDerWaalsContact O-CG 3.31Å; Q323-Q327 WeakPolarHBondContact O-CG 3.34Å; Q323-Q327 PolarHBondContact O-N 3.27Å
324	I	36	Very low	39.7	Very low	92 Å²	92	102.2 Å²	102.2	47%	0.472	52%	0.521	S	S	.	.	H	α-helix	trans	-65.7	-41.8	173.3	-59.7	172.5	0	0	0	110.3	R319 T320 R321	R319-I324 HydrophobicContact CB-CG1 4.23Å; T320-I324 PolarHBondContact O-N 3.25Å; T320-I324 VanDerWaalsContact O-N 3.12Å; R321-I324 PolarHBondContact O-N 3.43Å
325	L	37.9	Very low	41.2	Very low	116 Å²	116	98 Å²	98	61%	0.607	50%	0.503	S	S	*	.	H	α-helix	trans	-73.9	-32.3	173.9	-92.9	111.6	0	0	0	113.8	R321 R322 Q327 T328	R321-L325 HydrophobicContact CG-CD1 4.07Å; R321-L325 WeakPolarHBondContact O-CD1 3.4Å; R321-L325 PolarHBondContact O-N 3.08Å; R322-L325 PolarHBondContact O-N 3.35Å; L325-Q327 VanDerWaalsContact C-N 3.27Å; L325-Q327 PolarHBondContact O-N 3.32Å; L325-T328 WeakPolarHBondContact O-CB 3.27Å; L325-T328 PolarHBondContact O-N 2.81Å; L325-T328 PolarHBondContact O-OG1 3.11Å
326	A	40.6	Very low	42.4	Very low	78 Å²	78	97.4 Å²	97.4	65%	0.645	50%	0.504	S	S	*	.	H	α-helix	trans	-74	-20.8	176.7	0	0	0	0	0	112.5	R322 Q323 T328	R322-A326 WeakPolarHBondContact O-CB 3.43Å; R322-A326 PolarHBondContact O-N 3.1Å; Q323-A326 PolarHBondContact O-N 2.8Å; A326-T328 VanDerWaalsContact C-N 3.3Å
327	Q	32.1	Very low	44.1	Very low	93 Å²	93	96.4 Å²	96.4	44%	0.435	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	0.9	171.8	-77.8	-177.5	7.5	0	0	114	Q323 L325 P329	Q323-Q327 WeakPolarHBondContact O-CB 3.41Å; Q323-Q327 VanDerWaalsContact O-CG 3.31Å; Q323-Q327 WeakPolarHBondContact O-CG 3.34Å; Q323-Q327 PolarHBondContact O-N 3.27Å; L325-Q327 VanDerWaalsContact C-N 3.27Å; L325-Q327 PolarHBondContact O-N 3.32Å; Q327-P329 WeakPolarHBondContact O-CD 3.43Å
328	T	29.7	Very low	45.8	Very low	92 Å²	92	95.3 Å²	95.3	56%	0.564	49%	0.485	S	S	*	.	S	Bend	trans	-56.8	111.8	152.9	-24.3	0	0	0	0	104.5	L325 A326 P330	L325-T328 WeakPolarHBondContact O-CB 3.27Å; L325-T328 PolarHBondContact O-N 2.81Å; L325-T328 PolarHBondContact O-OG1 3.11Å; A326-T328 VanDerWaalsContact C-N 3.3Å; T328-P330 VanDerWaalsContact O-N 3.15Å
329	P	34	Very low	47.4	Very low	93 Å²	93	97.3 Å²	97.3	60%	0.604	51%	0.506	S	S	*	.			trans	-49.7	131.4	-175.8	19.3	-31.1	0	0	0	106.5	Q327 S331	Q327-P329 WeakPolarHBondContact O-CD 3.43Å; P329-S331 WeakPolarHBondContact O-CA 3.39Å; P329-S331 PolarHBondContact O-N 3.44Å
330	P	33.2	Very low	49.3	Very low	120 Å²	120	102.7 Å²	102.7	78%	0.779	53%	0.526	S	S	*	.	S	Bend	trans	-46.1	111.1	-169	19	-32.5	0	0	0	106.3	T328 K332	T328-P330 VanDerWaalsContact O-N 3.15Å; P330-K332 WeakPolarHBondContact O-CA 3.02Å; P330-K332 PolarHBondContact O-N 3.08Å
331	S	30.6	Very low	51.4	Low	101 Å²	101	106.6 Å²	106.6	71%	0.706	54%	0.544	S	S	*	.			trans	-28.2	100.9	-166.7	154.6	0	0	0	0	108.1	P329 K333	P329-S331 WeakPolarHBondContact O-CA 3.39Å; P329-S331 PolarHBondContact O-N 3.44Å; S331-K333 WeakPolarHBondContact O-CA 3.44Å; S331-K333 PolarHBondContact O-N 3.06Å
332	K	43.8	Very low	53.7	Low	141 Å²	141	100.5 Å²	100.5	61%	0.613	52%	0.523	S	S	*	.			trans	-40.6	112.3	-174.1	-89.3	-176.1	176.2	-178.5	0	105.1	P330 T334	P330-K332 WeakPolarHBondContact O-CA 3.02Å; P330-K332 PolarHBondContact O-N 3.08Å; K332-T334 VanDerWaalsContact C-N 3.25Å; K332-T334 PolarHBondContact O-N 3.39Å; K332-T334 PolarHBondContact O-OG1 3.39Å
333	K	48	Very low	55.8	Low	195 Å²	195	90.7 Å²	90.7	85%	0.848	49%	0.488	S	S	*	.			trans	-56.4	100.2	-172.6	-83.1	-176.2	178.9	176.1	0	105.9	S331 F335	S331-K333 WeakPolarHBondContact O-CA 3.44Å; S331-K333 PolarHBondContact O-N 3.06Å; K333-F335 PolarHBondContact O-N 3.47Å
334	T	55.4	Low	58	Low	87 Å²	87	87 Å²	87	53%	0.534	47%	0.472	S	S	.	.			trans	-75.4	122	-173	-3.2	0	0	0	0	104.1	K332 Q336	K332-T334 VanDerWaalsContact C-N 3.25Å; K332-T334 PolarHBondContact O-N 3.39Å; K332-T334 PolarHBondContact O-OG1 3.39Å; T334-Q336 WeakPolarHBondContact O-CG 3.48Å; T334-Q336 PolarHBondContact O-N 2.81Å
335	F	66.6	Low	60.6	Low	35 Å²	35	84.1 Å²	84.1	15%	0.154	46%	0.457	C	S	.	.			trans	-65.1	107.9	-179.3	-174.4	-129.6	0	0	0	108.2	K333 S476 V477 F716 Y718 H719	K333-F335 PolarHBondContact O-N 3.47Å; F335-S476 WeakPolarHBondContact CE1-O 3.33Å; F335-V477 HydrophobicContact CD1-CB 4.41Å; F335-V477 HydrophobicContact CD1-CG2 4.2Å; F335-V477 VanDerWaalsContact CE1-CA 3.41Å; F335-V477 HydrophobicContact CE1-CB 4.17Å; F335-V477 HydrophobicContact CE1-CG2 3.8Å; F335-V477 HydrophobicContact CE2-CG2 4.47Å; F335-V477 HydrophobicContact CZ-CG2 3.94Å; F335-F716 HydrophobicContact CB-CE2 4.49Å; F335-F716 HydrophobicContact CB-CZ 3.99Å; F335-F716 HydrophobicContact CD2-CD2 4.22Å; F335-F716 AromaticContact CD2-CE2 3.2Å; F335-F716 HydrophobicContact CD2-CE2 3.2Å; F335-F716 AromaticContact CD2-CZ 3.44Å; F335-F716 HydrophobicContact CD2-CZ 3.44Å; F335-F716 VanDerWaalsContact CD2-CZ 3.44Å; F335-F716 HydrophobicContact CE2-CD2 4.23Å; F335-F716 AromaticContact CE2-CE2 3.46Å; F335-F716 HydrophobicContact CE2-CE2 3.46Å; F335-F716 VanDerWaalsContact CE2-CE2 3.46Å; F335-F716 HydrophobicContact CE2-CZ 4.19Å; F335-F716 AromaticContact CG-CE2 4Å; F335-F716 HydrophobicContact CG-CE2 4Å; F335-F716 AromaticContact CG-CZ 4Å; F335-F716 HydrophobicContact CG-CZ 4Å; F335-F716 HydrophobicContact CZ-CE2 4.4Å; F335-Y718 HydrophobicContact CD1-CD2 4.36Å; F335-Y718 HydrophobicContact CD1-CE2 4.49Å; F335-Y718 AromaticContact CE1-CD2 3.81Å; F335-Y718 HydrophobicContact CE1-CD2 3.81Å; F335-Y718 HydrophobicContact CE1-CE2 4.37Å; F335-Y718 HydrophobicContact CE2-CD2 4.41Å; F335-Y718 AromaticContact CZ-CD2 3.85Å; F335-Y718 HydrophobicContact CZ-CD2 3.85Å; F335-H719 AromaticContact CE2-NE2 3.99Å; F335-H719 AromaticContact CZ-CD2 3.87Å; F335-H719 AromaticContact CZ-NE2 3.38Å; F335-H719 WeakPolarHBondContact CZ-NE2 3.44Å
336	Q	68.7	Low	63.1	Low	71 Å²	71	81.8 Å²	81.8	33%	0.332	45%	0.447	S	S	.	.			trans	-122.8	155.2	-173.8	-74.5	178.6	12.1	0	0	109.9	T334	T334-Q336 WeakPolarHBondContact O-CG 3.48Å; T334-Q336 PolarHBondContact O-N 2.81Å
337	R	76.4	Confident	65.3	Low	78 Å²	78	81.8 Å²	81.8	29%	0.294	44%	0.437	S	S	.	.			trans	-64.8	134.9	178	-164.1	174.9	-174.7	-167	0.9	111.6	F473 D474 V913 P916 M917	R337-F473 PolarHBondContact NE-O 3.47Å; R337-F473 PolarHBondContact NH2-O 3.04Å; R337-D474 HydrophobicContact CG-CB 4.03Å; R337-V913 WeakPolarHBondContact CB-O 3.24Å; R337-V913 PolarHBondContact N-O 3.42Å; R337-P916 WeakPolarHBondContact O-CA 3.45Å; R337-M917 PolarHBondContact O-N 3.45Å
338	T	78.2	Confident	68.1	Low	26 Å²	26	77.7 Å²	77.7	16%	0.16	42%	0.418	C	S	.	.			trans	-81.1	-30	179.5	70.2	0	0	0	0	112.1	R340 G343 G344 D347 D474	T338-R340 VanDerWaalsContact C-N 3.27Å; T338-R340 PolarHBondContact O-N 3.39Å; T338-R340 PolarHBondContact OG1-N 2.85Å; T338-G343 VanDerWaalsContact OG1-CA 3.27Å; T338-G343 WeakPolarHBondContact OG1-CA 3.36Å; T338-G344 PolarHBondContact OG1-N 3.33Å; T338-D347 WeakPolarHBondContact CG2-OD2 3.34Å; T338-D474 WeakPolarHBondContact CB-OD2 3.3Å; T338-D474 PolarHBondContact N-OD2 3.31Å; T338-D474 PolarHBondContact OG1-OD2 3.08Å
339	G	77.9	Confident	71	Confident	50 Å²	50	78 Å²	78	52%	0.515	42%	0.415	S	S	.	.			trans	75.7	10.7	-178.7	0	0	0	0	0	114.6
340	R	83.1	Confident	73.6	Confident	139 Å²	139	80.2 Å²	80.2	53%	0.525	42%	0.415	S	S	.	.	S	Bend	trans	-113.7	145.5	174.3	-63.6	176.5	-180	-152.1	-9.8	109	T338 F342 G343 R919	T338-R340 VanDerWaalsContact C-N 3.27Å; T338-R340 PolarHBondContact O-N 3.39Å; T338-R340 PolarHBondContact OG1-N 2.85Å; R340-F342 PolarHBondContact O-N 2.87Å; R340-G343 PolarHBondContact O-N 2.96Å; R340-R919 VanDerWaalsContact NH1-NH2 3.14Å
341	I	86.8	Confident	76.2	Confident	129 Å²	129	77 Å²	77	66%	0.662	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	126	171.7	-50.6	-179.7	0	0	0	107.8	G343 A472	I341-G343 PolarHBondContact O-N 3.3Å; I341-A472 WeakPolarHBondContact CA-O 3.41Å; I341-A472 HydrophobicContact CG2-CB 3.93Å
342	F	88.3	Confident	79	Confident	81 Å²	81	72.7 Å²	72.7	36%	0.355	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	18.8	-172.4	-61.1	-77.5	0	0	0	115.1	R340 L345 V346 V471 A472	R340-F342 PolarHBondContact O-N 2.87Å; F342-L345 HydrophobicContact CD1-CD2 4.04Å; F342-L345 PolarHBondContact O-N 2.98Å; F342-V346 WeakPolarHBondContact O-CG2 3.41Å; F342-V346 PolarHBondContact O-N 2.99Å; F342-V346 VanDerWaalsContact O-N 3.14Å; F342-V471 HydrophobicContact CD1-CG1 3.99Å; F342-V471 HydrophobicContact CE1-CG1 4.28Å; F342-A472 HydrophobicContact CD1-CB 4.33Å; F342-A472 HydrophobicContact CD2-CB 4.41Å; F342-A472 HydrophobicContact CE1-CB 3.99Å; F342-A472 HydrophobicContact CE2-CB 4.06Å; F342-A472 HydrophobicContact CZ-CB 3.85Å; F342-A472 PolarHBondContact N-O 3.26Å
343	G	85.2	Confident	81.1	Confident	7 Å²	7	68.9 Å²	68.9	7%	0.072	36%	0.362	C	S	.	.	H	α-helix	trans	-64	-44.2	-178.9	0	0	0	0	0	112.3	T338 R340 I341 L345 V346 D347	T338-G343 VanDerWaalsContact OG1-CA 3.27Å; T338-G343 WeakPolarHBondContact OG1-CA 3.36Å; R340-G343 PolarHBondContact O-N 2.96Å; I341-G343 PolarHBondContact O-N 3.3Å; G343-L345 VanDerWaalsContact C-N 3.35Å; G343-L345 PolarHBondContact O-N 3.17Å; G343-V346 PolarHBondContact O-N 3.45Å; G343-D347 PolarHBondContact O-N 3.45Å
344	G	86.5	Confident	83	Confident	3 Å²	3	64 Å²	64	3%	0.031	35%	0.351	C	S	.	.	H	α-helix	trans	-60.8	-41	176.8	0	0	0	0	0	113	T338 V346 D347 D348 D474	T338-G344 PolarHBondContact OG1-N 3.33Å; G344-V346 PolarHBondContact O-N 3.38Å; G344-D347 PolarHBondContact O-N 3Å; G344-D348 WeakPolarHBondContact O-CB 3.16Å; G344-D348 PolarHBondContact O-N 3.47Å; G344-D474 WeakPolarHBondContact CA-OD1 3.36Å; G344-D474 PolarHBondContact N-OD1 2.97Å
345	L	90.1	Very high	84.5	Confident	32 Å²	32	65 Å²	65	17%	0.168	35%	0.345	C	S	.	.	H	α-helix	trans	-62.5	-44	176.7	178	61.3	0	0	0	112.4	F342 G343 D347 D348 L349 V471 H719 L720 T723	F342-L345 HydrophobicContact CD1-CD2 4.04Å; F342-L345 PolarHBondContact O-N 2.98Å; G343-L345 VanDerWaalsContact C-N 3.35Å; G343-L345 PolarHBondContact O-N 3.17Å; L345-D347 VanDerWaalsContact C-N 3.33Å; L345-D348 PolarHBondContact O-N 3.15Å; L345-L349 WeakPolarHBondContact O-CB 3.44Å; L345-L349 PolarHBondContact O-N 3.35Å; L345-V471 HydrophobicContact CB-CG1 3.89Å; L345-V471 HydrophobicContact CD2-CG1 4.16Å; L345-V471 HydrophobicContact CG-CG1 4.46Å; L345-H719 HydrophobicContact CB-CB 4.28Å; L345-L720 HydrophobicContact CD1-CB 4.28Å; L345-L720 HydrophobicContact CD1-CD1 4.15Å; L345-T723 WeakPolarHBondContact CD1-OG1 3.47Å; L345-T723 HydrophobicContact CD2-CG2 4.23Å
346	V	89.7	Confident	85.6	Confident	66 Å²	66	67.3 Å²	67.3	40%	0.4	35%	0.353	S	S	.	.	H	α-helix	trans	-67.2	-37.3	-179.8	172.8	0	0	0	0	111.1	F342 G343 G344 K350	F342-V346 WeakPolarHBondContact O-CG2 3.41Å; F342-V346 PolarHBondContact O-N 2.99Å; F342-V346 VanDerWaalsContact O-N 3.14Å; G343-V346 PolarHBondContact O-N 3.45Å; G344-V346 PolarHBondContact O-N 3.38Å; V346-K350 HydrophobicContact CG1-CD 4.06Å; V346-K350 VanDerWaalsContact CG1-CE 3.48Å; V346-K350 WeakPolarHBondContact O-CB 3.5Å; V346-K350 VanDerWaalsContact O-CG 3.26Å; V346-K350 WeakPolarHBondContact O-CG 3.48Å; V346-K350 PolarHBondContact O-N 2.88Å
347	D	87.5	Confident	86.5	Confident	78 Å²	78	69 Å²	69	42%	0.417	37%	0.368	S	S	.	.	H	α-helix	trans	-70.7	-39.9	177.7	-72.4	-14.7	0	0	0	111.4	T338 G343 G344 L345 K350 A351	T338-D347 WeakPolarHBondContact CG2-OD2 3.34Å; G343-D347 PolarHBondContact O-N 3.45Å; G344-D347 PolarHBondContact O-N 3Å; L345-D347 VanDerWaalsContact C-N 3.33Å; D347-K350 PolarHBondContact O-N 3.25Å; D347-A351 VanDerWaalsContact O-CB 3.31Å; D347-A351 WeakPolarHBondContact O-CB 3.42Å; D347-A351 PolarHBondContact O-N 3.38Å
348	D	90.4	Very high	87	Confident	8 Å²	8	66.3 Å²	66.3	4%	0.043	36%	0.361	C	S	.	.	H	α-helix	trans	-59.8	-46.3	172.1	-78	2.5	0	0	0	111.2	G344 L345 A351 K352 G717 Y718 H719 L720	G344-D348 WeakPolarHBondContact O-CB 3.16Å; G344-D348 PolarHBondContact O-N 3.47Å; L345-D348 PolarHBondContact O-N 3.15Å; D348-A351 PolarHBondContact O-N 2.94Å; D348-K352 WeakPolarHBondContact O-CB 3.37Å; D348-K352 WeakPolarHBondContact O-CG 3.45Å; D348-K352 PolarHBondContact O-N 2.78Å; D348-G717 WeakPolarHBondContact OD2-CA 3.11Å; D348-Y718 PolarHBondContact OD2-N 3.36Å; D348-H719 WeakPolarHBondContact OD2-CB 3.46Å; D348-H719 IonicContact OD2-CD2 3.03Å; D348-H719 IonicContact OD2-CG 2.73Å; D348-H719 PolarHBondContact OD2-N 3.41Å; D348-L720 HydrophobicContact CB-CB 4.24Å; D348-L720 PolarHBondContact OD2-N 2.86Å
349	L	90.4	Very high	87.4	Confident	98 Å²	98	65.2 Å²	65.2	51%	0.513	36%	0.355	S	S	.	.	H	α-helix	trans	-64.1	-43.6	179.2	-173.7	64.4	0	0	0	111.6	L345 A351 K352 A353	L345-L349 WeakPolarHBondContact O-CB 3.44Å; L345-L349 PolarHBondContact O-N 3.35Å; L349-A351 VanDerWaalsContact C-N 3.31Å; L349-A351 PolarHBondContact O-N 3.33Å; L349-K352 PolarHBondContact O-N 3Å; L349-A353 WeakPolarHBondContact O-CB 3.13Å; L349-A353 PolarHBondContact O-N 3.1Å
350	K	89.8	Confident	87.9	Confident	139 Å²	139	65.6 Å²	65.6	60%	0.604	34%	0.342	S	S	*	.	H	α-helix	trans	-64.7	-36.6	176.5	-76	171.2	-176.9	168.2	0	112.4	V346 D347 P354	V346-K350 HydrophobicContact CG1-CD 4.06Å; V346-K350 VanDerWaalsContact CG1-CE 3.48Å; V346-K350 WeakPolarHBondContact O-CB 3.5Å; V346-K350 VanDerWaalsContact O-CG 3.26Å; V346-K350 WeakPolarHBondContact O-CG 3.48Å; V346-K350 PolarHBondContact O-N 2.88Å; D347-K350 PolarHBondContact O-N 3.25Å; K350-P354 WeakPolarHBondContact O-CD 3.28Å
351	A	86.6	Confident	88.1	Confident	53 Å²	53	61.4 Å²	61.4	44%	0.438	33%	0.332	S	S	.	.	H	α-helix	trans	-68.5	-38.6	177.4	0	0	0	0	0	111.6	D347 D348 L349 W355	D347-A351 VanDerWaalsContact O-CB 3.31Å; D347-A351 WeakPolarHBondContact O-CB 3.42Å; D347-A351 PolarHBondContact O-N 3.38Å; D348-A351 PolarHBondContact O-N 2.94Å; L349-A351 VanDerWaalsContact C-N 3.31Å; L349-A351 PolarHBondContact O-N 3.33Å; A351-W355 VanDerWaalsContact O-CD1 3.27Å
352	K	89.1	Confident	88	Confident	10 Å²	10	58 Å²	58	4%	0.043	32%	0.315	C	S	.	.	H	α-helix	trans	-89.6	-29.8	-175	-70.1	-69.3	-176.5	173.7	0	115	D348 L349 P354 W355 Y356 G422 K714 G715 F716	D348-K352 WeakPolarHBondContact O-CB 3.37Å; D348-K352 WeakPolarHBondContact O-CG 3.45Å; D348-K352 PolarHBondContact O-N 2.78Å; L349-K352 PolarHBondContact O-N 3Å; K352-P354 VanDerWaalsContact C-CD 3.47Å; K352-W355 PolarHBondContact O-N 3.18Å; K352-Y356 PolarHBondContact O-N 3.46Å; K352-G422 WeakPolarHBondContact CE-O 3.25Å; K352-G422 PolarHBondContact NZ-O 3.27Å; K352-K714 VanDerWaalsContact CE-O 3.27Å; K352-K714 WeakPolarHBondContact CE-O 3.17Å; K352-K714 PolarHBondContact NZ-O 3.1Å; K352-G715 WeakPolarHBondContact CE-O 3.42Å; K352-G715 PolarHBondContact NZ-O 2.92Å; K352-F716 WeakPolarHBondContact CE-O 3.33Å
353	A	87.8	Confident	87.8	Confident	61 Å²	61	54.1 Å²	54.1	50%	0.504	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-48	-47.5	-178.6	0	0	0	0	0	115.2	L349 W355 Y356	L349-A353 WeakPolarHBondContact O-CB 3.13Å; L349-A353 PolarHBondContact O-N 3.1Å; A353-W355 PolarHBondContact O-N 3.34Å; A353-Y356 PolarHBondContact O-N 3.48Å
354	P	87.8	Confident	87.7	Confident	93 Å²	93	59 Å²	59	60%	0.604	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-68	-23.4	-179.3	26.4	-34.6	0	0	0	113.5	K350 K352	K350-P354 WeakPolarHBondContact O-CD 3.28Å; K352-P354 VanDerWaalsContact C-CD 3.47Å
355	W	87.2	Confident	87.2	Confident	107 Å²	107	67.5 Å²	67.5	41%	0.405	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-89.1	-7.6	-178.6	-59.6	100.6	0	0	0	113.6	A351 K352 A353 V357 S358 D359 K714	A351-W355 VanDerWaalsContact O-CD1 3.27Å; K352-W355 PolarHBondContact O-N 3.18Å; A353-W355 PolarHBondContact O-N 3.34Å; W355-V357 VanDerWaalsContact C-N 3.34Å; W355-V357 PolarHBondContact O-N 3.45Å; W355-S358 WeakPolarHBondContact CA-OG 3.28Å; W355-S358 PolarHBondContact O-N 3.22Å; W355-S358 VanDerWaalsContact O-N 3.12Å; W355-S358 PolarHBondContact O-OG 3.13Å; W355-D359 VanDerWaalsContact O-CG 3.32Å; W355-D359 PolarHBondContact O-N 3.5Å; W355-K714 HydrophobicContact CB-CD 4.2Å; W355-K714 HydrophobicContact CB-CG 4.43Å; W355-K714 HydrophobicContact CD2-CB 4.48Å; W355-K714 HydrophobicContact CD2-CG 4.07Å; W355-K714 HydrophobicContact CE3-CD 4.31Å; W355-K714 HydrophobicContact CE3-CG 3.98Å; W355-K714 HydrophobicContact CG-CB 4.29Å; W355-K714 HydrophobicContact CG-CG 4.25Å
356	Y	89.7	Confident	86.4	Confident	85 Å²	85	69.8 Å²	69.8	33%	0.333	38%	0.384	S	S	.	.	H	α-helix	trans	-60.7	-41.7	-174.2	-170.8	-98.4	0	0	0	113	K352 A353 D359 F360 L419	K352-Y356 PolarHBondContact O-N 3.46Å; A353-Y356 PolarHBondContact O-N 3.48Å; Y356-D359 PolarHBondContact O-N 3.27Å; Y356-F360 HydrophobicContact CD1-CE2 4.45Å; Y356-F360 AromaticContact CE1-CE2 3.85Å; Y356-F360 HydrophobicContact CE1-CE2 3.85Å; Y356-F360 HydrophobicContact CE2-CE2 4.37Å; Y356-F360 AromaticContact CZ-CE2 3.8Å; Y356-F360 WeakPolarHBondContact O-CD2 3.32Å; Y356-L419 WeakPolarHBondContact CE2-O 3.43Å; Y356-L419 PolarHBondContact OH-O 3.01Å
357	V	87.5	Confident	85.8	Confident	105 Å²	105	68.9 Å²	68.9	64%	0.636	37%	0.374	S	S	*	.	H	α-helix	trans	-72.7	-33.7	177.8	-177.5	0	0	0	0	111.2	W355 D359 F360 T361	W355-V357 VanDerWaalsContact C-N 3.34Å; W355-V357 PolarHBondContact O-N 3.45Å; V357-D359 VanDerWaalsContact C-N 3.32Å; V357-D359 PolarHBondContact O-N 3.49Å; V357-F360 PolarHBondContact O-N 3.08Å; V357-T361 PolarHBondContact O-N 2.97Å; V357-T361 PolarHBondContact O-OG1 3.33Å; V357-T361 VanDerWaalsContact O-OG1 3.11Å
358	S	86.7	Confident	85.7	Confident	23 Å²	23	68.7 Å²	68.7	16%	0.161	37%	0.373	C	S	.	.	H	α-helix	trans	-68.8	-30	175.3	59	0	0	0	0	112.2	W355 F360 T361 D362	W355-S358 WeakPolarHBondContact CA-OG 3.28Å; W355-S358 PolarHBondContact O-N 3.22Å; W355-S358 VanDerWaalsContact O-N 3.12Å; W355-S358 PolarHBondContact O-OG 3.13Å; S358-F360 VanDerWaalsContact C-N 3.26Å; S358-F360 PolarHBondContact O-N 3.23Å; S358-T361 WeakPolarHBondContact CA-OG1 3.28Å; S358-T361 PolarHBondContact O-N 3.01Å; S358-T361 PolarHBondContact O-OG1 3.09Å; S358-D362 WeakPolarHBondContact O-CA 3.2Å; S358-D362 WeakPolarHBondContact O-CB 3.28Å; S358-D362 PolarHBondContact O-N 3.3Å; S358-D362 VanDerWaalsContact O-OD2 3.13Å
359	D	86.9	Confident	85.4	Confident	3 Å²	3	70.6 Å²	70.6	2%	0.016	39%	0.385	C	S	.	.	H	α-helix	trans	-58.3	-33.5	176.2	-69.5	-16.4	0	0	0	114.3	W355 Y356 V357 K714 Q775 R776	W355-D359 VanDerWaalsContact O-CG 3.32Å; W355-D359 PolarHBondContact O-N 3.5Å; Y356-D359 PolarHBondContact O-N 3.27Å; V357-D359 VanDerWaalsContact C-N 3.32Å; V357-D359 PolarHBondContact O-N 3.49Å; D359-K714 WeakPolarHBondContact OD1-CD 3.22Å; D359-K714 WeakPolarHBondContact OD1-CE 3.02Å; D359-K714 IonicContact OD1-NZ 3.29Å; D359-K714 PolarHBondContact OD1-NZ 3.47Å; D359-Q775 WeakPolarHBondContact O-CA 3.33Å; D359-Q775 WeakPolarHBondContact O-CB 3.24Å; D359-R776 HydrophobicContact CB-CB 4.48Å; D359-R776 HydrophobicContact CB-CG 3.92Å; D359-R776 PolarHBondContact O-N 2.99Å; D359-R776 IonicContact OD2-CZ 3.31Å; D359-R776 VanDerWaalsContact OD2-CZ 3.29Å; D359-R776 IonicContact OD2-NE 3.5Å; D359-R776 PolarHBondContact OD2-NE 2.92Å; D359-R776 IonicContact OD2-NH2 2.68Å; D359-R776 PolarHBondContact OD2-NH2 3.47Å
360	F	89.9	Confident	85.3	Confident	57 Å²	57	66.3 Å²	66.3	25%	0.25	36%	0.362	C	S	.	.	H	α-helix	trans	-84.5	-43.3	175.5	-69.2	-84.5	0	0	0	111.8	Y356 V357 S358 G363 L364 L419 R776 V777 L780	Y356-F360 HydrophobicContact CD1-CE2 4.45Å; Y356-F360 AromaticContact CE1-CE2 3.85Å; Y356-F360 HydrophobicContact CE1-CE2 3.85Å; Y356-F360 HydrophobicContact CE2-CE2 4.37Å; Y356-F360 AromaticContact CZ-CE2 3.8Å; Y356-F360 WeakPolarHBondContact O-CD2 3.32Å; V357-F360 PolarHBondContact O-N 3.08Å; S358-F360 VanDerWaalsContact C-N 3.26Å; S358-F360 PolarHBondContact O-N 3.23Å; F360-G363 PolarHBondContact O-N 3.4Å; F360-L364 WeakPolarHBondContact O-CG 3.34Å; F360-L364 PolarHBondContact O-N 2.93Å; F360-L419 HydrophobicContact CZ-CD2 4.26Å; F360-R776 HydrophobicContact CE1-CB 4.27Å; F360-R776 HydrophobicContact CZ-CB 4.15Å; F360-V777 HydrophobicContact CD1-CG2 4Å; F360-L780 HydrophobicContact CE1-CD2 4.07Å
361	T	87.3	Confident	85.3	Confident	52 Å²	52	59.8 Å²	59.8	32%	0.319	33%	0.334	S	S	.	.	H	α-helix	trans	-71.9	-38.6	-177.3	56	0	0	0	0	112.5	V357 S358 G363 L364 R365	V357-T361 PolarHBondContact O-N 2.97Å; V357-T361 PolarHBondContact O-OG1 3.33Å; V357-T361 VanDerWaalsContact O-OG1 3.11Å; S358-T361 WeakPolarHBondContact CA-OG1 3.28Å; S358-T361 PolarHBondContact O-N 3.01Å; S358-T361 PolarHBondContact O-OG1 3.09Å; T361-G363 PolarHBondContact O-N 3.18Å; T361-L364 PolarHBondContact O-N 3.38Å; T361-R365 VanDerWaalsContact O-CB 3.24Å; T361-R365 WeakPolarHBondContact O-CB 3.41Å; T361-R365 VanDerWaalsContact O-CG 3.22Å; T361-R365 WeakPolarHBondContact O-CG 3.35Å; T361-R365 PolarHBondContact O-N 3.01Å
362	D	84.9	Confident	85.5	Confident	56 Å²	56	60.7 Å²	60.7	30%	0.299	33%	0.33	S	S	.	.	H	α-helix	trans	-61.8	-38	172.5	-66.4	-23.7	0	0	0	110.3	S358 L364 R365 K714 K773	S358-D362 WeakPolarHBondContact O-CA 3.2Å; S358-D362 WeakPolarHBondContact O-CB 3.28Å; S358-D362 PolarHBondContact O-N 3.3Å; S358-D362 VanDerWaalsContact O-OD2 3.13Å; D362-L364 VanDerWaalsContact C-N 3.31Å; D362-L364 PolarHBondContact O-N 3.23Å; D362-R365 PolarHBondContact O-N 2.93Å; D362-R365 VanDerWaalsContact O-O 3.07Å; D362-K714 WeakPolarHBondContact OD2-CE 3.42Å; D362-K714 IonicContact OD2-NZ 3.13Å; D362-K714 PolarHBondContact OD2-NZ 3.13Å; D362-K773 WeakPolarHBondContact O-CE 3.45Å; D362-K773 PolarHBondContact O-NZ 2.86Å
363	G	82.2	Confident	85.5	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-63.6	-37	178.2	0	0	0	0	0	113.8	F360 T361 T371 K773 Q775	F360-G363 PolarHBondContact O-N 3.4Å; T361-G363 PolarHBondContact O-N 3.18Å; G363-T371 PolarHBondContact O-OG1 2.93Å; G363-K773 PolarHBondContact O-NZ 3Å; G363-Q775 PolarHBondContact O-OE1 3.2Å
364	L	83.8	Confident	85.6	Confident	111 Å²	111	57.7 Å²	57.7	58%	0.581	31%	0.307	S	S	*	.	H	α-helix	trans	-84.9	-25.7	176.9	-63.7	173.5	0	0	0	113.5	F360 T361 D362 L368	F360-L364 WeakPolarHBondContact O-CG 3.34Å; F360-L364 PolarHBondContact O-N 2.93Å; T361-L364 PolarHBondContact O-N 3.38Å; D362-L364 VanDerWaalsContact C-N 3.31Å; D362-L364 PolarHBondContact O-N 3.23Å; L364-L368 HydrophobicContact CD2-CD1 4.05Å
365	R	76.4	Confident	85.8	Confident	180 Å²	180	53.3 Å²	53.3	68%	0.679	28%	0.279	S	S	*	.	S	Bend	trans	-80.8	152	177.9	-76.2	175.2	174.6	-167.6	-1.3	111.8	T361 D362 K773	T361-R365 VanDerWaalsContact O-CB 3.24Å; T361-R365 WeakPolarHBondContact O-CB 3.41Å; T361-R365 VanDerWaalsContact O-CG 3.22Å; T361-R365 WeakPolarHBondContact O-CG 3.35Å; T361-R365 PolarHBondContact O-N 3.01Å; D362-R365 PolarHBondContact O-N 2.93Å; D362-R365 VanDerWaalsContact O-O 3.07Å; R365-K773 WeakPolarHBondContact O-CE 3.37Å; R365-K773 PolarHBondContact O-NZ 3.48Å
366	G	73.8	Confident	85.9	Confident	80 Å²	80	50.5 Å²	50.5	83%	0.825	27%	0.271	S	S	*	.	S	Bend	trans	78	-132.4	179.3	0	0	0	0	0	113.4	L368	G366-L368 PolarHBondContact O-N 2.88Å; G366-L368 VanDerWaalsContact O-N 3.11Å
367	R	77.4	Confident	85.7	Confident	48 Å²	48	47.1 Å²	47.1	18%	0.181	26%	0.258	C	S	.	.			trans	-79.8	88.2	179.9	-63.2	-169.7	-148.3	149.5	13.6	111.2	T369 Q370 E759	R367-T369 PolarHBondContact O-N 3.42Å; R367-Q370 HydrophobicContact CB-CB 4.28Å; R367-Q370 PolarHBondContact O-N 3.48Å; R367-E759 IonicContact CZ-OE1 3.33Å; R367-E759 IonicContact NE-OE1 3.67Å; R367-E759 PolarHBondContact NE-OE1 3.45Å; R367-E759 IonicContact NH2-OE1 2.66Å; R367-E759 PolarHBondContact NH2-OE1 3.44Å
368	L	84.2	Confident	85.8	Confident	74 Å²	74	42.1 Å²	42.1	39%	0.387	23%	0.228	S	C	.	.	H	α-helix	trans	-63.1	-31.1	174.6	-174.8	65.9	0	0	0	112.2	L364 G366 Q370 T371 I372	L364-L368 HydrophobicContact CD2-CD1 4.05Å; G366-L368 PolarHBondContact O-N 2.88Å; G366-L368 VanDerWaalsContact O-N 3.11Å; L368-Q370 VanDerWaalsContact C-N 3.31Å; L368-Q370 PolarHBondContact O-N 3.45Å; L368-T371 WeakPolarHBondContact O-CB 3.44Å; L368-T371 PolarHBondContact O-N 2.85Å; L368-T371 VanDerWaalsContact O-N 3.16Å; L368-I372 HydrophobicContact CD1-CD1 4.47Å; L368-I372 HydrophobicContact CD1-CG1 4.49Å; L368-I372 HydrophobicContact CD2-CD1 4.13Å; L368-I372 HydrophobicContact CG-CD1 3.82Å; L368-I372 HydrophobicContact CG-CG1 4.25Å; L368-I372 WeakPolarHBondContact O-CG1 3.21Å; L368-I372 PolarHBondContact O-N 3.44Å
369	T	84.9	Confident	86	Confident	48 Å²	48	41.5 Å²	41.5	29%	0.294	22%	0.222	S	C	.	.	H	α-helix	trans	-58	-41.8	179.3	53.1	0	0	0	0	112.4	R367 I372 A373 V607 D610	R367-T369 PolarHBondContact O-N 3.42Å; T369-I372 PolarHBondContact O-N 3.24Å; T369-A373 WeakPolarHBondContact O-CB 3.22Å; T369-A373 PolarHBondContact O-N 2.97Å; T369-V607 HydrophobicContact CG2-CG2 4.02Å; T369-D610 PolarHBondContact OG1-OD2 3.42Å
370	Q	87.4	Confident	85.9	Confident	8 Å²	8	42.4 Å²	42.4	4%	0.037	23%	0.227	C	C	.	.	H	α-helix	trans	-64	-45	176.2	-175.9	177.5	12.3	0	0	111.7	R367 L368 I372 A373 A374 S753 R755	R367-Q370 HydrophobicContact CB-CB 4.28Å; R367-Q370 PolarHBondContact O-N 3.48Å; L368-Q370 VanDerWaalsContact C-N 3.31Å; L368-Q370 PolarHBondContact O-N 3.45Å; Q370-I372 PolarHBondContact O-N 3.4Å; Q370-A373 PolarHBondContact O-N 3.46Å; Q370-A374 VanDerWaalsContact O-CB 3.28Å; Q370-A374 WeakPolarHBondContact O-CB 3.38Å; Q370-A374 PolarHBondContact O-N 3.47Å; Q370-S753 PolarHBondContact NE2-O 2.87Å; Q370-R755 PolarHBondContact NE2-O 3.45Å
371	T	90.3	Very high	85.5	Confident	2 Å²	2	40 Å²	40	1%	0.012	22%	0.217	C	C	.	.	H	α-helix	trans	-60.5	-44.8	177.3	-66.6	0	0	0	0	111.4	G363 L368 A375 K773 Q775 V777 T778	G363-T371 PolarHBondContact O-OG1 2.93Å; L368-T371 WeakPolarHBondContact O-CB 3.44Å; L368-T371 PolarHBondContact O-N 2.85Å; L368-T371 VanDerWaalsContact O-N 3.16Å; T371-A375 WeakPolarHBondContact O-CB 3.48Å; T371-A375 PolarHBondContact O-N 3.39Å; T371-K773 PolarHBondContact OG1-NZ 2.61Å; T371-Q775 PolarHBondContact OG1-NE2 3.43Å; T371-Q775 PolarHBondContact OG1-OE1 3.15Å; T371-V777 HydrophobicContact CG2-CB 4.46Å; T371-V777 HydrophobicContact CG2-CG1 4.2Å; T371-T778 HydrophobicContact CG2-CG2 3.8Å; T371-T778 WeakPolarHBondContact O-CG2 3.3Å
372	I	90.6	Very high	85.5	Confident	72 Å²	72	37.5 Å²	37.5	37%	0.369	20%	0.202	S	C	.	.	H	α-helix	trans	-66.8	-45.5	179.2	-66.4	170.9	0	0	0	110.9	L368 T369 Q370 A374 A375 I376 F611	L368-I372 HydrophobicContact CD1-CD1 4.47Å; L368-I372 HydrophobicContact CD1-CG1 4.49Å; L368-I372 HydrophobicContact CD2-CD1 4.13Å; L368-I372 HydrophobicContact CG-CD1 3.82Å; L368-I372 HydrophobicContact CG-CG1 4.25Å; L368-I372 WeakPolarHBondContact O-CG1 3.21Å; L368-I372 PolarHBondContact O-N 3.44Å; T369-I372 PolarHBondContact O-N 3.24Å; Q370-I372 PolarHBondContact O-N 3.4Å; I372-A374 VanDerWaalsContact C-N 3.35Å; I372-A374 PolarHBondContact O-N 2.94Å; I372-A375 PolarHBondContact O-N 2.69Å; I372-I376 HydrophobicContact CG2-CD1 3.83Å; I372-I376 HydrophobicContact CG2-CG1 4.5Å; I372-I376 WeakPolarHBondContact O-CG1 3.46Å; I372-I376 PolarHBondContact O-N 3.43Å; I372-F611 HydrophobicContact CB-CZ 4.41Å; I372-F611 HydrophobicContact CG2-CE1 4.4Å; I372-F611 HydrophobicContact CG2-CZ 4.11Å
373	A	89	Confident	85.6	Confident	5 Å²	5	35 Å²	35	4%	0.041	19%	0.188	C	C	.	.	H	α-helix	trans	-59.5	-45.7	177.9	0	0	0	0	0	111.6	T369 Q370 A375 I376 F377 D610 F611	T369-A373 WeakPolarHBondContact O-CB 3.22Å; T369-A373 PolarHBondContact O-N 2.97Å; Q370-A373 PolarHBondContact O-N 3.46Å; A373-A375 PolarHBondContact O-N 3.36Å; A373-I376 PolarHBondContact O-N 3.49Å; A373-F377 VanDerWaalsContact O-CB 3.28Å; A373-F377 WeakPolarHBondContact O-CB 3.36Å; A373-F377 PolarHBondContact O-N 2.97Å; A373-D610 WeakPolarHBondContact CB-O 3.26Å; A373-F611 HydrophobicContact CB-CD1 3.84Å; A373-F611 HydrophobicContact CB-CD2 4.17Å; A373-F611 HydrophobicContact CB-CE1 3.85Å; A373-F611 HydrophobicContact CB-CE2 4.18Å; A373-F611 HydrophobicContact CB-CG 4.01Å; A373-F611 HydrophobicContact CB-CZ 4.02Å
374	A	89.9	Confident	85.5	Confident	3 Å²	3	35.6 Å²	35.6	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-60.2	-41	175.9	0	0	0	0	0	112.6	Q370 I372 L378 S753 L754 T778	Q370-A374 VanDerWaalsContact O-CB 3.28Å; Q370-A374 WeakPolarHBondContact O-CB 3.38Å; Q370-A374 PolarHBondContact O-N 3.47Å; I372-A374 VanDerWaalsContact C-N 3.35Å; I372-A374 PolarHBondContact O-N 2.94Å; A374-L378 WeakPolarHBondContact O-CB 3.5Å; A374-L378 PolarHBondContact O-N 3.16Å; A374-S753 VanDerWaalsContact CB-OG 3.28Å; A374-S753 WeakPolarHBondContact CB-OG 3.4Å; A374-L754 HydrophobicContact CB-CD2 3.84Å; A374-L754 HydrophobicContact CB-CG 4.42Å; A374-T778 HydrophobicContact CB-CG2 3.99Å
375	A	92.3	Very high	85.4	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-66.3	-43.9	178.5	0	0	0	0	0	112.8	T371 I372 A373 L378 F379 I781	T371-A375 WeakPolarHBondContact O-CB 3.48Å; T371-A375 PolarHBondContact O-N 3.39Å; I372-A375 PolarHBondContact O-N 2.69Å; A373-A375 PolarHBondContact O-N 3.36Å; A375-L378 PolarHBondContact O-N 3.45Å; A375-F379 PolarHBondContact O-N 3.36Å; A375-I781 HydrophobicContact CB-CB 4.09Å; A375-I781 HydrophobicContact CB-CG2 3.9Å
376	I	88.7	Confident	85.9	Confident	47 Å²	47	24 Å²	24	24%	0.241	14%	0.142	C	C	.	.	H	α-helix	trans	-64.3	-44.6	177.1	-66.8	167.2	0	0	0	110.5	I372 A373 F379 F380 F611 T614	I372-I376 HydrophobicContact CG2-CD1 3.83Å; I372-I376 HydrophobicContact CG2-CG1 4.5Å; I372-I376 WeakPolarHBondContact O-CG1 3.46Å; I372-I376 PolarHBondContact O-N 3.43Å; A373-I376 PolarHBondContact O-N 3.49Å; I376-F379 WeakPolarHBondContact O-CB 3.4Å; I376-F379 PolarHBondContact O-N 3.45Å; I376-F380 HydrophobicContact CG2-CD2 3.92Å; I376-F380 HydrophobicContact CG2-CE2 3.63Å; I376-F380 VanDerWaalsContact O-CD2 3.31Å; I376-F380 WeakPolarHBondContact O-CD2 3.31Å; I376-F380 PolarHBondContact O-N 3.1Å; I376-F611 HydrophobicContact CD1-CE1 4.23Å; I376-T614 HydrophobicContact CG2-CG2 3.92Å
377	F	86.4	Confident	86.3	Confident	14 Å²	14	21.2 Å²	21.2	6%	0.061	11%	0.108	C	C	.	.	H	α-helix	trans	-59.5	-47.5	175.7	162.8	-107.7	0	0	0	111.7	A373 F379 F380 A381 V613 M749 I807 M811	A373-F377 VanDerWaalsContact O-CB 3.28Å; A373-F377 WeakPolarHBondContact O-CB 3.36Å; A373-F377 PolarHBondContact O-N 2.97Å; F377-F379 VanDerWaalsContact C-N 3.27Å; F377-F379 PolarHBondContact O-N 3.05Å; F377-F380 PolarHBondContact O-N 3.42Å; F377-A381 HydrophobicContact CE2-CB 4.25Å; F377-A381 HydrophobicContact CZ-CB 4.23Å; F377-A381 WeakPolarHBondContact O-CB 3.46Å; F377-A381 PolarHBondContact O-N 2.76Å; F377-V613 HydrophobicContact CD2-CB 4.27Å; F377-V613 HydrophobicContact CD2-CG1 3.64Å; F377-V613 HydrophobicContact CD2-CG2 4.49Å; F377-V613 HydrophobicContact CE2-CG1 4.2Å; F377-M749 HydrophobicContact CE1-CB 4.01Å; F377-M749 HydrophobicContact CE1-CE 4.25Å; F377-M749 HydrophobicContact CE2-CE 4.3Å; F377-M749 HydrophobicContact CZ-CB 4.1Å; F377-M749 HydrophobicContact CZ-CE 3.47Å; F377-M749 VanDerWaalsContact CZ-CE 3.47Å; F377-I807 HydrophobicContact CE2-CG2 4.18Å; F377-M811 HydrophobicContact CD2-SD 4.46Å; F377-M811 HydrophobicContact CE1-SD 4.02Å; F377-M811 HydrophobicContact CE2-CE 3.5Å; F377-M811 VanDerWaalsContact CE2-CE 3.5Å; F377-M811 HydrophobicContact CE2-SD 3.32Å; F377-M811 WeakPolarHBondContact CE2-SD 3.19Å; F377-M811 HydrophobicContact CZ-CE 3.45Å; F377-M811 VanDerWaalsContact CZ-CE 3.45Å; F377-M811 HydrophobicContact CZ-SD 3.04Å; F377-M811 WeakPolarHBondContact CZ-SD 3.42Å
378	L	89.7	Confident	86.2	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62	-36.4	179.2	-175.5	60.7	0	0	0	112	A374 A375 N382 V427 I746 H750 A782	A374-L378 WeakPolarHBondContact O-CB 3.5Å; A374-L378 PolarHBondContact O-N 3.16Å; A375-L378 PolarHBondContact O-N 3.45Å; L378-N382 VanDerWaalsContact O-CB 3.23Å; L378-N382 WeakPolarHBondContact O-CB 3.49Å; L378-N382 PolarHBondContact O-N 3.33Å; L378-V427 HydrophobicContact CD1-CG1 4.16Å; L378-V427 HydrophobicContact CD1-CG2 4.07Å; L378-V427 HydrophobicContact CD2-CG2 3.96Å; L378-I746 HydrophobicContact CD1-CG2 3.28Å; L378-H750 HydrophobicContact CD1-CB 4.36Å; L378-A782 HydrophobicContact CB-CB 3.87Å; L378-A782 HydrophobicContact CD2-CB 3.67Å; L378-A782 HydrophobicContact CG-CB 3.7Å
379	F	89.6	Confident	86.1	Confident	10 Å²	10	20.7 Å²	20.7	4%	0.044	11%	0.11	C	C	.	.	H	α-helix	trans	-58.8	-55.2	173	165.5	-105	0	0	0	111.8	A375 I376 F377 A381 N382 I383 L785 I786 A789 L792 M796	A375-F379 PolarHBondContact O-N 3.36Å; I376-F379 WeakPolarHBondContact O-CB 3.4Å; I376-F379 PolarHBondContact O-N 3.45Å; F377-F379 VanDerWaalsContact C-N 3.27Å; F377-F379 PolarHBondContact O-N 3.05Å; F379-A381 PolarHBondContact O-N 2.89Å; F379-N382 PolarHBondContact O-N 2.93Å; F379-I383 HydrophobicContact CE2-CB 4.46Å; F379-I383 WeakPolarHBondContact O-CB 3.45Å; F379-I383 WeakPolarHBondContact O-CG2 3.4Å; F379-I383 PolarHBondContact O-N 2.93Å; F379-L785 HydrophobicContact CB-CB 4.39Å; F379-L785 HydrophobicContact CB-CD1 4.21Å; F379-L785 HydrophobicContact CD2-CB 3.4Å; F379-L785 HydrophobicContact CE2-CB 3.8Å; F379-L785 WeakPolarHBondContact CE2-O 3.26Å; F379-L785 HydrophobicContact CG-CB 3.96Å; F379-L785 HydrophobicContact CG-CD1 4.27Å; F379-I786 HydrophobicContact CD2-CG1 3.88Å; F379-I786 HydrophobicContact CE2-CG1 4.33Å; F379-A789 HydrophobicContact CE2-CB 4.31Å; F379-L792 HydrophobicContact CE2-CD1 4.44Å; F379-L792 HydrophobicContact CZ-CD1 4.1Å; F379-M796 HydrophobicContact CE1-SD 3.46Å; F379-M796 WeakPolarHBondContact CE1-SD 3.32Å; F379-M796 HydrophobicContact CZ-CE 4.43Å; F379-M796 HydrophobicContact CZ-SD 3.39Å; F379-M796 WeakPolarHBondContact CZ-SD 3.23Å
380	F	85	Confident	86	Confident	23 Å²	23	18.4 Å²	18.4	10%	0.101	10%	0.096	C	C	.	.	H	α-helix	trans	-64	-39.8	-178.9	-73.3	-60.4	0	0	0	112.9	I376 F377 I383 S384 I617 M796 V799 L804	I376-F380 HydrophobicContact CG2-CD2 3.92Å; I376-F380 HydrophobicContact CG2-CE2 3.63Å; I376-F380 VanDerWaalsContact O-CD2 3.31Å; I376-F380 WeakPolarHBondContact O-CD2 3.31Å; I376-F380 PolarHBondContact O-N 3.1Å; F377-F380 PolarHBondContact O-N 3.42Å; F380-I383 WeakPolarHBondContact O-CG2 3.38Å; F380-S384 PolarHBondContact O-N 3.49Å; F380-I617 HydrophobicContact CB-CD1 4.34Å; F380-I617 HydrophobicContact CD2-CD1 3.86Å; F380-I617 HydrophobicContact CE2-CD1 4.43Å; F380-I617 HydrophobicContact CG-CD1 4.18Å; F380-M796 HydrophobicContact CD1-CE 4.35Å; F380-M796 HydrophobicContact CD1-SD 4.36Å; F380-M796 HydrophobicContact CE1-CE 4.46Å; F380-M796 HydrophobicContact CE1-SD 3.98Å; F380-V799 HydrophobicContact CE1-CG2 3.82Å; F380-V799 HydrophobicContact CZ-CG2 4.27Å; F380-L804 HydrophobicContact CB-CD2 4.31Å
381	A	82.2	Confident	85.7	Confident	6 Å²	6	19.6 Å²	19.6	5%	0.05	11%	0.111	C	C	.	.	H	α-helix	trans	-64.6	-43.1	177.8	0	0	0	0	0	112	F377 F379 M749 F808	F377-A381 HydrophobicContact CE2-CB 4.25Å; F377-A381 HydrophobicContact CZ-CB 4.23Å; F377-A381 WeakPolarHBondContact O-CB 3.46Å; F377-A381 PolarHBondContact O-N 2.76Å; F379-A381 PolarHBondContact O-N 2.89Å; A381-M749 HydrophobicContact CB-CE 3.7Å; A381-F808 HydrophobicContact CB-CE1 4.42Å
382	N	87.8	Confident	85.1	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-79	-39.5	-176.2	-159.4	14	0	0	0	111.9	L378 F379 S384 K385 I386 S429 I746 H783 I786	L378-N382 VanDerWaalsContact O-CB 3.23Å; L378-N382 WeakPolarHBondContact O-CB 3.49Å; L378-N382 PolarHBondContact O-N 3.33Å; F379-N382 PolarHBondContact O-N 2.93Å; N382-S384 PolarHBondContact O-N 2.82Å; N382-K385 WeakPolarHBondContact O-CB 3.31Å; N382-K385 PolarHBondContact O-N 3.49Å; N382-I386 VanDerWaalsContact O-CG1 3.22Å; N382-I386 WeakPolarHBondContact O-CG1 3.31Å; N382-I386 PolarHBondContact O-N 3.35Å; N382-S429 VanDerWaalsContact OD1-CB 3.28Å; N382-S429 WeakPolarHBondContact OD1-CB 3.48Å; N382-S429 PolarHBondContact OD1-OG 3.1Å; N382-I746 HydrophobicContact CB-CD1 4.31Å; N382-I746 WeakPolarHBondContact OD1-CD1 3.46Å; N382-H783 PolarHBondContact ND2-NE2 3.4Å; N382-I786 HydrophobicContact CB-CD1 3.73Å; N382-I786 VanDerWaalsContact ND2-CD1 3.33Å; N382-I786 WeakPolarHBondContact ND2-CD1 3.44Å
383	I	86.2	Confident	84.7	Confident	3 Å²	3	19.8 Å²	19.8	2%	0.015	11%	0.114	C	C	.	.	H	α-helix	trans	-64.1	-40.5	-179.6	-166.8	64.5	0	0	0	112.3	F379 F380 K385 I386 I387 V407 L634 I786 A789 M796	F379-I383 HydrophobicContact CE2-CB 4.46Å; F379-I383 WeakPolarHBondContact O-CB 3.45Å; F379-I383 WeakPolarHBondContact O-CG2 3.4Å; F379-I383 PolarHBondContact O-N 2.93Å; F380-I383 WeakPolarHBondContact O-CG2 3.38Å; I383-K385 VanDerWaalsContact C-N 3.28Å; I383-K385 PolarHBondContact O-N 3.29Å; I383-I386 PolarHBondContact O-N 3.38Å; I383-I387 HydrophobicContact CD1-CD1 4.41Å; I383-I387 HydrophobicContact CG1-CD1 3.96Å; I383-I387 HydrophobicContact CG1-CG1 4.46Å; I383-I387 WeakPolarHBondContact O-CG1 2.88Å; I383-I387 PolarHBondContact O-N 2.99Å; I383-V407 HydrophobicContact CD1-CG2 4.33Å; I383-L634 HydrophobicContact CG2-CD2 4.48Å; I383-I786 HydrophobicContact CD1-CG2 4.19Å; I383-A789 HydrophobicContact CD1-CB 3.77Å; I383-A789 HydrophobicContact CG1-CB 4.43Å; I383-M796 HydrophobicContact CB-CE 4.39Å; I383-M796 HydrophobicContact CG1-CE 4.02Å; I383-M796 HydrophobicContact CG2-CE 3.43Å; I383-M796 VanDerWaalsContact CG2-CE 3.43Å; I383-M796 HydrophobicContact CG2-SD 4.46Å
384	S	79.8	Confident	84.4	Confident	12 Å²	12	21.7 Å²	21.7	8%	0.084	12%	0.124	C	C	.	.	H	α-helix	trans	-58.6	-43.9	175.5	-171	0	0	0	0	110.9	F380 N382 T388	F380-S384 PolarHBondContact O-N 3.49Å; N382-S384 PolarHBondContact O-N 2.82Å; S384-T388 WeakPolarHBondContact O-CB 3.24Å; S384-T388 PolarHBondContact O-N 3.35Å; S384-T388 VanDerWaalsContact O-N 3.07Å; S384-T388 PolarHBondContact O-OG1 2.98Å
385	K	81.7	Confident	84.1	Confident	48 Å²	48	29 Å²	29	21%	0.209	16%	0.158	C	C	.	.	H	α-helix	trans	-65.9	-46.7	177.7	-170.8	179.9	179	-159.5	0	111.4	N382 I383 I387 T388 F389 A430 I746	N382-K385 WeakPolarHBondContact O-CB 3.31Å; N382-K385 PolarHBondContact O-N 3.49Å; I383-K385 VanDerWaalsContact C-N 3.28Å; I383-K385 PolarHBondContact O-N 3.29Å; K385-I387 VanDerWaalsContact C-N 3.33Å; K385-I387 PolarHBondContact O-N 3.4Å; K385-T388 PolarHBondContact O-N 3.38Å; K385-F389 HydrophobicContact CD-CD2 4.46Å; K385-F389 HydrophobicContact CD-CE2 4.24Å; K385-F389 VanDerWaalsContact CE-CE2 3.45Å; K385-F389 HydrophobicContact CG-CD2 3.58Å; K385-F389 HydrophobicContact CG-CE2 3.72Å; K385-F389 WeakPolarHBondContact O-CB 3.26Å; K385-F389 WeakPolarHBondContact O-CD2 3.02Å; K385-F389 PolarHBondContact O-N 3.47Å; K385-A430 WeakPolarHBondContact CE-O 2.95Å; K385-A430 PolarHBondContact NZ-O 3.21Å; K385-I746 HydrophobicContact CD-CD1 3.63Å
386	I	87.2	Confident	83.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.8	-42.9	179.3	-69.1	167.1	0	0	0	111.2	N382 I383 G390 N406 V407 Y740 I786	N382-I386 VanDerWaalsContact O-CG1 3.22Å; N382-I386 WeakPolarHBondContact O-CG1 3.31Å; N382-I386 PolarHBondContact O-N 3.35Å; I383-I386 PolarHBondContact O-N 3.38Å; I386-G390 PolarHBondContact O-N 3.22Å; I386-N406 HydrophobicContact CG2-CB 4.11Å; I386-N406 WeakPolarHBondContact CG2-O 3.43Å; I386-N406 PolarHBondContact O-ND2 3.13Å; I386-V407 HydrophobicContact CG2-CB 4.39Å; I386-V407 HydrophobicContact CG2-CG2 3.81Å; I386-Y740 HydrophobicContact CG1-CE1 4.46Å; I386-I786 HydrophobicContact CD1-CD1 4.03Å; I386-I786 HydrophobicContact CD1-CG2 3.72Å
387	I	81.6	Confident	83.6	Confident	21 Å²	21	29.4 Å²	29.4	11%	0.108	16%	0.162	C	C	.	.	H	α-helix	trans	-65.2	-47.8	178.1	-68.6	168.8	0	0	0	110.7	I383 K385 F389 G390 G391 T403 L634 V636	I383-I387 HydrophobicContact CD1-CD1 4.41Å; I383-I387 HydrophobicContact CG1-CD1 3.96Å; I383-I387 HydrophobicContact CG1-CG1 4.46Å; I383-I387 WeakPolarHBondContact O-CG1 2.88Å; I383-I387 PolarHBondContact O-N 2.99Å; K385-I387 VanDerWaalsContact C-N 3.33Å; K385-I387 PolarHBondContact O-N 3.4Å; I387-F389 PolarHBondContact O-N 3.3Å; I387-G390 PolarHBondContact O-N 3.19Å; I387-G390 VanDerWaalsContact O-N 3.15Å; I387-G391 PolarHBondContact O-N 3.05Å; I387-T403 HydrophobicContact CB-CG2 4.41Å; I387-T403 HydrophobicContact CG1-CG2 4.24Å; I387-T403 HydrophobicContact CG2-CG2 4.3Å; I387-L634 HydrophobicContact CD1-CD2 3.76Å; I387-L634 HydrophobicContact CD1-CG 4.26Å; I387-V636 HydrophobicContact CD1-CG2 4.3Å
388	T	75.4	Confident	83.4	Confident	70 Å²	70	34.8 Å²	34.8	43%	0.429	19%	0.185	S	C	.	.	H	α-helix	trans	-60.5	-48.7	-179.7	-51.5	0	0	0	0	111.4	S384 K385 G390 G391 V392	S384-T388 WeakPolarHBondContact O-CB 3.24Å; S384-T388 PolarHBondContact O-N 3.35Å; S384-T388 VanDerWaalsContact O-N 3.07Å; S384-T388 PolarHBondContact O-OG1 2.98Å; K385-T388 PolarHBondContact O-N 3.38Å; T388-G390 VanDerWaalsContact C-N 3.31Å; T388-G390 PolarHBondContact O-N 3.45Å; T388-G391 PolarHBondContact O-N 2.84Å; T388-V392 WeakPolarHBondContact O-CG2 3.26Å; T388-V392 PolarHBondContact O-N 3.28Å; T388-V392 VanDerWaalsContact O-N 3.09Å
389	F	81.5	Confident	82.8	Confident	41 Å²	41	41.2 Å²	41.2	18%	0.18	21%	0.213	C	C	.	.	H	α-helix	trans	-62.9	-38.9	175.3	-90	-87.4	0	0	0	112.1	K385 I387 G391 V392 M393 A430 L435	K385-F389 HydrophobicContact CD-CD2 4.46Å; K385-F389 HydrophobicContact CD-CE2 4.24Å; K385-F389 VanDerWaalsContact CE-CE2 3.45Å; K385-F389 HydrophobicContact CG-CD2 3.58Å; K385-F389 HydrophobicContact CG-CE2 3.72Å; K385-F389 WeakPolarHBondContact O-CB 3.26Å; K385-F389 WeakPolarHBondContact O-CD2 3.02Å; K385-F389 PolarHBondContact O-N 3.47Å; I387-F389 PolarHBondContact O-N 3.3Å; F389-G391 VanDerWaalsContact C-N 3.32Å; F389-G391 PolarHBondContact O-N 3.33Å; F389-V392 PolarHBondContact O-N 3.27Å; F389-M393 WeakPolarHBondContact O-CB 3.26Å; F389-M393 PolarHBondContact O-N 3.22Å; F389-A430 HydrophobicContact CB-CB 3.88Å; F389-A430 HydrophobicContact CD1-CB 4.02Å; F389-A430 HydrophobicContact CD2-CB 4.34Å; F389-A430 HydrophobicContact CG-CB 3.81Å; F389-L435 HydrophobicContact CD1-CB 4.33Å; F389-L435 HydrophobicContact CD1-CD2 3.88Å; F389-L435 HydrophobicContact CE1-CB 4.24Å; F389-L435 HydrophobicContact CE1-CD2 3.92Å
390	G	83.5	Confident	82.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.6	-35.2	177.9	0	0	0	0	0	113.1	I386 I387 T388 D394 G402 T403 N406	I386-G390 PolarHBondContact O-N 3.22Å; I387-G390 PolarHBondContact O-N 3.19Å; I387-G390 VanDerWaalsContact O-N 3.15Å; T388-G390 VanDerWaalsContact C-N 3.31Å; T388-G390 PolarHBondContact O-N 3.45Å; G390-D394 WeakPolarHBondContact O-CB 3.04Å; G390-D394 PolarHBondContact O-N 2.97Å; G390-G402 CarbonylContact O-C 3.35Å; G390-T403 VanDerWaalsContact C-OG1 3.26Å; G390-T403 PolarHBondContact O-OG1 2.88Å; G390-N406 PolarHBondContact N-ND2 3.04Å
391	G	80.8	Confident	82.1	Confident	34 Å²	34	42.5 Å²	42.5	35%	0.351	22%	0.22	S	C	.	.	H	α-helix	trans	-71.3	-45.6	175.4	0	0	0	0	0	112.8	I387 T388 F389 M393 D394 H395 T403	I387-G391 PolarHBondContact O-N 3.05Å; T388-G391 PolarHBondContact O-N 2.84Å; F389-G391 VanDerWaalsContact C-N 3.32Å; F389-G391 PolarHBondContact O-N 3.33Å; G391-M393 VanDerWaalsContact C-N 3.27Å; G391-M393 PolarHBondContact O-N 2.86Å; G391-D394 PolarHBondContact O-N 3.49Å; G391-H395 PolarHBondContact O-N 3.08Å; G391-T403 PolarHBondContact N-OG1 3.48Å
392	V	79.1	Confident	82.1	Confident	69 Å²	69	42.2 Å²	42.2	42%	0.418	22%	0.217	S	C	.	.	H	α-helix	trans	-61.5	-40.5	174.1	177.6	0	0	0	0	110.5	T388 F389 H395 V396 L435	T388-V392 WeakPolarHBondContact O-CG2 3.26Å; T388-V392 PolarHBondContact O-N 3.28Å; T388-V392 VanDerWaalsContact O-N 3.09Å; F389-V392 PolarHBondContact O-N 3.27Å; V392-H395 PolarHBondContact O-N 3.49Å; V392-V396 HydrophobicContact CG1-CG2 4.08Å; V392-V396 WeakPolarHBondContact O-CB 3.32Å; V392-V396 VanDerWaalsContact O-CG2 3.29Å; V392-V396 WeakPolarHBondContact O-CG2 3.24Å; V392-V396 PolarHBondContact O-N 2.9Å; V392-L435 HydrophobicContact CB-CD2 4.49Å; V392-L435 HydrophobicContact CG1-CD2 3.88Å
393	M	81.6	Confident	81.8	Confident	8 Å²	8	43.5 Å²	43.5	4%	0.039	23%	0.225	C	C	.	.	H	α-helix	trans	-64.1	-42.5	178.3	-167.2	59.2	147.1	0	0	112.7	F389 G391 H395 V396 L397 I401 L435 E438	F389-M393 WeakPolarHBondContact O-CB 3.26Å; F389-M393 PolarHBondContact O-N 3.22Å; G391-M393 VanDerWaalsContact C-N 3.27Å; G391-M393 PolarHBondContact O-N 2.86Å; M393-H395 VanDerWaalsContact C-N 3.26Å; M393-H395 PolarHBondContact O-N 3.3Å; M393-V396 PolarHBondContact O-N 3.39Å; M393-L397 HydrophobicContact CE-CD1 3.24Å; M393-L397 HydrophobicContact CE-CG 4.04Å; M393-L397 HydrophobicContact CG-CD1 3.81Å; M393-L397 HydrophobicContact CG-CG 4.22Å; M393-L397 WeakPolarHBondContact O-CB 3.47Å; M393-L397 PolarHBondContact O-N 2.87Å; M393-L397 HydrophobicContact SD-CD1 3.37Å; M393-L397 WeakPolarHBondContact SD-CD1 3.07Å; M393-L397 HydrophobicContact SD-CD2 4.43Å; M393-L397 HydrophobicContact SD-CG 3.56Å; M393-L397 VanDerWaalsContact SD-CG 3.56Å; M393-I401 CarbonylContact C-O 3.55Å; M393-I401 HydrophobicContact CG-CB 4.31Å; M393-I401 HydrophobicContact CG-CG2 4.21Å; M393-L435 HydrophobicContact CB-CD1 4.22Å; M393-L435 HydrophobicContact CE-CD1 4.09Å; M393-L435 HydrophobicContact CG-CD1 4.34Å; M393-L435 HydrophobicContact SD-CD1 3.16Å; M393-L435 WeakPolarHBondContact SD-CD1 3.19Å; M393-E438 HydrophobicContact CE-CB 3.75Å; M393-E438 HydrophobicContact CE-CG 4.31Å; M393-E438 WeakPolarHBondContact CE-OE2 3.43Å
394	D	83.2	Confident	81.6	Confident	46 Å²	46	44.6 Å²	44.6	25%	0.246	23%	0.231	C	C	.	.	H	α-helix	trans	-56.7	-42.7	175.6	-169.4	57.6	0	0	0	111.5	G390 G391 K398 K399 I401	G390-D394 WeakPolarHBondContact O-CB 3.04Å; G390-D394 PolarHBondContact O-N 2.97Å; G391-D394 PolarHBondContact O-N 3.49Å; D394-K398 PolarHBondContact O-N 3.02Å; D394-K399 PolarHBondContact O-N 3.43Å; D394-K399 WeakPolarHBondContact OD1-CA 3.35Å; D394-I401 WeakPolarHBondContact CA-O 3.34Å; D394-I401 PolarHBondContact N-O 2.88Å
395	H	82.2	Confident	81.8	Confident	157 Å²	157	44 Å²	44	73%	0.727	23%	0.227	S	C	*	.	H	α-helix	trans	-70.2	-50.1	178.3	-177.2	-86.6	0	0	0	112.3	G391 V392 M393 L397 K398	G391-H395 PolarHBondContact O-N 3.08Å; V392-H395 PolarHBondContact O-N 3.49Å; M393-H395 VanDerWaalsContact C-N 3.26Å; M393-H395 PolarHBondContact O-N 3.3Å; H395-L397 PolarHBondContact O-N 3.34Å; H395-K398 PolarHBondContact O-N 3.3Å
396	V	84.4	Confident	82.1	Confident	55 Å²	55	42 Å²	42	33%	0.333	22%	0.218	S	C	.	.	H	α-helix	trans	-68.4	-36.2	-175.2	173.3	0	0	0	0	112.2	V392 M393 A439	V392-V396 HydrophobicContact CG1-CG2 4.08Å; V392-V396 WeakPolarHBondContact O-CB 3.32Å; V392-V396 VanDerWaalsContact O-CG2 3.29Å; V392-V396 WeakPolarHBondContact O-CG2 3.24Å; V392-V396 PolarHBondContact O-N 2.9Å; M393-V396 PolarHBondContact O-N 3.39Å; V396-A439 HydrophobicContact CG1-CB 3.42Å; V396-A439 VanDerWaalsContact CG1-CB 3.42Å
397	L	85.8	Confident	82.1	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	15.2	179.4	-60.6	-172.1	0	0	0	113.9	M393 H395 K399 Q400 I401 F442 F452	M393-L397 HydrophobicContact CE-CD1 3.24Å; M393-L397 HydrophobicContact CE-CG 4.04Å; M393-L397 HydrophobicContact CG-CD1 3.81Å; M393-L397 HydrophobicContact CG-CG 4.22Å; M393-L397 WeakPolarHBondContact O-CB 3.47Å; M393-L397 PolarHBondContact O-N 2.87Å; M393-L397 HydrophobicContact SD-CD1 3.37Å; M393-L397 WeakPolarHBondContact SD-CD1 3.07Å; M393-L397 HydrophobicContact SD-CD2 4.43Å; M393-L397 HydrophobicContact SD-CG 3.56Å; M393-L397 VanDerWaalsContact SD-CG 3.56Å; H395-L397 PolarHBondContact O-N 3.34Å; L397-K399 VanDerWaalsContact C-N 3.29Å; L397-K399 PolarHBondContact O-N 2.83Å; L397-Q400 HydrophobicContact CB-CB 4.28Å; L397-Q400 WeakPolarHBondContact O-CB 3.25Å; L397-Q400 VanDerWaalsContact O-CG 3.31Å; L397-Q400 WeakPolarHBondContact O-CG 3.46Å; L397-Q400 PolarHBondContact O-N 3.29Å; L397-Q400 VanDerWaalsContact O-N 3.09Å; L397-I401 HydrophobicContact CD1-CB 3.93Å; L397-I401 HydrophobicContact CD1-CD1 3.93Å; L397-I401 HydrophobicContact CD1-CG1 4.07Å; L397-F442 HydrophobicContact CD2-CB 3.29Å; L397-F442 HydrophobicContact CD2-CD1 3.96Å; L397-F442 HydrophobicContact CD2-CD2 4.01Å; L397-F442 HydrophobicContact CD2-CG 3.48Å; L397-F442 VanDerWaalsContact CD2-CG 3.48Å; L397-F452 HydrophobicContact CD1-CE1 3.99Å; L397-F452 HydrophobicContact CD1-CZ 3.96Å; L397-F452 HydrophobicContact CD2-CE1 4.49Å; L397-F452 HydrophobicContact CD2-CZ 4.03Å
398	K	82.2	Confident	82.3	Confident	127 Å²	127	44 Å²	44	55%	0.552	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.1	48.4	177.6	-59.1	178.1	179.9	169.5	0	112.7	D394 H395 Q400 F442 E446	D394-K398 PolarHBondContact O-N 3.02Å; H395-K398 PolarHBondContact O-N 3.3Å; K398-Q400 PolarHBondContact O-N 3.08Å; K398-F442 HydrophobicContact CB-CE1 4.49Å; K398-F442 HydrophobicContact CB-CZ 4.21Å; K398-F442 HydrophobicContact CD-CE1 4.09Å; K398-F442 HydrophobicContact CD-CZ 4.17Å; K398-F442 HydrophobicContact CG-CE1 4.13Å; K398-F442 HydrophobicContact CG-CZ 4.28Å; K398-E446 IonicContact NZ-OE1 2.67Å; K398-E446 PolarHBondContact NZ-OE1 3.04Å; K398-E446 IonicContact NZ-OE2 3.4Å; K398-E446 PolarHBondContact NZ-OE2 3.1Å
399	K	77.3	Confident	83	Confident	135 Å²	135	40.6 Å²	40.6	59%	0.587	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	67	18.6	178.6	-53.5	179.6	177.4	174.3	0	117.1	D394 L397 T662 S663	D394-K399 PolarHBondContact O-N 3.43Å; D394-K399 WeakPolarHBondContact OD1-CA 3.35Å; L397-K399 VanDerWaalsContact C-N 3.29Å; L397-K399 PolarHBondContact O-N 2.83Å; K399-T662 HydrophobicContact CB-CG2 4.17Å; K399-S663 PolarHBondContact O-OG 3.16Å
400	Q	78	Confident	83.5	Confident	61 Å²	61	38.7 Å²	38.7	29%	0.285	20%	0.2	S	C	.	.	S	Bend	trans	-72.2	-37.2	170.7	-70.1	-69.5	-30.1	0	0	112.7	L397 K398 F442 F452	L397-Q400 HydrophobicContact CB-CB 4.28Å; L397-Q400 WeakPolarHBondContact O-CB 3.25Å; L397-Q400 VanDerWaalsContact O-CG 3.31Å; L397-Q400 WeakPolarHBondContact O-CG 3.46Å; L397-Q400 PolarHBondContact O-N 3.29Å; L397-Q400 VanDerWaalsContact O-N 3.09Å; K398-Q400 PolarHBondContact O-N 3.08Å; Q400-F442 HydrophobicContact CG-CE2 3.94Å; Q400-F452 HydrophobicContact CB-CD1 4.39Å
