A0A087XSR1_POEFO Loading...

Transmembrane channel-like protein

AlphaFold DB , UniProt , Accession A0A087XSR1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 743 aa.

Structure Viewer

Loading PAE data...

(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	28.9	Very low	30.6	Very low	241 Å²	241	147.5 Å²	147.5	100%	1.187	86%	0.864	S	S	*	*				0	104.9	0	-111.4	165.8	162.2	0	0	106.6
2	E	29.2	Very low	31.2	Very low	188 Å²	188	157.3 Å²	157.3	88%	0.879	88%	0.875	S	S	*	*			trans	32.2	106.6	156.9	-67	172.3	161.8	0	0	120.6
3	D	35.2	Very low	31.2	Very low	151 Å²	151	150.5 Å²	150.5	81%	0.807	86%	0.863	S	S	*	*			trans	-57.8	136.3	144.6	-91.1	-43.4	0	0	0	111.6
4	N	27.2	Very low	31.5	Very low	162 Å²	162	157.4 Å²	157.4	87%	0.866	87%	0.868	S	S	*	*			trans	-167.5	93.8	147.6	-93.6	-37.7	0	0	0	109.5
5	S	29.8	Very low	31.5	Very low	110 Å²	110	157.6 Å²	157.6	77%	0.769	87%	0.865	S	S	*	*			trans	-140	79.1	166.2	59	0	0	0	0	111.3
6	V	29.3	Very low	31.8	Very low	127 Å²	127	155.9 Å²	155.9	77%	0.77	86%	0.861	S	S	*	*			trans	-138.9	41.8	168.7	-163.2	0	0	0	0	111.2
7	F	29	Very low	31.9	Very low	214 Å²	214	152 Å²	152	94%	0.939	85%	0.847	S	S	*	*			trans	-149.8	72.8	164	-69.7	-69.4	0	0	0	110.9
8	A	28.8	Very low	32.2	Very low	99 Å²	99	149.6 Å²	149.6	82%	0.818	83%	0.832	S	S	*	*			trans	-136.9	103.8	163	0	0	0	0	0	108.6	G10	A8-G10 PolarHBondContact O-N 3.3Å
9	I	34.9	Very low	32.8	Very low	181 Å²	181	146.8 Å²	146.8	93%	0.928	82%	0.822	S	S	*	*			trans	-90.8	92.7	170.6	-63	174.1	0	0	0	106.5
10	G	28.2	Very low	33.1	Very low	73 Å²	73	145.6 Å²	145.6	75%	0.753	81%	0.813	S	S	*	*			trans	-87.5	131.6	166.6	0	0	0	0	0	110.1	A8	A8-G10 PolarHBondContact O-N 3.3Å
11	G	36.5	Very low	33.5	Very low	76 Å²	76	144.7 Å²	144.7	78%	0.784	81%	0.806	S	S	*	*			trans	-72.5	169	-172.4	0	0	0	0	0	116.2
12	R	37.5	Very low	34	Very low	265 Å²	265	140.2 Å²	140.2	100%	1	79%	0.786	S	S	*	*			trans	76.4	97.1	173	-92.2	178.5	-175.8	-157.3	2	117.2
13	G	31.4	Very low	34.6	Very low	70 Å²	70	138.9 Å²	138.9	72%	0.722	78%	0.78	S	S	*	*	S	Bend	trans	161.5	126.4	159.2	0	0	0	0	0	110.8	I15	G13-I15 PolarHBondContact O-N 3.23Å
14	R	34.5	Very low	34.8	Very low	247 Å²	247	137.3 Å²	137.3	93%	0.932	77%	0.771	S	S	*	*			trans	-45.5	122.9	-174.7	-87.3	176.6	175.7	174.1	-1.4	113.1	T16	R14-T16 PolarHBondContact O-N 3.26Å
15	I	32.8	Very low	35.1	Very low	160 Å²	160	134.3 Å²	134.3	82%	0.821	76%	0.76	S	S	*	*			trans	-73.8	107	167.1	-60.7	169.1	0	0	0	107.6	G13 S17	G13-I15 PolarHBondContact O-N 3.23Å; I15-S17 PolarHBondContact O-N 3.42Å
16	T	35.6	Very low	35.7	Very low	130 Å²	130	132.4 Å²	132.4	80%	0.798	75%	0.747	S	S	*	*			trans	-75.4	97.7	158.3	49.1	0	0	0	0	107.1	R14 N18	R14-T16 PolarHBondContact O-N 3.26Å; T16-N18 PolarHBondContact O-N 2.93Å
17	S	34.2	Very low	36.1	Very low	90 Å²	90	135.4 Å²	135.4	63%	0.629	75%	0.746	S	S	*	*			trans	-58.9	118.1	173.4	50.5	0	0	0	0	109.2	I15 P19	I15-S17 PolarHBondContact O-N 3.42Å; S17-P19 WeakPolarHBondContact O-CD 3.34Å
18	N	36.9	Very low	36.5	Very low	109 Å²	109	132.5 Å²	132.5	58%	0.583	74%	0.735	S	S	*	*			trans	-67.8	116.3	174.8	-120.5	-39.5	0	0	0	108.4	T16 L20 L21	T16-N18 PolarHBondContact O-N 2.93Å; N18-L20 PolarHBondContact O-N 3.2Å; N18-L21 PolarHBondContact O-N 3.24Å
19	P	42.4	Very low	37	Very low	97 Å²	97	130.2 Å²	130.2	63%	0.63	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-2.7	-176.6	27.3	-34.3	0	0	0	113.6	S17	S17-P19 WeakPolarHBondContact O-CD 3.34Å
20	L	40.4	Very low	37.2	Very low	122 Å²	122	127.2 Å²	127.2	64%	0.639	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-26.5	-179	-122	153.8	0	0	0	113.3	N18	N18-L20 PolarHBondContact O-N 3.2Å
21	L	40.8	Very low	37.7	Very low	127 Å²	127	128.8 Å²	128.8	67%	0.665	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-27.2	178.2	-91.4	153.2	0	0	0	112.5	N18 Q23 L24	N18-L21 PolarHBondContact O-N 3.24Å; L21-Q23 VanDerWaalsContact C-N 3.27Å; L21-Q23 PolarHBondContact O-N 2.92Å; L21-L24 HydrophobicContact CD2-CD1 4.25Å
22	D	39.2	Very low	37.6	Very low	146 Å²	146	134 Å²	134	78%	0.781	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-6.8	175.7	-87.1	-16.2	0	0	0	113.9
23	Q	41.5	Very low	37.6	Very low	161 Å²	161	129.6 Å²	129.6	75%	0.752	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-1.1	177.6	-70.3	-170.7	-1.5	0	0	114.1	L21	L21-Q23 VanDerWaalsContact C-N 3.27Å; L21-Q23 PolarHBondContact O-N 2.92Å
24	L	39.2	Very low	37.8	Very low	118 Å²	118	136.4 Å²	136.4	62%	0.618	67%	0.674	S	S	*	*	S	Bend	trans	-73.4	130.2	170.5	-76	161.8	0	0	0	109.1	L21 S26	L21-L24 HydrophobicContact CD2-CD1 4.25Å; L24-S26 PolarHBondContact O-N 3.43Å
25	P	34.8	Very low	37.7	Very low	98 Å²	98	132.7 Å²	132.7	64%	0.636	66%	0.664	S	S	*	*			trans	-67.2	102.3	177.5	26.2	-29.8	0	0	0	108.1	S29	P25-S29 WeakPolarHBondContact CB-OG 3.43Å
26	S	41.8	Very low	37.6	Very low	70 Å²	70	129 Å²	129	49%	0.49	65%	0.653	S	S	.	*			trans	-56.9	147	169.9	73.4	0	0	0	0	108.7	L24 Q28 S29	L24-S26 PolarHBondContact O-N 3.43Å; S26-Q28 PolarHBondContact O-N 3.36Å; S26-S29 WeakPolarHBondContact O-CB 3.24Å; S26-S29 PolarHBondContact O-N 3.38Å; S26-S29 PolarHBondContact O-OG 2.99Å
27	Y	37.7	Very low	37.5	Very low	191 Å²	191	128.2 Å²	128.2	75%	0.749	65%	0.652	S	S	*	*	H	α-helix	trans	-49.6	-21.3	-178.9	-170.2	-99.4	0	0	0	113.8
28	Q	38.1	Very low	37.6	Very low	152 Å²	152	128.9 Å²	128.9	71%	0.71	66%	0.657	S	S	*	*	H	α-helix	trans	-68	-31.3	172.8	-90	170.3	-34.3	0	0	114.7	S26 L30 L31 Y32	S26-Q28 PolarHBondContact O-N 3.36Å; Q28-L30 VanDerWaalsContact C-N 3.33Å; Q28-L30 PolarHBondContact O-N 3.44Å; Q28-L31 PolarHBondContact O-N 3.5Å; Q28-Y32 PolarHBondContact O-N 3.31Å
29	S	37.7	Very low	37.7	Very low	52 Å²	52	128.6 Å²	128.6	36%	0.364	66%	0.659	S	S	.	*	H	α-helix	trans	-68.1	-31.3	179.1	63.7	0	0	0	0	112.8	P25 S26 Y32 R33	P25-S29 WeakPolarHBondContact CB-OG 3.43Å; S26-S29 WeakPolarHBondContact O-CB 3.24Å; S26-S29 PolarHBondContact O-N 3.38Å; S26-S29 PolarHBondContact O-OG 2.99Å; S29-Y32 PolarHBondContact O-N 3.03Å; S29-R33 PolarHBondContact O-N 2.92Å; S29-R33 VanDerWaalsContact O-N 3.14Å
30	L	40.2	Very low	37.1	Very low	118 Å²	118	134 Å²	134	62%	0.618	67%	0.673	S	S	*	*	H	α-helix	trans	-70.3	-30.4	174	-78.9	168.7	0	0	0	112.6	Q28	Q28-L30 VanDerWaalsContact C-N 3.33Å; Q28-L30 PolarHBondContact O-N 3.44Å
31	L	38.7	Very low	36.5	Very low	106 Å²	106	133.9 Å²	133.9	56%	0.555	68%	0.682	S	S	*	*	H	α-helix	trans	-73.5	-33.4	175	-68.7	172	0	0	0	111.9	Q28	Q28-L31 PolarHBondContact O-N 3.5Å
32	Y	33.6	Very low	35.9	Very low	185 Å²	185	139.9 Å²	139.9	73%	0.725	70%	0.696	S	S	*	*	H	α-helix	trans	-73.9	-36.2	176.4	-134.2	-93	0	0	0	112.6	Q28 S29 R34 K35	Q28-Y32 PolarHBondContact O-N 3.31Å; S29-Y32 PolarHBondContact O-N 3.03Å; Y32-R34 VanDerWaalsContact C-N 3.27Å; Y32-R34 PolarHBondContact O-N 3.09Å; Y32-K35 PolarHBondContact O-N 3.41Å; Y32-K35 VanDerWaalsContact O-N 3.09Å
33	R	37.8	Very low	35.3	Very low	172 Å²	172	136.7 Å²	136.7	65%	0.649	70%	0.698	S	S	*	*	H	α-helix	trans	-66.2	-25.6	177.4	-165	177.5	-84.7	-159.1	-3.9	113	S29 K35 E682	S29-R33 PolarHBondContact O-N 2.92Å; S29-R33 VanDerWaalsContact O-N 3.14Å; R33-K35 VanDerWaalsContact C-N 3.33Å; R33-E682 IonicContact NH1-OE1 3.83Å
34	R	35.7	Very low	34.8	Very low	213 Å²	213	134.4 Å²	134.4	80%	0.804	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-20.9	173.4	-149.9	178.2	-150.7	160.9	7.3	113.6	Y32	Y32-R34 VanDerWaalsContact C-N 3.27Å; Y32-R34 PolarHBondContact O-N 3.09Å
35	K	32.7	Very low	34.3	Very low	169 Å²	169	137 Å²	137	74%	0.735	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-17.2	176.1	-101.6	179.9	174.2	179.8	0	113.5	Y32 R33	Y32-K35 PolarHBondContact O-N 3.41Å; Y32-K35 VanDerWaalsContact O-N 3.09Å; R33-K35 VanDerWaalsContact C-N 3.33Å
36	S	30	Very low	34.1	Very low	84 Å²	84	143 Å²	143	59%	0.587	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-85.6	-8.8	-173.9	178.2	0	0	0	0	115	S38	S36-S38 PolarHBondContact O-N 2.7Å
37	S	34	Very low	33.5	Very low	112 Å²	112	142.7 Å²	142.7	78%	0.783	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-85.6	2.6	-173.5	60.5	0	0	0	0	115.4
38	S	35.3	Very low	33.5	Very low	104 Å²	104	145.6 Å²	145.6	73%	0.727	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-112	2.4	177.1	81.1	0	0	0	0	115.3	S36	S36-S38 PolarHBondContact O-N 2.7Å
39	V	39.7	Very low	33.1	Very low	104 Å²	104	146.7 Å²	146.7	63%	0.63	76%	0.757	S	S	*	*	S	Bend	trans	-142.9	93.4	-179.7	-174.2	0	0	0	0	110.4
40	K	30.5	Very low	33	Very low	209 Å²	209	148.7 Å²	148.7	91%	0.909	77%	0.771	S	S	*	*			trans	165.1	106	138	-92	169.8	-176.9	-177.9	0	110.6
41	S	27.8	Very low	32.8	Very low	120 Å²	120	149.5 Å²	149.5	84%	0.839	78%	0.781	S	S	*	*			trans	-142.8	103.7	138	-178.2	0	0	0	0	107.6
42	R	28.6	Very low	32.7	Very low	253 Å²	253	149.2 Å²	149.2	96%	0.955	79%	0.788	S	S	*	*			trans	-168.6	111.1	146.4	-114.2	174	170.2	170	-2.6	110.7
43	G	26.8	Very low	32.8	Very low	80 Å²	80	142.3 Å²	142.3	83%	0.825	77%	0.773	S	S	*	*			trans	-171	68.3	170.8	0	0	0	0	0	110.5
44	S	29.6	Very low	32.7	Very low	113 Å²	113	144 Å²	144	79%	0.79	78%	0.779	S	S	*	*			trans	173.2	106.7	136.6	-166.7	0	0	0	0	109.6
45	L	29.2	Very low	32.9	Very low	173 Å²	173	139.9 Å²	139.9	91%	0.906	77%	0.772	S	S	*	*			trans	-178.4	93.8	150.7	-101.8	143.5	0	0	0	106.6	G47	L45-G47 PolarHBondContact O-N 2.85Å
46	K	31.8	Very low	33.1	Very low	222 Å²	222	137.3 Å²	137.3	97%	0.965	77%	0.767	S	S	*	*			trans	-75.2	110.9	166.3	-111.9	177.2	174.8	177.9	0	106.8
47	G	28.6	Very low	33.5	Very low	65 Å²	65	137.4 Å²	137.4	67%	0.67	76%	0.764	S	S	*	*			trans	-151.6	123.8	169.2	0	0	0	0	0	108.6	L45 L49	L45-G47 PolarHBondContact O-N 2.85Å; G47-L49 PolarHBondContact O-N 3.4Å
48	R	36.9	Very low	34	Very low	252 Å²	252	135.7 Å²	135.7	95%	0.951	75%	0.748	S	S	*	*			trans	-56.3	118.6	-169.3	-67.6	172.4	-179.3	173.7	-0.8	112.6
49	L	31.2	Very low	34.2	Very low	174 Å²	174	134.4 Å²	134.4	91%	0.911	73%	0.733	S	S	*	*			trans	-147	144.8	159.2	-101.5	112.3	0	0	0	110.5	G47	G47-L49 PolarHBondContact O-N 3.4Å
50	S	33.6	Very low	34.3	Very low	95 Å²	95	138.5 Å²	138.5	66%	0.664	74%	0.737	S	S	*	*			trans	-65.8	152.5	-162	67.6	0	0	0	0	115.3	S52 G53	S50-S52 PolarHBondContact O-N 3.47Å; S50-S52 VanDerWaalsContact O-N 3.15Å; S50-G53 PolarHBondContact O-N 2.87Å
51	V	37.8	Very low	34.7	Very low	135 Å²	135	133.5 Å²	133.5	82%	0.818	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-20.5	-172.8	173.2	0	0	0	0	113.5	G53	V51-G53 PolarHBondContact O-N 3.45Å
52	S	36.7	Very low	35.4	Very low	100 Å²	100	133.1 Å²	133.1	70%	0.699	71%	0.705	S	S	*	*	H	α-helix	trans	-74.5	-20.1	-177.4	-162.5	0	0	0	0	114.7	S50	S50-S52 PolarHBondContact O-N 3.47Å; S50-S52 VanDerWaalsContact O-N 3.15Å
53	G	35.7	Very low	35.9	Very low	40 Å²	40	127.5 Å²	127.5	41%	0.412	69%	0.69	S	S	.	*	H	α-helix	trans	-84.2	-18.2	-177.6	0	0	0	0	0	115.1	S50 V51 T57	S50-G53 PolarHBondContact O-N 2.87Å; V51-G53 PolarHBondContact O-N 3.45Å; G53-T57 PolarHBondContact O-OG1 3.45Å
54	R	34.4	Very low	36.5	Very low	208 Å²	208	133 Å²	133	79%	0.785	69%	0.685	S	S	*	*	H	α-helix	trans	-72.1	-38.2	-177.6	-101	-176.8	-175	-164.9	2.2	112.7	T57 V58	R54-T57 PolarHBondContact O-N 3.25Å; R54-V58 WeakPolarHBondContact O-CG2 3.5Å; R54-V58 PolarHBondContact O-N 3.38Å; R54-V58 VanDerWaalsContact O-N 3.11Å
55	L	39.3	Very low	36.8	Very low	125 Å²	125	133.1 Å²	133.1	65%	0.654	67%	0.674	S	S	*	*	H	α-helix	trans	-68.8	-42.9	-174.6	-147.9	74.6	0	0	0	111.9	T57 V58 N59	L55-T57 VanDerWaalsContact C-N 3.31Å; L55-T57 PolarHBondContact O-N 2.87Å; L55-V58 PolarHBondContact O-N 2.86Å; L55-N59 WeakPolarHBondContact O-CB 3.48Å; L55-N59 VanDerWaalsContact O-CG 3.27Å; L55-N59 PolarHBondContact O-N 3.47Å; L55-N59 PolarHBondContact O-OD1 3.28Å
56	N	37.5	Very low	37.1	Very low	116 Å²	116	132.1 Å²	132.1	62%	0.62	66%	0.662	S	S	*	*	H	α-helix	trans	-68.1	-28.7	177.4	-82.3	-5.2	0	0	0	113.7	R60	N56-R60 WeakPolarHBondContact O-CB 3.33Å; N56-R60 PolarHBondContact O-N 2.89Å; N56-R60 VanDerWaalsContact O-N 3.17Å
57	T	39.4	Very low	37.4	Very low	85 Å²	85	123.8 Å²	123.8	52%	0.521	63%	0.632	S	S	.	*	H	α-helix	trans	-80.2	-34.8	-179.6	-46.3	0	0	0	0	111.6	G53 R54 L55 L61	G53-T57 PolarHBondContact O-OG1 3.45Å; R54-T57 PolarHBondContact O-N 3.25Å; L55-T57 VanDerWaalsContact C-N 3.31Å; L55-T57 PolarHBondContact O-N 2.87Å; T57-L61 PolarHBondContact O-N 2.93Å; T57-L61 VanDerWaalsContact O-N 3.09Å
58	V	43.8	Very low	37.8	Very low	76 Å²	76	127 Å²	127	46%	0.461	63%	0.629	S	S	.	*	H	α-helix	trans	-69.1	-45.5	174	173.1	0	0	0	0	110.4	R54 L55 R60 L61 E62	R54-V58 WeakPolarHBondContact O-CG2 3.5Å; R54-V58 PolarHBondContact O-N 3.38Å; R54-V58 VanDerWaalsContact O-N 3.11Å; L55-V58 PolarHBondContact O-N 2.86Å; V58-R60 VanDerWaalsContact C-N 3.33Å; V58-R60 PolarHBondContact O-N 3.32Å; V58-L61 PolarHBondContact O-N 2.95Å; V58-E62 PolarHBondContact O-N 3.42Å
59	N	39.8	Very low	37.9	Very low	77 Å²	77	120.4 Å²	120.4	41%	0.412	61%	0.611	S	S	.	*	H	α-helix	trans	-60.1	-41.3	176.3	-70.2	-1.6	0	0	0	112	L55 L61 E62 E63	L55-N59 WeakPolarHBondContact O-CB 3.48Å; L55-N59 VanDerWaalsContact O-CG 3.27Å; L55-N59 PolarHBondContact O-N 3.47Å; L55-N59 PolarHBondContact O-OD1 3.28Å; N59-L61 PolarHBondContact O-N 3.25Å; N59-E62 PolarHBondContact O-N 2.96Å; N59-E63 WeakPolarHBondContact O-CB 3.38Å; N59-E63 WeakPolarHBondContact O-CG 3.49Å; N59-E63 PolarHBondContact O-N 3.42Å
60	R	41	Very low	38.5	Very low	190 Å²	190	117.1 Å²	117.1	72%	0.717	59%	0.591	S	S	*	*	H	α-helix	trans	-66.8	-31.1	174.3	-95	-175.8	169.1	-174	-1.1	114	N56 V58 R64	N56-R60 WeakPolarHBondContact O-CB 3.33Å; N56-R60 PolarHBondContact O-N 2.89Å; N56-R60 VanDerWaalsContact O-N 3.17Å; V58-R60 VanDerWaalsContact C-N 3.33Å; V58-R60 PolarHBondContact O-N 3.32Å; R60-R64 WeakPolarHBondContact O-CB 3.47Å; R60-R64 PolarHBondContact O-N 3.24Å; R60-R64 VanDerWaalsContact O-N 3.09Å
61	L	39.5	Very low	39	Very low	104 Å²	104	120.6 Å²	120.6	55%	0.545	60%	0.597	S	S	.	*	H	α-helix	trans	-75.8	-38.6	177.2	-122	104.8	0	0	0	111.2	T57 V58 N59 R64 Q65	T57-L61 PolarHBondContact O-N 2.93Å; T57-L61 VanDerWaalsContact O-N 3.09Å; V58-L61 PolarHBondContact O-N 2.95Å; N59-L61 PolarHBondContact O-N 3.25Å; L61-R64 PolarHBondContact O-N 3.29Å; L61-Q65 WeakPolarHBondContact O-CB 3.35Å; L61-Q65 WeakPolarHBondContact O-CG 3.48Å; L61-Q65 PolarHBondContact O-N 3.15Å
62	E	41.4	Very low	39.6	Very low	112 Å²	112	121.6 Å²	121.6	52%	0.523	59%	0.586	S	S	.	*	H	α-helix	trans	-66.9	-40.1	173.9	-76.7	-174.5	154.1	0	0	111.8	V58 N59 R64 Q65 K66	V58-E62 PolarHBondContact O-N 3.42Å; N59-E62 PolarHBondContact O-N 2.96Å; E62-R64 PolarHBondContact O-N 3.36Å; E62-Q65 PolarHBondContact O-N 3.45Å; E62-K66 WeakPolarHBondContact O-CB 3.42Å; E62-K66 PolarHBondContact O-N 3.23Å
63	E	40	Very low	40.6	Very low	136 Å²	136	119.1 Å²	119.1	64%	0.636	57%	0.571	S	S	*	*	H	α-helix	trans	-63	-39	170.9	-80.7	-177.5	152.2	0	0	112.3	N59 K66 S67	N59-E63 WeakPolarHBondContact O-CB 3.38Å; N59-E63 WeakPolarHBondContact O-CG 3.49Å; N59-E63 PolarHBondContact O-N 3.42Å; E63-K66 PolarHBondContact O-N 3.45Å; E63-S67 WeakPolarHBondContact O-CB 3.37Å; E63-S67 PolarHBondContact O-N 2.74Å; E63-S67 PolarHBondContact O-OG 3.09Å
64	R	38.4	Very low	41.7	Very low	194 Å²	194	118.9 Å²	118.9	73%	0.732	56%	0.56	S	S	*	*	H	α-helix	trans	-67.5	-36	174.4	-103.4	-175.9	175.7	-174.3	-0.2	113.1	R60 L61 E62 S67 Q68	R60-R64 WeakPolarHBondContact O-CB 3.47Å; R60-R64 PolarHBondContact O-N 3.24Å; R60-R64 VanDerWaalsContact O-N 3.09Å; L61-R64 PolarHBondContact O-N 3.29Å; E62-R64 PolarHBondContact O-N 3.36Å; R64-S67 VanDerWaalsContact CA-OG 3.29Å; R64-S67 WeakPolarHBondContact CA-OG 3.48Å; R64-S67 PolarHBondContact O-OG 3.31Å; R64-Q68 WeakPolarHBondContact O-CB 3.5Å; R64-Q68 PolarHBondContact O-N 3.14Å
65	Q	36.5	Very low	42.4	Very low	117 Å²	117	113.1 Å²	113.1	55%	0.547	55%	0.552	S	S	.	*	H	α-helix	trans	-72.6	-39.6	174.9	-80.3	-175.8	-32.2	0	0	112	L61 E62 Q68 M69	L61-Q65 WeakPolarHBondContact O-CB 3.35Å; L61-Q65 WeakPolarHBondContact O-CG 3.48Å; L61-Q65 PolarHBondContact O-N 3.15Å; E62-Q65 PolarHBondContact O-N 3.45Å; Q65-Q68 PolarHBondContact O-N 3.41Å; Q65-M69 WeakPolarHBondContact O-CB 3.23Å; Q65-M69 PolarHBondContact O-N 3.48Å
66	K	36.7	Very low	43.1	Very low	151 Å²	151	114 Å²	114	66%	0.657	55%	0.553	S	S	*	*	H	α-helix	trans	-60.1	-48.9	172.2	-96.6	-178	170.8	-178.5	0	111.4	E62 E63 Q68 M69 E70	E62-K66 WeakPolarHBondContact O-CB 3.42Å; E62-K66 PolarHBondContact O-N 3.23Å; E63-K66 PolarHBondContact O-N 3.45Å; K66-Q68 PolarHBondContact O-N 2.84Å; K66-M69 CarbonylContact O-C 3.59Å; K66-M69 PolarHBondContact O-N 2.86Å; K66-M69 VanDerWaalsContact O-N 3.1Å; K66-E70 WeakPolarHBondContact O-CB 3.32Å; K66-E70 WeakPolarHBondContact O-CG 3.29Å; K66-E70 PolarHBondContact O-N 3.05Å
67	S	37.1	Very low	44.6	Very low	48 Å²	48	109.5 Å²	109.5	34%	0.336	53%	0.528	S	S	.	.	H	α-helix	trans	-64.9	-34.6	177.9	51.4	0	0	0	0	113.7	E63 R64 Q71	E63-S67 WeakPolarHBondContact O-CB 3.37Å; E63-S67 PolarHBondContact O-N 2.74Å; E63-S67 PolarHBondContact O-OG 3.09Å; R64-S67 VanDerWaalsContact CA-OG 3.29Å; R64-S67 WeakPolarHBondContact CA-OG 3.48Å; R64-S67 PolarHBondContact O-OG 3.31Å; S67-Q71 PolarHBondContact O-N 3.44Å
68	Q	37.2	Very low	45.6	Very low	132 Å²	132	111.5 Å²	111.5	62%	0.617	54%	0.542	S	S	*	.	H	α-helix	trans	-70.2	-30.8	171.2	-89.4	-173.7	-18.3	0	0	113.5	R64 Q65 K66	R64-Q68 WeakPolarHBondContact O-CB 3.5Å; R64-Q68 PolarHBondContact O-N 3.14Å; Q65-Q68 PolarHBondContact O-N 3.41Å; K66-Q68 PolarHBondContact O-N 2.84Å
69	M	39	Very low	47.1	Very low	114 Å²	114	111.5 Å²	111.5	56%	0.562	54%	0.537	S	S	*	.	H	α-helix	trans	-80	-28.9	176.7	-159.8	177.2	-69.8	0	0	111.9	Q65 K66 Q71 R91	Q65-M69 WeakPolarHBondContact O-CB 3.23Å; Q65-M69 PolarHBondContact O-N 3.48Å; K66-M69 CarbonylContact O-C 3.59Å; K66-M69 PolarHBondContact O-N 2.86Å; K66-M69 VanDerWaalsContact O-N 3.1Å; M69-Q71 VanDerWaalsContact C-N 3.34Å; M69-R91 PolarHBondContact O-NH2 2.89Å
70	E	44.8	Very low	49.1	Very low	104 Å²	104	111.8 Å²	111.8	49%	0.486	54%	0.543	S	S	.	.	H	α-helix	trans	-63.9	-34.4	171.3	-82.5	170.6	177.4	0	0	113.2	K66 R72 R91	K66-E70 WeakPolarHBondContact O-CB 3.32Å; K66-E70 WeakPolarHBondContact O-CG 3.29Å; K66-E70 PolarHBondContact O-N 3.05Å; E70-R72 PolarHBondContact O-N 3.37Å; E70-R91 PolarHBondContact O-NH1 3.32Å
71	Q	44.1	Very low	50.4	Low	169 Å²	169	108.8 Å²	108.8	79%	0.79	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-12.4	-178.4	-76.5	176.6	-12.8	0	0	115	S67 M69	S67-Q71 PolarHBondContact O-N 3.44Å; M69-Q71 VanDerWaalsContact C-N 3.34Å
72	R	50.3	Low	52.1	Low	156 Å²	156	107 Å²	107	59%	0.589	54%	0.539	S	S	*	.	S	Bend	trans	-79.8	139.5	174.1	-68.3	-172.6	-162	176.1	5.8	110.9	E70 I74	E70-R72 PolarHBondContact O-N 3.37Å; R72-I74 PolarHBondContact O-N 3.38Å
73	A	57.8	Low	53.7	Low	48 Å²	48	105.9 Å²	105.9	40%	0.397	53%	0.533	S	S	.	.			trans	-61.5	131.7	175	0	0	0	0	0	109.4	S75 E76	A73-S75 WeakPolarHBondContact CB-OG 3.45Å; A73-S75 PolarHBondContact O-N 3.45Å; A73-E76 HydrophobicContact CB-CG 4.31Å; A73-E76 PolarHBondContact O-N 3.11Å
74	I	56.9	Low	55.4	Low	35 Å²	35	101.2 Å²	101.2	18%	0.179	51%	0.511	C	S	.	.	G	3₁₀ helix	trans	-54.8	-26.8	-178.8	-59.1	172.1	0	0	0	111.5	R72 E76 K84 K88	R72-I74 PolarHBondContact O-N 3.38Å; I74-E76 VanDerWaalsContact C-N 3.33Å; I74-E76 PolarHBondContact O-N 3.05Å; I74-K84 HydrophobicContact CG2-CB 3.85Å; I74-K84 HydrophobicContact CG2-CG 4.02Å; I74-K84 WeakPolarHBondContact O-CD 3.39Å; I74-K84 WeakPolarHBondContact O-CE 3.43Å; I74-K88 HydrophobicContact CD1-CB 3.81Å; I74-K88 HydrophobicContact CD1-CG 4.13Å
75	S	49.2	Very low	57.1	Low	87 Å²	87	99.9 Å²	99.9	61%	0.608	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-62.4	-32.7	174.2	51	0	0	0	0	114.2	A73 K84	A73-S75 WeakPolarHBondContact CB-OG 3.45Å; A73-S75 PolarHBondContact O-N 3.45Å; S75-K84 PolarHBondContact O-NZ 3.09Å
76	E	55.7	Low	59	Low	144 Å²	144	102.9 Å²	102.9	67%	0.673	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-87.4	-8.6	-175.1	-63.7	-178.1	173.1	0	0	113.5	A73 I74	A73-E76 HydrophobicContact CB-CG 4.31Å; A73-E76 PolarHBondContact O-N 3.11Å; I74-E76 VanDerWaalsContact C-N 3.33Å; I74-E76 PolarHBondContact O-N 3.05Å
77	L	68.1	Low	60.8	Low	21 Å²	21	98.9 Å²	98.9	11%	0.11	50%	0.496	C	S	.	.	S	Bend	trans	-72.5	136.9	174.9	-78.4	150.2	0	0	0	109.9	F79 K84	L77-F79 HydrophobicContact CB-CD2 3.64Å; L77-F79 HydrophobicContact CB-CE2 4.08Å; L77-F79 HydrophobicContact CB-CG 4.41Å; L77-F79 HydrophobicContact CD1-CD2 4.43Å; L77-F79 HydrophobicContact CD1-CE2 4.39Å; L77-F79 HydrophobicContact CD2-CD2 4.19Å; L77-F79 HydrophobicContact CD2-CE2 3.72Å; L77-F79 HydrophobicContact CD2-CZ 4.46Å; L77-F79 HydrophobicContact CG-CD2 4.29Å; L77-F79 HydrophobicContact CG-CE2 4.27Å; L77-F79 PolarHBondContact O-N 3.16Å; L77-K84 WeakPolarHBondContact O-CE 3.49Å; L77-K84 PolarHBondContact O-NZ 2.9Å
78	P	61.1	Low	62.5	Low	126 Å²	126	102.3 Å²	102.3	82%	0.818	51%	0.505	S	S	*	.			trans	-80	48.1	179.3	35.1	-36.2	0	0	0	111.3
79	F	75.6	Confident	64.3	Low	77 Å²	77	100.2 Å²	100.2	34%	0.338	50%	0.497	S	S	.	.			trans	-104	149.8	177.7	-65.2	-48.1	0	0	0	111.6	L77 E83 K84	L77-F79 HydrophobicContact CB-CD2 3.64Å; L77-F79 HydrophobicContact CB-CE2 4.08Å; L77-F79 HydrophobicContact CB-CG 4.41Å; L77-F79 HydrophobicContact CD1-CD2 4.43Å; L77-F79 HydrophobicContact CD1-CE2 4.39Å; L77-F79 HydrophobicContact CD2-CD2 4.19Å; L77-F79 HydrophobicContact CD2-CE2 3.72Å; L77-F79 HydrophobicContact CD2-CZ 4.46Å; L77-F79 HydrophobicContact CG-CD2 4.29Å; L77-F79 HydrophobicContact CG-CE2 4.27Å; L77-F79 PolarHBondContact O-N 3.16Å; F79-E83 HydrophobicContact CB-CB 4.33Å; F79-K84 HydrophobicContact CB-CG 4.1Å; F79-K84 WeakPolarHBondContact O-CE 3.46Å
80	P	80.3	Confident	65.9	Low	83 Å²	83	99.7 Å²	99.7	54%	0.539	49%	0.494	S	S	.	.			trans	-52.7	149.7	167.3	-22.8	32.3	0	0	0	112.4	A82 E83 K84	P80-A82 VanDerWaalsContact C-N 3.26Å; P80-A82 PolarHBondContact O-N 3.38Å; P80-E83 WeakPolarHBondContact CD-OE2 3.5Å; P80-E83 PolarHBondContact O-N 3.22Å; P80-K84 PolarHBondContact O-N 3.13Å
81	M	68.8	Low	66.9	Low	127 Å²	127	97.1 Å²	97.1	63%	0.626	48%	0.48	S	S	*	.	H	α-helix	trans	-59.7	-32.5	-176.1	-84.1	-65.6	-73.6	0	0	113.9	E83 K84 R85	M81-E83 VanDerWaalsContact C-N 3.34Å; M81-K84 HydrophobicContact SD-CD 4.24Å; M81-R85 WeakPolarHBondContact O-CG 3.43Å; M81-R85 PolarHBondContact O-N 3.31Å; M81-R85 VanDerWaalsContact O-N 3.11Å
82	A	75.6	Confident	67.7	Low	67 Å²	67	94.3 Å²	94.3	55%	0.554	47%	0.468	S	S	*	.	H	α-helix	trans	-64.7	-40.3	176.1	0	0	0	0	0	111.9	P80 R85 R86	P80-A82 VanDerWaalsContact C-N 3.26Å; P80-A82 PolarHBondContact O-N 3.38Å; A82-R85 PolarHBondContact O-N 3.31Å; A82-R86 PolarHBondContact O-N 2.86Å
83	E	75.6	Confident	68.5	Low	87 Å²	87	93.1 Å²	93.1	41%	0.407	47%	0.469	S	S	.	.	H	α-helix	trans	-75.3	-34.1	-179.1	-162.4	161.9	-152	0	0	111.5	F79 P80 M81 R85 R86 H87	F79-E83 HydrophobicContact CB-CB 4.33Å; P80-E83 WeakPolarHBondContact CD-OE2 3.5Å; P80-E83 PolarHBondContact O-N 3.22Å; M81-E83 VanDerWaalsContact C-N 3.34Å; E83-R85 VanDerWaalsContact C-N 3.34Å; E83-R85 PolarHBondContact O-N 3Å; E83-R86 PolarHBondContact O-N 3.21Å; E83-H87 PolarHBondContact O-CD2 3.41Å; E83-H87 PolarHBondContact O-N 2.77Å
84	K	75	Confident	68.7	Low	38 Å²	38	96.5 Å²	96.5	17%	0.165	48%	0.477	C	S	.	.	H	α-helix	trans	-60.7	-39.2	168.3	-73.5	-176.7	177	175.9	0	113	I74 S75 L77 F79 P80 M81 K88	I74-K84 HydrophobicContact CG2-CB 3.85Å; I74-K84 HydrophobicContact CG2-CG 4.02Å; I74-K84 WeakPolarHBondContact O-CD 3.39Å; I74-K84 WeakPolarHBondContact O-CE 3.43Å; S75-K84 PolarHBondContact O-NZ 3.09Å; L77-K84 WeakPolarHBondContact O-CE 3.49Å; L77-K84 PolarHBondContact O-NZ 2.9Å; F79-K84 HydrophobicContact CB-CG 4.1Å; F79-K84 WeakPolarHBondContact O-CE 3.46Å; P80-K84 PolarHBondContact O-N 3.13Å; M81-K84 HydrophobicContact SD-CD 4.24Å; K84-K88 WeakPolarHBondContact O-CB 3.42Å; K84-K88 PolarHBondContact O-N 3Å; K84-K88 VanDerWaalsContact O-N 3.07Å
85	R	74.5	Confident	68.6	Low	166 Å²	166	99 Å²	99	63%	0.626	48%	0.483	S	S	*	.	H	α-helix	trans	-65	-47	176.3	-74	-179.3	-172.1	-173.7	2.9	110.7	M81 A82 E83 H87 K88 D89	M81-R85 WeakPolarHBondContact O-CG 3.43Å; M81-R85 PolarHBondContact O-N 3.31Å; M81-R85 VanDerWaalsContact O-N 3.11Å; A82-R85 PolarHBondContact O-N 3.31Å; E83-R85 VanDerWaalsContact C-N 3.34Å; E83-R85 PolarHBondContact O-N 3Å; R85-H87 PolarHBondContact O-N 3.17Å; R85-K88 WeakPolarHBondContact O-CA 3.46Å; R85-K88 VanDerWaalsContact O-CB 3.32Å; R85-K88 WeakPolarHBondContact O-CB 3.49Å; R85-K88 PolarHBondContact O-N 3.33Å; R85-D89 PolarHBondContact O-N 3.05Å