401	I	82.6	Confident	83.9	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	-138.5	125.4	176.3	-57.5	177.9	0	0	0	106.6	M393 D394 L397 E405 F452 P738	M393-I401 CarbonylContact C-O 3.55Å; M393-I401 HydrophobicContact CG-CB 4.31Å; M393-I401 HydrophobicContact CG-CG2 4.21Å; D394-I401 WeakPolarHBondContact CA-O 3.34Å; D394-I401 PolarHBondContact N-O 2.88Å; L397-I401 HydrophobicContact CD1-CB 3.93Å; L397-I401 HydrophobicContact CD1-CD1 3.93Å; L397-I401 HydrophobicContact CD1-CG1 4.07Å; I401-E405 HydrophobicContact CG2-CB 3.93Å; I401-E405 HydrophobicContact CG2-CG 4.5Å; I401-F452 HydrophobicContact CD1-CE1 4.12Å; I401-P738 HydrophobicContact CG2-CG 4.32Å
402	G	81.8	Confident	84.4	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.196	C	C	.	.			trans	-120.8	-155.9	-177.9	0	0	0	0	0	113.1	G390 E405 N406	G390-G402 CarbonylContact O-C 3.35Å; G402-E405 WeakPolarHBondContact CA-OE2 3.49Å; G402-E405 PolarHBondContact N-OE2 3.36Å; G402-N406 PolarHBondContact O-N 3.11Å
403	T	82	Confident	85.1	Confident	26 Å²	26	35.9 Å²	35.9	16%	0.16	18%	0.177	C	C	.	.	H	α-helix	trans	-71.4	-34.8	-176.6	-56	0	0	0	0	112.8	I387 G390 G391 N406 V407 P637	I387-T403 HydrophobicContact CB-CG2 4.41Å; I387-T403 HydrophobicContact CG1-CG2 4.24Å; I387-T403 HydrophobicContact CG2-CG2 4.3Å; G390-T403 VanDerWaalsContact C-OG1 3.26Å; G390-T403 PolarHBondContact O-OG1 2.88Å; G391-T403 PolarHBondContact N-OG1 3.48Å; T403-N406 PolarHBondContact O-N 3.31Å; T403-V407 HydrophobicContact CG2-CG2 4.44Å; T403-V407 WeakPolarHBondContact O-CG2 3.18Å; T403-V407 PolarHBondContact O-N 3.29Å; T403-P637 HydrophobicContact CG2-CG 4.18Å
404	I	81.1	Confident	85.6	Confident	27 Å²	27	35.5 Å²	35.5	14%	0.138	18%	0.175	C	C	.	.	H	α-helix	trans	-67.5	-45.1	-176.6	-60.9	173.5	0	0	0	110.5	N406 V407 L408 P637 L659	I404-N406 PolarHBondContact O-N 2.87Å; I404-V407 PolarHBondContact O-N 3.23Å; I404-L408 PolarHBondContact O-N 3.13Å; I404-P637 HydrophobicContact CG1-CG 4.27Å; I404-L659 HydrophobicContact CG2-CD2 3.91Å
405	E	84.3	Confident	86.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.4	-36.3	175	-64.9	80.5	-178.2	0	0	111.3	I401 G402 L408 A409 P661 T662 W667 I737	I401-E405 HydrophobicContact CG2-CB 3.93Å; I401-E405 HydrophobicContact CG2-CG 4.5Å; G402-E405 WeakPolarHBondContact CA-OE2 3.49Å; G402-E405 PolarHBondContact N-OE2 3.36Å; E405-L408 PolarHBondContact O-N 3.26Å; E405-A409 WeakPolarHBondContact O-CB 3.25Å; E405-A409 PolarHBondContact O-N 3Å; E405-P661 VanDerWaalsContact OE1-CA 3.25Å; E405-P661 WeakPolarHBondContact OE1-CA 3.3Å; E405-P661 VanDerWaalsContact OE1-CB 3.29Å; E405-P661 WeakPolarHBondContact OE1-CB 3.5Å; E405-T662 PolarHBondContact OE1-N 3.09Å; E405-T662 PolarHBondContact OE1-OG1 2.7Å; E405-T662 PolarHBondContact OE2-OG1 2.9Å; E405-W667 HydrophobicContact CG-CH2 4.07Å; E405-W667 HydrophobicContact CG-CZ3 3.9Å; E405-I737 HydrophobicContact CB-CG2 4.47Å
406	N	88	Confident	86.8	Confident	5 Å²	5	30.6 Å²	30.6	3%	0.027	15%	0.153	C	C	.	.	H	α-helix	trans	-69.4	-40.7	177.9	-151.8	30.8	0	0	0	112.4	I386 G390 G402 T403 I404 A409 G410 P738 Y740	I386-N406 HydrophobicContact CG2-CB 4.11Å; I386-N406 WeakPolarHBondContact CG2-O 3.43Å; I386-N406 PolarHBondContact O-ND2 3.13Å; G390-N406 PolarHBondContact N-ND2 3.04Å; G402-N406 PolarHBondContact O-N 3.11Å; T403-N406 PolarHBondContact O-N 3.31Å; I404-N406 PolarHBondContact O-N 2.87Å; N406-A409 PolarHBondContact O-N 3.21Å; N406-G410 PolarHBondContact O-N 3.09Å; N406-P738 HydrophobicContact CB-CG 4.12Å; N406-P738 WeakPolarHBondContact OD1-CG 3.44Å; N406-Y740 PolarHBondContact O-OH 2.72Å; N406-Y740 WeakPolarHBondContact OD1-CE2 3.31Å; N406-Y740 PolarHBondContact OD1-OH 2.94Å
407	V	87.8	Confident	87.3	Confident	15 Å²	15	28 Å²	28	9%	0.091	14%	0.138	C	C	.	.	H	α-helix	trans	-63.1	-43.7	173.7	173.4	0	0	0	0	111.2	I383 I386 T403 I404 A409 G410 G411 A789	I383-V407 HydrophobicContact CD1-CG2 4.33Å; I386-V407 HydrophobicContact CG2-CB 4.39Å; I386-V407 HydrophobicContact CG2-CG2 3.81Å; T403-V407 HydrophobicContact CG2-CG2 4.44Å; T403-V407 WeakPolarHBondContact O-CG2 3.18Å; T403-V407 PolarHBondContact O-N 3.29Å; I404-V407 PolarHBondContact O-N 3.23Å; V407-A409 VanDerWaalsContact C-N 3.35Å; V407-A409 PolarHBondContact O-N 3.33Å; V407-G410 PolarHBondContact O-N 3.11Å; V407-G411 PolarHBondContact O-N 3.43Å; V407-A789 HydrophobicContact CG1-CB 4.48Å
408	L	86.6	Confident	87.7	Confident	47 Å²	47	28.1 Å²	28.1	25%	0.246	14%	0.138	C	C	.	.	H	α-helix	trans	-61.9	-43.4	175.7	-175.8	66.2	0	0	0	111.5	I404 E405 G411 V412 W667 I737	I404-L408 PolarHBondContact O-N 3.13Å; E405-L408 PolarHBondContact O-N 3.26Å; L408-G411 PolarHBondContact O-N 3.4Å; L408-V412 HydrophobicContact CD1-CG2 4.05Å; L408-V412 HydrophobicContact CG-CG2 4.27Å; L408-V412 WeakPolarHBondContact O-CG2 3.05Å; L408-V412 PolarHBondContact O-N 3.44Å; L408-W667 HydrophobicContact CD2-CD2 4.44Å; L408-W667 HydrophobicContact CD2-CE3 3.87Å; L408-W667 HydrophobicContact CD2-CH2 3.53Å; L408-W667 HydrophobicContact CD2-CZ2 4.13Å; L408-W667 HydrophobicContact CD2-CZ3 3.37Å; L408-I737 HydrophobicContact CD2-CG2 4.31Å
409	A	90.1	Very high	88.3	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-59.5	-47.1	175.8	0	0	0	0	0	112	E405 N406 V407 G411 V412 C413 I737 P738 Y740	E405-A409 WeakPolarHBondContact O-CB 3.25Å; E405-A409 PolarHBondContact O-N 3Å; N406-A409 PolarHBondContact O-N 3.21Å; V407-A409 VanDerWaalsContact C-N 3.35Å; V407-A409 PolarHBondContact O-N 3.33Å; A409-G411 VanDerWaalsContact C-N 3.29Å; A409-G411 PolarHBondContact O-N 3.19Å; A409-V412 PolarHBondContact O-N 3.49Å; A409-C413 WeakPolarHBondContact O-CB 3.45Å; A409-C413 PolarHBondContact O-N 3.44Å; A409-C413 PolarHBondContact O-SG 2.75Å; A409-I737 HydrophobicContact CB-CB 4.12Å; A409-I737 HydrophobicContact CB-CD1 4.23Å; A409-I737 HydrophobicContact CB-CG1 4.44Å; A409-P738 HydrophobicContact CB-CG 3.75Å; A409-Y740 HydrophobicContact CB-CD2 3.87Å; A409-Y740 HydrophobicContact CB-CE2 3.51Å
410	G	90.9	Very high	89.1	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-56.7	-42.4	175.6	0	0	0	0	0	112.9	N406 V407 G414 H783	N406-G410 PolarHBondContact O-N 3.09Å; V407-G410 PolarHBondContact O-N 3.11Å; G410-G414 WeakPolarHBondContact O-CA 3.31Å; G410-G414 PolarHBondContact O-N 3.35Å; G410-H783 PolarHBondContact O-CD2 3.3Å
411	G	91.1	Very high	89.7	Confident	3 Å²	3	20.9 Å²	20.9	3%	0.031	11%	0.108	C	C	.	.	H	α-helix	trans	-64.3	-57.9	174.3	0	0	0	0	0	112.9	V407 L408 A409 I415	V407-G411 PolarHBondContact O-N 3.43Å; L408-G411 PolarHBondContact O-N 3.4Å; A409-G411 VanDerWaalsContact C-N 3.29Å; A409-G411 PolarHBondContact O-N 3.19Å; G411-I415 WeakPolarHBondContact O-CB 3.49Å; G411-I415 WeakPolarHBondContact O-CD1 3.35Å; G411-I415 WeakPolarHBondContact O-CG1 3.3Å; G411-I415 PolarHBondContact O-N 3.23Å
412	V	91.3	Very high	90	Very high	40 Å²	40	20.9 Å²	20.9	24%	0.242	11%	0.108	C	C	.	.	H	α-helix	trans	-66	-53.1	-173.1	174.5	0	0	0	0	111.8	L408 A409 G414 I415 I416 V731	L408-V412 HydrophobicContact CD1-CG2 4.05Å; L408-V412 HydrophobicContact CG-CG2 4.27Å; L408-V412 WeakPolarHBondContact O-CG2 3.05Å; L408-V412 PolarHBondContact O-N 3.44Å; A409-V412 PolarHBondContact O-N 3.49Å; V412-G414 VanDerWaalsContact C-N 3.32Å; V412-G414 PolarHBondContact O-N 3.16Å; V412-I415 PolarHBondContact O-N 2.98Å; V412-I416 HydrophobicContact CG1-CD1 3.82Å; V412-I416 WeakPolarHBondContact O-CG1 3.4Å; V412-I416 PolarHBondContact O-N 3.36Å; V412-I416 VanDerWaalsContact O-N 3.1Å; V412-V731 HydrophobicContact CG1-CG1 4.48Å
413	C	93.9	Very high	90.4	Very high	1 Å²	1	21 Å²	21	1%	0.007	11%	0.109	C	C	.	.	H	α-helix	trans	-63.3	-42.5	-178.6	-59	0	0	0	0	110.9	A409 Y417 L428 L728 C732 Y740	A409-C413 WeakPolarHBondContact O-CB 3.45Å; A409-C413 PolarHBondContact O-N 3.44Å; A409-C413 PolarHBondContact O-SG 2.75Å; C413-Y417 WeakPolarHBondContact O-CB 3.39Å; C413-Y417 PolarHBondContact O-N 3.32Å; C413-L428 HydrophobicContact CB-CD1 4.22Å; C413-L728 HydrophobicContact CB-CD1 4.48Å; C413-L728 HydrophobicContact CB-CD2 4.29Å; C413-C732 PolarHBondContact SG-SG 2.99Å; C413-Y740 HydrophobicContact CB-CD1 4.44Å; C413-Y740 HydrophobicContact CB-CG 4.3Å
414	G	93.8	Very high	90.7	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-63.9	-42.1	179.3	0	0	0	0	0	113.8	G410 V412 A418 H783	G410-G414 WeakPolarHBondContact O-CA 3.31Å; G410-G414 PolarHBondContact O-N 3.35Å; V412-G414 VanDerWaalsContact C-N 3.32Å; V412-G414 PolarHBondContact O-N 3.16Å; G414-A418 WeakPolarHBondContact O-CB 3.34Å; G414-A418 PolarHBondContact O-N 3.49Å; G414-H783 VanDerWaalsContact CA-CD2 3.46Å; G414-H783 WeakPolarHBondContact CA-CD2 3.25Å; G414-H783 VanDerWaalsContact CA-CG 3.45Å
415	I	95.1	Very high	91.2	Very high	52 Å²	52	18.9 Å²	18.9	27%	0.267	10%	0.097	S	C	.	.	H	α-helix	trans	-65.8	-50.7	177.1	-70.3	165.2	0	0	0	110.8	G411 V412 Y417 A418 L419 L780 H783 I784	G411-I415 WeakPolarHBondContact O-CB 3.49Å; G411-I415 WeakPolarHBondContact O-CD1 3.35Å; G411-I415 WeakPolarHBondContact O-CG1 3.3Å; G411-I415 PolarHBondContact O-N 3.23Å; V412-I415 PolarHBondContact O-N 2.98Å; I415-Y417 VanDerWaalsContact C-N 3.3Å; I415-Y417 PolarHBondContact O-N 3.43Å; I415-A418 PolarHBondContact O-N 3.06Å; I415-L419 HydrophobicContact CG2-CD1 4Å; I415-L419 VanDerWaalsContact O-CG 3.31Å; I415-L419 WeakPolarHBondContact O-CG 3.41Å; I415-L419 PolarHBondContact O-N 3.02Å; I415-L780 HydrophobicContact CG1-CD1 4.48Å; I415-L780 HydrophobicContact CG2-CD1 4.07Å; I415-H783 HydrophobicContact CG1-CB 4.05Å; I415-I784 HydrophobicContact CD1-CG1 4.01Å; I415-I784 HydrophobicContact CG1-CG1 4.09Å
416	I	94.6	Very high	91.6	Very high	47 Å²	47	18.9 Å²	18.9	24%	0.241	10%	0.097	C	C	.	.	H	α-helix	trans	-60.2	-44.2	-179.6	-68.2	170.2	0	0	0	110.1	V412 L419 F420 V724 L728	V412-I416 HydrophobicContact CG1-CD1 3.82Å; V412-I416 WeakPolarHBondContact O-CG1 3.4Å; V412-I416 PolarHBondContact O-N 3.36Å; V412-I416 VanDerWaalsContact O-N 3.1Å; I416-L419 PolarHBondContact O-N 3.48Å; I416-F420 HydrophobicContact CG2-CD2 4.12Å; I416-F420 VanDerWaalsContact O-CD2 3.31Å; I416-F420 WeakPolarHBondContact O-CD2 3.35Å; I416-F420 PolarHBondContact O-N 3.47Å; I416-V724 HydrophobicContact CG2-CG1 4.45Å; I416-L728 HydrophobicContact CB-CD2 3.81Å; I416-L728 HydrophobicContact CD1-CD2 3.81Å; I416-L728 HydrophobicContact CG1-CD2 4.41Å; I416-L728 HydrophobicContact CG2-CD2 3.65Å; I416-L728 HydrophobicContact CG2-CG 4.1Å
417	Y	95.9	Very high	91.8	Very high	2 Å²	2	18.7 Å²	18.7	1%	0.008	10%	0.096	C	C	.	.	H	α-helix	trans	-66.3	-45.7	178.2	-171	-94.5	0	0	0	112.3	C413 I415 L419 F420 A421 C426 L428 Q698 D721 V724 I725 L728	C413-Y417 WeakPolarHBondContact O-CB 3.39Å; C413-Y417 PolarHBondContact O-N 3.32Å; I415-Y417 VanDerWaalsContact C-N 3.3Å; I415-Y417 PolarHBondContact O-N 3.43Å; Y417-L419 PolarHBondContact O-N 3.32Å; Y417-F420 PolarHBondContact O-N 3.44Å; Y417-A421 HydrophobicContact CD1-CB 3.8Å; Y417-A421 HydrophobicContact CD2-CB 4.04Å; Y417-A421 HydrophobicContact CE1-CB 3.57Å; Y417-A421 HydrophobicContact CE2-CB 3.82Å; Y417-A421 HydrophobicContact CG-CB 4.03Å; Y417-A421 WeakPolarHBondContact O-CA 3.45Å; Y417-A421 WeakPolarHBondContact O-CB 3.45Å; Y417-A421 PolarHBondContact O-N 2.88Å; Y417-C426 HydrophobicContact CE1-CB 3.89Å; Y417-C426 VanDerWaalsContact CE1-O 3.29Å; Y417-C426 WeakPolarHBondContact CE1-O 3.45Å; Y417-C426 WeakPolarHBondContact OH-CB 3.37Å; Y417-L428 HydrophobicContact CD1-CD1 4.29Å; Y417-L428 HydrophobicContact CD1-CD2 4.28Å; Y417-L428 HydrophobicContact CD1-CG 3.8Å; Y417-L428 HydrophobicContact CD2-CD1 3.7Å; Y417-L428 HydrophobicContact CD2-CD2 3.97Å; Y417-L428 HydrophobicContact CD2-CG 3.89Å; Y417-L428 HydrophobicContact CE1-CD2 4.37Å; Y417-L428 HydrophobicContact CE1-CG 4.35Å; Y417-L428 HydrophobicContact CE2-CD2 4.08Å; Y417-L428 HydrophobicContact CE2-CG 4.44Å; Y417-L428 HydrophobicContact CG-CD1 3.52Å; Y417-L428 HydrophobicContact CG-CD2 4.08Å; Y417-L428 HydrophobicContact CG-CG 3.54Å; Y417-Q698 PolarHBondContact OH-NE2 2.96Å; Y417-D721 HydrophobicContact CE2-CB 4.49Å; Y417-V724 HydrophobicContact CD2-CG1 3.93Å; Y417-I725 HydrophobicContact CD2-CG1 4.37Å; Y417-I725 HydrophobicContact CE2-CD1 4.29Å; Y417-I725 HydrophobicContact CE2-CG1 4.19Å; Y417-L728 HydrophobicContact CD2-CD1 4.48Å
418	A	93.8	Very high	92.1	Very high	2 Å²	2	18 Å²	18	2%	0.017	9%	0.092	C	C	.	.	H	α-helix	trans	-58.2	-34.1	177.3	0	0	0	0	0	112.6	G414 I415 R776 A779 L780	G414-A418 WeakPolarHBondContact O-CB 3.34Å; G414-A418 PolarHBondContact O-N 3.49Å; I415-A418 PolarHBondContact O-N 3.06Å; A418-R776 PolarHBondContact O-NH1 3.4Å; A418-A779 HydrophobicContact CB-CB 4.09Å; A418-L780 HydrophobicContact CB-CB 4.15Å; A418-L780 HydrophobicContact CB-CD1 4.39Å
419	L	93.6	Very high	92.3	Very high	47 Å²	47	15.7 Å²	15.7	25%	0.246	8%	0.08	C	C	.	.	H	α-helix	trans	-74	-50.8	176.3	-68.4	173.7	0	0	0	112.1	Y356 F360 I415 I416 Y417 R776 L780	Y356-L419 WeakPolarHBondContact CE2-O 3.43Å; Y356-L419 PolarHBondContact OH-O 3.01Å; F360-L419 HydrophobicContact CZ-CD2 4.26Å; I415-L419 HydrophobicContact CG2-CD1 4Å; I415-L419 VanDerWaalsContact O-CG 3.31Å; I415-L419 WeakPolarHBondContact O-CG 3.41Å; I415-L419 PolarHBondContact O-N 3.02Å; I416-L419 PolarHBondContact O-N 3.48Å; Y417-L419 PolarHBondContact O-N 3.32Å; L419-R776 PolarHBondContact O-NH1 3.38Å; L419-R776 VanDerWaalsContact O-NH1 3.15Å; L419-L780 HydrophobicContact CD2-CD1 4.15Å; L419-L780 HydrophobicContact CD2-CD2 4.17Å; L419-L780 HydrophobicContact CG-CD1 4.18Å
420	F	94	Very high	92.1	Very high	124 Å²	124	16.1 Å²	16.1	54%	0.544	8%	0.084	S	C	.	.	H	α-helix	trans	-103.2	-7.4	-167	-61.6	-71.8	0	0	0	115.8	I416 Y417 V724	I416-F420 HydrophobicContact CG2-CD2 4.12Å; I416-F420 VanDerWaalsContact O-CD2 3.31Å; I416-F420 WeakPolarHBondContact O-CD2 3.35Å; I416-F420 PolarHBondContact O-N 3.47Å; Y417-F420 PolarHBondContact O-N 3.44Å; F420-V724 HydrophobicContact CB-CG1 4.33Å; F420-V724 HydrophobicContact CB-CG2 3.75Å; F420-V724 WeakPolarHBondContact O-CG2 3.49Å
421	A	92.3	Very high	91.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.088	C	C	.	.			trans	-63.4	148.3	-177.2	0	0	0	0	0	113.3	Y417 R776	Y417-A421 HydrophobicContact CD1-CB 3.8Å; Y417-A421 HydrophobicContact CD2-CB 4.04Å; Y417-A421 HydrophobicContact CE1-CB 3.57Å; Y417-A421 HydrophobicContact CE2-CB 3.82Å; Y417-A421 HydrophobicContact CG-CB 4.03Å; Y417-A421 WeakPolarHBondContact O-CA 3.45Å; Y417-A421 WeakPolarHBondContact O-CB 3.45Å; Y417-A421 PolarHBondContact O-N 2.88Å; A421-R776 PolarHBondContact O-NH1 3.32Å; A421-R776 PolarHBondContact O-NH2 2.96Å
422	G	88.7	Confident	91.2	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.1	C	C	.	.	S	Bend	trans	-73	-35.5	167.9	0	0	0	0	0	112.2	K352 P424 D721	K352-G422 WeakPolarHBondContact CE-O 3.25Å; K352-G422 PolarHBondContact NZ-O 3.27Å; G422-P424 WeakPolarHBondContact O-CD 3.46Å; G422-D721 VanDerWaalsContact CA-OD1 3.31Å; G422-D721 WeakPolarHBondContact CA-OD1 3.47Å; G422-D721 PolarHBondContact N-OD1 3.08Å
423	Q	90.5	Very high	90.8	Very high	1 Å²	1	17 Å²	17	1%	0.005	10%	0.095	C	C	.	.			trans	-113.9	83.8	175.5	-164.4	65.6	21.5	0	0	111.7	L425 C426 V705 N706 D721	Q423-L425 PolarHBondContact O-N 2.77Å; Q423-L425 VanDerWaalsContact O-N 3.1Å; Q423-C426 WeakPolarHBondContact O-CB 3.41Å; Q423-C426 PolarHBondContact O-N 2.92Å; Q423-V705 HydrophobicContact CG-CG1 4.02Å; Q423-N706 PolarHBondContact NE2-OD1 3.44Å; Q423-N706 PolarHBondContact OE1-ND2 3.36Å; Q423-N706 VanDerWaalsContact OE1-ND2 3.08Å; Q423-N706 PolarHBondContact OE1-OD1 3.42Å; Q423-N706 VanDerWaalsContact OE1-OD1 3.09Å; Q423-D721 WeakPolarHBondContact CB-OD2 3.15Å; Q423-D721 PolarHBondContact N-OD1 3Å
424	P	87.6	Confident	90.4	Very high	8 Å²	8	17.1 Å²	17.1	5%	0.052	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-10	-174.8	29.4	-37	0	0	0	115	G422 C426 R776	G422-P424 WeakPolarHBondContact O-CD 3.46Å; P424-C426 VanDerWaalsContact C-N 3.26Å; P424-R776 HydrophobicContact CB-CB 4.35Å; P424-R776 HydrophobicContact CB-CG 3.44Å; P424-R776 VanDerWaalsContact CB-CG 3.44Å; P424-R776 HydrophobicContact CG-CG 3.82Å
425	L	91	Very high	90	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.005	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-22.1	172.1	-68.6	175.3	0	0	0	112.3	Q423 V705 L712 H750 L751 L754 I772 E774	Q423-L425 PolarHBondContact O-N 2.77Å; Q423-L425 VanDerWaalsContact O-N 3.1Å; L425-V705 HydrophobicContact CB-CG1 3.79Å; L425-V705 HydrophobicContact CD1-CG1 4.15Å; L425-L712 HydrophobicContact CD1-CD2 3.73Å; L425-H750 PolarHBondContact O-ND1 2.96Å; L425-L751 HydrophobicContact CD1-CD1 4.34Å; L425-L754 HydrophobicContact CD2-CD1 3.76Å; L425-I772 HydrophobicContact CD1-CG2 4.1Å; L425-E774 HydrophobicContact CD1-CG 4.37Å
426	C	92.4	Very high	89.5	Confident	1 Å²	1	18 Å²	18	1%	0.007	10%	0.101	C	C	.	.			trans	-71.9	137.1	173.4	-66	0	0	0	0	110.2	Y417 Q423 P424 S702 A742	Y417-C426 HydrophobicContact CE1-CB 3.89Å; Y417-C426 VanDerWaalsContact CE1-O 3.29Å; Y417-C426 WeakPolarHBondContact CE1-O 3.45Å; Y417-C426 WeakPolarHBondContact OH-CB 3.37Å; Q423-C426 WeakPolarHBondContact O-CB 3.41Å; Q423-C426 PolarHBondContact O-N 2.92Å; P424-C426 VanDerWaalsContact C-N 3.26Å; C426-S702 PolarHBondContact SG-OG 2.93Å; C426-A742 HydrophobicContact CB-CB 4.44Å
427	V	92.7	Very high	89.1	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.095	C	C	.	.			trans	-117.5	123.7	-177.3	-177.7	0	0	0	0	108.6	L378 A743 I746 S747 H750	L378-V427 HydrophobicContact CD1-CG1 4.16Å; L378-V427 HydrophobicContact CD1-CG2 4.07Å; L378-V427 HydrophobicContact CD2-CG2 3.96Å; V427-A743 PolarHBondContact O-N 2.79Å; V427-I746 HydrophobicContact CB-CG2 3.85Å; V427-I746 HydrophobicContact CG1-CG2 3.7Å; V427-I746 HydrophobicContact CG2-CG2 4.26Å; V427-S747 PolarHBondContact N-OG 3.07Å; V427-H750 HydrophobicContact CG2-CB 4.19Å
428	L	93.5	Very high	88.8	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	137.2	174.7	-62.1	-171.9	0	0	0	110.6	C413 Y417 L728 Y740 V741 A742 H783	C413-L428 HydrophobicContact CB-CD1 4.22Å; Y417-L428 HydrophobicContact CD1-CD1 4.29Å; Y417-L428 HydrophobicContact CD1-CD2 4.28Å; Y417-L428 HydrophobicContact CD1-CG 3.8Å; Y417-L428 HydrophobicContact CD2-CD1 3.7Å; Y417-L428 HydrophobicContact CD2-CD2 3.97Å; Y417-L428 HydrophobicContact CD2-CG 3.89Å; Y417-L428 HydrophobicContact CE1-CD2 4.37Å; Y417-L428 HydrophobicContact CE1-CG 4.35Å; Y417-L428 HydrophobicContact CE2-CD2 4.08Å; Y417-L428 HydrophobicContact CE2-CG 4.44Å; Y417-L428 HydrophobicContact CG-CD1 3.52Å; Y417-L428 HydrophobicContact CG-CD2 4.08Å; Y417-L428 HydrophobicContact CG-CG 3.54Å; L428-L728 HydrophobicContact CD1-CD1 3.54Å; L428-Y740 HydrophobicContact CB-CD1 4.49Å; L428-V741 WeakPolarHBondContact CA-O 3.04Å; L428-V741 VanDerWaalsContact CD2-C 3.45Å; L428-A742 HydrophobicContact CD2-CB 4.24Å; L428-A742 VanDerWaalsContact CD2-N 3.3Å; L428-H783 PolarHBondContact O-NE2 2.96Å
429	S	91.6	Very high	88.5	Confident	0 Å²	0	18 Å²	18	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	170.8	173.3	-169.5	0	0	0	0	109.5	N382 T431 Y740 V741	N382-S429 VanDerWaalsContact OD1-CB 3.28Å; N382-S429 WeakPolarHBondContact OD1-CB 3.48Å; N382-S429 PolarHBondContact OD1-OG 3.1Å; S429-T431 PolarHBondContact O-N 3.3Å; S429-Y740 VanDerWaalsContact CA-CD1 3.41Å; S429-V741 PolarHBondContact N-O 3.36Å; S429-V741 VanDerWaalsContact N-O 3.09Å; S429-V741 PolarHBondContact O-N 3Å
430	A	86.4	Confident	88.1	Confident	9 Å²	9	21.1 Å²	21.1	7%	0.074	12%	0.118	C	C	.	.			trans	-61.8	134.1	170.6	0	0	0	0	0	110.1	K385 F389 Y740	K385-A430 WeakPolarHBondContact CE-O 2.95Å; K385-A430 PolarHBondContact NZ-O 3.21Å; F389-A430 HydrophobicContact CB-CB 3.88Å; F389-A430 HydrophobicContact CD1-CB 4.02Å; F389-A430 HydrophobicContact CD2-CB 4.34Å; F389-A430 HydrophobicContact CG-CB 3.81Å; A430-Y740 HydrophobicContact CB-CE2 4.27Å
431	T	84.3	Confident	87.8	Confident	14 Å²	14	16 Å²	16	9%	0.086	10%	0.097	C	C	.	.			trans	-114.5	148.9	176.5	67.5	0	0	0	0	110.5	S429 C434 L435 V741	S429-T431 PolarHBondContact O-N 3.3Å; T431-C434 PolarHBondContact O-N 2.85Å; T431-C434 WeakPolarHBondContact OG1-CB 3.29Å; T431-C434 PolarHBondContact OG1-SG 3.45Å; T431-L435 PolarHBondContact O-N 3.25Å; T431-L435 VanDerWaalsContact O-N 3.1Å; T431-V741 HydrophobicContact CG2-CB 4.42Å
432	G	79.5	Confident	87.7	Confident	28 Å²	28	17 Å²	17	29%	0.289	10%	0.101	S	C	.	.	H	α-helix	trans	-56.3	-48.8	178.3	0	0	0	0	0	113.4	C434 L435 V436	G432-C434 VanDerWaalsContact C-N 3.31Å; G432-C434 PolarHBondContact O-N 2.62Å; G432-L435 WeakPolarHBondContact O-CB 3.39Å; G432-L435 PolarHBondContact O-N 2.92Å; G432-L435 VanDerWaalsContact O-N 3.15Å; G432-V436 WeakPolarHBondContact O-CG2 3.39Å; G432-V436 PolarHBondContact O-N 3.03Å
433	P	81.8	Confident	87.7	Confident	20 Å²	20	19.5 Å²	19.5	13%	0.13	12%	0.118	C	C	.	.	H	α-helix	trans	-60.4	-37.6	178.8	-26.9	36.3	0	0	0	113.5	V436 F437 L693	P433-V436 PolarHBondContact O-N 3.31Å; P433-F437 WeakPolarHBondContact O-CB 3.46Å; P433-F437 PolarHBondContact O-N 2.85Å; P433-L693 HydrophobicContact CB-CD1 3.8Å; P433-L693 HydrophobicContact CB-CD2 4.25Å; P433-L693 HydrophobicContact CB-CG 4.3Å
434	C	86	Confident	87.5	Confident	3 Å²	3	24.7 Å²	24.7	2%	0.02	14%	0.141	C	C	.	.	H	α-helix	trans	-64.8	-43.4	174.1	-70	0	0	0	0	112	T431 G432 V436 F437 E438 F690	T431-C434 PolarHBondContact O-N 2.85Å; T431-C434 WeakPolarHBondContact OG1-CB 3.29Å; T431-C434 PolarHBondContact OG1-SG 3.45Å; G432-C434 VanDerWaalsContact C-N 3.31Å; G432-C434 PolarHBondContact O-N 2.62Å; C434-V436 VanDerWaalsContact C-N 3.34Å; C434-V436 PolarHBondContact O-N 3.09Å; C434-F437 PolarHBondContact O-N 3.31Å; C434-E438 WeakPolarHBondContact O-CG 3.36Å; C434-E438 PolarHBondContact O-N 3.08Å; C434-F690 HydrophobicContact CB-CE2 4.31Å
435	L	85.3	Confident	87.6	Confident	30 Å²	30	24.5 Å²	24.5	16%	0.157	14%	0.14	C	C	.	.	H	α-helix	trans	-58.3	-46.8	175.6	172.4	66	0	0	0	111.6	F389 V392 M393 T431 G432 F437 E438 A439	F389-L435 HydrophobicContact CD1-CB 4.33Å; F389-L435 HydrophobicContact CD1-CD2 3.88Å; F389-L435 HydrophobicContact CE1-CB 4.24Å; F389-L435 HydrophobicContact CE1-CD2 3.92Å; V392-L435 HydrophobicContact CB-CD2 4.49Å; V392-L435 HydrophobicContact CG1-CD2 3.88Å; M393-L435 HydrophobicContact CB-CD1 4.22Å; M393-L435 HydrophobicContact CE-CD1 4.09Å; M393-L435 HydrophobicContact CG-CD1 4.34Å; M393-L435 HydrophobicContact SD-CD1 3.16Å; M393-L435 WeakPolarHBondContact SD-CD1 3.19Å; T431-L435 PolarHBondContact O-N 3.25Å; T431-L435 VanDerWaalsContact O-N 3.1Å; G432-L435 WeakPolarHBondContact O-CB 3.39Å; G432-L435 PolarHBondContact O-N 2.92Å; G432-L435 VanDerWaalsContact O-N 3.15Å; L435-F437 PolarHBondContact O-N 3.04Å; L435-E438 PolarHBondContact O-N 3.46Å; L435-A439 WeakPolarHBondContact O-CB 3.43Å; L435-A439 PolarHBondContact O-N 3.45Å
436	V	84.1	Confident	87.4	Confident	41 Å²	41	28.3 Å²	28.3	25%	0.248	16%	0.158	C	C	.	.	H	α-helix	trans	-64.2	-41.1	-179.6	170.1	0	0	0	0	111.2	G432 P433 C434 A439 M440 M874	G432-V436 WeakPolarHBondContact O-CG2 3.39Å; G432-V436 PolarHBondContact O-N 3.03Å; P433-V436 PolarHBondContact O-N 3.31Å; C434-V436 VanDerWaalsContact C-N 3.34Å; C434-V436 PolarHBondContact O-N 3.09Å; V436-A439 PolarHBondContact O-N 3.14Å; V436-M440 WeakPolarHBondContact O-CG 3.36Å; V436-M440 PolarHBondContact O-N 2.65Å; V436-M874 HydrophobicContact CB-CG 4.47Å; V436-M874 HydrophobicContact CG1-CE 3.31Å; V436-M874 HydrophobicContact CG1-CG 3.61Å; V436-M874 HydrophobicContact CG1-SD 3.9Å
437	F	86.8	Confident	87.3	Confident	23 Å²	23	33.7 Å²	33.7	10%	0.101	19%	0.186	C	C	.	.	H	α-helix	trans	-61	-47.5	173.5	175.9	-93.6	0	0	0	111.9	P433 C434 L435 A439 M440 M441 V459 P686 F690	P433-F437 WeakPolarHBondContact O-CB 3.46Å; P433-F437 PolarHBondContact O-N 2.85Å; C434-F437 PolarHBondContact O-N 3.31Å; L435-F437 PolarHBondContact O-N 3.04Å; F437-A439 VanDerWaalsContact C-N 3.32Å; F437-A439 PolarHBondContact O-N 3.28Å; F437-M440 PolarHBondContact O-N 3.28Å; F437-M441 HydrophobicContact CE1-SD 4.34Å; F437-M441 WeakPolarHBondContact O-CB 2.99Å; F437-M441 PolarHBondContact O-N 3.43Å; F437-V459 HydrophobicContact CE1-CG1 4.11Å; F437-V459 HydrophobicContact CZ-CG1 4.08Å; F437-P686 HydrophobicContact CE2-CB 4.41Å; F437-P686 HydrophobicContact CZ-CB 4.16Å; F437-F690 HydrophobicContact CB-CD2 4.24Å; F437-F690 HydrophobicContact CB-CE2 4.3Å; F437-F690 HydrophobicContact CD1-CB 4.4Å; F437-F690 HydrophobicContact CD1-CD1 4.32Å; F437-F690 AromaticContact CD1-CD2 3.47Å; F437-F690 HydrophobicContact CD1-CD2 3.47Å; F437-F690 VanDerWaalsContact CD1-CD2 3.47Å; F437-F690 HydrophobicContact CD1-CE1 4.47Å; F437-F690 AromaticContact CD1-CE2 3.71Å; F437-F690 HydrophobicContact CD1-CE2 3.71Å; F437-F690 AromaticContact CD1-CG 3.83Å; F437-F690 HydrophobicContact CD1-CG 3.83Å; F437-F690 HydrophobicContact CD1-CZ 4.22Å; F437-F690 HydrophobicContact CD2-CB 4.41Å; F437-F690 HydrophobicContact CD2-CD2 4.12Å; F437-F690 HydrophobicContact CE1-CB 3.88Å; F437-F690 AromaticContact CE1-CD1 3.95Å; F437-F690 HydrophobicContact CE1-CD1 3.95Å; F437-F690 AromaticContact CE1-CD2 3.78Å; F437-F690 HydrophobicContact CE1-CD2 3.78Å; F437-F690 HydrophobicContact CE1-CE1 4.4Å; F437-F690 HydrophobicContact CE1-CE2 4.3Å; F437-F690 AromaticContact CE1-CG 3.62Å; F437-F690 HydrophobicContact CE1-CG 3.62Å; F437-F690 HydrophobicContact CE2-CB 3.89Å; F437-F690 HydrophobicContact CE2-CD2 4.38Å; F437-F690 HydrophobicContact CE2-CG 4.34Å; F437-F690 AromaticContact CG-CD2 3.66Å; F437-F690 HydrophobicContact CG-CD2 3.66Å; F437-F690 HydrophobicContact CG-CE2 4.07Å; F437-F690 HydrophobicContact CG-CG 4.3Å; F437-F690 HydrophobicContact CZ-CB 3.61Å; F437-F690 HydrophobicContact CZ-CD1 4.49Å; F437-F690 HydrophobicContact CZ-CD2 4.23Å; F437-F690 AromaticContact CZ-CG 3.9Å; F437-F690 HydrophobicContact CZ-CG 3.9Å
438	E	88.9	Confident	87	Confident	3 Å²	3	38.3 Å²	38.3	1%	0.014	21%	0.208	C	C	.	.	H	α-helix	trans	-64.2	-37.5	179.3	-69.6	-171.1	-169.9	0	0	112.1	M393 C434 L435 M441 F442 R456 F739	M393-E438 HydrophobicContact CE-CB 3.75Å; M393-E438 HydrophobicContact CE-CG 4.31Å; M393-E438 WeakPolarHBondContact CE-OE2 3.43Å; C434-E438 WeakPolarHBondContact O-CG 3.36Å; C434-E438 PolarHBondContact O-N 3.08Å; L435-E438 PolarHBondContact O-N 3.46Å; E438-M441 PolarHBondContact O-N 3Å; E438-F442 WeakPolarHBondContact O-CB 3.5Å; E438-F442 PolarHBondContact O-N 2.93Å; E438-R456 IonicContact OE1-CZ 2.81Å; E438-R456 IonicContact OE1-NH1 3.42Å; E438-R456 PolarHBondContact OE1-NH1 3.49Å; E438-R456 IonicContact OE1-NH2 2.63Å; E438-R456 PolarHBondContact OE1-NH2 3.06Å; E438-R456 IonicContact OE2-CZ 2.73Å; E438-R456 IonicContact OE2-NH1 2.8Å; E438-R456 PolarHBondContact OE2-NH1 2.66Å; E438-R456 IonicContact OE2-NH2 2.82Å; E438-R456 PolarHBondContact OE2-NH2 3.31Å; E438-F739 HydrophobicContact CG-CD2 4.48Å; E438-F739 WeakPolarHBondContact OE1-CD2 3.29Å; E438-F739 PolarHBondContact OE1-N 2.78Å
439	A	86.9	Confident	86.5	Confident	24 Å²	24	45.5 Å²	45.5	20%	0.198	25%	0.246	C	C	.	.	H	α-helix	trans	-62.7	-45	174.5	0	0	0	0	0	112.6	V396 L435 V436 F437 F442 S443	V396-A439 HydrophobicContact CG1-CB 3.42Å; V396-A439 VanDerWaalsContact CG1-CB 3.42Å; L435-A439 WeakPolarHBondContact O-CB 3.43Å; L435-A439 PolarHBondContact O-N 3.45Å; V436-A439 PolarHBondContact O-N 3.14Å; F437-A439 VanDerWaalsContact C-N 3.32Å; F437-A439 PolarHBondContact O-N 3.28Å; A439-F442 PolarHBondContact O-N 2.94Å; A439-S443 PolarHBondContact O-N 3.33Å
440	M	86.8	Confident	86.3	Confident	113 Å²	113	47.7 Å²	47.7	56%	0.557	26%	0.255	S	S	*	.	H	α-helix	trans	-64.7	-41.6	176.3	-72.2	-64.7	-68	0	0	111.7	V436 F437 F442 S443 F444 M874	V436-M440 WeakPolarHBondContact O-CG 3.36Å; V436-M440 PolarHBondContact O-N 2.65Å; F437-M440 PolarHBondContact O-N 3.28Å; M440-F442 VanDerWaalsContact C-N 3.32Å; M440-F442 PolarHBondContact O-N 3.06Å; M440-S443 PolarHBondContact O-N 2.9Å; M440-F444 WeakPolarHBondContact O-CB 3.37Å; M440-F444 PolarHBondContact O-N 3.13Å; M440-M874 HydrophobicContact CG-CE 3.48Å; M440-M874 VanDerWaalsContact CG-CE 3.48Å; M440-M874 HydrophobicContact CG-SD 4.43Å; M440-M874 HydrophobicContact SD-CE 4.24Å
441	M	88	Confident	86.2	Confident	18 Å²	18	51.1 Å²	51.1	9%	0.089	27%	0.272	C	S	.	.	H	α-helix	trans	-61.7	-41.8	176.2	-175.6	177.9	72	0	0	111.3	F437 E438 F444 C445 F452 R456 V459	F437-M441 HydrophobicContact CE1-SD 4.34Å; F437-M441 WeakPolarHBondContact O-CB 2.99Å; F437-M441 PolarHBondContact O-N 3.43Å; E438-M441 PolarHBondContact O-N 3Å; M441-F444 PolarHBondContact O-N 3.05Å; M441-C445 PolarHBondContact O-N 3.07Å; M441-C445 PolarHBondContact O-SG 2.95Å; M441-F452 HydrophobicContact CB-CE2 4.5Å; M441-F452 HydrophobicContact CE-CD2 4.11Å; M441-F452 HydrophobicContact CE-CE2 3.37Å; M441-F452 HydrophobicContact CE-CZ 3.93Å; M441-F452 HydrophobicContact CG-CE2 4.36Å; M441-R456 HydrophobicContact CE-CB 3.7Å; M441-R456 HydrophobicContact CE-CG 3.95Å; M441-V459 HydrophobicContact SD-CB 4.17Å; M441-V459 HydrophobicContact SD-CG1 4.28Å; M441-V459 HydrophobicContact SD-CG2 3.88Å
442	F	89.6	Confident	86.4	Confident	20 Å²	20	50.9 Å²	50.9	9%	0.088	27%	0.269	C	S	.	.	H	α-helix	trans	-62.5	-49	175.4	179.4	-104.5	0	0	0	112.2	L397 K398 Q400 E438 A439 M440 F444 C445 E446 F452	L397-F442 HydrophobicContact CD2-CB 3.29Å; L397-F442 HydrophobicContact CD2-CD1 3.96Å; L397-F442 HydrophobicContact CD2-CD2 4.01Å; L397-F442 HydrophobicContact CD2-CG 3.48Å; L397-F442 VanDerWaalsContact CD2-CG 3.48Å; K398-F442 HydrophobicContact CB-CE1 4.49Å; K398-F442 HydrophobicContact CB-CZ 4.21Å; K398-F442 HydrophobicContact CD-CE1 4.09Å; K398-F442 HydrophobicContact CD-CZ 4.17Å; K398-F442 HydrophobicContact CG-CE1 4.13Å; K398-F442 HydrophobicContact CG-CZ 4.28Å; Q400-F442 HydrophobicContact CG-CE2 3.94Å; E438-F442 WeakPolarHBondContact O-CB 3.5Å; E438-F442 PolarHBondContact O-N 2.93Å; A439-F442 PolarHBondContact O-N 2.94Å; M440-F442 VanDerWaalsContact C-N 3.32Å; M440-F442 PolarHBondContact O-N 3.06Å; F442-F444 VanDerWaalsContact C-N 3.26Å; F442-F444 PolarHBondContact O-N 2.88Å; F442-C445 PolarHBondContact O-N 3.47Å; F442-E446 WeakPolarHBondContact O-CB 3.36Å; F442-E446 PolarHBondContact O-N 3.44Å; F442-F452 HydrophobicContact CB-CD2 3.84Å; F442-F452 HydrophobicContact CB-CE2 3.61Å; F442-F452 HydrophobicContact CB-CZ 4.2Å; F442-F452 HydrophobicContact CD2-CB 3.98Å; F442-F452 AromaticContact CD2-CD1 3.97Å; F442-F452 HydrophobicContact CD2-CD1 3.97Å; F442-F452 AromaticContact CD2-CD2 3.74Å; F442-F452 HydrophobicContact CD2-CD2 3.74Å; F442-F452 HydrophobicContact CD2-CE1 4.35Å; F442-F452 HydrophobicContact CD2-CE2 4.13Å; F442-F452 AromaticContact CD2-CG 3.63Å; F442-F452 HydrophobicContact CD2-CG 3.63Å; F442-F452 HydrophobicContact CD2-CZ 4.42Å; F442-F452 HydrophobicContact CE2-CB 4.4Å; F442-F452 HydrophobicContact CE2-CG 4.39Å; F442-F452 HydrophobicContact CG-CD2 4.3Å; F442-F452 HydrophobicContact CG-CE2 4.38Å
443	S	87.7	Confident	86.7	Confident	52 Å²	52	50.3 Å²	50.3	36%	0.364	26%	0.26	S	S	.	.	H	α-helix	trans	-59.1	-38.6	176.7	-179.2	0	0	0	0	112	A439 M440 E446 N447	A439-S443 PolarHBondContact O-N 3.33Å; M440-S443 PolarHBondContact O-N 2.9Å; S443-E446 PolarHBondContact O-N 3.4Å; S443-N447 WeakPolarHBondContact O-CB 3.35Å; S443-N447 PolarHBondContact O-N 3.14Å; S443-N447 PolarHBondContact O-ND2 3.4Å
444	F	87.1	Confident	87	Confident	110 Å²	110	49.5 Å²	49.5	48%	0.482	26%	0.255	S	S	.	.	H	α-helix	trans	-66.3	-43.7	175.9	-173.4	-105.9	0	0	0	112.7	M440 M441 F442 E446 N447 Q448 W450	M440-F444 WeakPolarHBondContact O-CB 3.37Å; M440-F444 PolarHBondContact O-N 3.13Å; M441-F444 PolarHBondContact O-N 3.05Å; F442-F444 VanDerWaalsContact C-N 3.26Å; F442-F444 PolarHBondContact O-N 2.88Å; F444-E446 VanDerWaalsContact C-N 3.35Å; F444-N447 PolarHBondContact O-N 3.41Å; F444-Q448 HydrophobicContact CZ-CG 4.36Å; F444-Q448 WeakPolarHBondContact O-CG 3.41Å; F444-Q448 PolarHBondContact O-N 3.03Å; F444-W450 HydrophobicContact CD1-CZ3 4.24Å; F444-W450 HydrophobicContact CE1-CE3 4.38Å; F444-W450 HydrophobicContact CE1-CH2 4.16Å; F444-W450 AromaticContact CE1-CZ3 3.57Å; F444-W450 HydrophobicContact CE1-CZ3 3.57Å; F444-W450 HydrophobicContact CZ-CZ3 4.39Å
445	C	88.7	Confident	87.1	Confident	4 Å²	4	49.7 Å²	49.7	3%	0.027	26%	0.256	C	S	.	.	H	α-helix	trans	-64.7	-39.9	176.5	-64.3	0	0	0	0	111.5	M441 F442 Q448 N449 W450 F452	M441-C445 PolarHBondContact O-N 3.07Å; M441-C445 PolarHBondContact O-SG 2.95Å; F442-C445 PolarHBondContact O-N 3.47Å; C445-Q448 CarbonylContact O-C 3.35Å; C445-Q448 PolarHBondContact O-N 3.29Å; C445-N449 WeakPolarHBondContact O-CA 3.43Å; C445-N449 PolarHBondContact O-N 3.29Å; C445-W450 HydrophobicContact CB-CB 4.38Å; C445-W450 PolarHBondContact O-N 2.68Å; C445-F452 HydrophobicContact CB-CB 4.35Å
446	E	88	Confident	87.3	Confident	82 Å²	82	48.3 Å²	48.3	38%	0.383	25%	0.249	S	C	.	.	H	α-helix	trans	-64.1	-44.1	177.2	-174.1	168.3	-131.2	0	0	111.5	K398 F442 S443 F444 Q448 N449	K398-E446 IonicContact NZ-OE1 2.67Å; K398-E446 PolarHBondContact NZ-OE1 3.04Å; K398-E446 IonicContact NZ-OE2 3.4Å; K398-E446 PolarHBondContact NZ-OE2 3.1Å; F442-E446 WeakPolarHBondContact O-CB 3.36Å; F442-E446 PolarHBondContact O-N 3.44Å; S443-E446 PolarHBondContact O-N 3.4Å; F444-E446 VanDerWaalsContact C-N 3.35Å; E446-Q448 PolarHBondContact O-N 3.01Å; E446-N449 PolarHBondContact O-N 3.3Å
447	N	89.5	Confident	87.7	Confident	113 Å²	113	47.2 Å²	47.2	60%	0.604	24%	0.241	S	C	*	.	H	α-helix	trans	-62.2	-29.4	177.1	-71.1	-21	0	0	0	113.2	S443 F444	S443-N447 WeakPolarHBondContact O-CB 3.35Å; S443-N447 PolarHBondContact O-N 3.14Å; S443-N447 PolarHBondContact O-ND2 3.4Å; F444-N447 PolarHBondContact O-N 3.41Å
448	Q	86	Confident	88	Confident	98 Å²	98	48.9 Å²	48.9	46%	0.458	25%	0.246	S	C	.	.	H	α-helix	trans	-99.1	-0.5	179.7	-60.5	-58.9	-44.6	0	0	113.5	F444 C445 E446 W450	F444-Q448 HydrophobicContact CZ-CG 4.36Å; F444-Q448 WeakPolarHBondContact O-CG 3.41Å; F444-Q448 PolarHBondContact O-N 3.03Å; C445-Q448 CarbonylContact O-C 3.35Å; C445-Q448 PolarHBondContact O-N 3.29Å; E446-Q448 PolarHBondContact O-N 3.01Å; Q448-W450 VanDerWaalsContact C-N 3.31Å; Q448-W450 HydrophobicContact CB-CD2 3.75Å; Q448-W450 HydrophobicContact CB-CE3 4.16Å; Q448-W450 HydrophobicContact CB-CG 4.12Å; Q448-W450 HydrophobicContact CB-CH2 4.37Å; Q448-W450 HydrophobicContact CB-CZ2 3.95Å; Q448-W450 HydrophobicContact CB-CZ3 4.48Å; Q448-W450 HydrophobicContact CG-CH2 4.28Å; Q448-W450 HydrophobicContact CG-CZ2 4.21Å; Q448-W450 HydrophobicContact CG-CZ3 4.49Å; Q448-W450 PolarHBondContact O-N 2.63Å
449	N	84.6	Confident	88.2	Confident	150 Å²	150	49 Å²	49	80%	0.802	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.5	37.5	-172.7	-60.8	-55.7	0	0	0	114.5	C445 E446	C445-N449 WeakPolarHBondContact O-CA 3.43Å; C445-N449 PolarHBondContact O-N 3.29Å; E446-N449 PolarHBondContact O-N 3.3Å
450	W	85.9	Confident	88.5	Confident	46 Å²	46	47.8 Å²	47.8	17%	0.174	24%	0.238	C	C	.	.			trans	-93.2	149.4	173.9	-60.9	-20.5	0	0	0	111.6	F444 C445 Q448 F452 W678 L679	F444-W450 HydrophobicContact CD1-CZ3 4.24Å; F444-W450 HydrophobicContact CE1-CE3 4.38Å; F444-W450 HydrophobicContact CE1-CH2 4.16Å; F444-W450 AromaticContact CE1-CZ3 3.57Å; F444-W450 HydrophobicContact CE1-CZ3 3.57Å; F444-W450 HydrophobicContact CZ-CZ3 4.39Å; C445-W450 HydrophobicContact CB-CB 4.38Å; C445-W450 PolarHBondContact O-N 2.68Å; Q448-W450 VanDerWaalsContact C-N 3.31Å; Q448-W450 HydrophobicContact CB-CD2 3.75Å; Q448-W450 HydrophobicContact CB-CE3 4.16Å; Q448-W450 HydrophobicContact CB-CG 4.12Å; Q448-W450 HydrophobicContact CB-CH2 4.37Å; Q448-W450 HydrophobicContact CB-CZ2 3.95Å; Q448-W450 HydrophobicContact CB-CZ3 4.48Å; Q448-W450 HydrophobicContact CG-CH2 4.28Å; Q448-W450 HydrophobicContact CG-CZ2 4.21Å; Q448-W450 HydrophobicContact CG-CZ3 4.49Å; Q448-W450 PolarHBondContact O-N 2.63Å; W450-F452 PolarHBondContact O-N 3.44Å; W450-F452 VanDerWaalsContact O-N 3.12Å; W450-W678 AromaticContact CH2-CH2 3.92Å; W450-W678 HydrophobicContact CH2-CH2 3.92Å; W450-W678 HydrophobicContact CH2-CZ3 4.07Å; W450-W678 AromaticContact CZ2-CH2 3.56Å; W450-W678 HydrophobicContact CZ2-CH2 3.56Å; W450-W678 HydrophobicContact CZ2-CZ2 4.35Å; W450-W678 HydrophobicContact CZ2-CZ3 4.14Å; W450-L679 HydrophobicContact CB-CD2 4.27Å; W450-L679 HydrophobicContact CD2-CD1 4.09Å; W450-L679 HydrophobicContact CD2-CD2 4.09Å; W450-L679 HydrophobicContact CE3-CD1 3.42Å; W450-L679 VanDerWaalsContact CE3-CD1 3.42Å; W450-L679 HydrophobicContact CE3-CD2 4.07Å; W450-L679 HydrophobicContact CE3-CG 4.39Å; W450-L679 HydrophobicContact CG-CD2 4.18Å; W450-L679 HydrophobicContact CH2-CD1 4.04Å; W450-L679 HydrophobicContact CZ3-CD1 3.36Å
451	D	85.7	Confident	88.9	Confident	82 Å²	82	45.8 Å²	45.8	44%	0.439	23%	0.226	S	C	.	.			trans	-68.2	111	173.3	-174.2	0.3	0	0	0	110.4	L453 C454 A455	D451-L453 VanDerWaalsContact C-N 3.31Å; D451-L453 PolarHBondContact O-N 2.93Å; D451-L453 PolarHBondContact OD1-N 3.17Å; D451-C454 HydrophobicContact CB-CB 4.16Å; D451-C454 PolarHBondContact O-N 3.2Å; D451-C454 PolarHBondContact OD2-SG 2.82Å; D451-A455 WeakPolarHBondContact O-CB 3.46Å; D451-A455 PolarHBondContact O-N 3.17Å
452	F	86.7	Confident	89.3	Confident	8 Å²	8	47.3 Å²	47.3	4%	0.035	23%	0.231	C	C	.	.	H	α-helix	trans	-58.1	-40.1	-177.4	169.3	-109	0	0	0	112.9	L397 Q400 I401 M441 F442 C445 W450 A455 R456	L397-F452 HydrophobicContact CD1-CE1 3.99Å; L397-F452 HydrophobicContact CD1-CZ 3.96Å; L397-F452 HydrophobicContact CD2-CE1 4.49Å; L397-F452 HydrophobicContact CD2-CZ 4.03Å; Q400-F452 HydrophobicContact CB-CD1 4.39Å; I401-F452 HydrophobicContact CD1-CE1 4.12Å; M441-F452 HydrophobicContact CB-CE2 4.5Å; M441-F452 HydrophobicContact CE-CD2 4.11Å; M441-F452 HydrophobicContact CE-CE2 3.37Å; M441-F452 HydrophobicContact CE-CZ 3.93Å; M441-F452 HydrophobicContact CG-CE2 4.36Å; F442-F452 HydrophobicContact CB-CD2 3.84Å; F442-F452 HydrophobicContact CB-CE2 3.61Å; F442-F452 HydrophobicContact CB-CZ 4.2Å; F442-F452 HydrophobicContact CD2-CB 3.98Å; F442-F452 AromaticContact CD2-CD1 3.97Å; F442-F452 HydrophobicContact CD2-CD1 3.97Å; F442-F452 AromaticContact CD2-CD2 3.74Å; F442-F452 HydrophobicContact CD2-CD2 3.74Å; F442-F452 HydrophobicContact CD2-CE1 4.35Å; F442-F452 HydrophobicContact CD2-CE2 4.13Å; F442-F452 AromaticContact CD2-CG 3.63Å; F442-F452 HydrophobicContact CD2-CG 3.63Å; F442-F452 HydrophobicContact CD2-CZ 4.42Å; F442-F452 HydrophobicContact CE2-CB 4.4Å; F442-F452 HydrophobicContact CE2-CG 4.39Å; F442-F452 HydrophobicContact CG-CD2 4.3Å; F442-F452 HydrophobicContact CG-CE2 4.38Å; C445-F452 HydrophobicContact CB-CB 4.35Å; W450-F452 PolarHBondContact O-N 3.44Å; W450-F452 VanDerWaalsContact O-N 3.12Å; F452-A455 PolarHBondContact O-N 3.01Å; F452-R456 WeakPolarHBondContact O-CB 3.32Å; F452-R456 PolarHBondContact O-N 3.22Å
453	L	86.2	Confident	89.6	Confident	17 Å²	17	46.3 Å²	46.3	9%	0.089	23%	0.226	C	C	.	.	H	α-helix	trans	-69.8	-39.6	-176.1	-69.8	173.7	0	0	0	111.3	D451 R456 F457 V669	D451-L453 VanDerWaalsContact C-N 3.31Å; D451-L453 PolarHBondContact O-N 2.93Å; D451-L453 PolarHBondContact OD1-N 3.17Å; L453-R456 WeakPolarHBondContact O-CB 3.42Å; L453-F457 PolarHBondContact O-N 2.92Å; L453-V669 HydrophobicContact CB-CG1 4.28Å
454	C	87.6	Confident	90	Very high	3 Å²	3	44 Å²	44	2%	0.02	21%	0.21	C	C	.	.	H	α-helix	trans	-66.3	-45.9	174.3	-68.1	0	0	0	0	111.6	D451 R456 F457 W458 S673 I674	D451-C454 HydrophobicContact CB-CB 4.16Å; D451-C454 PolarHBondContact O-N 3.2Å; D451-C454 PolarHBondContact OD2-SG 2.82Å; C454-R456 VanDerWaalsContact C-N 3.32Å; C454-R456 PolarHBondContact O-N 2.98Å; C454-F457 WeakPolarHBondContact O-CB 2.79Å; C454-F457 PolarHBondContact O-N 3.11Å; C454-W458 PolarHBondContact O-N 3.23Å; C454-S673 PolarHBondContact SG-OG 2.83Å; C454-I674 HydrophobicContact CB-CD1 4.02Å; C454-I674 HydrophobicContact CB-CG1 3.67Å
455	A	88.7	Confident	90.4	Very high	6 Å²	6	41.4 Å²	41.4	5%	0.05	20%	0.201	C	C	.	.	H	α-helix	trans	-59.6	-44.3	175.7	0	0	0	0	0	111.4	D451 F452 F457 W458 V459 L679	D451-A455 WeakPolarHBondContact O-CB 3.46Å; D451-A455 PolarHBondContact O-N 3.17Å; F452-A455 PolarHBondContact O-N 3.01Å; A455-F457 VanDerWaalsContact C-N 3.32Å; A455-F457 PolarHBondContact O-N 2.76Å; A455-W458 PolarHBondContact O-N 3.19Å; A455-V459 WeakPolarHBondContact O-CG2 3.41Å; A455-V459 PolarHBondContact O-N 3.43Å; A455-L679 HydrophobicContact CB-CD2 4.33Å
456	R	90.6	Very high	90.8	Very high	2 Å²	2	42 Å²	42	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-56.2	-43.8	174.6	178.5	-167.9	-174.3	78.7	13.6	112	E438 M441 F452 L453 C454 W458 V459 G460 I737 P738 F739	E438-R456 IonicContact OE1-CZ 2.81Å; E438-R456 IonicContact OE1-NH1 3.42Å; E438-R456 PolarHBondContact OE1-NH1 3.49Å; E438-R456 IonicContact OE1-NH2 2.63Å; E438-R456 PolarHBondContact OE1-NH2 3.06Å; E438-R456 IonicContact OE2-CZ 2.73Å; E438-R456 IonicContact OE2-NH1 2.8Å; E438-R456 PolarHBondContact OE2-NH1 2.66Å; E438-R456 IonicContact OE2-NH2 2.82Å; E438-R456 PolarHBondContact OE2-NH2 3.31Å; M441-R456 HydrophobicContact CE-CB 3.7Å; M441-R456 HydrophobicContact CE-CG 3.95Å; F452-R456 WeakPolarHBondContact O-CB 3.32Å; F452-R456 PolarHBondContact O-N 3.22Å; L453-R456 WeakPolarHBondContact O-CB 3.42Å; C454-R456 VanDerWaalsContact C-N 3.32Å; C454-R456 PolarHBondContact O-N 2.98Å; R456-W458 PolarHBondContact O-N 2.96Å; R456-V459 PolarHBondContact O-N 3.36Å; R456-G460 PolarHBondContact O-N 3.37Å; R456-I737 PolarHBondContact NH2-O 3.03Å; R456-P738 VanDerWaalsContact NH2-CA 3.25Å; R456-F739 HydrophobicContact CG-CE2 4Å; R456-F739 HydrophobicContact CG-CZ 3.99Å; R456-F739 VanDerWaalsContact NH2-N 3.2Å
457	F	91.8	Very high	91.1	Very high	17 Å²	17	38 Å²	38	8%	0.075	19%	0.186	C	C	.	.	H	α-helix	trans	-57.7	-49.2	179	171.2	-89.4	0	0	0	111.5	L453 C454 A455 G460 F461 P671 L734	L453-F457 PolarHBondContact O-N 2.92Å; C454-F457 WeakPolarHBondContact O-CB 2.79Å; C454-F457 PolarHBondContact O-N 3.11Å; A455-F457 VanDerWaalsContact C-N 3.32Å; A455-F457 PolarHBondContact O-N 2.76Å; F457-G460 PolarHBondContact O-N 3.15Å; F457-F461 HydrophobicContact CE1-CB 4.48Å; F457-F461 WeakPolarHBondContact O-CB 3.37Å; F457-F461 PolarHBondContact O-N 2.73Å; F457-P671 HydrophobicContact CD1-CB 3.56Å; F457-P671 HydrophobicContact CD2-CB 4.45Å; F457-P671 HydrophobicContact CE1-CB 3.32Å; F457-P671 HydrophobicContact CE1-CG 4.34Å; F457-P671 HydrophobicContact CE2-CB 4.26Å; F457-P671 HydrophobicContact CG-CB 4.15Å; F457-P671 HydrophobicContact CZ-CB 3.7Å; F457-P671 HydrophobicContact CZ-CG 4.3Å; F457-L734 HydrophobicContact CD2-CD2 4.43Å; F457-L734 HydrophobicContact CE2-CD2 3.57Å; F457-L734 HydrophobicContact CE2-CG 4.07Å; F457-L734 HydrophobicContact CZ-CD2 4.36Å
458	W	92.8	Very high	91.4	Very high	58 Å²	58	35.4 Å²	35.4	22%	0.22	17%	0.171	C	C	.	.	H	α-helix	trans	-69.4	-36.6	-179.3	-75.3	95.9	0	0	0	113.1	C454 A455 R456 F461 W462 P671 I674 A683	C454-W458 PolarHBondContact O-N 3.23Å; A455-W458 PolarHBondContact O-N 3.19Å; R456-W458 PolarHBondContact O-N 2.96Å; W458-F461 HydrophobicContact CE3-CD1 4.04Å; W458-F461 HydrophobicContact CZ3-CD1 4.04Å; W458-F461 HydrophobicContact CZ3-CE1 4.25Å; W458-F461 PolarHBondContact O-N 3.45Å; W458-W462 PolarHBondContact O-N 2.82Å; W458-P671 PolarHBondContact NE1-O 2.58Å; W458-I674 HydrophobicContact CG-CD1 4.23Å; W458-A683 HydrophobicContact CB-CB 3.87Å
459	V	93.3	Very high	91.8	Very high	5 Å²	5	34.3 Å²	34.3	3%	0.03	17%	0.168	C	C	.	.	H	α-helix	trans	-59.4	-49.6	172.4	172.8	0	0	0	0	110.1	F437 M441 A455 R456 F461 W462 T463 A683 P686 A687	F437-V459 HydrophobicContact CE1-CG1 4.11Å; F437-V459 HydrophobicContact CZ-CG1 4.08Å; M441-V459 HydrophobicContact SD-CB 4.17Å; M441-V459 HydrophobicContact SD-CG1 4.28Å; M441-V459 HydrophobicContact SD-CG2 3.88Å; A455-V459 WeakPolarHBondContact O-CG2 3.41Å; A455-V459 PolarHBondContact O-N 3.43Å; R456-V459 PolarHBondContact O-N 3.36Å; V459-F461 PolarHBondContact O-N 2.93Å; V459-W462 PolarHBondContact O-N 3.42Å; V459-T463 WeakPolarHBondContact O-CB 3.22Å; V459-T463 PolarHBondContact O-N 3.42Å; V459-T463 PolarHBondContact O-OG1 3.23Å; V459-A683 HydrophobicContact CG2-CB 3.96Å; V459-P686 HydrophobicContact CG2-CG 4.06Å; V459-A687 HydrophobicContact CG1-CB 4.25Å; V459-A687 WeakPolarHBondContact O-CB 3.47Å
460	G	94.4	Very high	92.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-65.4	-35.9	178.8	0	0	0	0	0	113.9	R456 F457 T463 S464 S733	R456-G460 PolarHBondContact O-N 3.37Å; F457-G460 PolarHBondContact O-N 3.15Å; G460-T463 PolarHBondContact O-N 3.32Å; G460-S464 PolarHBondContact O-N 3.19Å; G460-S733 WeakPolarHBondContact CA-OG 3.39Å
461	F	94.4	Very high	92.5	Very high	70 Å²	70	27.2 Å²	27.2	31%	0.307	13%	0.131	S	C	.	.	H	α-helix	trans	-63.2	-49.8	173.8	-179.3	-101.5	0	0	0	112	F457 W458 V459 T463 S464 I465	F457-F461 HydrophobicContact CE1-CB 4.48Å; F457-F461 WeakPolarHBondContact O-CB 3.37Å; F457-F461 PolarHBondContact O-N 2.73Å; W458-F461 HydrophobicContact CE3-CD1 4.04Å; W458-F461 HydrophobicContact CZ3-CD1 4.04Å; W458-F461 HydrophobicContact CZ3-CE1 4.25Å; W458-F461 PolarHBondContact O-N 3.45Å; V459-F461 PolarHBondContact O-N 2.93Å; F461-T463 VanDerWaalsContact C-N 3.34Å; F461-T463 PolarHBondContact O-N 2.74Å; F461-S464 WeakPolarHBondContact O-CB 3.34Å; F461-S464 PolarHBondContact O-N 3.43Å; F461-I465 HydrophobicContact CD1-CD1 3.98Å; F461-I465 HydrophobicContact CE1-CD1 3.44Å; F461-I465 VanDerWaalsContact CE1-CD1 3.44Å; F461-I465 HydrophobicContact CE1-CG1 4.5Å; F461-I465 HydrophobicContact CZ-CD1 3.81Å; F461-I465 PolarHBondContact O-N 3.35Å; F461-I465 VanDerWaalsContact O-N 3.15Å
462	W	96.1	Very high	92.8	Very high	50 Å²	50	23.9 Å²	23.9	19%	0.189	12%	0.115	C	C	.	.	H	α-helix	trans	-64.6	-38.2	175.7	-78.2	117.3	0	0	0	112.4	W458 V459 S464 I465 V466 S680 L681 I684 A687	W458-W462 PolarHBondContact O-N 2.82Å; V459-W462 PolarHBondContact O-N 3.42Å; W462-S464 VanDerWaalsContact C-N 3.3Å; W462-S464 PolarHBondContact O-N 3.36Å; W462-I465 HydrophobicContact CE3-CB 4.41Å; W462-I465 HydrophobicContact CE3-CD1 3.9Å; W462-I465 HydrophobicContact CZ3-CD1 3.97Å; W462-I465 PolarHBondContact O-N 3.27Å; W462-I465 VanDerWaalsContact O-N 3.14Å; W462-V466 WeakPolarHBondContact O-CG2 3.28Å; W462-V466 PolarHBondContact O-N 3.11Å; W462-S680 PolarHBondContact NE1-O 3.2Å; W462-L681 HydrophobicContact CZ2-CD2 4.38Å; W462-I684 HydrophobicContact CB-CG1 4.48Å; W462-I684 HydrophobicContact CD2-CB 4.17Å; W462-I684 HydrophobicContact CD2-CD1 4.16Å; W462-I684 HydrophobicContact CD2-CG1 3.98Å; W462-I684 HydrophobicContact CE3-CD1 3.77Å; W462-I684 HydrophobicContact CE3-CG1 3.96Å; W462-I684 HydrophobicContact CG-CB 4.19Å; W462-I684 HydrophobicContact CG-CG1 4.22Å; W462-I684 HydrophobicContact CH2-CD1 4.34Å; W462-I684 HydrophobicContact CZ3-CD1 3.87Å; W462-A687 HydrophobicContact CB-CB 3.45Å; W462-A687 VanDerWaalsContact CB-CB 3.45Å
463	T	95.6	Very high	93	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.3	-43.4	174.6	-67.5	0	0	0	0	110.6	V459 G460 F461 I465 V466 L467 A687 F690 S691 I694 M729	V459-T463 WeakPolarHBondContact O-CB 3.22Å; V459-T463 PolarHBondContact O-N 3.42Å; V459-T463 PolarHBondContact O-OG1 3.23Å; G460-T463 PolarHBondContact O-N 3.32Å; F461-T463 VanDerWaalsContact C-N 3.34Å; F461-T463 PolarHBondContact O-N 2.74Å; T463-I465 VanDerWaalsContact C-N 3.35Å; T463-I465 PolarHBondContact O-N 3.25Å; T463-V466 PolarHBondContact O-N 3.43Å; T463-L467 HydrophobicContact CG2-CD1 4.01Å; T463-L467 HydrophobicContact CG2-CG 4.23Å; T463-L467 WeakPolarHBondContact O-CB 3.43Å; T463-L467 WeakPolarHBondContact O-CG 3.48Å; T463-L467 PolarHBondContact O-N 3.36Å; T463-A687 WeakPolarHBondContact OG1-CA 3.24Å; T463-A687 WeakPolarHBondContact OG1-CB 3.48Å; T463-A687 PolarHBondContact OG1-O 3.47Å; T463-F690 HydrophobicContact CG2-CD1 4.06Å; T463-S691 WeakPolarHBondContact CA-OG 3.44Å; T463-S691 WeakPolarHBondContact CG2-OG 3.33Å; T463-I694 HydrophobicContact CG2-CD1 3.62Å; T463-M729 HydrophobicContact CG2-CE 3.61Å; T463-M729 HydrophobicContact CG2-CG 4.4Å
464	S	96.2	Very high	93.1	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.014	14%	0.135	C	C	.	.	H	α-helix	trans	-58.2	-44.6	173.7	-179	0	0	0	0	112.5	G460 F461 W462 L467 L468 S726 I730	G460-S464 PolarHBondContact O-N 3.19Å; F461-S464 WeakPolarHBondContact O-CB 3.34Å; F461-S464 PolarHBondContact O-N 3.43Å; W462-S464 VanDerWaalsContact C-N 3.3Å; W462-S464 PolarHBondContact O-N 3.36Å; S464-L467 PolarHBondContact O-N 3.1Å; S464-L468 WeakPolarHBondContact O-CG 2.95Å; S464-L468 PolarHBondContact O-N 3.18Å; S464-S726 WeakPolarHBondContact CB-O 3.01Å; S464-S726 PolarHBondContact OG-O 2.93Å; S464-I730 WeakPolarHBondContact OG-CD1 3.41Å; S464-I730 WeakPolarHBondContact OG-CG1 3.47Å
465	I	96.2	Very high	93	Very high	56 Å²	56	29.5 Å²	29.5	29%	0.287	14%	0.142	S	C	.	.	H	α-helix	trans	-63	-46.5	178.8	-67.6	173.2	0	0	0	110.8	F461 W462 T463 L467 L468 I469	F461-I465 HydrophobicContact CD1-CD1 3.98Å; F461-I465 HydrophobicContact CE1-CD1 3.44Å; F461-I465 VanDerWaalsContact CE1-CD1 3.44Å; F461-I465 HydrophobicContact CE1-CG1 4.5Å; F461-I465 HydrophobicContact CZ-CD1 3.81Å; F461-I465 PolarHBondContact O-N 3.35Å; F461-I465 VanDerWaalsContact O-N 3.15Å; W462-I465 HydrophobicContact CE3-CB 4.41Å; W462-I465 HydrophobicContact CE3-CD1 3.9Å; W462-I465 HydrophobicContact CZ3-CD1 3.97Å; W462-I465 PolarHBondContact O-N 3.27Å; W462-I465 VanDerWaalsContact O-N 3.14Å; T463-I465 VanDerWaalsContact C-N 3.35Å; T463-I465 PolarHBondContact O-N 3.25Å; I465-L467 VanDerWaalsContact C-N 3.34Å; I465-L467 PolarHBondContact O-N 3.46Å; I465-L468 PolarHBondContact O-N 3.06Å; I465-I469 HydrophobicContact CG2-CD1 4.03Å; I465-I469 WeakPolarHBondContact O-CG1 3.47Å; I465-I469 PolarHBondContact O-N 3.23Å