86	R	75.9	Confident	69.2	Low	180 Å²	180	102.6 Å²	102.6	68%	0.679	49%	0.488	S	S	*	.	H	α-helix	trans	-58.6	-45.4	176.6	-69	179.6	-178.7	-177.1	-0.6	113.2	A82 E83 K88 D89 Q90	A82-R86 PolarHBondContact O-N 2.86Å; E83-R86 PolarHBondContact O-N 3.21Å; R86-K88 VanDerWaalsContact C-N 3.28Å; R86-K88 PolarHBondContact O-N 3.42Å; R86-D89 PolarHBondContact O-N 3.03Å; R86-Q90 WeakPolarHBondContact O-CB 3.34Å; R86-Q90 WeakPolarHBondContact O-CG 3.32Å; R86-Q90 PolarHBondContact O-N 3.3Å
87	H	73.6	Confident	69.4	Low	67 Å²	67	102.8 Å²	102.8	31%	0.31	49%	0.494	S	S	.	.	H	α-helix	trans	-65	-30.9	175.1	-87.4	-65.5	0	0	0	113.4	E83 R85 R91	E83-H87 PolarHBondContact O-CD2 3.41Å; E83-H87 PolarHBondContact O-N 2.77Å; R85-H87 PolarHBondContact O-N 3.17Å; H87-R91 WeakPolarHBondContact O-CB 3.41Å; H87-R91 WeakPolarHBondContact O-CG 3.42Å; H87-R91 PolarHBondContact O-N 3.44Å; H87-R91 VanDerWaalsContact O-N 3.12Å
88	K	73.7	Confident	68.9	Low	121 Å²	121	104.8 Å²	104.8	53%	0.526	50%	0.504	S	S	.	.	H	α-helix	trans	-69.6	-41.4	174.8	-172.7	-172.9	175.6	-168	0	110.8	I74 K84 R85 R86 R91 M92	I74-K88 HydrophobicContact CD1-CB 3.81Å; I74-K88 HydrophobicContact CD1-CG 4.13Å; K84-K88 WeakPolarHBondContact O-CB 3.42Å; K84-K88 PolarHBondContact O-N 3Å; K84-K88 VanDerWaalsContact O-N 3.07Å; R85-K88 WeakPolarHBondContact O-CA 3.46Å; R85-K88 VanDerWaalsContact O-CB 3.32Å; R85-K88 WeakPolarHBondContact O-CB 3.49Å; R85-K88 PolarHBondContact O-N 3.33Å; R86-K88 VanDerWaalsContact C-N 3.28Å; R86-K88 PolarHBondContact O-N 3.42Å; K88-R91 PolarHBondContact O-N 3.46Å; K88-M92 WeakPolarHBondContact O-CG 3.47Å; K88-M92 PolarHBondContact O-N 3.06Å
89	D	74	Confident	69.1	Low	87 Å²	87	102.3 Å²	102.3	47%	0.465	49%	0.49	S	S	.	.	H	α-helix	trans	-69.6	-43.5	-179.9	-60.4	-26.9	0	0	0	110.8	R85 R86 R91 M92 E93	R85-D89 PolarHBondContact O-N 3.05Å; R86-D89 PolarHBondContact O-N 3.03Å; D89-R91 PolarHBondContact O-N 2.88Å; D89-M92 WeakPolarHBondContact O-CA 3.44Å; D89-M92 WeakPolarHBondContact O-CB 3.49Å; D89-M92 PolarHBondContact O-N 2.83Å; D89-E93 PolarHBondContact O-N 3.5Å
90	Q	73	Confident	68.7	Low	103 Å²	103	103.3 Å²	103.3	48%	0.481	51%	0.507	S	S	.	.	H	α-helix	trans	-58.4	-45.3	172.3	-75.9	176.4	-18.1	0	0	112.5	R86 M92 E93 E94	R86-Q90 WeakPolarHBondContact O-CB 3.34Å; R86-Q90 WeakPolarHBondContact O-CG 3.32Å; R86-Q90 PolarHBondContact O-N 3.3Å; Q90-M92 PolarHBondContact O-N 3.17Å; Q90-E93 PolarHBondContact O-N 3.36Å; Q90-E94 WeakPolarHBondContact O-CG 3.44Å; Q90-E94 PolarHBondContact O-N 2.92Å
91	R	66.6	Low	67.8	Low	51 Å²	51	104.1 Å²	104.1	19%	0.192	51%	0.513	C	S	.	.	H	α-helix	trans	-68.4	-17.4	174.6	-75.2	-171.3	-169.9	175.6	4.2	113.6	M69 E70 H87 K88 D89 R95	M69-R91 PolarHBondContact O-NH2 2.89Å; E70-R91 PolarHBondContact O-NH1 3.32Å; H87-R91 WeakPolarHBondContact O-CB 3.41Å; H87-R91 WeakPolarHBondContact O-CG 3.42Å; H87-R91 PolarHBondContact O-N 3.44Å; H87-R91 VanDerWaalsContact O-N 3.12Å; K88-R91 PolarHBondContact O-N 3.46Å; D89-R91 PolarHBondContact O-N 2.88Å; R91-R95 WeakPolarHBondContact O-CD 3.47Å; R91-R95 WeakPolarHBondContact O-CG 3.41Å; R91-R95 PolarHBondContact O-NE 2.9Å
92	M	61.3	Low	67.6	Low	110 Å²	110	105.8 Å²	105.8	54%	0.542	51%	0.513	S	S	.	.	H	α-helix	trans	-84.1	-32	173.4	-72.4	-121.2	-75.9	0	0	111.4	K88 D89 Q90	K88-M92 WeakPolarHBondContact O-CG 3.47Å; K88-M92 PolarHBondContact O-N 3.06Å; D89-M92 WeakPolarHBondContact O-CA 3.44Å; D89-M92 WeakPolarHBondContact O-CB 3.49Å; D89-M92 PolarHBondContact O-N 2.83Å; Q90-M92 PolarHBondContact O-N 3.17Å
93	E	67.3	Low	67.2	Low	131 Å²	131	106.2 Å²	106.2	61%	0.612	50%	0.503	S	S	*	.	H	α-helix	trans	-69.6	-52.1	172	-102.9	171	166.3	0	0	112	D89 Q90 R95 K96	D89-E93 PolarHBondContact O-N 3.5Å; Q90-E93 PolarHBondContact O-N 3.36Å; E93-R95 PolarHBondContact O-N 3.09Å; E93-K96 WeakPolarHBondContact O-CB 3.45Å; E93-K96 PolarHBondContact O-N 3.27Å
94	E	62.1	Low	67	Low	119 Å²	119	111.3 Å²	111.3	56%	0.556	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-20.8	176.6	-70.2	174	166.3	0	0	112.9	Q90	Q90-E94 WeakPolarHBondContact O-CG 3.44Å; Q90-E94 PolarHBondContact O-N 2.92Å
95	R	53.8	Low	67	Low	86 Å²	86	118.9 Å²	118.9	33%	0.325	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-26.5	175.7	-85.2	175.2	-166.4	-85.9	-3.2	114.1	R91 E93 D97 Q103 E106	R91-R95 WeakPolarHBondContact O-CD 3.47Å; R91-R95 WeakPolarHBondContact O-CG 3.41Å; R91-R95 PolarHBondContact O-NE 2.9Å; E93-R95 PolarHBondContact O-N 3.09Å; R95-D97 PolarHBondContact O-N 3.09Å; R95-Q103 PolarHBondContact O-NE2 2.99Å; R95-E106 IonicContact CZ-OE2 3.97Å; R95-E106 IonicContact NH1-OE2 2.99Å; R95-E106 PolarHBondContact NH1-OE2 3.1Å
96	K	60.8	Low	67	Low	163 Å²	163	114.7 Å²	114.7	71%	0.709	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-23.8	179	-69.6	179.2	-179.7	176.6	0	111.5	E93	E93-K96 WeakPolarHBondContact O-CB 3.45Å; E93-K96 PolarHBondContact O-N 3.27Å
97	D	59.8	Low	66.9	Low	148 Å²	148	107.5 Å²	107.5	79%	0.791	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-1	-176.6	-62.7	-20.4	0	0	0	114.6	R95	R95-D97 PolarHBondContact O-N 3.09Å
98	L	57.7	Low	66.8	Low	63 Å²	63	106.5 Å²	106.5	33%	0.33	52%	0.519	S	S	.	.	S	Bend	trans	-89	139.8	179.6	-84.8	153.5	0	0	0	112.4	Q103	L98-Q103 HydrophobicContact CB-CG 4.3Å; L98-Q103 PolarHBondContact O-NE2 3.44Å; L98-Q103 VanDerWaalsContact O-NE2 3.1Å
99	S	65.4	Low	66.9	Low	74 Å²	74	104.4 Å²	104.4	52%	0.517	52%	0.519	S	S	.	.			trans	-55.2	141.4	-178.6	72.7	0	0	0	0	113.8	C101 R102 Q103	S99-C101 PolarHBondContact O-N 3.01Å; S99-R102 PolarHBondContact O-N 3.31Å; S99-Q103 PolarHBondContact O-N 2.91Å; S99-Q103 VanDerWaalsContact O-N 3.13Å
100	S	68.6	Low	67.1	Low	98 Å²	98	105.3 Å²	105.3	69%	0.685	52%	0.516	S	S	*	.	H	α-helix	trans	-53.1	-30.4	-173.2	-61.9	0	0	0	0	114.8	W104	S100-W104 PolarHBondContact O-N 3.47Å
101	C	60.6	Low	67.3	Low	100 Å²	100	107.5 Å²	107.5	68%	0.676	52%	0.521	S	S	*	.	H	α-helix	trans	-71.4	-38.5	178	-171.1	0	0	0	0	112.7	S99 R105	S99-C101 PolarHBondContact O-N 3.01Å; C101-R105 PolarHBondContact O-N 2.91Å; C101-R105 VanDerWaalsContact O-N 3.12Å
102	R	63.7	Low	67.3	Low	163 Å²	163	111.2 Å²	111.2	62%	0.615	54%	0.542	S	S	*	.	H	α-helix	trans	-71	-38.3	174.2	-77.8	-174	177.2	-172.5	1.1	111.3	S99 W104 R105 E106	S99-R102 PolarHBondContact O-N 3.31Å; R102-W104 PolarHBondContact O-N 3.05Å; R102-R105 PolarHBondContact O-N 2.9Å; R102-E106 WeakPolarHBondContact O-CB 3.5Å; R102-E106 WeakPolarHBondContact O-CG 3.36Å; R102-E106 PolarHBondContact O-N 3.45Å
103	Q	68	Low	68	Low	75 Å²	75	112.6 Å²	112.6	35%	0.35	55%	0.545	S	S	.	.	H	α-helix	trans	-59.6	-42.9	173.8	-74.9	176.1	-15.5	0	0	112.3	R95 L98 S99 G107	R95-Q103 PolarHBondContact O-NE2 2.99Å; L98-Q103 HydrophobicContact CB-CG 4.3Å; L98-Q103 PolarHBondContact O-NE2 3.44Å; L98-Q103 VanDerWaalsContact O-NE2 3.1Å; S99-Q103 PolarHBondContact O-N 2.91Å; S99-Q103 VanDerWaalsContact O-N 3.13Å; Q103-G107 PolarHBondContact O-N 3.25Å
104	W	71.6	Confident	68.7	Low	195 Å²	195	113.9 Å²	113.9	74%	0.739	54%	0.544	S	S	*	.	H	α-helix	trans	-66.2	-45.3	176.7	-177.3	83	0	0	0	112.5	S100 R102 E106 G107 A108	S100-W104 PolarHBondContact O-N 3.47Å; R102-W104 PolarHBondContact O-N 3.05Å; W104-E106 PolarHBondContact O-N 2.94Å; W104-G107 CarbonylContact O-C 3.58Å; W104-G107 WeakPolarHBondContact O-CA 3.39Å; W104-G107 PolarHBondContact O-N 3.45Å; W104-G107 VanDerWaalsContact O-N 3.11Å; W104-A108 PolarHBondContact O-N 3.41Å
105	R	75	Confident	69.2	Low	197 Å²	197	112.1 Å²	112.1	74%	0.743	54%	0.538	S	S	*	.	H	α-helix	trans	-62.1	-42	178.3	-173.4	176.4	177.5	-178.6	-0.4	112.4	C101 R102 G107 S109	C101-R105 PolarHBondContact O-N 2.91Å; C101-R105 VanDerWaalsContact O-N 3.12Å; R102-R105 PolarHBondContact O-N 2.9Å; R105-G107 VanDerWaalsContact C-N 3.35Å; R105-S109 WeakPolarHBondContact O-CB 3.43Å; R105-S109 PolarHBondContact O-N 3.18Å
106	E	73.7	Confident	70	Confident	78 Å²	78	113.6 Å²	113.6	36%	0.364	55%	0.551	S	S	.	*	H	α-helix	trans	-70.3	-31.1	173.5	-73.1	-173.5	-163.4	0	0	112.8	R95 R102 W104 R110	R95-E106 IonicContact CZ-OE2 3.97Å; R95-E106 IonicContact NH1-OE2 2.99Å; R95-E106 PolarHBondContact NH1-OE2 3.1Å; R102-E106 WeakPolarHBondContact O-CB 3.5Å; R102-E106 WeakPolarHBondContact O-CG 3.36Å; R102-E106 PolarHBondContact O-N 3.45Å; W104-E106 PolarHBondContact O-N 2.94Å; E106-R110 WeakPolarHBondContact O-CB 2.8Å; E106-R110 VanDerWaalsContact O-CG 3.24Å; E106-R110 WeakPolarHBondContact O-CG 3.2Å; E106-R110 PolarHBondContact O-N 3.35Å; E106-R110 VanDerWaalsContact O-N 3.1Å; E106-R110 PolarHBondContact O-NE 3.11Å
107	G	74.8	Confident	70.6	Confident	28 Å²	28	110 Å²	110	29%	0.289	54%	0.539	S	S	.	.	H	α-helix	trans	-63.1	-50.5	171.6	0	0	0	0	0	111.8	Q103 W104 R105 R110 Y111	Q103-G107 PolarHBondContact O-N 3.25Å; W104-G107 CarbonylContact O-C 3.58Å; W104-G107 WeakPolarHBondContact O-CA 3.39Å; W104-G107 PolarHBondContact O-N 3.45Å; W104-G107 VanDerWaalsContact O-N 3.11Å; R105-G107 VanDerWaalsContact C-N 3.35Å; G107-R110 PolarHBondContact O-N 3.37Å; G107-Y111 WeakPolarHBondContact O-CB 3.38Å; G107-Y111 PolarHBondContact O-N 3.21Å
108	A	71.6	Confident	71.1	Confident	46 Å²	46	108 Å²	108	38%	0.38	53%	0.528	S	S	.	.	H	α-helix	trans	-62.6	-43.9	178.4	0	0	0	0	0	112.3	W104 R110 Y111 M112	W104-A108 PolarHBondContact O-N 3.41Å; A108-R110 PolarHBondContact O-N 3.03Å; A108-Y111 PolarHBondContact O-N 3.28Å; A108-M112 WeakPolarHBondContact O-CB 3.33Å; A108-M112 PolarHBondContact O-N 2.97Å
109	S	75	Confident	71.6	Confident	78 Å²	78	107.7 Å²	107.7	55%	0.545	54%	0.535	S	S	.	.	H	α-helix	trans	-62.6	-41.1	176.2	179.9	0	0	0	0	112.3	R105 K113	R105-S109 WeakPolarHBondContact O-CB 3.43Å; R105-S109 PolarHBondContact O-N 3.18Å; S109-K113 WeakPolarHBondContact O-CB 3.19Å; S109-K113 PolarHBondContact O-N 2.92Å
110	R	77.9	Confident	71.7	Confident	106 Å²	106	109.9 Å²	109.9	40%	0.4	54%	0.537	S	S	.	.	H	α-helix	trans	-68.9	-40	176.2	-75.5	-179.2	-68.4	169.7	-0.4	112.3	E106 G107 A108 K113 R114	E106-R110 WeakPolarHBondContact O-CB 2.8Å; E106-R110 VanDerWaalsContact O-CG 3.24Å; E106-R110 WeakPolarHBondContact O-CG 3.2Å; E106-R110 PolarHBondContact O-N 3.35Å; E106-R110 VanDerWaalsContact O-N 3.1Å; E106-R110 PolarHBondContact O-NE 3.11Å; G107-R110 PolarHBondContact O-N 3.37Å; A108-R110 PolarHBondContact O-N 3.03Å; R110-K113 PolarHBondContact O-N 3.46Å; R110-R114 WeakPolarHBondContact O-CB 3.42Å; R110-R114 VanDerWaalsContact O-CG 3.3Å; R110-R114 WeakPolarHBondContact O-CG 3.43Å; R110-R114 PolarHBondContact O-N 3.12Å
111	Y	78.4	Confident	71.5	Confident	148 Å²	148	107.3 Å²	107.3	58%	0.58	52%	0.522	S	S	*	.	H	α-helix	trans	-64	-44.8	176.1	-177.3	-107.7	0	0	0	111.2	G107 A108 K113 R114 L115	G107-Y111 WeakPolarHBondContact O-CB 3.38Å; G107-Y111 PolarHBondContact O-N 3.21Å; A108-Y111 PolarHBondContact O-N 3.28Å; Y111-K113 VanDerWaalsContact C-N 3.34Å; Y111-K113 PolarHBondContact O-N 2.96Å; Y111-R114 PolarHBondContact O-N 3.48Å; Y111-L115 HydrophobicContact CD1-CD1 3.85Å; Y111-L115 HydrophobicContact CD1-CG 4.37Å; Y111-L115 HydrophobicContact CE1-CD1 3.31Å; Y111-L115 HydrophobicContact CE1-CG 4Å; Y111-L115 HydrophobicContact CE2-CG 4.37Å; Y111-L115 WeakPolarHBondContact O-CG 3.38Å; Y111-L115 PolarHBondContact O-N 3.07Å
112	M	66.6	Low	71.6	Confident	129 Å²	129	109.1 Å²	109.1	64%	0.635	52%	0.518	S	S	*	.	H	α-helix	trans	-64.8	-38.8	176.4	-161.8	-128.9	-75.6	0	0	112	A108 L115 M116	A108-M112 WeakPolarHBondContact O-CB 3.33Å; A108-M112 PolarHBondContact O-N 2.97Å; M112-L115 PolarHBondContact O-N 2.85Å; M112-M116 WeakPolarHBondContact O-CB 3.29Å; M112-M116 PolarHBondContact O-N 2.78Å
113	K	75.6	Confident	71.4	Confident	140 Å²	140	103.9 Å²	103.9	61%	0.609	50%	0.502	S	S	*	.	H	α-helix	trans	-65.1	-42.6	174.6	-167.3	171.3	-176.6	177.5	0	111.9	S109 R110 Y111 M116 D117	S109-K113 WeakPolarHBondContact O-CB 3.19Å; S109-K113 PolarHBondContact O-N 2.92Å; R110-K113 PolarHBondContact O-N 3.46Å; Y111-K113 VanDerWaalsContact C-N 3.34Å; Y111-K113 PolarHBondContact O-N 2.96Å; K113-M116 PolarHBondContact O-N 2.98Å; K113-D117 WeakPolarHBondContact O-CB 3.39Å; K113-D117 PolarHBondContact O-N 3.43Å
114	R	81.5	Confident	71	Confident	157 Å²	157	103.8 Å²	103.8	59%	0.592	51%	0.51	S	S	*	.	H	α-helix	trans	-61.8	-47.8	173.7	-75.6	176.9	-171.3	168.8	1.2	111.8	R110 Y111 M116 D117 D118	R110-R114 WeakPolarHBondContact O-CB 3.42Å; R110-R114 VanDerWaalsContact O-CG 3.3Å; R110-R114 WeakPolarHBondContact O-CG 3.43Å; R110-R114 PolarHBondContact O-N 3.12Å; Y111-R114 PolarHBondContact O-N 3.48Å; R114-M116 PolarHBondContact O-N 2.91Å; R114-D117 CarbonylContact O-C 3.58Å; R114-D117 PolarHBondContact O-N 3.24Å; R114-D118 VanDerWaalsContact O-CB 3.25Å; R114-D118 WeakPolarHBondContact O-CB 3.44Å; R114-D118 PolarHBondContact O-N 3.38Å