466	V	95.6	Very high	92.8	Very high	16 Å²	16	29.2 Å²	29.2	10%	0.097	14%	0.14	C	C	.	.	H	α-helix	trans	-64.5	-39.6	179.6	174.9	0	0	0	0	111.2	W462 T463 L468 I469 F470 S691	W462-V466 WeakPolarHBondContact O-CG2 3.28Å; W462-V466 PolarHBondContact O-N 3.11Å; T463-V466 PolarHBondContact O-N 3.43Å; V466-L468 PolarHBondContact O-N 3.47Å; V466-I469 WeakPolarHBondContact O-CB 3.44Å; V466-I469 PolarHBondContact O-N 2.99Å; V466-F470 HydrophobicContact CG1-CD2 4.3Å; V466-F470 HydrophobicContact CG1-CE1 4.45Å; V466-F470 HydrophobicContact CG1-CE2 3.78Å; V466-F470 HydrophobicContact CG1-CZ 3.86Å; V466-F470 WeakPolarHBondContact O-CG 3.34Å; V466-F470 PolarHBondContact O-N 3.45Å; V466-S691 WeakPolarHBondContact CB-OG 3.4Å
467	L	96	Very high	92.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.9	-42.1	173.3	-70.2	-179.9	0	0	0	111.8	T463 S464 I465 I469 F470 V471 I694 L722 I725 M729	T463-L467 HydrophobicContact CG2-CD1 4.01Å; T463-L467 HydrophobicContact CG2-CG 4.23Å; T463-L467 WeakPolarHBondContact O-CB 3.43Å; T463-L467 WeakPolarHBondContact O-CG 3.48Å; T463-L467 PolarHBondContact O-N 3.36Å; S464-L467 PolarHBondContact O-N 3.1Å; I465-L467 VanDerWaalsContact C-N 3.34Å; I465-L467 PolarHBondContact O-N 3.46Å; L467-I469 VanDerWaalsContact C-N 3.31Å; L467-I469 PolarHBondContact O-N 3.29Å; L467-F470 HydrophobicContact CD2-CD2 4.21Å; L467-F470 WeakPolarHBondContact O-CB 3.19Å; L467-F470 PolarHBondContact O-N 3.23Å; L467-V471 WeakPolarHBondContact O-CG2 3.4Å; L467-V471 PolarHBondContact O-N 3.09Å; L467-I694 HydrophobicContact CD1-CD1 4.4Å; L467-I694 HydrophobicContact CD1-CG2 3.97Å; L467-I694 HydrophobicContact CD2-CB 4.42Å; L467-I694 HydrophobicContact CD2-CG2 4.19Å; L467-L722 HydrophobicContact CD2-CD1 3.79Å; L467-L722 HydrophobicContact CD2-CG 4.33Å; L467-I725 HydrophobicContact CD1-CG2 4.21Å; L467-M729 HydrophobicContact CD1-CG 4.28Å
468	L	95.1	Very high	91.8	Very high	58 Å²	58	32 Å²	32	30%	0.304	16%	0.155	S	C	.	.	H	α-helix	trans	-64.4	-34.9	174.1	-72.7	172.8	0	0	0	112.4	S464 I465 V466 V471 A472 T723 S726	S464-L468 WeakPolarHBondContact O-CG 2.95Å; S464-L468 PolarHBondContact O-N 3.18Å; I465-L468 PolarHBondContact O-N 3.06Å; V466-L468 PolarHBondContact O-N 3.47Å; L468-V471 PolarHBondContact O-N 2.79Å; L468-A472 VanDerWaalsContact O-CB 3.26Å; L468-A472 WeakPolarHBondContact O-CB 3.48Å; L468-A472 PolarHBondContact O-N 2.96Å; L468-T723 HydrophobicContact CD2-CG2 4.37Å; L468-S726 WeakPolarHBondContact CD2-OG 3.37Å
469	I	94.5	Very high	91.2	Very high	75 Å²	75	29.9 Å²	29.9	39%	0.385	15%	0.148	S	C	.	.	H	α-helix	trans	-62.7	-44.1	172	-70.9	168.4	0	0	0	110.3	I465 V466 L467 V471 A472 F473	I465-I469 HydrophobicContact CG2-CD1 4.03Å; I465-I469 WeakPolarHBondContact O-CG1 3.47Å; I465-I469 PolarHBondContact O-N 3.23Å; V466-I469 WeakPolarHBondContact O-CB 3.44Å; V466-I469 PolarHBondContact O-N 2.99Å; L467-I469 VanDerWaalsContact C-N 3.31Å; L467-I469 PolarHBondContact O-N 3.29Å; I469-V471 VanDerWaalsContact C-N 3.35Å; I469-V471 PolarHBondContact O-N 3.04Å; I469-A472 PolarHBondContact O-N 3.38Å; I469-F473 HydrophobicContact CG2-CD2 3.69Å; I469-F473 HydrophobicContact CG2-CE2 3.81Å; I469-F473 VanDerWaalsContact O-CD2 3.28Å; I469-F473 WeakPolarHBondContact O-CD2 3.34Å; I469-F473 PolarHBondContact O-N 3.01Å
470	F	92.9	Very high	90.4	Very high	47 Å²	47	30.9 Å²	30.9	21%	0.206	16%	0.155	C	C	.	.	H	α-helix	trans	-61.7	-41.1	174.7	-70	-28.5	0	0	0	112.5	V466 L467 D474 A475 I692 L695 L722	V466-F470 HydrophobicContact CG1-CD2 4.3Å; V466-F470 HydrophobicContact CG1-CE1 4.45Å; V466-F470 HydrophobicContact CG1-CE2 3.78Å; V466-F470 HydrophobicContact CG1-CZ 3.86Å; V466-F470 WeakPolarHBondContact O-CG 3.34Å; V466-F470 PolarHBondContact O-N 3.45Å; L467-F470 HydrophobicContact CD2-CD2 4.21Å; L467-F470 WeakPolarHBondContact O-CB 3.19Å; L467-F470 PolarHBondContact O-N 3.23Å; F470-D474 PolarHBondContact O-N 2.97Å; F470-A475 HydrophobicContact CB-CB 3.8Å; F470-A475 HydrophobicContact CD1-CB 4.07Å; F470-A475 HydrophobicContact CG-CB 4.19Å; F470-A475 VanDerWaalsContact O-CB 3.3Å; F470-A475 WeakPolarHBondContact O-CB 3.5Å; F470-A475 PolarHBondContact O-N 2.98Å; F470-I692 HydrophobicContact CZ-CG1 4.38Å; F470-L695 HydrophobicContact CB-CD1 4.41Å; F470-L695 HydrophobicContact CD2-CB 4.34Å; F470-L695 HydrophobicContact CD2-CD1 4.28Å; F470-L695 HydrophobicContact CD2-CD2 3.9Å; F470-L695 HydrophobicContact CD2-CG 4.4Å; F470-L695 HydrophobicContact CE2-CB 4.47Å; F470-L695 HydrophobicContact CE2-CD2 4.05Å; F470-L695 HydrophobicContact CG-CD2 4.3Å; F470-L722 HydrophobicContact CB-CD2 4.14Å
471	V	93.1	Very high	89.6	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.6	-44.6	172.4	175.8	0	0	0	0	110.9	F342 L345 L467 L468 I469 F473 D474 H719 L722	F342-V471 HydrophobicContact CD1-CG1 3.99Å; F342-V471 HydrophobicContact CE1-CG1 4.28Å; L345-V471 HydrophobicContact CB-CG1 3.89Å; L345-V471 HydrophobicContact CD2-CG1 4.16Å; L345-V471 HydrophobicContact CG-CG1 4.46Å; L467-V471 WeakPolarHBondContact O-CG2 3.4Å; L467-V471 PolarHBondContact O-N 3.09Å; L468-V471 PolarHBondContact O-N 2.79Å; I469-V471 VanDerWaalsContact C-N 3.35Å; I469-V471 PolarHBondContact O-N 3.04Å; V471-F473 VanDerWaalsContact C-N 3.31Å; V471-F473 PolarHBondContact O-N 3.02Å; V471-D474 PolarHBondContact O-N 3.35Å; V471-H719 HydrophobicContact CG1-CB 4.28Å; V471-L722 HydrophobicContact CG2-CB 3.85Å; V471-L722 HydrophobicContact CG2-CD2 3.69Å; V471-L722 HydrophobicContact CG2-CG 3.91Å
472	A	91.9	Very high	88.9	Confident	11 Å²	11	31.1 Å²	31.1	9%	0.091	16%	0.156	C	C	.	.	H	α-helix	trans	-63	-35.7	-176.6	0	0	0	0	0	112.9	I341 F342 L468 I469	I341-A472 WeakPolarHBondContact CA-O 3.41Å; I341-A472 HydrophobicContact CG2-CB 3.93Å; F342-A472 HydrophobicContact CD1-CB 4.33Å; F342-A472 HydrophobicContact CD2-CB 4.41Å; F342-A472 HydrophobicContact CE1-CB 3.99Å; F342-A472 HydrophobicContact CE2-CB 4.06Å; F342-A472 HydrophobicContact CZ-CB 3.85Å; F342-A472 PolarHBondContact N-O 3.26Å; L468-A472 VanDerWaalsContact O-CB 3.26Å; L468-A472 WeakPolarHBondContact O-CB 3.48Å; L468-A472 PolarHBondContact O-N 2.96Å; I469-A472 PolarHBondContact O-N 3.38Å
473	F	90.3	Very high	88.2	Confident	121 Å²	121	29 Å²	29	53%	0.531	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	8.1	-179.8	-72.7	-65.2	0	0	0	114.9	R337 I469 V471 A475	R337-F473 PolarHBondContact NE-O 3.47Å; R337-F473 PolarHBondContact NH2-O 3.04Å; I469-F473 HydrophobicContact CG2-CD2 3.69Å; I469-F473 HydrophobicContact CG2-CE2 3.81Å; I469-F473 VanDerWaalsContact O-CD2 3.28Å; I469-F473 WeakPolarHBondContact O-CD2 3.34Å; I469-F473 PolarHBondContact O-N 3.01Å; V471-F473 VanDerWaalsContact C-N 3.31Å; V471-F473 PolarHBondContact O-N 3.02Å; F473-A475 VanDerWaalsContact C-N 3.33Å
474	D	88	Confident	87.4	Confident	5 Å²	5	30.8 Å²	30.8	3%	0.027	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	38.5	-174.8	-60.2	-22.9	0	0	0	113	R337 T338 G344 F470 V471 S476 V477	R337-D474 HydrophobicContact CG-CB 4.03Å; T338-D474 WeakPolarHBondContact CB-OD2 3.3Å; T338-D474 PolarHBondContact N-OD2 3.31Å; T338-D474 PolarHBondContact OG1-OD2 3.08Å; G344-D474 WeakPolarHBondContact CA-OD1 3.36Å; G344-D474 PolarHBondContact N-OD1 2.97Å; F470-D474 PolarHBondContact O-N 2.97Å; V471-D474 PolarHBondContact O-N 3.35Å; D474-S476 PolarHBondContact O-N 3.1Å; D474-V477 HydrophobicContact CB-CG2 3.97Å; D474-V477 VanDerWaalsContact O-CB 3.31Å; D474-V477 WeakPolarHBondContact O-CB 3.47Å; D474-V477 VanDerWaalsContact O-CG2 3.31Å; D474-V477 WeakPolarHBondContact O-CG2 3.29Å; D474-V477 PolarHBondContact O-N 2.93Å; D474-V477 VanDerWaalsContact O-N 3.09Å
475	A	85.4	Confident	86.8	Confident	20 Å²	20	30.7 Å²	30.7	17%	0.165	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-61.9	-29.9	-176.7	0	0	0	0	0	113.2	F470 F473 V477 M478	F470-A475 HydrophobicContact CB-CB 3.8Å; F470-A475 HydrophobicContact CD1-CB 4.07Å; F470-A475 HydrophobicContact CG-CB 4.19Å; F470-A475 VanDerWaalsContact O-CB 3.3Å; F470-A475 WeakPolarHBondContact O-CB 3.5Å; F470-A475 PolarHBondContact O-N 2.98Å; F473-A475 VanDerWaalsContact C-N 3.33Å; A475-V477 PolarHBondContact O-N 3.27Å; A475-M478 WeakPolarHBondContact O-CB 3.35Å; A475-M478 WeakPolarHBondContact O-CG 3.37Å; A475-M478 PolarHBondContact O-N 3.42Å; A475-M478 VanDerWaalsContact O-N 3.1Å
476	S	85.4	Confident	86.2	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-59.4	-16.3	176.3	-46.6	0	0	0	0	113	F335 D474 M478 V479 H719	F335-S476 WeakPolarHBondContact CE1-O 3.33Å; D474-S476 PolarHBondContact O-N 3.1Å; S476-M478 PolarHBondContact O-N 2.82Å; S476-M478 VanDerWaalsContact O-N 3.17Å; S476-V479 WeakPolarHBondContact O-CB 2.99Å; S476-V479 WeakPolarHBondContact O-CG2 3.35Å; S476-V479 PolarHBondContact O-N 2.96Å; S476-H719 VanDerWaalsContact CB-CE1 3.4Å; S476-H719 WeakPolarHBondContact CB-CE1 3.3Å; S476-H719 PolarHBondContact OG-ND1 2.94Å
477	V	83.4	Confident	85.4	Confident	6 Å²	6	28.3 Å²	28.3	4%	0.036	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-59.9	-24.3	174.4	175.1	0	0	0	0	113.1	F335 D474 A475 V479 S480 V913	F335-V477 HydrophobicContact CD1-CB 4.41Å; F335-V477 HydrophobicContact CD1-CG2 4.2Å; F335-V477 VanDerWaalsContact CE1-CA 3.41Å; F335-V477 HydrophobicContact CE1-CB 4.17Å; F335-V477 HydrophobicContact CE1-CG2 3.8Å; F335-V477 HydrophobicContact CE2-CG2 4.47Å; F335-V477 HydrophobicContact CZ-CG2 3.94Å; D474-V477 HydrophobicContact CB-CG2 3.97Å; D474-V477 VanDerWaalsContact O-CB 3.31Å; D474-V477 WeakPolarHBondContact O-CB 3.47Å; D474-V477 VanDerWaalsContact O-CG2 3.31Å; D474-V477 WeakPolarHBondContact O-CG2 3.29Å; D474-V477 PolarHBondContact O-N 2.93Å; D474-V477 VanDerWaalsContact O-N 3.09Å; A475-V477 PolarHBondContact O-N 3.27Å; V477-V479 PolarHBondContact O-N 3.21Å; V477-V479 VanDerWaalsContact O-N 3.09Å; V477-S480 WeakPolarHBondContact O-CB 3.45Å; V477-S480 PolarHBondContact O-N 3.1Å; V477-S480 PolarHBondContact O-OG 3.34Å; V477-V913 HydrophobicContact CG1-CG1 3.34Å
478	M	78.4	Confident	84.9	Confident	73 Å²	73	28.3 Å²	28.3	36%	0.36	14%	0.141	S	C	.	.	G	3₁₀ helix	trans	-58.2	-22.5	173.8	-69.1	173.9	58.4	0	0	113.4	A475 S476 S480 W481	A475-M478 WeakPolarHBondContact O-CB 3.35Å; A475-M478 WeakPolarHBondContact O-CG 3.37Å; A475-M478 PolarHBondContact O-N 3.42Å; A475-M478 VanDerWaalsContact O-N 3.1Å; S476-M478 PolarHBondContact O-N 2.82Å; S476-M478 VanDerWaalsContact O-N 3.17Å; M478-S480 PolarHBondContact O-N 2.89Å; M478-S480 VanDerWaalsContact O-N 3.15Å; M478-W481 HydrophobicContact CB-CE3 4.22Å; M478-W481 HydrophobicContact CB-CZ3 4.21Å; M478-W481 HydrophobicContact CE-CZ3 4.07Å; M478-W481 HydrophobicContact CG-CE3 4.41Å; M478-W481 HydrophobicContact CG-CH2 4.31Å; M478-W481 HydrophobicContact CG-CZ3 3.89Å; M478-W481 PolarHBondContact O-N 3.23Å; M478-W481 VanDerWaalsContact O-N 3.12Å
479	V	79.4	Confident	84.4	Confident	13 Å²	13	25.5 Å²	25.5	8%	0.079	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-51.9	-32.4	171.2	160.1	0	0	0	0	113	S476 V477 W481 I482 N699 V703 Y718	S476-V479 WeakPolarHBondContact O-CB 2.99Å; S476-V479 WeakPolarHBondContact O-CG2 3.35Å; S476-V479 PolarHBondContact O-N 2.96Å; V477-V479 PolarHBondContact O-N 3.21Å; V477-V479 VanDerWaalsContact O-N 3.09Å; V479-W481 PolarHBondContact O-N 2.66Å; V479-I482 WeakPolarHBondContact O-CB 3.33Å; V479-I482 PolarHBondContact O-N 3.46Å; V479-N699 HydrophobicContact CG2-CB 3.53Å; V479-V703 HydrophobicContact CB-CG2 4.18Å; V479-V703 HydrophobicContact CG1-CB 4.43Å; V479-V703 HydrophobicContact CG1-CG2 3.03Å; V479-V703 HydrophobicContact CG2-CG2 4.17Å; V479-Y718 HydrophobicContact CG1-CE2 4.37Å
480	S	76	Confident	83.8	Confident	25 Å²	25	22.3 Å²	22.3	18%	0.175	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-60.9	-10.5	179.6	62.3	0	0	0	0	114.5	V477 M478 P908 V913	V477-S480 WeakPolarHBondContact O-CB 3.45Å; V477-S480 PolarHBondContact O-N 3.1Å; V477-S480 PolarHBondContact O-OG 3.34Å; M478-S480 PolarHBondContact O-N 2.89Å; M478-S480 VanDerWaalsContact O-N 3.15Å; S480-P908 WeakPolarHBondContact O-CG 3.27Å; S480-V913 WeakPolarHBondContact OG-CG1 3.29Å
481	W	77.7	Confident	83.1	Confident	45 Å²	45	20.1 Å²	20.1	17%	0.17	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-88.1	-15.7	173.4	-60.8	-29.1	0	0	0	114	M478 V479 I884 W910 M914	M478-W481 HydrophobicContact CB-CE3 4.22Å; M478-W481 HydrophobicContact CB-CZ3 4.21Å; M478-W481 HydrophobicContact CE-CZ3 4.07Å; M478-W481 HydrophobicContact CG-CE3 4.41Å; M478-W481 HydrophobicContact CG-CH2 4.31Å; M478-W481 HydrophobicContact CG-CZ3 3.89Å; M478-W481 PolarHBondContact O-N 3.23Å; M478-W481 VanDerWaalsContact O-N 3.12Å; V479-W481 PolarHBondContact O-N 2.66Å; W481-I884 HydrophobicContact CB-CG2 3.96Å; W481-W910 AromaticContact CH2-CD1 3.96Å; W481-W910 AromaticContact CH2-NE1 3.81Å; W481-W910 AromaticContact CZ2-CD1 3.55Å; W481-W910 AromaticContact CZ2-NE1 3.84Å; W481-M914 HydrophobicContact CH2-CE 4.32Å
482	I	80	Confident	82.7	Confident	30 Å²	30	20.1 Å²	20.1	15%	0.154	10%	0.101	C	C	.	.			trans	-73.4	139.8	170.4	-59.4	169.3	0	0	0	108.1	V479 E487 I700 V703 I884	V479-I482 WeakPolarHBondContact O-CB 3.33Å; V479-I482 PolarHBondContact O-N 3.46Å; I482-E487 HydrophobicContact CG2-CG 3.6Å; I482-I700 HydrophobicContact CD1-CG1 3.79Å; I482-V703 HydrophobicContact CB-CG1 4.4Å; I482-V703 HydrophobicContact CD1-CG2 4.48Å; I482-V703 HydrophobicContact CG2-CG1 3.92Å; I482-I884 HydrophobicContact CG1-CD1 3.94Å
483	T	80.7	Confident	82.5	Confident	5 Å²	5	19.7 Å²	19.7	3%	0.031	10%	0.097	C	C	.	.			trans	-146.2	172.6	-177	50.2	0	0	0	0	112.8	F485 T486 E487 R887 D905	T483-F485 VanDerWaalsContact C-N 3.25Å; T483-F485 PolarHBondContact O-N 3.33Å; T483-T486 PolarHBondContact N-OG1 3.29Å; T483-T486 VanDerWaalsContact N-OG1 3.15Å; T483-T486 PolarHBondContact O-N 2.9Å; T483-T486 PolarHBondContact O-OG1 3.29Å; T483-E487 WeakPolarHBondContact O-CG 3.25Å; T483-E487 PolarHBondContact O-N 3.36Å; T483-R887 VanDerWaalsContact CG2-NH2 3.27Å; T483-R887 WeakPolarHBondContact OG1-CD 3.4Å; T483-R887 PolarHBondContact OG1-NE 3.38Å; T483-R887 PolarHBondContact OG1-NH1 3.26Å; T483-R887 PolarHBondContact OG1-NH2 2.93Å; T483-D905 HydrophobicContact CG2-CB 4.05Å
484	R	79.6	Confident	81.9	Confident	38 Å²	38	14.3 Å²	14.3	14%	0.143	7%	0.073	C	C	.	.	H	α-helix	trans	-42	-45.5	177.4	-165	-172.2	-168.7	125	27.9	114.6	T486 E487 E488 D709 D904	R484-T486 PolarHBondContact O-N 2.88Å; R484-E487 PolarHBondContact O-N 3.33Å; R484-E488 HydrophobicContact CG-CG 4.05Å; R484-E488 WeakPolarHBondContact CG-OE1 3.2Å; R484-E488 IonicContact CZ-OE1 2.79Å; R484-E488 IonicContact NE-OE1 3.97Å; R484-E488 PolarHBondContact NE-OE1 3.08Å; R484-E488 IonicContact NH2-OE1 2.9Å; R484-E488 VanDerWaalsContact O-CB 3.3Å; R484-E488 WeakPolarHBondContact O-CB 3.43Å; R484-E488 VanDerWaalsContact O-CG 3.3Å; R484-E488 WeakPolarHBondContact O-CG 3.12Å; R484-E488 PolarHBondContact O-N 3.01Å; R484-D709 IonicContact CZ-OD2 3.18Å; R484-D709 IonicContact NH2-OD2 3.92Å; R484-D709 PolarHBondContact NH2-OD2 2.99Å; R484-D904 VanDerWaalsContact CB-OD1 3.3Å; R484-D904 WeakPolarHBondContact CB-OD1 3.36Å; R484-D904 PolarHBondContact N-OD1 3.34Å
485	F	84.3	Confident	81.5	Confident	1 Å²	1	14.5 Å²	14.5	0%	0.004	8%	0.075	C	C	.	.	H	α-helix	trans	-55.5	-51.8	176.8	176.1	-93.2	0	0	0	113.3	T483 A489 F852 V855 Q856 L883 R887 L891 D904	T483-F485 VanDerWaalsContact C-N 3.25Å; T483-F485 PolarHBondContact O-N 3.33Å; F485-A489 PolarHBondContact O-N 3.11Å; F485-F852 HydrophobicContact CB-CZ 4.4Å; F485-F852 HydrophobicContact CD2-CE1 4.2Å; F485-F852 AromaticContact CD2-CE2 3.87Å; F485-F852 HydrophobicContact CD2-CE2 3.87Å; F485-F852 AromaticContact CD2-CZ 3.58Å; F485-F852 HydrophobicContact CD2-CZ 3.58Å; F485-F852 HydrophobicContact CE2-CE2 4.44Å; F485-F852 HydrophobicContact CE2-CZ 4.39Å; F485-F852 HydrophobicContact CG-CZ 4.45Å; F485-V855 HydrophobicContact CE2-CG1 4.49Å; F485-V855 HydrophobicContact CZ-CG1 4.2Å; F485-Q856 HydrophobicContact CD2-CB 4.18Å; F485-Q856 HydrophobicContact CD2-CG 3.93Å; F485-Q856 HydrophobicContact CE2-CB 3.44Å; F485-Q856 VanDerWaalsContact CE2-CB 3.44Å; F485-Q856 HydrophobicContact CE2-CG 3.55Å; F485-Q856 HydrophobicContact CZ-CB 4.03Å; F485-Q856 HydrophobicContact CZ-CG 4.03Å; F485-Q856 PolarHBondContact O-NE2 2.99Å; F485-L883 HydrophobicContact CE1-CD2 4.35Å; F485-R887 HydrophobicContact CD1-CB 4.45Å; F485-R887 HydrophobicContact CD1-CG 4.36Å; F485-L891 HydrophobicContact CD2-CD1 4.42Å; F485-L891 HydrophobicContact CG-CD1 4.44Å; F485-D904 PolarHBondContact N-OD1 2.76Å
486	T	83.2	Confident	81.5	Confident	4 Å²	4	16.4 Å²	16.4	3%	0.025	8%	0.082	C	C	.	.	H	α-helix	trans	-73.6	-37	-178.5	53.8	0	0	0	0	111.7	T483 R484 F490 L883 I884	T483-T486 PolarHBondContact N-OG1 3.29Å; T483-T486 VanDerWaalsContact N-OG1 3.15Å; T483-T486 PolarHBondContact O-N 2.9Å; T483-T486 PolarHBondContact O-OG1 3.29Å; R484-T486 PolarHBondContact O-N 2.88Å; T486-F490 WeakPolarHBondContact O-CB 3.25Å; T486-F490 PolarHBondContact O-N 3.07Å; T486-L883 HydrophobicContact CG2-CB 3.79Å; T486-I884 HydrophobicContact CG2-CG1 4.42Å
487	E	79.2	Confident	81.4	Confident	17 Å²	17	17.8 Å²	17.8	8%	0.079	9%	0.09	C	C	.	.	H	α-helix	trans	-64.6	-47.2	178.2	-70.2	169	-159.9	0	0	112	I482 T483 R484 F490 A491 V703	I482-E487 HydrophobicContact CG2-CG 3.6Å; T483-E487 WeakPolarHBondContact O-CG 3.25Å; T483-E487 PolarHBondContact O-N 3.36Å; R484-E487 PolarHBondContact O-N 3.33Å; E487-F490 PolarHBondContact O-N 2.71Å; E487-A491 WeakPolarHBondContact O-CB 3.43Å; E487-A491 PolarHBondContact O-N 3.38Å; E487-V703 HydrophobicContact CG-CG1 4.18Å; E487-V703 VanDerWaalsContact OE1-CG1 3.31Å; E487-V703 WeakPolarHBondContact OE1-CG1 3.36Å
488	E	84	Confident	81	Confident	0 Å²	0	19 Å²	19	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-67.3	-38	180	-72.9	-179	170.6	0	0	111.7	R484 F490 S492 R707 F821 R824	R484-E488 HydrophobicContact CG-CG 4.05Å; R484-E488 WeakPolarHBondContact CG-OE1 3.2Å; R484-E488 IonicContact CZ-OE1 2.79Å; R484-E488 IonicContact NE-OE1 3.97Å; R484-E488 PolarHBondContact NE-OE1 3.08Å; R484-E488 IonicContact NH2-OE1 2.9Å; R484-E488 VanDerWaalsContact O-CB 3.3Å; R484-E488 WeakPolarHBondContact O-CB 3.43Å; R484-E488 VanDerWaalsContact O-CG 3.3Å; R484-E488 WeakPolarHBondContact O-CG 3.12Å; R484-E488 PolarHBondContact O-N 3.01Å; E488-F490 VanDerWaalsContact C-N 3.32Å; E488-F490 PolarHBondContact O-N 3.13Å; E488-S492 VanDerWaalsContact O-CB 3.23Å; E488-S492 WeakPolarHBondContact O-CB 3.21Å; E488-S492 PolarHBondContact O-N 3.37Å; E488-S492 PolarHBondContact O-OG 3.06Å; E488-R707 IonicContact OE1-CZ 2.81Å; E488-R707 IonicContact OE1-NH1 3.04Å; E488-R707 IonicContact OE1-NH2 2.83Å; E488-R707 PolarHBondContact OE1-NH2 3.41Å; E488-F821 HydrophobicContact CB-CB 4.09Å; E488-R824 IonicContact OE2-CZ 3.77Å; E488-R824 IonicContact OE2-NH1 2.62Å; E488-R824 PolarHBondContact OE2-NH1 2.9Å; E488-R824 IonicContact OE2-NH2 3.09Å; E488-R824 PolarHBondContact OE2-NH2 3.3Å
489	A	84.6	Confident	81.3	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-61	-44.6	174.4	0	0	0	0	0	110.9	F485 L493 Q856 L863	F485-A489 PolarHBondContact O-N 3.11Å; A489-L493 WeakPolarHBondContact O-CB 3.35Å; A489-L493 PolarHBondContact O-N 3.27Å; A489-Q856 HydrophobicContact CB-CG 4.47Å; A489-L863 HydrophobicContact CB-CD1 4.29Å
490	F	82	Confident	81.6	Confident	7 Å²	7	19.6 Å²	19.6	3%	0.031	10%	0.1	C	C	.	.	H	α-helix	trans	-70.8	-44.1	-179.6	-175.5	-95.6	0	0	0	113.4	T486 E487 E488 S492 L493 I494 I700 I704 T744 F876 L880	T486-F490 WeakPolarHBondContact O-CB 3.25Å; T486-F490 PolarHBondContact O-N 3.07Å; E487-F490 PolarHBondContact O-N 2.71Å; E488-F490 VanDerWaalsContact C-N 3.32Å; E488-F490 PolarHBondContact O-N 3.13Å; F490-S492 VanDerWaalsContact C-N 3.28Å; F490-S492 PolarHBondContact O-N 2.88Å; F490-L493 PolarHBondContact O-N 3.37Å; F490-I494 HydrophobicContact CD1-CD1 3.43Å; F490-I494 VanDerWaalsContact CD1-CD1 3.43Å; F490-I494 HydrophobicContact CD1-CG1 4.44Å; F490-I494 HydrophobicContact CE1-CD1 3.08Å; F490-I494 HydrophobicContact CE1-CG1 4.28Å; F490-I494 HydrophobicContact CE2-CD1 4.41Å; F490-I494 HydrophobicContact CG-CD1 4.27Å; F490-I494 HydrophobicContact CZ-CD1 3.66Å; F490-I494 WeakPolarHBondContact O-CG1 3.23Å; F490-I494 PolarHBondContact O-N 3.12Å; F490-I700 HydrophobicContact CD1-CG2 4.02Å; F490-I700 HydrophobicContact CE1-CG2 3.52Å; F490-I700 HydrophobicContact CE2-CG2 4.17Å; F490-I700 HydrophobicContact CG-CG2 4.5Å; F490-I700 HydrophobicContact CZ-CG2 3.6Å; F490-I704 HydrophobicContact CD1-CD1 3.16Å; F490-I704 HydrophobicContact CD1-CG1 4.34Å; F490-I704 HydrophobicContact CE1-CD1 3.25Å; F490-I704 HydrophobicContact CG-CD1 4.33Å; F490-I704 HydrophobicContact CZ-CD1 4.49Å; F490-T744 HydrophobicContact CE1-CG2 3.71Å; F490-T744 HydrophobicContact CZ-CG2 3.87Å; F490-F876 HydrophobicContact CD2-CE1 4.36Å; F490-F876 AromaticContact CD2-CZ 3.86Å; F490-F876 HydrophobicContact CD2-CZ 3.86Å; F490-F876 AromaticContact CE2-CE1 3.4Å; F490-F876 HydrophobicContact CE2-CE1 3.4Å; F490-F876 HydrophobicContact CE2-CE2 4.49Å; F490-F876 AromaticContact CE2-CZ 3.29Å; F490-F876 HydrophobicContact CE2-CZ 3.29Å; F490-F876 HydrophobicContact CZ-CE1 4.1Å; F490-F876 HydrophobicContact CZ-CZ 4.25Å; F490-L880 HydrophobicContact CB-CD2 4.48Å; F490-L880 HydrophobicContact CD2-CD1 4.01Å; F490-L880 HydrophobicContact CD2-CD2 3.77Å; F490-L880 HydrophobicContact CD2-CG 4.45Å; F490-L880 HydrophobicContact CE2-CD1 3.74Å; F490-L880 HydrophobicContact CE2-CD2 4.35Å; F490-L880 HydrophobicContact CG-CD2 4.44Å
491	A	79.3	Confident	81.9	Confident	2 Å²	2	23.9 Å²	23.9	2%	0.017	12%	0.116	C	C	.	.	H	α-helix	trans	-63	-36.9	176.3	0	0	0	0	0	111.9	E487 S495 I704	E487-A491 WeakPolarHBondContact O-CB 3.43Å; E487-A491 PolarHBondContact O-N 3.38Å; A491-S495 WeakPolarHBondContact O-CB 3.44Å; A491-S495 PolarHBondContact O-N 3.47Å; A491-S495 VanDerWaalsContact O-N 3.08Å; A491-S495 PolarHBondContact O-OG 2.9Å; A491-I704 HydrophobicContact CB-CG2 4.33Å
492	S	84.2	Confident	82.2	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-69.7	-38.1	174.7	-54.4	0	0	0	0	111.6	E488 F490 S495 L496 F821	E488-S492 VanDerWaalsContact O-CB 3.23Å; E488-S492 WeakPolarHBondContact O-CB 3.21Å; E488-S492 PolarHBondContact O-N 3.37Å; E488-S492 PolarHBondContact O-OG 3.06Å; F490-S492 VanDerWaalsContact C-N 3.28Å; F490-S492 PolarHBondContact O-N 2.88Å; S492-S495 PolarHBondContact O-N 3.26Å; S492-L496 WeakPolarHBondContact O-CB 3.38Å; S492-L496 PolarHBondContact O-N 2.96Å; S492-F821 WeakPolarHBondContact OG-CD1 3.42Å
493	L	86.8	Confident	82.6	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-63.1	-50	178.6	-178.9	70.1	0	0	0	109.7	A489 F490 S495 L496 I497 F860 L863 A864 F876	A489-L493 WeakPolarHBondContact O-CB 3.35Å; A489-L493 PolarHBondContact O-N 3.27Å; F490-L493 PolarHBondContact O-N 3.37Å; L493-S495 VanDerWaalsContact C-N 3.33Å; L493-S495 PolarHBondContact O-N 3.43Å; L493-L496 CarbonylContact O-C 3.54Å; L493-L496 WeakPolarHBondContact O-CA 3.5Å; L493-L496 WeakPolarHBondContact O-CB 3.4Å; L493-L496 PolarHBondContact O-N 3.29Å; L493-I497 HydrophobicContact CD2-CD1 4.49Å; L493-I497 HydrophobicContact CG-CD1 3.86Å; L493-I497 HydrophobicContact CG-CG1 4.34Å; L493-I497 VanDerWaalsContact O-CD1 3.26Å; L493-I497 WeakPolarHBondContact O-CD1 3.33Å; L493-I497 VanDerWaalsContact O-CG1 3.26Å; L493-I497 WeakPolarHBondContact O-CG1 3.5Å; L493-I497 PolarHBondContact O-N 3.19Å; L493-F860 VanDerWaalsContact CA-CE2 3.48Å; L493-F860 HydrophobicContact CB-CD2 4.23Å; L493-F860 HydrophobicContact CB-CE2 3.78Å; L493-F860 HydrophobicContact CD1-CE2 4.03Å; L493-F860 HydrophobicContact CD1-CZ 4.22Å; L493-L863 HydrophobicContact CD2-CB 3.6Å; L493-L863 HydrophobicContact CD2-CD1 4.21Å; L493-A864 HydrophobicContact CD1-CB 3.67Å; L493-F876 HydrophobicContact CD2-CE2 3.88Å; L493-F876 HydrophobicContact CD2-CZ 4.28Å
494	I	79	Confident	82.8	Confident	7 Å²	7	29.4 Å²	29.4	4%	0.036	15%	0.145	C	C	.	.	H	α-helix	trans	-52.2	-48.7	173.3	-73.9	166.4	0	0	0	112.7	F490 L496 I497 F498 T744 V745	F490-I494 HydrophobicContact CD1-CD1 3.43Å; F490-I494 VanDerWaalsContact CD1-CD1 3.43Å; F490-I494 HydrophobicContact CD1-CG1 4.44Å; F490-I494 HydrophobicContact CE1-CD1 3.08Å; F490-I494 HydrophobicContact CE1-CG1 4.28Å; F490-I494 HydrophobicContact CE2-CD1 4.41Å; F490-I494 HydrophobicContact CG-CD1 4.27Å; F490-I494 HydrophobicContact CZ-CD1 3.66Å; F490-I494 WeakPolarHBondContact O-CG1 3.23Å; F490-I494 PolarHBondContact O-N 3.12Å; I494-L496 PolarHBondContact O-N 3.3Å; I494-I497 HydrophobicContact CG1-CD1 4.48Å; I494-I497 PolarHBondContact O-N 3.5Å; I494-F498 WeakPolarHBondContact O-CB 3.31Å; I494-F498 PolarHBondContact O-N 3.36Å; I494-F498 VanDerWaalsContact O-N 3.08Å; I494-T744 VanDerWaalsContact CD1-CB 3.49Å; I494-T744 HydrophobicContact CD1-CG2 4.08Å; I494-T744 VanDerWaalsContact CD1-OG1 3.25Å; I494-T744 WeakPolarHBondContact CD1-OG1 3.09Å; I494-V745 HydrophobicContact CG2-CB 3.95Å; I494-V745 HydrophobicContact CG2-CG1 3.93Å; I494-V745 HydrophobicContact CG2-CG2 3.51Å
495	S	78.1	Confident	82.8	Confident	9 Å²	9	32 Å²	32	6%	0.063	16%	0.159	C	C	.	.	H	α-helix	trans	-62.6	-35.6	-180	-57.1	0	0	0	0	111.3	A491 S492 L493 L499	A491-S495 WeakPolarHBondContact O-CB 3.44Å; A491-S495 PolarHBondContact O-N 3.47Å; A491-S495 VanDerWaalsContact O-N 3.08Å; A491-S495 PolarHBondContact O-OG 2.9Å; S492-S495 PolarHBondContact O-N 3.26Å; L493-S495 VanDerWaalsContact C-N 3.33Å; L493-S495 PolarHBondContact O-N 3.43Å; S495-L499 PolarHBondContact O-N 2.74Å
496	L	86.4	Confident	82.8	Confident	60 Å²	60	33 Å²	33	31%	0.314	16%	0.164	S	C	.	.	H	α-helix	trans	-73.1	-47.4	176.9	-176.1	63.9	0	0	0	112.6	S492 L493 I494 F498 L499 V500 F860	S492-L496 WeakPolarHBondContact O-CB 3.38Å; S492-L496 PolarHBondContact O-N 2.96Å; L493-L496 CarbonylContact O-C 3.54Å; L493-L496 WeakPolarHBondContact O-CA 3.5Å; L493-L496 WeakPolarHBondContact O-CB 3.4Å; L493-L496 PolarHBondContact O-N 3.29Å; I494-L496 PolarHBondContact O-N 3.3Å; L496-F498 PolarHBondContact O-N 2.85Å; L496-L499 WeakPolarHBondContact O-CB 3.45Å; L496-L499 PolarHBondContact O-N 2.93Å; L496-L499 VanDerWaalsContact O-N 3.08Å; L496-V500 HydrophobicContact CD1-CG2 4.25Å; L496-V500 HydrophobicContact CG-CG2 4.29Å; L496-V500 WeakPolarHBondContact O-CG2 3.41Å; L496-V500 PolarHBondContact O-N 2.74Å; L496-F860 HydrophobicContact CB-CZ 4.49Å; L496-F860 HydrophobicContact CD2-CE1 4.07Å; L496-F860 HydrophobicContact CD2-CZ 3.65Å
497	I	82.3	Confident	82.8	Confident	30 Å²	30	38.8 Å²	38.8	15%	0.154	19%	0.189	C	C	.	.	H	α-helix	trans	-56.3	-41.8	177.6	-61.1	143.6	0	0	0	110.2	L493 I494 L499 V500 K501 E867	L493-I497 HydrophobicContact CD2-CD1 4.49Å; L493-I497 HydrophobicContact CG-CD1 3.86Å; L493-I497 HydrophobicContact CG-CG1 4.34Å; L493-I497 VanDerWaalsContact O-CD1 3.26Å; L493-I497 WeakPolarHBondContact O-CD1 3.33Å; L493-I497 VanDerWaalsContact O-CG1 3.26Å; L493-I497 WeakPolarHBondContact O-CG1 3.5Å; L493-I497 PolarHBondContact O-N 3.19Å; I494-I497 HydrophobicContact CG1-CD1 4.48Å; I494-I497 PolarHBondContact O-N 3.5Å; I497-L499 VanDerWaalsContact C-N 3.34Å; I497-L499 PolarHBondContact O-N 3.19Å; I497-V500 PolarHBondContact O-N 3.45Å; I497-K501 HydrophobicContact CG2-CD 3.87Å; I497-K501 HydrophobicContact CG2-CG 4.17Å; I497-K501 WeakPolarHBondContact O-CB 3.26Å; I497-K501 WeakPolarHBondContact O-CG 3.39Å; I497-K501 PolarHBondContact O-N 2.9Å; I497-E867 WeakPolarHBondContact CD1-OE1 3.07Å; I497-E867 WeakPolarHBondContact CD1-OE2 3.22Å; I497-E867 VanDerWaalsContact CG1-CD 3.49Å; I497-E867 VanDerWaalsContact CG1-OE1 3.24Å; I497-E867 WeakPolarHBondContact CG1-OE1 3.47Å; I497-E867 WeakPolarHBondContact CG1-OE2 3.29Å
498	F	75.7	Confident	82.7	Confident	31 Å²	31	39.9 Å²	39.9	14%	0.136	20%	0.201	C	C	.	.	H	α-helix	trans	-64.7	-39.6	179.4	-175.4	-118.4	0	0	0	112.4	I494 L496 A502 V745 M749 F808 M811	I494-F498 WeakPolarHBondContact O-CB 3.31Å; I494-F498 PolarHBondContact O-N 3.36Å; I494-F498 VanDerWaalsContact O-N 3.08Å; L496-F498 PolarHBondContact O-N 2.85Å; F498-A502 WeakPolarHBondContact O-CB 3.13Å; F498-A502 PolarHBondContact O-N 3.09Å; F498-V745 HydrophobicContact CB-CG1 4.34Å; F498-V745 HydrophobicContact CD2-CG1 4.09Å; F498-V745 HydrophobicContact CE2-CG1 4.5Å; F498-V745 HydrophobicContact CG-CG1 4.22Å; F498-M749 HydrophobicContact CE1-SD 4.14Å; F498-M749 HydrophobicContact CE2-SD 4.37Å; F498-M749 HydrophobicContact CZ-CE 4.25Å; F498-M749 HydrophobicContact CZ-SD 3.79Å; F498-F808 HydrophobicContact CD1-CB 4.28Å; F498-F808 VanDerWaalsContact CD1-O 3.26Å; F498-F808 WeakPolarHBondContact CD1-O 3.33Å; F498-F808 VanDerWaalsContact CE1-C 3.48Å; F498-F808 HydrophobicContact CE1-CB 3.54Å; F498-F808 HydrophobicContact CE1-CD1 4.09Å; F498-F808 HydrophobicContact CE1-CG 4.02Å; F498-F808 WeakPolarHBondContact CE1-O 3.38Å; F498-F808 HydrophobicContact CE2-CB 3.76Å; F498-F808 AromaticContact CE2-CD1 3.72Å; F498-F808 HydrophobicContact CE2-CD1 3.72Å; F498-F808 AromaticContact CE2-CD2 3.87Å; F498-F808 HydrophobicContact CE2-CD2 3.87Å; F498-F808 HydrophobicContact CE2-CE1 4.16Å; F498-F808 HydrophobicContact CE2-CE2 4.34Å; F498-F808 AromaticContact CE2-CG 3.51Å; F498-F808 HydrophobicContact CE2-CG 3.51Å; F498-F808 HydrophobicContact CE2-CZ 4.46Å; F498-F808 VanDerWaalsContact CZ-CA 3.46Å; F498-F808 HydrophobicContact CZ-CB 3.27Å; F498-F808 AromaticContact CZ-CD1 3.14Å; F498-F808 HydrophobicContact CZ-CD1 3.14Å; F498-F808 HydrophobicContact CZ-CD2 4.05Å; F498-F808 AromaticContact CZ-CE1 3.87Å; F498-F808 HydrophobicContact CZ-CE1 3.87Å; F498-F808 AromaticContact CZ-CG 3.21Å; F498-F808 HydrophobicContact CZ-CG 3.21Å; F498-M811 HydrophobicContact CE1-CB 4.23Å; F498-M811 HydrophobicContact CE1-CE 4.14Å; F498-M811 HydrophobicContact CZ-CE 4.06Å
499	L	84.4	Confident	82.3	Confident	35 Å²	35	40.6 Å²	40.6	18%	0.183	20%	0.204	C	C	.	.	H	α-helix	trans	-64.2	-46.3	173.4	-175.3	67.5	0	0	0	111.2	S495 L496 I497 A502 L503 I809 I813	S495-L499 PolarHBondContact O-N 2.74Å; L496-L499 WeakPolarHBondContact O-CB 3.45Å; L496-L499 PolarHBondContact O-N 2.93Å; L496-L499 VanDerWaalsContact O-N 3.08Å; I497-L499 VanDerWaalsContact C-N 3.34Å; I497-L499 PolarHBondContact O-N 3.19Å; L499-A502 PolarHBondContact O-N 3.28Å; L499-L503 WeakPolarHBondContact O-CG 3.42Å; L499-L503 PolarHBondContact O-N 3.08Å; L499-L503 VanDerWaalsContact O-N 3.11Å; L499-I809 HydrophobicContact CD1-CB 4.24Å; L499-I809 HydrophobicContact CD1-CG1 4.19Å; L499-I809 HydrophobicContact CD1-CG2 3.88Å; L499-I813 HydrophobicContact CD1-CG1 4.21Å
500	V	86.9	Confident	81.7	Confident	63 Å²	63	42.6 Å²	42.6	38%	0.382	22%	0.216	S	C	.	.	H	α-helix	trans	-64.6	-47.1	-179.9	173	0	0	0	0	111.2	L496 I497 A502 L503 E504	L496-V500 HydrophobicContact CD1-CG2 4.25Å; L496-V500 HydrophobicContact CG-CG2 4.29Å; L496-V500 WeakPolarHBondContact O-CG2 3.41Å; L496-V500 PolarHBondContact O-N 2.74Å; I497-V500 PolarHBondContact O-N 3.45Å; V500-A502 VanDerWaalsContact C-N 3.32Å; V500-A502 PolarHBondContact O-N 3.09Å; V500-L503 CarbonylContact O-C 3.55Å; V500-L503 WeakPolarHBondContact O-CA 3.34Å; V500-L503 WeakPolarHBondContact O-CB 3.13Å; V500-L503 PolarHBondContact O-N 2.95Å; V500-L503 VanDerWaalsContact O-N 3.08Å; V500-E504 PolarHBondContact O-N 3.01Å
501	K	82	Confident	81	Confident	115 Å²	115	50.7 Å²	50.7	50%	0.5	25%	0.254	S	S	.	.	H	α-helix	trans	-61.7	-38.5	176.7	-75.8	-175.8	177.8	174.1	0	112.5	I497 L503 E504 E505	I497-K501 HydrophobicContact CG2-CD 3.87Å; I497-K501 HydrophobicContact CG2-CG 4.17Å; I497-K501 WeakPolarHBondContact O-CB 3.26Å; I497-K501 WeakPolarHBondContact O-CG 3.39Å; I497-K501 PolarHBondContact O-N 2.9Å; K501-L503 VanDerWaalsContact C-N 3.28Å; K501-L503 PolarHBondContact O-N 2.87Å; K501-E504 PolarHBondContact O-N 3.4Å; K501-E505 WeakPolarHBondContact O-CB 3.24Å; K501-E505 VanDerWaalsContact O-CG 3.3Å; K501-E505 WeakPolarHBondContact O-CG 3.45Å; K501-E505 PolarHBondContact O-N 3.18Å
502	A	83.1	Confident	80.2	Confident	3 Å²	3	55.4 Å²	55.4	3%	0.025	28%	0.283	C	S	.	.	H	α-helix	trans	-64.3	-35.2	175.4	0	0	0	0	0	112.1	F498 L499 V500 M506 F808 I809	F498-A502 WeakPolarHBondContact O-CB 3.13Å; F498-A502 PolarHBondContact O-N 3.09Å; L499-A502 PolarHBondContact O-N 3.28Å; V500-A502 VanDerWaalsContact C-N 3.32Å; V500-A502 PolarHBondContact O-N 3.09Å; A502-M506 WeakPolarHBondContact O-CB 3.21Å; A502-M506 PolarHBondContact O-N 3.4Å; A502-M506 VanDerWaalsContact O-N 3.15Å; A502-F808 HydrophobicContact CB-CB 4Å; A502-I809 HydrophobicContact CB-CG1 3.81Å
503	L	88.4	Confident	79.1	Confident	66 Å²	66	57.8 Å²	57.8	35%	0.346	30%	0.296	S	S	.	.	H	α-helix	trans	-72.7	-39.2	173.5	-66.5	172.4	0	0	0	112.2	L499 V500 K501 M506 F507 I809	L499-L503 WeakPolarHBondContact O-CG 3.42Å; L499-L503 PolarHBondContact O-N 3.08Å; L499-L503 VanDerWaalsContact O-N 3.11Å; V500-L503 CarbonylContact O-C 3.55Å; V500-L503 WeakPolarHBondContact O-CA 3.34Å; V500-L503 WeakPolarHBondContact O-CB 3.13Å; V500-L503 PolarHBondContact O-N 2.95Å; V500-L503 VanDerWaalsContact O-N 3.08Å; K501-L503 VanDerWaalsContact C-N 3.28Å; K501-L503 PolarHBondContact O-N 2.87Å; L503-M506 HydrophobicContact CD2-CE 3.87Å; L503-M506 WeakPolarHBondContact O-CB 3.44Å; L503-M506 PolarHBondContact O-N 2.72Å; L503-F507 WeakPolarHBondContact O-CD2 3.1Å; L503-F507 PolarHBondContact O-N 2.73Å; L503-I809 HydrophobicContact CD2-CD1 4.03Å
504	E	85.7	Confident	77.7	Confident	127 Å²	127	60.6 Å²	60.6	59%	0.593	32%	0.315	S	S	*	.	H	α-helix	trans	-60.8	-49.2	175.6	-173.6	-177.5	-177.5	0	0	111.2	V500 K501 M506 F507 A508	V500-E504 PolarHBondContact O-N 3.01Å; K501-E504 PolarHBondContact O-N 3.4Å; E504-M506 VanDerWaalsContact C-N 3.28Å; E504-M506 PolarHBondContact O-N 3.5Å; E504-F507 CarbonylContact O-C 3.53Å; E504-F507 WeakPolarHBondContact O-CA 3.33Å; E504-F507 PolarHBondContact O-N 2.93Å; E504-A508 PolarHBondContact O-N 3.47Å
505	E	79.6	Confident	76.5	Confident	94 Å²	94	64.7 Å²	64.7	44%	0.439	34%	0.339	S	S	.	.	H	α-helix	trans	-61.7	-35.8	175.4	-69.8	-74.1	177.4	0	0	111.9	K501 F507 A508 I509 L805	K501-E505 WeakPolarHBondContact O-CB 3.24Å; K501-E505 VanDerWaalsContact O-CG 3.3Å; K501-E505 WeakPolarHBondContact O-CG 3.45Å; K501-E505 PolarHBondContact O-N 3.18Å; E505-F507 VanDerWaalsContact C-N 3.35Å; E505-A508 PolarHBondContact O-N 3.34Å; E505-I509 WeakPolarHBondContact O-CG1 3.42Å; E505-I509 PolarHBondContact O-N 3.18Å; E505-L805 HydrophobicContact CB-CD1 3.97Å; E505-L805 HydrophobicContact CB-CD2 3.65Å; E505-L805 HydrophobicContact CB-CG 4.49Å; E505-L805 HydrophobicContact CG-CD2 4.28Å
506	M	84.1	Confident	75.2	Confident	22 Å²	22	67 Å²	67	11%	0.108	35%	0.351	C	S	.	.	H	α-helix	trans	-60.9	-44.8	171.8	176.1	-172.8	74.7	0	0	111	A502 L503 E504 I509 Y574 V578 I581	A502-M506 WeakPolarHBondContact O-CB 3.21Å; A502-M506 PolarHBondContact O-N 3.4Å; A502-M506 VanDerWaalsContact O-N 3.15Å; L503-M506 HydrophobicContact CD2-CE 3.87Å; L503-M506 WeakPolarHBondContact O-CB 3.44Å; L503-M506 PolarHBondContact O-N 2.72Å; E504-M506 VanDerWaalsContact C-N 3.28Å; E504-M506 PolarHBondContact O-N 3.5Å; M506-I509 PolarHBondContact O-N 3.45Å; M506-Y574 WeakPolarHBondContact O-CE2 3.45Å; M506-V578 HydrophobicContact CG-CG2 4.31Å; M506-V578 HydrophobicContact SD-CG2 4.3Å; M506-I581 HydrophobicContact CB-CD1 3.81Å; M506-I581 HydrophobicContact CG-CD1 3.5Å; M506-I581 VanDerWaalsContact CG-CD1 3.5Å; M506-I581 HydrophobicContact SD-CD1 3.97Å
507	F	83.3	Confident	73.5	Confident	124 Å²	124	68.8 Å²	68.8	54%	0.544	37%	0.366	S	S	.	.	H	α-helix	trans	-70	-33.4	176.9	-72.1	-63.1	0	0	0	112.7	L503 E504 E505 I509 T510	L503-F507 WeakPolarHBondContact O-CD2 3.1Å; L503-F507 PolarHBondContact O-N 2.73Å; E504-F507 CarbonylContact O-C 3.53Å; E504-F507 WeakPolarHBondContact O-CA 3.33Å; E504-F507 PolarHBondContact O-N 2.93Å; E505-F507 VanDerWaalsContact C-N 3.35Å; F507-I509 PolarHBondContact O-N 2.81Å; F507-T510 WeakPolarHBondContact O-CA 3.34Å; F507-T510 WeakPolarHBondContact O-CB 3.33Å; F507-T510 PolarHBondContact O-N 2.8Å; F507-T510 PolarHBondContact O-OG1 3.37Å
508	A	77.9	Confident	71.5	Confident	40 Å²	40	75 Å²	75	33%	0.331	39%	0.392	S	S	.	.	H	α-helix	trans	-61.9	-29.9	176.1	0	0	0	0	0	112.9	E504 E505 T510 E511 T512	E504-A508 PolarHBondContact O-N 3.47Å; E505-A508 PolarHBondContact O-N 3.34Å; A508-T510 PolarHBondContact O-N 3.1Å; A508-E511 PolarHBondContact O-N 2.95Å; A508-E511 VanDerWaalsContact O-N 3.14Å; A508-T512 PolarHBondContact O-N 3.23Å; A508-T512 PolarHBondContact O-OG1 3.12Å
509	I	75.3	Confident	70.2	Confident	15 Å²	15	77.1 Å²	77.1	8%	0.077	40%	0.404	C	S	.	.	H	α-helix	trans	-62	-27.7	172.8	-63.5	164.2	0	0	0	111.5	E505 M506 F507 E511 T512 N513 Y574 P632 P802 L805	E505-I509 WeakPolarHBondContact O-CG1 3.42Å; E505-I509 PolarHBondContact O-N 3.18Å; M506-I509 PolarHBondContact O-N 3.45Å; F507-I509 PolarHBondContact O-N 2.81Å; I509-E511 VanDerWaalsContact C-N 3.34Å; I509-T512 PolarHBondContact O-N 3.43Å; I509-T512 PolarHBondContact O-OG1 3.34Å; I509-N513 PolarHBondContact O-N 3.12Å; I509-Y574 HydrophobicContact CB-CD2 4.43Å; I509-Y574 HydrophobicContact CG2-CD2 4.26Å; I509-P632 HydrophobicContact CG2-CG 4.43Å; I509-P802 HydrophobicContact CD1-CG 4.31Å; I509-L805 HydrophobicContact CD1-CD1 3.92Å
510	T	71.6	Confident	68.3	Low	42 Å²	42	80.2 Å²	80.2	26%	0.258	43%	0.425	S	S	.	.	H	α-helix	trans	-65.5	-37.5	175.9	-32.1	0	0	0	0	111.8	F507 A508 T512 N513 Y574	F507-T510 WeakPolarHBondContact O-CA 3.34Å; F507-T510 WeakPolarHBondContact O-CB 3.33Å; F507-T510 PolarHBondContact O-N 2.8Å; F507-T510 PolarHBondContact O-OG1 3.37Å; A508-T510 PolarHBondContact O-N 3.1Å; T510-T512 VanDerWaalsContact C-N 3.32Å; T510-N513 CarbonylContact O-C 3.44Å; T510-Y574 HydrophobicContact CG2-CD1 4.43Å; T510-Y574 HydrophobicContact CG2-CD2 4.24Å; T510-Y574 HydrophobicContact CG2-CE1 4.42Å; T510-Y574 HydrophobicContact CG2-CE2 4.24Å; T510-Y574 HydrophobicContact CG2-CG 4.33Å; T510-Y574 WeakPolarHBondContact OG1-CD2 3.43Å; T510-Y574 WeakPolarHBondContact OG1-CE2 3.2Å; T510-Y574 VanDerWaalsContact OG1-CZ 3.3Å
511	E	66.6	Low	66.5	Low	177 Å²	177	78.7 Å²	78.7	83%	0.827	42%	0.415	S	S	*	.	H	α-helix	trans	-70.2	-33	-179.8	-63.7	-172.6	169.8	0	0	111.4	A508 I509	A508-E511 PolarHBondContact O-N 2.95Å; A508-E511 VanDerWaalsContact O-N 3.14Å; I509-E511 VanDerWaalsContact C-N 3.34Å
512	T	62.8	Low	65.1	Low	102 Å²	102	77.2 Å²	77.2	63%	0.626	42%	0.419	S	S	*	.	H	α-helix	trans	-81.4	-27.6	177.1	14.5	0	0	0	0	113.4	A508 I509 T510	A508-T512 PolarHBondContact O-N 3.23Å; A508-T512 PolarHBondContact O-OG1 3.12Å; I509-T512 PolarHBondContact O-N 3.43Å; I509-T512 PolarHBondContact O-OG1 3.34Å; T510-T512 VanDerWaalsContact C-N 3.32Å
513	N	61.9	Low	63.5	Low	49 Å²	49	77.9 Å²	77.9	26%	0.262	42%	0.423	S	S	.	.	S	Bend	trans	-137.8	85.7	-179.5	-60.4	-80.1	0	0	0	111	I509 T510 V573	I509-N513 PolarHBondContact O-N 3.12Å; T510-N513 CarbonylContact O-C 3.44Å; N513-V573 HydrophobicContact CB-CB 4.22Å; N513-V573 HydrophobicContact CB-CG1 4.4Å
514	P	56.2	Low	61.6	Low	62 Å²	62	81.7 Å²	81.7	40%	0.403	44%	0.443	S	S	.	.			trans	-66.6	147.7	-178.6	25.2	-32.9	0	0	0	112.8	L516	P514-L516 VanDerWaalsContact C-N 3.33Å; P514-L516 HydrophobicContact CB-CD1 4.43Å; P514-L516 HydrophobicContact CG-CD1 3.9Å; P514-L516 PolarHBondContact O-N 3.12Å
515	V	54.7	Low	59.4	Low	92 Å²	92	80.9 Å²	80.9	56%	0.558	44%	0.443	S	S	*	.			trans	-77.3	78.6	178.5	-169.2	0	0	0	0	109.9	Y574	V515-Y574 HydrophobicContact CG2-CD1 3.68Å; V515-Y574 HydrophobicContact CG2-CG 4.24Å
516	L	51	Low	57.3	Low	57 Å²	57	84.1 Å²	84.1	30%	0.298	46%	0.458	S	S	.	.			trans	-96	140.1	177.7	-77.4	156	0	0	0	111	P514 L558 P571	P514-L516 VanDerWaalsContact C-N 3.33Å; P514-L516 HydrophobicContact CB-CD1 4.43Å; P514-L516 HydrophobicContact CG-CD1 3.9Å; P514-L516 PolarHBondContact O-N 3.12Å; L516-L558 HydrophobicContact CD1-CD2 4.15Å; L516-P571 WeakPolarHBondContact O-CA 3.42Å; L516-P571 WeakPolarHBondContact O-CB 3.31Å; L516-P571 WeakPolarHBondContact O-CG 3.39Å
517	P	49.1	Very low	54.8	Low	99 Å²	99	91.5 Å²	91.5	64%	0.643	49%	0.489	S	S	*	.			trans	-60.3	146.2	171.1	24.8	-31.4	0	0	0	111.4	I519	P517-I519 PolarHBondContact O-N 3.46Å; P517-I519 VanDerWaalsContact O-N 3.13Å
518	K	42	Very low	52.3	Low	159 Å²	159	95.3 Å²	95.3	69%	0.691	51%	0.506	S	S	*	.			trans	-57.5	114.6	-174.7	-168.8	177.9	179.4	179.4	0	110.9	P571	K518-P571 VanDerWaalsContact CA-CG 3.48Å; K518-P571 HydrophobicContact CB-CG 3.74Å; K518-P571 HydrophobicContact CG-CG 4.38Å
519	I	47	Very low	50	Low	77 Å²	77	101.8 Å²	101.8	40%	0.395	53%	0.527	S	S	.	.			trans	-118.4	123.1	171.9	-60.8	166.3	0	0	0	107.4	P517 V521	P517-I519 PolarHBondContact O-N 3.46Å; P517-I519 VanDerWaalsContact O-N 3.13Å; I519-V521 HydrophobicContact CG2-CG2 3.42Å; I519-V521 VanDerWaalsContact CG2-CG2 3.42Å
520	T	44.6	Very low	47.8	Very low	100 Å²	100	110.1 Å²	110.1	61%	0.613	56%	0.563	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-107.8	111.2	168.5	49.9	0	0	0	0	107.4
521	V	49.8	Very low	45.9	Very low	31 Å²	31	112.7 Å²	112.7	19%	0.188	59%	0.588	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.5	127.5	174.9	-174.3	0	0	0	0	109	I519 F550 A566 C567	I519-V521 HydrophobicContact CG2-CG2 3.42Å; I519-V521 VanDerWaalsContact CG2-CG2 3.42Å; V521-F550 HydrophobicContact CB-CD2 4.46Å; V521-F550 HydrophobicContact CG1-CD2 4.41Å; V521-F550 HydrophobicContact CG2-CD2 4Å; V521-F550 HydrophobicContact CG2-CE2 4.45Å; V521-A566 WeakPolarHBondContact O-CA 3.47Å; V521-C567 PolarHBondContact O-N 3.3Å
522	S	51.8	Low	44.2	Very low	83 Å²	83	112.2 Å²	112.2	58%	0.58	59%	0.591	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-74.4	127.8	172	178.1	0	0	0	0	109.5	D524 D565	S522-D524 PolarHBondContact O-N 3.47Å; S522-D565 CarbonylContact C-O 3.47Å
523	L	49.6	Very low	42.7	Very low	18 Å²	18	110.6 Å²	110.6	9%	0.094	60%	0.595	C	S	.	*			trans	-84.5	85.7	172.8	-65.2	153	0	0	0	107.4	D525 F550 I552 V562 D565	L523-D525 PolarHBondContact O-N 2.77Å; L523-F550 WeakPolarHBondContact CD2-O 3.38Å; L523-I552 HydrophobicContact CD2-CG1 4.27Å; L523-V562 HydrophobicContact CD1-CB 4.36Å; L523-V562 HydrophobicContact CD1-CG1 3.56Å; L523-V562 HydrophobicContact CD1-CG2 4.03Å; L523-D565 WeakPolarHBondContact CA-O 3.43Å; L523-D565 HydrophobicContact CB-CB 4.3Å; L523-D565 VanDerWaalsContact CB-O 3.32Å; L523-D565 WeakPolarHBondContact CB-O 3.23Å; L523-D565 PolarHBondContact N-O 3.09Å
524	D	48.5	Very low	41.2	Very low	145 Å²	145	113.6 Å²	113.6	78%	0.775	62%	0.62	S	S	*	*			trans	-81.2	99.1	171.9	-124.9	9.7	0	0	0	108.4	S522 H526	S522-D524 PolarHBondContact O-N 3.47Å; D524-H526 PolarHBondContact O-N 3.42Å; D524-H526 VanDerWaalsContact O-N 3.15Å
525	D	40	Very low	39.8	Very low	110 Å²	110	119.4 Å²	119.4	59%	0.588	64%	0.642	S	S	*	*			trans	-63.4	114.7	168.2	-95.6	-15	0	0	0	107.9	L523	L523-D525 PolarHBondContact O-N 2.77Å
526	H	36.6	Very low	38.6	Very low	162 Å²	162	120.1 Å²	120.1	75%	0.75	65%	0.65	S	S	*	*			trans	89.6	93.3	175.4	-43.9	-61.6	0	0	0	117.1	D524	D524-H526 PolarHBondContact O-N 3.42Å; D524-H526 VanDerWaalsContact O-N 3.15Å
527	K	30.3	Very low	37.4	Very low	177 Å²	177	124.4 Å²	124.4	77%	0.77	68%	0.679	S	S	*	*				-170.4	108	121.4	-101.4	154.2	-167.7	173.4	0	113	F529	K527-F529 HydrophobicContact CB-CD2 4.21Å; K527-F529 HydrophobicContact CD-CE2 4.46Å; K527-F529 HydrophobicContact CG-CD2 4.2Å; K527-F529 HydrophobicContact CG-CE2 4.31Å; K527-F529 PolarHBondContact O-N 2.71Å; K527-F529 VanDerWaalsContact O-N 3.11Å
528	F	30.5	Very low	36.2	Very low	205 Å²	205	130.5 Å²	130.5	90%	0.899	69%	0.689	S	S	*	*			trans	-59.1	102.1	153.9	-102.4	-99.2	0	0	0	108.8
529	F	30.8	Very low	35.5	Very low	176 Å²	176	132.1 Å²	132.1	77%	0.772	70%	0.701	S	S	*	*			trans	-117.3	103.4	161.2	-101.7	-86.8	0	0	0	110.1	K527 A531	K527-F529 HydrophobicContact CB-CD2 4.21Å; K527-F529 HydrophobicContact CD-CE2 4.46Å; K527-F529 HydrophobicContact CG-CD2 4.2Å; K527-F529 HydrophobicContact CG-CE2 4.31Å; K527-F529 PolarHBondContact O-N 2.71Å; K527-F529 VanDerWaalsContact O-N 3.11Å; F529-A531 PolarHBondContact O-N 2.94Å; F529-A531 VanDerWaalsContact O-N 3.11Å
530	K	29	Very low	34.5	Very low	190 Å²	190	132.6 Å²	132.6	83%	0.826	72%	0.717	S	S	*	*			trans	-61.2	103	166.5	-78.5	176.9	173.2	175.6	0	108.7
531	A	32.1	Very low	33.7	Very low	96 Å²	96	140 Å²	140	79%	0.793	73%	0.734	S	S	*	*			trans	-100.7	87.6	165.9	0	0	0	0	0	109.2	F529 G533	F529-A531 PolarHBondContact O-N 2.94Å; F529-A531 VanDerWaalsContact O-N 3.11Å; A531-G533 PolarHBondContact O-N 3.5Å
532	N	31.1	Very low	32.7	Very low	166 Å²	166	143.1 Å²	143.1	89%	0.888	76%	0.757	S	S	*	*			trans	-71.1	112.9	158.2	-79.5	-11.4	0	0	0	107.1
533	G	29.8	Very low	31.7	Very low	68 Å²	68	147.3 Å²	147.3	70%	0.701	77%	0.771	S	S	*	*			trans	-175.9	82.4	179.3	0	0	0	0	0	112.8	A531 Q535	A531-G533 PolarHBondContact O-N 3.5Å; G533-Q535 PolarHBondContact O-N 2.85Å
534	S	30.5	Very low	30.8	Very low	113 Å²	113	150.9 Å²	150.9	79%	0.79	80%	0.796	S	S	*	*			trans	-49.4	125.4	158.9	52.5	0	0	0	0	110.4
535	Q	27.9	Very low	30	Very low	184 Å²	184	150 Å²	150	86%	0.86	80%	0.801	S	S	*	*				-176.8	132.1	128.2	-99.2	176.3	34	0	0	113	G533	G533-Q535 PolarHBondContact O-N 2.85Å
536	S	28	Very low	29.8	Very low	106 Å²	106	151.6 Å²	151.6	74%	0.741	81%	0.805	S	S	*	*			trans	-46.7	132.8	167.9	50.5	0	0	0	0	115.1
537	V	25.7	Very low	29.9	Very low	148 Å²	148	149 Å²	149	90%	0.897	81%	0.805	S	S	*	*			trans	-151.5	142.8	141.1	179.4	0	0	0	0	110.6
538	R	24.5	Very low	30.5	Very low	226 Å²	226	146.7 Å²	146.7	85%	0.853	80%	0.797	S	S	*	*			trans	-63.9	150.6	-176.4	-64.5	163.8	164.4	173.4	-5.9	115.5
539	M	26.9	Very low	31.4	Very low	193 Å²	193	143.5 Å²	143.5	95%	0.951	79%	0.789	S	S	*	*			trans	36.2	102.2	139.1	-71.3	-90.3	-171	0	0	117.9
540	A	26.7	Very low	32.5	Very low	88 Å²	88	138.3 Å²	138.3	73%	0.727	77%	0.766	S	S	*	*			trans	-144.6	117.6	146.2	0	0	0	0	0	110.1	S542	A540-S542 PolarHBondContact O-N 3.12Å; A540-S542 VanDerWaalsContact O-N 3.08Å
541	R	27.7	Very low	33.9	Very low	256 Å²	256	133.1 Å²	133.1	97%	0.966	75%	0.751	S	S	*	*			trans	-62	97.8	165.6	-90.5	172.7	169.8	153.9	-3.4	109.5
542	S	28.6	Very low	35.2	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	73%	0.734	S	S	*	*	S	Bend	trans	179.7	113.6	152.8	48.5	0	0	0	0	104.1	A540 P544	A540-S542 PolarHBondContact O-N 3.12Å; A540-S542 VanDerWaalsContact O-N 3.08Å; S542-P544 WeakPolarHBondContact O-CD 3.17Å
543	L	30	Very low	36.5	Very low	171 Å²	171	128.1 Å²	128.1	90%	0.895	72%	0.715	S	S	*	*			trans	-36.5	109.4	-175.4	-98.2	72.2	0	0	0	110.2	S545	L543-S545 PolarHBondContact O-N 3.31Å
544	P	31.1	Very low	38	Very low	93 Å²	93	128.4 Å²	128.4	60%	0.604	70%	0.698	S	S	*	*			trans	-69.2	132.2	175.7	28.5	-29.4	0	0	0	106.5	S542 E546	S542-P544 WeakPolarHBondContact O-CD 3.17Å; P544-E546 HydrophobicContact CB-CG 4.44Å; P544-E546 HydrophobicContact CG-CG 4.35Å; P544-E546 PolarHBondContact O-N 3.35Å
545	S	32.8	Very low	39.4	Very low	128 Å²	128	123 Å²	123	90%	0.895	66%	0.661	S	S	*	*			trans	-60.6	70.9	163.6	-52.8	0	0	0	0	109	L543 S547	L543-S545 PolarHBondContact O-N 3.31Å; S545-S547 PolarHBondContact O-N 3.35Å
546	E	34.6	Very low	40.9	Very low	143 Å²	143	120.6 Å²	120.6	67%	0.668	65%	0.647	S	S	*	*			trans	-77.4	102.9	168.3	-84.6	-176.8	156.7	0	0	107	P544 H548	P544-E546 HydrophobicContact CB-CG 4.44Å; P544-E546 HydrophobicContact CG-CG 4.35Å; P544-E546 PolarHBondContact O-N 3.35Å; E546-H548 PolarHBondContact O-N 2.85Å
547	S	38.9	Very low	42.3	Very low	106 Å²	106	123.5 Å²	123.5	74%	0.741	65%	0.65	S	S	*	*			trans	-58.8	83.5	169.4	53.7	0	0	0	0	110	S545 N549	S545-S547 PolarHBondContact O-N 3.35Å; S547-N549 PolarHBondContact O-N 3Å
548	H	42.7	Very low	43.6	Very low	129 Å²	129	119.1 Å²	119.1	60%	0.597	62%	0.621	S	S	*	*			trans	-75.5	111.1	163.7	-79.9	-78.2	0	0	0	108.3	E546 F550	E546-H548 PolarHBondContact O-N 2.85Å; H548-F550 PolarHBondContact O-N 3.34Å
549	N	50.9	Low	45	Very low	139 Å²	139	110.5 Å²	110.5	74%	0.743	60%	0.602	S	S	*	*			trans	-69.4	112.4	174.4	-65.9	-11.7	0	0	0	108.6	S547	S547-N549 PolarHBondContact O-N 3Å
550	F	53.8	Low	46.4	Very low	67 Å²	67	101.5 Å²	101.5	29%	0.294	56%	0.559	S	S	.	*			trans	-86.2	134.9	177	-91.9	-86.2	0	0	0	110.9	V521 L523 H548 E554 L558	V521-F550 HydrophobicContact CB-CD2 4.46Å; V521-F550 HydrophobicContact CG1-CD2 4.41Å; V521-F550 HydrophobicContact CG2-CD2 4Å; V521-F550 HydrophobicContact CG2-CE2 4.45Å; L523-F550 WeakPolarHBondContact CD2-O 3.38Å; H548-F550 PolarHBondContact O-N 3.34Å; F550-E554 HydrophobicContact CD1-CB 3.69Å; F550-E554 HydrophobicContact CE1-CB 4.2Å; F550-L558 HydrophobicContact CD1-CD1 4.05Å; F550-L558 HydrophobicContact CE1-CD1 3.26Å; F550-L558 HydrophobicContact CZ-CD1 3.76Å
551	T	58.7	Low	47.8	Very low	81 Å²	81	104 Å²	104	50%	0.497	55%	0.549	S	S	.	.			trans	-77.7	150.7	170.4	-5	0	0	0	0	110.5	S553 E554 C555	T551-S553 PolarHBondContact O-N 3.47Å; T551-S553 VanDerWaalsContact O-N 3.14Å; T551-E554 PolarHBondContact N-OE2 3.43Å; T551-E554 PolarHBondContact O-N 3.3Å; T551-E554 VanDerWaalsContact OG1-CD 3.23Å; T551-E554 PolarHBondContact OG1-OE2 3.39Å; T551-C555 PolarHBondContact O-N 3.05Å; T551-C555 VanDerWaalsContact O-N 3.1Å
552	I	59.2	Low	49.2	Very low	85 Å²	85	94.3 Å²	94.3	44%	0.436	52%	0.519	S	S	.	.	H	α-helix	trans	-53.3	-38.3	178.5	-65.7	172.2	0	0	0	111.5	L523 C555 F556 V562	L523-I552 HydrophobicContact CD2-CG1 4.27Å; I552-C555 WeakPolarHBondContact O-CB 3.41Å; I552-C555 PolarHBondContact O-N 3.28Å; I552-F556 HydrophobicContact CG2-CD2 3.89Å; I552-F556 HydrophobicContact CG2-CE2 3.58Å; I552-F556 WeakPolarHBondContact O-CD2 3.39Å; I552-F556 PolarHBondContact O-N 3.31Å; I552-V562 HydrophobicContact CG2-CG2 4.4Å
553	S	58.4	Low	50.4	Low	71 Å²	71	95.6 Å²	95.6	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-62.7	-42.1	176.4	50.2	0	0	0	0	113.1	T551 C555 F556 E557	T551-S553 PolarHBondContact O-N 3.47Å; T551-S553 VanDerWaalsContact O-N 3.14Å; S553-C555 VanDerWaalsContact C-N 3.33Å; S553-F556 PolarHBondContact O-N 3.09Å; S553-E557 PolarHBondContact O-N 3.19Å