115	L	72.4	Confident	69.9	Low	82 Å²	82	97.9 Å²	97.9	43%	0.429	50%	0.499	S	S	.	.	H	α-helix	trans	-58.9	-38.1	175.1	-76.8	180	0	0	0	112.2	Y111 M112 A119	Y111-L115 HydrophobicContact CD1-CD1 3.85Å; Y111-L115 HydrophobicContact CD1-CG 4.37Å; Y111-L115 HydrophobicContact CE1-CD1 3.31Å; Y111-L115 HydrophobicContact CE1-CG 4Å; Y111-L115 HydrophobicContact CE2-CG 4.37Å; Y111-L115 WeakPolarHBondContact O-CG 3.38Å; Y111-L115 PolarHBondContact O-N 3.07Å; M112-L115 PolarHBondContact O-N 2.85Å; L115-A119 WeakPolarHBondContact O-CB 3.45Å; L115-A119 PolarHBondContact O-N 3.1Å
116	M	72.1	Confident	69.1	Low	118 Å²	118	91.9 Å²	91.9	58%	0.581	48%	0.48	S	S	*	.	H	α-helix	trans	-70.6	-39.6	177.1	-172.8	136.6	174.6	0	0	112.3	M112 K113 R114 H120	M112-M116 WeakPolarHBondContact O-CB 3.29Å; M112-M116 PolarHBondContact O-N 2.78Å; K113-M116 PolarHBondContact O-N 2.98Å; R114-M116 PolarHBondContact O-N 2.91Å; M116-H120 VanDerWaalsContact O-CB 3.26Å; M116-H120 WeakPolarHBondContact O-CB 3.44Å; M116-H120 PolarHBondContact O-N 3.19Å
117	D	71.6	Confident	68.4	Low	88 Å²	88	95.3 Å²	95.3	47%	0.471	49%	0.493	S	S	.	.	H	α-helix	trans	-69.2	-38.9	175.7	-69.5	-25.4	0	0	0	110.9	K113 R114 H120 A121	K113-D117 WeakPolarHBondContact O-CB 3.39Å; K113-D117 PolarHBondContact O-N 3.43Å; R114-D117 CarbonylContact O-C 3.58Å; R114-D117 PolarHBondContact O-N 3.24Å; D117-H120 PolarHBondContact O-N 2.82Å; D117-A121 WeakPolarHBondContact O-CA 3.46Å; D117-A121 WeakPolarHBondContact O-CB 3.2Å; D117-A121 PolarHBondContact O-N 2.77Å
118	D	71.9	Confident	68.1	Low	104 Å²	104	96.7 Å²	96.7	56%	0.556	49%	0.494	S	S	*	.	H	α-helix	trans	-70.9	-40.6	176	-70.9	-23.4	0	0	0	111.3	R114 H120 A121 F122	R114-D118 VanDerWaalsContact O-CB 3.25Å; R114-D118 WeakPolarHBondContact O-CB 3.44Å; R114-D118 PolarHBondContact O-N 3.38Å; D118-H120 VanDerWaalsContact C-N 3.34Å; D118-A121 CarbonylContact O-C 3.58Å; D118-A121 PolarHBondContact O-N 3.03Å; D118-F122 VanDerWaalsContact O-CB 3.23Å; D118-F122 WeakPolarHBondContact O-CB 3.3Å; D118-F122 PolarHBondContact O-N 2.93Å
119	A	67.8	Low	68.6	Low	58 Å²	58	95 Å²	95	48%	0.479	48%	0.478	S	S	.	.	H	α-helix	trans	-64.3	-41.3	171.7	0	0	0	0	0	110.5	L115 F122 L123	L115-A119 WeakPolarHBondContact O-CB 3.45Å; L115-A119 PolarHBondContact O-N 3.1Å; A119-F122 PolarHBondContact O-N 3.09Å; A119-L123 VanDerWaalsContact O-CB 3.26Å; A119-L123 WeakPolarHBondContact O-CB 3.44Å; A119-L123 PolarHBondContact O-N 3.42Å
120	H	67.7	Low	68.9	Low	119 Å²	119	98.6 Å²	98.6	55%	0.551	48%	0.479	S	S	*	.	H	α-helix	trans	-66.9	-40.1	175.1	-166.9	4.2	0	0	0	111.5	M116 D117 D118 L123 S124	M116-H120 VanDerWaalsContact O-CB 3.26Å; M116-H120 WeakPolarHBondContact O-CB 3.44Å; M116-H120 PolarHBondContact O-N 3.19Å; D117-H120 PolarHBondContact O-N 2.82Å; D118-H120 VanDerWaalsContact C-N 3.34Å; H120-L123 PolarHBondContact O-N 3.42Å; H120-S124 WeakPolarHBondContact O-CB 3.47Å; H120-S124 PolarHBondContact O-N 3.42Å; H120-S124 PolarHBondContact O-OG 3.49Å
121	A	64	Low	69	Low	45 Å²	45	98 Å²	98	37%	0.372	49%	0.491	S	S	.	.	H	α-helix	trans	-63	-46.9	175.7	0	0	0	0	0	110.1	D117 D118 S124 S125	D117-A121 WeakPolarHBondContact O-CA 3.46Å; D117-A121 WeakPolarHBondContact O-CB 3.2Å; D117-A121 PolarHBondContact O-N 2.77Å; D118-A121 CarbonylContact O-C 3.58Å; D118-A121 PolarHBondContact O-N 3.03Å; A121-S124 WeakPolarHBondContact CA-OG 3.48Å; A121-S124 CarbonylContact O-C 3.3Å; A121-S124 PolarHBondContact O-N 2.95Å; A121-S124 VanDerWaalsContact O-N 3.15Å; A121-S124 PolarHBondContact O-OG 3.42Å; A121-S125 WeakPolarHBondContact O-CA 3.32Å; A121-S125 WeakPolarHBondContact O-CB 3.11Å; A121-S125 PolarHBondContact O-N 3.05Å; A121-S125 PolarHBondContact O-OG 2.97Å
122	F	62.2	Low	69.3	Low	137 Å²	137	92.6 Å²	92.6	60%	0.601	47%	0.472	S	S	*	.	H	α-helix	trans	-59.6	-46.4	173.8	-174.9	-100.2	0	0	0	111.6	D118 A119 S124 S125 M126	D118-F122 VanDerWaalsContact O-CB 3.23Å; D118-F122 WeakPolarHBondContact O-CB 3.3Å; D118-F122 PolarHBondContact O-N 2.93Å; A119-F122 PolarHBondContact O-N 3.09Å; F122-S124 PolarHBondContact O-N 2.95Å; F122-S125 WeakPolarHBondContact CA-OG 3.43Å; F122-S125 PolarHBondContact O-N 3.27Å; F122-S125 PolarHBondContact O-OG 3.14Å; F122-S125 VanDerWaalsContact O-OG 3.1Å; F122-M126 HydrophobicContact CE1-CG 4.48Å; F122-M126 HydrophobicContact CE1-SD 4.13Å; F122-M126 WeakPolarHBondContact O-CG 3.2Å; F122-M126 PolarHBondContact O-N 3.24Å
123	L	61	Low	70.2	Confident	54 Å²	54	87.1 Å²	87.1	28%	0.283	45%	0.446	S	S	.	.	H	α-helix	trans	-65.8	-27.7	176.8	-146.1	107.8	0	0	0	112.9	A119 H120 I160 W262	A119-L123 VanDerWaalsContact O-CB 3.26Å; A119-L123 WeakPolarHBondContact O-CB 3.44Å; A119-L123 PolarHBondContact O-N 3.42Å; H120-L123 PolarHBondContact O-N 3.42Å; L123-I160 HydrophobicContact CD1-CD1 3.85Å; L123-W262 HydrophobicContact CD1-CH2 4.23Å; L123-W262 HydrophobicContact CD2-CH2 3.8Å; L123-W262 HydrophobicContact CD2-CZ2 3.49Å; L123-W262 VanDerWaalsContact CD2-CZ2 3.49Å
124	S	58.2	Low	70.4	Confident	73 Å²	73	84.9 Å²	84.9	51%	0.51	44%	0.437	S	S	.	.	H	α-helix	trans	-87.4	-27	175.5	77.7	0	0	0	0	113.3	H120 A121 F122	H120-S124 WeakPolarHBondContact O-CB 3.47Å; H120-S124 PolarHBondContact O-N 3.42Å; H120-S124 PolarHBondContact O-OG 3.49Å; A121-S124 WeakPolarHBondContact CA-OG 3.48Å; A121-S124 CarbonylContact O-C 3.3Å; A121-S124 PolarHBondContact O-N 2.95Å; A121-S124 VanDerWaalsContact O-N 3.15Å; A121-S124 PolarHBondContact O-OG 3.42Å; F122-S124 PolarHBondContact O-N 2.95Å
125	S	49.8	Very low	70.4	Confident	71 Å²	71	82.2 Å²	82.2	50%	0.497	43%	0.432	S	S	.	.	H	α-helix	trans	-84.8	-20	179.5	79.6	0	0	0	0	111.6	A121 F122 K127	A121-S125 WeakPolarHBondContact O-CA 3.32Å; A121-S125 WeakPolarHBondContact O-CB 3.11Å; A121-S125 PolarHBondContact O-N 3.05Å; A121-S125 PolarHBondContact O-OG 2.97Å; F122-S125 WeakPolarHBondContact CA-OG 3.43Å; F122-S125 PolarHBondContact O-N 3.27Å; F122-S125 PolarHBondContact O-OG 3.14Å; F122-S125 VanDerWaalsContact O-OG 3.1Å; S125-K127 PolarHBondContact O-N 3.5Å
126	M	56.7	Low	70.8	Confident	71 Å²	71	78.3 Å²	78.3	35%	0.35	41%	0.411	S	S	.	.			trans	-58.7	71.3	151.1	-71.8	-172.1	79	0	0	108.9	F122 L128 L159	F122-M126 HydrophobicContact CE1-CG 4.48Å; F122-M126 HydrophobicContact CE1-SD 4.13Å; F122-M126 WeakPolarHBondContact O-CG 3.2Å; F122-M126 PolarHBondContact O-N 3.24Å; M126-L128 PolarHBondContact O-N 2.91Å; M126-L159 HydrophobicContact CE-CD2 4.24Å
127	K	59.8	Low	71.1	Confident	149 Å²	149	75.4 Å²	75.4	65%	0.648	40%	0.396	S	S	*	.			trans	-69.3	29.5	171.3	-70	175.8	179.6	172.9	0	110.8	S125 W129 R130	S125-K127 PolarHBondContact O-N 3.5Å; K127-W129 PolarHBondContact O-N 3.29Å; K127-W129 VanDerWaalsContact O-N 3.08Å; K127-R130 PolarHBondContact O-N 3.04Å
128	L	68.8	Low	71	Confident	58 Å²	58	72.6 Å²	72.6	30%	0.304	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	118.8	-179.1	-159	83	0	0	0	108	M126 R130 R152 F552	M126-L128 PolarHBondContact O-N 2.91Å; L128-R130 VanDerWaalsContact C-N 3.25Å; L128-R130 PolarHBondContact O-N 3.06Å; L128-R130 VanDerWaalsContact O-N 3.16Å; L128-R152 WeakPolarHBondContact O-CD 3.39Å; L128-F552 HydrophobicContact CD1-CE2 4.31Å; L128-F552 HydrophobicContact CD2-CD2 4.17Å; L128-F552 HydrophobicContact CD2-CE2 4.03Å
129	W	81.2	Confident	71.1	Confident	11 Å²	11	72 Å²	72	4%	0.042	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.4	17	178.4	-47.5	-48.7	0	0	0	117.1	K127 S131 D132 I133 R152 V155 F552 F555 Y556	K127-W129 PolarHBondContact O-N 3.29Å; K127-W129 VanDerWaalsContact O-N 3.08Å; W129-S131 VanDerWaalsContact C-N 3.26Å; W129-S131 PolarHBondContact O-N 3.48Å; W129-D132 HydrophobicContact CB-CB 4.18Å; W129-D132 PolarHBondContact O-N 2.91Å; W129-I133 HydrophobicContact CB-CD1 4.23Å; W129-I133 HydrophobicContact CB-CG1 4.28Å; W129-I133 VanDerWaalsContact O-CB 3.25Å; W129-I133 WeakPolarHBondContact O-CB 3.47Å; W129-I133 WeakPolarHBondContact O-CG1 3.25Å; W129-I133 PolarHBondContact O-N 2.98Å; W129-R152 HydrophobicContact CE3-CG 4.46Å; W129-V155 HydrophobicContact CH2-CG2 4.31Å; W129-V155 HydrophobicContact CZ3-CG2 4.21Å; W129-F552 HydrophobicContact CH2-CB 4.26Å; W129-F552 AromaticContact CH2-CD2 3.44Å; W129-F552 HydrophobicContact CH2-CD2 3.44Å; W129-F552 VanDerWaalsContact CH2-CD2 3.44Å; W129-F552 HydrophobicContact CH2-CE2 4.01Å; W129-F552 AromaticContact CH2-CG 3.99Å; W129-F552 HydrophobicContact CH2-CG 3.99Å; W129-F552 HydrophobicContact CZ2-CD1 4.44Å; W129-F552 AromaticContact CZ2-CD2 3.23Å; W129-F552 HydrophobicContact CZ2-CD2 3.23Å; W129-F552 AromaticContact CZ2-CE2 3.34Å; W129-F552 HydrophobicContact CZ2-CE2 3.34Å; W129-F552 AromaticContact CZ2-CG 3.82Å; W129-F552 HydrophobicContact CZ2-CG 3.82Å; W129-F552 HydrophobicContact CZ2-CZ 4.02Å; W129-F555 HydrophobicContact CB-CE1 3.74Å; W129-F555 HydrophobicContact CB-CE2 4.02Å; W129-F555 HydrophobicContact CB-CZ 3.36Å; W129-F555 AromaticContact CD1-CE1 3.6Å; W129-F555 AromaticContact CD2-CD1 3.52Å; W129-F555 HydrophobicContact CD2-CD1 3.52Å; W129-F555 AromaticContact CD2-CD2 3.85Å; W129-F555 HydrophobicContact CD2-CD2 3.85Å; W129-F555 AromaticContact CD2-CE1 3.45Å; W129-F555 HydrophobicContact CD2-CE1 3.45Å; W129-F555 VanDerWaalsContact CD2-CE1 3.45Å; W129-F555 AromaticContact CD2-CE2 3.77Å; W129-F555 HydrophobicContact CD2-CE2 3.77Å; W129-F555 AromaticContact CD2-CG 3.76Å; W129-F555 HydrophobicContact CD2-CG 3.76Å; W129-F555 AromaticContact CD2-CZ 3.6Å; W129-F555 HydrophobicContact CD2-CZ 3.6Å; W129-F555 AromaticContact CE2-CD1 3.48Å; W129-F555 VanDerWaalsContact CE2-CD1 3.48Å; W129-F555 AromaticContact CE2-CE1 3.79Å; W129-F555 AromaticContact CE2-CG 3.87Å; W129-F555 HydrophobicContact CE3-CB 4.42Å; W129-F555 AromaticContact CE3-CD1 3.9Å; W129-F555 HydrophobicContact CE3-CD1 3.9Å; W129-F555 AromaticContact CE3-CD2 3.35Å; W129-F555 HydrophobicContact CE3-CD2 3.35Å; W129-F555 HydrophobicContact CE3-CE1 4Å; W129-F555 AromaticContact CE3-CE2 3.44Å; W129-F555 HydrophobicContact CE3-CE2 3.44Å; W129-F555 VanDerWaalsContact CE3-CE2 3.44Å; W129-F555 AromaticContact CE3-CG 3.62Å; W129-F555 HydrophobicContact CE3-CG 3.62Å; W129-F555 AromaticContact CE3-CZ 3.81Å; W129-F555 HydrophobicContact CE3-CZ 3.81Å; W129-F555 AromaticContact CG-CD1 3.9Å; W129-F555 HydrophobicContact CG-CD1 3.9Å; W129-F555 AromaticContact CG-CE1 3.32Å; W129-F555 HydrophobicContact CG-CE1 3.32Å; W129-F555 HydrophobicContact CG-CE2 4.05Å; W129-F555 AromaticContact CG-CZ 3.44Å; W129-F555 HydrophobicContact CG-CZ 3.44Å; W129-F555 VanDerWaalsContact CG-CZ 3.44Å; W129-F555 HydrophobicContact CH2-CB 3.7Å; W129-F555 HydrophobicContact CH2-CD1 4.21Å; W129-F555 HydrophobicContact CH2-CD2 4.16Å; W129-F555 AromaticContact CH2-CG 3.76Å; W129-F555 HydrophobicContact CH2-CG 3.76Å; W129-F555 HydrophobicContact CZ2-CB 3.95Å; W129-F555 AromaticContact CZ2-CD1 3.82Å; W129-F555 HydrophobicContact CZ2-CD1 3.82Å; W129-F555 AromaticContact CZ2-CG 3.86Å; W129-F555 HydrophobicContact CZ2-CG 3.86Å; W129-F555 HydrophobicContact CZ3-CB 3.93Å; W129-F555 HydrophobicContact CZ3-CD1 4.24Å; W129-F555 AromaticContact CZ3-CD2 3.54Å; W129-F555 HydrophobicContact CZ3-CD2 3.54Å; W129-F555 HydrophobicContact CZ3-CE2 4.12Å; W129-F555 AromaticContact CZ3-CG 3.63Å; W129-F555 HydrophobicContact CZ3-CG 3.63Å; W129-F555 AromaticContact NE1-CD1 3.85Å; W129-F555 AromaticContact NE1-CE1 3.88Å; W129-Y556 AromaticContact CE2-CE2 3.83Å; W129-Y556 HydrophobicContact CZ2-CD2 4.31Å; W129-Y556 AromaticContact CZ2-CE2 3.7Å; W129-Y556 HydrophobicContact CZ2-CE2 3.7Å; W129-Y556 AromaticContact NE1-CE2 3.44Å; W129-Y556 AromaticContact NE1-CZ 3.17Å; W129-Y556 PolarHBondContact NE1-OH 3.08Å
130	R	81.5	Confident	71.3	Confident	152 Å²	152	71.5 Å²	71.5	57%	0.574	37%	0.37	S	S	*	.	H	α-helix	trans	-57.7	-41.7	177.5	-174.9	174.6	-177.9	-178	-1.4	111.9	K127 L128 H134	K127-R130 PolarHBondContact O-N 3.04Å; L128-R130 VanDerWaalsContact C-N 3.25Å; L128-R130 PolarHBondContact O-N 3.06Å; L128-R130 VanDerWaalsContact O-N 3.16Å; R130-H134 PolarHBondContact O-CD2 3.38Å; R130-H134 PolarHBondContact O-N 2.94Å; R130-H134 VanDerWaalsContact O-N 3.1Å