554	E	61.5	Low	51.6	Low	75 Å²	75	94.7 Å²	94.7	35%	0.35	51%	0.51	S	S	.	.	H	α-helix	trans	-69.5	-32.8	179	-67.4	170.4	144.3	0	0	111.5	F550 T551 F556 E557 L558	F550-E554 HydrophobicContact CD1-CB 3.69Å; F550-E554 HydrophobicContact CE1-CB 4.2Å; T551-E554 PolarHBondContact N-OE2 3.43Å; T551-E554 PolarHBondContact O-N 3.3Å; T551-E554 VanDerWaalsContact OG1-CD 3.23Å; T551-E554 PolarHBondContact OG1-OE2 3.39Å; E554-F556 VanDerWaalsContact C-N 3.34Å; E554-F556 PolarHBondContact O-N 3.27Å; E554-E557 PolarHBondContact O-N 2.96Å; E554-L558 WeakPolarHBondContact O-CB 3.23Å; E554-L558 WeakPolarHBondContact O-CG 3.31Å; E554-L558 PolarHBondContact O-N 2.66Å
555	C	59.6	Low	52.9	Low	0 Å²	0	94.9 Å²	94.9	0%	0	51%	0.506	C	S	.	.	H	α-helix	trans	-60.4	-43.4	172.5	-177.1	0	0	0	0	111.6	T551 I552 S553 L558 G559 G560 V562 C567	T551-C555 PolarHBondContact O-N 3.05Å; T551-C555 VanDerWaalsContact O-N 3.1Å; I552-C555 WeakPolarHBondContact O-CB 3.41Å; I552-C555 PolarHBondContact O-N 3.28Å; S553-C555 VanDerWaalsContact C-N 3.33Å; C555-L558 PolarHBondContact O-N 2.83Å; C555-G559 PolarHBondContact O-N 3.03Å; C555-G560 WeakPolarHBondContact O-CA 3.49Å; C555-G560 PolarHBondContact O-N 3.5Å; C555-V562 HydrophobicContact CB-CG2 4.47Å; C555-C567 VanDerWaalsContact CA-SG 3.57Å; C555-C567 HydrophobicContact CB-CB 3.87Å; C555-C567 WeakPolarHBondContact CB-SG 3.48Å; C555-C567 WeakPolarHBondContact SG-CB 3.46Å; C555-C567 CovalentContact SG-SG 2.03Å; C555-C567 PolarHBondContact SG-SG 3.07Å
556	F	59.7	Low	54	Low	132 Å²	132	90 Å²	90	58%	0.579	47%	0.474	S	S	*	.	H	α-helix	trans	-69.5	-36.9	176	-77	-66.6	0	0	0	112.7	I552 S553 E554 L558 G559 V562	I552-F556 HydrophobicContact CG2-CD2 3.89Å; I552-F556 HydrophobicContact CG2-CE2 3.58Å; I552-F556 WeakPolarHBondContact O-CD2 3.39Å; I552-F556 PolarHBondContact O-N 3.31Å; S553-F556 PolarHBondContact O-N 3.09Å; E554-F556 VanDerWaalsContact C-N 3.34Å; E554-F556 PolarHBondContact O-N 3.27Å; F556-L558 VanDerWaalsContact C-N 3.29Å; F556-L558 PolarHBondContact O-N 2.99Å; F556-G559 PolarHBondContact O-N 3.26Å; F556-G559 VanDerWaalsContact O-N 3.16Å; F556-V562 HydrophobicContact CE2-CG2 4.49Å
557	E	56.7	Low	55.1	Low	168 Å²	168	83.4 Å²	83.4	79%	0.785	44%	0.443	S	S	*	.	H	α-helix	trans	-64.7	-32.5	175.3	-75.5	-176	173.2	0	0	112.7	S553 E554 G559	S553-E557 PolarHBondContact O-N 3.19Å; E554-E557 PolarHBondContact O-N 2.96Å; E557-G559 VanDerWaalsContact C-N 3.28Å; E557-G559 PolarHBondContact O-N 3.41Å
558	L	52.4	Low	56	Low	55 Å²	55	81.3 Å²	81.3	29%	0.288	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	2.7	174.9	-73.3	167.6	0	0	0	114.2	L516 F550 E554 C555 F556 G560 I569	L516-L558 HydrophobicContact CD1-CD2 4.15Å; F550-L558 HydrophobicContact CD1-CD1 4.05Å; F550-L558 HydrophobicContact CE1-CD1 3.26Å; F550-L558 HydrophobicContact CZ-CD1 3.76Å; E554-L558 WeakPolarHBondContact O-CB 3.23Å; E554-L558 WeakPolarHBondContact O-CG 3.31Å; E554-L558 PolarHBondContact O-N 2.66Å; C555-L558 PolarHBondContact O-N 2.83Å; F556-L558 VanDerWaalsContact C-N 3.29Å; F556-L558 PolarHBondContact O-N 2.99Å; L558-G560 VanDerWaalsContact C-N 3.3Å; L558-G560 PolarHBondContact O-N 3.07Å; L558-I569 HydrophobicContact CB-CD1 4.03Å; L558-I569 HydrophobicContact CD1-CD1 4.17Å
559	G	53.5	Low	56.6	Low	45 Å²	45	76 Å²	76	46%	0.464	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	15.7	-178.6	0	0	0	0	0	114.6	C555 F556 E557	C555-G559 PolarHBondContact O-N 3.03Å; F556-G559 PolarHBondContact O-N 3.26Å; F556-G559 VanDerWaalsContact O-N 3.16Å; E557-G559 VanDerWaalsContact C-N 3.28Å; E557-G559 PolarHBondContact O-N 3.41Å
560	G	56.3	Low	56.7	Low	4 Å²	4	73.4 Å²	73.4	4%	0.041	38%	0.382	C	S	.	.			trans	-78.4	155.4	174.6	0	0	0	0	0	112.9	C555 L558 I568	C555-G560 WeakPolarHBondContact O-CA 3.49Å; C555-G560 PolarHBondContact O-N 3.5Å; L558-G560 VanDerWaalsContact C-N 3.3Å; L558-G560 PolarHBondContact O-N 3.07Å; G560-I568 CarbonylContact C-O 3.59Å; G560-I568 VanDerWaalsContact CA-O 3.3Å; G560-I568 WeakPolarHBondContact CA-O 3.33Å
561	R	56.4	Low	57	Low	141 Å²	141	71 Å²	71	53%	0.532	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	139	167.7	-70	-170.1	-177.4	-177.4	8.3	110.2	I568 H630	R561-I568 PolarHBondContact N-O 3.15Å; R561-I568 PolarHBondContact O-N 3.45Å; R561-H630 PolarHBondContact NH1-CD2 2.79Å; R561-H630 PolarHBondContact NH1-NE2 2.91Å; R561-H630 PolarHBondContact NH2-CD2 2.72Å
562	V	58.2	Low	57.5	Low	53 Å²	53	71.7 Å²	71.7	32%	0.321	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	116.2	170.8	-179.3	0	0	0	0	108.4	L523 I552 C555 F556 A566	L523-V562 HydrophobicContact CD1-CB 4.36Å; L523-V562 HydrophobicContact CD1-CG1 3.56Å; L523-V562 HydrophobicContact CD1-CG2 4.03Å; I552-V562 HydrophobicContact CG2-CG2 4.4Å; C555-V562 HydrophobicContact CB-CG2 4.47Å; F556-V562 HydrophobicContact CE2-CG2 4.49Å; V562-A566 WeakPolarHBondContact CA-O 3.32Å
563	Q	53.5	Low	58.2	Low	122 Å²	122	68 Å²	68	57%	0.57	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.5	125.8	171.3	-169.6	156	-1.4	0	0	108.8	D565 A566 I568	Q563-D565 PolarHBondContact O-N 3.3Å; Q563-A566 PolarHBondContact N-O 2.95Å; Q563-A566 VanDerWaalsContact N-O 3.1Å; Q563-A566 PolarHBondContact O-N 3.38Å; Q563-A566 VanDerWaalsContact O-N 3.13Å; Q563-I568 HydrophobicContact CB-CD1 4.24Å
564	D	54.5	Low	59.2	Low	152 Å²	152	66.5 Å²	66.5	81%	0.813	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	54.1	-178.4	-54.8	-37.6	0	0	0	113.6	A566	D564-A566 PolarHBondContact O-N 3.26Å; D564-A566 VanDerWaalsContact O-N 3.15Å
565	D	59	Low	60.3	Low	96 Å²	96	67.3 Å²	67.3	51%	0.513	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	33	-179.7	-65.8	-19.5	0	0	0	114	S522 L523 Q563	S522-D565 CarbonylContact C-O 3.47Å; L523-D565 WeakPolarHBondContact CA-O 3.43Å; L523-D565 HydrophobicContact CB-CB 4.3Å; L523-D565 VanDerWaalsContact CB-O 3.32Å; L523-D565 WeakPolarHBondContact CB-O 3.23Å; L523-D565 PolarHBondContact N-O 3.09Å; Q563-D565 PolarHBondContact O-N 3.3Å
566	A	56	Low	61.5	Low	27 Å²	27	68.1 Å²	68.1	22%	0.223	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	137.7	166.2	0	0	0	0	0	111.1	V521 V562 Q563 D564 I568	V521-A566 WeakPolarHBondContact O-CA 3.47Å; V562-A566 WeakPolarHBondContact CA-O 3.32Å; Q563-A566 PolarHBondContact N-O 2.95Å; Q563-A566 VanDerWaalsContact N-O 3.1Å; Q563-A566 PolarHBondContact O-N 3.38Å; Q563-A566 VanDerWaalsContact O-N 3.13Å; D564-A566 PolarHBondContact O-N 3.26Å; D564-A566 VanDerWaalsContact O-N 3.15Å; A566-I568 PolarHBondContact O-N 3.46Å
567	C	58.1	Low	62.8	Low	3 Å²	3	61.9 Å²	61.9	2%	0.02	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	110.7	168.6	-174.5	0	0	0	0	109	V521 C555	V521-C567 PolarHBondContact O-N 3.3Å; C555-C567 VanDerWaalsContact CA-SG 3.57Å; C555-C567 HydrophobicContact CB-CB 3.87Å; C555-C567 WeakPolarHBondContact CB-SG 3.48Å; C555-C567 WeakPolarHBondContact SG-CB 3.46Å; C555-C567 CovalentContact SG-SG 2.03Å; C555-C567 PolarHBondContact SG-SG 3.07Å
568	I	56.7	Low	64.3	Low	63 Å²	63	55.3 Å²	55.3	32%	0.323	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	104.3	176.5	-55	175.3	0	0	0	107.9	G560 R561 Q563 A566 E570	G560-I568 CarbonylContact C-O 3.59Å; G560-I568 VanDerWaalsContact CA-O 3.3Å; G560-I568 WeakPolarHBondContact CA-O 3.33Å; R561-I568 PolarHBondContact N-O 3.15Å; R561-I568 PolarHBondContact O-N 3.45Å; Q563-I568 HydrophobicContact CB-CD1 4.24Å; A566-I568 PolarHBondContact O-N 3.46Å; I568-E570 HydrophobicContact CG2-CG 4.44Å
569	I	54.7	Low	66.1	Low	16 Å²	16	56.8 Å²	56.8	8%	0.082	30%	0.3	C	S	.	.			trans	-90.6	119.3	170.5	-58.9	168	0	0	0	107	L558 P571	L558-I569 HydrophobicContact CB-CD1 4.03Å; L558-I569 HydrophobicContact CD1-CD1 4.17Å; I569-P571 VanDerWaalsContact O-CD 3.23Å; I569-P571 WeakPolarHBondContact O-CD 3.27Å
570	E	54.7	Low	67.8	Low	86 Å²	86	54.6 Å²	54.6	40%	0.402	28%	0.278	S	S	.	.			trans	-90.5	103	176.6	-71.4	-169.5	175.1	0	0	110.8	I568 N572 V573	I568-E570 HydrophobicContact CG2-CG 4.44Å; E570-N572 PolarHBondContact O-N 3.06Å; E570-N572 VanDerWaalsContact O-N 3.12Å; E570-V573 HydrophobicContact CB-CG2 4.25Å
571	P	58.5	Low	69.5	Low	17 Å²	17	54.6 Å²	54.6	11%	0.11	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-24.7	-174.6	-31.9	43.1	0	0	0	116.3	L516 K518 I569	L516-P571 WeakPolarHBondContact O-CA 3.42Å; L516-P571 WeakPolarHBondContact O-CB 3.31Å; L516-P571 WeakPolarHBondContact O-CG 3.39Å; K518-P571 VanDerWaalsContact CA-CG 3.48Å; K518-P571 HydrophobicContact CB-CG 3.74Å; K518-P571 HydrophobicContact CG-CG 4.38Å; I569-P571 VanDerWaalsContact O-CD 3.23Å; I569-P571 WeakPolarHBondContact O-CD 3.27Å
572	N	69.7	Low	71.3	Confident	95 Å²	95	53.1 Å²	53.1	51%	0.508	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	3.8	-152.1	-68	-27.7	0	0	0	112.9	E570 Y574 L575 F576	E570-N572 PolarHBondContact O-N 3.06Å; E570-N572 VanDerWaalsContact O-N 3.12Å; N572-Y574 PolarHBondContact O-N 3.43Å; N572-L575 PolarHBondContact O-N 3.41Å; N572-F576 WeakPolarHBondContact O-CB 3.34Å; N572-F576 PolarHBondContact O-N 2.83Å
573	V	75.2	Confident	73	Confident	8 Å²	8	53.6 Å²	53.6	5%	0.048	28%	0.279	C	S	.	.	H	α-helix	trans	-62.2	-43	-175.7	-177.7	0	0	0	0	111.3	N513 E570 S577 I629	N513-V573 HydrophobicContact CB-CB 4.22Å; N513-V573 HydrophobicContact CB-CG1 4.4Å; E570-V573 HydrophobicContact CB-CG2 4.25Å; V573-S577 WeakPolarHBondContact O-CB 3.35Å; V573-S577 PolarHBondContact O-N 3.34Å; V573-S577 PolarHBondContact O-OG 3.09Å; V573-I629 HydrophobicContact CG2-CG2 4.39Å
574	Y	79.4	Confident	74.9	Confident	38 Å²	38	47.8 Å²	47.8	15%	0.149	25%	0.252	C	S	.	.	H	α-helix	trans	-66	-52.2	177.6	176.1	-104.4	0	0	0	112.1	M506 I509 T510 V515 N572 F576 S577 V578	M506-Y574 WeakPolarHBondContact O-CE2 3.45Å; I509-Y574 HydrophobicContact CB-CD2 4.43Å; I509-Y574 HydrophobicContact CG2-CD2 4.26Å; T510-Y574 HydrophobicContact CG2-CD1 4.43Å; T510-Y574 HydrophobicContact CG2-CD2 4.24Å; T510-Y574 HydrophobicContact CG2-CE1 4.42Å; T510-Y574 HydrophobicContact CG2-CE2 4.24Å; T510-Y574 HydrophobicContact CG2-CG 4.33Å; T510-Y574 WeakPolarHBondContact OG1-CD2 3.43Å; T510-Y574 WeakPolarHBondContact OG1-CE2 3.2Å; T510-Y574 VanDerWaalsContact OG1-CZ 3.3Å; V515-Y574 HydrophobicContact CG2-CD1 3.68Å; V515-Y574 HydrophobicContact CG2-CG 4.24Å; N572-Y574 PolarHBondContact O-N 3.43Å; Y574-F576 VanDerWaalsContact C-N 3.26Å; Y574-F576 PolarHBondContact O-N 3.13Å; Y574-S577 WeakPolarHBondContact O-CA 3.19Å; Y574-S577 WeakPolarHBondContact O-CB 3.48Å; Y574-S577 PolarHBondContact O-N 3.47Å; Y574-V578 HydrophobicContact CD1-CG2 4.36Å; Y574-V578 HydrophobicContact CD2-CG2 4.46Å; Y574-V578 HydrophobicContact CE1-CG2 3.84Å; Y574-V578 HydrophobicContact CE2-CG2 3.93Å; Y574-V578 PolarHBondContact O-N 3.26Å
575	L	82.9	Confident	76.7	Confident	93 Å²	93	41.1 Å²	41.1	49%	0.487	22%	0.218	S	C	.	.	H	α-helix	trans	-57.6	-42.8	178.3	179.5	64.3	0	0	0	110.9	N572 S577 V578 I579	N572-L575 PolarHBondContact O-N 3.41Å; L575-S577 VanDerWaalsContact C-N 3.35Å; L575-V578 PolarHBondContact O-N 3.5Å; L575-I579 HydrophobicContact CD1-CD1 4.44Å; L575-I579 HydrophobicContact CG-CD1 4.08Å; L575-I579 VanDerWaalsContact O-CG1 3.28Å; L575-I579 WeakPolarHBondContact O-CG1 3.21Å; L575-I579 PolarHBondContact O-N 2.89Å
576	F	85.6	Confident	78.4	Confident	16 Å²	16	38.9 Å²	38.9	7%	0.07	21%	0.213	C	C	.	.	H	α-helix	trans	-62.6	-41.1	174.8	-177.6	-114.9	0	0	0	111.8	N572 Y574 V578 I579 M580 L627 I629 A631	N572-F576 WeakPolarHBondContact O-CB 3.34Å; N572-F576 PolarHBondContact O-N 2.83Å; Y574-F576 VanDerWaalsContact C-N 3.26Å; Y574-F576 PolarHBondContact O-N 3.13Å; F576-V578 PolarHBondContact O-N 3.19Å; F576-I579 PolarHBondContact O-N 3.05Å; F576-M580 HydrophobicContact CD1-CG 4.14Å; F576-M580 HydrophobicContact CD2-CG 4.29Å; F576-M580 HydrophobicContact CE1-CE 4.41Å; F576-M580 HydrophobicContact CE1-CG 3.82Å; F576-M580 HydrophobicContact CE1-SD 4.15Å; F576-M580 HydrophobicContact CE2-CG 3.95Å; F576-M580 HydrophobicContact CE2-SD 4.08Å; F576-M580 HydrophobicContact CG-CG 4.37Å; F576-M580 HydrophobicContact CZ-CE 4.33Å; F576-M580 HydrophobicContact CZ-CG 3.72Å; F576-M580 HydrophobicContact CZ-SD 3.63Å; F576-M580 WeakPolarHBondContact O-CB 3.46Å; F576-M580 WeakPolarHBondContact O-CG 3.3Å; F576-M580 PolarHBondContact O-N 2.95Å; F576-L627 HydrophobicContact CD2-CD1 4.34Å; F576-L627 HydrophobicContact CE2-CD1 3.37Å; F576-L627 HydrophobicContact CZ-CD1 3.78Å; F576-I629 HydrophobicContact CB-CD1 4.37Å; F576-I629 HydrophobicContact CB-CG2 4.21Å; F576-I629 HydrophobicContact CD1-CB 3.9Å; F576-I629 HydrophobicContact CD1-CD1 4.22Å; F576-I629 HydrophobicContact CD1-CG2 3.59Å; F576-I629 HydrophobicContact CD2-CD1 3.81Å; F576-I629 HydrophobicContact CE1-CB 4.02Å; F576-I629 HydrophobicContact CE1-CD1 4.49Å; F576-I629 HydrophobicContact CE1-CG2 4.21Å; F576-I629 HydrophobicContact CE2-CD1 4.14Å; F576-I629 HydrophobicContact CG-CB 4.38Å; F576-I629 HydrophobicContact CG-CD1 3.86Å; F576-I629 HydrophobicContact CG-CG2 4.01Å; F576-I629 HydrophobicContact CZ-CD1 4.46Å; F576-A631 HydrophobicContact CD1-CB 4.23Å; F576-A631 HydrophobicContact CE1-CB 4.17Å
577	S	86.7	Confident	80.3	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.007	21%	0.211	C	C	.	.	H	α-helix	trans	-62.1	-42.4	175.5	-61.9	0	0	0	0	112	V573 Y574 L575 M580 I581 P802	V573-S577 WeakPolarHBondContact O-CB 3.35Å; V573-S577 PolarHBondContact O-N 3.34Å; V573-S577 PolarHBondContact O-OG 3.09Å; Y574-S577 WeakPolarHBondContact O-CA 3.19Å; Y574-S577 WeakPolarHBondContact O-CB 3.48Å; Y574-S577 PolarHBondContact O-N 3.47Å; L575-S577 VanDerWaalsContact C-N 3.35Å; S577-M580 WeakPolarHBondContact O-CB 3.28Å; S577-M580 PolarHBondContact O-N 3.38Å; S577-I581 WeakPolarHBondContact O-CD1 3.31Å; S577-I581 VanDerWaalsContact O-CG1 3.24Å; S577-I581 WeakPolarHBondContact O-CG1 3.21Å; S577-I581 PolarHBondContact O-N 2.92Å; S577-P802 WeakPolarHBondContact OG-CG 3.16Å
578	V	88.9	Confident	81.8	Confident	31 Å²	31	39.1 Å²	39.1	19%	0.188	21%	0.21	C	C	.	.	H	α-helix	trans	-63.1	-44.6	174.6	174.4	0	0	0	0	111.1	M506 Y574 L575 F576 M580 I581 I582	M506-V578 HydrophobicContact CG-CG2 4.31Å; M506-V578 HydrophobicContact SD-CG2 4.3Å; Y574-V578 HydrophobicContact CD1-CG2 4.36Å; Y574-V578 HydrophobicContact CD2-CG2 4.46Å; Y574-V578 HydrophobicContact CE1-CG2 3.84Å; Y574-V578 HydrophobicContact CE2-CG2 3.93Å; Y574-V578 PolarHBondContact O-N 3.26Å; L575-V578 PolarHBondContact O-N 3.5Å; F576-V578 PolarHBondContact O-N 3.19Å; V578-M580 VanDerWaalsContact C-N 3.31Å; V578-M580 PolarHBondContact O-N 3.1Å; V578-I581 PolarHBondContact O-N 3.23Å; V578-I582 HydrophobicContact CG1-CD1 3.92Å; V578-I582 WeakPolarHBondContact O-CG1 3.12Å; V578-I582 PolarHBondContact O-N 3.41Å
579	I	89.5	Confident	83.5	Confident	85 Å²	85	39.8 Å²	39.8	44%	0.436	21%	0.211	S	C	.	.	H	α-helix	trans	-59.7	-44.7	175.5	-69	166	0	0	0	110.3	L575 F576 I581 I582 L583	L575-I579 HydrophobicContact CD1-CD1 4.44Å; L575-I579 HydrophobicContact CG-CD1 4.08Å; L575-I579 VanDerWaalsContact O-CG1 3.28Å; L575-I579 WeakPolarHBondContact O-CG1 3.21Å; L575-I579 PolarHBondContact O-N 2.89Å; F576-I579 PolarHBondContact O-N 3.05Å; I579-I581 PolarHBondContact O-N 3.23Å; I579-I582 PolarHBondContact O-N 3.12Å; I579-L583 WeakPolarHBondContact O-CB 3.2Å; I579-L583 PolarHBondContact O-N 3.12Å
580	M	90.1	Very high	85.2	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.2	-44.3	177.8	-72.2	-80.4	-76.7	0	0	111.5	F576 S577 V578 L583 T584 M620 L623 N624 P800 P802	F576-M580 HydrophobicContact CD1-CG 4.14Å; F576-M580 HydrophobicContact CD2-CG 4.29Å; F576-M580 HydrophobicContact CE1-CE 4.41Å; F576-M580 HydrophobicContact CE1-CG 3.82Å; F576-M580 HydrophobicContact CE1-SD 4.15Å; F576-M580 HydrophobicContact CE2-CG 3.95Å; F576-M580 HydrophobicContact CE2-SD 4.08Å; F576-M580 HydrophobicContact CG-CG 4.37Å; F576-M580 HydrophobicContact CZ-CE 4.33Å; F576-M580 HydrophobicContact CZ-CG 3.72Å; F576-M580 HydrophobicContact CZ-SD 3.63Å; F576-M580 WeakPolarHBondContact O-CB 3.46Å; F576-M580 WeakPolarHBondContact O-CG 3.3Å; F576-M580 PolarHBondContact O-N 2.95Å; S577-M580 WeakPolarHBondContact O-CB 3.28Å; S577-M580 PolarHBondContact O-N 3.38Å; V578-M580 VanDerWaalsContact C-N 3.31Å; V578-M580 PolarHBondContact O-N 3.1Å; M580-L583 PolarHBondContact O-N 3.23Å; M580-T584 WeakPolarHBondContact O-CB 3.14Å; M580-T584 PolarHBondContact O-N 2.85Å; M580-T584 PolarHBondContact O-OG1 3.36Å; M580-M620 HydrophobicContact CE-CB 3.7Å; M580-M620 HydrophobicContact CE-CG 4.43Å; M580-M620 WeakPolarHBondContact CE-O 3.33Å; M580-M620 HydrophobicContact CE-SD 4.3Å; M580-M620 HydrophobicContact SD-CB 4.31Å; M580-M620 HydrophobicContact SD-SD 3.66Å; M580-M620 VanDerWaalsContact SD-SD 3.66Å; M580-L623 HydrophobicContact SD-CD2 3.92Å; M580-L623 HydrophobicContact SD-CG 4.46Å; M580-N624 HydrophobicContact CE-CB 4.16Å; M580-P800 HydrophobicContact CE-CB 4.23Å; M580-P800 HydrophobicContact CE-CG 3.72Å; M580-P802 HydrophobicContact CB-CB 4.01Å
581	I	92	Very high	87	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-58	-53.1	176.6	-72.3	163	0	0	0	110.7	M506 S577 V578 I579 T584 A585 P802 L805 G806 I809	M506-I581 HydrophobicContact CB-CD1 3.81Å; M506-I581 HydrophobicContact CG-CD1 3.5Å; M506-I581 VanDerWaalsContact CG-CD1 3.5Å; M506-I581 HydrophobicContact SD-CD1 3.97Å; S577-I581 WeakPolarHBondContact O-CD1 3.31Å; S577-I581 VanDerWaalsContact O-CG1 3.24Å; S577-I581 WeakPolarHBondContact O-CG1 3.21Å; S577-I581 PolarHBondContact O-N 2.92Å; V578-I581 PolarHBondContact O-N 3.23Å; I579-I581 PolarHBondContact O-N 3.23Å; I581-T584 PolarHBondContact O-N 2.86Å; I581-A585 PolarHBondContact O-N 3.01Å; I581-A585 VanDerWaalsContact O-N 3.09Å; I581-P802 HydrophobicContact CD1-CB 4.4Å; I581-P802 HydrophobicContact CG1-CB 3.97Å; I581-P802 WeakPolarHBondContact CG1-O 3.48Å; I581-L805 HydrophobicContact CD1-CB 4.2Å; I581-L805 HydrophobicContact CD1-CD1 4.17Å; I581-L805 HydrophobicContact CG1-CB 4.03Å; I581-G806 VanDerWaalsContact O-CA 3.3Å; I581-G806 WeakPolarHBondContact O-CA 3.23Å; I581-I809 HydrophobicContact CG2-CD1 3.58Å
582	I	93.4	Very high	88.3	Confident	110 Å²	110	42 Å²	42	56%	0.564	23%	0.229	S	C	*	.	H	α-helix	trans	-64	-45.4	-178.1	-65.3	170	0	0	0	110.5	V578 I579 T584 A585 A586	V578-I582 HydrophobicContact CG1-CD1 3.92Å; V578-I582 WeakPolarHBondContact O-CG1 3.12Å; V578-I582 PolarHBondContact O-N 3.41Å; I579-I582 PolarHBondContact O-N 3.12Å; I582-T584 PolarHBondContact O-N 3.25Å; I582-A585 PolarHBondContact O-N 3.03Å; I582-A586 VanDerWaalsContact O-CB 3.32Å; I582-A586 WeakPolarHBondContact O-CB 3.43Å; I582-A586 PolarHBondContact O-N 3.49Å
583	L	94.1	Very high	88.9	Confident	63 Å²	63	46.8 Å²	46.8	33%	0.33	24%	0.24	S	C	.	.	H	α-helix	trans	-66.3	-38.7	-178.6	-173.3	58.7	0	0	0	111.4	I579 M580 A586 I587 M620 L623	I579-L583 WeakPolarHBondContact O-CB 3.2Å; I579-L583 PolarHBondContact O-N 3.12Å; M580-L583 PolarHBondContact O-N 3.23Å; L583-A586 PolarHBondContact O-N 3.18Å; L583-I587 HydrophobicContact CD1-CD1 4.07Å; L583-I587 HydrophobicContact CD1-CG1 4.23Å; L583-I587 HydrophobicContact CG-CD1 3.84Å; L583-I587 HydrophobicContact CG-CG1 4.43Å; L583-I587 WeakPolarHBondContact O-CB 3.09Å; L583-I587 WeakPolarHBondContact O-CG1 3.48Å; L583-I587 PolarHBondContact O-N 3.33Å; L583-M620 HydrophobicContact CB-SD 4.13Å; L583-M620 HydrophobicContact CD2-CE 3.59Å; L583-M620 HydrophobicContact CD2-SD 3.98Å; L583-M620 HydrophobicContact CG-CE 3.81Å; L583-M620 HydrophobicContact CG-SD 4.01Å; L583-L623 HydrophobicContact CD2-CD2 3.97Å
584	T	93.7	Very high	89.4	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.6	-46.4	175.4	-46.1	0	0	0	0	111	M580 I581 I582 I587 A588 A616 M620 A803 I807	M580-T584 WeakPolarHBondContact O-CB 3.14Å; M580-T584 PolarHBondContact O-N 2.85Å; M580-T584 PolarHBondContact O-OG1 3.36Å; I581-T584 PolarHBondContact O-N 2.86Å; I582-T584 PolarHBondContact O-N 3.25Å; T584-I587 PolarHBondContact O-N 3.2Å; T584-A588 WeakPolarHBondContact O-CB 3.45Å; T584-A588 PolarHBondContact O-N 3.39Å; T584-A616 HydrophobicContact CG2-CB 3.79Å; T584-M620 HydrophobicContact CG2-CG 4.15Å; T584-M620 VanDerWaalsContact OG1-CG 3.24Å; T584-M620 WeakPolarHBondContact OG1-CG 3.37Å; T584-A803 HydrophobicContact CG2-CB 4.24Å; T584-A803 WeakPolarHBondContact CG2-O 3.35Å; T584-A803 WeakPolarHBondContact OG1-CA 3.47Å; T584-I807 HydrophobicContact CG2-CD1 3.93Å; T584-I807 HydrophobicContact CG2-CG1 3.65Å
585	A	92.5	Very high	89.4	Confident	11 Å²	11	49 Å²	49	9%	0.091	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-45.5	177.1	0	0	0	0	0	111.3	I581 I582 A588 F589 G806	I581-A585 PolarHBondContact O-N 3.01Å; I581-A585 VanDerWaalsContact O-N 3.09Å; I582-A585 PolarHBondContact O-N 3.03Å; A585-A588 PolarHBondContact O-N 3.2Å; A585-F589 WeakPolarHBondContact O-CD2 3.37Å; A585-F589 PolarHBondContact O-N 3.18Å; A585-G806 WeakPolarHBondContact CB-O 3.3Å
586	A	94.6	Very high	88.9	Confident	50 Å²	50	50.5 Å²	50.5	41%	0.413	25%	0.253	S	S	.	.	H	α-helix	trans	-62.4	-44	179.1	0	0	0	0	0	112.3	I582 L583 F589 A590	I582-A586 VanDerWaalsContact O-CB 3.32Å; I582-A586 WeakPolarHBondContact O-CB 3.43Å; I582-A586 PolarHBondContact O-N 3.49Å; L583-A586 PolarHBondContact O-N 3.18Å; A586-F589 PolarHBondContact O-N 3.34Å; A586-A590 VanDerWaalsContact O-CB 3.3Å; A586-A590 WeakPolarHBondContact O-CB 3.3Å; A586-A590 PolarHBondContact O-N 3.12Å
587	I	94.7	Very high	88.4	Confident	35 Å²	35	50.7 Å²	50.7	18%	0.179	26%	0.257	C	S	.	.	H	α-helix	trans	-62.8	-45.8	175.6	-69.5	166.9	0	0	0	110.2	L583 T584 F589 A590 L591 A616 V619 M620	L583-I587 HydrophobicContact CD1-CD1 4.07Å; L583-I587 HydrophobicContact CD1-CG1 4.23Å; L583-I587 HydrophobicContact CG-CD1 3.84Å; L583-I587 HydrophobicContact CG-CG1 4.43Å; L583-I587 WeakPolarHBondContact O-CB 3.09Å; L583-I587 WeakPolarHBondContact O-CG1 3.48Å; L583-I587 PolarHBondContact O-N 3.33Å; T584-I587 PolarHBondContact O-N 3.2Å; I587-F589 VanDerWaalsContact C-N 3.32Å; I587-F589 PolarHBondContact O-N 3.44Å; I587-A590 PolarHBondContact O-N 2.85Å; I587-L591 HydrophobicContact CG2-CD1 3.68Å; I587-L591 HydrophobicContact CG2-CG 4.07Å; I587-L591 WeakPolarHBondContact O-CB 3.28Å; I587-L591 VanDerWaalsContact O-CG 3.27Å; I587-L591 WeakPolarHBondContact O-CG 3.24Å; I587-L591 PolarHBondContact O-N 3.42Å; I587-A616 HydrophobicContact CB-CB 4.33Å; I587-A616 HydrophobicContact CG2-CB 3.92Å; I587-V619 HydrophobicContact CD1-CG1 4.17Å; I587-M620 HydrophobicContact CD1-CE 3.53Å
588	A	91.1	Very high	87.8	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.7	-40.6	178.8	0	0	0	0	0	112.3	T584 A585 K592 N612 A616 Y810	T584-A588 WeakPolarHBondContact O-CB 3.45Å; T584-A588 PolarHBondContact O-N 3.39Å; A585-A588 PolarHBondContact O-N 3.2Å; A588-K592 WeakPolarHBondContact O-CB 3.38Å; A588-K592 PolarHBondContact O-N 3.29Å; A588-K592 VanDerWaalsContact O-N 3.09Å; A588-N612 PolarHBondContact O-ND2 2.65Å; A588-A616 HydrophobicContact CB-CB 4.39Å; A588-Y810 HydrophobicContact CB-CD1 3.85Å; A588-Y810 HydrophobicContact CB-CD2 3.94Å; A588-Y810 HydrophobicContact CB-CE1 4.13Å; A588-Y810 HydrophobicContact CB-CE2 4.21Å; A588-Y810 HydrophobicContact CB-CG 3.78Å
589	F	90.8	Very high	87.4	Confident	77 Å²	77	61.1 Å²	61.1	34%	0.338	31%	0.314	S	S	.	.	H	α-helix	trans	-65.1	-48.2	173	-86.3	-64.6	0	0	0	112.3	A585 A586 I587 L591 K592 W593 Y810 I813 V814	A585-F589 WeakPolarHBondContact O-CD2 3.37Å; A585-F589 PolarHBondContact O-N 3.18Å; A586-F589 PolarHBondContact O-N 3.34Å; I587-F589 VanDerWaalsContact C-N 3.32Å; I587-F589 PolarHBondContact O-N 3.44Å; F589-L591 PolarHBondContact O-N 2.84Å; F589-K592 PolarHBondContact O-N 2.71Å; F589-W593 WeakPolarHBondContact O-CB 3.4Å; F589-W593 PolarHBondContact O-N 3.44Å; F589-Y810 AromaticContact CD1-CD2 3.77Å; F589-Y810 HydrophobicContact CD1-CD2 3.77Å; F589-Y810 AromaticContact CD1-CE2 3.71Å; F589-Y810 HydrophobicContact CD1-CE2 3.71Å; F589-Y810 AromaticContact CD2-CD2 3.6Å; F589-Y810 HydrophobicContact CD2-CD2 3.6Å; F589-Y810 HydrophobicContact CD2-CE2 4.34Å; F589-Y810 AromaticContact CE1-CD2 3.74Å; F589-Y810 HydrophobicContact CE1-CD2 3.74Å; F589-Y810 AromaticContact CE1-CE2 3.83Å; F589-Y810 HydrophobicContact CE1-CE2 3.83Å; F589-Y810 AromaticContact CE2-CD2 3.56Å; F589-Y810 HydrophobicContact CE2-CD2 3.56Å; F589-Y810 HydrophobicContact CE2-CE2 4.44Å; F589-Y810 HydrophobicContact CE2-CG 4.38Å; F589-Y810 AromaticContact CG-CD2 3.69Å; F589-Y810 HydrophobicContact CG-CD2 3.69Å; F589-Y810 AromaticContact CG-CE2 3.96Å; F589-Y810 HydrophobicContact CG-CE2 3.96Å; F589-Y810 AromaticContact CZ-CD2 3.61Å; F589-Y810 HydrophobicContact CZ-CD2 3.61Å; F589-Y810 HydrophobicContact CZ-CE2 4.19Å; F589-I813 HydrophobicContact CZ-CB 4.17Å; F589-I813 HydrophobicContact CZ-CG2 3.9Å; F589-V814 HydrophobicContact CD1-CG2 4.45Å; F589-V814 HydrophobicContact CE1-CG2 3.53Å; F589-V814 HydrophobicContact CZ-CG2 3.93Å
590	A	92	Very high	87	Confident	61 Å²	61	64.4 Å²	64.4	50%	0.504	33%	0.325	S	S	.	.	H	α-helix	trans	-62.1	-43.7	-178.9	0	0	0	0	0	111.9	A586 I587 W593 F594	A586-A590 VanDerWaalsContact O-CB 3.3Å; A586-A590 WeakPolarHBondContact O-CB 3.3Å; A586-A590 PolarHBondContact O-N 3.12Å; I587-A590 PolarHBondContact O-N 2.85Å; A590-W593 PolarHBondContact O-N 3.4Å; A590-F594 PolarHBondContact O-N 3.29Å
591	L	91.3	Very high	86.5	Confident	32 Å²	32	67.7 Å²	67.7	17%	0.168	35%	0.348	C	S	.	.	H	α-helix	trans	-68.2	-33.1	176.8	-65.8	179.8	0	0	0	112.2	I587 F589 F594 I608 A609 N612 I615	I587-L591 HydrophobicContact CG2-CD1 3.68Å; I587-L591 HydrophobicContact CG2-CG 4.07Å; I587-L591 WeakPolarHBondContact O-CB 3.28Å; I587-L591 VanDerWaalsContact O-CG 3.27Å; I587-L591 WeakPolarHBondContact O-CG 3.24Å; I587-L591 PolarHBondContact O-N 3.42Å; F589-L591 PolarHBondContact O-N 2.84Å; L591-F594 VanDerWaalsContact O-CB 3.25Å; L591-F594 WeakPolarHBondContact O-CB 3.28Å; L591-F594 PolarHBondContact O-N 2.93Å; L591-I608 HydrophobicContact CD2-CG2 3.71Å; L591-A609 WeakPolarHBondContact O-CA 3.28Å; L591-A609 WeakPolarHBondContact O-CB 3.5Å; L591-N612 HydrophobicContact CB-CB 3.57Å; L591-N612 HydrophobicContact CD1-CB 4.41Å; L591-I615 HydrophobicContact CD1-CB 3.76Å; L591-I615 HydrophobicContact CD1-CD1 4.37Å; L591-I615 HydrophobicContact CD1-CG2 3.58Å
592	K	85.6	Confident	85.6	Confident	71 Å²	71	71.1 Å²	71.1	31%	0.309	37%	0.372	S	S	.	.	H	α-helix	trans	-66.4	-45.3	170.9	-177	161.3	177.1	175	0	111.2	A588 F589 F594 R595 E752 Y810 V814	A588-K592 WeakPolarHBondContact O-CB 3.38Å; A588-K592 PolarHBondContact O-N 3.29Å; A588-K592 VanDerWaalsContact O-N 3.09Å; F589-K592 PolarHBondContact O-N 2.71Å; K592-F594 PolarHBondContact O-N 3.37Å; K592-R595 VanDerWaalsContact O-CB 3.31Å; K592-R595 WeakPolarHBondContact O-CB 3.49Å; K592-R595 PolarHBondContact O-N 3.44Å; K592-E752 IonicContact NZ-OE1 2.79Å; K592-Y810 HydrophobicContact CD-CE2 4.5Å; K592-Y810 WeakPolarHBondContact CD-OH 3.46Å; K592-V814 VanDerWaalsContact NZ-CG1 3.34Å
593	W	84	Confident	84.8	Confident	197 Å²	197	75.4 Å²	75.4	75%	0.746	38%	0.381	S	S	*	.	H	α-helix	trans	-62.1	-31.1	176.6	-168.5	-78.9	0	0	0	112.3	F589 A590 R595 H596	F589-W593 WeakPolarHBondContact O-CB 3.4Å; F589-W593 PolarHBondContact O-N 3.44Å; A590-W593 PolarHBondContact O-N 3.4Å; W593-R595 PolarHBondContact O-N 2.93Å; W593-H596 PolarHBondContact O-N 3.2Å
594	F	84.1	Confident	84.3	Confident	43 Å²	43	75.5 Å²	75.5	19%	0.189	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-53.4	-25.9	177.4	-164.6	-105.9	0	0	0	113	A590 L591 K592 H596 S597 F599 F600 R605 I608	A590-F594 PolarHBondContact O-N 3.29Å; L591-F594 VanDerWaalsContact O-CB 3.25Å; L591-F594 WeakPolarHBondContact O-CB 3.28Å; L591-F594 PolarHBondContact O-N 2.93Å; K592-F594 PolarHBondContact O-N 3.37Å; F594-H596 PolarHBondContact O-N 3.49Å; F594-H596 VanDerWaalsContact O-N 3.16Å; F594-S597 WeakPolarHBondContact CD2-OG 3.4Å; F594-S597 VanDerWaalsContact O-CB 3.31Å; F594-S597 WeakPolarHBondContact O-CB 3.44Å; F594-S597 PolarHBondContact O-N 2.93Å; F594-S597 PolarHBondContact O-OG 3.25Å; F594-F599 HydrophobicContact CE2-CB 4.49Å; F594-F600 HydrophobicContact CE1-CD2 4.2Å; F594-F600 HydrophobicContact CE2-CD2 4.43Å; F594-F600 AromaticContact CZ-CD2 3.48Å; F594-F600 HydrophobicContact CZ-CD2 3.48Å; F594-F600 VanDerWaalsContact CZ-CD2 3.48Å; F594-F600 AromaticContact CZ-CE2 3.8Å; F594-F600 HydrophobicContact CZ-CE2 3.8Å; F594-R605 HydrophobicContact CD1-CB 4.5Å; F594-R605 HydrophobicContact CD1-CG 3.86Å; F594-R605 HydrophobicContact CE1-CB 4.4Å; F594-R605 HydrophobicContact CE1-CG 4.12Å; F594-R605 WeakPolarHBondContact O-CD 3.27Å; F594-R605 WeakPolarHBondContact O-CG 3.43Å; F594-I608 HydrophobicContact CD1-CB 4.16Å; F594-I608 HydrophobicContact CD1-CD1 4.38Å; F594-I608 HydrophobicContact CD1-CG2 3.88Å; F594-I608 HydrophobicContact CE1-CB 4.38Å; F594-I608 HydrophobicContact CE1-CD1 3.76Å; F594-I608 HydrophobicContact CE1-CG2 4.29Å; F594-I608 HydrophobicContact CZ-CD1 4.45Å
595	R	80.5	Confident	83.8	Confident	48 Å²	48	78.3 Å²	78.3	18%	0.181	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-53.4	-31.6	172.1	-167.6	173	-64.4	-149.7	-5.6	114	K592 W593 R605 A609 D610	K592-R595 VanDerWaalsContact O-CB 3.31Å; K592-R595 WeakPolarHBondContact O-CB 3.49Å; K592-R595 PolarHBondContact O-N 3.44Å; W593-R595 PolarHBondContact O-N 2.93Å; R595-R605 VanDerWaalsContact O-CD 3.25Å; R595-R605 WeakPolarHBondContact O-CD 3.4Å; R595-R605 PolarHBondContact O-NE 3.45Å; R595-R605 PolarHBondContact O-NH1 3.05Å; R595-R605 PolarHBondContact O-NH2 3.29Å; R595-A609 HydrophobicContact CB-CB 3.8Å; R595-A609 HydrophobicContact CG-CB 4.38Å; R595-D610 IonicContact CZ-OD1 2.72Å; R595-D610 IonicContact NH2-OD1 3.16Å; R595-D610 PolarHBondContact NH2-OD1 3.26Å
596	H	71	Confident	83.2	Confident	125 Å²	125	79 Å²	79	58%	0.579	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-96.5	-7.7	179.7	-61.2	-69.6	0	0	0	113.1	W593 F594	W593-H596 PolarHBondContact O-N 3.2Å; F594-H596 PolarHBondContact O-N 3.49Å; F594-H596 VanDerWaalsContact O-N 3.16Å
597	S	76.9	Confident	82.8	Confident	21 Å²	21	79.2 Å²	79.2	15%	0.147	39%	0.393	C	S	.	.			trans	-66.2	151.7	178.9	78.4	0	0	0	0	111.8	F594 F599 R605	F594-S597 WeakPolarHBondContact CD2-OG 3.4Å; F594-S597 VanDerWaalsContact O-CB 3.31Å; F594-S597 WeakPolarHBondContact O-CB 3.44Å; F594-S597 PolarHBondContact O-N 2.93Å; F594-S597 PolarHBondContact O-OG 3.25Å; S597-F599 VanDerWaalsContact C-N 3.3Å; S597-R605 WeakPolarHBondContact O-CD 3.43Å; S597-R605 PolarHBondContact O-NH1 3.21Å
598	S	73.5	Confident	82.4	Confident	111 Å²	111	79.7 Å²	79.7	78%	0.776	40%	0.396	S	S	*	.	S	Bend	trans	-85.3	-4.8	178.3	47.3	0	0	0	0	113.2
599	F	79.6	Confident	82.1	Confident	140 Å²	140	79.9 Å²	79.9	61%	0.614	40%	0.397	S	S	*	.	S	Bend	trans	-79.6	141.4	-179.6	-60.5	-76.8	0	0	0	111.1	F594 S597	F594-F599 HydrophobicContact CE2-CB 4.49Å; S597-F599 VanDerWaalsContact C-N 3.3Å
600	F	82.4	Confident	81.8	Confident	153 Å²	153	77 Å²	77	67%	0.671	39%	0.385	S	S	*	.	S	Bend	trans	64	173.9	-179.7	-54.2	-88.1	0	0	0	116.3	F594 V604	F594-F600 HydrophobicContact CE1-CD2 4.2Å; F594-F600 HydrophobicContact CE2-CD2 4.43Å; F594-F600 AromaticContact CZ-CD2 3.48Å; F594-F600 HydrophobicContact CZ-CD2 3.48Å; F594-F600 VanDerWaalsContact CZ-CD2 3.48Å; F594-F600 AromaticContact CZ-CE2 3.8Å; F594-F600 HydrophobicContact CZ-CE2 3.8Å; F600-V604 HydrophobicContact CB-CB 4.46Å; F600-V604 HydrophobicContact CB-CG1 4.4Å
601	S	78.5	Confident	81.7	Confident	69 Å²	69	76.1 Å²	76.1	48%	0.483	37%	0.37	S	S	.	.			trans	-73	150.7	177	74.9	0	0	0	0	111.9	R603 V604 R605	S601-R603 PolarHBondContact O-N 3Å; S601-R603 VanDerWaalsContact O-N 3.07Å; S601-V604 PolarHBondContact O-N 2.96Å; S601-V604 VanDerWaalsContact O-N 3.13Å; S601-R605 WeakPolarHBondContact O-CB 3.33Å; S601-R605 PolarHBondContact O-N 2.99Å
602	S	73.6	Confident	81.6	Confident	76 Å²	76	75.3 Å²	75.3	53%	0.531	37%	0.366	S	S	.	.	H	α-helix	trans	-54.3	-32.8	-178.9	-49.7	0	0	0	0	113.8	N606	S602-N606 WeakPolarHBondContact O-CB 3.45Å; S602-N606 PolarHBondContact O-N 3.14Å; S602-N606 VanDerWaalsContact O-N 3.08Å; S602-N606 PolarHBondContact O-ND2 2.91Å
603	R	76.6	Confident	81.7	Confident	201 Å²	201	72.5 Å²	72.5	76%	0.758	36%	0.355	S	S	*	.	H	α-helix	trans	-65.2	-54	177.7	-69.6	-175.4	179.1	167.8	-2.3	111.3	S601 R605 N606 V607	S601-R603 PolarHBondContact O-N 3Å; S601-R603 VanDerWaalsContact O-N 3.07Å; R603-R605 VanDerWaalsContact C-N 3.32Å; R603-R605 PolarHBondContact O-N 2.95Å; R603-N606 PolarHBondContact O-N 2.92Å; R603-V607 WeakPolarHBondContact O-CG2 3.25Å; R603-V607 PolarHBondContact O-N 3.16Å
604	V	83.4	Confident	81.8	Confident	65 Å²	65	64.6 Å²	64.6	39%	0.394	33%	0.328	S	S	.	.	H	α-helix	trans	-61.7	-44.5	-178.9	175.5	0	0	0	0	110.4	F600 S601 N606 V607 I608	F600-V604 HydrophobicContact CB-CB 4.46Å; F600-V604 HydrophobicContact CB-CG1 4.4Å; S601-V604 PolarHBondContact O-N 2.96Å; S601-V604 VanDerWaalsContact O-N 3.13Å; V604-N606 VanDerWaalsContact C-N 3.35Å; V604-N606 PolarHBondContact O-N 3.29Å; V604-V607 PolarHBondContact O-N 2.91Å; V604-I608 HydrophobicContact CG1-CD1 3.68Å; V604-I608 HydrophobicContact CG1-CG1 4.34Å; V604-I608 WeakPolarHBondContact O-CG1 3.32Å; V604-I608 PolarHBondContact O-N 3.4Å
605	R	83.4	Confident	82.2	Confident	59 Å²	59	65.3 Å²	65.3	22%	0.223	33%	0.333	C	S	.	.	H	α-helix	trans	-58.7	-43.1	178.6	-169.9	-178.1	64.8	171.8	5.9	112.8	F594 R595 S597 S601 R603 A609	F594-R605 HydrophobicContact CD1-CB 4.5Å; F594-R605 HydrophobicContact CD1-CG 3.86Å; F594-R605 HydrophobicContact CE1-CB 4.4Å; F594-R605 HydrophobicContact CE1-CG 4.12Å; F594-R605 WeakPolarHBondContact O-CD 3.27Å; F594-R605 WeakPolarHBondContact O-CG 3.43Å; R595-R605 VanDerWaalsContact O-CD 3.25Å; R595-R605 WeakPolarHBondContact O-CD 3.4Å; R595-R605 PolarHBondContact O-NE 3.45Å; R595-R605 PolarHBondContact O-NH1 3.05Å; R595-R605 PolarHBondContact O-NH2 3.29Å; S597-R605 WeakPolarHBondContact O-CD 3.43Å; S597-R605 PolarHBondContact O-NH1 3.21Å; S601-R605 WeakPolarHBondContact O-CB 3.33Å; S601-R605 PolarHBondContact O-N 2.99Å; R603-R605 VanDerWaalsContact C-N 3.32Å; R603-R605 PolarHBondContact O-N 2.95Å; R605-A609 WeakPolarHBondContact O-CB 3.31Å; R605-A609 PolarHBondContact O-N 3.19Å; R605-A609 VanDerWaalsContact O-N 3.09Å
606	N	80.1	Confident	82.7	Confident	24 Å²	24	63 Å²	63	13%	0.128	32%	0.324	C	S	.	.	H	α-helix	trans	-68	-41.1	176.9	-71	-12.5	0	0	0	111.7	S602 R603 V604 A609 D610	S602-N606 WeakPolarHBondContact O-CB 3.45Å; S602-N606 PolarHBondContact O-N 3.14Å; S602-N606 VanDerWaalsContact O-N 3.08Å; S602-N606 PolarHBondContact O-ND2 2.91Å; R603-N606 PolarHBondContact O-N 2.92Å; V604-N606 VanDerWaalsContact C-N 3.35Å; V604-N606 PolarHBondContact O-N 3.29Å; N606-A609 PolarHBondContact O-N 3.39Å; N606-D610 WeakPolarHBondContact O-CB 3.27Å; N606-D610 PolarHBondContact O-N 3.37Å
607	V	85	Confident	83.6	Confident	56 Å²	56	57.4 Å²	57.4	34%	0.339	30%	0.299	S	S	.	.	H	α-helix	trans	-62	-47.5	177.1	173.3	0	0	0	0	111.4	T369 R603 V604 A609 D610 F611	T369-V607 HydrophobicContact CG2-CG2 4.02Å; R603-V607 WeakPolarHBondContact O-CG2 3.25Å; R603-V607 PolarHBondContact O-N 3.16Å; V604-V607 PolarHBondContact O-N 2.91Å; V607-A609 VanDerWaalsContact C-N 3.28Å; V607-A609 PolarHBondContact O-N 3.44Å; V607-D610 PolarHBondContact O-N 3.32Å; V607-F611 HydrophobicContact CG1-CD2 4.02Å; V607-F611 HydrophobicContact CG1-CE2 4.36Å; V607-F611 WeakPolarHBondContact O-CD2 3.41Å; V607-F611 PolarHBondContact O-N 2.88Å
608	I	87.7	Confident	84.1	Confident	45 Å²	45	58.8 Å²	58.8	23%	0.231	31%	0.312	C	S	.	.	H	α-helix	trans	-60	-42	177.7	-69.1	170.6	0	0	0	110.7	L591 F594 V604 N612	L591-I608 HydrophobicContact CD2-CG2 3.71Å; F594-I608 HydrophobicContact CD1-CB 4.16Å; F594-I608 HydrophobicContact CD1-CD1 4.38Å; F594-I608 HydrophobicContact CD1-CG2 3.88Å; F594-I608 HydrophobicContact CE1-CB 4.38Å; F594-I608 HydrophobicContact CE1-CD1 3.76Å; F594-I608 HydrophobicContact CE1-CG2 4.29Å; F594-I608 HydrophobicContact CZ-CD1 4.45Å; V604-I608 HydrophobicContact CG1-CD1 3.68Å; V604-I608 HydrophobicContact CG1-CG1 4.34Å; V604-I608 WeakPolarHBondContact O-CG1 3.32Å; V604-I608 PolarHBondContact O-N 3.4Å; I608-N612 PolarHBondContact O-N 2.92Å
609	A	84.3	Confident	85	Confident	3 Å²	3	56.8 Å²	56.8	3%	0.025	29%	0.294	C	S	.	.	H	α-helix	trans	-71	-32.3	178.6	0	0	0	0	0	113.5	L591 R595 R605 N606 V607 N612	L591-A609 WeakPolarHBondContact O-CA 3.28Å; L591-A609 WeakPolarHBondContact O-CB 3.5Å; R595-A609 HydrophobicContact CB-CB 3.8Å; R595-A609 HydrophobicContact CG-CB 4.38Å; R605-A609 WeakPolarHBondContact O-CB 3.31Å; R605-A609 PolarHBondContact O-N 3.19Å; R605-A609 VanDerWaalsContact O-N 3.09Å; N606-A609 PolarHBondContact O-N 3.39Å; V607-A609 VanDerWaalsContact C-N 3.28Å; V607-A609 PolarHBondContact O-N 3.44Å; A609-N612 WeakPolarHBondContact O-CB 3.43Å; A609-N612 PolarHBondContact O-OD1 3.2Å
610	D	84.9	Confident	85.6	Confident	17 Å²	17	50.2 Å²	50.2	9%	0.091	27%	0.266	C	S	.	.	H	α-helix	trans	-71	-37.6	176.3	-71.5	-19.8	0	0	0	111.3	T369 A373 R595 N606 V607 N612	T369-D610 PolarHBondContact OG1-OD2 3.42Å; A373-D610 WeakPolarHBondContact CB-O 3.26Å; R595-D610 IonicContact CZ-OD1 2.72Å; R595-D610 IonicContact NH2-OD1 3.16Å; R595-D610 PolarHBondContact NH2-OD1 3.26Å; N606-D610 WeakPolarHBondContact O-CB 3.27Å; N606-D610 PolarHBondContact O-N 3.37Å; V607-D610 PolarHBondContact O-N 3.32Å; D610-N612 VanDerWaalsContact C-N 3.31Å; D610-N612 PolarHBondContact O-N 3.46Å
611	F	89.6	Confident	85.8	Confident	42 Å²	42	43.1 Å²	43.1	18%	0.184	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	16.5	177.9	-79	-86.8	0	0	0	113.8	I372 A373 I376 V607 V613 T614 I615	I372-F611 HydrophobicContact CB-CZ 4.41Å; I372-F611 HydrophobicContact CG2-CE1 4.4Å; I372-F611 HydrophobicContact CG2-CZ 4.11Å; A373-F611 HydrophobicContact CB-CD1 3.84Å; A373-F611 HydrophobicContact CB-CD2 4.17Å; A373-F611 HydrophobicContact CB-CE1 3.85Å; A373-F611 HydrophobicContact CB-CE2 4.18Å; A373-F611 HydrophobicContact CB-CG 4.01Å; A373-F611 HydrophobicContact CB-CZ 4.02Å; I376-F611 HydrophobicContact CD1-CE1 4.23Å; V607-F611 HydrophobicContact CG1-CD2 4.02Å; V607-F611 HydrophobicContact CG1-CE2 4.36Å; V607-F611 WeakPolarHBondContact O-CD2 3.41Å; V607-F611 PolarHBondContact O-N 2.88Å; F611-V613 VanDerWaalsContact C-N 3.31Å; F611-V613 PolarHBondContact O-N 2.78Å; F611-T614 HydrophobicContact CD1-CG2 4.4Å; F611-T614 PolarHBondContact O-N 3.46Å; F611-T614 VanDerWaalsContact O-N 3.16Å; F611-I615 HydrophobicContact CB-CD1 3.83Å; F611-I615 HydrophobicContact CB-CG1 4.06Å; F611-I615 WeakPolarHBondContact O-CB 3.38Å; F611-I615 VanDerWaalsContact O-CG1 3.28Å; F611-I615 WeakPolarHBondContact O-CG1 3.39Å; F611-I615 PolarHBondContact O-N 3.43Å
612	N	88	Confident	86.4	Confident	16 Å²	16	44.3 Å²	44.3	9%	0.086	24%	0.239	C	C	.	.	H	α-helix	trans	-53.5	-44.3	-174.3	66.4	-28.4	0	0	0	113.4	A588 L591 I608 A609 D610 A616 Y810	A588-N612 PolarHBondContact O-ND2 2.65Å; L591-N612 HydrophobicContact CB-CB 3.57Å; L591-N612 HydrophobicContact CD1-CB 4.41Å; I608-N612 PolarHBondContact O-N 2.92Å; A609-N612 WeakPolarHBondContact O-CB 3.43Å; A609-N612 PolarHBondContact O-OD1 3.2Å; D610-N612 VanDerWaalsContact C-N 3.31Å; D610-N612 PolarHBondContact O-N 3.46Å; N612-A616 WeakPolarHBondContact O-CB 3.43Å; N612-A616 PolarHBondContact O-N 2.79Å; N612-Y810 PolarHBondContact ND2-OH 3.35Å; N612-Y810 VanDerWaalsContact ND2-OH 3.13Å
613	V	87.7	Confident	87	Confident	12 Å²	12	43.1 Å²	43.1	7%	0.073	23%	0.227	C	C	.	.	H	α-helix	trans	-69.8	-46	179.4	179.5	0	0	0	0	111	F377 F611 I615 A616 I617 I807 Y810	F377-V613 HydrophobicContact CD2-CB 4.27Å; F377-V613 HydrophobicContact CD2-CG1 3.64Å; F377-V613 HydrophobicContact CD2-CG2 4.49Å; F377-V613 HydrophobicContact CE2-CG1 4.2Å; F611-V613 VanDerWaalsContact C-N 3.31Å; F611-V613 PolarHBondContact O-N 2.78Å; V613-I615 PolarHBondContact O-N 2.9Å; V613-A616 WeakPolarHBondContact O-CB 3.44Å; V613-A616 PolarHBondContact O-N 3.19Å; V613-I617 HydrophobicContact CG1-CD1 4.34Å; V613-I617 WeakPolarHBondContact O-CG1 3.28Å; V613-I617 PolarHBondContact O-N 3.24Å; V613-I807 HydrophobicContact CG1-CB 4.4Å; V613-I807 HydrophobicContact CG1-CD1 3.75Å; V613-I807 HydrophobicContact CG1-CG1 3.96Å; V613-I807 HydrophobicContact CG1-CG2 3.53Å; V613-I807 HydrophobicContact CG2-CG2 4.48Å; V613-Y810 HydrophobicContact CG2-CD1 4.49Å; V613-Y810 HydrophobicContact CG2-CE1 4.03Å
614	T	87.1	Confident	87.4	Confident	30 Å²	30	34.4 Å²	34.4	18%	0.184	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-41.9	-179.7	-47.8	0	0	0	0	112	I376 F611 A616 I617 A618	I376-T614 HydrophobicContact CG2-CG2 3.92Å; F611-T614 HydrophobicContact CD1-CG2 4.4Å; F611-T614 PolarHBondContact O-N 3.46Å; F611-T614 VanDerWaalsContact O-N 3.16Å; T614-A616 VanDerWaalsContact C-N 3.34Å; T614-I617 PolarHBondContact O-N 3.44Å; T614-A618 WeakPolarHBondContact O-CB 3.48Å; T614-A618 PolarHBondContact O-N 3Å
615	I	91.6	Very high	87.4	Confident	58 Å²	58	34.2 Å²	34.2	30%	0.297	20%	0.201	S	C	.	.	H	α-helix	trans	-64.4	-41.4	175.5	-66.3	165.5	0	0	0	109.9	L591 F611 V613 A618 V619	L591-I615 HydrophobicContact CD1-CB 3.76Å; L591-I615 HydrophobicContact CD1-CD1 4.37Å; L591-I615 HydrophobicContact CD1-CG2 3.58Å; F611-I615 HydrophobicContact CB-CD1 3.83Å; F611-I615 HydrophobicContact CB-CG1 4.06Å; F611-I615 WeakPolarHBondContact O-CB 3.38Å; F611-I615 VanDerWaalsContact O-CG1 3.28Å; F611-I615 WeakPolarHBondContact O-CG1 3.39Å; F611-I615 PolarHBondContact O-N 3.43Å; V613-I615 PolarHBondContact O-N 2.9Å; I615-A618 PolarHBondContact O-N 3.24Å; I615-V619 HydrophobicContact CG2-CG2 4.03Å; I615-V619 WeakPolarHBondContact O-CB 3.23Å; I615-V619 VanDerWaalsContact O-CG2 3.25Å; I615-V619 WeakPolarHBondContact O-CG2 3.49Å; I615-V619 PolarHBondContact O-N 3.2Å
616	A	92.3	Very high	87.4	Confident	0 Å²	0	36 Å²	36	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.2	-46.9	176.2	0	0	0	0	0	111.7	T584 I587 A588 N612 V613 T614 A618 V619 M620	T584-A616 HydrophobicContact CG2-CB 3.79Å; I587-A616 HydrophobicContact CB-CB 4.33Å; I587-A616 HydrophobicContact CG2-CB 3.92Å; A588-A616 HydrophobicContact CB-CB 4.39Å; N612-A616 WeakPolarHBondContact O-CB 3.43Å; N612-A616 PolarHBondContact O-N 2.79Å; V613-A616 WeakPolarHBondContact O-CB 3.44Å; V613-A616 PolarHBondContact O-N 3.19Å; T614-A616 VanDerWaalsContact C-N 3.34Å; A616-A618 VanDerWaalsContact C-N 3.35Å; A616-A618 PolarHBondContact O-N 3.33Å; A616-V619 PolarHBondContact O-N 2.89Å; A616-M620 WeakPolarHBondContact O-CB 3.31Å; A616-M620 WeakPolarHBondContact O-CG 3.43Å; A616-M620 PolarHBondContact O-N 3.27Å; A616-M620 VanDerWaalsContact O-N 3.08Å
617	I	88.6	Confident	87.4	Confident	7 Å²	7	39.1 Å²	39.1	4%	0.036	24%	0.237	C	C	.	.	H	α-helix	trans	-58.4	-47.6	174.8	-62.2	172.9	0	0	0	110.8	F380 V613 T614 M620 A621 V799 L804 I807	F380-I617 HydrophobicContact CB-CD1 4.34Å; F380-I617 HydrophobicContact CD2-CD1 3.86Å; F380-I617 HydrophobicContact CE2-CD1 4.43Å; F380-I617 HydrophobicContact CG-CD1 4.18Å; V613-I617 HydrophobicContact CG1-CD1 4.34Å; V613-I617 WeakPolarHBondContact O-CG1 3.28Å; V613-I617 PolarHBondContact O-N 3.24Å; T614-I617 PolarHBondContact O-N 3.44Å; I617-M620 PolarHBondContact O-N 3.29Å; I617-A621 VanDerWaalsContact O-CB 3.3Å; I617-A621 WeakPolarHBondContact O-CB 3.37Å; I617-A621 PolarHBondContact O-N 3.12Å; I617-V799 HydrophobicContact CG2-CB 4.5Å; I617-V799 HydrophobicContact CG2-CG1 3.75Å; I617-V799 HydrophobicContact CG2-CG2 4.03Å; I617-L804 HydrophobicContact CD1-CD2 4.03Å; I617-I807 HydrophobicContact CB-CD1 4.5Å; I617-I807 HydrophobicContact CD1-CD1 3.63Å; I617-I807 HydrophobicContact CG1-CD1 3.12Å
618	A	89.2	Confident	86.6	Confident	51 Å²	51	41.7 Å²	41.7	42%	0.421	25%	0.249	S	C	.	.	H	α-helix	trans	-64.4	-45	-176.4	0	0	0	0	0	112.3	T614 I615 A616 M620 A621 V622	T614-A618 WeakPolarHBondContact O-CB 3.48Å; T614-A618 PolarHBondContact O-N 3Å; I615-A618 PolarHBondContact O-N 3.24Å; A616-A618 VanDerWaalsContact C-N 3.35Å; A616-A618 PolarHBondContact O-N 3.33Å; A618-M620 VanDerWaalsContact C-N 3.31Å; A618-M620 PolarHBondContact O-N 3.47Å; A618-A621 PolarHBondContact O-N 3.44Å; A618-V622 WeakPolarHBondContact O-CG2 3.31Å; A618-V622 PolarHBondContact O-N 2.88Å
619	V	92.4	Very high	85.6	Confident	68 Å²	68	41.5 Å²	41.5	41%	0.412	25%	0.248	S	C	.	.	H	α-helix	trans	-62.7	-41	178	173.7	0	0	0	0	110.6	I587 I615 A616 V622 L623	I587-V619 HydrophobicContact CD1-CG1 4.17Å; I615-V619 HydrophobicContact CG2-CG2 4.03Å; I615-V619 WeakPolarHBondContact O-CB 3.23Å; I615-V619 VanDerWaalsContact O-CG2 3.25Å; I615-V619 WeakPolarHBondContact O-CG2 3.49Å; I615-V619 PolarHBondContact O-N 3.2Å; A616-V619 PolarHBondContact O-N 2.89Å; V619-V622 PolarHBondContact O-N 3.18Å; V619-L623 WeakPolarHBondContact O-CB 3.48Å; V619-L623 PolarHBondContact O-N 3.32Å
620	M	90.3	Very high	84.8	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-69.3	-39.2	177	-64.8	-64.4	94.3	0	0	112.3	M580 L583 T584 I587 A616 I617 A618 V622 L623 N624 A803	M580-M620 HydrophobicContact CE-CB 3.7Å; M580-M620 HydrophobicContact CE-CG 4.43Å; M580-M620 WeakPolarHBondContact CE-O 3.33Å; M580-M620 HydrophobicContact CE-SD 4.3Å; M580-M620 HydrophobicContact SD-CB 4.31Å; M580-M620 HydrophobicContact SD-SD 3.66Å; M580-M620 VanDerWaalsContact SD-SD 3.66Å; L583-M620 HydrophobicContact CB-SD 4.13Å; L583-M620 HydrophobicContact CD2-CE 3.59Å; L583-M620 HydrophobicContact CD2-SD 3.98Å; L583-M620 HydrophobicContact CG-CE 3.81Å; L583-M620 HydrophobicContact CG-SD 4.01Å; T584-M620 HydrophobicContact CG2-CG 4.15Å; T584-M620 VanDerWaalsContact OG1-CG 3.24Å; T584-M620 WeakPolarHBondContact OG1-CG 3.37Å; I587-M620 HydrophobicContact CD1-CE 3.53Å; A616-M620 WeakPolarHBondContact O-CB 3.31Å; A616-M620 WeakPolarHBondContact O-CG 3.43Å; A616-M620 PolarHBondContact O-N 3.27Å; A616-M620 VanDerWaalsContact O-N 3.08Å; I617-M620 PolarHBondContact O-N 3.29Å; A618-M620 VanDerWaalsContact C-N 3.31Å; A618-M620 PolarHBondContact O-N 3.47Å; M620-V622 VanDerWaalsContact C-N 3.35Å; M620-V622 PolarHBondContact O-N 3.32Å; M620-L623 HydrophobicContact CE-CB 4.5Å; M620-L623 HydrophobicContact CE-CD2 3.87Å; M620-L623 PolarHBondContact O-N 2.79Å; M620-L623 HydrophobicContact SD-CD2 4.36Å; M620-N624 WeakPolarHBondContact O-CB 3.44Å; M620-N624 PolarHBondContact O-N 3.22Å; M620-A803 HydrophobicContact CB-CB 3.8Å; M620-A803 HydrophobicContact CG-CB 4.22Å
621	A	88.4	Confident	84.1	Confident	5 Å²	5	44.6 Å²	44.6	4%	0.041	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-42.5	174	0	0	0	0	0	112.1	I617 A618 N624 A625 L798	I617-A621 VanDerWaalsContact O-CB 3.3Å; I617-A621 WeakPolarHBondContact O-CB 3.37Å; I617-A621 PolarHBondContact O-N 3.12Å; A618-A621 PolarHBondContact O-N 3.44Å; A621-N624 PolarHBondContact O-N 2.82Å; A621-A625 PolarHBondContact O-N 2.88Å; A621-L798 HydrophobicContact CB-CG 4.16Å
622	V	89.3	Confident	83.2	Confident	93 Å²	93	44.6 Å²	44.6	56%	0.564	27%	0.267	S	S	*	.	H	α-helix	trans	-65.3	-43.8	173.9	172.5	0	0	0	0	111	A618 V619 M620 N624 A625 C626	A618-V622 WeakPolarHBondContact O-CG2 3.31Å; A618-V622 PolarHBondContact O-N 2.88Å; V619-V622 PolarHBondContact O-N 3.18Å; M620-V622 VanDerWaalsContact C-N 3.35Å; M620-V622 PolarHBondContact O-N 3.32Å; V622-N624 VanDerWaalsContact C-N 3.31Å; V622-N624 PolarHBondContact O-N 2.74Å; V622-A625 PolarHBondContact O-N 3.44Å; V622-C626 WeakPolarHBondContact O-CB 3.39Å; V622-C626 PolarHBondContact O-N 2.87Å; V622-C626 PolarHBondContact O-SG 2.93Å
623	L	87.2	Confident	82.6	Confident	52 Å²	52	46 Å²	46	27%	0.272	28%	0.277	S	S	.	.	H	α-helix	trans	-60.5	-41.7	177.4	-175.8	63.3	0	0	0	111.7	M580 L583 V619 M620 C626 L627	M580-L623 HydrophobicContact SD-CD2 3.92Å; M580-L623 HydrophobicContact SD-CG 4.46Å; L583-L623 HydrophobicContact CD2-CD2 3.97Å; V619-L623 WeakPolarHBondContact O-CB 3.48Å; V619-L623 PolarHBondContact O-N 3.32Å; M620-L623 HydrophobicContact CE-CB 4.5Å; M620-L623 HydrophobicContact CE-CD2 3.87Å; M620-L623 PolarHBondContact O-N 2.79Å; M620-L623 HydrophobicContact SD-CD2 4.36Å; L623-C626 PolarHBondContact O-N 3.45Å; L623-L627 HydrophobicContact CD1-CD1 3.65Å; L623-L627 HydrophobicContact CD1-CG 4.01Å; L623-L627 HydrophobicContact CG-CD1 3.83Å; L623-L627 HydrophobicContact CG-CG 4.45Å; L623-L627 WeakPolarHBondContact O-CB 3.3Å; L623-L627 WeakPolarHBondContact O-CG 3.3Å; L623-L627 PolarHBondContact O-N 3.04Å
624	N	86	Confident	81.7	Confident	17 Å²	17	46 Å²	46	9%	0.091	28%	0.277	C	S	.	.	H	α-helix	trans	-61.8	-44.3	175.4	-167.8	49.3	0	0	0	111.5	M580 M620 A621 V622 N628 I629 A631 P800	M580-N624 HydrophobicContact CE-CB 4.16Å; M620-N624 WeakPolarHBondContact O-CB 3.44Å; M620-N624 PolarHBondContact O-N 3.22Å; A621-N624 PolarHBondContact O-N 2.82Å; V622-N624 VanDerWaalsContact C-N 3.31Å; V622-N624 PolarHBondContact O-N 2.74Å; N624-N628 PolarHBondContact O-N 3.15Å; N624-N628 VanDerWaalsContact O-N 3.15Å; N624-I629 PolarHBondContact OD1-O 3.02Å; N624-A631 VanDerWaalsContact OD1-CB 3.26Å; N624-A631 WeakPolarHBondContact OD1-CB 3.33Å; N624-P800 HydrophobicContact CB-CG 4.4Å
625	A	82.6	Confident	80.4	Confident	61 Å²	61	49.3 Å²	49.3	50%	0.504	30%	0.301	S	S	.	.	H	α-helix	trans	-66.8	-38.6	176.8	0	0	0	0	0	112.9	A621 V622	A621-A625 PolarHBondContact O-N 2.88Å; V622-A625 PolarHBondContact O-N 3.44Å
626	C	84.2	Confident	79	Confident	98 Å²	98	47.5 Å²	47.5	66%	0.662	29%	0.293	S	S	*	.	H	α-helix	trans	-72.8	-40.1	-179.6	-72.1	0	0	0	0	113.2	V622 L623 N628	V622-C626 WeakPolarHBondContact O-CB 3.39Å; V622-C626 PolarHBondContact O-N 2.87Å; V622-C626 PolarHBondContact O-SG 2.93Å; L623-C626 PolarHBondContact O-N 3.45Å; C626-N628 VanDerWaalsContact C-N 3.28Å
627	L	78.7	Confident	77.3	Confident	88 Å²	88	50 Å²	50	46%	0.461	31%	0.309	S	S	.	.	H	α-helix	trans	-79.3	-15.9	179.6	-66.8	175.1	0	0	0	112.5	F576 L623 I629	F576-L627 HydrophobicContact CD2-CD1 4.34Å; F576-L627 HydrophobicContact CE2-CD1 3.37Å; F576-L627 HydrophobicContact CZ-CD1 3.78Å; L623-L627 HydrophobicContact CD1-CD1 3.65Å; L623-L627 HydrophobicContact CD1-CG 4.01Å; L623-L627 HydrophobicContact CG-CD1 3.83Å; L623-L627 HydrophobicContact CG-CG 4.45Å; L623-L627 WeakPolarHBondContact O-CB 3.3Å; L623-L627 WeakPolarHBondContact O-CG 3.3Å; L623-L627 PolarHBondContact O-N 3.04Å; L627-I629 HydrophobicContact CB-CD1 4.08Å; L627-I629 HydrophobicContact CB-CG1 4.14Å; L627-I629 HydrophobicContact CD1-CD1 4.46Å; L627-I629 PolarHBondContact O-N 2.84Å