131	S	80.3	Confident	71.5	Confident	94 Å²	94	67.3 Å²	67.3	66%	0.657	36%	0.359	S	S	*	.	H	α-helix	trans	-65.1	-47.2	176.6	-168.5	0	0	0	0	111.6	W129 I133 H134 Q135	W129-S131 VanDerWaalsContact C-N 3.26Å; W129-S131 PolarHBondContact O-N 3.48Å; S131-I133 VanDerWaalsContact C-N 3.33Å; S131-I133 PolarHBondContact O-N 3.43Å; S131-H134 PolarHBondContact O-N 2.82Å; S131-Q135 WeakPolarHBondContact O-CB 3.24Å; S131-Q135 PolarHBondContact O-N 2.87Å
132	D	84.8	Confident	71.9	Confident	34 Å²	34	68.3 Å²	68.3	18%	0.182	36%	0.361	C	S	.	.	H	α-helix	trans	-61.8	-42.2	179.6	-59.9	-55.8	0	0	0	112.1	W129 Q135 I136 F555 K559	W129-D132 HydrophobicContact CB-CB 4.18Å; W129-D132 PolarHBondContact O-N 2.91Å; D132-Q135 WeakPolarHBondContact O-CB 3.39Å; D132-Q135 PolarHBondContact O-N 3Å; D132-I136 WeakPolarHBondContact O-CD1 3.31Å; D132-I136 WeakPolarHBondContact O-CG1 3.25Å; D132-I136 PolarHBondContact O-N 3.39Å; D132-F555 HydrophobicContact CB-CE1 4.46Å; D132-F555 HydrophobicContact CB-CZ 4.41Å; D132-K559 HydrophobicContact CB-CD 4.4Å; D132-K559 VanDerWaalsContact CG-NZ 3.32Å; D132-K559 IonicContact OD1-NZ 3.44Å; D132-K559 PolarHBondContact OD1-NZ 3.02Å
133	I	84.8	Confident	72.4	Confident	14 Å²	14	62.2 Å²	62.2	7%	0.072	34%	0.336	C	S	.	.	H	α-helix	trans	-64.2	-43.2	178.9	-72.7	174.4	0	0	0	110.6	W129 S131 I136 E137 L145 F148 R152 F555	W129-I133 HydrophobicContact CB-CD1 4.23Å; W129-I133 HydrophobicContact CB-CG1 4.28Å; W129-I133 VanDerWaalsContact O-CB 3.25Å; W129-I133 WeakPolarHBondContact O-CB 3.47Å; W129-I133 WeakPolarHBondContact O-CG1 3.25Å; W129-I133 PolarHBondContact O-N 2.98Å; S131-I133 VanDerWaalsContact C-N 3.33Å; S131-I133 PolarHBondContact O-N 3.43Å; I133-I136 PolarHBondContact O-N 3.47Å; I133-E137 WeakPolarHBondContact O-CB 3.49Å; I133-E137 PolarHBondContact O-N 3.4Å; I133-L145 HydrophobicContact CG2-CD1 3.13Å; I133-L145 HydrophobicContact CG2-CG 4.4Å; I133-F148 HydrophobicContact CD1-CB 4.49Å; I133-F148 HydrophobicContact CG1-CB 4.07Å; I133-R152 HydrophobicContact CD1-CB 4.47Å; I133-F555 HydrophobicContact CD1-CE2 4.33Å; I133-F555 HydrophobicContact CG1-CE2 4.2Å; I133-F555 HydrophobicContact CG1-CZ 4.11Å
134	H	79.8	Confident	73.4	Confident	93 Å²	93	60 Å²	60	43%	0.431	33%	0.325	S	S	.	.	H	α-helix	trans	-69.2	-33.6	175	-77.9	-51.4	0	0	0	113	R130 S131 E137 G138	R130-H134 PolarHBondContact O-CD2 3.38Å; R130-H134 PolarHBondContact O-N 2.94Å; R130-H134 VanDerWaalsContact O-N 3.1Å; S131-H134 PolarHBondContact O-N 2.82Å; H134-E137 IonicContact CE1-OE2 3.56Å; H134-E137 IonicContact ND1-OE2 3.54Å; H134-E137 PolarHBondContact ND1-OE2 2.86Å; H134-E137 WeakPolarHBondContact O-CB 3.46Å; H134-E137 PolarHBondContact O-N 3.05Å; H134-G138 PolarHBondContact O-N 3.45Å
135	Q	82	Confident	74.5	Confident	102 Å²	102	58.2 Å²	58.2	48%	0.477	31%	0.309	S	S	.	.	H	α-helix	trans	-64	-45.2	173.5	-167.7	-171.9	17.8	0	0	111	S131 D132 E137 G138 M139	S131-Q135 WeakPolarHBondContact O-CB 3.24Å; S131-Q135 PolarHBondContact O-N 2.87Å; D132-Q135 WeakPolarHBondContact O-CB 3.39Å; D132-Q135 PolarHBondContact O-N 3Å; Q135-E137 VanDerWaalsContact C-N 3.33Å; Q135-E137 PolarHBondContact O-N 3.36Å; Q135-G138 PolarHBondContact O-N 3.43Å; Q135-M139 HydrophobicContact CG-CE 4.03Å; Q135-M139 WeakPolarHBondContact O-CG 3.18Å; Q135-M139 PolarHBondContact O-N 3.27Å
136	I	81.7	Confident	76.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.6	-40.6	176.6	-67.3	162.9	0	0	0	110.7	D132 I133 G138 M139 F140 I144 F148 K559 L562	D132-I136 WeakPolarHBondContact O-CD1 3.31Å; D132-I136 WeakPolarHBondContact O-CG1 3.25Å; D132-I136 PolarHBondContact O-N 3.39Å; I133-I136 PolarHBondContact O-N 3.47Å; I136-G138 VanDerWaalsContact C-N 3.3Å; I136-G138 PolarHBondContact O-N 3.37Å; I136-M139 PolarHBondContact O-N 3.49Å; I136-F140 HydrophobicContact CG2-CD2 4.17Å; I136-F140 PolarHBondContact O-N 3.33Å; I136-I144 HydrophobicContact CG2-CB 4.48Å; I136-I144 HydrophobicContact CG2-CG2 3.77Å; I136-F148 HydrophobicContact CD1-CD1 4.43Å; I136-F148 HydrophobicContact CD1-CD2 3.94Å; I136-F148 HydrophobicContact CD1-CE1 4.33Å; I136-F148 HydrophobicContact CD1-CE2 3.86Å; I136-F148 HydrophobicContact CD1-CG 4.24Å; I136-F148 HydrophobicContact CD1-CZ 4.06Å; I136-F148 HydrophobicContact CG2-CD2 4.04Å; I136-F148 HydrophobicContact CG2-CE2 4Å; I136-K559 HydrophobicContact CD1-CD 4.44Å; I136-K559 HydrophobicContact CD1-CG 4.11Å; I136-L562 HydrophobicContact CG2-CD2 3.74Å
137	E	78.3	Confident	77.6	Confident	56 Å²	56	51.5 Å²	51.5	26%	0.262	27%	0.269	S	S	.	.	H	α-helix	trans	-57.6	-42.7	173.9	-179.4	179.7	-161.4	0	0	111.8	I133 H134 Q135 M139 G141 L145	I133-E137 WeakPolarHBondContact O-CB 3.49Å; I133-E137 PolarHBondContact O-N 3.4Å; H134-E137 IonicContact CE1-OE2 3.56Å; H134-E137 IonicContact ND1-OE2 3.54Å; H134-E137 PolarHBondContact ND1-OE2 2.86Å; H134-E137 WeakPolarHBondContact O-CB 3.46Å; H134-E137 PolarHBondContact O-N 3.05Å; Q135-E137 VanDerWaalsContact C-N 3.33Å; Q135-E137 PolarHBondContact O-N 3.36Å; E137-M139 PolarHBondContact O-N 2.85Å; E137-G141 VanDerWaalsContact O-CA 3.23Å; E137-G141 WeakPolarHBondContact O-CA 3.46Å; E137-G141 PolarHBondContact O-N 2.83Å; E137-L145 HydrophobicContact CB-CB 4.31Å; E137-L145 HydrophobicContact CB-CD1 3.94Å; E137-L145 HydrophobicContact CG-CB 4.47Å; E137-L145 HydrophobicContact CG-CD1 4.33Å; E137-L145 HydrophobicContact CG-CD2 4.24Å
138	G	68.6	Low	79	Confident	30 Å²	30	44.4 Å²	44.4	31%	0.309	24%	0.239	S	C	.	.	H	α-helix	trans	-69.2	-29.3	179.3	0	0	0	0	0	114.9	H134 Q135 I136	H134-G138 PolarHBondContact O-N 3.45Å; Q135-G138 PolarHBondContact O-N 3.43Å; I136-G138 VanDerWaalsContact C-N 3.3Å; I136-G138 PolarHBondContact O-N 3.37Å
139	M	73.6	Confident	79.8	Confident	92 Å²	92	43 Å²	43	45%	0.453	23%	0.234	S	C	.	.	H	α-helix	trans	-89.8	-38.2	-179.9	-65.7	-176	-61.8	0	0	113.6	Q135 I136 E137 I563	Q135-M139 HydrophobicContact CG-CE 4.03Å; Q135-M139 WeakPolarHBondContact O-CG 3.18Å; Q135-M139 PolarHBondContact O-N 3.27Å; I136-M139 PolarHBondContact O-N 3.49Å; E137-M139 PolarHBondContact O-N 2.85Å; M139-I563 HydrophobicContact CE-CD1 4.16Å; M139-I563 HydrophobicContact CE-CG1 4.1Å
140	F	72.9	Confident	80.2	Confident	46 Å²	46	42.7 Å²	42.7	20%	0.202	23%	0.233	C	C	.	.	H	α-helix	trans	-122.6	-5	-167.8	-62.1	-82.1	0	0	0	114.4	I136 I144 L562 I563 P568	I136-F140 HydrophobicContact CG2-CD2 4.17Å; I136-F140 PolarHBondContact O-N 3.33Å; F140-I144 HydrophobicContact CB-CB 4.33Å; F140-I144 HydrophobicContact CB-CD1 3.55Å; F140-I144 HydrophobicContact CB-CG1 4.38Å; F140-I144 HydrophobicContact CD1-CD1 4.21Å; F140-I144 HydrophobicContact CG-CD1 4.09Å; F140-L562 HydrophobicContact CD1-CD1 4.14Å; F140-L562 HydrophobicContact CD1-CG 4.43Å; F140-L562 HydrophobicContact CD2-CD2 3.8Å; F140-L562 HydrophobicContact CD2-CG 4.09Å; F140-L562 HydrophobicContact CE1-CD1 4.08Å; F140-L562 HydrophobicContact CE1-CG 4.19Å; F140-L562 HydrophobicContact CE2-CD2 3.95Å; F140-L562 HydrophobicContact CE2-CG 3.82Å; F140-L562 HydrophobicContact CG-CD1 4.4Å; F140-L562 HydrophobicContact CG-CD2 4.22Å; F140-L562 HydrophobicContact CG-CG 4.39Å; F140-L562 HydrophobicContact CZ-CD1 4.29Å; F140-L562 HydrophobicContact CZ-CD2 4.48Å; F140-L562 HydrophobicContact CZ-CG 3.88Å; F140-L562 WeakPolarHBondContact CZ-O 3.24Å; F140-I563 HydrophobicContact CE2-CG1 4.21Å; F140-P568 HydrophobicContact CD1-CB 4.17Å; F140-P568 HydrophobicContact CE1-CB 4.5Å
141	G	72.5	Confident	80.6	Confident	31 Å²	31	35.5 Å²	35.5	32%	0.32	21%	0.205	S	C	.	.			trans	87.3	-178.2	176	0	0	0	0	0	115.5	E137 G143 L145	E137-G141 VanDerWaalsContact O-CA 3.23Å; E137-G141 WeakPolarHBondContact O-CA 3.46Å; E137-G141 PolarHBondContact O-N 2.83Å; G141-G143 PolarHBondContact O-N 3.5Å; G141-L145 PolarHBondContact O-N 2.74Å
142	T	72	Confident	81.1	Confident	67 Å²	67	35.2 Å²	35.2	41%	0.411	19%	0.19	S	C	.	.	H	α-helix	trans	-75.8	-18.9	-168.7	56.6	0	0	0	0	114.3	L145 S146 A575	T142-L145 WeakPolarHBondContact O-CB 3.22Å; T142-S146 PolarHBondContact O-N 3.02Å; T142-S146 PolarHBondContact O-OG 3.29Å; T142-A575 VanDerWaalsContact C-CB 3.5Å; T142-A575 WeakPolarHBondContact O-CB 3.38Å; T142-A575 WeakPolarHBondContact OG1-CB 3.27Å
143	G	73	Confident	81.3	Confident	8 Å²	8	33.8 Å²	33.8	8%	0.082	18%	0.182	C	C	.	.	H	α-helix	trans	-64.9	-50.7	175.4	0	0	0	0	0	111.7	G141 S146	G141-G143 PolarHBondContact O-N 3.5Å; G143-S146 VanDerWaalsContact O-CB 3.32Å; G143-S146 WeakPolarHBondContact O-CB 3.48Å; G143-S146 PolarHBondContact O-N 3.19Å; G143-S146 VanDerWaalsContact O-N 3.15Å
144	I	80.4	Confident	81.7	Confident	7 Å²	7	33.1 Å²	33.1	4%	0.036	18%	0.179	C	C	.	.	H	α-helix	trans	-72.2	-33	-179	-62.3	177.6	0	0	0	111.6	I136 F140 S146 Y147 F148 F517 I519 L562	I136-I144 HydrophobicContact CG2-CB 4.48Å; I136-I144 HydrophobicContact CG2-CG2 3.77Å; F140-I144 HydrophobicContact CB-CB 4.33Å; F140-I144 HydrophobicContact CB-CD1 3.55Å; F140-I144 HydrophobicContact CB-CG1 4.38Å; F140-I144 HydrophobicContact CD1-CD1 4.21Å; F140-I144 HydrophobicContact CG-CD1 4.09Å; I144-S146 PolarHBondContact O-N 3.4Å; I144-Y147 WeakPolarHBondContact O-CB 2.98Å; I144-Y147 PolarHBondContact O-N 3.37Å; I144-Y147 VanDerWaalsContact O-N 3.1Å; I144-F148 HydrophobicContact CG2-CD2 3.79Å; I144-F148 HydrophobicContact CG2-CE2 3.54Å; I144-F148 WeakPolarHBondContact O-CD2 3.29Å; I144-F148 PolarHBondContact O-N 2.9Å; I144-F517 HydrophobicContact CD1-CD1 4.13Å; I144-F517 HydrophobicContact CG1-CD1 4.1Å; I144-F517 HydrophobicContact CG2-CD1 4.43Å; I144-F517 HydrophobicContact CG2-CE1 4.25Å; I144-I519 HydrophobicContact CG1-CD1 4.12Å; I144-I519 HydrophobicContact CG1-CG1 4.3Å; I144-L562 HydrophobicContact CD1-CD1 3.78Å; I144-L562 HydrophobicContact CD1-CD2 4.43Å; I144-L562 HydrophobicContact CG2-CD2 3.57Å
145	L	82.8	Confident	82.4	Confident	36 Å²	36	29.2 Å²	29.2	19%	0.188	16%	0.162	C	C	.	.	H	α-helix	trans	-49.1	-42.4	167.4	172.9	81.5	0	0	0	111.9	I133 E137 G141 T142 Y147 F148 S149	I133-L145 HydrophobicContact CG2-CD1 3.13Å; I133-L145 HydrophobicContact CG2-CG 4.4Å; E137-L145 HydrophobicContact CB-CB 4.31Å; E137-L145 HydrophobicContact CB-CD1 3.94Å; E137-L145 HydrophobicContact CG-CB 4.47Å; E137-L145 HydrophobicContact CG-CD1 4.33Å; E137-L145 HydrophobicContact CG-CD2 4.24Å; G141-L145 PolarHBondContact O-N 2.74Å; T142-L145 WeakPolarHBondContact O-CB 3.22Å; L145-Y147 VanDerWaalsContact C-N 3.3Å; L145-Y147 PolarHBondContact O-N 3.45Å; L145-F148 PolarHBondContact O-N 2.88Å; L145-S149 WeakPolarHBondContact O-CB 3.27Å; L145-S149 PolarHBondContact O-N 2.91Å
146	S	83.2	Confident	82.8	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.007	15%	0.149	C	C	.	.	H	α-helix	trans	-65.4	-34.8	-176.7	-59.5	0	0	0	0	111.9	T142 G143 I144 F150 N579	T142-S146 PolarHBondContact O-N 3.02Å; T142-S146 PolarHBondContact O-OG 3.29Å; G143-S146 VanDerWaalsContact O-CB 3.32Å; G143-S146 WeakPolarHBondContact O-CB 3.48Å; G143-S146 PolarHBondContact O-N 3.19Å; G143-S146 VanDerWaalsContact O-N 3.15Å; I144-S146 PolarHBondContact O-N 3.4Å; S146-F150 VanDerWaalsContact O-CB 3.26Å; S146-F150 WeakPolarHBondContact O-CB 3.08Å; S146-F150 PolarHBondContact O-N 3.1Å; S146-N579 WeakPolarHBondContact CB-OD1 3.2Å; S146-N579 PolarHBondContact OG-ND2 2.85Å
147	Y	86.8	Confident	83.4	Confident	1 Å²	1	25.6 Å²	25.6	0%	0.004	15%	0.149	C	C	.	.	H	α-helix	trans	-64.2	-52.8	172.8	169.8	-97	0	0	0	112.3	I144 L145 S149 F150 L151 F517 N522 V523 I526 K558	I144-Y147 WeakPolarHBondContact O-CB 2.98Å; I144-Y147 PolarHBondContact O-N 3.37Å; I144-Y147 VanDerWaalsContact O-N 3.1Å; L145-Y147 VanDerWaalsContact C-N 3.3Å; L145-Y147 PolarHBondContact O-N 3.45Å; Y147-S149 VanDerWaalsContact C-N 3.31Å; Y147-S149 PolarHBondContact O-N 3.13Å; Y147-F150 CarbonylContact O-C 3.6Å; Y147-F150 WeakPolarHBondContact O-CA 3.26Å; Y147-F150 WeakPolarHBondContact O-CB 3.15Å; Y147-F150 PolarHBondContact O-N 2.99Å; Y147-F150 VanDerWaalsContact O-N 3.11Å; Y147-L151 HydrophobicContact CE1-CD2 4.48Å; Y147-L151 PolarHBondContact O-N 3.13Å; Y147-F517 HydrophobicContact CD1-CE1 4.15Å; Y147-F517 AromaticContact CD1-CZ 3.77Å; Y147-F517 HydrophobicContact CD1-CZ 3.77Å; Y147-F517 HydrophobicContact CD2-CZ 4.49Å; Y147-F517 AromaticContact CE1-CZ 3.75Å; Y147-F517 HydrophobicContact CE1-CZ 3.75Å; Y147-F517 HydrophobicContact CE2-CZ 4.45Å; Y147-F517 HydrophobicContact CG-CE1 4.24Å; Y147-F517 HydrophobicContact CG-CZ 4.16Å; Y147-N522 HydrophobicContact CD2-CB 4.16Å; Y147-N522 HydrophobicContact CE2-CB 3.48Å; Y147-N522 VanDerWaalsContact CE2-CB 3.48Å; Y147-V523 HydrophobicContact CD2-CG2 3.84Å; Y147-I526 HydrophobicContact CD2-CD1 4.1Å; Y147-I526 HydrophobicContact CE2-CD1 3.25Å; Y147-I526 HydrophobicContact CE2-CG1 4.37Å; Y147-K558 HydrophobicContact CE1-CB 4.37Å
148	F	89.4	Confident	84.2	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-68.3	-32.2	-178.9	-72.9	-77.5	0	0	0	112.5	I133 I136 I144 L145 F150 L151 R152 F555 K558 K559 L562	I133-F148 HydrophobicContact CD1-CB 4.49Å; I133-F148 HydrophobicContact CG1-CB 4.07Å; I136-F148 HydrophobicContact CD1-CD1 4.43Å; I136-F148 HydrophobicContact CD1-CD2 3.94Å; I136-F148 HydrophobicContact CD1-CE1 4.33Å; I136-F148 HydrophobicContact CD1-CE2 3.86Å; I136-F148 HydrophobicContact CD1-CG 4.24Å; I136-F148 HydrophobicContact CD1-CZ 4.06Å; I136-F148 HydrophobicContact CG2-CD2 4.04Å; I136-F148 HydrophobicContact CG2-CE2 4Å; I144-F148 HydrophobicContact CG2-CD2 3.79Å; I144-F148 HydrophobicContact CG2-CE2 3.54Å; I144-F148 WeakPolarHBondContact O-CD2 3.29Å; I144-F148 PolarHBondContact O-N 2.9Å; L145-F148 PolarHBondContact O-N 2.88Å; F148-F150 VanDerWaalsContact C-N 3.32Å; F148-L151 PolarHBondContact O-N 2.96Å; F148-R152 WeakPolarHBondContact O-CB 3.49Å; F148-R152 PolarHBondContact O-N 3.01Å; F148-F555 HydrophobicContact CB-CE2 4.01Å; F148-F555 AromaticContact CD1-CD2 3.75Å; F148-F555 HydrophobicContact CD1-CD2 3.75Å; F148-F555 AromaticContact CD1-CE2 3.48Å; F148-F555 HydrophobicContact CD1-CE2 3.48Å; F148-F555 VanDerWaalsContact CD1-CE2 3.48Å; F148-F555 HydrophobicContact CD1-CG 4.48Å; F148-F555 AromaticContact CD1-CZ 3.99Å; F148-F555 HydrophobicContact CD1-CZ 3.99Å; F148-F555 HydrophobicContact CE1-CD2 4.46Å; F148-F555 HydrophobicContact CE1-CE2 4.39Å; F148-F555 HydrophobicContact CG-CE2 4.16Å; F148-K558 HydrophobicContact CE1-CB 4.48Å; F148-K559 HydrophobicContact CE1-CB 4.2Å; F148-K559 HydrophobicContact CZ-CB 4.41Å; F148-L562 HydrophobicContact CE2-CD2 3.75Å; F148-L562 HydrophobicContact CZ-CD2 4.19Å
149	S	86.8	Confident	85.4	Confident	29 Å²	29	24.1 Å²	24.1	20%	0.203	14%	0.136	C	C	.	.	H	α-helix	trans	-65.6	-34.8	171.5	-175.9	0	0	0	0	112.6	L145 Y147 F153 R266	L145-S149 WeakPolarHBondContact O-CB 3.27Å; L145-S149 PolarHBondContact O-N 2.91Å; Y147-S149 VanDerWaalsContact C-N 3.31Å; Y147-S149 PolarHBondContact O-N 3.13Å; S149-F153 PolarHBondContact O-N 2.97Å; S149-R266 PolarHBondContact O-NH2 3.33Å
150	F	88.7	Confident	86.4	Confident	4 Å²	4	21.5 Å²	21.5	2%	0.018	12%	0.123	C	C	.	.	H	α-helix	trans	-71.4	-42.6	172.7	-178.2	-109	0	0	0	112	S146 Y147 F148 R152 F153 L154 V523 I526 F582 L583 L586	S146-F150 VanDerWaalsContact O-CB 3.26Å; S146-F150 WeakPolarHBondContact O-CB 3.08Å; S146-F150 PolarHBondContact O-N 3.1Å; Y147-F150 CarbonylContact O-C 3.6Å; Y147-F150 WeakPolarHBondContact O-CA 3.26Å; Y147-F150 WeakPolarHBondContact O-CB 3.15Å; Y147-F150 PolarHBondContact O-N 2.99Å; Y147-F150 VanDerWaalsContact O-N 3.11Å; F148-F150 VanDerWaalsContact C-N 3.32Å; F150-R152 PolarHBondContact O-N 3.29Å; F150-F153 HydrophobicContact CD2-CD1 4.38Å; F150-F153 HydrophobicContact CE2-CD1 4.48Å; F150-F153 VanDerWaalsContact O-CB 3.29Å; F150-F153 WeakPolarHBondContact O-CB 3.41Å; F150-F153 PolarHBondContact O-N 3.26Å; F150-L154 HydrophobicContact CD1-CD1 4.1Å; F150-L154 HydrophobicContact CE1-CD1 3.63Å; F150-L154 HydrophobicContact CE1-CG 4.48Å; F150-L154 HydrophobicContact CZ-CD1 3.92Å; F150-L154 HydrophobicContact CZ-CG 4.44Å; F150-L154 PolarHBondContact O-N 2.93Å; F150-L154 VanDerWaalsContact O-N 3.1Å; F150-V523 HydrophobicContact CD1-CG1 4.48Å; F150-V523 HydrophobicContact CE1-CG1 4.09Å; F150-I526 HydrophobicContact CD1-CG2 4.26Å; F150-I526 HydrophobicContact CE1-CG2 3.76Å; F150-F582 HydrophobicContact CD2-CB 4.14Å; F150-F582 HydrophobicContact CE2-CB 4.14Å; F150-F582 HydrophobicContact CG-CB 4.5Å; F150-F582 HydrophobicContact CZ-CB 4.5Å; F150-L583 HydrophobicContact CE2-CD2 4.47Å; F150-L586 HydrophobicContact CE2-CB 4.36Å; F150-L586 HydrophobicContact CE2-CD2 3.81Å; F150-L586 HydrophobicContact CZ-CB 4.27Å; F150-L586 HydrophobicContact CZ-CD1 4.32Å; F150-L586 HydrophobicContact CZ-CD2 4.04Å; F150-L586 HydrophobicContact CZ-CG 4.45Å
151	L	90.5	Very high	87.5	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.7	-44.7	175.5	-176	59.3	0	0	0	111.9	Y147 F148 F153 L154 V155 I526 Y551 V554 F555	Y147-L151 HydrophobicContact CE1-CD2 4.48Å; Y147-L151 PolarHBondContact O-N 3.13Å; F148-L151 PolarHBondContact O-N 2.96Å; L151-F153 VanDerWaalsContact C-N 3.26Å; L151-F153 PolarHBondContact O-N 3.1Å; L151-L154 PolarHBondContact O-N 3.32Å; L151-L154 VanDerWaalsContact O-N 3.1Å; L151-V155 WeakPolarHBondContact O-CG2 3.06Å; L151-V155 PolarHBondContact O-N 2.8Å; L151-I526 HydrophobicContact CB-CD1 4.35Å; L151-I526 HydrophobicContact CD1-CD1 3.9Å; L151-I526 HydrophobicContact CD1-CG1 4.38Å; L151-Y551 HydrophobicContact CD1-CD1 3.63Å; L151-Y551 HydrophobicContact CD1-CE1 4.49Å; L151-Y551 HydrophobicContact CD1-CG 4.01Å; L151-V554 HydrophobicContact CD2-CG1 4.3Å; L151-F555 HydrophobicContact CD2-CB 3.78Å; L151-F555 HydrophobicContact CD2-CD2 3.95Å; L151-F555 HydrophobicContact CD2-CG 4.32Å; L151-F555 HydrophobicContact CG-CD2 4.41Å
152	R	90.3	Very high	88.6	Confident	88 Å²	88	19.8 Å²	19.8	33%	0.332	11%	0.107	S	C	.	.	H	α-helix	trans	-57.8	-38.7	173.6	-174.7	-176.9	70	102.8	-0.2	112.3	L128 W129 I133 F148 F150 L154 A156	L128-R152 WeakPolarHBondContact O-CD 3.39Å; W129-R152 HydrophobicContact CE3-CG 4.46Å; I133-R152 HydrophobicContact CD1-CB 4.47Å; F148-R152 WeakPolarHBondContact O-CB 3.49Å; F148-R152 PolarHBondContact O-N 3.01Å; F150-R152 PolarHBondContact O-N 3.29Å; R152-L154 VanDerWaalsContact C-N 3.35Å; R152-A156 PolarHBondContact O-N 3.39Å
153	F	90.3	Very high	89.7	Confident	4 Å²	4	20.4 Å²	20.4	2%	0.018	11%	0.107	C	C	.	.	H	α-helix	trans	-62.3	-42.6	175.7	168.7	-118.9	0	0	0	112.2	S149 F150 L151 A156 L157 W262 I263 L583 L586	S149-F153 PolarHBondContact O-N 2.97Å; F150-F153 HydrophobicContact CD2-CD1 4.38Å; F150-F153 HydrophobicContact CE2-CD1 4.48Å; F150-F153 VanDerWaalsContact O-CB 3.29Å; F150-F153 WeakPolarHBondContact O-CB 3.41Å; F150-F153 PolarHBondContact O-N 3.26Å; L151-F153 VanDerWaalsContact C-N 3.26Å; L151-F153 PolarHBondContact O-N 3.1Å; F153-A156 PolarHBondContact O-N 3.18Å; F153-L157 HydrophobicContact CE1-CD1 4.16Å; F153-L157 HydrophobicContact CE2-CD1 4.28Å; F153-L157 HydrophobicContact CZ-CD1 3.71Å; F153-L157 WeakPolarHBondContact O-CB 3.35Å; F153-L157 PolarHBondContact O-N 3.11Å; F153-W262 HydrophobicContact CD2-CZ2 4.44Å; F153-W262 AromaticContact CE2-CD2 3.9Å; F153-W262 HydrophobicContact CE2-CD2 3.9Å; F153-W262 AromaticContact CE2-CE2 3.78Å; F153-W262 HydrophobicContact CE2-CE3 4.43Å; F153-W262 HydrophobicContact CE2-CG 4.11Å; F153-W262 HydrophobicContact CE2-CZ2 4.23Å; F153-W262 AromaticContact CE2-NE1 3.9Å; F153-I263 HydrophobicContact CE1-CG1 4.37Å; F153-I263 HydrophobicContact CZ-CG1 4.12Å; F153-L583 HydrophobicContact CD1-CD2 4.41Å; F153-L583 HydrophobicContact CE1-CD2 3.99Å; F153-L586 HydrophobicContact CD1-CD2 4.44Å; F153-L586 HydrophobicContact CE1-CD2 3.71Å
154	L	92.5	Very high	90.7	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-70.3	-35.1	-180	-69.8	174.7	0	0	0	113.2	F150 L151 R152 A156 L157 N158 I526 Q530 L586	F150-L154 HydrophobicContact CD1-CD1 4.1Å; F150-L154 HydrophobicContact CE1-CD1 3.63Å; F150-L154 HydrophobicContact CE1-CG 4.48Å; F150-L154 HydrophobicContact CZ-CD1 3.92Å; F150-L154 HydrophobicContact CZ-CG 4.44Å; F150-L154 PolarHBondContact O-N 2.93Å; F150-L154 VanDerWaalsContact O-N 3.1Å; L151-L154 PolarHBondContact O-N 3.32Å; L151-L154 VanDerWaalsContact O-N 3.1Å; R152-L154 VanDerWaalsContact C-N 3.35Å; L154-A156 VanDerWaalsContact C-N 3.31Å; L154-A156 PolarHBondContact O-N 3.22Å; L154-L157 PolarHBondContact O-N 2.69Å; L154-N158 WeakPolarHBondContact O-CB 3.39Å; L154-N158 PolarHBondContact O-N 3.17Å; L154-N158 PolarHBondContact O-ND2 3.28Å; L154-I526 HydrophobicContact CD1-CB 4.46Å; L154-I526 HydrophobicContact CD1-CG2 2.95Å; L154-I526 HydrophobicContact CG-CG2 4.43Å; L154-Q530 HydrophobicContact CD2-CG 3.98Å; L154-L586 HydrophobicContact CD2-CD1 4.23Å; L154-L586 HydrophobicContact CD2-CD2 3.98Å
155	V	93.4	Very high	91.4	Very high	12 Å²	12	20.9 Å²	20.9	7%	0.073	11%	0.108	C	C	.	.	H	α-helix	trans	-57.4	-47.9	169.8	176.3	0	0	0	0	110	W129 L151 L157 L159 T548	W129-V155 HydrophobicContact CH2-CG2 4.31Å; W129-V155 HydrophobicContact CZ3-CG2 4.21Å; L151-V155 WeakPolarHBondContact O-CG2 3.06Å; L151-V155 PolarHBondContact O-N 2.8Å; V155-L157 PolarHBondContact O-N 2.87Å; V155-L159 VanDerWaalsContact O-CB 3.31Å; V155-L159 WeakPolarHBondContact O-CB 3.35Å; V155-L159 PolarHBondContact O-N 3.46Å; V155-T548 HydrophobicContact CG1-CG2 3.99Å
156	A	91.7	Very high	91.9	Very high	25 Å²	25	22.3 Å²	22.3	21%	0.207	11%	0.113	C	C	.	.	H	α-helix	trans	-65.2	-38.9	177.9	0	0	0	0	0	112.4	R152 F153 L154 L159 I160 W262	R152-A156 PolarHBondContact O-N 3.39Å; F153-A156 PolarHBondContact O-N 3.18Å; L154-A156 VanDerWaalsContact C-N 3.31Å; L154-A156 PolarHBondContact O-N 3.22Å; A156-L159 PolarHBondContact O-N 3.19Å; A156-I160 WeakPolarHBondContact O-CG1 3.39Å; A156-I160 PolarHBondContact O-N 2.89Å; A156-W262 HydrophobicContact CB-CH2 4.07Å
157	L	93.1	Very high	92.4	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-63.8	-49.6	178.1	-176.6	142.7	0	0	0	111.3	F153 L154 V155 L159 I160 I161 W262 I263 Q530 W534	F153-L157 HydrophobicContact CE1-CD1 4.16Å; F153-L157 HydrophobicContact CE2-CD1 4.28Å; F153-L157 HydrophobicContact CZ-CD1 3.71Å; F153-L157 WeakPolarHBondContact O-CB 3.35Å; F153-L157 PolarHBondContact O-N 3.11Å; L154-L157 PolarHBondContact O-N 2.69Å; V155-L157 PolarHBondContact O-N 2.87Å; L157-L159 VanDerWaalsContact C-N 3.33Å; L157-L159 PolarHBondContact O-N 3.38Å; L157-I160 PolarHBondContact O-N 2.9Å; L157-I161 HydrophobicContact CD2-CD1 3.5Å; L157-I161 HydrophobicContact CD2-CG1 4.39Å; L157-I161 HydrophobicContact CG-CD1 4.35Å; L157-I161 WeakPolarHBondContact O-CG1 3.37Å; L157-I161 PolarHBondContact O-N 3.25Å; L157-W262 HydrophobicContact CB-CZ3 4.34Å; L157-I263 HydrophobicContact CD1-CG1 4.41Å; L157-Q530 VanDerWaalsContact CD2-NE2 3.27Å; L157-W534 HydrophobicContact CD2-CZ2 4.44Å
158	N	95.6	Very high	92.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-67.5	-33.1	178.9	-67.9	-34.8	0	0	0	112.6	L154 I161 F162 Q530 C533 T548 Y551	L154-N158 WeakPolarHBondContact O-CB 3.39Å; L154-N158 PolarHBondContact O-N 3.17Å; L154-N158 PolarHBondContact O-ND2 3.28Å; N158-I161 PolarHBondContact O-N 3.36Å; N158-F162 WeakPolarHBondContact O-CB 3.47Å; N158-F162 PolarHBondContact O-N 2.9Å; N158-Q530 PolarHBondContact ND2-OE1 2.84Å; N158-Q530 PolarHBondContact OD1-NE2 3.3Å; N158-Q530 PolarHBondContact OD1-OE1 2.92Å; N158-C533 PolarHBondContact OD1-SG 3.49Å; N158-T548 WeakPolarHBondContact CB-OG1 3.45Å; N158-Y551 VanDerWaalsContact ND2-CD2 3.31Å; N158-Y551 WeakPolarHBondContact ND2-CD2 3.45Å; N158-Y551 WeakPolarHBondContact ND2-CE2 3.24Å
159	L	94.5	Very high	92.7	Very high	55 Å²	55	30.4 Å²	30.4	29%	0.288	16%	0.156	S	C	.	.	H	α-helix	trans	-62.1	-42.5	172	-178.3	65	0	0	0	111.5	M126 V155 A156 L157 F162 L163 T548	M126-L159 HydrophobicContact CE-CD2 4.24Å; V155-L159 VanDerWaalsContact O-CB 3.31Å; V155-L159 WeakPolarHBondContact O-CB 3.35Å; V155-L159 PolarHBondContact O-N 3.46Å; A156-L159 PolarHBondContact O-N 3.19Å; L157-L159 VanDerWaalsContact C-N 3.33Å; L157-L159 PolarHBondContact O-N 3.38Å; L159-F162 HydrophobicContact CD1-CD1 4.49Å; L159-F162 WeakPolarHBondContact O-CB 3.28Å; L159-F162 PolarHBondContact O-N 3.39Å; L159-L163 HydrophobicContact CG-CD1 4.46Å; L159-L163 VanDerWaalsContact O-CG 3.29Å; L159-L163 WeakPolarHBondContact O-CG 3.47Å; L159-L163 PolarHBondContact O-N 3.27Å; L159-T548 HydrophobicContact CB-CG2 4.23Å; L159-T548 HydrophobicContact CD1-CG2 4.48Å; L159-T548 PolarHBondContact N-OG1 3.44Å
160	I	93.4	Very high	92.9	Very high	37 Å²	37	29.2 Å²	29.2	19%	0.19	15%	0.147	C	C	.	.	H	α-helix	trans	-68.2	-41.6	176.3	-66.1	-174.4	0	0	0	111.4	L123 A156 L157 F162 L163 V164 L258 W262	L123-I160 HydrophobicContact CD1-CD1 3.85Å; A156-I160 WeakPolarHBondContact O-CG1 3.39Å; A156-I160 PolarHBondContact O-N 2.89Å; L157-I160 PolarHBondContact O-N 2.9Å; I160-F162 VanDerWaalsContact C-N 3.28Å; I160-F162 PolarHBondContact O-N 2.95Å; I160-L163 PolarHBondContact O-N 3.35Å; I160-L163 VanDerWaalsContact O-N 3.15Å; I160-V164 HydrophobicContact CG2-CG2 4.42Å; I160-V164 WeakPolarHBondContact O-CG2 3.19Å; I160-V164 PolarHBondContact O-N 3.21Å; I160-L258 HydrophobicContact CG2-CD1 4.14Å; I160-L258 HydrophobicContact CG2-CD2 3.7Å; I160-W262 HydrophobicContact CB-CZ3 4.37Å; I160-W262 HydrophobicContact CD1-CE3 4.2Å; I160-W262 HydrophobicContact CD1-CH2 3.51Å; I160-W262 HydrophobicContact CD1-CZ3 3.25Å; I160-W262 HydrophobicContact CG1-CH2 4.45Å; I160-W262 HydrophobicContact CG1-CZ3 4.07Å