628	N	68.3	Low	75.8	Confident	110 Å²	110	54.6 Å²	54.6	59%	0.588	33%	0.333	S	S	*	.			trans	54.5	19.1	-179.8	-145	19.4	0	0	0	114.2	N624 C626	N624-N628 PolarHBondContact O-N 3.15Å; N624-N628 VanDerWaalsContact O-N 3.15Å; C626-N628 VanDerWaalsContact C-N 3.28Å
629	I	67.9	Low	73.9	Confident	41 Å²	41	62.5 Å²	62.5	21%	0.21	35%	0.352	C	S	.	.			trans	-77.6	122.7	172	-59.7	169.4	0	0	0	106	V573 F576 N624 L627 A631	V573-I629 HydrophobicContact CG2-CG2 4.39Å; F576-I629 HydrophobicContact CB-CD1 4.37Å; F576-I629 HydrophobicContact CB-CG2 4.21Å; F576-I629 HydrophobicContact CD1-CB 3.9Å; F576-I629 HydrophobicContact CD1-CD1 4.22Å; F576-I629 HydrophobicContact CD1-CG2 3.59Å; F576-I629 HydrophobicContact CD2-CD1 3.81Å; F576-I629 HydrophobicContact CE1-CB 4.02Å; F576-I629 HydrophobicContact CE1-CD1 4.49Å; F576-I629 HydrophobicContact CE1-CG2 4.21Å; F576-I629 HydrophobicContact CE2-CD1 4.14Å; F576-I629 HydrophobicContact CG-CB 4.38Å; F576-I629 HydrophobicContact CG-CD1 3.86Å; F576-I629 HydrophobicContact CG-CG2 4.01Å; F576-I629 HydrophobicContact CZ-CD1 4.46Å; N624-I629 PolarHBondContact OD1-O 3.02Å; L627-I629 HydrophobicContact CB-CD1 4.08Å; L627-I629 HydrophobicContact CB-CG1 4.14Å; L627-I629 HydrophobicContact CD1-CD1 4.46Å; L627-I629 PolarHBondContact O-N 2.84Å; I629-A631 PolarHBondContact O-N 2.88Å
630	H	66.2	Low	71.7	Confident	80 Å²	80	61.1 Å²	61.1	37%	0.37	34%	0.343	S	S	.	.			trans	-77.1	67.8	-174.9	-67.5	-35.8	0	0	0	112.5	R561	R561-H630 PolarHBondContact NH1-CD2 2.79Å; R561-H630 PolarHBondContact NH1-NE2 2.91Å; R561-H630 PolarHBondContact NH2-CD2 2.72Å
631	A	70	Confident	69.3	Low	5 Å²	5	65.4 Å²	65.4	4%	0.041	37%	0.369	C	S	.	.			trans	-57.9	145.2	170.2	0	0	0	0	0	110.4	F576 N624 I629 C633 P800	F576-A631 HydrophobicContact CD1-CB 4.23Å; F576-A631 HydrophobicContact CE1-CB 4.17Å; N624-A631 VanDerWaalsContact OD1-CB 3.26Å; N624-A631 WeakPolarHBondContact OD1-CB 3.33Å; I629-A631 PolarHBondContact O-N 2.88Å; A631-C633 PolarHBondContact O-N 2.96Å; A631-C633 PolarHBondContact O-SG 3.41Å; A631-P800 HydrophobicContact CB-CB 4.43Å
632	P	71.6	Confident	66.7	Low	43 Å²	43	69.8 Å²	69.8	28%	0.279	40%	0.395	S	S	.	.			trans	-61	115	178.8	23.6	-31.3	0	0	0	109.6	I509 V801 P802	I509-P632 HydrophobicContact CG2-CG 4.43Å; P632-V801 WeakPolarHBondContact O-CB 3.29Å; P632-V801 WeakPolarHBondContact O-CG2 2.96Å; P632-V801 PolarHBondContact O-N 3.12Å; P632-P802 HydrophobicContact CG-CG 4.21Å; P632-P802 WeakPolarHBondContact O-CD 3.32Å
633	C	75.9	Confident	64	Low	45 Å²	45	68.4 Å²	68.4	30%	0.304	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-97.4	161.8	177.2	-63.1	0	0	0	0	110.1	A631 S635 K797	A631-C633 PolarHBondContact O-N 2.96Å; A631-C633 PolarHBondContact O-SG 3.41Å; C633-S635 PolarHBondContact O-N 3.15Å; C633-K797 WeakPolarHBondContact CB-O 2.95Å
634	L	67.4	Low	61.3	Low	12 Å²	12	71.2 Å²	71.2	6%	0.063	41%	0.412	C	S	.	.			trans	-61.3	110.6	-178	-143.7	77.8	0	0	0	110.8	I383 I387 V636 M796 V799 V801 L804	I383-L634 HydrophobicContact CG2-CD2 4.48Å; I387-L634 HydrophobicContact CD1-CD2 3.76Å; I387-L634 HydrophobicContact CD1-CG 4.26Å; L634-V636 PolarHBondContact O-N 3.24Å; L634-V636 VanDerWaalsContact O-N 3.12Å; L634-M796 HydrophobicContact CD2-CE 3.18Å; L634-V799 PolarHBondContact N-O 3.05Å; L634-V801 HydrophobicContact CD1-CG2 3.96Å; L634-L804 HydrophobicContact CD1-CD1 4.01Å
635	S	59.3	Low	58.7	Low	99 Å²	99	78.6 Å²	78.6	69%	0.692	44%	0.443	S	S	*	.			trans	-79.6	92.4	177.7	44.2	0	0	0	0	110.1	C633	C633-S635 PolarHBondContact O-N 3.15Å
636	V	63.5	Low	56.5	Low	20 Å²	20	80.3 Å²	80.3	12%	0.121	46%	0.458	C	S	.	.			trans	-80.1	138.3	172.7	-177.4	0	0	0	0	108.9	I387 L634 D638 T793 M796	I387-V636 HydrophobicContact CD1-CG2 4.3Å; L634-V636 PolarHBondContact O-N 3.24Å; L634-V636 VanDerWaalsContact O-N 3.12Å; V636-D638 PolarHBondContact O-N 3.01Å; V636-T793 HydrophobicContact CB-CG2 4.15Å; V636-T793 HydrophobicContact CG1-CG2 4.1Å; V636-M796 HydrophobicContact CG2-CB 3.72Å; V636-M796 HydrophobicContact CG2-CG 4.4Å
637	P	56.4	Low	54.1	Low	53 Å²	53	81.7 Å²	81.7	34%	0.344	46%	0.458	S	S	.	.			trans	-63.3	109.9	175.6	24.9	-33.7	0	0	0	110.8	T403 I404 R639	T403-P637 HydrophobicContact CG2-CG 4.18Å; I404-P637 HydrophobicContact CG1-CG 4.27Å; P637-R639 PolarHBondContact O-N 3.1Å; P637-R639 VanDerWaalsContact O-N 3.14Å
638	D	56.9	Low	52.1	Low	103 Å²	103	81.9 Å²	81.9	55%	0.551	47%	0.472	S	S	*	.			trans	-72.5	4.2	174.1	-72.4	-30.9	0	0	0	113.3	V636 L640 K797	V636-D638 PolarHBondContact O-N 3.01Å; D638-L640 PolarHBondContact O-N 3.04Å; D638-K797 WeakPolarHBondContact OD1-CE 3.43Å; D638-K797 IonicContact OD1-NZ 2.74Å; D638-K797 PolarHBondContact OD1-NZ 3.46Å; D638-K797 IonicContact OD2-NZ 2.72Å; D638-K797 PolarHBondContact OD2-NZ 3.12Å
639	R	50.2	Low	50.5	Low	217 Å²	217	88 Å²	88	82%	0.819	49%	0.487	S	S	*	.			trans	-76.2	58.8	-176.6	-63.4	-163	-157.8	-114	3.6	112	P637	P637-R639 PolarHBondContact O-N 3.1Å; P637-R639 VanDerWaalsContact O-N 3.14Å
640	L	45.8	Very low	48.9	Very low	40 Å²	40	90.6 Å²	90.6	21%	0.209	51%	0.509	C	S	.	.			trans	-91.6	96.8	154.9	-128	142.4	0	0	0	107	D638 V642 F657 V790	D638-L640 PolarHBondContact O-N 3.04Å; L640-V642 VanDerWaalsContact C-N 3.28Å; L640-V642 PolarHBondContact O-N 2.94Å; L640-F657 HydrophobicContact CD1-CD1 3.46Å; L640-F657 VanDerWaalsContact CD1-CD1 3.46Å; L640-F657 HydrophobicContact CD1-CE1 4.12Å; L640-F657 HydrophobicContact CD1-CG 4.47Å; L640-F657 HydrophobicContact CD2-CB 3.94Å; L640-F657 HydrophobicContact CD2-CD1 3.31Å; L640-F657 HydrophobicContact CD2-CE1 4.16Å; L640-F657 HydrophobicContact CD2-CG 4.02Å; L640-F657 HydrophobicContact CG-CD1 3.92Å; L640-V790 HydrophobicContact CD1-CG1 3.08Å; L640-V790 HydrophobicContact CG-CG1 4.48Å
641	V	39.9	Very low	47.6	Very low	92 Å²	92	92.8 Å²	92.8	56%	0.558	53%	0.528	S	S	*	.			trans	-65.3	99.4	168.1	-178.2	0	0	0	0	106	S643	V641-S643 PolarHBondContact O-N 3.07Å
642	V	32.9	Very low	46.1	Very low	97 Å²	97	101.3 Å²	101.3	59%	0.588	56%	0.564	S	S	*	*			trans	-67	82.8	165.7	-177.8	0	0	0	0	106.3	L640 C644	L640-V642 VanDerWaalsContact C-N 3.28Å; L640-V642 PolarHBondContact O-N 2.94Å; V642-C644 VanDerWaalsContact C-N 3.29Å; V642-C644 PolarHBondContact O-N 3.15Å; V642-C644 VanDerWaalsContact O-N 3.1Å
643	S	33.3	Very low	44.4	Very low	63 Å²	63	106.9 Å²	106.9	44%	0.441	59%	0.592	S	S	.	*			trans	-76.6	93.7	162.1	52.7	0	0	0	0	106.4	V641 F645	V641-S643 PolarHBondContact O-N 3.07Å; S643-F645 VanDerWaalsContact C-N 3.31Å; S643-F645 PolarHBondContact O-N 3.26Å
644	C	29.3	Very low	42.6	Very low	111 Å²	111	109.6 Å²	109.6	75%	0.75	61%	0.61	S	S	*	*			trans	-51.7	105.1	157.7	-87.1	0	0	0	0	106.5	V642 A646	V642-C644 VanDerWaalsContact C-N 3.29Å; V642-C644 PolarHBondContact O-N 3.15Å; V642-C644 VanDerWaalsContact O-N 3.1Å; C644-A646 PolarHBondContact O-N 2.96Å
645	F	32.9	Very low	41.2	Very low	172 Å²	172	114.1 Å²	114.1	75%	0.754	63%	0.633	S	S	*	*			trans	-68.4	88.9	169.9	-158.5	-97.7	0	0	0	105.8	S643 L647	S643-F645 VanDerWaalsContact C-N 3.31Å; S643-F645 PolarHBondContact O-N 3.26Å; F645-L647 HydrophobicContact CD1-CB 3.78Å; F645-L647 HydrophobicContact CE1-CB 3.67Å; F645-L647 HydrophobicContact CE1-CD1 3.75Å; F645-L647 HydrophobicContact CE1-CG 4.36Å; F645-L647 HydrophobicContact CZ-CD1 4.02Å; F645-L647 PolarHBondContact O-N 3.46Å
646	A	34.9	Very low	40.4	Very low	97 Å²	97	113.1 Å²	113.1	80%	0.802	63%	0.631	S	S	*	*			trans	-74	70.4	177.5	0	0	0	0	0	108.7	C644	C644-A646 PolarHBondContact O-N 2.96Å
647	L	35.2	Very low	39.6	Very low	128 Å²	128	116.4 Å²	116.4	67%	0.67	64%	0.643	S	S	*	*			trans	-138.7	110	169.1	-104.9	154	0	0	0	108.7	F645	F645-L647 HydrophobicContact CD1-CB 3.78Å; F645-L647 HydrophobicContact CE1-CB 3.67Å; F645-L647 HydrophobicContact CE1-CD1 3.75Å; F645-L647 HydrophobicContact CE1-CG 4.36Å; F645-L647 HydrophobicContact CZ-CD1 4.02Å; F645-L647 PolarHBondContact O-N 3.46Å
648	A	35.6	Very low	39.4	Very low	92 Å²	92	117.6 Å²	117.6	76%	0.76	65%	0.65	S	S	*	*			trans	67.9	99.5	155.3	0	0	0	0	0	118.5
649	R	36.2	Very low	39.3	Very low	239 Å²	239	115.6 Å²	115.6	90%	0.902	64%	0.638	S	S	*	*				56.1	105	128.6	-155.4	77.9	-170.4	168.5	3.4	118.1
650	S	34.3	Very low	39.6	Very low	95 Å²	95	110.9 Å²	110.9	66%	0.664	62%	0.624	S	S	*	*	S	Bend	trans	77	118	146	-160.6	0	0	0	0	118.5
651	T	38.6	Very low	40.4	Very low	125 Å²	125	109.5 Å²	109.5	77%	0.767	62%	0.617	S	S	*	*	S	Bend	trans	65.3	62.9	149.8	46.6	0	0	0	0	118.3
652	F	38.7	Very low	41.4	Very low	184 Å²	184	107.8 Å²	107.8	81%	0.807	61%	0.607	S	S	*	*				-177.1	118.8	125.2	-126	-107.3	0	0	0	105.4	C654	F652-C654 PolarHBondContact O-N 3.12Å
653	N	34.9	Very low	42.5	Very low	161 Å²	161	105.8 Å²	105.8	86%	0.861	60%	0.598	S	S	*	*			trans	-68.7	73	168.5	-83.7	-18.4	0	0	0	108.2	I655	N653-I655 PolarHBondContact O-N 3.14Å
654	C	37.5	Very low	43.8	Very low	101 Å²	101	106 Å²	106	68%	0.682	61%	0.61	S	S	*	*			trans	-72.6	90.2	163.2	-76.9	0	0	0	0	106.2	F652 A656	F652-C654 PolarHBondContact O-N 3.12Å; C654-A656 PolarHBondContact O-N 3Å
655	I	39.5	Very low	45.8	Very low	108 Å²	108	102.9 Å²	102.9	55%	0.554	58%	0.583	S	S	*	*			trans	-64	88.7	164.3	-54.6	167.4	0	0	0	105.1	N653 F657	N653-I655 PolarHBondContact O-N 3.14Å; I655-F657 HydrophobicContact CB-CD2 4.18Å; I655-F657 HydrophobicContact CB-CE2 3.8Å; I655-F657 HydrophobicContact CG2-CD2 3.61Å; I655-F657 HydrophobicContact CG2-CE1 4.3Å; I655-F657 HydrophobicContact CG2-CE2 3.25Å; I655-F657 HydrophobicContact CG2-CG 4.29Å; I655-F657 HydrophobicContact CG2-CZ 3.64Å; I655-F657 WeakPolarHBondContact O-CD2 3.24Å; I655-F657 PolarHBondContact O-N 3.06Å; I655-F657 VanDerWaalsContact O-N 3.09Å
656	A	41.1	Very low	47.7	Very low	77 Å²	77	98.7 Å²	98.7	64%	0.636	58%	0.575	S	S	*	*			trans	-75.7	96.7	172.7	0	0	0	0	0	107	C654 V658	C654-A656 PolarHBondContact O-N 3Å; A656-V658 PolarHBondContact O-N 3.09Å
657	F	46.7	Very low	49.6	Very low	89 Å²	89	97.1 Å²	97.1	39%	0.39	55%	0.548	S	S	.	.			trans	-67.6	96.3	173.5	-73.5	-97.5	0	0	0	108.7	L640 I655 F791	L640-F657 HydrophobicContact CD1-CD1 3.46Å; L640-F657 VanDerWaalsContact CD1-CD1 3.46Å; L640-F657 HydrophobicContact CD1-CE1 4.12Å; L640-F657 HydrophobicContact CD1-CG 4.47Å; L640-F657 HydrophobicContact CD2-CB 3.94Å; L640-F657 HydrophobicContact CD2-CD1 3.31Å; L640-F657 HydrophobicContact CD2-CE1 4.16Å; L640-F657 HydrophobicContact CD2-CG 4.02Å; L640-F657 HydrophobicContact CG-CD1 3.92Å; I655-F657 HydrophobicContact CB-CD2 4.18Å; I655-F657 HydrophobicContact CB-CE2 3.8Å; I655-F657 HydrophobicContact CG2-CD2 3.61Å; I655-F657 HydrophobicContact CG2-CE1 4.3Å; I655-F657 HydrophobicContact CG2-CE2 3.25Å; I655-F657 HydrophobicContact CG2-CG 4.29Å; I655-F657 HydrophobicContact CG2-CZ 3.64Å; I655-F657 WeakPolarHBondContact O-CD2 3.24Å; I655-F657 PolarHBondContact O-N 3.06Å; I655-F657 VanDerWaalsContact O-N 3.09Å; F657-F791 HydrophobicContact CB-CE1 4.07Å; F657-F791 HydrophobicContact CB-CZ 4.08Å; F657-F791 HydrophobicContact CD1-CE1 4.14Å; F657-F791 HydrophobicContact CD2-CD1 4.3Å; F657-F791 AromaticContact CD2-CE1 3.39Å; F657-F791 HydrophobicContact CD2-CE1 3.39Å; F657-F791 HydrophobicContact CD2-CZ 4.15Å; F657-F791 HydrophobicContact CE1-CE1 4.49Å; F657-F791 HydrophobicContact CE2-CD1 4.26Å; F657-F791 AromaticContact CE2-CE1 3.74Å; F657-F791 HydrophobicContact CE2-CE1 3.74Å; F657-F791 HydrophobicContact CG-CD1 4.49Å; F657-F791 AromaticContact CG-CE1 3.61Å; F657-F791 HydrophobicContact CG-CE1 3.61Å; F657-F791 HydrophobicContact CG-CZ 4.15Å; F657-F791 HydrophobicContact CZ-CD1 4.47Å; F657-F791 HydrophobicContact CZ-CE1 4.3Å
658	V	52.2	Low	51.8	Low	79 Å²	79	96.6 Å²	96.6	48%	0.479	54%	0.541	S	S	.	.			trans	-93.3	111.1	177.7	-178.1	0	0	0	0	109.3	A656 K660	A656-V658 PolarHBondContact O-N 3.09Å; V658-K660 PolarHBondContact O-N 3.17Å
659	L	56.7	Low	53.9	Low	60 Å²	60	92.7 Å²	92.7	31%	0.314	51%	0.507	S	S	.	.			trans	-67.9	110.7	169.5	-67.7	164.5	0	0	0	108.8	I404 W667 V790	I404-L659 HydrophobicContact CG2-CD2 3.91Å; L659-W667 HydrophobicContact CB-CZ2 4.08Å; L659-W667 PolarHBondContact O-NE1 2.62Å; L659-V790 HydrophobicContact CD2-CG1 4.5Å; L659-V790 HydrophobicContact CD2-CG2 4.15Å
660	K	56.1	Low	55.9	Low	118 Å²	118	85.5 Å²	85.5	51%	0.513	49%	0.487	S	S	.	.			trans	-93.3	134.6	169.3	-72	-175.6	179.8	178	0	109.1	V658	V658-K660 PolarHBondContact O-N 3.17Å
661	P	61	Low	57.8	Low	11 Å²	11	82.4 Å²	82.4	7%	0.071	46%	0.464	C	S	.	.			trans	-68	157.4	175.9	27.9	-31.7	0	0	0	111.1	E405 S663 G664 R665 W667	E405-P661 VanDerWaalsContact OE1-CA 3.25Å; E405-P661 WeakPolarHBondContact OE1-CA 3.3Å; E405-P661 VanDerWaalsContact OE1-CB 3.29Å; E405-P661 WeakPolarHBondContact OE1-CB 3.5Å; P661-S663 PolarHBondContact O-N 3.34Å; P661-S663 VanDerWaalsContact O-N 3.15Å; P661-G664 PolarHBondContact O-N 2.72Å; P661-R665 HydrophobicContact CB-CG 4.19Å; P661-R665 HydrophobicContact CG-CG 3.92Å; P661-R665 WeakPolarHBondContact CG-O 3.49Å; P661-W667 HydrophobicContact CB-CH2 4.45Å; P661-W667 HydrophobicContact CB-CZ2 4.3Å
662	T	61.6	Low	59.5	Low	56 Å²	56	83.7 Å²	83.7	34%	0.344	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-34.7	-169.4	-57.3	0	0	0	0	112.9	K399 E405	K399-T662 HydrophobicContact CB-CG2 4.17Å; E405-T662 PolarHBondContact OE1-N 3.09Å; E405-T662 PolarHBondContact OE1-OG1 2.7Å; E405-T662 PolarHBondContact OE2-OG1 2.9Å
663	S	56.8	Low	60.9	Low	56 Å²	56	78.1 Å²	78.1	39%	0.392	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	9.8	-178.3	-17	0	0	0	0	114.3	K399 P661 R665	K399-S663 PolarHBondContact O-OG 3.16Å; P661-S663 PolarHBondContact O-N 3.34Å; P661-S663 VanDerWaalsContact O-N 3.15Å; S663-R665 PolarHBondContact O-N 3.43Å
664	G	59.4	Low	62.5	Low	68 Å²	68	71.6 Å²	71.6	70%	0.701	41%	0.414	S	S	*	.	S	Bend	trans	68.6	11.1	-177.4	0	0	0	0	0	115.5	P661	P661-G664 PolarHBondContact O-N 2.72Å
665	R	71.8	Confident	64.2	Low	45 Å²	45	73.9 Å²	73.9	17%	0.17	42%	0.42	C	S	.	.			trans	-74.2	170.9	178.5	65.9	175.6	175.4	112.9	-4.8	113.6	P661 S663 G736	P661-R665 HydrophobicContact CB-CG 4.19Å; P661-R665 HydrophobicContact CG-CG 3.92Å; P661-R665 WeakPolarHBondContact CG-O 3.49Å; S663-R665 PolarHBondContact O-N 3.43Å; R665-G736 PolarHBondContact NH2-O 2.86Å
666	S	74	Confident	66.3	Low	84 Å²	84	71 Å²	71	59%	0.587	41%	0.408	S	S	*	.			trans	-72	147.9	164.7	54	0	0	0	0	111	F668	S666-F668 VanDerWaalsContact C-N 3.26Å; S666-F668 PolarHBondContact O-N 3.09Å; S666-F668 PolarHBondContact OG-O 3.22Å
667	W	74.8	Confident	68.3	Low	63 Å²	63	76.1 Å²	76.1	24%	0.239	41%	0.411	C	S	.	.	S	Bend	trans	-64.5	-32.2	172.8	-76.7	105.1	0	0	0	112.3	E405 L408 L659 P661 L735 I737	E405-W667 HydrophobicContact CG-CH2 4.07Å; E405-W667 HydrophobicContact CG-CZ3 3.9Å; L408-W667 HydrophobicContact CD2-CD2 4.44Å; L408-W667 HydrophobicContact CD2-CE3 3.87Å; L408-W667 HydrophobicContact CD2-CH2 3.53Å; L408-W667 HydrophobicContact CD2-CZ2 4.13Å; L408-W667 HydrophobicContact CD2-CZ3 3.37Å; L659-W667 HydrophobicContact CB-CZ2 4.08Å; L659-W667 PolarHBondContact O-NE1 2.62Å; P661-W667 HydrophobicContact CB-CH2 4.45Å; P661-W667 HydrophobicContact CB-CZ2 4.3Å; W667-L735 CarbonylContact O-C 3.6Å; W667-L735 VanDerWaalsContact O-CA 3.28Å; W667-L735 WeakPolarHBondContact O-CA 3.07Å; W667-I737 HydrophobicContact CE3-CG2 4.39Å; W667-I737 HydrophobicContact CZ3-CG2 3.94Å
668	F	80.7	Confident	70.3	Confident	118 Å²	118	77 Å²	77	52%	0.518	41%	0.412	S	S	.	.	S	Bend	trans	-84	124.1	176.4	-165.8	-100.4	0	0	0	110.4	S666 L734	S666-F668 VanDerWaalsContact C-N 3.26Å; S666-F668 PolarHBondContact O-N 3.09Å; S666-F668 PolarHBondContact OG-O 3.22Å; F668-L734 HydrophobicContact CE2-CB 4.16Å; F668-L734 HydrophobicContact CE2-CD2 3.78Å; F668-L734 HydrophobicContact CE2-CG 4.47Å; F668-L734 HydrophobicContact CZ-CD2 3.86Å
669	V	79.6	Confident	71.9	Confident	10 Å²	10	73.8 Å²	73.8	6%	0.061	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-84.4	122.5	173.2	-178.1	0	0	0	0	108.2	L453 P671 L734	L453-V669 HydrophobicContact CB-CG1 4.28Å; V669-P671 VanDerWaalsContact O-CD 3.31Å; V669-P671 WeakPolarHBondContact O-CD 3.36Å; V669-L734 PolarHBondContact N-O 2.95Å
670	N	77.9	Confident	73.4	Confident	88 Å²	88	71.9 Å²	71.9	47%	0.471	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-75.6	117.2	174.3	-171.4	-6	0	0	0	109.3	L672 S673	N670-L672 VanDerWaalsContact C-N 3.28Å; N670-L672 PolarHBondContact O-N 3.4Å; N670-L672 PolarHBondContact OD1-N 3.47Å; N670-S673 PolarHBondContact O-OG 3.22Å
671	P	75.3	Confident	74.9	Confident	30 Å²	30	70.8 Å²	70.8	20%	0.195	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-15.7	-176.7	31	-36.3	0	0	0	114	F457 W458 V669	F457-P671 HydrophobicContact CD1-CB 3.56Å; F457-P671 HydrophobicContact CD2-CB 4.45Å; F457-P671 HydrophobicContact CE1-CB 3.32Å; F457-P671 HydrophobicContact CE1-CG 4.34Å; F457-P671 HydrophobicContact CE2-CB 4.26Å; F457-P671 HydrophobicContact CG-CB 4.15Å; F457-P671 HydrophobicContact CZ-CB 3.7Å; F457-P671 HydrophobicContact CZ-CG 4.3Å; W458-P671 PolarHBondContact NE1-O 2.58Å; V669-P671 VanDerWaalsContact O-CD 3.31Å; V669-P671 WeakPolarHBondContact O-CD 3.36Å
672	L	73.4	Confident	76.2	Confident	152 Å²	152	73.6 Å²	73.6	80%	0.796	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-10.1	-170.8	-68.3	163.9	0	0	0	113.5	N670 I674	N670-L672 VanDerWaalsContact C-N 3.28Å; N670-L672 PolarHBondContact O-N 3.4Å; N670-L672 PolarHBondContact OD1-N 3.47Å; L672-I674 PolarHBondContact O-N 3.43Å
673	S	68.3	Low	77.6	Confident	66 Å²	66	71.2 Å²	71.2	46%	0.462	39%	0.386	S	S	.	.			trans	-79.6	43.1	179.2	49.3	0	0	0	0	113.8	C454 N670	C454-S673 PolarHBondContact SG-OG 2.83Å; N670-S673 PolarHBondContact O-OG 3.22Å
674	I	68.7	Low	79.3	Confident	25 Å²	25	72.2 Å²	72.2	13%	0.128	39%	0.386	C	S	.	.			trans	-102.6	119.4	-175.9	-75.9	179	0	0	0	112.6	C454 W458 L672 P676 L679	C454-I674 HydrophobicContact CB-CD1 4.02Å; C454-I674 HydrophobicContact CB-CG1 3.67Å; W458-I674 HydrophobicContact CG-CD1 4.23Å; L672-I674 PolarHBondContact O-N 3.43Å; I674-P676 WeakPolarHBondContact CG2-O 3.46Å; I674-L679 HydrophobicContact CG2-CB 4.26Å
675	D	73.6	Confident	80.7	Confident	148 Å²	148	74.6 Å²	74.6	79%	0.791	38%	0.382	S	S	*	.	S	Bend	trans	-112.7	120.1	162.2	-62.9	-38.8	0	0	0	108.3
676	P	83.1	Confident	81.6	Confident	48 Å²	48	74.4 Å²	74.4	31%	0.312	39%	0.386	S	S	.	.	S	Bend	cis	-91.7	155.7	-11.5	-4.9	25.5	0	0	0	114.3	I674 W678 L679	I674-P676 WeakPolarHBondContact CG2-O 3.46Å; P676-W678 VanDerWaalsContact C-N 3.28Å; P676-W678 HydrophobicContact CB-CG 4.42Å; P676-W678 VanDerWaalsContact CB-NE1 3.29Å; P676-W678 HydrophobicContact CG-CZ2 4.06Å; P676-W678 PolarHBondContact O-N 3.24Å; P676-W678 VanDerWaalsContact O-N 3.09Å; P676-L679 VanDerWaalsContact O-CB 3.27Å; P676-L679 WeakPolarHBondContact O-CB 3.47Å; P676-L679 PolarHBondContact O-N 3.15Å; P676-L679 VanDerWaalsContact O-N 3.1Å
677	W	83.5	Confident	82.5	Confident	185 Å²	185	70.4 Å²	70.4	70%	0.701	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-31.6	-175.6	70.6	-89.8	0	0	0	116	L679 S680 L681	W677-L679 PolarHBondContact O-N 3.07Å; W677-S680 WeakPolarHBondContact O-CB 3.31Å; W677-S680 PolarHBondContact O-N 3.43Å; W677-S680 VanDerWaalsContact O-N 3.16Å; W677-S680 PolarHBondContact O-OG 3.4Å; W677-L681 HydrophobicContact CZ3-CD1 3.81Å
678	W	87.6	Confident	83.3	Confident	108 Å²	108	71.3 Å²	71.3	41%	0.409	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-17	-177.9	57.2	-100.1	0	0	0	112.9	W450 P676 S680 L681 V682	W450-W678 AromaticContact CH2-CH2 3.92Å; W450-W678 HydrophobicContact CH2-CH2 3.92Å; W450-W678 HydrophobicContact CH2-CZ3 4.07Å; W450-W678 AromaticContact CZ2-CH2 3.56Å; W450-W678 HydrophobicContact CZ2-CH2 3.56Å; W450-W678 HydrophobicContact CZ2-CZ2 4.35Å; W450-W678 HydrophobicContact CZ2-CZ3 4.14Å; P676-W678 VanDerWaalsContact C-N 3.28Å; P676-W678 HydrophobicContact CB-CG 4.42Å; P676-W678 VanDerWaalsContact CB-NE1 3.29Å; P676-W678 HydrophobicContact CG-CZ2 4.06Å; P676-W678 PolarHBondContact O-N 3.24Å; P676-W678 VanDerWaalsContact O-N 3.09Å; W678-S680 PolarHBondContact O-N 2.96Å; W678-L681 PolarHBondContact O-N 3.24Å; W678-V682 HydrophobicContact CE3-CB 4.35Å; W678-V682 HydrophobicContact CE3-CG2 3.62Å; W678-V682 HydrophobicContact CZ3-CB 4.5Å; W678-V682 HydrophobicContact CZ3-CG2 3.95Å; W678-V682 PolarHBondContact O-N 3.32Å
679	L	87.2	Confident	83.6	Confident	10 Å²	10	71.9 Å²	71.9	5%	0.052	37%	0.37	C	S	.	.	H	α-helix	trans	-57.4	-35.8	172.2	-179	58.4	0	0	0	111.7	W450 A455 I674 P676 W677 L681 V682 A683	W450-L679 HydrophobicContact CB-CD2 4.27Å; W450-L679 HydrophobicContact CD2-CD1 4.09Å; W450-L679 HydrophobicContact CD2-CD2 4.09Å; W450-L679 HydrophobicContact CE3-CD1 3.42Å; W450-L679 VanDerWaalsContact CE3-CD1 3.42Å; W450-L679 HydrophobicContact CE3-CD2 4.07Å; W450-L679 HydrophobicContact CE3-CG 4.39Å; W450-L679 HydrophobicContact CG-CD2 4.18Å; W450-L679 HydrophobicContact CH2-CD1 4.04Å; W450-L679 HydrophobicContact CZ3-CD1 3.36Å; A455-L679 HydrophobicContact CB-CD2 4.33Å; I674-L679 HydrophobicContact CG2-CB 4.26Å; P676-L679 VanDerWaalsContact O-CB 3.27Å; P676-L679 WeakPolarHBondContact O-CB 3.47Å; P676-L679 PolarHBondContact O-N 3.15Å; P676-L679 VanDerWaalsContact O-N 3.1Å; W677-L679 PolarHBondContact O-N 3.07Å; L679-L681 PolarHBondContact O-N 3.49Å; L679-V682 PolarHBondContact O-N 3.38Å; L679-A683 WeakPolarHBondContact O-CB 3.31Å; L679-A683 PolarHBondContact O-N 3.3Å
680	S	86.6	Confident	84.1	Confident	21 Å²	21	71.4 Å²	71.4	15%	0.147	37%	0.367	C	S	.	.	H	α-helix	trans	-58.3	-36	175	66.9	0	0	0	0	111.8	W462 W677 W678	W462-S680 PolarHBondContact NE1-O 3.2Å; W677-S680 WeakPolarHBondContact O-CB 3.31Å; W677-S680 PolarHBondContact O-N 3.43Å; W677-S680 VanDerWaalsContact O-N 3.16Å; W677-S680 PolarHBondContact O-OG 3.4Å; W678-S680 PolarHBondContact O-N 2.96Å
681	L	88.9	Confident	84.8	Confident	94 Å²	94	67.2 Å²	67.2	49%	0.492	35%	0.345	S	S	.	.	H	α-helix	trans	-80.9	-42.5	178	-65.8	178.3	0	0	0	112	W462 W677 W678 L679 A683 I684	W462-L681 HydrophobicContact CZ2-CD2 4.38Å; W677-L681 HydrophobicContact CZ3-CD1 3.81Å; W678-L681 PolarHBondContact O-N 3.24Å; L679-L681 PolarHBondContact O-N 3.49Å; L681-A683 PolarHBondContact O-N 3.28Å; L681-I684 WeakPolarHBondContact O-CB 3.47Å; L681-I684 WeakPolarHBondContact O-CG2 3Å; L681-I684 PolarHBondContact O-N 3.21Å
682	V	88.3	Confident	85.4	Confident	71 Å²	71	68.8 Å²	68.8	43%	0.43	35%	0.351	S	S	.	.	H	α-helix	trans	-64	-29.9	-179.8	172.3	0	0	0	0	111.8	W678 L679 I684 L685 P686	W678-V682 HydrophobicContact CE3-CB 4.35Å; W678-V682 HydrophobicContact CE3-CG2 3.62Å; W678-V682 HydrophobicContact CZ3-CB 4.5Å; W678-V682 HydrophobicContact CZ3-CG2 3.95Å; W678-V682 PolarHBondContact O-N 3.32Å; L679-V682 PolarHBondContact O-N 3.38Å; V682-I684 PolarHBondContact O-N 3.34Å; V682-L685 PolarHBondContact O-N 2.82Å; V682-L685 VanDerWaalsContact O-N 3.13Å; V682-P686 WeakPolarHBondContact O-CD 3.45Å
683	A	90.5	Very high	86.1	Confident	6 Å²	6	62.1 Å²	62.1	5%	0.05	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-17.6	175.6	0	0	0	0	0	114.2	W458 V459 L679 L681 L685 P686 A687	W458-A683 HydrophobicContact CB-CB 3.87Å; V459-A683 HydrophobicContact CG2-CB 3.96Å; L679-A683 WeakPolarHBondContact O-CB 3.31Å; L679-A683 PolarHBondContact O-N 3.3Å; L681-A683 PolarHBondContact O-N 3.28Å; A683-L685 VanDerWaalsContact C-N 3.25Å; A683-L685 PolarHBondContact O-N 2.74Å; A683-P686 WeakPolarHBondContact O-CD 3.43Å; A683-P686 WeakPolarHBondContact O-CG 3.27Å; A683-A687 WeakPolarHBondContact O-CB 3.37Å; A683-A687 PolarHBondContact O-N 3.37Å; A683-A687 VanDerWaalsContact O-N 3.08Å
684	I	92.8	Very high	87.1	Confident	76 Å²	76	59 Å²	59	39%	0.39	29%	0.294	S	S	.	.	H	α-helix	trans	-61.8	-32.2	176	-158.7	169.7	0	0	0	112.9	W462 L681 V682 A687 L688	W462-I684 HydrophobicContact CB-CG1 4.48Å; W462-I684 HydrophobicContact CD2-CB 4.17Å; W462-I684 HydrophobicContact CD2-CD1 4.16Å; W462-I684 HydrophobicContact CD2-CG1 3.98Å; W462-I684 HydrophobicContact CE3-CD1 3.77Å; W462-I684 HydrophobicContact CE3-CG1 3.96Å; W462-I684 HydrophobicContact CG-CB 4.19Å; W462-I684 HydrophobicContact CG-CG1 4.22Å; W462-I684 HydrophobicContact CH2-CD1 4.34Å; W462-I684 HydrophobicContact CZ3-CD1 3.87Å; L681-I684 WeakPolarHBondContact O-CB 3.47Å; L681-I684 WeakPolarHBondContact O-CG2 3Å; L681-I684 PolarHBondContact O-N 3.21Å; V682-I684 PolarHBondContact O-N 3.34Å; I684-A687 PolarHBondContact O-N 2.98Å; I684-L688 WeakPolarHBondContact O-CB 3.32Å; I684-L688 PolarHBondContact O-N 2.67Å
685	L	88.9	Confident	88.2	Confident	118 Å²	118	58.3 Å²	58.3	62%	0.618	29%	0.291	S	S	*	.	H	α-helix	trans	-69	-55.8	-178	-174.7	121.9	0	0	0	112.2	V682 A683 A687 L688 F689	V682-L685 PolarHBondContact O-N 2.82Å; V682-L685 VanDerWaalsContact O-N 3.13Å; A683-L685 VanDerWaalsContact C-N 3.25Å; A683-L685 PolarHBondContact O-N 2.74Å; L685-A687 PolarHBondContact O-N 2.91Å; L685-L688 WeakPolarHBondContact O-CB 3.16Å; L685-L688 PolarHBondContact O-N 3.45Å; L685-F689 HydrophobicContact CD2-CE2 4.33Å; L685-F689 HydrophobicContact CG-CE2 4.36Å; L685-F689 WeakPolarHBondContact O-CD2 2.89Å; L685-F689 PolarHBondContact O-N 2.85Å
686	P	89.7	Confident	88.7	Confident	41 Å²	41	52.4 Å²	52.4	27%	0.266	26%	0.258	S	S	.	.	H	α-helix	trans	-61.8	-33.5	172.4	23.1	-31.8	0	0	0	112	F437 V459 V682 A683 L688 F689 F690	F437-P686 HydrophobicContact CE2-CB 4.41Å; F437-P686 HydrophobicContact CZ-CB 4.16Å; V459-P686 HydrophobicContact CG2-CG 4.06Å; V682-P686 WeakPolarHBondContact O-CD 3.45Å; A683-P686 WeakPolarHBondContact O-CD 3.43Å; A683-P686 WeakPolarHBondContact O-CG 3.27Å; P686-L688 VanDerWaalsContact C-N 3.31Å; P686-L688 PolarHBondContact O-N 2.97Å; P686-F689 PolarHBondContact O-N 3.47Å; P686-F690 WeakPolarHBondContact O-CB 3.45Å; P686-F690 PolarHBondContact O-N 3.41Å
687	A	93.2	Very high	88.8	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-35.4	175.3	0	0	0	0	0	113.1	V459 W462 T463 A683 I684 L685 F690 S691	V459-A687 HydrophobicContact CG1-CB 4.25Å; V459-A687 WeakPolarHBondContact O-CB 3.47Å; W462-A687 HydrophobicContact CB-CB 3.45Å; W462-A687 VanDerWaalsContact CB-CB 3.45Å; T463-A687 WeakPolarHBondContact OG1-CA 3.24Å; T463-A687 WeakPolarHBondContact OG1-CB 3.48Å; T463-A687 PolarHBondContact OG1-O 3.47Å; A683-A687 WeakPolarHBondContact O-CB 3.37Å; A683-A687 PolarHBondContact O-N 3.37Å; A683-A687 VanDerWaalsContact O-N 3.08Å; I684-A687 PolarHBondContact O-N 2.98Å; L685-A687 PolarHBondContact O-N 2.91Å; A687-F690 PolarHBondContact O-N 3.35Å; A687-S691 WeakPolarHBondContact O-CB 3.24Å; A687-S691 PolarHBondContact O-N 2.73Å; A687-S691 PolarHBondContact O-OG 2.8Å
688	L	91.2	Very high	89.2	Confident	82 Å²	82	42 Å²	42	43%	0.429	21%	0.214	S	C	.	.	H	α-helix	trans	-65.1	-46.3	176.8	-174	150.7	0	0	0	111.4	I684 L685 P686 F690 S691 I692	I684-L688 WeakPolarHBondContact O-CB 3.32Å; I684-L688 PolarHBondContact O-N 2.67Å; L685-L688 WeakPolarHBondContact O-CB 3.16Å; L685-L688 PolarHBondContact O-N 3.45Å; P686-L688 VanDerWaalsContact C-N 3.31Å; P686-L688 PolarHBondContact O-N 2.97Å; L688-F690 VanDerWaalsContact C-N 3.34Å; L688-F690 PolarHBondContact O-N 3.46Å; L688-S691 PolarHBondContact O-N 2.82Å; L688-I692 HydrophobicContact CD2-CD1 3.74Å; L688-I692 WeakPolarHBondContact O-CG1 3.21Å; L688-I692 PolarHBondContact O-N 2.72Å; L688-I692 VanDerWaalsContact O-N 3.11Å
689	F	87.6	Confident	89.3	Confident	130 Å²	130	37 Å²	37	57%	0.57	20%	0.196	S	C	*	.	H	α-helix	trans	-61	-44.3	175	-74.5	-72.7	0	0	0	111.6	L685 P686 S691 I692 L693	L685-F689 HydrophobicContact CD2-CE2 4.33Å; L685-F689 HydrophobicContact CG-CE2 4.36Å; L685-F689 WeakPolarHBondContact O-CD2 2.89Å; L685-F689 PolarHBondContact O-N 2.85Å; P686-F689 PolarHBondContact O-N 3.47Å; F689-S691 VanDerWaalsContact C-N 3.32Å; F689-S691 PolarHBondContact O-N 3.35Å; F689-I692 PolarHBondContact O-N 2.76Å; F689-L693 PolarHBondContact O-N 3.45Å; F689-L693 VanDerWaalsContact O-N 3.11Å
690	F	91	Very high	89.2	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65.4	-36.4	178.5	-164.4	-136.1	0	0	0	112.6	C434 F437 T463 P686 A687 L688 I692 L693 I694 M729 F739	C434-F690 HydrophobicContact CB-CE2 4.31Å; F437-F690 HydrophobicContact CB-CD2 4.24Å; F437-F690 HydrophobicContact CB-CE2 4.3Å; F437-F690 HydrophobicContact CD1-CB 4.4Å; F437-F690 HydrophobicContact CD1-CD1 4.32Å; F437-F690 AromaticContact CD1-CD2 3.47Å; F437-F690 HydrophobicContact CD1-CD2 3.47Å; F437-F690 VanDerWaalsContact CD1-CD2 3.47Å; F437-F690 HydrophobicContact CD1-CE1 4.47Å; F437-F690 AromaticContact CD1-CE2 3.71Å; F437-F690 HydrophobicContact CD1-CE2 3.71Å; F437-F690 AromaticContact CD1-CG 3.83Å; F437-F690 HydrophobicContact CD1-CG 3.83Å; F437-F690 HydrophobicContact CD1-CZ 4.22Å; F437-F690 HydrophobicContact CD2-CB 4.41Å; F437-F690 HydrophobicContact CD2-CD2 4.12Å; F437-F690 HydrophobicContact CE1-CB 3.88Å; F437-F690 AromaticContact CE1-CD1 3.95Å; F437-F690 HydrophobicContact CE1-CD1 3.95Å; F437-F690 AromaticContact CE1-CD2 3.78Å; F437-F690 HydrophobicContact CE1-CD2 3.78Å; F437-F690 HydrophobicContact CE1-CE1 4.4Å; F437-F690 HydrophobicContact CE1-CE2 4.3Å; F437-F690 AromaticContact CE1-CG 3.62Å; F437-F690 HydrophobicContact CE1-CG 3.62Å; F437-F690 HydrophobicContact CE2-CB 3.89Å; F437-F690 HydrophobicContact CE2-CD2 4.38Å; F437-F690 HydrophobicContact CE2-CG 4.34Å; F437-F690 AromaticContact CG-CD2 3.66Å; F437-F690 HydrophobicContact CG-CD2 3.66Å; F437-F690 HydrophobicContact CG-CE2 4.07Å; F437-F690 HydrophobicContact CG-CG 4.3Å; F437-F690 HydrophobicContact CZ-CB 3.61Å; F437-F690 HydrophobicContact CZ-CD1 4.49Å; F437-F690 HydrophobicContact CZ-CD2 4.23Å; F437-F690 AromaticContact CZ-CG 3.9Å; F437-F690 HydrophobicContact CZ-CG 3.9Å; T463-F690 HydrophobicContact CG2-CD1 4.06Å; P686-F690 WeakPolarHBondContact O-CB 3.45Å; P686-F690 PolarHBondContact O-N 3.41Å; A687-F690 PolarHBondContact O-N 3.35Å; L688-F690 VanDerWaalsContact C-N 3.34Å; L688-F690 PolarHBondContact O-N 3.46Å; F690-I692 VanDerWaalsContact C-N 3.34Å; F690-I692 PolarHBondContact O-N 2.89Å; F690-L693 HydrophobicContact CD2-CD2 4.49Å; F690-L693 HydrophobicContact CE2-CD2 4.34Å; F690-L693 WeakPolarHBondContact O-CB 3.18Å; F690-L693 PolarHBondContact O-N 3.1Å; F690-I694 HydrophobicContact CD1-CD1 3.86Å; F690-I694 HydrophobicContact CE1-CD1 3.76Å; F690-I694 HydrophobicContact CE2-CD1 4.46Å; F690-I694 HydrophobicContact CE2-CG1 4.45Å; F690-I694 HydrophobicContact CG-CD1 4.29Å; F690-I694 HydrophobicContact CZ-CD1 4.05Å; F690-I694 HydrophobicContact CZ-CG1 4.42Å; F690-I694 WeakPolarHBondContact O-CG1 3.18Å; F690-I694 PolarHBondContact O-N 3.04Å; F690-M729 HydrophobicContact CD1-CE 3.88Å; F690-M729 HydrophobicContact CE1-CE 3.38Å; F690-M729 HydrophobicContact CZ-CE 4.4Å; F690-F739 HydrophobicContact CE1-CB 4.25Å; F690-F739 AromaticContact CE1-CD2 3.54Å; F690-F739 HydrophobicContact CE1-CD2 3.54Å; F690-F739 HydrophobicContact CE1-CE2 4.07Å; F690-F739 HydrophobicContact CE1-CG 4.01Å; F690-F739 HydrophobicContact CZ-CB 4.04Å; F690-F739 AromaticContact CZ-CD2 3.85Å; F690-F739 HydrophobicContact CZ-CD2 3.85Å; F690-F739 HydrophobicContact CZ-CG 4.24Å
691	S	92.2	Very high	89.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.7	-38.4	175.5	-55.9	0	0	0	0	112.3	T463 V466 A687 L688 F689 L695	T463-S691 WeakPolarHBondContact CA-OG 3.44Å; T463-S691 WeakPolarHBondContact CG2-OG 3.33Å; V466-S691 WeakPolarHBondContact CB-OG 3.4Å; A687-S691 WeakPolarHBondContact O-CB 3.24Å; A687-S691 PolarHBondContact O-N 2.73Å; A687-S691 PolarHBondContact O-OG 2.8Å; L688-S691 PolarHBondContact O-N 2.82Å; F689-S691 VanDerWaalsContact C-N 3.32Å; F689-S691 PolarHBondContact O-N 3.35Å; S691-L695 VanDerWaalsContact O-CB 3.25Å; S691-L695 WeakPolarHBondContact O-CB 3.25Å; S691-L695 PolarHBondContact O-N 3.43Å
692	I	88	Confident	89.2	Confident	64 Å²	64	31.6 Å²	31.6	33%	0.328	17%	0.165	S	C	.	.	H	α-helix	trans	-65	-43.7	175.4	-67.6	168.6	0	0	0	110.2	F470 L688 F689 F690 L695 M696	F470-I692 HydrophobicContact CZ-CG1 4.38Å; L688-I692 HydrophobicContact CD2-CD1 3.74Å; L688-I692 WeakPolarHBondContact O-CG1 3.21Å; L688-I692 PolarHBondContact O-N 2.72Å; L688-I692 VanDerWaalsContact O-N 3.11Å; F689-I692 PolarHBondContact O-N 2.76Å; F690-I692 VanDerWaalsContact C-N 3.34Å; F690-I692 PolarHBondContact O-N 2.89Å; I692-L695 PolarHBondContact O-N 2.77Å; I692-M696 HydrophobicContact CG2-CG 4.44Å; I692-M696 WeakPolarHBondContact O-CB 3.49Å; I692-M696 VanDerWaalsContact O-CG 3.27Å; I692-M696 WeakPolarHBondContact O-CG 3Å; I692-M696 PolarHBondContact O-N 2.76Å
693	L	86.8	Confident	89.1	Confident	12 Å²	12	28.6 Å²	28.6	6%	0.063	15%	0.147	C	C	.	.	H	α-helix	trans	-58.7	-49.7	176.4	-175.1	156.1	0	0	0	110.9	P433 F689 F690 M696 D697 P877	P433-L693 HydrophobicContact CB-CD1 3.8Å; P433-L693 HydrophobicContact CB-CD2 4.25Å; P433-L693 HydrophobicContact CB-CG 4.3Å; F689-L693 PolarHBondContact O-N 3.45Å; F689-L693 VanDerWaalsContact O-N 3.11Å; F690-L693 HydrophobicContact CD2-CD2 4.49Å; F690-L693 HydrophobicContact CE2-CD2 4.34Å; F690-L693 WeakPolarHBondContact O-CB 3.18Å; F690-L693 PolarHBondContact O-N 3.1Å; L693-M696 PolarHBondContact O-N 2.62Å; L693-D697 WeakPolarHBondContact O-CB 3.41Å; L693-D697 PolarHBondContact O-N 3.44Å; L693-P877 HydrophobicContact CG-CG 4.42Å
694	I	90.6	Very high	88.7	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.3	-45.9	178.2	-67.2	169.3	0	0	0	111.7	T463 L467 F690 M696 Q698 I725 M729 V741	T463-I694 HydrophobicContact CG2-CD1 3.62Å; L467-I694 HydrophobicContact CD1-CD1 4.4Å; L467-I694 HydrophobicContact CD1-CG2 3.97Å; L467-I694 HydrophobicContact CD2-CB 4.42Å; L467-I694 HydrophobicContact CD2-CG2 4.19Å; F690-I694 HydrophobicContact CD1-CD1 3.86Å; F690-I694 HydrophobicContact CE1-CD1 3.76Å; F690-I694 HydrophobicContact CE2-CD1 4.46Å; F690-I694 HydrophobicContact CE2-CG1 4.45Å; F690-I694 HydrophobicContact CG-CD1 4.29Å; F690-I694 HydrophobicContact CZ-CD1 4.05Å; F690-I694 HydrophobicContact CZ-CG1 4.42Å; F690-I694 WeakPolarHBondContact O-CG1 3.18Å; F690-I694 PolarHBondContact O-N 3.04Å; I694-M696 VanDerWaalsContact C-N 3.26Å; I694-M696 PolarHBondContact O-N 3.34Å; I694-Q698 WeakPolarHBondContact O-CB 3.3Å; I694-Q698 PolarHBondContact O-N 2.83Å; I694-I725 HydrophobicContact CG2-CG2 3.73Å; I694-M729 HydrophobicContact CD1-CE 3.69Å; I694-M729 HydrophobicContact CD1-SD 3.92Å; I694-V741 HydrophobicContact CG1-CG2 3.89Å; I694-V741 HydrophobicContact CG2-CG1 4.49Å; I694-V741 HydrophobicContact CG2-CG2 4.46Å
695	L	89.9	Confident	88.4	Confident	10 Å²	10	25.2 Å²	25.2	5%	0.052	13%	0.129	C	C	.	.	H	α-helix	trans	-56.7	-45.1	179.1	178.3	73.1	0	0	0	110.6	F470 S691 I692 N699 L722	F470-L695 HydrophobicContact CB-CD1 4.41Å; F470-L695 HydrophobicContact CD2-CB 4.34Å; F470-L695 HydrophobicContact CD2-CD1 4.28Å; F470-L695 HydrophobicContact CD2-CD2 3.9Å; F470-L695 HydrophobicContact CD2-CG 4.4Å; F470-L695 HydrophobicContact CE2-CB 4.47Å; F470-L695 HydrophobicContact CE2-CD2 4.05Å; F470-L695 HydrophobicContact CG-CD2 4.3Å; S691-L695 VanDerWaalsContact O-CB 3.25Å; S691-L695 WeakPolarHBondContact O-CB 3.25Å; S691-L695 PolarHBondContact O-N 3.43Å; I692-L695 PolarHBondContact O-N 2.77Å; L695-N699 WeakPolarHBondContact CD1-ND2 3.48Å; L695-N699 WeakPolarHBondContact O-CB 3.26Å; L695-N699 PolarHBondContact O-N 2.87Å; L695-N699 VanDerWaalsContact O-N 3.08Å; L695-N699 PolarHBondContact O-ND2 3.4Å; L695-N699 VanDerWaalsContact O-ND2 3.13Å; L695-L722 HydrophobicContact CD1-CD1 4.13Å; L695-L722 HydrophobicContact CD1-CD2 3.42Å; L695-L722 VanDerWaalsContact CD1-CD2 3.42Å; L695-L722 HydrophobicContact CD1-CG 4.44Å
696	M	84.9	Confident	88.2	Confident	24 Å²	24	20.9 Å²	20.9	12%	0.118	11%	0.107	C	C	.	.	H	α-helix	trans	-70.1	-54.4	-179.6	-70.3	-66.5	99	0	0	111.6	I692 L693 I694 Q698 N699 I700 P877	I692-M696 HydrophobicContact CG2-CG 4.44Å; I692-M696 WeakPolarHBondContact O-CB 3.49Å; I692-M696 VanDerWaalsContact O-CG 3.27Å; I692-M696 WeakPolarHBondContact O-CG 3Å; I692-M696 PolarHBondContact O-N 2.76Å; L693-M696 PolarHBondContact O-N 2.62Å; I694-M696 VanDerWaalsContact C-N 3.26Å; I694-M696 PolarHBondContact O-N 3.34Å; M696-Q698 VanDerWaalsContact C-N 3.29Å; M696-Q698 PolarHBondContact O-N 3.04Å; M696-N699 PolarHBondContact O-N 2.78Å; M696-I700 HydrophobicContact CB-CD1 3.98Å; M696-I700 VanDerWaalsContact O-CB 3.25Å; M696-I700 WeakPolarHBondContact O-CB 3.35Å; M696-I700 WeakPolarHBondContact O-CD1 3.39Å; M696-I700 WeakPolarHBondContact O-CG1 3.37Å; M696-I700 PolarHBondContact O-N 2.81Å; M696-I700 HydrophobicContact SD-CD1 4.38Å; M696-P877 HydrophobicContact CB-CB 3.55Å; M696-P877 HydrophobicContact CB-CG 4.3Å; M696-P877 HydrophobicContact CG-CB 3.76Å
697	D	86.2	Confident	87.8	Confident	16 Å²	16	20.1 Å²	20.1	9%	0.086	10%	0.098	C	C	.	.	H	α-helix	trans	-55.5	-45.5	-179.3	-85.4	13.7	0	0	0	111.4	L693 T701 V741	L693-D697 WeakPolarHBondContact O-CB 3.41Å; L693-D697 PolarHBondContact O-N 3.44Å; D697-T701 WeakPolarHBondContact O-CB 3.37Å; D697-T701 PolarHBondContact O-N 2.81Å; D697-T701 VanDerWaalsContact O-N 3.1Å; D697-T701 PolarHBondContact O-OG1 3.46Å; D697-V741 HydrophobicContact CB-CG1 3.76Å
698	Q	90.6	Very high	86.7	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-65.7	-52.6	179.3	-177.5	59.7	34.6	0	0	112.1	Y417 I694 M696 I700 T701 S702 D721 I725	Y417-Q698 PolarHBondContact OH-NE2 2.96Å; I694-Q698 WeakPolarHBondContact O-CB 3.3Å; I694-Q698 PolarHBondContact O-N 2.83Å; M696-Q698 VanDerWaalsContact C-N 3.29Å; M696-Q698 PolarHBondContact O-N 3.04Å; Q698-I700 PolarHBondContact O-N 3.47Å; Q698-T701 PolarHBondContact O-N 2.83Å; Q698-S702 PolarHBondContact NE2-OG 2.92Å; Q698-S702 PolarHBondContact O-N 3.37Å; Q698-S702 PolarHBondContact O-OG 2.81Å; Q698-D721 HydrophobicContact CG-CB 4.38Å; Q698-I725 HydrophobicContact CB-CD1 3.97Å; Q698-I725 HydrophobicContact CG-CD1 3.47Å; Q698-I725 VanDerWaalsContact CG-CD1 3.47Å
699	N	89.3	Confident	85.8	Confident	3 Å²	3	22.7 Å²	22.7	2%	0.016	12%	0.116	C	C	.	.	H	α-helix	trans	-65.9	-43.1	-174.3	-79.2	-23.1	0	0	0	111.3	V479 L695 M696 T701 S702 V703	V479-N699 HydrophobicContact CG2-CB 3.53Å; L695-N699 WeakPolarHBondContact CD1-ND2 3.48Å; L695-N699 WeakPolarHBondContact O-CB 3.26Å; L695-N699 PolarHBondContact O-N 2.87Å; L695-N699 VanDerWaalsContact O-N 3.08Å; L695-N699 PolarHBondContact O-ND2 3.4Å; L695-N699 VanDerWaalsContact O-ND2 3.13Å; M696-N699 PolarHBondContact O-N 2.78Å; N699-T701 VanDerWaalsContact C-N 3.32Å; N699-T701 PolarHBondContact O-N 3.29Å; N699-S702 PolarHBondContact O-N 3.48Å; N699-V703 WeakPolarHBondContact O-CB 3.27Å; N699-V703 WeakPolarHBondContact O-CG2 3.2Å; N699-V703 PolarHBondContact O-N 2.75Å
700	I	85.3	Confident	85.2	Confident	9 Å²	9	17.7 Å²	17.7	5%	0.046	10%	0.096	C	C	.	.	H	α-helix	trans	-61.5	-44.3	177.5	-72.9	149.8	0	0	0	110	I482 F490 M696 Q698 S702 V703 I704 L880	I482-I700 HydrophobicContact CD1-CG1 3.79Å; F490-I700 HydrophobicContact CD1-CG2 4.02Å; F490-I700 HydrophobicContact CE1-CG2 3.52Å; F490-I700 HydrophobicContact CE2-CG2 4.17Å; F490-I700 HydrophobicContact CG-CG2 4.5Å; F490-I700 HydrophobicContact CZ-CG2 3.6Å; M696-I700 HydrophobicContact CB-CD1 3.98Å; M696-I700 VanDerWaalsContact O-CB 3.25Å; M696-I700 WeakPolarHBondContact O-CB 3.35Å; M696-I700 WeakPolarHBondContact O-CD1 3.39Å; M696-I700 WeakPolarHBondContact O-CG1 3.37Å; M696-I700 PolarHBondContact O-N 2.81Å; M696-I700 HydrophobicContact SD-CD1 4.38Å; Q698-I700 PolarHBondContact O-N 3.47Å; I700-S702 PolarHBondContact O-N 2.97Å; I700-V703 PolarHBondContact O-N 2.79Å; I700-I704 HydrophobicContact CG2-CD1 3.65Å; I700-I704 HydrophobicContact CG2-CG1 4.48Å; I700-I704 WeakPolarHBondContact O-CD1 3.43Å; I700-I704 WeakPolarHBondContact O-CG1 3.49Å; I700-I704 PolarHBondContact O-N 3.04Å; I700-I704 VanDerWaalsContact O-N 3.09Å; I700-L880 HydrophobicContact CD1-CB 4.39Å; I700-L880 HydrophobicContact CD1-CD1 3.2Å; I700-L880 HydrophobicContact CD1-CG 4.37Å; I700-L880 HydrophobicContact CG1-CD1 4.12Å; I700-L880 HydrophobicContact CG2-CD1 4.33Å
701	T	86.8	Confident	84.4	Confident	2 Å²	2	23.3 Å²	23.3	1%	0.012	12%	0.12	C	C	.	.	H	α-helix	trans	-58	-51	175.3	-54.9	0	0	0	0	111.7	D697 Q698 N699 V703 I704 V705 A742 T744	D697-T701 WeakPolarHBondContact O-CB 3.37Å; D697-T701 PolarHBondContact O-N 2.81Å; D697-T701 VanDerWaalsContact O-N 3.1Å; D697-T701 PolarHBondContact O-OG1 3.46Å; Q698-T701 PolarHBondContact O-N 2.83Å; N699-T701 VanDerWaalsContact C-N 3.32Å; N699-T701 PolarHBondContact O-N 3.29Å; T701-V703 VanDerWaalsContact C-N 3.26Å; T701-V703 PolarHBondContact O-N 3Å; T701-I704 PolarHBondContact O-N 2.9Å; T701-V705 WeakPolarHBondContact O-CG2 3.23Å; T701-V705 PolarHBondContact O-N 2.67Å; T701-V705 VanDerWaalsContact O-N 3.12Å; T701-A742 HydrophobicContact CG2-CB 3.79Å; T701-T744 HydrophobicContact CG2-CG2 4.26Å; T701-T744 WeakPolarHBondContact OG1-CG2 3.43Å
702	S	89.1	Confident	84	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.7	-30.6	-179	-68.5	0	0	0	0	112.4	C426 Q698 N699 I700 N706 D721	C426-S702 PolarHBondContact SG-OG 2.93Å; Q698-S702 PolarHBondContact NE2-OG 2.92Å; Q698-S702 PolarHBondContact O-N 3.37Å; Q698-S702 PolarHBondContact O-OG 2.81Å; N699-S702 PolarHBondContact O-N 3.48Å; I700-S702 PolarHBondContact O-N 2.97Å; S702-N706 VanDerWaalsContact O-CB 3.23Å; S702-N706 WeakPolarHBondContact O-CB 3.33Å; S702-N706 PolarHBondContact O-N 2.81Å; S702-N706 PolarHBondContact O-ND2 3.24Å; S702-D721 PolarHBondContact OG-OD2 3.09Å
703	V	85.9	Confident	83.5	Confident	8 Å²	8	29.8 Å²	29.8	5%	0.048	15%	0.15	C	C	.	.	H	α-helix	trans	-69.1	-47.2	176.8	170.3	0	0	0	0	112.1	V479 I482 E487 N699 I700 T701 V705 N706 R707 Y718	V479-V703 HydrophobicContact CB-CG2 4.18Å; V479-V703 HydrophobicContact CG1-CB 4.43Å; V479-V703 HydrophobicContact CG1-CG2 3.03Å; V479-V703 HydrophobicContact CG2-CG2 4.17Å; I482-V703 HydrophobicContact CB-CG1 4.4Å; I482-V703 HydrophobicContact CD1-CG2 4.48Å; I482-V703 HydrophobicContact CG2-CG1 3.92Å; E487-V703 HydrophobicContact CG-CG1 4.18Å; E487-V703 VanDerWaalsContact OE1-CG1 3.31Å; E487-V703 WeakPolarHBondContact OE1-CG1 3.36Å; N699-V703 WeakPolarHBondContact O-CB 3.27Å; N699-V703 WeakPolarHBondContact O-CG2 3.2Å; N699-V703 PolarHBondContact O-N 2.75Å; I700-V703 PolarHBondContact O-N 2.79Å; T701-V703 VanDerWaalsContact C-N 3.26Å; T701-V703 PolarHBondContact O-N 3Å; V703-V705 PolarHBondContact O-N 2.74Å; V703-N706 CarbonylContact O-C 3.29Å; V703-N706 WeakPolarHBondContact O-CA 3.49Å; V703-N706 PolarHBondContact O-N 3.4Å; V703-R707 PolarHBondContact O-N 3.48Å; V703-Y718 HydrophobicContact CG2-CE1 3.94Å
704	I	83.6	Confident	83.3	Confident	11 Å²	11	29.9 Å²	29.9	6%	0.056	15%	0.149	C	C	.	.	H	α-helix	trans	-65.7	-36.2	-178.7	-57.3	152.7	0	0	0	109.9	F490 A491 I700 T701 R707 L748	F490-I704 HydrophobicContact CD1-CD1 3.16Å; F490-I704 HydrophobicContact CD1-CG1 4.34Å; F490-I704 HydrophobicContact CE1-CD1 3.25Å; F490-I704 HydrophobicContact CG-CD1 4.33Å; F490-I704 HydrophobicContact CZ-CD1 4.49Å; A491-I704 HydrophobicContact CB-CG2 4.33Å; I700-I704 HydrophobicContact CG2-CD1 3.65Å; I700-I704 HydrophobicContact CG2-CG1 4.48Å; I700-I704 WeakPolarHBondContact O-CD1 3.43Å; I700-I704 WeakPolarHBondContact O-CG1 3.49Å; I700-I704 PolarHBondContact O-N 3.04Å; I700-I704 VanDerWaalsContact O-N 3.09Å; T701-I704 PolarHBondContact O-N 2.9Å; I704-R707 WeakPolarHBondContact O-CB 3.21Å; I704-L748 HydrophobicContact CB-CD2 4.38Å; I704-L748 HydrophobicContact CG2-CD1 4.21Å; I704-L748 HydrophobicContact CG2-CD2 3.53Å; I704-L748 HydrophobicContact CG2-CG 4.44Å
705	V	86.5	Confident	82.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.4	-44	171.8	172.2	0	0	0	0	110.6	Q423 L425 T701 V703 R707 N710 L712 L751	Q423-V705 HydrophobicContact CG-CG1 4.02Å; L425-V705 HydrophobicContact CB-CG1 3.79Å; L425-V705 HydrophobicContact CD1-CG1 4.15Å; T701-V705 WeakPolarHBondContact O-CG2 3.23Å; T701-V705 PolarHBondContact O-N 2.67Å; T701-V705 VanDerWaalsContact O-N 3.12Å; V703-V705 PolarHBondContact O-N 2.74Å; V705-R707 PolarHBondContact O-N 3.18Å; V705-R707 VanDerWaalsContact O-N 3.13Å; V705-N710 PolarHBondContact O-ND2 3.32Å; V705-L712 VanDerWaalsContact O-CD1 3.3Å; V705-L712 WeakPolarHBondContact O-CD1 3.44Å; V705-L751 HydrophobicContact CB-CD1 4.39Å; V705-L751 HydrophobicContact CG1-CD1 3.8Å
706	N	84.8	Confident	82.3	Confident	27 Å²	27	33.9 Å²	33.9	14%	0.144	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	20	-179.4	-78	-37	0	0	0	115.5	Q423 S702 V703 L712	Q423-N706 PolarHBondContact NE2-OD1 3.44Å; Q423-N706 PolarHBondContact OE1-ND2 3.36Å; Q423-N706 VanDerWaalsContact OE1-ND2 3.08Å; Q423-N706 PolarHBondContact OE1-OD1 3.42Å; Q423-N706 VanDerWaalsContact OE1-OD1 3.09Å; S702-N706 VanDerWaalsContact O-CB 3.23Å; S702-N706 WeakPolarHBondContact O-CB 3.33Å; S702-N706 PolarHBondContact O-N 2.81Å; S702-N706 PolarHBondContact O-ND2 3.24Å; V703-N706 CarbonylContact O-C 3.29Å; V703-N706 WeakPolarHBondContact O-CA 3.49Å; V703-N706 PolarHBondContact O-N 3.4Å; N706-L712 VanDerWaalsContact OD1-CD1 3.28Å; N706-L712 WeakPolarHBondContact OD1-CD1 3.01Å
707	R	79.7	Confident	82.6	Confident	25 Å²	25	32.8 Å²	32.8	9%	0.094	17%	0.171	C	C	.	.			trans	-54.1	135.5	177.1	-168.7	176.8	170.4	156.9	2.2	110.9	E488 V703 I704 V705 D709 N710	E488-R707 IonicContact OE1-CZ 2.81Å; E488-R707 IonicContact OE1-NH1 3.04Å; E488-R707 IonicContact OE1-NH2 2.83Å; E488-R707 PolarHBondContact OE1-NH2 3.41Å; V703-R707 PolarHBondContact O-N 3.48Å; I704-R707 WeakPolarHBondContact O-CB 3.21Å; V705-R707 PolarHBondContact O-N 3.18Å; V705-R707 VanDerWaalsContact O-N 3.13Å; R707-D709 HydrophobicContact CG-CB 4.05Å; R707-D709 IonicContact CZ-OD2 3.55Å; R707-D709 IonicContact NE-OD2 3.03Å; R707-D709 PolarHBondContact NE-OD2 3.44Å; R707-D709 IonicContact NH2-OD2 2.72Å; R707-D709 PolarHBondContact NH2-OD2 2.97Å; R707-D709 PolarHBondContact O-N 3.06Å; R707-D709 VanDerWaalsContact O-N 3.12Å; R707-N710 VanDerWaalsContact O-CB 3.28Å; R707-N710 WeakPolarHBondContact O-CB 3.48Å; R707-N710 PolarHBondContact O-N 3.5Å
708	P	70.4	Confident	82.8	Confident	70 Å²	70	32.9 Å²	32.9	46%	0.455	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-60.8	-26.5	179.7	23.9	-34.6	0	0	0	112.8	N710 K711	P708-N710 PolarHBondContact O-N 3.33Å; P708-K711 PolarHBondContact O-N 3.08Å; P708-K711 VanDerWaalsContact O-N 3.14Å
709	D	72.1	Confident	82.9	Confident	66 Å²	66	33 Å²	33	35%	0.353	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-63.3	-24.4	176.1	-64.8	-21	0	0	0	112.6	R484 R707 K711 F769	R484-D709 IonicContact CZ-OD2 3.18Å; R484-D709 IonicContact NH2-OD2 3.92Å; R484-D709 PolarHBondContact NH2-OD2 2.99Å; R707-D709 HydrophobicContact CG-CB 4.05Å; R707-D709 IonicContact CZ-OD2 3.55Å; R707-D709 IonicContact NE-OD2 3.03Å; R707-D709 PolarHBondContact NE-OD2 3.44Å; R707-D709 IonicContact NH2-OD2 2.72Å; R707-D709 PolarHBondContact NH2-OD2 2.97Å; R707-D709 PolarHBondContact O-N 3.06Å; R707-D709 VanDerWaalsContact O-N 3.12Å; D709-K711 VanDerWaalsContact C-N 3.28Å; D709-K711 PolarHBondContact O-N 3.39Å; D709-F769 WeakPolarHBondContact O-CE1 3.09Å
710	N	76.1	Confident	83.1	Confident	25 Å²	25	34 Å²	34	13%	0.134	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-77.8	-9.9	178.2	-71.3	-18.8	0	0	0	113.3	V705 R707 P708 L712 L751 I772	V705-N710 PolarHBondContact O-ND2 3.32Å; R707-N710 VanDerWaalsContact O-CB 3.28Å; R707-N710 WeakPolarHBondContact O-CB 3.48Å; R707-N710 PolarHBondContact O-N 3.5Å; P708-N710 PolarHBondContact O-N 3.33Å; N710-L712 VanDerWaalsContact C-N 3.26Å; N710-L712 HydrophobicContact CB-CD1 4.31Å; N710-L712 HydrophobicContact CB-CG 4.15Å; N710-L712 PolarHBondContact O-N 2.93Å; N710-L751 WeakPolarHBondContact ND2-CD1 3.38Å; N710-I772 HydrophobicContact CB-CD1 3.43Å; N710-I772 VanDerWaalsContact CB-CD1 3.43Å
711	K	74.3	Confident	83.5	Confident	118 Å²	118	33.5 Å²	33.5	51%	0.513	17%	0.174	S	C	.	.			trans	50.3	40.6	177.6	-59.8	179	-178.5	173.4	0	114.2	P708 D709 F769 L770	P708-K711 PolarHBondContact O-N 3.08Å; P708-K711 VanDerWaalsContact O-N 3.14Å; D709-K711 VanDerWaalsContact C-N 3.28Å; D709-K711 PolarHBondContact O-N 3.39Å; K711-F769 HydrophobicContact CG-CE1 4.48Å; K711-F769 PolarHBondContact NZ-O 2.99Å; K711-L770 WeakPolarHBondContact CD-O 3.06Å
712	L	82.9	Confident	83.9	Confident	35 Å²	35	33.4 Å²	33.4	18%	0.183	17%	0.173	C	C	.	.			trans	-68.1	133.2	175.7	-61.7	162.8	0	0	0	110	L425 V705 N706 N710 I772 E774	L425-L712 HydrophobicContact CD1-CD2 3.73Å; V705-L712 VanDerWaalsContact O-CD1 3.3Å; V705-L712 WeakPolarHBondContact O-CD1 3.44Å; N706-L712 VanDerWaalsContact OD1-CD1 3.28Å; N706-L712 WeakPolarHBondContact OD1-CD1 3.01Å; N710-L712 VanDerWaalsContact C-N 3.26Å; N710-L712 HydrophobicContact CB-CD1 4.31Å; N710-L712 HydrophobicContact CB-CG 4.15Å; N710-L712 PolarHBondContact O-N 2.93Å; L712-I772 HydrophobicContact CD2-CB 4.13Å; L712-I772 HydrophobicContact CD2-CG2 4.29Å; L712-E774 VanDerWaalsContact CA-OE1 3.24Å; L712-E774 WeakPolarHBondContact CA-OE1 3.07Å; L712-E774 VanDerWaalsContact CD2-CD 3.45Å; L712-E774 HydrophobicContact CD2-CG 3.34Å
713	Q	76.9	Confident	84.2	Confident	165 Å²	165	34.7 Å²	34.7	77%	0.771	18%	0.181	S	C	*	.	S	Bend	trans	-93.7	-32.4	-175.3	-60.5	-175.7	-0.4	0	0	112.6	G715 E774	Q713-G715 VanDerWaalsContact C-N 3.28Å; Q713-G715 PolarHBondContact O-N 3.49Å; Q713-E774 PolarHBondContact N-OE1 2.76Å