161	I	95.8	Very high	92.9	Very high	2 Å²	2	32 Å²	32	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-59.1	-44.5	175.2	-62.9	172.6	0	0	0	110	L157 N158 L163 V164 M165 Y255 T537 P544	L157-I161 HydrophobicContact CD2-CD1 3.5Å; L157-I161 HydrophobicContact CD2-CG1 4.39Å; L157-I161 HydrophobicContact CG-CD1 4.35Å; L157-I161 WeakPolarHBondContact O-CG1 3.37Å; L157-I161 PolarHBondContact O-N 3.25Å; N158-I161 PolarHBondContact O-N 3.36Å; I161-L163 PolarHBondContact O-N 3.03Å; I161-V164 PolarHBondContact O-N 3.46Å; I161-M165 PolarHBondContact O-N 3.11Å; I161-Y255 HydrophobicContact CD1-CD2 4.44Å; I161-Y255 HydrophobicContact CG1-CD2 4.49Å; I161-Y255 HydrophobicContact CG2-CD1 4.44Å; I161-Y255 HydrophobicContact CG2-CD2 4.07Å; I161-Y255 HydrophobicContact CG2-CG 3.95Å; I161-T537 HydrophobicContact CG2-CG2 3.93Å; I161-P544 HydrophobicContact CB-CB 4.13Å; I161-P544 HydrophobicContact CB-CG 4.29Å; I161-P544 HydrophobicContact CG2-CB 3.94Å; I161-P544 HydrophobicContact CG2-CG 3.54Å
162	F	96.3	Very high	92.8	Very high	38 Å²	38	32.5 Å²	32.5	17%	0.167	17%	0.165	C	C	.	.	H	α-helix	trans	-57.6	-47.5	173.9	170.8	-114.7	0	0	0	111.5	N158 L159 I160 V164 M165 F166 M170 M542 P544 A545	N158-F162 WeakPolarHBondContact O-CB 3.47Å; N158-F162 PolarHBondContact O-N 2.9Å; L159-F162 HydrophobicContact CD1-CD1 4.49Å; L159-F162 WeakPolarHBondContact O-CB 3.28Å; L159-F162 PolarHBondContact O-N 3.39Å; I160-F162 VanDerWaalsContact C-N 3.28Å; I160-F162 PolarHBondContact O-N 2.95Å; F162-V164 VanDerWaalsContact C-N 3.32Å; F162-V164 PolarHBondContact O-N 2.89Å; F162-M165 PolarHBondContact O-N 3.03Å; F162-F166 HydrophobicContact CD2-CB 4.49Å; F162-F166 HydrophobicContact CE1-CB 4.45Å; F162-F166 HydrophobicContact CE2-CB 4.13Å; F162-F166 HydrophobicContact CE2-CD2 4.25Å; F162-F166 HydrophobicContact CZ-CB 4.11Å; F162-F166 AromaticContact CZ-CD2 3.9Å; F162-F166 HydrophobicContact CZ-CD2 3.9Å; F162-F166 HydrophobicContact CZ-CG 4.16Å; F162-F166 WeakPolarHBondContact O-CA 3.46Å; F162-F166 WeakPolarHBondContact O-CB 3.32Å; F162-F166 PolarHBondContact O-N 3.1Å; F162-M170 HydrophobicContact CD2-CE 3.9Å; F162-M170 HydrophobicContact CE2-CE 3.66Å; F162-M170 HydrophobicContact CE2-SD 4.25Å; F162-M542 HydrophobicContact CE2-CE 3.75Å; F162-M542 HydrophobicContact CZ-CE 4.23Å; F162-P544 HydrophobicContact CB-CB 3.95Å; F162-A545 HydrophobicContact CD2-CB 3.63Å; F162-A545 HydrophobicContact CE2-CB 3.84Å; F162-A545 HydrophobicContact CG-CB 3.99Å; F162-A545 HydrophobicContact CZ-CB 4.39Å
163	L	94.9	Very high	92.6	Very high	81 Å²	81	29.3 Å²	29.3	42%	0.424	15%	0.154	S	C	.	.	H	α-helix	trans	-61.5	-38.4	178.6	-71.9	171.2	0	0	0	112.4	L159 I160 I161 F166 C167	L159-L163 HydrophobicContact CG-CD1 4.46Å; L159-L163 VanDerWaalsContact O-CG 3.29Å; L159-L163 WeakPolarHBondContact O-CG 3.47Å; L159-L163 PolarHBondContact O-N 3.27Å; I160-L163 PolarHBondContact O-N 3.35Å; I160-L163 VanDerWaalsContact O-N 3.15Å; I161-L163 PolarHBondContact O-N 3.03Å; L163-F166 PolarHBondContact O-N 2.9Å; L163-C167 VanDerWaalsContact O-CB 3.24Å; L163-C167 WeakPolarHBondContact O-CB 3.22Å; L163-C167 PolarHBondContact O-N 2.81Å; L163-C167 PolarHBondContact O-SG 3.38Å
164	V	94.8	Very high	92.4	Very high	24 Å²	24	33 Å²	33	15%	0.145	17%	0.173	C	C	.	.	H	α-helix	trans	-62.4	-52.3	175	172.1	0	0	0	0	110.3	I160 I161 F162 F166 C167 F168 A251	I160-V164 HydrophobicContact CG2-CG2 4.42Å; I160-V164 WeakPolarHBondContact O-CG2 3.19Å; I160-V164 PolarHBondContact O-N 3.21Å; I161-V164 PolarHBondContact O-N 3.46Å; F162-V164 VanDerWaalsContact C-N 3.32Å; F162-V164 PolarHBondContact O-N 2.89Å; V164-F166 VanDerWaalsContact C-N 3.3Å; V164-F166 PolarHBondContact O-N 3.33Å; V164-C167 PolarHBondContact O-N 3.35Å; V164-F168 HydrophobicContact CG1-CD2 4.07Å; V164-F168 VanDerWaalsContact O-CD2 3.31Å; V164-F168 WeakPolarHBondContact O-CD2 3.43Å; V164-F168 PolarHBondContact O-N 3.12Å; V164-A251 HydrophobicContact CG1-CB 4.37Å
165	M	94.4	Very high	92	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.7	-36.4	178.5	-66	-56.9	-68.8	0	0	112	I161 F162 V169 M170 Y248 A251 Y255 T537 P541	I161-M165 PolarHBondContact O-N 3.11Å; F162-M165 PolarHBondContact O-N 3.03Å; M165-V169 HydrophobicContact CE-CB 4.4Å; M165-V169 HydrophobicContact CE-CG2 3.9Å; M165-V169 WeakPolarHBondContact O-CA 3.3Å; M165-V169 VanDerWaalsContact O-CB 3.29Å; M165-V169 WeakPolarHBondContact O-CB 3.38Å; M165-V169 PolarHBondContact O-N 2.98Å; M165-V169 HydrophobicContact SD-CG2 4.43Å; M165-M170 HydrophobicContact CB-CE 3.85Å; M165-M170 PolarHBondContact O-N 3.45Å; M165-M170 VanDerWaalsContact O-N 3.1Å; M165-Y248 HydrophobicContact CE-CE2 4.2Å; M165-A251 HydrophobicContact SD-CB 3.93Å; M165-Y255 HydrophobicContact SD-CD1 4.1Å; M165-Y255 HydrophobicContact SD-CE1 4.39Å; M165-T537 HydrophobicContact CE-CG2 4.43Å; M165-T537 HydrophobicContact CG-CG2 3.67Å; M165-T537 HydrophobicContact SD-CG2 4.12Å; M165-P541 HydrophobicContact CE-CB 3.79Å; M165-P541 HydrophobicContact CE-CG 4.06Å
166	F	93.9	Very high	91.3	Very high	66 Å²	66	38.3 Å²	38.3	29%	0.289	20%	0.201	S	C	.	.	I	π-helix	trans	-64.9	-51	178.4	-177.8	-99.6	0	0	0	110.6	F162 L163 V164 M170 L171 I174	F162-F166 HydrophobicContact CD2-CB 4.49Å; F162-F166 HydrophobicContact CE1-CB 4.45Å; F162-F166 HydrophobicContact CE2-CB 4.13Å; F162-F166 HydrophobicContact CE2-CD2 4.25Å; F162-F166 HydrophobicContact CZ-CB 4.11Å; F162-F166 AromaticContact CZ-CD2 3.9Å; F162-F166 HydrophobicContact CZ-CD2 3.9Å; F162-F166 HydrophobicContact CZ-CG 4.16Å; F162-F166 WeakPolarHBondContact O-CA 3.46Å; F162-F166 WeakPolarHBondContact O-CB 3.32Å; F162-F166 PolarHBondContact O-N 3.1Å; L163-F166 PolarHBondContact O-N 2.9Å; V164-F166 VanDerWaalsContact C-N 3.3Å; V164-F166 PolarHBondContact O-N 3.33Å; F166-M170 VanDerWaalsContact CA-CE 3.42Å; F166-M170 HydrophobicContact CB-CE 3.84Å; F166-M170 HydrophobicContact CD2-CB 4.02Å; F166-M170 HydrophobicContact CD2-CE 4.33Å; F166-M170 HydrophobicContact CD2-SD 3.96Å; F166-M170 VanDerWaalsContact N-CE 3.33Å; F166-M170 PolarHBondContact O-N 3.44Å; F166-L171 HydrophobicContact CE1-CD1 4.37Å; F166-L171 HydrophobicContact CZ-CD1 4.49Å; F166-L171 WeakPolarHBondContact O-CB 3.17Å; F166-L171 PolarHBondContact O-N 3.47Å; F166-I174 HydrophobicContact CE2-CD1 4.34Å
167	C	92.8	Very high	90.1	Very high	62 Å²	62	41.7 Å²	41.7	42%	0.419	22%	0.221	S	C	.	.	I	π-helix	trans	-68.7	-40.4	-177	-69.5	0	0	0	0	113.3	L163 V164 P172	L163-C167 VanDerWaalsContact O-CB 3.24Å; L163-C167 WeakPolarHBondContact O-CB 3.22Å; L163-C167 PolarHBondContact O-N 2.81Å; L163-C167 PolarHBondContact O-SG 3.38Å; V164-C167 PolarHBondContact O-N 3.35Å; C167-P172 WeakPolarHBondContact O-CD 3.15Å
168	F	92	Very high	88.8	Confident	111 Å²	111	44.8 Å²	44.8	49%	0.487	24%	0.24	S	C	.	.	I	π-helix	trans	-95.3	-21.9	-173.6	-69.1	-75.6	0	0	0	114.2	V164 Y242 A251	V164-F168 HydrophobicContact CG1-CD2 4.07Å; V164-F168 VanDerWaalsContact O-CD2 3.31Å; V164-F168 WeakPolarHBondContact O-CD2 3.43Å; V164-F168 PolarHBondContact O-N 3.12Å; F168-Y242 PolarHBondContact O-OH 2.71Å; F168-A251 HydrophobicContact CB-CB 4.08Å
169	V	91.3	Very high	86.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.271	C	S	.	.	I	π-helix	trans	-117.9	-51.3	-176.2	-177.6	0	0	0	0	111.6	M165 M173 Y230 L244 Y248 A251	M165-V169 HydrophobicContact CE-CB 4.4Å; M165-V169 HydrophobicContact CE-CG2 3.9Å; M165-V169 WeakPolarHBondContact O-CA 3.3Å; M165-V169 VanDerWaalsContact O-CB 3.29Å; M165-V169 WeakPolarHBondContact O-CB 3.38Å; M165-V169 PolarHBondContact O-N 2.98Å; M165-V169 HydrophobicContact SD-CG2 4.43Å; V169-M173 WeakPolarHBondContact O-CG 3.43Å; V169-Y230 HydrophobicContact CG1-CD1 3.79Å; V169-Y230 HydrophobicContact CG1-CE1 3.58Å; V169-L244 HydrophobicContact CG1-CD1 4.4Å; V169-Y248 HydrophobicContact CB-CD2 4.48Å; V169-Y248 HydrophobicContact CG1-CD2 3.64Å; V169-Y248 HydrophobicContact CG1-CE2 3.89Å; V169-Y248 HydrophobicContact CG2-CD2 3.97Å; V169-A251 HydrophobicContact CG2-CB 4.03Å
170	M	90.5	Very high	85.1	Confident	4 Å²	4	54.4 Å²	54.4	2%	0.02	29%	0.285	C	S	.	.	I	π-helix	trans	-77.1	-45.8	-174.7	-62.3	176.1	-110.4	0	0	113	F162 M165 F166 M173 I174 Y230 M542	F162-M170 HydrophobicContact CD2-CE 3.9Å; F162-M170 HydrophobicContact CE2-CE 3.66Å; F162-M170 HydrophobicContact CE2-SD 4.25Å; M165-M170 HydrophobicContact CB-CE 3.85Å; M165-M170 PolarHBondContact O-N 3.45Å; M165-M170 VanDerWaalsContact O-N 3.1Å; F166-M170 VanDerWaalsContact CA-CE 3.42Å; F166-M170 HydrophobicContact CB-CE 3.84Å; F166-M170 HydrophobicContact CD2-CB 4.02Å; F166-M170 HydrophobicContact CD2-CE 4.33Å; F166-M170 HydrophobicContact CD2-SD 3.96Å; F166-M170 VanDerWaalsContact N-CE 3.33Å; F166-M170 PolarHBondContact O-N 3.44Å; M170-M173 WeakPolarHBondContact O-CB 3.38Å; M170-M173 PolarHBondContact O-N 3.36Å; M170-M173 VanDerWaalsContact O-N 3.14Å; M170-I174 HydrophobicContact CB-CD1 4.48Å; M170-I174 WeakPolarHBondContact O-CG1 3.34Å; M170-I174 PolarHBondContact O-N 3.03Å; M170-Y230 WeakPolarHBondContact CG-OH 3.12Å; M170-M542 HydrophobicContact CE-CG 4.21Å; M170-M542 HydrophobicContact SD-CE 4.29Å; M170-M542 HydrophobicContact SD-CG 3.63Å; M170-M542 HydrophobicContact SD-SD 4.28Å
171	L	90.1	Very high	82.9	Confident	62 Å²	62	59.2 Å²	59.2	33%	0.325	31%	0.312	S	S	.	.	H	α-helix	trans	-61.8	-45.7	-174.9	-178.1	72.7	0	0	0	112.2	F166 M173 I174 L175	F166-L171 HydrophobicContact CE1-CD1 4.37Å; F166-L171 HydrophobicContact CZ-CD1 4.49Å; F166-L171 WeakPolarHBondContact O-CB 3.17Å; F166-L171 PolarHBondContact O-N 3.47Å; L171-M173 PolarHBondContact O-N 2.77Å; L171-I174 PolarHBondContact O-N 2.97Å; L171-L175 HydrophobicContact CD1-CD1 3.99Å; L171-L175 HydrophobicContact CD1-CG 4.19Å; L171-L175 HydrophobicContact CD2-CD1 4.46Å; L171-L175 HydrophobicContact CG-CD1 3.84Å; L171-L175 HydrophobicContact CG-CG 4.38Å; L171-L175 WeakPolarHBondContact O-CB 3.4Å; L171-L175 VanDerWaalsContact O-CG 3.32Å; L171-L175 WeakPolarHBondContact O-CG 3.44Å; L171-L175 PolarHBondContact O-N 3.28Å
172	P	88.2	Confident	80.3	Confident	10 Å²	10	63.5 Å²	63.5	7%	0.065	34%	0.338	C	S	.	.	H	α-helix	trans	-60.4	-35.1	174.9	-24.1	36	0	0	0	112.7	C167 D176 I235 F237 Y242	C167-P172 WeakPolarHBondContact O-CD 3.15Å; P172-D176 PolarHBondContact O-N 2.91Å; P172-I235 HydrophobicContact CB-CD1 3.99Å; P172-F237 HydrophobicContact CB-CE2 4.44Å; P172-F237 HydrophobicContact CB-CZ 4.18Å; P172-Y242 HydrophobicContact CB-CD1 3.97Å; P172-Y242 HydrophobicContact CB-CE1 3.85Å; P172-Y242 HydrophobicContact CG-CD1 4.34Å; P172-Y242 HydrophobicContact CG-CE1 3.75Å; P172-Y242 HydrophobicContact CG-CE2 4.5Å
173	M	84.8	Confident	77.7	Confident	21 Å²	21	67.7 Å²	67.7	10%	0.103	36%	0.36	C	S	.	.	H	α-helix	trans	-71	-32.8	177.2	-75.5	-70	-68.4	0	0	113.3	V169 M170 L171 Y224 F229 Y230 K232 I235 L244	V169-M173 WeakPolarHBondContact O-CG 3.43Å; M170-M173 WeakPolarHBondContact O-CB 3.38Å; M170-M173 PolarHBondContact O-N 3.36Å; M170-M173 VanDerWaalsContact O-N 3.14Å; L171-M173 PolarHBondContact O-N 2.77Å; M173-Y224 HydrophobicContact CB-CE1 4.29Å; M173-F229 HydrophobicContact CE-CD1 4.33Å; M173-F229 HydrophobicContact CE-CE1 4.08Å; M173-Y230 HydrophobicContact CE-CD1 4.41Å; M173-Y230 HydrophobicContact CG-CD1 3.97Å; M173-Y230 HydrophobicContact CG-CE1 4.23Å; M173-K232 HydrophobicContact CE-CG 4.4Å; M173-K232 HydrophobicContact SD-CB 4.2Å; M173-K232 HydrophobicContact SD-CD 4.39Å; M173-K232 HydrophobicContact SD-CG 4.45Å; M173-I235 HydrophobicContact CG-CD1 4.25Å; M173-I235 HydrophobicContact SD-CD1 3.82Å; M173-L244 HydrophobicContact CG-CD1 4.06Å; M173-L244 HydrophobicContact CG-CD2 4.21Å; M173-L244 HydrophobicContact SD-CD1 4.4Å; M173-L244 HydrophobicContact SD-CD2 3.67Å