714	K	82.8	Confident	84.6	Confident	13 Å²	13	34.9 Å²	34.9	6%	0.057	18%	0.183	C	C	.	.	S	Bend	trans	-86.5	9.6	-169.3	-52.2	177.1	177.4	176.5	0	114.3	K352 W355 D359 D362 E774	K352-K714 VanDerWaalsContact CE-O 3.27Å; K352-K714 WeakPolarHBondContact CE-O 3.17Å; K352-K714 PolarHBondContact NZ-O 3.1Å; W355-K714 HydrophobicContact CB-CD 4.2Å; W355-K714 HydrophobicContact CB-CG 4.43Å; W355-K714 HydrophobicContact CD2-CB 4.48Å; W355-K714 HydrophobicContact CD2-CG 4.07Å; W355-K714 HydrophobicContact CE3-CD 4.31Å; W355-K714 HydrophobicContact CE3-CG 3.98Å; W355-K714 HydrophobicContact CG-CB 4.29Å; W355-K714 HydrophobicContact CG-CG 4.25Å; D359-K714 WeakPolarHBondContact OD1-CD 3.22Å; D359-K714 WeakPolarHBondContact OD1-CE 3.02Å; D359-K714 IonicContact OD1-NZ 3.29Å; D359-K714 PolarHBondContact OD1-NZ 3.47Å; D362-K714 WeakPolarHBondContact OD2-CE 3.42Å; D362-K714 IonicContact OD2-NZ 3.13Å; D362-K714 PolarHBondContact OD2-NZ 3.13Å; K714-E774 VanDerWaalsContact CB-OE2 3.28Å; K714-E774 WeakPolarHBondContact CB-OE2 3.08Å; K714-E774 HydrophobicContact CD-CB 3.89Å; K714-E774 HydrophobicContact CG-CB 4.48Å; K714-E774 PolarHBondContact N-OE1 2.75Å; K714-E774 PolarHBondContact N-OE2 2.92Å; K714-E774 PolarHBondContact NZ-O 3.27Å
715	G	77.6	Confident	85.2	Confident	36 Å²	36	34.4 Å²	34.4	37%	0.371	18%	0.18	S	C	.	.			trans	71.4	-173.4	176.4	0	0	0	0	0	115	K352 Q713	K352-G715 WeakPolarHBondContact CE-O 3.42Å; K352-G715 PolarHBondContact NZ-O 2.92Å; Q713-G715 VanDerWaalsContact C-N 3.28Å; Q713-G715 PolarHBondContact O-N 3.49Å
716	F	83.5	Confident	85.6	Confident	59 Å²	59	34.4 Å²	34.4	26%	0.259	18%	0.18	S	C	.	.			trans	-101.2	167.7	-179.9	55.2	-99.9	0	0	0	112.1	F335 K352 Y718	F335-F716 HydrophobicContact CB-CE2 4.49Å; F335-F716 HydrophobicContact CB-CZ 3.99Å; F335-F716 HydrophobicContact CD2-CD2 4.22Å; F335-F716 AromaticContact CD2-CE2 3.2Å; F335-F716 HydrophobicContact CD2-CE2 3.2Å; F335-F716 AromaticContact CD2-CZ 3.44Å; F335-F716 HydrophobicContact CD2-CZ 3.44Å; F335-F716 VanDerWaalsContact CD2-CZ 3.44Å; F335-F716 HydrophobicContact CE2-CD2 4.23Å; F335-F716 AromaticContact CE2-CE2 3.46Å; F335-F716 HydrophobicContact CE2-CE2 3.46Å; F335-F716 VanDerWaalsContact CE2-CE2 3.46Å; F335-F716 HydrophobicContact CE2-CZ 4.19Å; F335-F716 AromaticContact CG-CE2 4Å; F335-F716 HydrophobicContact CG-CE2 4Å; F335-F716 AromaticContact CG-CZ 4Å; F335-F716 HydrophobicContact CG-CZ 4Å; F335-F716 HydrophobicContact CZ-CE2 4.4Å; K352-F716 WeakPolarHBondContact CE-O 3.33Å; F716-Y718 HydrophobicContact CB-CD2 4.14Å; F716-Y718 HydrophobicContact CB-CE1 4.45Å; F716-Y718 HydrophobicContact CB-CE2 3.59Å; F716-Y718 HydrophobicContact CD1-CE2 4.28Å; F716-Y718 AromaticContact CD2-CD2 3.61Å; F716-Y718 HydrophobicContact CD2-CD2 3.61Å; F716-Y718 AromaticContact CD2-CE2 3.54Å; F716-Y718 HydrophobicContact CD2-CE2 3.54Å; F716-Y718 HydrophobicContact CE2-CD2 4.34Å; F716-Y718 HydrophobicContact CE2-CE2 4.32Å; F716-Y718 HydrophobicContact CG-CD2 4.06Å; F716-Y718 AromaticContact CG-CE2 3.53Å; F716-Y718 HydrophobicContact CG-CE2 3.53Å
717	G	89.3	Confident	86.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.195	C	C	.	.			trans	-155.5	54.9	179	0	0	0	0	0	113.2	D348 L720 D721	D348-G717 WeakPolarHBondContact OD2-CA 3.11Å; G717-L720 PolarHBondContact O-N 3.09Å; G717-D721 VanDerWaalsContact O-CG 3.31Å; G717-D721 PolarHBondContact O-N 3.22Å
718	Y	90.8	Very high	86.9	Confident	19 Å²	19	35.8 Å²	35.8	8%	0.075	19%	0.192	C	C	.	.	H	α-helix	trans	-65.1	-38.9	-172.2	-55.7	-65.9	0	0	0	113.5	F335 D348 V479 V703 F716 L722	F335-Y718 HydrophobicContact CD1-CD2 4.36Å; F335-Y718 HydrophobicContact CD1-CE2 4.49Å; F335-Y718 AromaticContact CE1-CD2 3.81Å; F335-Y718 HydrophobicContact CE1-CD2 3.81Å; F335-Y718 HydrophobicContact CE1-CE2 4.37Å; F335-Y718 HydrophobicContact CE2-CD2 4.41Å; F335-Y718 AromaticContact CZ-CD2 3.85Å; F335-Y718 HydrophobicContact CZ-CD2 3.85Å; D348-Y718 PolarHBondContact OD2-N 3.36Å; V479-Y718 HydrophobicContact CG1-CE2 4.37Å; V703-Y718 HydrophobicContact CG2-CE1 3.94Å; F716-Y718 HydrophobicContact CB-CD2 4.14Å; F716-Y718 HydrophobicContact CB-CE1 4.45Å; F716-Y718 HydrophobicContact CB-CE2 3.59Å; F716-Y718 HydrophobicContact CD1-CE2 4.28Å; F716-Y718 AromaticContact CD2-CD2 3.61Å; F716-Y718 HydrophobicContact CD2-CD2 3.61Å; F716-Y718 AromaticContact CD2-CE2 3.54Å; F716-Y718 HydrophobicContact CD2-CE2 3.54Å; F716-Y718 HydrophobicContact CE2-CD2 4.34Å; F716-Y718 HydrophobicContact CE2-CE2 4.32Å; F716-Y718 HydrophobicContact CG-CD2 4.06Å; F716-Y718 AromaticContact CG-CE2 3.53Å; F716-Y718 HydrophobicContact CG-CE2 3.53Å; Y718-L722 PolarHBondContact O-N 3.48Å
719	H	92.5	Very high	88.1	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-74	-35.2	179.9	-63.6	-63.2	0	0	0	111.2	F335 L345 D348 V471 S476 L722 T723	F335-H719 AromaticContact CE2-NE2 3.99Å; F335-H719 AromaticContact CZ-CD2 3.87Å; F335-H719 AromaticContact CZ-NE2 3.38Å; F335-H719 WeakPolarHBondContact CZ-NE2 3.44Å; L345-H719 HydrophobicContact CB-CB 4.28Å; D348-H719 WeakPolarHBondContact OD2-CB 3.46Å; D348-H719 IonicContact OD2-CD2 3.03Å; D348-H719 IonicContact OD2-CG 2.73Å; D348-H719 PolarHBondContact OD2-N 3.41Å; V471-H719 HydrophobicContact CG1-CB 4.28Å; S476-H719 VanDerWaalsContact CB-CE1 3.4Å; S476-H719 WeakPolarHBondContact CB-CE1 3.3Å; S476-H719 PolarHBondContact OG-ND1 2.94Å; H719-L722 PolarHBondContact O-N 3.28Å; H719-T723 WeakPolarHBondContact O-CB 3.21Å; H719-T723 PolarHBondContact O-N 3.08Å; H719-T723 PolarHBondContact O-OG1 3.21Å
720	L	93.3	Very high	89.1	Confident	24 Å²	24	32.3 Å²	32.3	13%	0.126	17%	0.169	C	C	.	.	H	α-helix	trans	-63.4	-46.9	173.7	-177.6	58.3	0	0	0	110.9	L345 D348 G717 L722 T723 V724	L345-L720 HydrophobicContact CD1-CB 4.28Å; L345-L720 HydrophobicContact CD1-CD1 4.15Å; D348-L720 HydrophobicContact CB-CB 4.24Å; D348-L720 PolarHBondContact OD2-N 2.86Å; G717-L720 PolarHBondContact O-N 3.09Å; L720-L722 VanDerWaalsContact C-N 3.35Å; L720-L722 PolarHBondContact O-N 3.48Å; L720-T723 PolarHBondContact O-N 3.35Å; L720-V724 WeakPolarHBondContact O-CG2 3.4Å; L720-V724 PolarHBondContact O-N 3.08Å
721	D	94.5	Very high	89.9	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-55.7	-47.9	175.9	-71.5	-12.6	0	0	0	112.1	Y417 G422 Q423 Q698 S702 G717 T723 V724 I725	Y417-D721 HydrophobicContact CE2-CB 4.49Å; G422-D721 VanDerWaalsContact CA-OD1 3.31Å; G422-D721 WeakPolarHBondContact CA-OD1 3.47Å; G422-D721 PolarHBondContact N-OD1 3.08Å; Q423-D721 WeakPolarHBondContact CB-OD2 3.15Å; Q423-D721 PolarHBondContact N-OD1 3Å; Q698-D721 HydrophobicContact CG-CB 4.38Å; S702-D721 PolarHBondContact OG-OD2 3.09Å; G717-D721 VanDerWaalsContact O-CG 3.31Å; G717-D721 PolarHBondContact O-N 3.22Å; D721-T723 VanDerWaalsContact C-N 3.32Å; D721-T723 PolarHBondContact O-N 3.34Å; D721-V724 PolarHBondContact O-N 2.86Å; D721-I725 WeakPolarHBondContact O-CG1 3.44Å; D721-I725 PolarHBondContact O-N 3.05Å
722	L	94.4	Very high	90.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.2	-35.3	-179	-164.6	65.3	0	0	0	112.4	L467 F470 V471 L695 Y718 H719 L720 I725 S726	L467-L722 HydrophobicContact CD2-CD1 3.79Å; L467-L722 HydrophobicContact CD2-CG 4.33Å; F470-L722 HydrophobicContact CB-CD2 4.14Å; V471-L722 HydrophobicContact CG2-CB 3.85Å; V471-L722 HydrophobicContact CG2-CD2 3.69Å; V471-L722 HydrophobicContact CG2-CG 3.91Å; L695-L722 HydrophobicContact CD1-CD1 4.13Å; L695-L722 HydrophobicContact CD1-CD2 3.42Å; L695-L722 VanDerWaalsContact CD1-CD2 3.42Å; L695-L722 HydrophobicContact CD1-CG 4.44Å; Y718-L722 PolarHBondContact O-N 3.48Å; H719-L722 PolarHBondContact O-N 3.28Å; L720-L722 VanDerWaalsContact C-N 3.35Å; L720-L722 PolarHBondContact O-N 3.48Å; L722-I725 PolarHBondContact O-N 2.98Å; L722-S726 PolarHBondContact O-N 2.8Å
723	T	95.6	Very high	91.1	Very high	26 Å²	26	25.9 Å²	25.9	16%	0.16	14%	0.142	C	C	.	.	H	α-helix	trans	-65.1	-44.9	175.2	-55.9	0	0	0	0	110.7	L345 L468 H719 L720 D721 I725 S726 V727	L345-T723 WeakPolarHBondContact CD1-OG1 3.47Å; L345-T723 HydrophobicContact CD2-CG2 4.23Å; L468-T723 HydrophobicContact CD2-CG2 4.37Å; H719-T723 WeakPolarHBondContact O-CB 3.21Å; H719-T723 PolarHBondContact O-N 3.08Å; H719-T723 PolarHBondContact O-OG1 3.21Å; L720-T723 PolarHBondContact O-N 3.35Å; D721-T723 VanDerWaalsContact C-N 3.32Å; D721-T723 PolarHBondContact O-N 3.34Å; T723-I725 VanDerWaalsContact C-N 3.3Å; T723-I725 PolarHBondContact O-N 3.46Å; T723-S726 WeakPolarHBondContact O-CB 3.28Å; T723-S726 PolarHBondContact O-N 2.65Å; T723-S726 PolarHBondContact O-OG 3.01Å; T723-V727 PolarHBondContact O-N 3.09Å; T723-V727 VanDerWaalsContact O-N 3.13Å
724	V	95.8	Very high	91.8	Very high	13 Å²	13	20.5 Å²	20.5	8%	0.079	12%	0.118	C	C	.	.	H	α-helix	trans	-61.2	-41.8	176.9	175.8	0	0	0	0	110.8	I416 Y417 F420 L720 D721 S726 V727 L728	I416-V724 HydrophobicContact CG2-CG1 4.45Å; Y417-V724 HydrophobicContact CD2-CG1 3.93Å; F420-V724 HydrophobicContact CB-CG1 4.33Å; F420-V724 HydrophobicContact CB-CG2 3.75Å; F420-V724 WeakPolarHBondContact O-CG2 3.49Å; L720-V724 WeakPolarHBondContact O-CG2 3.4Å; L720-V724 PolarHBondContact O-N 3.08Å; D721-V724 PolarHBondContact O-N 2.86Å; V724-S726 PolarHBondContact O-N 3.39Å; V724-V727 PolarHBondContact O-N 3.36Å; V724-L728 HydrophobicContact CG1-CD1 4.14Å; V724-L728 WeakPolarHBondContact O-CG 3.33Å; V724-L728 PolarHBondContact O-N 2.84Å
725	I	95.3	Very high	92	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.1	-40.6	176	-68.5	168.8	0	0	0	111.4	Y417 L467 I694 Q698 D721 L722 T723 V727 L728 M729	Y417-I725 HydrophobicContact CD2-CG1 4.37Å; Y417-I725 HydrophobicContact CE2-CD1 4.29Å; Y417-I725 HydrophobicContact CE2-CG1 4.19Å; L467-I725 HydrophobicContact CD1-CG2 4.21Å; I694-I725 HydrophobicContact CG2-CG2 3.73Å; Q698-I725 HydrophobicContact CB-CD1 3.97Å; Q698-I725 HydrophobicContact CG-CD1 3.47Å; Q698-I725 VanDerWaalsContact CG-CD1 3.47Å; D721-I725 WeakPolarHBondContact O-CG1 3.44Å; D721-I725 PolarHBondContact O-N 3.05Å; L722-I725 PolarHBondContact O-N 2.98Å; T723-I725 VanDerWaalsContact C-N 3.3Å; T723-I725 PolarHBondContact O-N 3.46Å; I725-V727 VanDerWaalsContact C-N 3.29Å; I725-V727 PolarHBondContact O-N 2.88Å; I725-L728 CarbonylContact O-C 3.57Å; I725-L728 WeakPolarHBondContact O-CA 3.44Å; I725-L728 WeakPolarHBondContact O-CB 3.38Å; I725-L728 PolarHBondContact O-N 3.39Å; I725-L728 VanDerWaalsContact O-N 3.1Å; I725-M729 HydrophobicContact CG2-CG 4.3Å; I725-M729 VanDerWaalsContact O-CG 3.28Å; I725-M729 WeakPolarHBondContact O-CG 3.5Å; I725-M729 PolarHBondContact O-N 3.18Å
726	S	95.7	Very high	92.3	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-57.5	-43.6	175.8	76.6	0	0	0	0	111.9	S464 L468 L722 T723 V724 L728 M729 I730	S464-S726 WeakPolarHBondContact CB-O 3.01Å; S464-S726 PolarHBondContact OG-O 2.93Å; L468-S726 WeakPolarHBondContact CD2-OG 3.37Å; L722-S726 PolarHBondContact O-N 2.8Å; T723-S726 WeakPolarHBondContact O-CB 3.28Å; T723-S726 PolarHBondContact O-N 2.65Å; T723-S726 PolarHBondContact O-OG 3.01Å; V724-S726 PolarHBondContact O-N 3.39Å; S726-L728 PolarHBondContact O-N 3.45Å; S726-M729 WeakPolarHBondContact O-CB 3.38Å; S726-M729 PolarHBondContact O-N 3.28Å; S726-I730 PolarHBondContact O-N 3.46Å
727	V	95.7	Very high	92.6	Very high	78 Å²	78	17.9 Å²	17.9	47%	0.473	10%	0.099	S	C	.	.	H	α-helix	trans	-64.6	-42.9	175.6	175.7	0	0	0	0	110.8	T723 V724 I725 M729 I730 V731	T723-V727 PolarHBondContact O-N 3.09Å; T723-V727 VanDerWaalsContact O-N 3.13Å; V724-V727 PolarHBondContact O-N 3.36Å; I725-V727 VanDerWaalsContact C-N 3.29Å; I725-V727 PolarHBondContact O-N 2.88Å; V727-M729 VanDerWaalsContact C-N 3.28Å; V727-M729 PolarHBondContact O-N 2.77Å; V727-I730 PolarHBondContact O-N 3.19Å; V727-V731 WeakPolarHBondContact O-CG2 3.34Å; V727-V731 PolarHBondContact O-N 3.1Å; V727-V731 VanDerWaalsContact O-N 3.08Å
728	L	95.3	Very high	92.6	Very high	4 Å²	4	18.2 Å²	18.2	2%	0.021	10%	0.101	C	C	.	.	H	α-helix	trans	-60.9	-36	175.5	-76.2	173.3	0	0	0	112.5	C413 I416 Y417 L428 V724 I725 S726 I730 V731 C732	C413-L728 HydrophobicContact CB-CD1 4.48Å; C413-L728 HydrophobicContact CB-CD2 4.29Å; I416-L728 HydrophobicContact CB-CD2 3.81Å; I416-L728 HydrophobicContact CD1-CD2 3.81Å; I416-L728 HydrophobicContact CG1-CD2 4.41Å; I416-L728 HydrophobicContact CG2-CD2 3.65Å; I416-L728 HydrophobicContact CG2-CG 4.1Å; Y417-L728 HydrophobicContact CD2-CD1 4.48Å; L428-L728 HydrophobicContact CD1-CD1 3.54Å; V724-L728 HydrophobicContact CG1-CD1 4.14Å; V724-L728 WeakPolarHBondContact O-CG 3.33Å; V724-L728 PolarHBondContact O-N 2.84Å; I725-L728 CarbonylContact O-C 3.57Å; I725-L728 WeakPolarHBondContact O-CA 3.44Å; I725-L728 WeakPolarHBondContact O-CB 3.38Å; I725-L728 PolarHBondContact O-N 3.39Å; I725-L728 VanDerWaalsContact O-N 3.1Å; S726-L728 PolarHBondContact O-N 3.45Å; L728-I730 VanDerWaalsContact C-N 3.32Å; L728-I730 PolarHBondContact O-N 3.45Å; L728-V731 PolarHBondContact O-N 2.93Å; L728-C732 WeakPolarHBondContact O-CB 3.41Å; L728-C732 PolarHBondContact O-N 3Å; L728-C732 PolarHBondContact O-SG 2.85Å
729	M	94.9	Very high	92.7	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.01	10%	0.098	C	C	.	.	H	α-helix	trans	-60.9	-41.6	176.1	-69.1	-58.7	-75	0	0	111.5	T463 L467 F690 I694 I725 S726 V727 S733 F739	T463-M729 HydrophobicContact CG2-CE 3.61Å; T463-M729 HydrophobicContact CG2-CG 4.4Å; L467-M729 HydrophobicContact CD1-CG 4.28Å; F690-M729 HydrophobicContact CD1-CE 3.88Å; F690-M729 HydrophobicContact CE1-CE 3.38Å; F690-M729 HydrophobicContact CZ-CE 4.4Å; I694-M729 HydrophobicContact CD1-CE 3.69Å; I694-M729 HydrophobicContact CD1-SD 3.92Å; I725-M729 HydrophobicContact CG2-CG 4.3Å; I725-M729 VanDerWaalsContact O-CG 3.28Å; I725-M729 WeakPolarHBondContact O-CG 3.5Å; I725-M729 PolarHBondContact O-N 3.18Å; S726-M729 WeakPolarHBondContact O-CB 3.38Å; S726-M729 PolarHBondContact O-N 3.28Å; V727-M729 VanDerWaalsContact C-N 3.28Å; V727-M729 PolarHBondContact O-N 2.77Å; M729-S733 VanDerWaalsContact O-CB 3.27Å; M729-S733 WeakPolarHBondContact O-CB 3.31Å; M729-S733 PolarHBondContact O-N 3.39Å; M729-S733 PolarHBondContact O-OG 3.38Å; M729-F739 HydrophobicContact CE-CB 4.33Å; M729-F739 HydrophobicContact CE-CD1 3.51Å; M729-F739 HydrophobicContact CE-CD2 4.13Å; M729-F739 HydrophobicContact CE-CE1 3.73Å; M729-F739 HydrophobicContact CE-CE2 4.32Å; M729-F739 HydrophobicContact CE-CG 3.74Å; M729-F739 HydrophobicContact CE-CZ 4.14Å; M729-F739 HydrophobicContact SD-CB 4.13Å; M729-F739 HydrophobicContact SD-CD1 3.54Å; M729-F739 VanDerWaalsContact SD-CD1 3.54Å; M729-F739 HydrophobicContact SD-CE1 4.16Å; M729-F739 HydrophobicContact SD-CG 3.97Å
730	I	93.9	Very high	92.7	Very high	60 Å²	60	17.6 Å²	17.6	31%	0.308	10%	0.098	S	C	.	.	H	α-helix	trans	-64.6	-47.7	174.8	-63.3	174.6	0	0	0	110.4	S464 S726 V727 L728 C732 S733 L734	S464-I730 WeakPolarHBondContact OG-CD1 3.41Å; S464-I730 WeakPolarHBondContact OG-CG1 3.47Å; S726-I730 PolarHBondContact O-N 3.46Å; V727-I730 PolarHBondContact O-N 3.19Å; L728-I730 VanDerWaalsContact C-N 3.32Å; L728-I730 PolarHBondContact O-N 3.45Å; I730-C732 VanDerWaalsContact C-N 3.34Å; I730-C732 PolarHBondContact O-N 3.05Å; I730-S733 WeakPolarHBondContact O-CB 3.45Å; I730-S733 PolarHBondContact O-N 3.49Å; I730-L734 HydrophobicContact CG2-CD1 3.84Å; I730-L734 HydrophobicContact CG2-CG 4.38Å; I730-L734 WeakPolarHBondContact O-CG 3.29Å; I730-L734 PolarHBondContact O-N 2.88Å
731	V	92.2	Very high	92.6	Very high	41 Å²	41	16.4 Å²	16.4	25%	0.248	9%	0.092	C	C	.	.	H	α-helix	trans	-59.9	-45.1	179.5	173.8	0	0	0	0	111.1	V412 V727 L728 S733 L734 L735	V412-V731 HydrophobicContact CG1-CG1 4.48Å; V727-V731 WeakPolarHBondContact O-CG2 3.34Å; V727-V731 PolarHBondContact O-N 3.1Å; V727-V731 VanDerWaalsContact O-N 3.08Å; L728-V731 PolarHBondContact O-N 2.93Å; V731-S733 VanDerWaalsContact C-N 3.33Å; V731-S733 PolarHBondContact O-N 2.81Å; V731-L734 PolarHBondContact O-N 2.78Å; V731-L735 HydrophobicContact CG1-CD1 3.91Å; V731-L735 WeakPolarHBondContact O-CB 3.36Å; V731-L735 WeakPolarHBondContact O-CG 3.43Å; V731-L735 PolarHBondContact O-N 2.85Å
732	C	92.2	Very high	92.5	Very high	2 Å²	2	16.5 Å²	16.5	1%	0.014	9%	0.093	C	C	.	.	H	α-helix	trans	-65.5	-37.7	178.5	-64.2	0	0	0	0	112.1	C413 L728 I730 G736 I737 F739	C413-C732 PolarHBondContact SG-SG 2.99Å; L728-C732 WeakPolarHBondContact O-CB 3.41Å; L728-C732 PolarHBondContact O-N 3Å; L728-C732 PolarHBondContact O-SG 2.85Å; I730-C732 VanDerWaalsContact C-N 3.34Å; I730-C732 PolarHBondContact O-N 3.05Å; C732-G736 WeakPolarHBondContact O-CA 3.42Å; C732-G736 PolarHBondContact O-N 2.78Å; C732-I737 HydrophobicContact CB-CD1 4.48Å; C732-I737 HydrophobicContact CB-CG1 3.88Å; C732-I737 PolarHBondContact O-N 2.8Å; C732-F739 HydrophobicContact CB-CD1 3.7Å; C732-F739 HydrophobicContact CB-CE1 3.89Å
733	S	92	Very high	92.2	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.007	9%	0.094	C	C	.	.	H	α-helix	trans	-65.6	-43.9	177.3	-60.4	0	0	0	0	111.7	G460 M729 I730 V731 G736 F739	G460-S733 WeakPolarHBondContact CA-OG 3.39Å; M729-S733 VanDerWaalsContact O-CB 3.27Å; M729-S733 WeakPolarHBondContact O-CB 3.31Å; M729-S733 PolarHBondContact O-N 3.39Å; M729-S733 PolarHBondContact O-OG 3.38Å; I730-S733 WeakPolarHBondContact O-CB 3.45Å; I730-S733 PolarHBondContact O-N 3.49Å; V731-S733 VanDerWaalsContact C-N 3.33Å; V731-S733 PolarHBondContact O-N 2.81Å; S733-G736 PolarHBondContact O-N 2.9Å; S733-F739 WeakPolarHBondContact OG-CE1 3.11Å
734	L	90.3	Very high	91.6	Very high	51 Å²	51	16.6 Å²	16.6	27%	0.267	9%	0.094	S	C	.	.	H	α-helix	trans	-66.3	-41.2	178.5	-72	167.8	0	0	0	112.6	F457 F668 V669 I730 V731 G736	F457-L734 HydrophobicContact CD2-CD2 4.43Å; F457-L734 HydrophobicContact CE2-CD2 3.57Å; F457-L734 HydrophobicContact CE2-CG 4.07Å; F457-L734 HydrophobicContact CZ-CD2 4.36Å; F668-L734 HydrophobicContact CE2-CB 4.16Å; F668-L734 HydrophobicContact CE2-CD2 3.78Å; F668-L734 HydrophobicContact CE2-CG 4.47Å; F668-L734 HydrophobicContact CZ-CD2 3.86Å; V669-L734 PolarHBondContact N-O 2.95Å; I730-L734 HydrophobicContact CG2-CD1 3.84Å; I730-L734 HydrophobicContact CG2-CG 4.38Å; I730-L734 WeakPolarHBondContact O-CG 3.29Å; I730-L734 PolarHBondContact O-N 2.88Å; V731-L734 PolarHBondContact O-N 2.78Å; L734-G736 VanDerWaalsContact C-N 3.28Å
735	L	87.3	Confident	90.7	Very high	53 Å²	53	17.8 Å²	17.8	28%	0.277	10%	0.101	S	C	.	.	H	α-helix	trans	-81.8	-6.9	178.6	-64.7	176.7	0	0	0	113.2	W667 V731 I737	W667-L735 CarbonylContact O-C 3.6Å; W667-L735 VanDerWaalsContact O-CA 3.28Å; W667-L735 WeakPolarHBondContact O-CA 3.07Å; V731-L735 HydrophobicContact CG1-CD1 3.91Å; V731-L735 WeakPolarHBondContact O-CB 3.36Å; V731-L735 WeakPolarHBondContact O-CG 3.43Å; V731-L735 PolarHBondContact O-N 2.85Å; L735-I737 HydrophobicContact CB-CD1 4.1Å; L735-I737 HydrophobicContact CB-CG1 3.97Å; L735-I737 HydrophobicContact CB-CG2 4.19Å; L735-I737 HydrophobicContact CD1-CD1 3.94Å; L735-I737 PolarHBondContact O-N 2.87Å
736	G	84.8	Confident	90.2	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.01	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	34.6	-174.9	0	0	0	0	0	113.8	R665 C732 S733 L734	R665-G736 PolarHBondContact NH2-O 2.86Å; C732-G736 WeakPolarHBondContact O-CA 3.42Å; C732-G736 PolarHBondContact O-N 2.78Å; S733-G736 PolarHBondContact O-N 2.9Å; L734-G736 VanDerWaalsContact C-N 3.28Å
737	I	89	Confident	89.9	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.103	C	C	.	.	P	Polyproline II helix	trans	-97.4	158.2	177.1	56.6	178.4	0	0	0	110.5	E405 L408 A409 R456 W667 C732 L735	E405-I737 HydrophobicContact CB-CG2 4.47Å; L408-I737 HydrophobicContact CD2-CG2 4.31Å; A409-I737 HydrophobicContact CB-CB 4.12Å; A409-I737 HydrophobicContact CB-CD1 4.23Å; A409-I737 HydrophobicContact CB-CG1 4.44Å; R456-I737 PolarHBondContact NH2-O 3.03Å; W667-I737 HydrophobicContact CE3-CG2 4.39Å; W667-I737 HydrophobicContact CZ3-CG2 3.94Å; C732-I737 HydrophobicContact CB-CD1 4.48Å; C732-I737 HydrophobicContact CB-CG1 3.88Å; C732-I737 PolarHBondContact O-N 2.8Å; L735-I737 HydrophobicContact CB-CD1 4.1Å; L735-I737 HydrophobicContact CB-CG1 3.97Å; L735-I737 HydrophobicContact CB-CG2 4.19Å; L735-I737 HydrophobicContact CD1-CD1 3.94Å; L735-I737 PolarHBondContact O-N 2.87Å
738	P	89.7	Confident	89.3	Confident	6 Å²	6	15.9 Å²	15.9	4%	0.039	9%	0.088	C	C	.	.	P	Polyproline II helix	trans	-59	149.4	-179.6	18.5	-29.8	0	0	0	113.2	I401 N406 A409 R456 Y740	I401-P738 HydrophobicContact CG2-CG 4.32Å; N406-P738 HydrophobicContact CB-CG 4.12Å; N406-P738 WeakPolarHBondContact OD1-CG 3.44Å; A409-P738 HydrophobicContact CB-CG 3.75Å; R456-P738 VanDerWaalsContact NH2-CA 3.25Å; P738-Y740 HydrophobicContact CB-CE2 4.18Å; P738-Y740 HydrophobicContact CG-CE2 4Å
739	F	92.2	Very high	88.6	Confident	3 Å²	3	16.2 Å²	16.2	1%	0.013	9%	0.09	C	C	.	.	P	Polyproline II helix	trans	-81.2	130.6	179.2	-62	-56.5	0	0	0	111.2	E438 R456 F690 M729 C732 S733	E438-F739 HydrophobicContact CG-CD2 4.48Å; E438-F739 WeakPolarHBondContact OE1-CD2 3.29Å; E438-F739 PolarHBondContact OE1-N 2.78Å; R456-F739 HydrophobicContact CG-CE2 4Å; R456-F739 HydrophobicContact CG-CZ 3.99Å; R456-F739 VanDerWaalsContact NH2-N 3.2Å; F690-F739 HydrophobicContact CE1-CB 4.25Å; F690-F739 AromaticContact CE1-CD2 3.54Å; F690-F739 HydrophobicContact CE1-CD2 3.54Å; F690-F739 HydrophobicContact CE1-CE2 4.07Å; F690-F739 HydrophobicContact CE1-CG 4.01Å; F690-F739 HydrophobicContact CZ-CB 4.04Å; F690-F739 AromaticContact CZ-CD2 3.85Å; F690-F739 HydrophobicContact CZ-CD2 3.85Å; F690-F739 HydrophobicContact CZ-CG 4.24Å; M729-F739 HydrophobicContact CE-CB 4.33Å; M729-F739 HydrophobicContact CE-CD1 3.51Å; M729-F739 HydrophobicContact CE-CD2 4.13Å; M729-F739 HydrophobicContact CE-CE1 3.73Å; M729-F739 HydrophobicContact CE-CE2 4.32Å; M729-F739 HydrophobicContact CE-CG 3.74Å; M729-F739 HydrophobicContact CE-CZ 4.14Å; M729-F739 HydrophobicContact SD-CB 4.13Å; M729-F739 HydrophobicContact SD-CD1 3.54Å; M729-F739 VanDerWaalsContact SD-CD1 3.54Å; M729-F739 HydrophobicContact SD-CE1 4.16Å; M729-F739 HydrophobicContact SD-CG 3.97Å; C732-F739 HydrophobicContact CB-CD1 3.7Å; C732-F739 HydrophobicContact CB-CE1 3.89Å; S733-F739 WeakPolarHBondContact OG-CE1 3.11Å
740	Y	92.8	Very high	88.2	Confident	4 Å²	4	16.1 Å²	16.1	2%	0.016	9%	0.089	C	C	.	.			trans	-112.7	133.4	-176.7	-87.7	-131.3	0	0	0	110.4	I386 N406 A409 C413 L428 S429 A430 P738	I386-Y740 HydrophobicContact CG1-CE1 4.46Å; N406-Y740 PolarHBondContact O-OH 2.72Å; N406-Y740 WeakPolarHBondContact OD1-CE2 3.31Å; N406-Y740 PolarHBondContact OD1-OH 2.94Å; A409-Y740 HydrophobicContact CB-CD2 3.87Å; A409-Y740 HydrophobicContact CB-CE2 3.51Å; C413-Y740 HydrophobicContact CB-CD1 4.44Å; C413-Y740 HydrophobicContact CB-CG 4.3Å; L428-Y740 HydrophobicContact CB-CD1 4.49Å; S429-Y740 VanDerWaalsContact CA-CD1 3.41Å; A430-Y740 HydrophobicContact CB-CE2 4.27Å; P738-Y740 HydrophobicContact CB-CE2 4.18Å; P738-Y740 HydrophobicContact CG-CE2 4Å
741	V	91.6	Very high	87.9	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	162.7	179.3	-174.2	0	0	0	0	108	L428 S429 T431 I694 D697 A743	L428-V741 WeakPolarHBondContact CA-O 3.04Å; L428-V741 VanDerWaalsContact CD2-C 3.45Å; S429-V741 PolarHBondContact N-O 3.36Å; S429-V741 VanDerWaalsContact N-O 3.09Å; S429-V741 PolarHBondContact O-N 3Å; T431-V741 HydrophobicContact CG2-CB 4.42Å; I694-V741 HydrophobicContact CG1-CG2 3.89Å; I694-V741 HydrophobicContact CG2-CG1 4.49Å; I694-V741 HydrophobicContact CG2-CG2 4.46Å; D697-V741 HydrophobicContact CB-CG1 3.76Å; V741-A743 PolarHBondContact O-N 2.84Å; V741-A743 VanDerWaalsContact O-N 3.13Å
742	A	91.7	Very high	87.4	Confident	2 Å²	2	14.5 Å²	14.5	2%	0.017	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	122.6	177.9	0	0	0	0	0	110.9	C426 L428 T701 T744	C426-A742 HydrophobicContact CB-CB 4.44Å; L428-A742 HydrophobicContact CD2-CB 4.24Å; L428-A742 VanDerWaalsContact CD2-N 3.3Å; T701-A742 HydrophobicContact CG2-CB 3.79Å; A742-T744 PolarHBondContact O-N 2.91Å
743	A	89	Confident	86.9	Confident	2 Å²	2	15.9 Å²	15.9	2%	0.017	9%	0.087	C	C	.	.			trans	-86.5	108.6	173.3	0	0	0	0	0	108.6	V427 V741 V745 I746 S747	V427-A743 PolarHBondContact O-N 2.79Å; V741-A743 PolarHBondContact O-N 2.84Å; V741-A743 VanDerWaalsContact O-N 3.13Å; A743-V745 VanDerWaalsContact C-N 3.33Å; A743-V745 PolarHBondContact O-N 2.93Å; A743-I746 HydrophobicContact CB-CB 4.27Å; A743-I746 HydrophobicContact CB-CD1 4.25Å; A743-I746 HydrophobicContact CB-CG1 4.35Å; A743-I746 PolarHBondContact O-N 3.05Å; A743-S747 WeakPolarHBondContact O-CB 3.26Å; A743-S747 PolarHBondContact O-N 3.11Å; A743-S747 PolarHBondContact O-OG 2.78Å
744	T	81.5	Confident	86.7	Confident	25 Å²	25	15.8 Å²	15.8	15%	0.153	9%	0.087	C	C	.	.	H	α-helix	trans	-48.5	-52.3	178.5	54.2	0	0	0	0	112.2	F490 I494 T701 A742 I746 S747 L748	F490-T744 HydrophobicContact CE1-CG2 3.71Å; F490-T744 HydrophobicContact CZ-CG2 3.87Å; I494-T744 VanDerWaalsContact CD1-CB 3.49Å; I494-T744 HydrophobicContact CD1-CG2 4.08Å; I494-T744 VanDerWaalsContact CD1-OG1 3.25Å; I494-T744 WeakPolarHBondContact CD1-OG1 3.09Å; T701-T744 HydrophobicContact CG2-CG2 4.26Å; T701-T744 WeakPolarHBondContact OG1-CG2 3.43Å; A742-T744 PolarHBondContact O-N 2.91Å; T744-I746 PolarHBondContact O-N 3.11Å; T744-S747 PolarHBondContact O-N 3.44Å; T744-L748 WeakPolarHBondContact O-CG 3.49Å; T744-L748 PolarHBondContact O-N 2.92Å
745	V	77.6	Confident	86.4	Confident	39 Å²	39	17.1 Å²	17.1	24%	0.236	9%	0.088	C	C	.	.	H	α-helix	trans	-59.5	-49.9	-175	-162.9	0	0	0	0	111.9	I494 F498 A743 S747 L748 M749	I494-V745 HydrophobicContact CG2-CB 3.95Å; I494-V745 HydrophobicContact CG2-CG1 3.93Å; I494-V745 HydrophobicContact CG2-CG2 3.51Å; F498-V745 HydrophobicContact CB-CG1 4.34Å; F498-V745 HydrophobicContact CD2-CG1 4.09Å; F498-V745 HydrophobicContact CE2-CG1 4.5Å; F498-V745 HydrophobicContact CG-CG1 4.22Å; A743-V745 VanDerWaalsContact C-N 3.33Å; A743-V745 PolarHBondContact O-N 2.93Å; V745-S747 VanDerWaalsContact C-N 3.33Å; V745-S747 PolarHBondContact O-N 3.48Å; V745-L748 PolarHBondContact O-N 2.59Å; V745-M749 HydrophobicContact CG1-SD 3.92Å; V745-M749 WeakPolarHBondContact O-CG 3.31Å; V745-M749 PolarHBondContact O-N 3.2Å
746	I	85.7	Confident	85.9	Confident	6 Å²	6	16.7 Å²	16.7	3%	0.031	9%	0.086	C	C	.	.	H	α-helix	trans	-68	-37.9	-177.4	-62.8	177.6	0	0	0	110.4	L378 N382 K385 V427 A743 T744 L748 M749 H750	L378-I746 HydrophobicContact CD1-CG2 3.28Å; N382-I746 HydrophobicContact CB-CD1 4.31Å; N382-I746 WeakPolarHBondContact OD1-CD1 3.46Å; K385-I746 HydrophobicContact CD-CD1 3.63Å; V427-I746 HydrophobicContact CB-CG2 3.85Å; V427-I746 HydrophobicContact CG1-CG2 3.7Å; V427-I746 HydrophobicContact CG2-CG2 4.26Å; A743-I746 HydrophobicContact CB-CB 4.27Å; A743-I746 HydrophobicContact CB-CD1 4.25Å; A743-I746 HydrophobicContact CB-CG1 4.35Å; A743-I746 PolarHBondContact O-N 3.05Å; T744-I746 PolarHBondContact O-N 3.11Å; I746-L748 VanDerWaalsContact C-N 3.34Å; I746-L748 PolarHBondContact O-N 3.09Å; I746-M749 PolarHBondContact O-N 2.87Å; I746-H750 VanDerWaalsContact O-CB 3.3Å; I746-H750 WeakPolarHBondContact O-CB 3.14Å; I746-H750 PolarHBondContact O-N 3.12Å
747	S	89.1	Confident	85.1	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64.3	-38.1	177.6	-55.2	0	0	0	0	112	V427 A743 T744 V745 L751	V427-S747 PolarHBondContact N-OG 3.07Å; A743-S747 WeakPolarHBondContact O-CB 3.26Å; A743-S747 PolarHBondContact O-N 3.11Å; A743-S747 PolarHBondContact O-OG 2.78Å; T744-S747 PolarHBondContact O-N 3.44Å; V745-S747 VanDerWaalsContact C-N 3.33Å; V745-S747 PolarHBondContact O-N 3.48Å; S747-L751 WeakPolarHBondContact O-CB 3.36Å; S747-L751 PolarHBondContact O-N 3.17Å
748	L	82.9	Confident	83.9	Confident	32 Å²	32	20.4 Å²	20.4	17%	0.168	11%	0.106	C	C	.	.	H	α-helix	trans	-71.9	-41.2	176.1	-65.4	172.9	0	0	0	112.4	I704 T744 V745 I746 H750 L751 E752	I704-L748 HydrophobicContact CB-CD2 4.38Å; I704-L748 HydrophobicContact CG2-CD1 4.21Å; I704-L748 HydrophobicContact CG2-CD2 3.53Å; I704-L748 HydrophobicContact CG2-CG 4.44Å; T744-L748 WeakPolarHBondContact O-CG 3.49Å; T744-L748 PolarHBondContact O-N 2.92Å; V745-L748 PolarHBondContact O-N 2.59Å; I746-L748 VanDerWaalsContact C-N 3.34Å; I746-L748 PolarHBondContact O-N 3.09Å; L748-H750 VanDerWaalsContact C-N 3.29Å; L748-H750 PolarHBondContact O-N 3.22Å; L748-L751 PolarHBondContact O-N 2.84Å; L748-E752 PolarHBondContact O-N 2.98Å
749	M	79.7	Confident	82.4	Confident	11 Å²	11	26.3 Å²	26.3	5%	0.054	13%	0.133	C	C	.	.	H	α-helix	trans	-60.4	-41.2	173.1	-76.8	158	44.6	0	0	111.5	F377 A381 F498 V745 I746 E752 S753 M811	F377-M749 HydrophobicContact CE1-CB 4.01Å; F377-M749 HydrophobicContact CE1-CE 4.25Å; F377-M749 HydrophobicContact CE2-CE 4.3Å; F377-M749 HydrophobicContact CZ-CB 4.1Å; F377-M749 HydrophobicContact CZ-CE 3.47Å; F377-M749 VanDerWaalsContact CZ-CE 3.47Å; A381-M749 HydrophobicContact CB-CE 3.7Å; F498-M749 HydrophobicContact CE1-SD 4.14Å; F498-M749 HydrophobicContact CE2-SD 4.37Å; F498-M749 HydrophobicContact CZ-CE 4.25Å; F498-M749 HydrophobicContact CZ-SD 3.79Å; V745-M749 HydrophobicContact CG1-SD 3.92Å; V745-M749 WeakPolarHBondContact O-CG 3.31Å; V745-M749 PolarHBondContact O-N 3.2Å; I746-M749 PolarHBondContact O-N 2.87Å; M749-E752 PolarHBondContact O-N 3.34Å; M749-S753 PolarHBondContact O-N 2.56Å; M749-M811 HydrophobicContact CE-CE 3.46Å; M749-M811 VanDerWaalsContact CE-CE 3.46Å; M749-M811 HydrophobicContact CE-SD 4.26Å; M749-M811 HydrophobicContact CG-CE 4.24Å; M749-M811 HydrophobicContact CG-SD 4.14Å; M749-M811 HydrophobicContact SD-CE 3.95Å
750	H	88	Confident	80.4	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.7	-45.4	174.3	178.1	-142	0	0	0	111.5	L378 L425 V427 I746 L748 S753 L754 T778	L378-H750 HydrophobicContact CD1-CB 4.36Å; L425-H750 PolarHBondContact O-ND1 2.96Å; V427-H750 HydrophobicContact CG2-CB 4.19Å; I746-H750 VanDerWaalsContact O-CB 3.3Å; I746-H750 WeakPolarHBondContact O-CB 3.14Å; I746-H750 PolarHBondContact O-N 3.12Å; L748-H750 VanDerWaalsContact C-N 3.29Å; L748-H750 PolarHBondContact O-N 3.22Å; H750-S753 PolarHBondContact O-N 3.01Å; H750-S753 PolarHBondContact O-OG 3.11Å; H750-L754 WeakPolarHBondContact NE2-CD1 3.15Å; H750-L754 PolarHBondContact O-N 2.71Å; H750-T778 PolarHBondContact CE1-OG1 3.44Å; H750-T778 VanDerWaalsContact CE1-OG1 3.3Å; H750-T778 VanDerWaalsContact NE2-CB 3.3Å; H750-T778 WeakPolarHBondContact NE2-CB 3.28Å; H750-T778 PolarHBondContact NE2-OG1 2.73Å
751	L	86.5	Confident	78.3	Confident	12 Å²	12	32.1 Å²	32.1	6%	0.063	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-45.1	177.4	-178.6	135.1	0	0	0	112.8	L425 V705 N710 S747 L748 S753 L754 R755 I772	L425-L751 HydrophobicContact CD1-CD1 4.34Å; V705-L751 HydrophobicContact CB-CD1 4.39Å; V705-L751 HydrophobicContact CG1-CD1 3.8Å; N710-L751 WeakPolarHBondContact ND2-CD1 3.38Å; S747-L751 WeakPolarHBondContact O-CB 3.36Å; S747-L751 PolarHBondContact O-N 3.17Å; L748-L751 PolarHBondContact O-N 2.84Å; L751-S753 VanDerWaalsContact C-N 3.32Å; L751-S753 PolarHBondContact O-N 3.24Å; L751-L754 PolarHBondContact O-N 3.44Å; L751-L754 VanDerWaalsContact O-N 3.14Å; L751-R755 PolarHBondContact O-N 3.48Å; L751-I772 HydrophobicContact CD1-CD1 3.84Å; L751-I772 HydrophobicContact CD2-CD1 3.68Å; L751-I772 HydrophobicContact CG-CD1 3.6Å; L751-I772 HydrophobicContact CG-CG1 4.24Å
752	E	81.2	Confident	76.5	Confident	54 Å²	54	32.9 Å²	32.9	25%	0.252	18%	0.176	S	C	.	.	H	α-helix	trans	-66.2	-33.4	177.9	-178.2	61.1	-158.2	0	0	111.9	K592 L748 M749 L754 R755	K592-E752 IonicContact NZ-OE1 2.79Å; L748-E752 PolarHBondContact O-N 2.98Å; M749-E752 PolarHBondContact O-N 3.34Å; E752-L754 PolarHBondContact O-N 3.22Å; E752-R755 WeakPolarHBondContact O-CB 3.27Å; E752-R755 PolarHBondContact O-N 3.37Å; E752-R755 IonicContact OE1-NH1 2.76Å; E752-R755 VanDerWaalsContact OE2-CD 3.29Å; E752-R755 WeakPolarHBondContact OE2-CD 3.46Å; E752-R755 IonicContact OE2-NH1 3.74Å; E752-R755 PolarHBondContact OE2-NH1 3.34Å
753	S	83.2	Confident	74.6	Confident	31 Å²	31	34.4 Å²	34.4	22%	0.217	19%	0.186	C	C	.	.	H	α-helix	trans	-65.2	-25.7	174.6	76.9	0	0	0	0	113.3	Q370 A374 M749 H750 L751	Q370-S753 PolarHBondContact NE2-O 2.87Å; A374-S753 VanDerWaalsContact CB-OG 3.28Å; A374-S753 WeakPolarHBondContact CB-OG 3.4Å; M749-S753 PolarHBondContact O-N 2.56Å; H750-S753 PolarHBondContact O-N 3.01Å; H750-S753 PolarHBondContact O-OG 3.11Å; L751-S753 VanDerWaalsContact C-N 3.32Å; L751-S753 PolarHBondContact O-N 3.24Å
754	L	87.3	Confident	72.9	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	11.7	179.6	-66	-176.9	0	0	0	113.9	A374 L425 H750 L751 E752 I756 I772 K773 Q775 T778	A374-L754 HydrophobicContact CB-CD2 3.84Å; A374-L754 HydrophobicContact CB-CG 4.42Å; L425-L754 HydrophobicContact CD2-CD1 3.76Å; H750-L754 WeakPolarHBondContact NE2-CD1 3.15Å; H750-L754 PolarHBondContact O-N 2.71Å; L751-L754 PolarHBondContact O-N 3.44Å; L751-L754 VanDerWaalsContact O-N 3.14Å; E752-L754 PolarHBondContact O-N 3.22Å; L754-I756 PolarHBondContact O-N 3.17Å; L754-I772 HydrophobicContact CB-CG2 3.95Å; L754-K773 HydrophobicContact CB-CB 4.47Å; L754-K773 PolarHBondContact O-N 2.88Å; L754-K773 VanDerWaalsContact O-N 3.09Å; L754-Q775 HydrophobicContact CD1-CG 4.14Å; L754-T778 HydrophobicContact CD1-CG2 4.31Å; L754-T778 HydrophobicContact CD2-CG2 4.09Å
755	R	83.5	Confident	71.6	Confident	78 Å²	78	39 Å²	39	29%	0.294	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	124.7	178.7	-160.2	175.8	179.5	170	-2.4	111.3	Q370 L751 E752 M757 F769	Q370-R755 PolarHBondContact NE2-O 3.45Å; L751-R755 PolarHBondContact O-N 3.48Å; E752-R755 WeakPolarHBondContact O-CB 3.27Å; E752-R755 PolarHBondContact O-N 3.37Å; E752-R755 IonicContact OE1-NH1 2.76Å; E752-R755 VanDerWaalsContact OE2-CD 3.29Å; E752-R755 WeakPolarHBondContact OE2-CD 3.46Å; E752-R755 IonicContact OE2-NH1 3.74Å; E752-R755 PolarHBondContact OE2-NH1 3.34Å; R755-M757 HydrophobicContact CG-CE 4.19Å; R755-F769 HydrophobicContact CB-CE2 4.41Å; R755-F769 HydrophobicContact CG-CD2 3.53Å; R755-F769 HydrophobicContact CG-CE2 3.24Å; R755-F769 HydrophobicContact CG-CZ 4.28Å
756	I	77.2	Confident	70.5	Confident	45 Å²	45	43 Å²	43	23%	0.231	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	122.1	176.3	-54.6	173.8	0	0	0	109.8	L754 F769 L770 G771 K773	L754-I756 PolarHBondContact O-N 3.17Å; I756-F769 WeakPolarHBondContact O-CD2 3.26Å; I756-L770 HydrophobicContact CG2-CD1 4.35Å; I756-L770 PolarHBondContact O-N 3.44Å; I756-L770 VanDerWaalsContact O-N 3.12Å; I756-G771 WeakPolarHBondContact CA-O 3.38Å; I756-G771 WeakPolarHBondContact CB-O 3.04Å; I756-G771 PolarHBondContact N-O 3.38Å; I756-K773 HydrophobicContact CD1-CB 3.92Å; I756-K773 HydrophobicContact CD1-CG 4.42Å; I756-K773 HydrophobicContact CG1-CB 4.44Å
757	M	68.4	Low	69.3	Low	56 Å²	56	45.7 Å²	45.7	28%	0.276	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	148.3	169.1	-57	-58.7	-167.8	0	0	109.9	R755 E759 P767 F769	R755-M757 HydrophobicContact CG-CE 4.19Å; M757-E759 PolarHBondContact O-N 3Å; M757-P767 HydrophobicContact CB-CB 4.44Å; M757-F769 HydrophobicContact SD-CB 3.96Å; M757-F769 HydrophobicContact SD-CD2 4Å; M757-F769 HydrophobicContact SD-CG 4.49Å
758	S	62.8	Low	67.9	Low	22 Å²	22	48 Å²	48	15%	0.154	27%	0.268	C	S	.	.			trans	-59.1	130.5	178.1	63.1	0	0	0	0	111.7	A768	S758-A768 PolarHBondContact N-O 2.74Å; S758-A768 PolarHBondContact OG-N 2.86Å; S758-A768 VanDerWaalsContact OG-N 3.07Å
759	E	57.8	Low	67.2	Low	130 Å²	130	48 Å²	48	61%	0.607	27%	0.267	S	S	*	.	S	Bend	trans	-79.1	-29.9	175.1	-64.6	-173.5	-171.1	0	0	112	R367 M757	R367-E759 IonicContact CZ-OE1 3.33Å; R367-E759 IonicContact NE-OE1 3.67Å; R367-E759 PolarHBondContact NE-OE1 3.45Å; R367-E759 IonicContact NH2-OE1 2.66Å; R367-E759 PolarHBondContact NH2-OE1 3.44Å; M757-E759 PolarHBondContact O-N 3Å
760	I	51.8	Low	66.6	Low	90 Å²	90	52.4 Å²	52.4	46%	0.462	29%	0.29	S	S	.	.			trans	-112.3	97	-173.8	-55.5	168.8	0	0	0	105.9	K225	K225-I760 WeakPolarHBondContact O-CG2 3.41Å
761	A	47.8	Very low	66.3	Low	39 Å²	39	52.9 Å²	52.9	32%	0.322	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-101	133.1	161.4	0	0	0	0	0	106.4	E765	A761-E765 HydrophobicContact CB-CB 4.15Å; A761-E765 VanDerWaalsContact CB-O 3.3Å; A761-E765 WeakPolarHBondContact CB-O 3.4Å
762	A	54.3	Low	66.3	Low	17 Å²	17	53 Å²	53	14%	0.14	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-51.8	143.5	163.2	0	0	0	0	0	107.4	I97 K98 G764 E765	I97-A762 HydrophobicContact CG2-CB 4.38Å; K98-A762 HydrophobicContact CB-CB 4.02Å; K98-A762 HydrophobicContact CD-CB 4.37Å; A762-G764 PolarHBondContact O-N 3.49Å; A762-G764 VanDerWaalsContact O-N 3.1Å; A762-E765 WeakPolarHBondContact O-CB 3.38Å; A762-E765 PolarHBondContact O-N 3.07Å
763	P	52.4	Low	66.5	Low	34 Å²	34	51.4 Å²	51.4	22%	0.221	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.3	125.5	179.1	-26.8	34.8	0	0	0	110.4	I97 Y99 E101 P112	I97-P763 HydrophobicContact CD1-CG 4.5Å; Y99-P763 WeakPolarHBondContact CD2-O 3.4Å; E101-P763 VanDerWaalsContact OE1-CB 3.24Å; E101-P763 WeakPolarHBondContact OE1-CB 3.47Å; P112-P763 VanDerWaalsContact CB-C 3.42Å; P112-P763 HydrophobicContact CB-CB 3.8Å; P112-P763 WeakPolarHBondContact CB-O 3.42Å; P112-P763 HydrophobicContact CG-CB 3.09Å; P112-P763 WeakPolarHBondContact CG-O 3.39Å
764	G	52.4	Low	66.7	Low	46 Å²	46	50.9 Å²	50.9	47%	0.474	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.9	-15.4	179.2	0	0	0	0	0	115.7	P306 A762	P306-G764 WeakPolarHBondContact CG-O 3.22Å; A762-G764 PolarHBondContact O-N 3.49Å; A762-G764 VanDerWaalsContact O-N 3.1Å
765	E	54.9	Low	66.9	Low	76 Å²	76	50.9 Å²	50.9	36%	0.355	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-84.8	133.2	177.8	-174.2	163.6	-161.2	0	0	111.3	K98 Y99 A761 A762	K98-E765 IonicContact NZ-OE1 3.36Å; K98-E765 PolarHBondContact NZ-OE1 2.96Å; K98-E765 IonicContact NZ-OE2 2.79Å; K98-E765 PolarHBondContact NZ-OE2 3.12Å; Y99-E765 HydrophobicContact CE2-CB 4.5Å; A761-E765 HydrophobicContact CB-CB 4.15Å; A761-E765 VanDerWaalsContact CB-O 3.3Å; A761-E765 WeakPolarHBondContact CB-O 3.4Å; A762-E765 WeakPolarHBondContact O-CB 3.38Å; A762-E765 PolarHBondContact O-N 3.07Å
766	K	53.7	Low	67.4	Low	124 Å²	124	47.4 Å²	47.4	54%	0.539	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-67	144.8	174	-71.9	-177.7	-178.8	172.6	0	109.5	D308 A768	D308-K766 WeakPolarHBondContact OD1-CE 3.48Å; D308-K766 IonicContact OD1-NZ 2.74Å; D308-K766 PolarHBondContact OD1-NZ 3.45Å; D308-K766 IonicContact OD2-NZ 2.74Å; D308-K766 PolarHBondContact OD2-NZ 3.48Å; K766-A768 PolarHBondContact O-N 2.72Å
767	P	59.8	Low	68.1	Low	63 Å²	63	46 Å²	46	41%	0.409	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-58.8	116.5	179.4	24.8	-33.9	0	0	0	109.7	M757	M757-P767 HydrophobicContact CB-CB 4.44Å
768	A	60.2	Low	69.3	Low	47 Å²	47	43.3 Å²	43.3	39%	0.388	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-82.8	140	-179	0	0	0	0	0	109.6	S758 K766 L770	S758-A768 PolarHBondContact N-O 2.74Å; S758-A768 PolarHBondContact OG-N 2.86Å; S758-A768 VanDerWaalsContact OG-N 3.07Å; K766-A768 PolarHBondContact O-N 2.72Å; A768-L770 PolarHBondContact O-N 2.78Å; A768-L770 VanDerWaalsContact O-N 3.15Å
769	F	69.1	Low	70.8	Confident	32 Å²	32	42.3 Å²	42.3	14%	0.14	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	110	170.4	175.3	-114.7	0	0	0	109.6	D709 K711 R755 I756 M757 G771 I772	D709-F769 WeakPolarHBondContact O-CE1 3.09Å; K711-F769 HydrophobicContact CG-CE1 4.48Å; K711-F769 PolarHBondContact NZ-O 2.99Å; R755-F769 HydrophobicContact CB-CE2 4.41Å; R755-F769 HydrophobicContact CG-CD2 3.53Å; R755-F769 HydrophobicContact CG-CE2 3.24Å; R755-F769 HydrophobicContact CG-CZ 4.28Å; I756-F769 WeakPolarHBondContact O-CD2 3.26Å; M757-F769 HydrophobicContact SD-CB 3.96Å; M757-F769 HydrophobicContact SD-CD2 4Å; M757-F769 HydrophobicContact SD-CG 4.49Å; F769-G771 WeakPolarHBondContact CE2-O 3.08Å; F769-I772 HydrophobicContact CE2-CG1 4.18Å; F769-I772 HydrophobicContact CZ-CD1 3.86Å; F769-I772 HydrophobicContact CZ-CG1 3.88Å
770	L	67.4	Low	72.5	Confident	105 Å²	105	37.5 Å²	37.5	55%	0.55	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-44.8	-179.7	-70.7	175.8	0	0	0	110.7	K711 I756 A768	K711-L770 WeakPolarHBondContact CD-O 3.06Å; I756-L770 HydrophobicContact CG2-CD1 4.35Å; I756-L770 PolarHBondContact O-N 3.44Å; I756-L770 VanDerWaalsContact O-N 3.12Å; A768-L770 PolarHBondContact O-N 2.78Å; A768-L770 VanDerWaalsContact O-N 3.15Å
771	G	80.5	Confident	74.5	Confident	9 Å²	9	36.3 Å²	36.3	9%	0.093	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.1	-174.5	-176.7	0	0	0	0	0	111.7	I756 F769	I756-G771 WeakPolarHBondContact CA-O 3.38Å; I756-G771 WeakPolarHBondContact CB-O 3.04Å; I756-G771 PolarHBondContact N-O 3.38Å; F769-G771 WeakPolarHBondContact CE2-O 3.08Å
772	I	86.6	Confident	76.7	Confident	15 Å²	15	34.4 Å²	34.4	8%	0.077	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	144.5	175.3	-74	137	0	0	0	110.2	L425 N710 L712 L751 L754 F769 E774	L425-I772 HydrophobicContact CD1-CG2 4.1Å; N710-I772 HydrophobicContact CB-CD1 3.43Å; N710-I772 VanDerWaalsContact CB-CD1 3.43Å; L712-I772 HydrophobicContact CD2-CB 4.13Å; L712-I772 HydrophobicContact CD2-CG2 4.29Å; L751-I772 HydrophobicContact CD1-CD1 3.84Å; L751-I772 HydrophobicContact CD2-CD1 3.68Å; L751-I772 HydrophobicContact CG-CD1 3.6Å; L751-I772 HydrophobicContact CG-CG1 4.24Å; L754-I772 HydrophobicContact CB-CG2 3.95Å; F769-I772 HydrophobicContact CE2-CG1 4.18Å; F769-I772 HydrophobicContact CZ-CD1 3.86Å; F769-I772 HydrophobicContact CZ-CG1 3.88Å; I772-E774 PolarHBondContact O-N 2.95Å; I772-E774 VanDerWaalsContact O-N 3.12Å
773	K	85.9	Confident	78.5	Confident	21 Å²	21	33.7 Å²	33.7	9%	0.091	19%	0.192	C	C	.	.			trans	-73.8	97.6	173.9	-161.1	179.4	-175.4	-174.3	0	110.6	D362 G363 R365 T371 L754 I756 Q775	D362-K773 WeakPolarHBondContact O-CE 3.45Å; D362-K773 PolarHBondContact O-NZ 2.86Å; G363-K773 PolarHBondContact O-NZ 3Å; R365-K773 WeakPolarHBondContact O-CE 3.37Å; R365-K773 PolarHBondContact O-NZ 3.48Å; T371-K773 PolarHBondContact OG1-NZ 2.61Å; L754-K773 HydrophobicContact CB-CB 4.47Å; L754-K773 PolarHBondContact O-N 2.88Å; L754-K773 VanDerWaalsContact O-N 3.09Å; I756-K773 HydrophobicContact CD1-CB 3.92Å; I756-K773 HydrophobicContact CD1-CG 4.42Å; I756-K773 HydrophobicContact CG1-CB 4.44Å; K773-Q775 PolarHBondContact O-N 3.03Å
774	E	87.8	Confident	80.5	Confident	19 Å²	19	35.4 Å²	35.4	9%	0.089	20%	0.199	C	C	.	.			trans	-75.7	109.5	178.1	-70.1	179.6	-105.4	0	0	112	L425 L712 Q713 K714 I772	L425-E774 HydrophobicContact CD1-CG 4.37Å; L712-E774 VanDerWaalsContact CA-OE1 3.24Å; L712-E774 WeakPolarHBondContact CA-OE1 3.07Å; L712-E774 VanDerWaalsContact CD2-CD 3.45Å; L712-E774 HydrophobicContact CD2-CG 3.34Å; Q713-E774 PolarHBondContact N-OE1 2.76Å; K714-E774 VanDerWaalsContact CB-OE2 3.28Å; K714-E774 WeakPolarHBondContact CB-OE2 3.08Å; K714-E774 HydrophobicContact CD-CB 3.89Å; K714-E774 HydrophobicContact CG-CB 4.48Å; K714-E774 PolarHBondContact N-OE1 2.75Å; K714-E774 PolarHBondContact N-OE2 2.92Å; K714-E774 PolarHBondContact NZ-O 3.27Å; I772-E774 PolarHBondContact O-N 2.95Å; I772-E774 VanDerWaalsContact O-N 3.12Å
775	Q	91.2	Very high	82.3	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.188	C	C	.	.			trans	-149.1	158.4	-177.1	62.5	-175.8	-27.2	0	0	112.2	D359 G363 T371 L754 K773 T778	D359-Q775 WeakPolarHBondContact O-CA 3.33Å; D359-Q775 WeakPolarHBondContact O-CB 3.24Å; G363-Q775 PolarHBondContact O-OE1 3.2Å; T371-Q775 PolarHBondContact OG1-NE2 3.43Å; T371-Q775 PolarHBondContact OG1-OE1 3.15Å; L754-Q775 HydrophobicContact CD1-CG 4.14Å; K773-Q775 PolarHBondContact O-N 3.03Å; Q775-T778 HydrophobicContact CG-CG2 4.42Å
776	R	93	Very high	83.9	Confident	5 Å²	5	31.8 Å²	31.8	2%	0.019	17%	0.171	C	C	.	.	S	Bend	trans	-93.9	-22	172.2	-72.1	169.8	-166.2	-79	-10.5	113.7	D359 F360 A418 L419 A421 P424 T778 L780	D359-R776 HydrophobicContact CB-CB 4.48Å; D359-R776 HydrophobicContact CB-CG 3.92Å; D359-R776 PolarHBondContact O-N 2.99Å; D359-R776 IonicContact OD2-CZ 3.31Å; D359-R776 VanDerWaalsContact OD2-CZ 3.29Å; D359-R776 IonicContact OD2-NE 3.5Å; D359-R776 PolarHBondContact OD2-NE 2.92Å; D359-R776 IonicContact OD2-NH2 2.68Å; D359-R776 PolarHBondContact OD2-NH2 3.47Å; F360-R776 HydrophobicContact CE1-CB 4.27Å; F360-R776 HydrophobicContact CZ-CB 4.15Å; A418-R776 PolarHBondContact O-NH1 3.4Å; L419-R776 PolarHBondContact O-NH1 3.38Å; L419-R776 VanDerWaalsContact O-NH1 3.15Å; A421-R776 PolarHBondContact O-NH1 3.32Å; A421-R776 PolarHBondContact O-NH2 2.96Å; P424-R776 HydrophobicContact CB-CB 4.35Å; P424-R776 HydrophobicContact CB-CG 3.44Å; P424-R776 VanDerWaalsContact CB-CG 3.44Å; P424-R776 HydrophobicContact CG-CG 3.82Å; R776-T778 PolarHBondContact O-N 3.07Å; R776-L780 WeakPolarHBondContact O-CB 3.32Å; R776-L780 PolarHBondContact O-N 3.02Å; R776-L780 VanDerWaalsContact O-N 3.1Å
777	V	93	Very high	85.3	Confident	15 Å²	15	27.6 Å²	27.6	9%	0.091	16%	0.163	C	C	.	.	H	α-helix	trans	-61.9	-41.1	-165.9	179	0	0	0	0	112.9	F360 T371 L780 I781	F360-V777 HydrophobicContact CD1-CG2 4Å; T371-V777 HydrophobicContact CG2-CB 4.46Å; T371-V777 HydrophobicContact CG2-CG1 4.2Å; V777-L780 PolarHBondContact O-N 3.26Å; V777-I781 HydrophobicContact CG1-CD1 3.52Å; V777-I781 HydrophobicContact CG1-CG1 4.16Å; V777-I781 WeakPolarHBondContact O-CB 3.34Å; V777-I781 VanDerWaalsContact O-CG1 3.27Å; V777-I781 WeakPolarHBondContact O-CG1 3.49Å; V777-I781 PolarHBondContact O-N 3.31Å
778	T	93.1	Very high	86.4	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.8	-52.8	-178.2	39.9	0	0	0	0	112.9	T371 A374 H750 L754 Q775 R776 L780 I781 A782	T371-T778 HydrophobicContact CG2-CG2 3.8Å; T371-T778 WeakPolarHBondContact O-CG2 3.3Å; A374-T778 HydrophobicContact CB-CG2 3.99Å; H750-T778 PolarHBondContact CE1-OG1 3.44Å; H750-T778 VanDerWaalsContact CE1-OG1 3.3Å; H750-T778 VanDerWaalsContact NE2-CB 3.3Å; H750-T778 WeakPolarHBondContact NE2-CB 3.28Å; H750-T778 PolarHBondContact NE2-OG1 2.73Å; L754-T778 HydrophobicContact CD1-CG2 4.31Å; L754-T778 HydrophobicContact CD2-CG2 4.09Å; Q775-T778 HydrophobicContact CG-CG2 4.42Å; R776-T778 PolarHBondContact O-N 3.07Å; T778-L780 VanDerWaalsContact C-N 3.29Å; T778-L780 PolarHBondContact O-N 3.45Å; T778-I781 PolarHBondContact O-N 3.35Å; T778-A782 WeakPolarHBondContact O-CB 3.47Å; T778-A782 PolarHBondContact O-N 3.36Å
779	A	93.2	Very high	87.2	Confident	2 Å²	2	26.5 Å²	26.5	2%	0.017	15%	0.147	C	C	.	.	H	α-helix	trans	-62.8	-39.7	178.1	0	0	0	0	0	110.7	A418 H783	A418-A779 HydrophobicContact CB-CB 4.09Å; A779-H783 PolarHBondContact O-N 2.94Å; A779-H783 VanDerWaalsContact O-N 3.09Å; A779-H783 PolarHBondContact O-ND1 2.94Å
780	L	94.7	Very high	87.2	Confident	28 Å²	28	26.8 Å²	26.8	15%	0.147	15%	0.151	C	C	.	.	H	α-helix	trans	-62.9	-51.7	177.5	-176.5	63.4	0	0	0	111.9	F360 I415 A418 L419 R776 V777 T778 A782 H783 I784	F360-L780 HydrophobicContact CE1-CD2 4.07Å; I415-L780 HydrophobicContact CG1-CD1 4.48Å; I415-L780 HydrophobicContact CG2-CD1 4.07Å; A418-L780 HydrophobicContact CB-CB 4.15Å; A418-L780 HydrophobicContact CB-CD1 4.39Å; L419-L780 HydrophobicContact CD2-CD1 4.15Å; L419-L780 HydrophobicContact CD2-CD2 4.17Å; L419-L780 HydrophobicContact CG-CD1 4.18Å; R776-L780 WeakPolarHBondContact O-CB 3.32Å; R776-L780 PolarHBondContact O-N 3.02Å; R776-L780 VanDerWaalsContact O-N 3.1Å; V777-L780 PolarHBondContact O-N 3.26Å; T778-L780 VanDerWaalsContact C-N 3.29Å; T778-L780 PolarHBondContact O-N 3.45Å; L780-A782 VanDerWaalsContact C-N 3.34Å; L780-A782 PolarHBondContact O-N 2.72Å; L780-H783 PolarHBondContact O-N 3.44Å; L780-I784 HydrophobicContact CD1-CD1 4.05Å; L780-I784 HydrophobicContact CD1-CG1 4.43Å; L780-I784 HydrophobicContact CG-CD1 3.84Å; L780-I784 WeakPolarHBondContact O-CB 3.18Å; L780-I784 VanDerWaalsContact O-CG1 3.24Å; L780-I784 WeakPolarHBondContact O-CG1 3.34Å; L780-I784 PolarHBondContact O-N 3.2Å
781	I	93.9	Very high	87.4	Confident	65 Å²	65	27.1 Å²	27.1	33%	0.333	15%	0.149	S	C	.	.	H	α-helix	trans	-60.2	-45.2	178.8	-69.3	172.4	0	0	0	110.4	A375 V777 T778 H783 I784 L785	A375-I781 HydrophobicContact CB-CB 4.09Å; A375-I781 HydrophobicContact CB-CG2 3.9Å; V777-I781 HydrophobicContact CG1-CD1 3.52Å; V777-I781 HydrophobicContact CG1-CG1 4.16Å; V777-I781 WeakPolarHBondContact O-CB 3.34Å; V777-I781 VanDerWaalsContact O-CG1 3.27Å; V777-I781 WeakPolarHBondContact O-CG1 3.49Å; V777-I781 PolarHBondContact O-N 3.31Å; T778-I781 PolarHBondContact O-N 3.35Å; I781-H783 PolarHBondContact O-N 3.09Å; I781-I784 PolarHBondContact O-N 2.96Å; I781-L785 HydrophobicContact CG2-CD1 4Å; I781-L785 HydrophobicContact CG2-CG 4.34Å; I781-L785 VanDerWaalsContact O-CG 3.32Å; I781-L785 WeakPolarHBondContact O-CG 3.46Å; I781-L785 PolarHBondContact O-N 3.16Å
782	A	92.9	Very high	86.9	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.5	-45.6	-179.6	0	0	0	0	0	112	L378 T778 L780 L785 I786	L378-A782 HydrophobicContact CB-CB 3.87Å; L378-A782 HydrophobicContact CD2-CB 3.67Å; L378-A782 HydrophobicContact CG-CB 3.7Å; T778-A782 WeakPolarHBondContact O-CB 3.47Å; T778-A782 PolarHBondContact O-N 3.36Å; L780-A782 VanDerWaalsContact C-N 3.34Å; L780-A782 PolarHBondContact O-N 2.72Å; A782-L785 WeakPolarHBondContact O-CB 3.31Å; A782-L785 PolarHBondContact O-N 3.34Å; A782-I786 VanDerWaalsContact O-CG1 3.29Å; A782-I786 WeakPolarHBondContact O-CG1 3.23Å; A782-I786 PolarHBondContact O-N 3.07Å
783	H	93.9	Very high	86.1	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.009	16%	0.159	C	C	.	.	H	α-helix	trans	-74.9	-28.5	179.1	-64.8	106.9	0	0	0	113.8	N382 G410 G414 I415 L428 A779 L780 I781 L785 I786 G787	N382-H783 PolarHBondContact ND2-NE2 3.4Å; G410-H783 PolarHBondContact O-CD2 3.3Å; G414-H783 VanDerWaalsContact CA-CD2 3.46Å; G414-H783 WeakPolarHBondContact CA-CD2 3.25Å; G414-H783 VanDerWaalsContact CA-CG 3.45Å; I415-H783 HydrophobicContact CG1-CB 4.05Å; L428-H783 PolarHBondContact O-NE2 2.96Å; A779-H783 PolarHBondContact O-N 2.94Å; A779-H783 VanDerWaalsContact O-N 3.09Å; A779-H783 PolarHBondContact O-ND1 2.94Å; L780-H783 PolarHBondContact O-N 3.44Å; I781-H783 PolarHBondContact O-N 3.09Å; H783-L785 VanDerWaalsContact C-N 3.33Å; H783-I786 PolarHBondContact O-N 3.09Å; H783-G787 PolarHBondContact O-N 2.62Å
784	I	92.5	Very high	85.5	Confident	69 Å²	69	33 Å²	33	35%	0.354	19%	0.185	S	C	.	.	H	α-helix	trans	-61	-46.1	167.5	-70.7	168	0	0	0	109.6	I415 L780 I781 I786 G787 L788	I415-I784 HydrophobicContact CD1-CG1 4.01Å; I415-I784 HydrophobicContact CG1-CG1 4.09Å; L780-I784 HydrophobicContact CD1-CD1 4.05Å; L780-I784 HydrophobicContact CD1-CG1 4.43Å; L780-I784 HydrophobicContact CG-CD1 3.84Å; L780-I784 WeakPolarHBondContact O-CB 3.18Å; L780-I784 VanDerWaalsContact O-CG1 3.24Å; L780-I784 WeakPolarHBondContact O-CG1 3.34Å; L780-I784 PolarHBondContact O-N 3.2Å; I781-I784 PolarHBondContact O-N 2.96Å; I784-I786 VanDerWaalsContact C-N 3.32Å; I784-I786 PolarHBondContact O-N 2.75Å; I784-G787 PolarHBondContact O-N 2.89Å; I784-L788 HydrophobicContact CG2-CD1 3.86Å; I784-L788 HydrophobicContact CG2-CG 4.44Å; I784-L788 WeakPolarHBondContact O-CB 3.41Å; I784-L788 VanDerWaalsContact O-CG 3.29Å; I784-L788 WeakPolarHBondContact O-CG 3.22Å; I784-L788 PolarHBondContact O-N 3.25Å
785	L	90.3	Very high	84.8	Confident	47 Å²	47	35.9 Å²	35.9	25%	0.246	20%	0.204	C	C	.	.	H	α-helix	trans	-63.6	-36.4	176.3	-67.5	173.3	0	0	0	112.3	F379 I781 A782 H783 L788 A789 L792	F379-L785 HydrophobicContact CB-CB 4.39Å; F379-L785 HydrophobicContact CB-CD1 4.21Å; F379-L785 HydrophobicContact CD2-CB 3.4Å; F379-L785 HydrophobicContact CE2-CB 3.8Å; F379-L785 WeakPolarHBondContact CE2-O 3.26Å; F379-L785 HydrophobicContact CG-CB 3.96Å; F379-L785 HydrophobicContact CG-CD1 4.27Å; I781-L785 HydrophobicContact CG2-CD1 4Å; I781-L785 HydrophobicContact CG2-CG 4.34Å; I781-L785 VanDerWaalsContact O-CG 3.32Å; I781-L785 WeakPolarHBondContact O-CG 3.46Å; I781-L785 PolarHBondContact O-N 3.16Å; A782-L785 WeakPolarHBondContact O-CB 3.31Å; A782-L785 PolarHBondContact O-N 3.34Å; H783-L785 VanDerWaalsContact C-N 3.33Å; L785-L788 CarbonylContact O-C 3.44Å; L785-L788 VanDerWaalsContact O-C 3.31Å; L785-L788 PolarHBondContact O-N 2.79Å; L785-A789 WeakPolarHBondContact O-CA 3.24Å; L785-A789 PolarHBondContact O-N 3Å; L785-L792 HydrophobicContact CB-CD1 4.48Å; L785-L792 HydrophobicContact CD2-CD1 4.02Å
786	I	88.8	Confident	83.9	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.4	-45.9	173.4	-66.9	164.6	0	0	0	110.8	F379 N382 I383 I386 A782 H783 I784 L788 A789	F379-I786 HydrophobicContact CD2-CG1 3.88Å; F379-I786 HydrophobicContact CE2-CG1 4.33Å; N382-I786 HydrophobicContact CB-CD1 3.73Å; N382-I786 VanDerWaalsContact ND2-CD1 3.33Å; N382-I786 WeakPolarHBondContact ND2-CD1 3.44Å; I383-I786 HydrophobicContact CD1-CG2 4.19Å; I386-I786 HydrophobicContact CD1-CD1 4.03Å; I386-I786 HydrophobicContact CD1-CG2 3.72Å; A782-I786 VanDerWaalsContact O-CG1 3.29Å; A782-I786 WeakPolarHBondContact O-CG1 3.23Å; A782-I786 PolarHBondContact O-N 3.07Å; H783-I786 PolarHBondContact O-N 3.09Å; I784-I786 VanDerWaalsContact C-N 3.32Å; I784-I786 PolarHBondContact O-N 2.75Å; I786-L788 PolarHBondContact O-N 3.11Å; I786-A789 WeakPolarHBondContact O-CB 3.23Å; I786-A789 PolarHBondContact O-N 2.95Å
787	G	83.5	Confident	83.1	Confident	35 Å²	35	39.9 Å²	39.9	36%	0.361	22%	0.221	S	C	.	.	H	α-helix	trans	-62.2	-32.6	175.3	0	0	0	0	0	112.7	H783 I784	H783-G787 PolarHBondContact O-N 2.62Å; I784-G787 PolarHBondContact O-N 2.89Å
788	L	82.8	Confident	82.4	Confident	81 Å²	81	43.8 Å²	43.8	42%	0.424	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	3.6	174	-63.1	175.8	0	0	0	113.7	I784 L785 I786 V790 F791 L792	I784-L788 HydrophobicContact CG2-CD1 3.86Å; I784-L788 HydrophobicContact CG2-CG 4.44Å; I784-L788 WeakPolarHBondContact O-CB 3.41Å; I784-L788 VanDerWaalsContact O-CG 3.29Å; I784-L788 WeakPolarHBondContact O-CG 3.22Å; I784-L788 PolarHBondContact O-N 3.25Å; L785-L788 CarbonylContact O-C 3.44Å; L785-L788 VanDerWaalsContact O-C 3.31Å; L785-L788 PolarHBondContact O-N 2.79Å; I786-L788 PolarHBondContact O-N 3.11Å; L788-V790 PolarHBondContact O-N 3.37Å; L788-F791 HydrophobicContact CB-CD2 4.49Å; L788-F791 HydrophobicContact CD2-CD2 3.94Å; L788-F791 HydrophobicContact CD2-CE2 4.15Å; L788-F791 WeakPolarHBondContact O-CB 3.36Å; L788-F791 PolarHBondContact O-N 2.81Å; L788-L792 PolarHBondContact O-N 2.95Å
789	A	77.9	Confident	81.9	Confident	6 Å²	6	44.1 Å²	44.1	5%	0.05	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-29.4	-172.3	0	0	0	0	0	112.3	F379 I383 V407 L785 I786 F791 L792 T793	F379-A789 HydrophobicContact CE2-CB 4.31Å; I383-A789 HydrophobicContact CD1-CB 3.77Å; I383-A789 HydrophobicContact CG1-CB 4.43Å; V407-A789 HydrophobicContact CG1-CB 4.48Å; L785-A789 WeakPolarHBondContact O-CA 3.24Å; L785-A789 PolarHBondContact O-N 3Å; I786-A789 WeakPolarHBondContact O-CB 3.23Å; I786-A789 PolarHBondContact O-N 2.95Å; A789-F791 VanDerWaalsContact C-N 3.3Å; A789-F791 PolarHBondContact O-N 2.94Å; A789-L792 CarbonylContact O-C 3.54Å; A789-L792 WeakPolarHBondContact O-CA 3.5Å; A789-L792 PolarHBondContact O-N 3.42Å; A789-T793 PolarHBondContact O-N 3.05Å
790	V	68.8	Low	81.5	Confident	38 Å²	38	44 Å²	44	23%	0.23	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-39.3	175.9	179.8	0	0	0	0	111.9	L640 L659 L788 L792 T793	L640-V790 HydrophobicContact CD1-CG1 3.08Å; L640-V790 HydrophobicContact CG-CG1 4.48Å; L659-V790 HydrophobicContact CD2-CG1 4.5Å; L659-V790 HydrophobicContact CD2-CG2 4.15Å; L788-V790 PolarHBondContact O-N 3.37Å; V790-L792 VanDerWaalsContact C-N 3.33Å; V790-T793 PolarHBondContact O-OG1 2.81Å
791	F	70.4	Confident	81	Confident	113 Å²	113	44.4 Å²	44.4	50%	0.496	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-24.1	173.8	-60.2	-76.7	0	0	0	112.4	F657 L788 A789 T793	F657-F791 HydrophobicContact CB-CE1 4.07Å; F657-F791 HydrophobicContact CB-CZ 4.08Å; F657-F791 HydrophobicContact CD1-CE1 4.14Å; F657-F791 HydrophobicContact CD2-CD1 4.3Å; F657-F791 AromaticContact CD2-CE1 3.39Å; F657-F791 HydrophobicContact CD2-CE1 3.39Å; F657-F791 HydrophobicContact CD2-CZ 4.15Å; F657-F791 HydrophobicContact CE1-CE1 4.49Å; F657-F791 HydrophobicContact CE2-CD1 4.26Å; F657-F791 AromaticContact CE2-CE1 3.74Å; F657-F791 HydrophobicContact CE2-CE1 3.74Å; F657-F791 HydrophobicContact CG-CD1 4.49Å; F657-F791 AromaticContact CG-CE1 3.61Å; F657-F791 HydrophobicContact CG-CE1 3.61Å; F657-F791 HydrophobicContact CG-CZ 4.15Å; F657-F791 HydrophobicContact CZ-CD1 4.47Å; F657-F791 HydrophobicContact CZ-CE1 4.3Å; L788-F791 HydrophobicContact CB-CD2 4.49Å; L788-F791 HydrophobicContact CD2-CD2 3.94Å; L788-F791 HydrophobicContact CD2-CE2 4.15Å; L788-F791 WeakPolarHBondContact O-CB 3.36Å; L788-F791 PolarHBondContact O-N 2.81Å; A789-F791 VanDerWaalsContact C-N 3.3Å; A789-F791 PolarHBondContact O-N 2.94Å; F791-T793 VanDerWaalsContact C-N 3.31Å
792	L	70.5	Confident	80.7	Confident	51 Å²	51	41.3 Å²	41.3	27%	0.267	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	5	178.4	-62.1	170.4	0	0	0	113.3	F379 L785 L788 A789 V790 P794 V795 M796	F379-L792 HydrophobicContact CE2-CD1 4.44Å; F379-L792 HydrophobicContact CZ-CD1 4.1Å; L785-L792 HydrophobicContact CB-CD1 4.48Å; L785-L792 HydrophobicContact CD2-CD1 4.02Å; L788-L792 PolarHBondContact O-N 2.95Å; A789-L792 CarbonylContact O-C 3.54Å; A789-L792 WeakPolarHBondContact O-CA 3.5Å; A789-L792 PolarHBondContact O-N 3.42Å; V790-L792 VanDerWaalsContact C-N 3.33Å; L792-P794 VanDerWaalsContact C-CD 3.4Å; L792-P794 VanDerWaalsContact C-N 3.34Å; L792-V795 WeakPolarHBondContact O-CA 3.39Å; L792-V795 WeakPolarHBondContact O-CB 3.21Å; L792-V795 PolarHBondContact O-N 3.2Å; L792-M796 HydrophobicContact CB-CG 4.5Å; L792-M796 WeakPolarHBondContact O-CG 3.15Å; L792-M796 PolarHBondContact O-N 3.06Å
793	T	71	Confident	80.5	Confident	20 Å²	20	41.3 Å²	41.3	12%	0.123	23%	0.23	C	C	.	.	H	α-helix	trans	-43	-47.2	176.8	-59.1	0	0	0	0	114.6	V636 A789 V790 F791 V795 M796 K797	V636-T793 HydrophobicContact CB-CG2 4.15Å; V636-T793 HydrophobicContact CG1-CG2 4.1Å; A789-T793 PolarHBondContact O-N 3.05Å; V790-T793 PolarHBondContact O-OG1 2.81Å; F791-T793 VanDerWaalsContact C-N 3.31Å; T793-V795 VanDerWaalsContact C-N 3.3Å; T793-V795 PolarHBondContact O-N 3.45Å; T793-M796 PolarHBondContact O-N 3.43Å; T793-K797 HydrophobicContact CG2-CD 4.36Å; T793-K797 WeakPolarHBondContact O-CG 3.38Å; T793-K797 PolarHBondContact O-N 3.21Å; T793-K797 VanDerWaalsContact O-N 3.07Å
794	P	71.7	Confident	80.2	Confident	97 Å²	97	41.5 Å²	41.5	63%	0.63	23%	0.231	S	C	*	.	H	α-helix	trans	-63.8	-33.6	178.8	23.8	-33.9	0	0	0	113.3	L792	L792-P794 VanDerWaalsContact C-CD 3.4Å; L792-P794 VanDerWaalsContact C-N 3.34Å
795	V	73.2	Confident	79.9	Confident	80 Å²	80	38.6 Å²	38.6	49%	0.485	22%	0.216	S	C	.	.	H	α-helix	trans	-73	-38.9	176.5	-178	0	0	0	0	110.5	L792 T793 K797 L798	L792-V795 WeakPolarHBondContact O-CA 3.39Å; L792-V795 WeakPolarHBondContact O-CB 3.21Å; L792-V795 PolarHBondContact O-N 3.2Å; T793-V795 VanDerWaalsContact C-N 3.3Å; T793-V795 PolarHBondContact O-N 3.45Å; V795-K797 PolarHBondContact O-N 3.49Å; V795-L798 WeakPolarHBondContact O-CB 3.31Å; V795-L798 PolarHBondContact O-N 3.45Å
796	M	72.7	Confident	79.9	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-65.6	-37.6	-179.6	-68	-56.8	-58.3	0	0	113	F379 F380 I383 L634 V636 L792 T793 L798 V799	F379-M796 HydrophobicContact CE1-SD 3.46Å; F379-M796 WeakPolarHBondContact CE1-SD 3.32Å; F379-M796 HydrophobicContact CZ-CE 4.43Å; F379-M796 HydrophobicContact CZ-SD 3.39Å; F379-M796 WeakPolarHBondContact CZ-SD 3.23Å; F380-M796 HydrophobicContact CD1-CE 4.35Å; F380-M796 HydrophobicContact CD1-SD 4.36Å; F380-M796 HydrophobicContact CE1-CE 4.46Å; F380-M796 HydrophobicContact CE1-SD 3.98Å; I383-M796 HydrophobicContact CB-CE 4.39Å; I383-M796 HydrophobicContact CG1-CE 4.02Å; I383-M796 HydrophobicContact CG2-CE 3.43Å; I383-M796 VanDerWaalsContact CG2-CE 3.43Å; I383-M796 HydrophobicContact CG2-SD 4.46Å; L634-M796 HydrophobicContact CD2-CE 3.18Å; V636-M796 HydrophobicContact CG2-CB 3.72Å; V636-M796 HydrophobicContact CG2-CG 4.4Å; L792-M796 HydrophobicContact CB-CG 4.5Å; L792-M796 WeakPolarHBondContact O-CG 3.15Å; L792-M796 PolarHBondContact O-N 3.06Å; T793-M796 PolarHBondContact O-N 3.43Å; M796-L798 PolarHBondContact O-N 2.8Å; M796-V799 PolarHBondContact O-N 2.75Å
797	K	75.5	Confident	79.8	Confident	86 Å²	86	36.5 Å²	36.5	37%	0.374	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-19.2	178.3	-74.2	-178	178.4	-176.3	0	113.6	C633 D638 T793 V795 V799	C633-K797 WeakPolarHBondContact CB-O 2.95Å; D638-K797 WeakPolarHBondContact OD1-CE 3.43Å; D638-K797 IonicContact OD1-NZ 2.74Å; D638-K797 PolarHBondContact OD1-NZ 3.46Å; D638-K797 IonicContact OD2-NZ 2.72Å; D638-K797 PolarHBondContact OD2-NZ 3.12Å; T793-K797 HydrophobicContact CG2-CD 4.36Å; T793-K797 WeakPolarHBondContact O-CG 3.38Å; T793-K797 PolarHBondContact O-N 3.21Å; T793-K797 VanDerWaalsContact O-N 3.07Å; V795-K797 PolarHBondContact O-N 3.49Å; K797-V799 VanDerWaalsContact C-N 3.31Å
798	L	78.9	Confident	79.8	Confident	98 Å²	98	36.2 Å²	36.2	51%	0.513	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-20.8	178.3	-172	63.2	0	0	0	112.4	A621 V795 M796 P800	A621-L798 HydrophobicContact CB-CG 4.16Å; V795-L798 WeakPolarHBondContact O-CB 3.31Å; V795-L798 PolarHBondContact O-N 3.45Å; M796-L798 PolarHBondContact O-N 2.8Å; L798-P800 VanDerWaalsContact O-CD 3.27Å; L798-P800 WeakPolarHBondContact O-CD 3.36Å
799	V	83.2	Confident	80.1	Confident	7 Å²	7	33.5 Å²	33.5	4%	0.042	18%	0.18	C	C	.	.	S	Bend	trans	-86.8	115.8	-172.9	179.8	0	0	0	0	110.6	F380 I617 L634 M796 K797 L804	F380-V799 HydrophobicContact CE1-CG2 3.82Å; F380-V799 HydrophobicContact CZ-CG2 4.27Å; I617-V799 HydrophobicContact CG2-CB 4.5Å; I617-V799 HydrophobicContact CG2-CG1 3.75Å; I617-V799 HydrophobicContact CG2-CG2 4.03Å; L634-V799 PolarHBondContact N-O 3.05Å; M796-V799 PolarHBondContact O-N 2.75Å; K797-V799 VanDerWaalsContact C-N 3.31Å; V799-L804 HydrophobicContact CG1-CD1 4.22Å; V799-L804 HydrophobicContact CG1-CD2 4.03Å; V799-L804 HydrophobicContact CG1-CG 4.02Å
800	P	85.1	Confident	80.5	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-73.1	134.4	176.2	28.3	-31.6	0	0	0	111	M580 N624 A631 L798 P802 A803	M580-P800 HydrophobicContact CE-CB 4.23Å; M580-P800 HydrophobicContact CE-CG 3.72Å; N624-P800 HydrophobicContact CB-CG 4.4Å; A631-P800 HydrophobicContact CB-CB 4.43Å; L798-P800 VanDerWaalsContact O-CD 3.27Å; L798-P800 WeakPolarHBondContact O-CD 3.36Å; P800-P802 VanDerWaalsContact C-CD 3.48Å; P800-A803 HydrophobicContact CG-CB 3.9Å; P800-A803 WeakPolarHBondContact O-CB 3.41Å; P800-A803 PolarHBondContact O-N 3.08Å; P800-A803 VanDerWaalsContact O-N 3.14Å
801	V	83.6	Confident	81	Confident	36 Å²	36	32.7 Å²	32.7	22%	0.218	17%	0.172	C	C	.	.	H	α-helix	trans	-57.8	-40.8	176.6	179.6	0	0	0	0	112.3	P632 L634 A803 L804 L805	P632-V801 WeakPolarHBondContact O-CB 3.29Å; P632-V801 WeakPolarHBondContact O-CG2 2.96Å; P632-V801 PolarHBondContact O-N 3.12Å; L634-V801 HydrophobicContact CD1-CG2 3.96Å; V801-A803 PolarHBondContact O-N 3.49Å; V801-A803 VanDerWaalsContact O-N 3.17Å; V801-L804 WeakPolarHBondContact O-CB 3.48Å; V801-L804 PolarHBondContact O-N 3.45Å; V801-L805 HydrophobicContact CG1-CD1 4.46Å; V801-L805 HydrophobicContact CG1-CG 4.4Å; V801-L805 PolarHBondContact O-N 3.21Å; V801-L805 VanDerWaalsContact O-N 3.08Å
802	P	88.5	Confident	81.6	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-55.6	-33.5	175.5	-28.1	35.7	0	0	0	114	I509 S577 M580 I581 P632 P800 L805 G806	I509-P802 HydrophobicContact CD1-CG 4.31Å; S577-P802 WeakPolarHBondContact OG-CG 3.16Å; M580-P802 HydrophobicContact CB-CB 4.01Å; I581-P802 HydrophobicContact CD1-CB 4.4Å; I581-P802 HydrophobicContact CG1-CB 3.97Å; I581-P802 WeakPolarHBondContact CG1-O 3.48Å; P632-P802 HydrophobicContact CG-CG 4.21Å; P632-P802 WeakPolarHBondContact O-CD 3.32Å; P800-P802 VanDerWaalsContact C-CD 3.48Å; P802-L805 PolarHBondContact O-N 3.09Å; P802-G806 PolarHBondContact O-N 2.78Å
803	A	88.8	Confident	82.4	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.8	-39.6	176.4	0	0	0	0	0	111.9	T584 M620 P800 V801 L805 G806 I807	T584-A803 HydrophobicContact CG2-CB 4.24Å; T584-A803 WeakPolarHBondContact CG2-O 3.35Å; T584-A803 WeakPolarHBondContact OG1-CA 3.47Å; M620-A803 HydrophobicContact CB-CB 3.8Å; M620-A803 HydrophobicContact CG-CB 4.22Å; P800-A803 HydrophobicContact CG-CB 3.9Å; P800-A803 WeakPolarHBondContact O-CB 3.41Å; P800-A803 PolarHBondContact O-N 3.08Å; P800-A803 VanDerWaalsContact O-N 3.14Å; V801-A803 PolarHBondContact O-N 3.49Å; V801-A803 VanDerWaalsContact O-N 3.17Å; A803-L805 VanDerWaalsContact C-N 3.34Å; A803-L805 PolarHBondContact O-N 3.45Å; A803-G806 PolarHBondContact O-N 3.36Å; A803-I807 WeakPolarHBondContact O-CD1 3.38Å; A803-I807 WeakPolarHBondContact O-CG1 3.39Å; A803-I807 PolarHBondContact O-N 2.9Å; A803-I807 VanDerWaalsContact O-N 3.12Å
804	L	85.8	Confident	82.9	Confident	5 Å²	5	27.9 Å²	27.9	3%	0.026	15%	0.152	C	C	.	.	H	α-helix	trans	-63.3	-40.7	175.7	-61.7	178.2	0	0	0	111.6	F380 I617 L634 V799 V801 G806 I807 F808	F380-L804 HydrophobicContact CB-CD2 4.31Å; I617-L804 HydrophobicContact CD1-CD2 4.03Å; L634-L804 HydrophobicContact CD1-CD1 4.01Å; V799-L804 HydrophobicContact CG1-CD1 4.22Å; V799-L804 HydrophobicContact CG1-CD2 4.03Å; V799-L804 HydrophobicContact CG1-CG 4.02Å; V801-L804 WeakPolarHBondContact O-CB 3.48Å; V801-L804 PolarHBondContact O-N 3.45Å; L804-G806 PolarHBondContact O-N 2.82Å; L804-I807 WeakPolarHBondContact O-CB 3.41Å; L804-I807 PolarHBondContact O-N 3.22Å; L804-F808 WeakPolarHBondContact O-CD1 3.38Å; L804-F808 VanDerWaalsContact O-CG 3.24Å; L804-F808 WeakPolarHBondContact O-CG 3.21Å; L804-F808 PolarHBondContact O-N 3.15Å
805	L	87.3	Confident	83.1	Confident	9 Å²	9	24.5 Å²	24.5	5%	0.047	13%	0.13	C	C	.	.	H	α-helix	trans	-61.6	-41.7	174.8	-64.4	178	0	0	0	112	E505 I509 I581 V801 P802 A803 I807 F808 I809	E505-L805 HydrophobicContact CB-CD1 3.97Å; E505-L805 HydrophobicContact CB-CD2 3.65Å; E505-L805 HydrophobicContact CB-CG 4.49Å; E505-L805 HydrophobicContact CG-CD2 4.28Å; I509-L805 HydrophobicContact CD1-CD1 3.92Å; I581-L805 HydrophobicContact CD1-CB 4.2Å; I581-L805 HydrophobicContact CD1-CD1 4.17Å; I581-L805 HydrophobicContact CG1-CB 4.03Å; V801-L805 HydrophobicContact CG1-CD1 4.46Å; V801-L805 HydrophobicContact CG1-CG 4.4Å; V801-L805 PolarHBondContact O-N 3.21Å; V801-L805 VanDerWaalsContact O-N 3.08Å; P802-L805 PolarHBondContact O-N 3.09Å; A803-L805 VanDerWaalsContact C-N 3.34Å; A803-L805 PolarHBondContact O-N 3.45Å; L805-I807 VanDerWaalsContact C-N 3.3Å; L805-I807 PolarHBondContact O-N 3.46Å; L805-F808 HydrophobicContact CD2-CD2 4.36Å; L805-F808 WeakPolarHBondContact O-CB 3.17Å; L805-F808 PolarHBondContact O-N 3.17Å; L805-I809 WeakPolarHBondContact O-CG1 3.36Å; L805-I809 PolarHBondContact O-N 2.88Å
806	G	90.1	Very high	83.6	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.3	-38	174.2	0	0	0	0	0	113.4	I581 A585 P802 A803 L804 I809 Y810	I581-G806 VanDerWaalsContact O-CA 3.3Å; I581-G806 WeakPolarHBondContact O-CA 3.23Å; A585-G806 WeakPolarHBondContact CB-O 3.3Å; P802-G806 PolarHBondContact O-N 2.78Å; A803-G806 PolarHBondContact O-N 3.36Å; L804-G806 PolarHBondContact O-N 2.82Å; G806-I809 PolarHBondContact O-N 3.06Å; G806-Y810 PolarHBondContact O-N 3.27Å
807	I	87.5	Confident	84	Confident	3 Å²	3	27.5 Å²	27.5	2%	0.015	14%	0.143	C	C	.	.	H	α-helix	trans	-68.6	-39.1	175.5	-69.3	157.1	0	0	0	111.2	F377 T584 V613 I617 A803 L804 L805 Y810 M811	F377-I807 HydrophobicContact CE2-CG2 4.18Å; T584-I807 HydrophobicContact CG2-CD1 3.93Å; T584-I807 HydrophobicContact CG2-CG1 3.65Å; V613-I807 HydrophobicContact CG1-CB 4.4Å; V613-I807 HydrophobicContact CG1-CD1 3.75Å; V613-I807 HydrophobicContact CG1-CG1 3.96Å; V613-I807 HydrophobicContact CG1-CG2 3.53Å; V613-I807 HydrophobicContact CG2-CG2 4.48Å; I617-I807 HydrophobicContact CB-CD1 4.5Å; I617-I807 HydrophobicContact CD1-CD1 3.63Å; I617-I807 HydrophobicContact CG1-CD1 3.12Å; A803-I807 WeakPolarHBondContact O-CD1 3.38Å; A803-I807 WeakPolarHBondContact O-CG1 3.39Å; A803-I807 PolarHBondContact O-N 2.9Å; A803-I807 VanDerWaalsContact O-N 3.12Å; L804-I807 WeakPolarHBondContact O-CB 3.41Å; L804-I807 PolarHBondContact O-N 3.22Å; L805-I807 VanDerWaalsContact C-N 3.3Å; L805-I807 PolarHBondContact O-N 3.46Å; I807-Y810 PolarHBondContact O-N 3Å; I807-M811 HydrophobicContact CG2-CE 3.67Å; I807-M811 HydrophobicContact CG2-SD 4.26Å; I807-M811 WeakPolarHBondContact O-CG 3.47Å; I807-M811 PolarHBondContact O-N 3.41Å
808	F	83	Confident	83.8	Confident	29 Å²	29	25.7 Å²	25.7	13%	0.127	15%	0.148	C	C	.	.	H	α-helix	trans	-62.6	-43.8	176.4	-66.9	-11.4	0	0	0	111.4	A381 F498 A502 L804 L805 M811 G812	A381-F808 HydrophobicContact CB-CE1 4.42Å; F498-F808 HydrophobicContact CD1-CB 4.28Å; F498-F808 VanDerWaalsContact CD1-O 3.26Å; F498-F808 WeakPolarHBondContact CD1-O 3.33Å; F498-F808 VanDerWaalsContact CE1-C 3.48Å; F498-F808 HydrophobicContact CE1-CB 3.54Å; F498-F808 HydrophobicContact CE1-CD1 4.09Å; F498-F808 HydrophobicContact CE1-CG 4.02Å; F498-F808 WeakPolarHBondContact CE1-O 3.38Å; F498-F808 HydrophobicContact CE2-CB 3.76Å; F498-F808 AromaticContact CE2-CD1 3.72Å; F498-F808 HydrophobicContact CE2-CD1 3.72Å; F498-F808 AromaticContact CE2-CD2 3.87Å; F498-F808 HydrophobicContact CE2-CD2 3.87Å; F498-F808 HydrophobicContact CE2-CE1 4.16Å; F498-F808 HydrophobicContact CE2-CE2 4.34Å; F498-F808 AromaticContact CE2-CG 3.51Å; F498-F808 HydrophobicContact CE2-CG 3.51Å; F498-F808 HydrophobicContact CE2-CZ 4.46Å; F498-F808 VanDerWaalsContact CZ-CA 3.46Å; F498-F808 HydrophobicContact CZ-CB 3.27Å; F498-F808 AromaticContact CZ-CD1 3.14Å; F498-F808 HydrophobicContact CZ-CD1 3.14Å; F498-F808 HydrophobicContact CZ-CD2 4.05Å; F498-F808 AromaticContact CZ-CE1 3.87Å; F498-F808 HydrophobicContact CZ-CE1 3.87Å; F498-F808 AromaticContact CZ-CG 3.21Å; F498-F808 HydrophobicContact CZ-CG 3.21Å; A502-F808 HydrophobicContact CB-CB 4Å; L804-F808 WeakPolarHBondContact O-CD1 3.38Å; L804-F808 VanDerWaalsContact O-CG 3.24Å; L804-F808 WeakPolarHBondContact O-CG 3.21Å; L804-F808 PolarHBondContact O-N 3.15Å; L805-F808 HydrophobicContact CD2-CD2 4.36Å; L805-F808 WeakPolarHBondContact O-CB 3.17Å; L805-F808 PolarHBondContact O-N 3.17Å; F808-M811 HydrophobicContact CD1-CE 3.95Å; F808-M811 PolarHBondContact O-N 2.87Å; F808-G812 PolarHBondContact O-N 3.46Å
809	I	89	Confident	83.9	Confident	23 Å²	23	22.6 Å²	22.6	12%	0.118	13%	0.131	C	C	.	.	H	α-helix	trans	-59.2	-50	172.1	-67	175.2	0	0	0	111.1	L499 A502 L503 I581 L805 G806 M811 G812 I813	L499-I809 HydrophobicContact CD1-CB 4.24Å; L499-I809 HydrophobicContact CD1-CG1 4.19Å; L499-I809 HydrophobicContact CD1-CG2 3.88Å; A502-I809 HydrophobicContact CB-CG1 3.81Å; L503-I809 HydrophobicContact CD2-CD1 4.03Å; I581-I809 HydrophobicContact CG2-CD1 3.58Å; L805-I809 WeakPolarHBondContact O-CG1 3.36Å; L805-I809 PolarHBondContact O-N 2.88Å; G806-I809 PolarHBondContact O-N 3.06Å; I809-M811 VanDerWaalsContact C-N 3.33Å; I809-M811 PolarHBondContact O-N 3.49Å; I809-G812 PolarHBondContact O-N 3.28Å; I809-I813 HydrophobicContact CG2-CD1 3.7Å; I809-I813 HydrophobicContact CG2-CG1 4.48Å; I809-I813 VanDerWaalsContact O-CG1 3.31Å; I809-I813 WeakPolarHBondContact O-CG1 3.41Å; I809-I813 PolarHBondContact O-N 2.86Å
810	Y	86.8	Confident	83.9	Confident	11 Å²	11	24.3 Å²	24.3	4%	0.043	14%	0.138	C	C	.	.	H	α-helix	trans	-54.3	-47.1	178.8	155.8	-101.8	0	0	0	112.1	A588 F589 K592 N612 V613 G806 I807 I813 V814	A588-Y810 HydrophobicContact CB-CD1 3.85Å; A588-Y810 HydrophobicContact CB-CD2 3.94Å; A588-Y810 HydrophobicContact CB-CE1 4.13Å; A588-Y810 HydrophobicContact CB-CE2 4.21Å; A588-Y810 HydrophobicContact CB-CG 3.78Å; F589-Y810 AromaticContact CD1-CD2 3.77Å; F589-Y810 HydrophobicContact CD1-CD2 3.77Å; F589-Y810 AromaticContact CD1-CE2 3.71Å; F589-Y810 HydrophobicContact CD1-CE2 3.71Å; F589-Y810 AromaticContact CD2-CD2 3.6Å; F589-Y810 HydrophobicContact CD2-CD2 3.6Å; F589-Y810 HydrophobicContact CD2-CE2 4.34Å; F589-Y810 AromaticContact CE1-CD2 3.74Å; F589-Y810 HydrophobicContact CE1-CD2 3.74Å; F589-Y810 AromaticContact CE1-CE2 3.83Å; F589-Y810 HydrophobicContact CE1-CE2 3.83Å; F589-Y810 AromaticContact CE2-CD2 3.56Å; F589-Y810 HydrophobicContact CE2-CD2 3.56Å; F589-Y810 HydrophobicContact CE2-CE2 4.44Å; F589-Y810 HydrophobicContact CE2-CG 4.38Å; F589-Y810 AromaticContact CG-CD2 3.69Å; F589-Y810 HydrophobicContact CG-CD2 3.69Å; F589-Y810 AromaticContact CG-CE2 3.96Å; F589-Y810 HydrophobicContact CG-CE2 3.96Å; F589-Y810 AromaticContact CZ-CD2 3.61Å; F589-Y810 HydrophobicContact CZ-CD2 3.61Å; F589-Y810 HydrophobicContact CZ-CE2 4.19Å; K592-Y810 HydrophobicContact CD-CE2 4.5Å; K592-Y810 WeakPolarHBondContact CD-OH 3.46Å; N612-Y810 PolarHBondContact ND2-OH 3.35Å; N612-Y810 VanDerWaalsContact ND2-OH 3.13Å; V613-Y810 HydrophobicContact CG2-CD1 4.49Å; V613-Y810 HydrophobicContact CG2-CE1 4.03Å; G806-Y810 PolarHBondContact O-N 3.27Å; I807-Y810 PolarHBondContact O-N 3Å; Y810-I813 PolarHBondContact O-N 2.92Å; Y810-V814 HydrophobicContact CD2-CG2 4.05Å; Y810-V814 HydrophobicContact CE2-CG2 3.62Å; Y810-V814 WeakPolarHBondContact O-CG2 3.44Å; Y810-V814 PolarHBondContact O-N 2.93Å
811	M	79	Confident	84.1	Confident	16 Å²	16	24.6 Å²	24.6	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-75.3	-33.9	-178.6	-67.7	-173.2	-58.4	0	0	113.6	F377 F498 M749 I807 F808 I809 I813 S815	F377-M811 HydrophobicContact CD2-SD 4.46Å; F377-M811 HydrophobicContact CE1-SD 4.02Å; F377-M811 HydrophobicContact CE2-CE 3.5Å; F377-M811 VanDerWaalsContact CE2-CE 3.5Å; F377-M811 HydrophobicContact CE2-SD 3.32Å; F377-M811 WeakPolarHBondContact CE2-SD 3.19Å; F377-M811 HydrophobicContact CZ-CE 3.45Å; F377-M811 VanDerWaalsContact CZ-CE 3.45Å; F377-M811 HydrophobicContact CZ-SD 3.04Å; F377-M811 WeakPolarHBondContact CZ-SD 3.42Å; F498-M811 HydrophobicContact CE1-CB 4.23Å; F498-M811 HydrophobicContact CE1-CE 4.14Å; F498-M811 HydrophobicContact CZ-CE 4.06Å; M749-M811 HydrophobicContact CE-CE 3.46Å; M749-M811 VanDerWaalsContact CE-CE 3.46Å; M749-M811 HydrophobicContact CE-SD 4.26Å; M749-M811 HydrophobicContact CG-CE 4.24Å; M749-M811 HydrophobicContact CG-SD 4.14Å; M749-M811 HydrophobicContact SD-CE 3.95Å; I807-M811 HydrophobicContact CG2-CE 3.67Å; I807-M811 HydrophobicContact CG2-SD 4.26Å; I807-M811 WeakPolarHBondContact O-CG 3.47Å; I807-M811 PolarHBondContact O-N 3.41Å; F808-M811 HydrophobicContact CD1-CE 3.95Å; F808-M811 PolarHBondContact O-N 2.87Å; I809-M811 VanDerWaalsContact C-N 3.33Å; I809-M811 PolarHBondContact O-N 3.49Å; M811-I813 VanDerWaalsContact C-N 3.32Å; M811-S815 VanDerWaalsContact O-CB 3.24Å; M811-S815 WeakPolarHBondContact O-CB 3.5Å; M811-S815 PolarHBondContact O-N 3.02Å; M811-S815 PolarHBondContact O-OG 3.37Å
812	G	82.1	Confident	84.2	Confident	2 Å²	2	24.9 Å²	24.9	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-57.5	-47.5	171.8	0	0	0	0	0	110.8	F808 I809 S815 L816	F808-G812 PolarHBondContact O-N 3.46Å; I809-G812 PolarHBondContact O-N 3.28Å; G812-S815 PolarHBondContact O-N 2.92Å; G812-L816 VanDerWaalsContact O-CB 3.3Å; G812-L816 WeakPolarHBondContact O-CB 3.32Å; G812-L816 PolarHBondContact O-N 2.79Å
813	I	87.3	Confident	84.2	Confident	57 Å²	57	27.1 Å²	27.1	29%	0.292	15%	0.15	S	C	.	.	H	α-helix	trans	-64.8	-49.2	178.9	-65.5	167.7	0	0	0	111.6	L499 F589 I809 Y810 M811 S815 L816 I817	L499-I813 HydrophobicContact CD1-CG1 4.21Å; F589-I813 HydrophobicContact CZ-CB 4.17Å; F589-I813 HydrophobicContact CZ-CG2 3.9Å; I809-I813 HydrophobicContact CG2-CD1 3.7Å; I809-I813 HydrophobicContact CG2-CG1 4.48Å; I809-I813 VanDerWaalsContact O-CG1 3.31Å; I809-I813 WeakPolarHBondContact O-CG1 3.41Å; I809-I813 PolarHBondContact O-N 2.86Å; Y810-I813 PolarHBondContact O-N 2.92Å; M811-I813 VanDerWaalsContact C-N 3.32Å; I813-S815 VanDerWaalsContact C-N 3.3Å; I813-S815 PolarHBondContact O-N 2.91Å; I813-L816 PolarHBondContact O-N 3.12Å; I813-I817 HydrophobicContact CG2-CD1 3.69Å; I813-I817 HydrophobicContact CG2-CG1 4.44Å; I813-I817 WeakPolarHBondContact O-CG1 3.03Å; I813-I817 PolarHBondContact O-N 2.81Å
814	V	81.9	Confident	84.2	Confident	24 Å²	24	27.3 Å²	27.3	15%	0.145	15%	0.15	C	C	.	.	H	α-helix	trans	-61.1	-40	180	168.4	0	0	0	0	111.6	F589 K592 Y810 G818	F589-V814 HydrophobicContact CD1-CG2 4.45Å; F589-V814 HydrophobicContact CE1-CG2 3.53Å; F589-V814 HydrophobicContact CZ-CG2 3.93Å; K592-V814 VanDerWaalsContact NZ-CG1 3.34Å; Y810-V814 HydrophobicContact CD2-CG2 4.05Å; Y810-V814 HydrophobicContact CE2-CG2 3.62Å; Y810-V814 WeakPolarHBondContact O-CG2 3.44Å; Y810-V814 PolarHBondContact O-N 2.93Å; V814-G818 PolarHBondContact O-N 2.7Å
815	S	76.1	Confident	84.4	Confident	26 Å²	26	28.3 Å²	28.3	18%	0.182	16%	0.157	C	C	.	.	H	α-helix	trans	-69	-37.2	179.2	-56.8	0	0	0	0	111.9	M811 G812 I813 G818	M811-S815 VanDerWaalsContact O-CB 3.24Å; M811-S815 WeakPolarHBondContact O-CB 3.5Å; M811-S815 PolarHBondContact O-N 3.02Å; M811-S815 PolarHBondContact O-OG 3.37Å; G812-S815 PolarHBondContact O-N 2.92Å; I813-S815 VanDerWaalsContact C-N 3.3Å; I813-S815 PolarHBondContact O-N 2.91Å; S815-G818 PolarHBondContact O-N 2.9Å
816	L	83.5	Confident	84.5	Confident	32 Å²	32	33.2 Å²	33.2	17%	0.168	18%	0.183	C	C	.	.	H	α-helix	trans	-68.2	-44.5	178.7	-167.6	66.5	0	0	0	111.5	G812 I813 G818 Q819 M822	G812-L816 VanDerWaalsContact O-CB 3.3Å; G812-L816 WeakPolarHBondContact O-CB 3.32Å; G812-L816 PolarHBondContact O-N 2.79Å; I813-L816 PolarHBondContact O-N 3.12Å; L816-G818 PolarHBondContact O-N 3.35Å; L816-Q819 PolarHBondContact O-N 2.85Å; L816-M822 HydrophobicContact CD1-CE 4.24Å; L816-M822 HydrophobicContact CD1-CG 3.51Å; L816-M822 HydrophobicContact CD1-SD 3.59Å; L816-M822 VanDerWaalsContact CD1-SD 3.59Å; L816-M822 HydrophobicContact CD2-CE 3.9Å; L816-M822 HydrophobicContact CD2-SD 4.33Å; L816-M822 HydrophobicContact CG-CE 3.87Å; L816-M822 HydrophobicContact CG-CG 3.67Å; L816-M822 HydrophobicContact CG-SD 3.87Å; L816-M822 VanDerWaalsContact O-CB 3.31Å; L816-M822 WeakPolarHBondContact O-CB 3.02Å; L816-M822 VanDerWaalsContact O-CG 3.23Å; L816-M822 WeakPolarHBondContact O-CG 3.47Å
817	I	82.1	Confident	84.4	Confident	114 Å²	114	33.5 Å²	33.5	59%	0.585	18%	0.184	S	C	*	.	H	α-helix	trans	-62.2	-29.5	177.9	-67	167.8	0	0	0	111.7	I813 Q819	I813-I817 HydrophobicContact CG2-CD1 3.69Å; I813-I817 HydrophobicContact CG2-CG1 4.44Å; I813-I817 WeakPolarHBondContact O-CG1 3.03Å; I813-I817 PolarHBondContact O-N 2.81Å; I817-Q819 VanDerWaalsContact C-N 3.32Å; I817-Q819 PolarHBondContact O-N 3.44Å
818	G	71.3	Confident	84.5	Confident	47 Å²	47	36.6 Å²	36.6	49%	0.485	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-6.3	-179.1	0	0	0	0	0	116	V814 S815 L816	V814-G818 PolarHBondContact O-N 2.7Å; S815-G818 PolarHBondContact O-N 2.9Å; L816-G818 PolarHBondContact O-N 3.35Å
819	Q	80.1	Confident	84.7	Confident	33 Å²	33	43.2 Å²	43.2	15%	0.154	23%	0.229	C	C	.	.			trans	-93.9	133.4	-177.6	-60.3	-59.5	-33.3	0	0	112	L816 I817 F821 M822 E823	L816-Q819 PolarHBondContact O-N 2.85Å; I817-Q819 VanDerWaalsContact C-N 3.32Å; I817-Q819 PolarHBondContact O-N 3.44Å; Q819-F821 PolarHBondContact O-N 3.22Å; Q819-M822 HydrophobicContact CB-CG 4.49Å; Q819-M822 WeakPolarHBondContact O-CB 3.47Å; Q819-M822 PolarHBondContact O-N 3.27Å; Q819-E823 PolarHBondContact O-N 3.35Å
820	Q	84	Confident	84.5	Confident	43 Å²	43	45.4 Å²	45.4	20%	0.201	24%	0.239	C	C	.	.	H	α-helix	trans	-62.6	-26.8	176.3	-66.2	-169	-10.2	0	0	113.5	M822 E823 R824	Q820-M822 VanDerWaalsContact C-N 3.28Å; Q820-M822 PolarHBondContact O-N 2.97Å; Q820-E823 PolarHBondContact O-N 3.11Å; Q820-R824 WeakPolarHBondContact O-CG 3.21Å; Q820-R824 PolarHBondContact O-N 3.38Å
821	F	87.6	Confident	84.5	Confident	6 Å²	6	48.8 Å²	48.8	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-56.4	-45.6	171.6	171.3	-116.6	0	0	0	111.2	E488 S492 Q819 R824 V825 Q856 I857 F860	E488-F821 HydrophobicContact CB-CB 4.09Å; S492-F821 WeakPolarHBondContact OG-CD1 3.42Å; Q819-F821 PolarHBondContact O-N 3.22Å; F821-R824 PolarHBondContact O-N 3.28Å; F821-V825 HydrophobicContact CD2-CG2 4.19Å; F821-V825 HydrophobicContact CE1-CG2 4.23Å; F821-V825 HydrophobicContact CE2-CG2 3.8Å; F821-V825 HydrophobicContact CZ-CG2 3.84Å; F821-V825 VanDerWaalsContact O-CG2 3.31Å; F821-V825 WeakPolarHBondContact O-CG2 3.35Å; F821-V825 PolarHBondContact O-N 3.24Å; F821-Q856 HydrophobicContact CD2-CB 4.22Å; F821-Q856 HydrophobicContact CD2-CG 3.72Å; F821-Q856 HydrophobicContact CE2-CB 3.88Å; F821-Q856 HydrophobicContact CE2-CG 3.66Å; F821-I857 HydrophobicContact CE2-CG1 3.94Å; F821-I857 HydrophobicContact CZ-CG1 3.93Å; F821-F860 HydrophobicContact CE1-CD2 4.23Å; F821-F860 HydrophobicContact CE1-CG 4.36Å; F821-F860 HydrophobicContact CZ-CB 4.32Å; F821-F860 HydrophobicContact CZ-CG 4.34Å
822	M	87.4	Confident	84.4	Confident	43 Å²	43	51.4 Å²	51.4	21%	0.212	29%	0.287	C	S	.	.	H	α-helix	trans	-69.1	-37.4	179.1	-69.8	-61.8	-53.6	0	0	112.2	L816 Q819 Q820 R824 V825 L826	L816-M822 HydrophobicContact CD1-CE 4.24Å; L816-M822 HydrophobicContact CD1-CG 3.51Å; L816-M822 HydrophobicContact CD1-SD 3.59Å; L816-M822 VanDerWaalsContact CD1-SD 3.59Å; L816-M822 HydrophobicContact CD2-CE 3.9Å; L816-M822 HydrophobicContact CD2-SD 4.33Å; L816-M822 HydrophobicContact CG-CE 3.87Å; L816-M822 HydrophobicContact CG-CG 3.67Å; L816-M822 HydrophobicContact CG-SD 3.87Å; L816-M822 VanDerWaalsContact O-CB 3.31Å; L816-M822 WeakPolarHBondContact O-CB 3.02Å; L816-M822 VanDerWaalsContact O-CG 3.23Å; L816-M822 WeakPolarHBondContact O-CG 3.47Å; Q819-M822 HydrophobicContact CB-CG 4.49Å; Q819-M822 WeakPolarHBondContact O-CB 3.47Å; Q819-M822 PolarHBondContact O-N 3.27Å; Q820-M822 VanDerWaalsContact C-N 3.28Å; Q820-M822 PolarHBondContact O-N 2.97Å; M822-R824 VanDerWaalsContact C-N 3.33Å; M822-R824 PolarHBondContact O-N 3.42Å; M822-V825 PolarHBondContact O-N 3.17Å; M822-L826 WeakPolarHBondContact O-CB 3.45Å; M822-L826 VanDerWaalsContact O-CG 3.28Å; M822-L826 WeakPolarHBondContact O-CG 3.35Å; M822-L826 PolarHBondContact O-N 3.04Å
823	E	86.9	Confident	84.3	Confident	46 Å²	46	60.2 Å²	60.2	22%	0.215	33%	0.325	C	S	.	.	H	α-helix	trans	-59.2	-43.9	171.2	-62.7	174.1	168.9	0	0	111.4	Q819 Q820 L826 I827 Y838	Q819-E823 PolarHBondContact O-N 3.35Å; Q820-E823 PolarHBondContact O-N 3.11Å; E823-L826 PolarHBondContact O-N 3.45Å; E823-I827 WeakPolarHBondContact O-CD1 3.46Å; E823-I827 VanDerWaalsContact O-CG1 3.24Å; E823-I827 WeakPolarHBondContact O-CG1 3.4Å; E823-I827 PolarHBondContact O-N 3.21Å; E823-Y838 HydrophobicContact CB-CE2 4.48Å
824	R	89.5	Confident	83.7	Confident	4 Å²	4	63.7 Å²	63.7	2%	0.015	34%	0.34	C	S	.	.	H	α-helix	trans	-64.7	-38.5	175.9	-72.3	-168.9	-59.7	-89.2	2	112.7	E488 Q820 F821 M822 I827 I828 W840 T853	E488-R824 IonicContact OE2-CZ 3.77Å; E488-R824 IonicContact OE2-NH1 2.62Å; E488-R824 PolarHBondContact OE2-NH1 2.9Å; E488-R824 IonicContact OE2-NH2 3.09Å; E488-R824 PolarHBondContact OE2-NH2 3.3Å; Q820-R824 WeakPolarHBondContact O-CG 3.21Å; Q820-R824 PolarHBondContact O-N 3.38Å; F821-R824 PolarHBondContact O-N 3.28Å; M822-R824 VanDerWaalsContact C-N 3.33Å; M822-R824 PolarHBondContact O-N 3.42Å; R824-I827 PolarHBondContact O-N 3.45Å; R824-I828 PolarHBondContact O-N 2.86Å; R824-W840 HydrophobicContact CG-CH2 3.65Å; R824-W840 HydrophobicContact CG-CZ2 4.18Å; R824-W840 HydrophobicContact CG-CZ3 4.14Å; R824-T853 HydrophobicContact CB-CG2 3.92Å
825	V	90.7	Very high	83.5	Confident	27 Å²	27	64 Å²	64	16%	0.164	34%	0.34	C	S	.	.	H	α-helix	trans	-63.6	-45.3	174	172.9	0	0	0	0	110.5	F821 M822 I827 I828 F829 T853 I857	F821-V825 HydrophobicContact CD2-CG2 4.19Å; F821-V825 HydrophobicContact CE1-CG2 4.23Å; F821-V825 HydrophobicContact CE2-CG2 3.8Å; F821-V825 HydrophobicContact CZ-CG2 3.84Å; F821-V825 VanDerWaalsContact O-CG2 3.31Å; F821-V825 WeakPolarHBondContact O-CG2 3.35Å; F821-V825 PolarHBondContact O-N 3.24Å; M822-V825 PolarHBondContact O-N 3.17Å; V825-I827 VanDerWaalsContact C-N 3.29Å; V825-I827 PolarHBondContact O-N 2.72Å; V825-I828 WeakPolarHBondContact O-CB 3.43Å; V825-I828 PolarHBondContact O-N 3.1Å; V825-F829 HydrophobicContact CG1-CE2 4.45Å; V825-F829 WeakPolarHBondContact O-CD2 3.43Å; V825-T853 HydrophobicContact CG2-CG2 4.09Å; V825-I857 HydrophobicContact CG2-CD1 4.13Å; V825-I857 HydrophobicContact CG2-CG1 4.15Å
826	L	89.2	Confident	83.4	Confident	112 Å²	112	65 Å²	65	59%	0.586	35%	0.345	S	S	*	.	H	α-helix	trans	-62.5	-36.5	177.2	-71.1	169.8	0	0	0	112.1	M822 E823 I828 F829 M830	M822-L826 WeakPolarHBondContact O-CB 3.45Å; M822-L826 VanDerWaalsContact O-CG 3.28Å; M822-L826 WeakPolarHBondContact O-CG 3.35Å; M822-L826 PolarHBondContact O-N 3.04Å; E823-L826 PolarHBondContact O-N 3.45Å; L826-I828 PolarHBondContact O-N 3.44Å; L826-F829 PolarHBondContact O-N 3.31Å; L826-M830 PolarHBondContact O-N 3.48Å
827	I	87.7	Confident	82.4	Confident	5 Å²	5	66.7 Å²	66.7	3%	0.026	35%	0.354	C	S	.	.	H	α-helix	trans	-63.4	-27.4	177.6	-74.2	161.5	0	0	0	112.6	E823 R824 V825 F829 M830 Y838 W840	E823-I827 WeakPolarHBondContact O-CD1 3.46Å; E823-I827 VanDerWaalsContact O-CG1 3.24Å; E823-I827 WeakPolarHBondContact O-CG1 3.4Å; E823-I827 PolarHBondContact O-N 3.21Å; R824-I827 PolarHBondContact O-N 3.45Å; V825-I827 VanDerWaalsContact C-N 3.29Å; V825-I827 PolarHBondContact O-N 2.72Å; I827-F829 PolarHBondContact O-N 2.92Å; I827-M830 PolarHBondContact O-N 3.26Å; I827-M830 VanDerWaalsContact O-N 3.15Å; I827-Y838 HydrophobicContact CD1-CD2 4.19Å; I827-Y838 HydrophobicContact CD1-CE2 4.17Å; I827-W840 HydrophobicContact CD1-CH2 3.52Å; I827-W840 HydrophobicContact CD1-CZ2 4.24Å; I827-W840 HydrophobicContact CD1-CZ3 4.41Å
828	I	88.5	Confident	81.9	Confident	69 Å²	69	63.7 Å²	63.7	35%	0.354	34%	0.336	S	S	.	.	H	α-helix	trans	-60.1	-35.5	173.9	-64.4	169.5	0	0	0	111	R824 V825 L826 T853 I857	R824-I828 PolarHBondContact O-N 2.86Å; V825-I828 WeakPolarHBondContact O-CB 3.43Å; V825-I828 PolarHBondContact O-N 3.1Å; L826-I828 PolarHBondContact O-N 3.44Å; I828-T853 HydrophobicContact CD1-CG2 3.81Å; I828-I857 HydrophobicContact CD1-CD1 4.01Å
829	F	88.9	Confident	81.5	Confident	167 Å²	167	64.6 Å²	64.6	73%	0.732	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-0.6	180	-58.3	-75.5	0	0	0	113.2	V825 L826 I827	V825-F829 HydrophobicContact CG1-CE2 4.45Å; V825-F829 WeakPolarHBondContact O-CD2 3.43Å; L826-F829 PolarHBondContact O-N 3.31Å; I827-F829 PolarHBondContact O-N 2.92Å
830	M	85.1	Confident	81.1	Confident	70 Å²	70	64 Å²	64	35%	0.345	33%	0.33	S	S	.	.	S	Bend	trans	-101.8	123.5	-176	-163.9	176.5	-148.2	0	0	111.2	L826 I827 H834 Q835	L826-M830 PolarHBondContact O-N 3.48Å; I827-M830 PolarHBondContact O-N 3.26Å; I827-M830 VanDerWaalsContact O-N 3.15Å; M830-H834 HydrophobicContact CE-CB 3.81Å; M830-H834 WeakPolarHBondContact CE-O 3.45Å; M830-H834 HydrophobicContact CG-CB 4.34Å; M830-Q835 HydrophobicContact CB-CG 4.36Å; M830-Q835 HydrophobicContact CG-CG 4.18Å; M830-Q835 PolarHBondContact O-NE2 3.27Å; M830-Q835 VanDerWaalsContact O-NE2 3.08Å; M830-Q835 HydrophobicContact SD-CG 4.19Å
831	P	86.1	Confident	80.7	Confident	81 Å²	81	63.3 Å²	63.3	53%	0.526	33%	0.327	S	S	.	.			trans	-65.2	145.5	176.1	29.6	-36.1	0	0	0	110.7	K833 H834	P831-K833 PolarHBondContact O-N 3.24Å; P831-H834 PolarHBondContact O-N 2.9Å
832	A	77.1	Confident	79.8	Confident	72 Å²	72	68 Å²	68	60%	0.595	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-52.2	-30.6	-172.5	0	0	0	0	0	114.8	H834 Q835	A832-H834 VanDerWaalsContact C-N 3.31Å; A832-H834 PolarHBondContact O-N 2.84Å; A832-Q835 PolarHBondContact O-N 3.23Å
833	K	78.9	Confident	78.8	Confident	186 Å²	186	72.1 Å²	72.1	81%	0.809	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-67.8	-26.5	-179.5	-170.4	177.4	179.4	-175.6	0	114.1	P831	P831-K833 PolarHBondContact O-N 3.24Å
834	H	76.1	Confident	78.3	Confident	131 Å²	131	70.1 Å²	70.1	61%	0.606	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-103.9	1.5	-177.9	-63.7	-56.8	0	0	0	112.7	M830 P831 A832	M830-H834 HydrophobicContact CE-CB 3.81Å; M830-H834 WeakPolarHBondContact CE-O 3.45Å; M830-H834 HydrophobicContact CG-CB 4.34Å; P831-H834 PolarHBondContact O-N 2.9Å; A832-H834 VanDerWaalsContact C-N 3.31Å; A832-H834 PolarHBondContact O-N 2.84Å
835	Q	77	Confident	78	Confident	31 Å²	31	73.3 Å²	73.3	15%	0.145	38%	0.377	C	S	.	.			trans	-66.2	137.5	-176.9	-71.3	176.9	-1.5	0	0	111.1	M830 A832 L841	M830-Q835 HydrophobicContact CB-CG 4.36Å; M830-Q835 HydrophobicContact CG-CG 4.18Å; M830-Q835 PolarHBondContact O-NE2 3.27Å; M830-Q835 VanDerWaalsContact O-NE2 3.08Å; M830-Q835 HydrophobicContact SD-CG 4.19Å; A832-Q835 PolarHBondContact O-N 3.23Å; Q835-L841 HydrophobicContact CB-CD2 4.12Å
836	P	72.8	Confident	77.7	Confident	46 Å²	46	74.9 Å²	74.9	30%	0.299	38%	0.384	S	S	.	.			trans	-71.4	152.2	176.5	30.3	-36.3	0	0	0	111.8	Y838 L841	P836-Y838 VanDerWaalsContact C-N 3.33Å; P836-Y838 HydrophobicContact CB-CD2 4.45Å; P836-Y838 HydrophobicContact CB-CE2 4.08Å; P836-Y838 HydrophobicContact CG-CD2 3.8Å; P836-Y838 HydrophobicContact CG-CE2 3.29Å; P836-Y838 PolarHBondContact O-N 3.48Å; P836-L841 WeakPolarHBondContact O-CD2 3.29Å
837	D	63.7	Low	77.5	Confident	68 Å²	68	79.8 Å²	79.8	36%	0.364	40%	0.395	S	S	.	.			trans	-81	70.1	-175.9	-76.5	-23.4	0	0	0	113.5	V29	V29-D837 WeakPolarHBondContact CG2-OD1 3.47Å
838	Y	72.2	Confident	77.5	Confident	51 Å²	51	82.8 Å²	82.8	20%	0.2	41%	0.408	C	S	.	.			trans	-79.3	142.2	174.2	-64.3	-50.2	0	0	0	113	E823 I827 P836 W840 L841 R842	E823-Y838 HydrophobicContact CB-CE2 4.48Å; I827-Y838 HydrophobicContact CD1-CD2 4.19Å; I827-Y838 HydrophobicContact CD1-CE2 4.17Å; P836-Y838 VanDerWaalsContact C-N 3.33Å; P836-Y838 HydrophobicContact CB-CD2 4.45Å; P836-Y838 HydrophobicContact CB-CE2 4.08Å; P836-Y838 HydrophobicContact CG-CD2 3.8Å; P836-Y838 HydrophobicContact CG-CE2 3.29Å; P836-Y838 PolarHBondContact O-N 3.48Å; Y838-W840 VanDerWaalsContact C-N 3.3Å; Y838-W840 AromaticContact CD2-CE2 3.9Å; Y838-W840 AromaticContact CD2-CH2 3.99Å; Y838-W840 HydrophobicContact CD2-CH2 3.99Å; Y838-W840 AromaticContact CD2-CZ2 3.35Å; Y838-W840 HydrophobicContact CD2-CZ2 3.35Å; Y838-W840 HydrophobicContact CE2-CZ2 4.07Å; Y838-W840 AromaticContact CG-CE2 3.9Å; Y838-W840 AromaticContact CG-CZ2 3.85Å; Y838-W840 HydrophobicContact CG-CZ2 3.85Å; Y838-W840 AromaticContact CG-NE1 3.86Å; Y838-W840 PolarHBondContact O-N 3.33Å; Y838-L841 WeakPolarHBondContact O-CB 3.34Å; Y838-L841 PolarHBondContact O-N 2.7Å; Y838-L841 VanDerWaalsContact O-N 3.08Å; Y838-R842 PolarHBondContact O-N 3.28Å
839	P	61.9	Low	77.4	Confident	65 Å²	65	79.5 Å²	79.5	42%	0.422	39%	0.391	S	S	.	.	H	α-helix	trans	-58.5	-38.4	179.9	-25.5	33.7	0	0	0	114	L841 R842 M843	P839-L841 VanDerWaalsContact C-N 3.3Å; P839-L841 PolarHBondContact O-N 3.43Å; P839-R842 PolarHBondContact O-N 3.35Å; P839-M843 PolarHBondContact O-N 2.9Å
840	W	72.1	Confident	77.4	Confident	21 Å²	21	74.4 Å²	74.4	8%	0.08	37%	0.369	C	S	.	.	H	α-helix	trans	-72	-24.3	179.4	51.6	-99.3	0	0	0	112.8	R824 I827 Y838 R842 V844 I849 V902	R824-W840 HydrophobicContact CG-CH2 3.65Å; R824-W840 HydrophobicContact CG-CZ2 4.18Å; R824-W840 HydrophobicContact CG-CZ3 4.14Å; I827-W840 HydrophobicContact CD1-CH2 3.52Å; I827-W840 HydrophobicContact CD1-CZ2 4.24Å; I827-W840 HydrophobicContact CD1-CZ3 4.41Å; Y838-W840 VanDerWaalsContact C-N 3.3Å; Y838-W840 AromaticContact CD2-CE2 3.9Å; Y838-W840 AromaticContact CD2-CH2 3.99Å; Y838-W840 HydrophobicContact CD2-CH2 3.99Å; Y838-W840 AromaticContact CD2-CZ2 3.35Å; Y838-W840 HydrophobicContact CD2-CZ2 3.35Å; Y838-W840 HydrophobicContact CE2-CZ2 4.07Å; Y838-W840 AromaticContact CG-CE2 3.9Å; Y838-W840 AromaticContact CG-CZ2 3.85Å; Y838-W840 HydrophobicContact CG-CZ2 3.85Å; Y838-W840 AromaticContact CG-NE1 3.86Å; Y838-W840 PolarHBondContact O-N 3.33Å; W840-R842 VanDerWaalsContact C-N 3.33Å; W840-V844 PolarHBondContact O-N 3.38Å; W840-I849 HydrophobicContact CE3-CD1 4.01Å; W840-I849 HydrophobicContact CZ3-CD1 4.05Å; W840-I849 HydrophobicContact CZ3-CG2 3.88Å; W840-V902 HydrophobicContact CB-CG1 3.68Å
841	L	75.3	Confident	77.7	Confident	28 Å²	28	75.1 Å²	75.1	15%	0.147	37%	0.374	C	S	.	.	H	α-helix	trans	-70.6	-30.2	175.6	-164.6	64.7	0	0	0	111.9	Q835 P836 Y838 P839 L846 I849	Q835-L841 HydrophobicContact CB-CD2 4.12Å; P836-L841 WeakPolarHBondContact O-CD2 3.29Å; Y838-L841 WeakPolarHBondContact O-CB 3.34Å; Y838-L841 PolarHBondContact O-N 2.7Å; Y838-L841 VanDerWaalsContact O-N 3.08Å; P839-L841 VanDerWaalsContact C-N 3.3Å; P839-L841 PolarHBondContact O-N 3.43Å; L841-L846 HydrophobicContact CD1-CD2 3.48Å; L841-L846 VanDerWaalsContact CD1-CD2 3.48Å; L841-L846 HydrophobicContact CG-CD2 4.48Å; L841-I849 HydrophobicContact CD1-CD1 3.65Å
842	R	68.4	Low	77.9	Confident	104 Å²	104	71.3 Å²	71.3	39%	0.392	35%	0.349	S	S	.	.	H	α-helix	trans	-77.1	-35.7	177.3	-57.5	-178.3	-154.8	178.6	4.7	112.8	V29 Y838 P839 W840	V29-R842 HydrophobicContact CG1-CG 4.36Å; V29-R842 WeakPolarHBondContact O-CD 3.21Å; Y838-R842 PolarHBondContact O-N 3.28Å; P839-R842 PolarHBondContact O-N 3.35Å; W840-R842 VanDerWaalsContact C-N 3.33Å
843	M	67	Low	78.6	Confident	130 Å²	130	67.9 Å²	67.9	64%	0.64	32%	0.32	S	S	*	.	H	α-helix	trans	-83.7	-22.1	-173.5	-66.4	-175.1	-172.7	0	0	113.6	P839 V902	P839-M843 PolarHBondContact O-N 2.9Å; M843-V902 HydrophobicContact CB-CG1 4.08Å; M843-V902 HydrophobicContact CB-CG2 4.33Å; M843-V902 HydrophobicContact SD-CG1 4.11Å; M843-V902 HydrophobicContact SD-CG2 3.79Å
844	V	76.7	Confident	79.1	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.024	30%	0.303	C	S	.	.	S	Bend	trans	-126.5	132.7	-173.7	-175.8	0	0	0	0	109.9	W840 K848 I849 E899 V902 L903	W840-V844 PolarHBondContact O-N 3.38Å; V844-K848 HydrophobicContact CG1-CB 3.95Å; V844-I849 HydrophobicContact CB-CD1 4.2Å; V844-I849 HydrophobicContact CB-CG1 4.09Å; V844-I849 HydrophobicContact CG1-CD1 4.45Å; V844-I849 HydrophobicContact CG1-CG1 3.84Å; V844-I849 WeakPolarHBondContact O-CD1 3.4Å; V844-E899 HydrophobicContact CG2-CB 4.39Å; V844-V902 HydrophobicContact CG2-CB 4.19Å; V844-V902 HydrophobicContact CG2-CG1 4.08Å; V844-L903 HydrophobicContact CG1-CD1 4.3Å; V844-L903 HydrophobicContact CG2-CG 4.43Å
845	P	81.9	Confident	79.8	Confident	71 Å²	71	56.3 Å²	56.3	46%	0.461	28%	0.28	S	S	.	.			trans	-64.9	140.9	178.6	26.6	-35	0	0	0	112	R847 K848 I849	P845-R847 VanDerWaalsContact C-N 3.29Å; P845-R847 PolarHBondContact O-N 2.98Å; P845-R847 VanDerWaalsContact O-N 3.12Å; P845-K848 HydrophobicContact CG-CB 4.26Å; P845-K848 HydrophobicContact CG-CD 3.97Å; P845-K848 HydrophobicContact CG-CG 4.07Å; P845-K848 WeakPolarHBondContact O-CB 3.42Å; P845-K848 PolarHBondContact O-N 3.35Å; P845-I849 PolarHBondContact O-N 2.95Å
846	L	84.2	Confident	80.4	Confident	61 Å²	61	54.9 Å²	54.9	32%	0.319	27%	0.273	S	S	.	.	H	α-helix	trans	-47.9	-43.9	-176.7	-76	168.7	0	0	0	114.4	L841 K848 I849 H850	L841-L846 HydrophobicContact CD1-CD2 3.48Å; L841-L846 VanDerWaalsContact CD1-CD2 3.48Å; L841-L846 HydrophobicContact CG-CD2 4.48Å; L846-K848 PolarHBondContact O-N 3.31Å; L846-I849 WeakPolarHBondContact O-CB 3.39Å; L846-I849 PolarHBondContact O-N 2.68Å; L846-I849 VanDerWaalsContact O-N 3.09Å; L846-H850 PolarHBondContact O-CD2 3.05Å; L846-H850 PolarHBondContact O-N 2.86Å
847	R	86.2	Confident	81.3	Confident	215 Å²	215	55.3 Å²	55.3	81%	0.811	27%	0.273	S	S	*	.	H	α-helix	trans	-56	-39.6	179.9	-69.2	-174.6	178.5	177.6	-0.2	112.4	P845 H850 I851	P845-R847 VanDerWaalsContact C-N 3.29Å; P845-R847 PolarHBondContact O-N 2.98Å; P845-R847 VanDerWaalsContact O-N 3.12Å; R847-H850 PolarHBondContact O-N 3.09Å; R847-I851 VanDerWaalsContact O-CG1 3.3Å; R847-I851 WeakPolarHBondContact O-CG1 3.39Å; R847-I851 PolarHBondContact O-N 3.06Å; R847-I851 VanDerWaalsContact O-N 3.1Å
848	K	86.5	Confident	82.6	Confident	67 Å²	67	58.2 Å²	58.2	29%	0.291	29%	0.287	S	S	.	.	H	α-helix	trans	-72.3	-38.2	179.2	-73.6	-167.5	176.3	-172.4	0	111.5	V844 P845 L846 H850 I851 F852 F895 E899	V844-K848 HydrophobicContact CG1-CB 3.95Å; P845-K848 HydrophobicContact CG-CB 4.26Å; P845-K848 HydrophobicContact CG-CD 3.97Å; P845-K848 HydrophobicContact CG-CG 4.07Å; P845-K848 WeakPolarHBondContact O-CB 3.42Å; P845-K848 PolarHBondContact O-N 3.35Å; L846-K848 PolarHBondContact O-N 3.31Å; K848-H850 VanDerWaalsContact C-N 3.32Å; K848-H850 PolarHBondContact O-N 2.78Å; K848-I851 PolarHBondContact O-N 3.45Å; K848-F852 WeakPolarHBondContact O-CB 3.29Å; K848-F852 PolarHBondContact O-N 3.34Å; K848-F895 HydrophobicContact CB-CD1 4.41Å; K848-F895 HydrophobicContact CB-CE1 3.9Å; K848-F895 HydrophobicContact CG-CE1 4.46Å; K848-F895 VanDerWaalsContact O-CE1 3.28Å; K848-F895 WeakPolarHBondContact O-CE1 3.39Å; K848-E899 VanDerWaalsContact CD-CD 3.47Å; K848-E899 VanDerWaalsContact CD-OE1 3.25Å; K848-E899 WeakPolarHBondContact CD-OE1 3.48Å; K848-E899 VanDerWaalsContact CD-OE2 3.31Å; K848-E899 WeakPolarHBondContact CD-OE2 3.42Å; K848-E899 WeakPolarHBondContact CE-OE1 3.49Å; K848-E899 IonicContact NZ-OE1 2.58Å; K848-E899 PolarHBondContact NZ-OE1 3.04Å; K848-E899 IonicContact NZ-OE2 2.68Å; K848-E899 PolarHBondContact NZ-OE2 3.21Å
849	I	87.3	Confident	83.3	Confident	1 Å²	1	56 Å²	56	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-61.6	-42.9	174.4	-60.3	172.1	0	0	0	110.6	W840 L841 V844 P845 L846 F852 T853 L903	W840-I849 HydrophobicContact CE3-CD1 4.01Å; W840-I849 HydrophobicContact CZ3-CD1 4.05Å; W840-I849 HydrophobicContact CZ3-CG2 3.88Å; L841-I849 HydrophobicContact CD1-CD1 3.65Å; V844-I849 HydrophobicContact CB-CD1 4.2Å; V844-I849 HydrophobicContact CB-CG1 4.09Å; V844-I849 HydrophobicContact CG1-CD1 4.45Å; V844-I849 HydrophobicContact CG1-CG1 3.84Å; V844-I849 WeakPolarHBondContact O-CD1 3.4Å; P845-I849 PolarHBondContact O-N 2.95Å; L846-I849 WeakPolarHBondContact O-CB 3.39Å; L846-I849 PolarHBondContact O-N 2.68Å; L846-I849 VanDerWaalsContact O-N 3.09Å; I849-F852 PolarHBondContact O-N 3.43Å; I849-T853 WeakPolarHBondContact O-CB 3.28Å; I849-T853 PolarHBondContact O-N 3.02Å; I849-T853 PolarHBondContact O-OG1 3.44Å; I849-L903 HydrophobicContact CG1-CD2 4.32Å
850	H	89.6	Confident	84.6	Confident	60 Å²	60	54.2 Å²	54.2	28%	0.278	27%	0.265	S	S	.	.	H	α-helix	trans	-65.7	-40.8	177	-63.5	-49.8	0	0	0	112.4	L846 R847 K848 F852 T853 A854	L846-H850 PolarHBondContact O-CD2 3.05Å; L846-H850 PolarHBondContact O-N 2.86Å; R847-H850 PolarHBondContact O-N 3.09Å; K848-H850 VanDerWaalsContact C-N 3.32Å; K848-H850 PolarHBondContact O-N 2.78Å; H850-F852 VanDerWaalsContact C-N 3.35Å; H850-F852 PolarHBondContact O-N 3.11Å; H850-T853 PolarHBondContact O-N 2.97Å; H850-A854 VanDerWaalsContact O-CB 3.32Å; H850-A854 WeakPolarHBondContact O-CB 3.13Å; H850-A854 PolarHBondContact O-N 3.08Å
851	I	90.9	Very high	85.4	Confident	84 Å²	84	56.3 Å²	56.3	43%	0.431	28%	0.28	S	S	.	.	H	α-helix	trans	-61.7	-44.4	174.1	-67.2	164.3	0	0	0	110.6	R847 K848 T853 A854 V855 F895	R847-I851 VanDerWaalsContact O-CG1 3.3Å; R847-I851 WeakPolarHBondContact O-CG1 3.39Å; R847-I851 PolarHBondContact O-N 3.06Å; R847-I851 VanDerWaalsContact O-N 3.1Å; K848-I851 PolarHBondContact O-N 3.45Å; I851-T853 VanDerWaalsContact C-N 3.33Å; I851-T853 PolarHBondContact O-N 3.04Å; I851-A854 PolarHBondContact O-N 3.36Å; I851-V855 WeakPolarHBondContact O-CG2 3.5Å; I851-V855 PolarHBondContact O-N 2.97Å; I851-F895 HydrophobicContact CB-CZ 4.27Å; I851-F895 HydrophobicContact CG2-CZ 3.99Å
852	F	90.1	Very high	85.9	Confident	1 Å²	1	58.9 Å²	58.9	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-59.9	-45.8	177.6	179	-95.7	0	0	0	111.2	F485 K848 I849 H850 V855 Q856 L891 F895 L903 D904	F485-F852 HydrophobicContact CB-CZ 4.4Å; F485-F852 HydrophobicContact CD2-CE1 4.2Å; F485-F852 AromaticContact CD2-CE2 3.87Å; F485-F852 HydrophobicContact CD2-CE2 3.87Å; F485-F852 AromaticContact CD2-CZ 3.58Å; F485-F852 HydrophobicContact CD2-CZ 3.58Å; F485-F852 HydrophobicContact CE2-CE2 4.44Å; F485-F852 HydrophobicContact CE2-CZ 4.39Å; F485-F852 HydrophobicContact CG-CZ 4.45Å; K848-F852 WeakPolarHBondContact O-CB 3.29Å; K848-F852 PolarHBondContact O-N 3.34Å; I849-F852 PolarHBondContact O-N 3.43Å; H850-F852 VanDerWaalsContact C-N 3.35Å; H850-F852 PolarHBondContact O-N 3.11Å; F852-V855 PolarHBondContact O-N 2.95Å; F852-Q856 PolarHBondContact O-N 2.93Å; F852-L891 HydrophobicContact CD2-CD2 4.14Å; F852-L891 HydrophobicContact CE2-CD1 4.11Å; F852-L891 HydrophobicContact CE2-CD2 4.33Å; F852-F895 HydrophobicContact CB-CE1 4.16Å; F852-F895 HydrophobicContact CB-CE2 4.29Å; F852-F895 HydrophobicContact CB-CZ 3.64Å; F852-F895 HydrophobicContact CD2-CE2 4.24Å; F852-F895 HydrophobicContact CD2-CZ 4.35Å; F852-L903 HydrophobicContact CB-CD1 4.25Å; F852-L903 HydrophobicContact CD2-CD1 4.23Å; F852-L903 HydrophobicContact CE1-CB 4.5Å; F852-L903 HydrophobicContact CE2-CB 4.35Å; F852-L903 HydrophobicContact CG-CD1 4.12Å; F852-L903 HydrophobicContact CZ-CB 4.28Å; F852-D904 HydrophobicContact CZ-CB 4.46Å
853	T	90.9	Very high	86.6	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-66.8	-37.8	178.9	-48.6	0	0	0	0	111.2	R824 V825 I828 I849 H850 I851 Q856 I857	R824-T853 HydrophobicContact CB-CG2 3.92Å; V825-T853 HydrophobicContact CG2-CG2 4.09Å; I828-T853 HydrophobicContact CD1-CG2 3.81Å; I849-T853 WeakPolarHBondContact O-CB 3.28Å; I849-T853 PolarHBondContact O-N 3.02Å; I849-T853 PolarHBondContact O-OG1 3.44Å; H850-T853 PolarHBondContact O-N 2.97Å; I851-T853 VanDerWaalsContact C-N 3.33Å; I851-T853 PolarHBondContact O-N 3.04Å; T853-Q856 PolarHBondContact O-N 3.23Å; T853-I857 HydrophobicContact CG2-CD1 4.05Å; T853-I857 HydrophobicContact CG2-CG1 4.39Å; T853-I857 WeakPolarHBondContact O-CB 3.47Å; T853-I857 VanDerWaalsContact O-CG1 3.23Å; T853-I857 WeakPolarHBondContact O-CG1 3.49Å; T853-I857 PolarHBondContact O-N 3.37Å
854	A	91.4	Very high	87.5	Confident	54 Å²	54	49 Å²	49	45%	0.446	26%	0.255	S	S	.	.	H	α-helix	trans	-63.9	-42.7	175.6	0	0	0	0	0	112.2	H850 I851 Q856 I857 L858	H850-A854 VanDerWaalsContact O-CB 3.32Å; H850-A854 WeakPolarHBondContact O-CB 3.13Å; H850-A854 PolarHBondContact O-N 3.08Å; I851-A854 PolarHBondContact O-N 3.36Å; A854-Q856 VanDerWaalsContact C-N 3.32Å; A854-Q856 PolarHBondContact O-N 3.03Å; A854-I857 PolarHBondContact O-N 3.44Å; A854-L858 WeakPolarHBondContact O-CB 3.36Å; A854-L858 PolarHBondContact O-N 2.92Å
855	V	90.2	Very high	87.8	Confident	21 Å²	21	53.5 Å²	53.5	13%	0.127	28%	0.278	C	S	.	.	H	α-helix	trans	-61	-43.3	172.5	172.6	0	0	0	0	110.4	F485 I851 F852 L858 S859 L890 L891 L894	F485-V855 HydrophobicContact CE2-CG1 4.49Å; F485-V855 HydrophobicContact CZ-CG1 4.2Å; I851-V855 WeakPolarHBondContact O-CG2 3.5Å; I851-V855 PolarHBondContact O-N 2.97Å; F852-V855 PolarHBondContact O-N 2.95Å; V855-L858 PolarHBondContact O-N 2.68Å; V855-S859 WeakPolarHBondContact O-CB 3.45Å; V855-S859 PolarHBondContact O-N 2.89Å; V855-S859 PolarHBondContact O-OG 3.06Å; V855-L890 HydrophobicContact CG1-CD2 3.66Å; V855-L890 HydrophobicContact CG2-CD2 4.06Å; V855-L891 HydrophobicContact CG1-CD2 4.32Å; V855-L894 HydrophobicContact CG2-CD1 4.28Å
856	Q	89.5	Confident	87.7	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65	-41.1	178	-160.7	171.2	1.3	0	0	112.8	F485 A489 F821 F852 T853 A854 S859 F860	F485-Q856 HydrophobicContact CD2-CB 4.18Å; F485-Q856 HydrophobicContact CD2-CG 3.93Å; F485-Q856 HydrophobicContact CE2-CB 3.44Å; F485-Q856 VanDerWaalsContact CE2-CB 3.44Å; F485-Q856 HydrophobicContact CE2-CG 3.55Å; F485-Q856 HydrophobicContact CZ-CB 4.03Å; F485-Q856 HydrophobicContact CZ-CG 4.03Å; F485-Q856 PolarHBondContact O-NE2 2.99Å; A489-Q856 HydrophobicContact CB-CG 4.47Å; F821-Q856 HydrophobicContact CD2-CB 4.22Å; F821-Q856 HydrophobicContact CD2-CG 3.72Å; F821-Q856 HydrophobicContact CE2-CB 3.88Å; F821-Q856 HydrophobicContact CE2-CG 3.66Å; F852-Q856 PolarHBondContact O-N 2.93Å; T853-Q856 PolarHBondContact O-N 3.23Å; A854-Q856 VanDerWaalsContact C-N 3.32Å; A854-Q856 PolarHBondContact O-N 3.03Å; Q856-S859 PolarHBondContact O-N 2.88Å; Q856-F860 WeakPolarHBondContact O-CB 3.22Å; Q856-F860 PolarHBondContact O-N 2.91Å
857	I	92.2	Very high	87.3	Confident	55 Å²	55	50.4 Å²	50.4	28%	0.282	26%	0.258	S	S	.	.	H	α-helix	trans	-62.6	-46.4	174.9	-69.4	164.2	0	0	0	110	F821 V825 I828 T853 A854 S859 F860 V861	F821-I857 HydrophobicContact CE2-CG1 3.94Å; F821-I857 HydrophobicContact CZ-CG1 3.93Å; V825-I857 HydrophobicContact CG2-CD1 4.13Å; V825-I857 HydrophobicContact CG2-CG1 4.15Å; I828-I857 HydrophobicContact CD1-CD1 4.01Å; T853-I857 HydrophobicContact CG2-CD1 4.05Å; T853-I857 HydrophobicContact CG2-CG1 4.39Å; T853-I857 WeakPolarHBondContact O-CB 3.47Å; T853-I857 VanDerWaalsContact O-CG1 3.23Å; T853-I857 WeakPolarHBondContact O-CG1 3.49Å; T853-I857 PolarHBondContact O-N 3.37Å; A854-I857 PolarHBondContact O-N 3.44Å; I857-S859 VanDerWaalsContact C-N 3.34Å; I857-S859 PolarHBondContact O-N 2.86Å; I857-F860 WeakPolarHBondContact O-CB 3.17Å; I857-F860 PolarHBondContact O-N 3.41Å; I857-V861 HydrophobicContact CG2-CG2 4.29Å; I857-V861 VanDerWaalsContact O-CG2 3.31Å; I857-V861 WeakPolarHBondContact O-CG2 3.47Å; I857-V861 PolarHBondContact O-N 2.9Å
858	L	90.9	Very high	86.8	Confident	129 Å²	129	46.9 Å²	46.9	68%	0.675	25%	0.25	S	S	*	.	H	α-helix	trans	-60.3	-46.6	177.8	179.8	66.5	0	0	0	111.2	A854 V855 F860 V861 L862	A854-L858 WeakPolarHBondContact O-CB 3.36Å; A854-L858 PolarHBondContact O-N 2.92Å; V855-L858 PolarHBondContact O-N 2.68Å; L858-F860 VanDerWaalsContact C-N 3.35Å; L858-V861 PolarHBondContact O-N 3.24Å; L858-L862 PolarHBondContact O-N 2.68Å
859	S	85.9	Confident	86.5	Confident	5 Å²	5	46.9 Å²	46.9	4%	0.035	26%	0.256	C	S	.	.	H	α-helix	trans	-58.2	-46.2	173.8	-76.2	0	0	0	0	111.7	V855 Q856 I857 L862 L863	V855-S859 WeakPolarHBondContact O-CB 3.45Å; V855-S859 PolarHBondContact O-N 2.89Å; V855-S859 PolarHBondContact O-OG 3.06Å; Q856-S859 PolarHBondContact O-N 2.88Å; I857-S859 VanDerWaalsContact C-N 3.34Å; I857-S859 PolarHBondContact O-N 2.86Å; S859-L862 WeakPolarHBondContact O-CB 3.43Å; S859-L862 PolarHBondContact O-N 3.41Å; S859-L863 VanDerWaalsContact O-CG 3.31Å; S859-L863 WeakPolarHBondContact O-CG 3.46Å; S859-L863 PolarHBondContact O-N 2.88Å; S859-L863 VanDerWaalsContact O-N 3.09Å
860	F	89.2	Confident	85.6	Confident	27 Å²	27	55.3 Å²	55.3	12%	0.118	29%	0.292	C	S	.	.	H	α-helix	trans	-61.2	-45.7	177.8	170.6	-91.3	0	0	0	112.9	L493 L496 F821 Q856 I857 L858 L862 L863 A864	L493-F860 VanDerWaalsContact CA-CE2 3.48Å; L493-F860 HydrophobicContact CB-CD2 4.23Å; L493-F860 HydrophobicContact CB-CE2 3.78Å; L493-F860 HydrophobicContact CD1-CE2 4.03Å; L493-F860 HydrophobicContact CD1-CZ 4.22Å; L496-F860 HydrophobicContact CB-CZ 4.49Å; L496-F860 HydrophobicContact CD2-CE1 4.07Å; L496-F860 HydrophobicContact CD2-CZ 3.65Å; F821-F860 HydrophobicContact CE1-CD2 4.23Å; F821-F860 HydrophobicContact CE1-CG 4.36Å; F821-F860 HydrophobicContact CZ-CB 4.32Å; F821-F860 HydrophobicContact CZ-CG 4.34Å; Q856-F860 WeakPolarHBondContact O-CB 3.22Å; Q856-F860 PolarHBondContact O-N 2.91Å; I857-F860 WeakPolarHBondContact O-CB 3.17Å; I857-F860 PolarHBondContact O-N 3.41Å; L858-F860 VanDerWaalsContact C-N 3.35Å; F860-L862 VanDerWaalsContact C-N 3.29Å; F860-L862 PolarHBondContact O-N 3.15Å; F860-L863 WeakPolarHBondContact O-CA 3.34Å; F860-L863 WeakPolarHBondContact O-CB 3.44Å; F860-L863 PolarHBondContact O-N 2.95Å; F860-A864 PolarHBondContact O-N 3.44Å
861	V	89.3	Confident	84.8	Confident	66 Å²	66	58.1 Å²	58.1	40%	0.4	31%	0.313	S	S	.	.	H	α-helix	trans	-61.5	-40.8	177	169.6	0	0	0	0	110.5	I857 L858 L863 A864 I865	I857-V861 HydrophobicContact CG2-CG2 4.29Å; I857-V861 VanDerWaalsContact O-CG2 3.31Å; I857-V861 WeakPolarHBondContact O-CG2 3.47Å; I857-V861 PolarHBondContact O-N 2.9Å; L858-V861 PolarHBondContact O-N 3.24Å; V861-L863 VanDerWaalsContact C-N 3.27Å; V861-L863 PolarHBondContact O-N 3.47Å; V861-A864 PolarHBondContact O-N 3.24Å; V861-I865 HydrophobicContact CG1-CD1 3.8Å; V861-I865 HydrophobicContact CG1-CG1 4.4Å; V861-I865 VanDerWaalsContact O-CG1 3.28Å; V861-I865 WeakPolarHBondContact O-CG1 3.43Å; V861-I865 PolarHBondContact O-N 3.4Å
862	L	85.5	Confident	83.9	Confident	81 Å²	81	56.7 Å²	56.7	42%	0.424	31%	0.309	S	S	.	.	H	α-helix	trans	-59.4	-39.3	173.2	-176.8	67.3	0	0	0	111.6	L858 S859 F860 V866	L858-L862 PolarHBondContact O-N 2.68Å; S859-L862 WeakPolarHBondContact O-CB 3.43Å; S859-L862 PolarHBondContact O-N 3.41Å; F860-L862 VanDerWaalsContact C-N 3.29Å; F860-L862 PolarHBondContact O-N 3.15Å; L862-V866 WeakPolarHBondContact O-CG2 3.23Å; L862-V866 PolarHBondContact O-N 3.41Å
863	L	83.7	Confident	82.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-64.5	-46.3	175.5	-47.5	-179.1	0	0	0	112.8	A489 L493 S859 F860 V861 I865 V866 E867 M879 L883	A489-L863 HydrophobicContact CB-CD1 4.29Å; L493-L863 HydrophobicContact CD2-CB 3.6Å; L493-L863 HydrophobicContact CD2-CD1 4.21Å; S859-L863 VanDerWaalsContact O-CG 3.31Å; S859-L863 WeakPolarHBondContact O-CG 3.46Å; S859-L863 PolarHBondContact O-N 2.88Å; S859-L863 VanDerWaalsContact O-N 3.09Å; F860-L863 WeakPolarHBondContact O-CA 3.34Å; F860-L863 WeakPolarHBondContact O-CB 3.44Å; F860-L863 PolarHBondContact O-N 2.95Å; V861-L863 VanDerWaalsContact C-N 3.27Å; V861-L863 PolarHBondContact O-N 3.47Å; L863-I865 VanDerWaalsContact C-N 3.33Å; L863-I865 PolarHBondContact O-N 2.88Å; L863-V866 PolarHBondContact O-N 2.83Å; L863-E867 PolarHBondContact O-N 2.58Å; L863-E867 VanDerWaalsContact O-N 3.1Å; L863-M879 VanDerWaalsContact CA-SD 3.53Å; L863-M879 HydrophobicContact CB-CE 3.7Å; L863-M879 HydrophobicContact CB-SD 4.14Å; L863-M879 HydrophobicContact CD2-CE 3.41Å; L863-M879 VanDerWaalsContact CD2-CE 3.41Å; L863-M879 HydrophobicContact CD2-CG 3.55Å; L863-M879 HydrophobicContact CD2-SD 3.41Å; L863-M879 WeakPolarHBondContact CD2-SD 3.44Å; L863-M879 HydrophobicContact CG-CE 4.08Å; L863-M879 HydrophobicContact CG-SD 4.37Å; L863-L883 HydrophobicContact CD1-CD1 3.61Å; L863-L883 HydrophobicContact CD2-CD1 3.28Å; L863-L883 HydrophobicContact CD2-CD2 4.08Å; L863-L883 HydrophobicContact CD2-CG 3.73Å; L863-L883 HydrophobicContact CG-CD1 3.99Å
864	A	84.7	Confident	81.6	Confident	27 Å²	27	60.4 Å²	60.4	22%	0.223	33%	0.329	C	S	.	.	H	α-helix	trans	-61	-42.7	-179.6	0	0	0	0	0	111.6	L493 F860 V861 V866 E867 E868	L493-A864 HydrophobicContact CD1-CB 3.67Å; F860-A864 PolarHBondContact O-N 3.44Å; V861-A864 PolarHBondContact O-N 3.24Å; A864-V866 PolarHBondContact O-N 2.91Å; A864-E867 PolarHBondContact O-N 3.32Å; A864-E868 WeakPolarHBondContact O-CG 3.41Å; A864-E868 PolarHBondContact O-N 2.98Å
865	I	84	Confident	80.6	Confident	99 Å²	99	62.3 Å²	62.3	51%	0.508	33%	0.331	S	S	.	.	H	α-helix	trans	-61.8	-44.8	178	-68.5	166.2	0	0	0	111.2	V861 L863 E867 E868 V869	V861-I865 HydrophobicContact CG1-CD1 3.8Å; V861-I865 HydrophobicContact CG1-CG1 4.4Å; V861-I865 VanDerWaalsContact O-CG1 3.28Å; V861-I865 WeakPolarHBondContact O-CG1 3.43Å; V861-I865 PolarHBondContact O-N 3.4Å; L863-I865 VanDerWaalsContact C-N 3.33Å; L863-I865 PolarHBondContact O-N 2.88Å; I865-E867 VanDerWaalsContact C-N 3.29Å; I865-E867 PolarHBondContact O-N 2.83Å; I865-E868 PolarHBondContact O-N 3.16Å; I865-V869 WeakPolarHBondContact O-CG2 3.43Å; I865-V869 PolarHBondContact O-N 3.22Å
866	V	79.7	Confident	79.6	Confident	26 Å²	26	62.2 Å²	62.2	16%	0.158	33%	0.329	C	S	.	.	H	α-helix	trans	-65.9	-35.2	-178	164.4	0	0	0	0	111.8	L862 L863 A864 V872 M879	L862-V866 WeakPolarHBondContact O-CG2 3.23Å; L862-V866 PolarHBondContact O-N 3.41Å; L863-V866 PolarHBondContact O-N 2.83Å; A864-V866 PolarHBondContact O-N 2.91Å; V866-V872 HydrophobicContact CG1-CG1 3.81Å; V866-M879 HydrophobicContact CB-CE 4.19Å; V866-M879 HydrophobicContact CB-SD 3.41Å; V866-M879 WeakPolarHBondContact CB-SD 3.49Å; V866-M879 HydrophobicContact CG1-CE 4.04Å; V866-M879 HydrophobicContact CG1-SD 3.55Å; V866-M879 VanDerWaalsContact CG1-SD 3.55Å; V866-M879 HydrophobicContact CG2-SD 3.62Å
867	E	76.4	Confident	78.6	Confident	41 Å²	41	62.5 Å²	62.5	19%	0.192	33%	0.331	C	S	.	.	H	α-helix	trans	-68.8	-41.7	179.1	-175.6	-178.9	-178.2	0	0	113.2	I497 L863 A864 I865 V869	I497-E867 WeakPolarHBondContact CD1-OE1 3.07Å; I497-E867 WeakPolarHBondContact CD1-OE2 3.22Å; I497-E867 VanDerWaalsContact CG1-CD 3.49Å; I497-E867 VanDerWaalsContact CG1-OE1 3.24Å; I497-E867 WeakPolarHBondContact CG1-OE1 3.47Å; I497-E867 WeakPolarHBondContact CG1-OE2 3.29Å; L863-E867 PolarHBondContact O-N 2.58Å; L863-E867 VanDerWaalsContact O-N 3.1Å; A864-E867 PolarHBondContact O-N 3.32Å; I865-E867 VanDerWaalsContact C-N 3.29Å; I865-E867 PolarHBondContact O-N 2.83Å; E867-V869 PolarHBondContact O-N 3.12Å
868	E	75.8	Confident	77.7	Confident	140 Å²	140	64.3 Å²	64.3	65%	0.654	34%	0.341	S	S	*	.	H	α-helix	trans	-60.9	-32.4	178.5	-74.1	-66	162.4	0	0	112.2	A864 I865 K870	A864-E868 WeakPolarHBondContact O-CG 3.41Å; A864-E868 PolarHBondContact O-N 2.98Å; I865-E868 PolarHBondContact O-N 3.16Å; E868-K870 PolarHBondContact O-N 3Å
869	V	79.4	Confident	77	Confident	68 Å²	68	58.9 Å²	58.9	41%	0.412	31%	0.312	S	S	.	.	S	Bend	trans	-77.6	97.8	179	-174.9	0	0	0	0	109.9	I865 E867 V871 V872 S873	I865-V869 WeakPolarHBondContact O-CG2 3.43Å; I865-V869 PolarHBondContact O-N 3.22Å; E867-V869 PolarHBondContact O-N 3.12Å; V869-V871 PolarHBondContact O-N 3.31Å; V869-V872 HydrophobicContact CB-CB 4.12Å; V869-V872 HydrophobicContact CB-CG2 4.12Å; V869-V872 HydrophobicContact CG1-CB 4.07Å; V869-V872 HydrophobicContact CG1-CG2 3.58Å; V869-V872 CarbonylContact O-C 3.08Å; V869-V872 PolarHBondContact O-N 3.23Å; V869-S873 PolarHBondContact O-N 3.45Å
870	K	69.3	Low	76.6	Confident	178 Å²	178	59.3 Å²	59.3	77%	0.774	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.4	-37	-178.1	-66.3	-178.6	-179.7	176.7	0	114.9	E868	E868-K870 PolarHBondContact O-N 3Å
871	V	71.7	Confident	76	Confident	118 Å²	118	61.1 Å²	61.1	72%	0.715	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-39.3	179.4	-173.3	0	0	0	0	112	V869	V869-V871 PolarHBondContact O-N 3.31Å
872	V	71.7	Confident	75.6	Confident	55 Å²	55	61.4 Å²	61.4	33%	0.333	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-84.2	-16.3	-178.3	-168.7	0	0	0	0	111.1	V866 V869 M874 L875	V866-V872 HydrophobicContact CG1-CG1 3.81Å; V869-V872 HydrophobicContact CB-CB 4.12Å; V869-V872 HydrophobicContact CB-CG2 4.12Å; V869-V872 HydrophobicContact CG1-CB 4.07Å; V869-V872 HydrophobicContact CG1-CG2 3.58Å; V869-V872 CarbonylContact O-C 3.08Å; V869-V872 PolarHBondContact O-N 3.23Å; V872-M874 PolarHBondContact O-N 3.47Å; V872-M874 VanDerWaalsContact O-N 3.09Å; V872-L875 HydrophobicContact CG1-CB 4.36Å; V872-L875 HydrophobicContact CG1-CD1 4.24Å; V872-L875 WeakPolarHBondContact O-CA 3.32Å; V872-L875 WeakPolarHBondContact O-CB 3.47Å; V872-L875 PolarHBondContact O-N 2.98Å
873	S	65.2	Low	75.5	Confident	20 Å²	20	57.7 Å²	57.7	14%	0.14	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-53.8	-29.9	175.7	-168.7	0	0	0	0	113.3	V869 L875 F876	V869-S873 PolarHBondContact O-N 3.45Å; S873-L875 PolarHBondContact O-N 2.76Å; S873-F876 WeakPolarHBondContact O-CB 3.43Å; S873-F876 PolarHBondContact O-N 3.49Å; S873-F876 VanDerWaalsContact O-N 3.11Å
874	M	68.9	Low	75.4	Confident	58 Å²	58	58.8 Å²	58.8	29%	0.286	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-65.2	-25.1	172.8	-67.7	-172.6	-120.2	0	0	113.7	V436 M440 V872 F876	V436-M874 HydrophobicContact CB-CG 4.47Å; V436-M874 HydrophobicContact CG1-CE 3.31Å; V436-M874 HydrophobicContact CG1-CG 3.61Å; V436-M874 HydrophobicContact CG1-SD 3.9Å; M440-M874 HydrophobicContact CG-CE 3.48Å; M440-M874 VanDerWaalsContact CG-CE 3.48Å; M440-M874 HydrophobicContact CG-SD 4.43Å; M440-M874 HydrophobicContact SD-CE 4.24Å; V872-M874 PolarHBondContact O-N 3.47Å; V872-M874 VanDerWaalsContact O-N 3.09Å; M874-F876 VanDerWaalsContact C-N 3.31Å
875	L	69.5	Low	75.3	Confident	94 Å²	94	60.5 Å²	60.5	49%	0.492	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-88.4	1.6	176.3	-60.9	174.6	0	0	0	112.6	V872 S873 P877 L878 M879	V872-L875 HydrophobicContact CG1-CB 4.36Å; V872-L875 HydrophobicContact CG1-CD1 4.24Å; V872-L875 WeakPolarHBondContact O-CA 3.32Å; V872-L875 WeakPolarHBondContact O-CB 3.47Å; V872-L875 PolarHBondContact O-N 2.98Å; S873-L875 PolarHBondContact O-N 2.76Å; L875-P877 VanDerWaalsContact C-CD 3.45Å; L875-P877 VanDerWaalsContact C-N 3.29Å; L875-L878 HydrophobicContact CD2-CD1 3.72Å; L875-L878 WeakPolarHBondContact O-CA 3.22Å; L875-L878 WeakPolarHBondContact O-CB 3.47Å; L875-L878 PolarHBondContact O-N 3.41Å; L875-M879 PolarHBondContact O-N 2.69Å; L875-M879 VanDerWaalsContact O-N 3.1Å
876	F	69.4	Low	75.2	Confident	20 Å²	20	57.8 Å²	57.8	9%	0.088	31%	0.308	C	S	.	.	H	α-helix	trans	-51.2	-41	178.5	176.4	-101.7	0	0	0	113.5	F490 L493 S873 M874 L878 M879	F490-F876 HydrophobicContact CD2-CE1 4.36Å; F490-F876 AromaticContact CD2-CZ 3.86Å; F490-F876 HydrophobicContact CD2-CZ 3.86Å; F490-F876 AromaticContact CE2-CE1 3.4Å; F490-F876 HydrophobicContact CE2-CE1 3.4Å; F490-F876 HydrophobicContact CE2-CE2 4.49Å; F490-F876 AromaticContact CE2-CZ 3.29Å; F490-F876 HydrophobicContact CE2-CZ 3.29Å; F490-F876 HydrophobicContact CZ-CE1 4.1Å; F490-F876 HydrophobicContact CZ-CZ 4.25Å; L493-F876 HydrophobicContact CD2-CE2 3.88Å; L493-F876 HydrophobicContact CD2-CZ 4.28Å; S873-F876 WeakPolarHBondContact O-CB 3.43Å; S873-F876 PolarHBondContact O-N 3.49Å; S873-F876 VanDerWaalsContact O-N 3.11Å; M874-F876 VanDerWaalsContact C-N 3.31Å; F876-L878 PolarHBondContact O-N 2.99Å; F876-M879 HydrophobicContact CD2-CE 3.27Å; F876-M879 HydrophobicContact CE2-CE 3.56Å; F876-M879 HydrophobicContact CG-CE 4.23Å; F876-M879 WeakPolarHBondContact O-CB 3.32Å; F876-M879 PolarHBondContact O-N 3.15Å
877	P	68.5	Low	75.4	Confident	6 Å²	6	56.6 Å²	56.6	4%	0.039	30%	0.301	C	S	.	.	H	α-helix	trans	-62.7	-37	173.1	-26.5	37.3	0	0	0	114.8	L693 M696 L875 M879 L880	L693-P877 HydrophobicContact CG-CG 4.42Å; M696-P877 HydrophobicContact CB-CB 3.55Å; M696-P877 HydrophobicContact CB-CG 4.3Å; M696-P877 HydrophobicContact CG-CB 3.76Å; L875-P877 VanDerWaalsContact C-CD 3.45Å; L875-P877 VanDerWaalsContact C-N 3.29Å; P877-M879 VanDerWaalsContact C-N 3.29Å; P877-M879 PolarHBondContact O-N 3.3Å; P877-L880 WeakPolarHBondContact O-CB 3.18Å; P877-L880 PolarHBondContact O-N 3.47Å
878	L	74	Confident	75.6	Confident	93 Å²	93	60 Å²	60	49%	0.487	31%	0.311	S	S	.	.	H	α-helix	trans	-67.2	-32.4	177.4	-96	142.1	0	0	0	111.7	L875 F876 L880 L881 V882	L875-L878 HydrophobicContact CD2-CD1 3.72Å; L875-L878 WeakPolarHBondContact O-CA 3.22Å; L875-L878 WeakPolarHBondContact O-CB 3.47Å; L875-L878 PolarHBondContact O-N 3.41Å; F876-L878 PolarHBondContact O-N 2.99Å; L878-L880 VanDerWaalsContact C-N 3.26Å; L878-L880 PolarHBondContact O-N 3.26Å; L878-L881 HydrophobicContact CD2-CD1 4.25Å; L878-L881 WeakPolarHBondContact O-CA 3.22Å; L878-L881 VanDerWaalsContact O-CB 3.27Å; L878-L881 WeakPolarHBondContact O-CB 3.39Å; L878-L881 PolarHBondContact O-N 3.31Å; L878-V882 PolarHBondContact O-N 2.89Å; L878-V882 VanDerWaalsContact O-N 3.15Å
879	M	75.7	Confident	76	Confident	14 Å²	14	60.2 Å²	60.2	7%	0.069	31%	0.311	C	S	.	.	H	α-helix	trans	-64.9	-30.2	175.6	-178.8	-177.8	62.6	0	0	112.8	L863 V866 L875 F876 P877 L881 V882 L883	L863-M879 VanDerWaalsContact CA-SD 3.53Å; L863-M879 HydrophobicContact CB-CE 3.7Å; L863-M879 HydrophobicContact CB-SD 4.14Å; L863-M879 HydrophobicContact CD2-CE 3.41Å; L863-M879 VanDerWaalsContact CD2-CE 3.41Å; L863-M879 HydrophobicContact CD2-CG 3.55Å; L863-M879 HydrophobicContact CD2-SD 3.41Å; L863-M879 WeakPolarHBondContact CD2-SD 3.44Å; L863-M879 HydrophobicContact CG-CE 4.08Å; L863-M879 HydrophobicContact CG-SD 4.37Å; V866-M879 HydrophobicContact CB-CE 4.19Å; V866-M879 HydrophobicContact CB-SD 3.41Å; V866-M879 WeakPolarHBondContact CB-SD 3.49Å; V866-M879 HydrophobicContact CG1-CE 4.04Å; V866-M879 HydrophobicContact CG1-SD 3.55Å; V866-M879 VanDerWaalsContact CG1-SD 3.55Å; V866-M879 HydrophobicContact CG2-SD 3.62Å; L875-M879 PolarHBondContact O-N 2.69Å; L875-M879 VanDerWaalsContact O-N 3.1Å; F876-M879 HydrophobicContact CD2-CE 3.27Å; F876-M879 HydrophobicContact CE2-CE 3.56Å; F876-M879 HydrophobicContact CG-CE 4.23Å; F876-M879 WeakPolarHBondContact O-CB 3.32Å; F876-M879 PolarHBondContact O-N 3.15Å; P877-M879 VanDerWaalsContact C-N 3.29Å; P877-M879 PolarHBondContact O-N 3.3Å; M879-L881 VanDerWaalsContact C-N 3.27Å; M879-L881 PolarHBondContact O-N 2.93Å; M879-V882 WeakPolarHBondContact O-CA 3.4Å; M879-V882 WeakPolarHBondContact O-CB 3.45Å; M879-V882 PolarHBondContact O-N 3.42Å; M879-V882 VanDerWaalsContact O-N 3.07Å; M879-L883 PolarHBondContact O-N 3.01Å
880	L	77	Confident	76.2	Confident	14 Å²	14	60.4 Å²	60.4	7%	0.073	31%	0.309	C	S	.	.	H	α-helix	trans	-65.7	-33.2	171.9	-70.1	163	0	0	0	111.6	F490 I700 P877 L878 V882 L883 I884	F490-L880 HydrophobicContact CB-CD2 4.48Å; F490-L880 HydrophobicContact CD2-CD1 4.01Å; F490-L880 HydrophobicContact CD2-CD2 3.77Å; F490-L880 HydrophobicContact CD2-CG 4.45Å; F490-L880 HydrophobicContact CE2-CD1 3.74Å; F490-L880 HydrophobicContact CE2-CD2 4.35Å; F490-L880 HydrophobicContact CG-CD2 4.44Å; I700-L880 HydrophobicContact CD1-CB 4.39Å; I700-L880 HydrophobicContact CD1-CD1 3.2Å; I700-L880 HydrophobicContact CD1-CG 4.37Å; I700-L880 HydrophobicContact CG1-CD1 4.12Å; I700-L880 HydrophobicContact CG2-CD1 4.33Å; P877-L880 WeakPolarHBondContact O-CB 3.18Å; P877-L880 PolarHBondContact O-N 3.47Å; L878-L880 VanDerWaalsContact C-N 3.26Å; L878-L880 PolarHBondContact O-N 3.26Å; L880-V882 VanDerWaalsContact C-N 3.32Å; L880-L883 HydrophobicContact CD2-CD1 3.73Å; L880-L883 WeakPolarHBondContact O-CB 3.47Å; L880-L883 PolarHBondContact O-N 2.64Å; L880-I884 VanDerWaalsContact O-CG1 3.29Å; L880-I884 WeakPolarHBondContact O-CG1 3.45Å; L880-I884 PolarHBondContact O-N 3.32Å
881	L	77.1	Confident	76.8	Confident	65 Å²	65	51.9 Å²	51.9	34%	0.34	27%	0.272	S	S	.	.	H	α-helix	trans	-64.3	-38.7	169.6	-59.7	173.4	0	0	0	111.3	L878 M879 L883 I884 C885	L878-L881 HydrophobicContact CD2-CD1 4.25Å; L878-L881 WeakPolarHBondContact O-CA 3.22Å; L878-L881 VanDerWaalsContact O-CB 3.27Å; L878-L881 WeakPolarHBondContact O-CB 3.39Å; L878-L881 PolarHBondContact O-N 3.31Å; M879-L881 VanDerWaalsContact C-N 3.27Å; M879-L881 PolarHBondContact O-N 2.93Å; L881-L883 VanDerWaalsContact C-N 3.34Å; L881-L883 PolarHBondContact O-N 2.93Å; L881-I884 HydrophobicContact CD2-CD1 4.29Å; L881-I884 WeakPolarHBondContact O-CB 3.3Å; L881-I884 PolarHBondContact O-N 3.36Å; L881-C885 PolarHBondContact O-N 2.86Å; L881-C885 PolarHBondContact O-SG 3.44Å; L881-C885 VanDerWaalsContact O-SG 3.32Å
882	V	81	Confident	77.3	Confident	72 Å²	72	49.5 Å²	49.5	44%	0.436	26%	0.259	S	S	.	.	H	α-helix	trans	-61.6	-42.6	174.8	178.2	0	0	0	0	111	L878 M879 L880 I884 C885 I886	L878-V882 PolarHBondContact O-N 2.89Å; L878-V882 VanDerWaalsContact O-N 3.15Å; M879-V882 WeakPolarHBondContact O-CA 3.4Å; M879-V882 WeakPolarHBondContact O-CB 3.45Å; M879-V882 PolarHBondContact O-N 3.42Å; M879-V882 VanDerWaalsContact O-N 3.07Å; L880-V882 VanDerWaalsContact C-N 3.32Å; V882-I884 VanDerWaalsContact C-N 3.33Å; V882-I884 PolarHBondContact O-N 3.36Å; V882-C885 CarbonylContact O-C 3.55Å; V882-C885 WeakPolarHBondContact O-CA 3.38Å; V882-C885 WeakPolarHBondContact O-CB 3.29Å; V882-C885 PolarHBondContact O-N 2.83Å; V882-C885 VanDerWaalsContact O-N 3.12Å; V882-I886 HydrophobicContact CG1-CD1 4Å; V882-I886 HydrophobicContact CG1-CG1 4.33Å; V882-I886 WeakPolarHBondContact O-CG1 3.4Å; V882-I886 PolarHBondContact O-N 3.33Å
883	L	82.5	Confident	77.8	Confident	3 Å²	3	54 Å²	54	2%	0.016	28%	0.28	C	S	.	.	H	α-helix	trans	-60.4	-41.6	173.5	-78.1	165.4	0	0	0	112.7	F485 T486 L863 M879 L880 L881 C885 I886 R887	F485-L883 HydrophobicContact CE1-CD2 4.35Å; T486-L883 HydrophobicContact CG2-CB 3.79Å; L863-L883 HydrophobicContact CD1-CD1 3.61Å; L863-L883 HydrophobicContact CD2-CD1 3.28Å; L863-L883 HydrophobicContact CD2-CD2 4.08Å; L863-L883 HydrophobicContact CD2-CG 3.73Å; L863-L883 HydrophobicContact CG-CD1 3.99Å; M879-L883 PolarHBondContact O-N 3.01Å; L880-L883 HydrophobicContact CD2-CD1 3.73Å; L880-L883 WeakPolarHBondContact O-CB 3.47Å; L880-L883 PolarHBondContact O-N 2.64Å; L881-L883 VanDerWaalsContact C-N 3.34Å; L881-L883 PolarHBondContact O-N 2.93Å; L883-C885 VanDerWaalsContact C-N 3.28Å; L883-C885 PolarHBondContact O-N 3.43Å; L883-I886 PolarHBondContact O-N 3.25Å; L883-R887 WeakPolarHBondContact O-CB 3.43Å; L883-R887 PolarHBondContact O-N 2.96Å
884	I	81.6	Confident	78.6	Confident	23 Å²	23	57.2 Å²	57.2	12%	0.118	30%	0.295	C	S	.	.	H	α-helix	trans	-61.7	-40.3	174.5	-66.3	164.7	0	0	0	110	W481 I482 T486 L880 L881 V882 R887 R888	W481-I884 HydrophobicContact CB-CG2 3.96Å; I482-I884 HydrophobicContact CG1-CD1 3.94Å; T486-I884 HydrophobicContact CG2-CG1 4.42Å; L880-I884 VanDerWaalsContact O-CG1 3.29Å; L880-I884 WeakPolarHBondContact O-CG1 3.45Å; L880-I884 PolarHBondContact O-N 3.32Å; L881-I884 HydrophobicContact CD2-CD1 4.29Å; L881-I884 WeakPolarHBondContact O-CB 3.3Å; L881-I884 PolarHBondContact O-N 3.36Å; V882-I884 VanDerWaalsContact C-N 3.33Å; V882-I884 PolarHBondContact O-N 3.36Å; I884-R887 PolarHBondContact O-N 2.91Å; I884-R888 VanDerWaalsContact O-CB 3.25Å; I884-R888 WeakPolarHBondContact O-CB 3.46Å; I884-R888 PolarHBondContact O-N 3.47Å
885	C	82.5	Confident	79.2	Confident	63 Å²	63	55 Å²	55	43%	0.426	28%	0.284	S	S	.	.	H	α-helix	trans	-65.2	-48.2	174.6	-68.5	0	0	0	0	112.2	L881 V882 L883 R887 R888 F889	L881-C885 PolarHBondContact O-N 2.86Å; L881-C885 PolarHBondContact O-SG 3.44Å; L881-C885 VanDerWaalsContact O-SG 3.32Å; V882-C885 CarbonylContact O-C 3.55Å; V882-C885 WeakPolarHBondContact O-CA 3.38Å; V882-C885 WeakPolarHBondContact O-CB 3.29Å; V882-C885 PolarHBondContact O-N 2.83Å; V882-C885 VanDerWaalsContact O-N 3.12Å; L883-C885 VanDerWaalsContact C-N 3.28Å; L883-C885 PolarHBondContact O-N 3.43Å; C885-R887 VanDerWaalsContact C-N 3.25Å; C885-R887 PolarHBondContact O-N 2.83Å; C885-R888 PolarHBondContact O-N 3.12Å; C885-R888 VanDerWaalsContact O-N 3.1Å; C885-F889 HydrophobicContact CB-CD2 4.27Å; C885-F889 HydrophobicContact CB-CE2 4.41Å; C885-F889 WeakPolarHBondContact O-CD2 3.45Å; C885-F889 PolarHBondContact O-N 3.12Å
886	I	83.3	Confident	79.7	Confident	43 Å²	43	53.5 Å²	53.5	22%	0.221	28%	0.282	C	S	.	.	H	α-helix	trans	-54.4	-48.9	175.6	-69.8	166.9	0	0	0	108.9	V882 L883 R888 F889 L890	V882-I886 HydrophobicContact CG1-CD1 4Å; V882-I886 HydrophobicContact CG1-CG1 4.33Å; V882-I886 WeakPolarHBondContact O-CG1 3.4Å; V882-I886 PolarHBondContact O-N 3.33Å; L883-I886 PolarHBondContact O-N 3.25Å; I886-R888 VanDerWaalsContact C-N 3.35Å; I886-R888 PolarHBondContact O-N 3.34Å; I886-F889 PolarHBondContact O-N 2.99Å; I886-L890 HydrophobicContact CG2-CB 4.12Å; I886-L890 HydrophobicContact CG2-CD2 4.18Å; I886-L890 WeakPolarHBondContact O-CA 3.47Å; I886-L890 WeakPolarHBondContact O-CB 3.18Å; I886-L890 PolarHBondContact O-N 3.26Å
887	R	82.5	Confident	80	Confident	1 Å²	1	61.6 Å²	61.6	0%	0.004	32%	0.317	C	S	.	.	H	α-helix	trans	-60.8	-43.5	178.1	-168.6	-160.6	168.4	-139.4	-3.7	112.4	T483 F485 L883 I884 C885 L891 P892 D904 D905 L907	T483-R887 VanDerWaalsContact CG2-NH2 3.27Å; T483-R887 WeakPolarHBondContact OG1-CD 3.4Å; T483-R887 PolarHBondContact OG1-NE 3.38Å; T483-R887 PolarHBondContact OG1-NH1 3.26Å; T483-R887 PolarHBondContact OG1-NH2 2.93Å; F485-R887 HydrophobicContact CD1-CB 4.45Å; F485-R887 HydrophobicContact CD1-CG 4.36Å; L883-R887 WeakPolarHBondContact O-CB 3.43Å; L883-R887 PolarHBondContact O-N 2.96Å; I884-R887 PolarHBondContact O-N 2.91Å; C885-R887 VanDerWaalsContact C-N 3.25Å; C885-R887 PolarHBondContact O-N 2.83Å; R887-L891 HydrophobicContact CB-CD1 4.29Å; R887-L891 HydrophobicContact CG-CD1 3.48Å; R887-L891 VanDerWaalsContact CG-CD1 3.48Å; R887-L891 HydrophobicContact CG-CG 4.37Å; R887-L891 WeakPolarHBondContact O-CB 3.45Å; R887-P892 VanDerWaalsContact O-CD 3.31Å; R887-P892 WeakPolarHBondContact O-CD 3.36Å; R887-D904 IonicContact CZ-OD2 2.72Å; R887-D904 IonicContact NE-OD2 2.75Å; R887-D904 PolarHBondContact NE-OD2 2.62Å; R887-D904 IonicContact NH2-OD1 2.62Å; R887-D904 IonicContact NH2-OD2 2.92Å; R887-D904 PolarHBondContact NH2-OD2 3.48Å; R887-D905 PolarHBondContact NH2-O 2.77Å; R887-L907 HydrophobicContact CG-CD1 4.48Å; R887-L907 VanDerWaalsContact CZ-CD1 3.46Å; R887-L907 VanDerWaalsContact CZ-CG 3.41Å
888	R	81.9	Confident	80.2	Confident	111 Å²	111	69.6 Å²	69.6	42%	0.419	35%	0.351	S	S	.	.	H	α-helix	trans	-68.3	-37.2	-178.2	179.4	60.1	179.2	-167	2.8	113.1	I884 C885 I886 P892	I884-R888 VanDerWaalsContact O-CB 3.25Å; I884-R888 WeakPolarHBondContact O-CB 3.46Å; I884-R888 PolarHBondContact O-N 3.47Å; C885-R888 PolarHBondContact O-N 3.12Å; C885-R888 VanDerWaalsContact O-N 3.1Å; I886-R888 VanDerWaalsContact C-N 3.35Å; I886-R888 PolarHBondContact O-N 3.34Å; R888-P892 WeakPolarHBondContact O-CD 3.42Å; R888-P892 WeakPolarHBondContact O-CG 3.14Å
889	F	83.4	Confident	80.4	Confident	146 Å²	146	66.7 Å²	66.7	64%	0.64	34%	0.335	S	S	*	.	H	α-helix	trans	-100.4	-43.1	-173.8	-65.9	-67.3	0	0	0	112.7	C885 I886 L893	C885-F889 HydrophobicContact CB-CD2 4.27Å; C885-F889 HydrophobicContact CB-CE2 4.41Å; C885-F889 WeakPolarHBondContact O-CD2 3.45Å; C885-F889 PolarHBondContact O-N 3.12Å; I886-F889 PolarHBondContact O-N 2.99Å; F889-L893 WeakPolarHBondContact O-CD1 3.12Å; F889-L893 VanDerWaalsContact O-CG 3.26Å; F889-L893 WeakPolarHBondContact O-CG 3.34Å
890	L	82.8	Confident	80.5	Confident	71 Å²	71	67.1 Å²	67.1	37%	0.372	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-46.3	-173.4	-162.4	99.5	0	0	0	113	V855 I886 L893 L894	V855-L890 HydrophobicContact CG1-CD2 3.66Å; V855-L890 HydrophobicContact CG2-CD2 4.06Å; I886-L890 HydrophobicContact CG2-CB 4.12Å; I886-L890 HydrophobicContact CG2-CD2 4.18Å; I886-L890 WeakPolarHBondContact O-CA 3.47Å; I886-L890 WeakPolarHBondContact O-CB 3.18Å; I886-L890 PolarHBondContact O-N 3.26Å; L890-L893 WeakPolarHBondContact O-CB 3.18Å; L890-L893 PolarHBondContact O-N 3.32Å; L890-L894 HydrophobicContact CD2-CD1 4.01Å; L890-L894 HydrophobicContact CG-CD1 4.15Å; L890-L894 PolarHBondContact O-N 3.12Å
891	L	82.6	Confident	80.4	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-66.1	-40.3	-174.2	-65.3	-179.2	0	0	0	113.6	F485 F852 V855 R887 L893 L894 F895 L900	F485-L891 HydrophobicContact CD2-CD1 4.42Å; F485-L891 HydrophobicContact CG-CD1 4.44Å; F852-L891 HydrophobicContact CD2-CD2 4.14Å; F852-L891 HydrophobicContact CE2-CD1 4.11Å; F852-L891 HydrophobicContact CE2-CD2 4.33Å; V855-L891 HydrophobicContact CG1-CD2 4.32Å; R887-L891 HydrophobicContact CB-CD1 4.29Å; R887-L891 HydrophobicContact CG-CD1 3.48Å; R887-L891 VanDerWaalsContact CG-CD1 3.48Å; R887-L891 HydrophobicContact CG-CG 4.37Å; R887-L891 WeakPolarHBondContact O-CB 3.45Å; L891-L893 PolarHBondContact O-N 2.94Å; L891-L894 PolarHBondContact O-N 3.39Å; L891-F895 HydrophobicContact CD2-CD2 4.1Å; L891-F895 HydrophobicContact CD2-CE2 3.93Å; L891-F895 WeakPolarHBondContact O-CD2 3.21Å; L891-F895 PolarHBondContact O-N 3.21Å; L891-L900 HydrophobicContact CB-CD1 4.14Å; L891-L900 HydrophobicContact CD1-CD1 4.05Å
892	P	81.5	Confident	80.2	Confident	68 Å²	68	71.6 Å²	71.6	44%	0.442	36%	0.357	S	S	.	.	H	α-helix	trans	-66.4	-19.4	176.4	-23.8	36.3	0	0	0	113.9	R887 R888	R887-P892 VanDerWaalsContact O-CD 3.31Å; R887-P892 WeakPolarHBondContact O-CD 3.36Å; R888-P892 WeakPolarHBondContact O-CD 3.42Å; R888-P892 WeakPolarHBondContact O-CG 3.14Å
893	L	82.9	Confident	79.9	Confident	149 Å²	149	68.4 Å²	68.4	78%	0.78	34%	0.338	S	S	*	.	H	α-helix	trans	-77	-32.3	175.1	-67.6	168.7	0	0	0	111.8	F889 L890 L891	F889-L893 WeakPolarHBondContact O-CD1 3.12Å; F889-L893 VanDerWaalsContact O-CG 3.26Å; F889-L893 WeakPolarHBondContact O-CG 3.34Å; L890-L893 WeakPolarHBondContact O-CB 3.18Å; L890-L893 PolarHBondContact O-N 3.32Å; L891-L893 PolarHBondContact O-N 2.94Å
894	L	81	Confident	79.6	Confident	87 Å²	87	68.5 Å²	68.5	46%	0.455	34%	0.338	S	S	.	.	H	α-helix	trans	-94.2	-28.5	-174.6	-66.4	169.4	0	0	0	113.4	V855 L890 L891	V855-L894 HydrophobicContact CG2-CD1 4.28Å; L890-L894 HydrophobicContact CD2-CD1 4.01Å; L890-L894 HydrophobicContact CG-CD1 4.15Å; L890-L894 PolarHBondContact O-N 3.12Å; L891-L894 PolarHBondContact O-N 3.39Å
895	F	83.2	Confident	79.1	Confident	13 Å²	13	69.9 Å²	69.9	6%	0.057	35%	0.346	C	S	.	.	S	Bend	trans	-123.3	145.6	-169.6	-62.5	-81.5	0	0	0	113	K848 I851 F852 L891 L900	K848-F895 HydrophobicContact CB-CD1 4.41Å; K848-F895 HydrophobicContact CB-CE1 3.9Å; K848-F895 HydrophobicContact CG-CE1 4.46Å; K848-F895 VanDerWaalsContact O-CE1 3.28Å; K848-F895 WeakPolarHBondContact O-CE1 3.39Å; I851-F895 HydrophobicContact CB-CZ 4.27Å; I851-F895 HydrophobicContact CG2-CZ 3.99Å; F852-F895 HydrophobicContact CB-CE1 4.16Å; F852-F895 HydrophobicContact CB-CE2 4.29Å; F852-F895 HydrophobicContact CB-CZ 3.64Å; F852-F895 HydrophobicContact CD2-CE2 4.24Å; F852-F895 HydrophobicContact CD2-CZ 4.35Å; L891-F895 HydrophobicContact CD2-CD2 4.1Å; L891-F895 HydrophobicContact CD2-CE2 3.93Å; L891-F895 WeakPolarHBondContact O-CD2 3.21Å; L891-F895 PolarHBondContact O-N 3.21Å; F895-L900 HydrophobicContact CB-CB 4.46Å
896	S	79.7	Confident	78.2	Confident	62 Å²	62	73.1 Å²	73.1	43%	0.434	36%	0.355	S	S	.	.			trans	-70.8	149.5	169.4	178.5	0	0	0	0	110.6	K898 E899 L900	S896-K898 PolarHBondContact O-N 3.47Å; S896-K898 VanDerWaalsContact O-N 3.12Å; S896-E899 PolarHBondContact N-OE2 3.33Å; S896-E899 VanDerWaalsContact N-OE2 3.11Å; S896-E899 PolarHBondContact O-N 2.49Å; S896-L900 PolarHBondContact O-N 2.97Å
897	K	75.6	Confident	77.2	Confident	189 Å²	189	72.8 Å²	72.8	82%	0.822	35%	0.353	S	S	*	.	H	α-helix	trans	-53.4	-36	178.9	-67.8	-174.4	179.3	-178.8	0	113.2	K901	K897-K901 WeakPolarHBondContact O-CB 3.39Å; K897-K901 PolarHBondContact O-N 3.33Å; K897-K901 VanDerWaalsContact O-N 3.07Å
898	K	72.6	Confident	76.3	Confident	175 Å²	175	74 Å²	74	76%	0.761	36%	0.361	S	S	*	.	H	α-helix	trans	-67.2	-42.4	177.7	-70.8	-175.2	179	179.9	0	112	S896 K901 V902	S896-K898 PolarHBondContact O-N 3.47Å; S896-K898 VanDerWaalsContact O-N 3.12Å; K898-K901 PolarHBondContact O-N 3.17Å; K898-V902 WeakPolarHBondContact O-CG2 3.47Å; K898-V902 PolarHBondContact O-N 3.37Å
899	E	77.4	Confident	75.3	Confident	31 Å²	31	70.6 Å²	70.6	15%	0.145	36%	0.355	C	S	.	.	H	α-helix	trans	-68.7	-43.2	-179.9	-62.1	170.1	160	0	0	110.4	V844 K848 S896 K901 V902 L903	V844-E899 HydrophobicContact CG2-CB 4.39Å; K848-E899 VanDerWaalsContact CD-CD 3.47Å; K848-E899 VanDerWaalsContact CD-OE1 3.25Å; K848-E899 WeakPolarHBondContact CD-OE1 3.48Å; K848-E899 VanDerWaalsContact CD-OE2 3.31Å; K848-E899 WeakPolarHBondContact CD-OE2 3.42Å; K848-E899 WeakPolarHBondContact CE-OE1 3.49Å; K848-E899 IonicContact NZ-OE1 2.58Å; K848-E899 PolarHBondContact NZ-OE1 3.04Å; K848-E899 IonicContact NZ-OE2 2.68Å; K848-E899 PolarHBondContact NZ-OE2 3.21Å; S896-E899 PolarHBondContact N-OE2 3.33Å; S896-E899 VanDerWaalsContact N-OE2 3.11Å; S896-E899 PolarHBondContact O-N 2.49Å; E899-K901 VanDerWaalsContact C-N 3.33Å; E899-K901 PolarHBondContact O-N 2.77Å; E899-V902 PolarHBondContact O-N 3.17Å; E899-V902 VanDerWaalsContact O-N 3.17Å; E899-L903 PolarHBondContact O-N 3.2Å; E899-L903 VanDerWaalsContact O-N 3.08Å
900	L	78.9	Confident	74.2	Confident	24 Å²	24	71.1 Å²	71.1	13%	0.126	35%	0.352	C	S	.	.	H	α-helix	trans	-63.5	-38.5	178	-170	63.6	0	0	0	111.7	L891 F895 S896 V902 L903 D904	L891-L900 HydrophobicContact CB-CD1 4.14Å; L891-L900 HydrophobicContact CD1-CD1 4.05Å; F895-L900 HydrophobicContact CB-CB 4.46Å; S896-L900 PolarHBondContact O-N 2.97Å; L900-V902 PolarHBondContact O-N 2.78Å; L900-L903 PolarHBondContact O-N 3.32Å; L900-D904 HydrophobicContact CD1-CB 4.19Å; L900-D904 CarbonylContact O-C 3.31Å; L900-D904 WeakPolarHBondContact O-CA 3.46Å; L900-D904 PolarHBondContact O-N 3.05Å
901	K	74.1	Confident	73.3	Confident	125 Å²	125	72.2 Å²	72.2	54%	0.543	36%	0.359	S	S	.	.	H	α-helix	trans	-63.5	-28.1	175.7	-175.8	178.9	-170.9	142.1	0	113.7	K897 K898 E899 D904 E906	K897-K901 WeakPolarHBondContact O-CB 3.39Å; K897-K901 PolarHBondContact O-N 3.33Å; K897-K901 VanDerWaalsContact O-N 3.07Å; K898-K901 PolarHBondContact O-N 3.17Å; E899-K901 VanDerWaalsContact C-N 3.33Å; E899-K901 PolarHBondContact O-N 2.77Å; K901-D904 CarbonylContact C-O 3.12Å; K901-D904 WeakPolarHBondContact CA-O 3.31Å; K901-D904 VanDerWaalsContact O-O 3.09Å; K901-E906 WeakPolarHBondContact CD-OE1 3.45Å; K901-E906 VanDerWaalsContact CE-OE1 3.24Å; K901-E906 WeakPolarHBondContact CE-OE1 3.28Å; K901-E906 HydrophobicContact CG-CG 4.32Å; K901-E906 IonicContact NZ-OE1 3.84Å; K901-E906 PolarHBondContact NZ-OE1 2.94Å
902	V	73.2	Confident	72.6	Confident	47 Å²	47	77.5 Å²	77.5	29%	0.285	38%	0.383	S	S	.	.	H	α-helix	trans	-82.7	-38.6	178.7	173.7	0	0	0	0	110.8	W840 M843 V844 K898 E899 L900	W840-V902 HydrophobicContact CB-CG1 3.68Å; M843-V902 HydrophobicContact CB-CG1 4.08Å; M843-V902 HydrophobicContact CB-CG2 4.33Å; M843-V902 HydrophobicContact SD-CG1 4.11Å; M843-V902 HydrophobicContact SD-CG2 3.79Å; V844-V902 HydrophobicContact CG2-CB 4.19Å; V844-V902 HydrophobicContact CG2-CG1 4.08Å; K898-V902 WeakPolarHBondContact O-CG2 3.47Å; K898-V902 PolarHBondContact O-N 3.37Å; E899-V902 PolarHBondContact O-N 3.17Å; E899-V902 VanDerWaalsContact O-N 3.17Å; L900-V902 PolarHBondContact O-N 2.78Å
903	L	74.3	Confident	71.7	Confident	6 Å²	6	74.5 Å²	74.5	3%	0.031	36%	0.363	C	S	.	.	H	α-helix	trans	-81.7	-29.8	-178.8	-69.1	169.9	0	0	0	113.4	V844 I849 F852 E899 L900	V844-L903 HydrophobicContact CG1-CD1 4.3Å; V844-L903 HydrophobicContact CG2-CG 4.43Å; I849-L903 HydrophobicContact CG1-CD2 4.32Å; F852-L903 HydrophobicContact CB-CD1 4.25Å; F852-L903 HydrophobicContact CD2-CD1 4.23Å; F852-L903 HydrophobicContact CE1-CB 4.5Å; F852-L903 HydrophobicContact CE2-CB 4.35Å; F852-L903 HydrophobicContact CG-CD1 4.12Å; F852-L903 HydrophobicContact CZ-CB 4.28Å; E899-L903 PolarHBondContact O-N 3.2Å; E899-L903 VanDerWaalsContact O-N 3.08Å; L900-L903 PolarHBondContact O-N 3.32Å
904	D	76.4	Confident	71	Confident	4 Å²	4	70.1 Å²	70.1	2%	0.021	34%	0.34	C	S	.	.	S	Bend	trans	-149.5	171.1	-170.2	-168	20.9	0	0	0	111	R484 F485 F852 R887 L900 K901	R484-D904 VanDerWaalsContact CB-OD1 3.3Å; R484-D904 WeakPolarHBondContact CB-OD1 3.36Å; R484-D904 PolarHBondContact N-OD1 3.34Å; F485-D904 PolarHBondContact N-OD1 2.76Å; F852-D904 HydrophobicContact CZ-CB 4.46Å; R887-D904 IonicContact CZ-OD2 2.72Å; R887-D904 IonicContact NE-OD2 2.75Å; R887-D904 PolarHBondContact NE-OD2 2.62Å; R887-D904 IonicContact NH2-OD1 2.62Å; R887-D904 IonicContact NH2-OD2 2.92Å; R887-D904 PolarHBondContact NH2-OD2 3.48Å; L900-D904 HydrophobicContact CD1-CB 4.19Å; L900-D904 CarbonylContact O-C 3.31Å; L900-D904 WeakPolarHBondContact O-CA 3.46Å; L900-D904 PolarHBondContact O-N 3.05Å; K901-D904 CarbonylContact C-O 3.12Å; K901-D904 WeakPolarHBondContact CA-O 3.31Å; K901-D904 VanDerWaalsContact O-O 3.09Å
905	D	71	Confident	70.1	Confident	53 Å²	53	72.3 Å²	72.3	28%	0.283	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-81.1	153.4	179.9	-74.1	-52.7	0	0	0	112.8	T483 R887 L907	T483-D905 HydrophobicContact CG2-CB 4.05Å; R887-D905 PolarHBondContact NH2-O 2.77Å; D905-L907 PolarHBondContact O-N 3.12Å
906	E	63.9	Low	69	Low	131 Å²	131	75.2 Å²	75.2	61%	0.612	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-67.9	128.2	175.6	-77.3	178.7	-175	0	0	111.5	K901 P908	K901-E906 WeakPolarHBondContact CD-OE1 3.45Å; K901-E906 VanDerWaalsContact CE-OE1 3.24Å; K901-E906 WeakPolarHBondContact CE-OE1 3.28Å; K901-E906 HydrophobicContact CG-CG 4.32Å; K901-E906 IonicContact NZ-OE1 3.84Å; K901-E906 PolarHBondContact NZ-OE1 2.94Å; E906-P908 WeakPolarHBondContact O-CD 3.39Å
907	L	62.9	Low	67.9	Low	36 Å²	36	77.9 Å²	77.9	19%	0.188	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-71.2	117.6	171.3	-86.9	143	0	0	0	110.3	R887 D905	R887-L907 HydrophobicContact CG-CD1 4.48Å; R887-L907 VanDerWaalsContact CZ-CD1 3.46Å; R887-L907 VanDerWaalsContact CZ-CG 3.41Å; D905-L907 PolarHBondContact O-N 3.12Å
908	P	63.6	Low	66.7	Low	26 Å²	26	80.2 Å²	80.2	17%	0.169	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-64.5	143.8	172.2	30	-34.9	0	0	0	109.6	S480 E906 V913	S480-P908 WeakPolarHBondContact O-CG 3.27Å; E906-P908 WeakPolarHBondContact O-CD 3.39Å; P908-V913 HydrophobicContact CB-CG2 3.55Å; P908-V913 HydrophobicContact CG-CG2 3.55Å
909	S	61.2	Low	65.3	Low	40 Å²	40	79.6 Å²	79.6	28%	0.28	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-70.8	150.7	177.6	67.7	0	0	0	0	110.6	N911 E912 V913	S909-N911 PolarHBondContact O-N 3.27Å; S909-N911 VanDerWaalsContact O-N 3.09Å; S909-E912 WeakPolarHBondContact CB-OE2 3.48Å; S909-E912 PolarHBondContact N-OE2 2.95Å; S909-E912 PolarHBondContact O-N 3.06Å; S909-E912 WeakPolarHBondContact OG-CG 3.4Å; S909-E912 PolarHBondContact OG-N 3.06Å; S909-E912 PolarHBondContact OG-OE2 3.48Å; S909-V913 PolarHBondContact O-N 3.36Å
910	W	58.7	Low	63.5	Low	157 Å²	157	83.8 Å²	83.8	60%	0.595	40%	0.399	S	S	*	.	H	α-helix	trans	-52.9	-37.8	-179.5	-159.5	83.4	0	0	0	112.1	W481 M914	W481-W910 AromaticContact CH2-CD1 3.96Å; W481-W910 AromaticContact CH2-NE1 3.81Å; W481-W910 AromaticContact CZ2-CD1 3.55Å; W481-W910 AromaticContact CZ2-NE1 3.84Å; W910-M914 HydrophobicContact CD2-CG 4.04Å; W910-M914 HydrophobicContact CE3-CB 4.39Å; W910-M914 HydrophobicContact CE3-CG 4.22Å; W910-M914 HydrophobicContact CH2-CG 4.25Å; W910-M914 HydrophobicContact CZ2-CE 4.13Å; W910-M914 HydrophobicContact CZ2-CG 4.07Å; W910-M914 HydrophobicContact CZ3-CB 4.45Å; W910-M914 HydrophobicContact CZ3-CG 4.32Å; W910-M914 VanDerWaalsContact O-CB 3.27Å; W910-M914 WeakPolarHBondContact O-CB 3.15Å; W910-M914 PolarHBondContact O-N 3.15Å
911	N	65.3	Low	61.3	Low	94 Å²	94	93.1 Å²	93.1	50%	0.503	43%	0.433	S	S	.	.	H	α-helix	trans	-70.7	-30.8	177.8	-72.4	-25.9	0	0	0	113.9	S909 K915	S909-N911 PolarHBondContact O-N 3.27Å; S909-N911 VanDerWaalsContact O-N 3.09Å; N911-K915 WeakPolarHBondContact O-CB 3.37Å; N911-K915 WeakPolarHBondContact O-CD 3.42Å; N911-K915 WeakPolarHBondContact O-CG 3.47Å; N911-K915 PolarHBondContact O-N 3.42Å
912	E	67.3	Low	59.4	Low	111 Å²	111	99.6 Å²	99.6	52%	0.519	45%	0.454	S	S	.	.	H	α-helix	trans	-73.3	-37.2	176.8	-77.2	160.8	159.5	0	0	111.6	S909	S909-E912 WeakPolarHBondContact CB-OE2 3.48Å; S909-E912 PolarHBondContact N-OE2 2.95Å; S909-E912 PolarHBondContact O-N 3.06Å; S909-E912 WeakPolarHBondContact OG-CG 3.4Å; S909-E912 PolarHBondContact OG-N 3.06Å; S909-E912 PolarHBondContact OG-OE2 3.48Å
913	V	63.4	Low	57.5	Low	4 Å²	4	101.5 Å²	101.5	2%	0.024	47%	0.469	C	S	.	.	H	α-helix	trans	-76.4	-44.4	-179.5	-178.3	0	0	0	0	111.3	R337 V477 S480 P908 S909	R337-V913 WeakPolarHBondContact CB-O 3.24Å; R337-V913 PolarHBondContact N-O 3.42Å; V477-V913 HydrophobicContact CG1-CG1 3.34Å; S480-V913 WeakPolarHBondContact OG-CG1 3.29Å; P908-V913 HydrophobicContact CB-CG2 3.55Å; P908-V913 HydrophobicContact CG-CG2 3.55Å; S909-V913 PolarHBondContact O-N 3.36Å
914	M	66.5	Low	55.4	Low	58 Å²	58	109.8 Å²	109.8	29%	0.286	51%	0.505	S	S	.	.	H	α-helix	trans	-83	-23.2	-174.2	-75	-65.4	-167.2	0	0	114.2	W481 W910	W481-M914 HydrophobicContact CH2-CE 4.32Å; W910-M914 HydrophobicContact CD2-CG 4.04Å; W910-M914 HydrophobicContact CE3-CB 4.39Å; W910-M914 HydrophobicContact CE3-CG 4.22Å; W910-M914 HydrophobicContact CH2-CG 4.25Å; W910-M914 HydrophobicContact CZ2-CE 4.13Å; W910-M914 HydrophobicContact CZ2-CG 4.07Å; W910-M914 HydrophobicContact CZ3-CB 4.45Å; W910-M914 HydrophobicContact CZ3-CG 4.32Å; W910-M914 VanDerWaalsContact O-CB 3.27Å; W910-M914 WeakPolarHBondContact O-CB 3.15Å; W910-M914 PolarHBondContact O-N 3.15Å
915	K	63.3	Low	53.3	Low	133 Å²	133	114.6 Å²	114.6	58%	0.578	55%	0.545	S	S	*	.	S	Bend	trans	-70	128.7	177.6	-80.9	176.5	-177	176.8	0	109.6	N911 M917	N911-K915 WeakPolarHBondContact O-CB 3.37Å; N911-K915 WeakPolarHBondContact O-CD 3.42Å; N911-K915 WeakPolarHBondContact O-CG 3.47Å; N911-K915 PolarHBondContact O-N 3.42Å; K915-M917 PolarHBondContact O-N 3.43Å
916	P	60.5	Low	51.5	Low	73 Å²	73	120 Å²	120	47%	0.474	57%	0.572	S	S	.	*			trans	-63	138.3	177.5	26.6	-33.6	0	0	0	110.2	R337 R918	R337-P916 WeakPolarHBondContact O-CA 3.45Å; P916-R918 PolarHBondContact O-N 3.17Å
917	M	55.2	Low	50	Low	119 Å²	119	117.1 Å²	117.1	59%	0.586	57%	0.571	S	S	*	*			trans	-54.1	110.9	179.8	-168.4	-178.8	162.7	0	0	110	R337 K915 R919	R337-M917 PolarHBondContact O-N 3.45Å; K915-M917 PolarHBondContact O-N 3.43Å; M917-R919 PolarHBondContact O-N 3.22Å
918	R	51.1	Low	48.4	Very low	237 Å²	237	122.8 Å²	122.8	89%	0.894	60%	0.601	S	S	*	*			trans	-68.4	107.7	173.8	-82.1	-175.7	167.5	169.2	-3.2	107.6	P916	P916-R918 PolarHBondContact O-N 3.17Å
919	R	43	Very low	46.8	Very low	163 Å²	163	126.6 Å²	126.6	62%	0.615	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-51.8	136.4	166.8	-75.3	-174.5	174.8	-167.6	-6.5	108	R340 M917 R921	R340-R919 VanDerWaalsContact NH1-NH2 3.14Å; M917-R919 PolarHBondContact O-N 3.22Å; R919-R921 PolarHBondContact O-N 3.13Å
920	P	40.8	Very low	45.4	Very low	118 Å²	118	131.9 Å²	131.9	77%	0.766	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-54	117.2	161.5	23	-29.4	0	0	0	105.7	R922	P920-R922 PolarHBondContact O-N 3.27Å
921	R	32.1	Very low	44	Very low	221 Å²	221	129.5 Å²	129.5	83%	0.834	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-51.5	119.4	171.7	-88.6	-179.7	162.8	169	-5.2	104.8	R919 S923	R919-R921 PolarHBondContact O-N 3.13Å; R921-S923 PolarHBondContact O-N 3.44Å; R921-S923 PolarHBondContact O-OG 3.36Å
922	R	34.6	Very low	42.3	Very low	261 Å²	261	131.8 Å²	131.8	99%	0.985	67%	0.673	S	S	*	*			trans	-66	58.1	160.8	-90.8	-176	166.5	177.3	-4.3	107.7	P920 K924	P920-R922 PolarHBondContact O-N 3.27Å; R922-K924 PolarHBondContact O-N 3.46Å
923	S	31.7	Very low	40.3	Very low	87 Å²	87	135 Å²	135	61%	0.608	69%	0.688	S	S	*	*			trans	-87.4	95.5	171.6	48	0	0	0	0	106.9	R921 A925	R921-S923 PolarHBondContact O-N 3.44Å; R921-S923 PolarHBondContact O-OG 3.36Å; S923-A925 PolarHBondContact O-N 3.34Å
924	K	31.5	Very low	38.7	Very low	179 Å²	179	143.8 Å²	143.8	78%	0.778	73%	0.727	S	S	*	*			trans	49.8	58.4	153.4	-63.8	-176.4	174.5	-177	0	116.8	R922 I926	R922-K924 PolarHBondContact O-N 3.46Å; K924-I926 PolarHBondContact O-N 3.07Å; K924-I926 VanDerWaalsContact O-N 3.16Å
925	A	31.8	Very low	36.9	Very low	106 Å²	106	147.1 Å²	147.1	88%	0.876	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	16.9	156.7	0	0	0	0	0	113.1	S923	S923-A925 PolarHBondContact O-N 3.34Å
926	I	32.7	Very low	35.1	Very low	166 Å²	166	149.8 Å²	149.8	85%	0.851	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.5	32.1	178.3	-49.1	176.8	0	0	0	110.4	K924	K924-I926 PolarHBondContact O-N 3.07Å; K924-I926 VanDerWaalsContact O-N 3.16Å
927	A	33.1	Very low	33.7	Very low	71 Å²	71	153.8 Å²	153.8	59%	0.587	78%	0.781	S	S	*	*	S	Bend	trans	-147.3	24.7	173.4	0	0	0	0	0	114.2
928	L	29.1	Very low	32.4	Very low	155 Å²	155	155.7 Å²	155.7	81%	0.812	79%	0.793	S	S	*	*			trans	-141.2	45.2	174.8	-138	95.5	0	0	0	111.9
929	S	29.7	Very low	31.6	Very low	105 Å²	105	150.1 Å²	150.1	73%	0.734	79%	0.787	S	S	*	*	S	Bend	trans	-104.6	-7.2	165.4	57.1	0	0	0	0	113.9
930	D	31.7	Very low	31.1	Very low	151 Å²	151	149.8 Å²	149.8	81%	0.807	80%	0.797	S	S	*	*	S	Bend	trans	-122.3	30	-174.2	-79.1	-17.5	0	0	0	115.4
931	T	29.4	Very low	30.8	Very low	107 Å²	107	149.8 Å²	149.8	66%	0.656	80%	0.8	S	S	*	*			trans	-130.7	90.4	164.1	9.1	0	0	0	0	110.3	Q933	T931-Q933 PolarHBondContact O-N 3.39Å
932	T	28.9	Very low	30.9	Very low	142 Å²	142	148.1 Å²	148.1	87%	0.871	80%	0.802	S	S	*	*			trans	-51.6	75.5	157.9	34.6	0	0	0	0	110.6	K934	T932-K934 VanDerWaalsContact C-N 3.31Å; T932-K934 PolarHBondContact O-N 3.47Å
933	Q	27.2	Very low	30.8	Very low	178 Å²	178	145.7 Å²	145.7	83%	0.832	82%	0.816	S	S	*	*			trans	-76.5	94	161.6	-85.6	-172.5	-17	0	0	108	T931 V935	T931-Q933 PolarHBondContact O-N 3.39Å; Q933-V935 PolarHBondContact O-N 3.49Å; Q933-V935 VanDerWaalsContact O-N 3.12Å
934	K	27.9	Very low	30.7	Very low	190 Å²	190	148.7 Å²	148.7	83%	0.826	83%	0.826	S	S	*	*			trans	-33.1	114.3	159	-72.8	174.5	174.8	177.5	0	109.5	T932 Q936	T932-K934 VanDerWaalsContact C-N 3.31Å; T932-K934 PolarHBondContact O-N 3.47Å; K934-Q936 PolarHBondContact O-N 3.32Å
935	V	29.3	Very low	30.7	Very low	128 Å²	128	147.1 Å²	147.1	78%	0.776	83%	0.829	S	S	*	*			trans	-56.2	102.7	164.7	175.5	0	0	0	0	106.7	Q933 L937	Q933-V935 PolarHBondContact O-N 3.49Å; Q933-V935 VanDerWaalsContact O-N 3.12Å; V935-L937 PolarHBondContact O-N 3.24Å
936	Q	26.1	Very low	30.6	Very low	188 Å²	188	149.3 Å²	149.3	88%	0.879	83%	0.826	S	S	*	*			trans	-67.8	102.1	168.5	-81.2	177.7	-22.6	0	0	107	K934 L938	K934-Q936 PolarHBondContact O-N 3.32Å; Q936-L938 PolarHBondContact O-N 3.17Å
937	L	31	Very low	30.5	Very low	158 Å²	158	148.4 Å²	148.4	83%	0.827	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-58.3	124.4	165.4	-72.5	159.7	0	0	0	107.8	V935	V935-L937 PolarHBondContact O-N 3.24Å
938	L	28.8	Very low	30.4	Very low	159 Å²	159	153.2 Å²	153.2	83%	0.832	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-54.3	138.4	173.1	-79	153.1	0	0	0	109.5	Q936 N940	Q936-L938 PolarHBondContact O-N 3.17Å; L938-N940 PolarHBondContact O-N 3.19Å
939	P	32.9	Very low	30.4	Very low	120 Å²	120	153.1 Å²	153.1	78%	0.779	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-69.7	133	-176.3	-0.8	15.5	0	0	0	109.7	S941	P939-S941 PolarHBondContact O-N 3.03Å
940	N	33.6	Very low	30.5	Very low	155 Å²	155	156.5 Å²	156.5	83%	0.829	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-53.1	119.5	170.1	-72.9	-26.4	0	0	0	109.2	L938 E942	L938-N940 PolarHBondContact O-N 3.19Å; N940-E942 PolarHBondContact O-N 3.27Å
941	S	34.7	Very low	30.4	Very low	118 Å²	118	156.9 Å²	156.9	83%	0.825	85%	0.852	S	S	*	*			trans	-60.1	115	164.1	50.3	0	0	0	0	108.4	P939	P939-S941 PolarHBondContact O-N 3.03Å
942	E	33.9	Very low	30.5	Very low	187 Å²	187	161.1 Å²	161.1	87%	0.874	87%	0.869	S	S	*	*			trans	-53	131.4	172.7	-69.5	172.4	155.3	0	0	110.9	N940	N940-E942 PolarHBondContact O-N 3.27Å
943	V	31.7	Very low	30.6	Very low	210 Å²	210	162.8 Å²	162.8	100%	1.273	87%	0.868	S	S	*	*			trans	-64.9	0	138.5	177.3	0	0	0	0	106.7

Retrieved 943 of 943 residues in 1858.6 ms (Link to these results)

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