174	I	85.7	Confident	74.7	Confident	82 Å²	82	70.7 Å²	70.7	42%	0.421	38%	0.377	S	S	.	.	H	α-helix	trans	-74.7	-37.4	176.9	-67.4	163	0	0	0	111	F166 M170 L171 D176 Y224	F166-I174 HydrophobicContact CE2-CD1 4.34Å; M170-I174 HydrophobicContact CB-CD1 4.48Å; M170-I174 WeakPolarHBondContact O-CG1 3.34Å; M170-I174 PolarHBondContact O-N 3.03Å; L171-I174 PolarHBondContact O-N 2.97Å; I174-D176 VanDerWaalsContact C-N 3.27Å; I174-D176 PolarHBondContact O-N 3.48Å; I174-Y224 HydrophobicContact CG1-CE1 3.99Å; I174-Y224 HydrophobicContact CG1-CE2 4.31Å
175	L	85.4	Confident	72	Confident	104 Å²	104	73.4 Å²	73.4	55%	0.545	39%	0.39	S	S	.	.	S	Bend	trans	-81.6	-3.3	-177.5	-66.2	176.8	0	0	0	113.8	L171 P177 F237	L171-L175 HydrophobicContact CD1-CD1 3.99Å; L171-L175 HydrophobicContact CD1-CG 4.19Å; L171-L175 HydrophobicContact CD2-CD1 4.46Å; L171-L175 HydrophobicContact CG-CD1 3.84Å; L171-L175 HydrophobicContact CG-CG 4.38Å; L171-L175 WeakPolarHBondContact O-CB 3.4Å; L171-L175 VanDerWaalsContact O-CG 3.32Å; L171-L175 WeakPolarHBondContact O-CG 3.44Å; L171-L175 PolarHBondContact O-N 3.28Å; L175-P177 VanDerWaalsContact O-CD 3.3Å; L175-P177 WeakPolarHBondContact O-CD 3.3Å; L175-F237 HydrophobicContact CB-CE1 4.24Å
176	D	78.3	Confident	69.1	Low	20 Å²	20	82 Å²	82	11%	0.107	43%	0.431	C	S	.	.			trans	-67.2	117.9	-177	-172	-12.4	0	0	0	111	P172 I174 T178 K232 I235	P172-D176 PolarHBondContact O-N 2.91Å; I174-D176 VanDerWaalsContact C-N 3.27Å; I174-D176 PolarHBondContact O-N 3.48Å; D176-T178 PolarHBondContact O-N 3.28Å; D176-T178 WeakPolarHBondContact OD1-CB 3.38Å; D176-T178 PolarHBondContact OD1-N 3.18Å; D176-T178 PolarHBondContact OD1-OG1 3.22Å; D176-T178 PolarHBondContact OD2-OG1 3.38Å; D176-K232 VanDerWaalsContact CG-NZ 3.3Å; D176-K232 IonicContact OD1-NZ 2.75Å; D176-K232 WeakPolarHBondContact OD2-CD 3.48Å; D176-K232 WeakPolarHBondContact OD2-CE 3.5Å; D176-K232 IonicContact OD2-NZ 3.66Å; D176-K232 PolarHBondContact OD2-NZ 2.59Å; D176-I235 HydrophobicContact CB-CG2 3.99Å
177	P	67.1	Low	66.5	Low	96 Å²	96	88 Å²	88	62%	0.623	46%	0.459	S	S	*	.			trans	-75.3	-10.5	-179.6	31.2	-35.1	0	0	0	113.1	L175 P179	L175-P177 VanDerWaalsContact O-CD 3.3Å; L175-P177 WeakPolarHBondContact O-CD 3.3Å; P177-P179 WeakPolarHBondContact O-CD 3.34Å
178	T	66	Low	63.7	Low	66 Å²	66	93.8 Å²	93.8	41%	0.405	48%	0.48	S	S	.	.	S	Bend	trans	-79.5	117.6	-177.4	60	0	0	0	0	111.1	D176 R180 K232	D176-T178 PolarHBondContact O-N 3.28Å; D176-T178 WeakPolarHBondContact OD1-CB 3.38Å; D176-T178 PolarHBondContact OD1-N 3.18Å; D176-T178 PolarHBondContact OD1-OG1 3.22Å; D176-T178 PolarHBondContact OD2-OG1 3.38Å; T178-R180 PolarHBondContact O-N 3.44Å; T178-K232 PolarHBondContact O-NZ 3.41Å; T178-K232 PolarHBondContact OG1-NZ 3.3Å
179	P	55.8	Low	61.3	Low	103 Å²	103	91.8 Å²	91.8	67%	0.669	49%	0.491	S	S	*	.			trans	-58.4	138.7	175.3	23.4	-30.9	0	0	0	109.1	P177 N181	P177-P179 WeakPolarHBondContact O-CD 3.34Å; P179-N181 VanDerWaalsContact C-N 3.34Å; P179-N181 PolarHBondContact O-N 3.2Å
180	R	56.7	Low	59	Low	154 Å²	154	97.2 Å²	97.2	58%	0.581	52%	0.52	S	S	*	.			trans	-61.6	101.6	170.4	-90	-177.3	-79.5	-170.2	-5.3	107.3	T178 V182 F229	T178-R180 PolarHBondContact O-N 3.44Å; R180-V182 VanDerWaalsContact C-N 3.31Å; R180-V182 PolarHBondContact O-N 3.14Å; R180-F229 VanDerWaalsContact NH1-CZ 3.29Å
181	N	45.5	Very low	56.9	Low	138 Å²	138	103 Å²	103	74%	0.738	56%	0.555	S	S	*	*			trans	-59.6	103.8	163.1	-70.7	-15.4	0	0	0	105.8	P179 I183	P179-N181 VanDerWaalsContact C-N 3.34Å; P179-N181 PolarHBondContact O-N 3.2Å; N181-I183 PolarHBondContact O-N 3.23Å
182	V	41.8	Very low	54.9	Low	92 Å²	92	102.5 Å²	102.5	56%	0.558	56%	0.556	S	S	*	*			trans	-58.6	102.4	159.9	177.7	0	0	0	0	103.4	R180 N184	R180-V182 VanDerWaalsContact C-N 3.31Å; R180-V182 PolarHBondContact O-N 3.14Å; V182-N184 PolarHBondContact O-N 3.16Å
183	I	40.8	Very low	52.6	Low	126 Å²	126	110.6 Å²	110.6	65%	0.646	59%	0.585	S	S	*	*			trans	-64.2	95.3	171.1	-53	174.3	0	0	0	104.6	N181 N185	N181-I183 PolarHBondContact O-N 3.23Å; I183-N185 WeakPolarHBondContact CG2-OD1 3.42Å; I183-N185 PolarHBondContact O-N 2.9Å
184	N	32.7	Very low	50.5	Low	144 Å²	144	112.2 Å²	112.2	77%	0.77	60%	0.596	S	S	*	*			trans	-64.5	94.3	153.8	-74.9	-13.1	0	0	0	103.8	V182 Q186	V182-N184 PolarHBondContact O-N 3.16Å; N184-Q186 PolarHBondContact O-N 3.44Å
185	N	38.5	Very low	48.5	Very low	80 Å²	80	111.9 Å²	111.9	43%	0.428	59%	0.593	S	S	.	*			trans	-60.7	105.1	175.5	-79.9	-39.3	0	0	0	107.1	I183 H187 T194	I183-N185 WeakPolarHBondContact CG2-OD1 3.42Å; I183-N185 PolarHBondContact O-N 2.9Å; N185-H187 PolarHBondContact O-N 3.38Å; N185-T194 HydrophobicContact CB-CG2 4.32Å
186	Q	32.9	Very low	46.4	Very low	182 Å²	182	109.5 Å²	109.5	85%	0.85	58%	0.584	S	S	*	*			trans	-58.6	125	158.6	-136.6	171.5	-25.5	0	0	106.1	N184 Q188	N184-Q186 PolarHBondContact O-N 3.44Å; Q186-Q188 PolarHBondContact O-N 3.19Å
187	H	39.1	Very low	44.7	Very low	190 Å²	190	115.8 Å²	115.8	88%	0.88	61%	0.606	S	S	*	*	S	Bend	trans	-61.1	93.2	-179.6	-78	-81.3	0	0	0	110.5	N185	N185-H187 PolarHBondContact O-N 3.38Å
188	Q	34.9	Very low	43.5	Very low	185 Å²	185	116.1 Å²	116.1	86%	0.864	61%	0.606	S	S	*	*			trans	-145.1	102.9	162.2	-109.5	168.8	-0.7	0	0	110	Q186	Q186-Q188 PolarHBondContact O-N 3.19Å
189	G	41.8	Very low	42.2	Very low	69 Å²	69	118.4 Å²	118.4	71%	0.711	62%	0.62	S	S	*	*	S	Bend	trans	56.9	76.1	152.5	0	0	0	0	0	118
190	N	42	Very low	41.6	Very low	114 Å²	114	120.9 Å²	120.9	61%	0.61	62%	0.616	S	S	*	*			trans	170.7	108.1	134.3	-83.8	-12.5	0	0	0	109.4	C192 R193	N190-C192 PolarHBondContact O-N 2.93Å; N190-C192 VanDerWaalsContact O-N 3.07Å; N190-R193 PolarHBondContact O-N 3.48Å
191	V	47.8	Very low	40.7	Very low	124 Å²	124	123.9 Å²	123.9	75%	0.752	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-21.3	-172.2	-178	0	0	0	0	113.3	T194	V191-T194 PolarHBondContact O-OG1 3.34Å; V191-T194 VanDerWaalsContact O-OG1 3.1Å
192	C	46.2	Very low	40.7	Very low	52 Å²	52	124.9 Å²	124.9	35%	0.351	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.7	-9.8	-179.6	-67.4	0	0	0	0	115.6	N190 C453	N190-C192 PolarHBondContact O-N 2.93Å; N190-C192 VanDerWaalsContact O-N 3.07Å; C192-C453 VanDerWaalsContact SG-SG 3.67Å
193	R	41.6	Very low	40.8	Very low	181 Å²	181	128.4 Å²	128.4	68%	0.683	65%	0.646	S	S	*	*	S	Bend	trans	-96	-11.7	177.6	-75.2	-173.5	177.4	167.2	-0.4	113.6	N190 H195	N190-R193 PolarHBondContact O-N 3.48Å; R193-H195 PolarHBondContact O-N 3.41Å
194	T	40.9	Very low	41.4	Very low	54 Å²	54	124.6 Å²	124.6	33%	0.331	63%	0.625	S	S	.	*			trans	-87.9	102.7	179	47.6	0	0	0	0	109	N185 V191 P196	N185-T194 HydrophobicContact CB-CG2 4.32Å; V191-T194 PolarHBondContact O-OG1 3.34Å; V191-T194 VanDerWaalsContact O-OG1 3.1Å; T194-P196 WeakPolarHBondContact O-CD 3.4Å
195	H	43.3	Very low	42.8	Very low	75 Å²	75	123.2 Å²	123.2	35%	0.347	62%	0.618	S	S	.	*			trans	-75.9	106	158.4	-172.7	74.1	0	0	0	106.5	R193 R197	R193-H195 PolarHBondContact O-N 3.41Å; H195-R197 PolarHBondContact O-N 2.9Å
196	P	41.8	Very low	44	Very low	54 Å²	54	127.9 Å²	127.9	35%	0.351	63%	0.631	S	S	.	*			trans	-67.4	98.8	169.1	27.9	-27.7	0	0	0	105.2	T194 T198 Y461	T194-P196 WeakPolarHBondContact O-CD 3.4Å; P196-T198 PolarHBondContact O-N 3.43Å; P196-Y461 HydrophobicContact CG-CE1 3.86Å
197	R	41.6	Very low	45.5	Very low	153 Å²	153	125.3 Å²	125.3	58%	0.577	62%	0.618	S	S	*	*			trans	-63	78.1	162.5	-74.1	-173.3	171.6	170	1	105.9	H195 T199	H195-R197 PolarHBondContact O-N 2.9Å; R197-T199 VanDerWaalsContact C-N 3.33Å; R197-T199 PolarHBondContact O-N 2.87Å
198	T	41.1	Very low	46.7	Very low	102 Å²	102	120.2 Å²	120.2	63%	0.626	60%	0.595	S	S	*	*			trans	-61.9	106.8	172.2	23.8	0	0	0	0	104.7	P196 R200	P196-T198 PolarHBondContact O-N 3.43Å; T198-R200 PolarHBondContact O-N 3.49Å
199	T	38.7	Very low	48.3	Very low	114 Å²	114	114.8 Å²	114.8	70%	0.699	57%	0.569	S	S	*	*			trans	-63	73.6	167.1	-25.9	0	0	0	0	106.3	R197 R201	R197-T199 VanDerWaalsContact C-N 3.33Å; R197-T199 PolarHBondContact O-N 2.87Å; T199-R201 PolarHBondContact O-N 2.89Å
200	R	43.3	Very low	49.7	Very low	155 Å²	155	115 Å²	115	59%	0.585	55%	0.553	S	S	*	*			trans	-57	112.1	164.6	-101.6	-168.7	-94.9	175.4	-0.2	104.3	T198 I202	T198-R200 PolarHBondContact O-N 3.49Å; R200-I202 PolarHBondContact O-N 3.18Å
201	R	38.8	Very low	51	Low	217 Å²	217	110.8 Å²	110.8	82%	0.819	53%	0.532	S	S	*	.			trans	-43.2	137.5	-173.7	-82.1	175.7	-177.5	155.4	0.8	110.5	T199 L203	T199-R201 PolarHBondContact O-N 2.89Å; R201-L203 PolarHBondContact O-N 2.84Å
202	I	45.5	Very low	52	Low	159 Å²	159	105.7 Å²	105.7	82%	0.815	50%	0.5	S	S	*	.	S	Bend	trans	-63.2	-7.3	179.8	-66.5	162.5	0	0	0	112.4	R200 K204	R200-I202 PolarHBondContact O-N 3.18Å; I202-K204 PolarHBondContact O-N 3.33Å
203	L	43	Very low	53.4	Low	167 Å²	167	107.8 Å²	107.8	87%	0.874	51%	0.507	S	S	*	.			trans	-89.7	84.6	165.5	-88.6	87.7	0	0	0	110.4	R201	R201-L203 PolarHBondContact O-N 2.84Å
204	K	54.4	Low	55	Low	45 Å²	45	101.9 Å²	101.9	20%	0.196	49%	0.489	C	S	.	.			trans	-105.8	149.7	159.2	-74.8	-173.3	172	-172.1	0	109.1	I202 E208 D212	I202-K204 PolarHBondContact O-N 3.33Å; K204-E208 HydrophobicContact CB-CB 4.17Å; K204-E208 WeakPolarHBondContact CB-OE2 3.32Å; K204-E208 HydrophobicContact CD-CB 4.17Å; K204-E208 VanDerWaalsContact CD-OE2 3.24Å; K204-E208 WeakPolarHBondContact CD-OE2 2.97Å; K204-E208 WeakPolarHBondContact CG-OE2 3.35Å; K204-D212 IonicContact NZ-OD1 2.85Å; K204-D212 PolarHBondContact NZ-OD1 2.96Å; K204-D212 IonicContact NZ-OD2 2.75Å; K204-D212 PolarHBondContact NZ-OD2 3.18Å
205	N	61.9	Low	56.2	Low	116 Å²	116	99.5 Å²	99.5	62%	0.62	47%	0.474	S	S	*	.			trans	-63.9	150.4	175.7	-69.9	-24	0	0	0	110.8	H207 E208	N205-H207 PolarHBondContact O-N 3.47Å; N205-H207 VanDerWaalsContact O-N 3.07Å; N205-E208 WeakPolarHBondContact O-CB 3.43Å; N205-E208 PolarHBondContact O-N 2.84Å
206	Y	63.3	Low	57.5	Low	178 Å²	178	96 Å²	96	70%	0.698	46%	0.458	S	S	*	.	H	α-helix	trans	-51.8	-35.7	-179.2	-172.5	-99.9	0	0	0	113.6	E208 H209 I210	Y206-E208 VanDerWaalsContact C-N 3.31Å; Y206-E208 PolarHBondContact O-N 2.88Å; Y206-H209 WeakPolarHBondContact O-CB 3.42Å; Y206-H209 PolarHBondContact O-N 2.86Å; Y206-I210 HydrophobicContact CD1-CD1 3.94Å; Y206-I210 HydrophobicContact CD1-CG1 4.45Å; Y206-I210 HydrophobicContact CE1-CD1 3.7Å; Y206-I210 HydrophobicContact CE1-CG1 4.22Å; Y206-I210 PolarHBondContact O-N 3.35Å
207	H	63.7	Low	58.7	Low	127 Å²	127	95 Å²	95	59%	0.588	45%	0.451	S	S	*	.	H	α-helix	trans	-64.7	-32.1	178.1	-62.8	86.8	0	0	0	113.3	N205 H209 I210 V211	N205-H207 PolarHBondContact O-N 3.47Å; N205-H207 VanDerWaalsContact O-N 3.07Å; H207-H209 VanDerWaalsContact C-N 3.33Å; H207-I210 PolarHBondContact O-N 3.3Å; H207-V211 PolarHBondContact O-N 3.46Å
208	E	66.3	Low	60.1	Low	83 Å²	83	88.7 Å²	88.7	39%	0.388	43%	0.433	S	S	.	.	H	α-helix	trans	-73.2	-27.9	176.4	-63.2	-175.3	-174.1	0	0	111.6	K204 N205 Y206 V211 D212	K204-E208 HydrophobicContact CB-CB 4.17Å; K204-E208 WeakPolarHBondContact CB-OE2 3.32Å; K204-E208 HydrophobicContact CD-CB 4.17Å; K204-E208 VanDerWaalsContact CD-OE2 3.24Å; K204-E208 WeakPolarHBondContact CD-OE2 2.97Å; K204-E208 WeakPolarHBondContact CG-OE2 3.35Å; N205-E208 WeakPolarHBondContact O-CB 3.43Å; N205-E208 PolarHBondContact O-N 2.84Å; Y206-E208 VanDerWaalsContact C-N 3.31Å; Y206-E208 PolarHBondContact O-N 2.88Å; E208-V211 PolarHBondContact O-N 3.31Å; E208-D212 VanDerWaalsContact O-CB 3.29Å; E208-D212 WeakPolarHBondContact O-CB 3.29Å; E208-D212 PolarHBondContact O-N 2.73Å
209	H	68.3	Low	61.4	Low	72 Å²	72	88.5 Å²	88.5	33%	0.333	43%	0.427	S	S	.	.	H	α-helix	trans	-69.7	-34	173.3	-71.9	-69.9	0	0	0	112.8	Y206 H207 L213	Y206-H209 WeakPolarHBondContact O-CB 3.42Å; Y206-H209 PolarHBondContact O-N 2.86Å; H207-H209 VanDerWaalsContact C-N 3.33Å; H209-L213 VanDerWaalsContact O-CB 3.31Å; H209-L213 WeakPolarHBondContact O-CB 3.46Å; H209-L213 PolarHBondContact O-N 3.28Å
210	I	70.4	Confident	62.9	Low	73 Å²	73	84.3 Å²	84.3	37%	0.374	40%	0.4	S	S	.	.	H	α-helix	trans	-68	-41.5	174.9	-61	172.8	0	0	0	110.2	Y206 H207 L213 L214	Y206-I210 HydrophobicContact CD1-CD1 3.94Å; Y206-I210 HydrophobicContact CD1-CG1 4.45Å; Y206-I210 HydrophobicContact CE1-CD1 3.7Å; Y206-I210 HydrophobicContact CE1-CG1 4.22Å; Y206-I210 PolarHBondContact O-N 3.35Å; H207-I210 PolarHBondContact O-N 3.3Å; I210-L213 PolarHBondContact O-N 2.86Å; I210-L214 HydrophobicContact CG2-CD1 3.89Å; I210-L214 HydrophobicContact CG2-CG 4.42Å; I210-L214 WeakPolarHBondContact O-CB 3.35Å; I210-L214 WeakPolarHBondContact O-CG 3.33Å; I210-L214 PolarHBondContact O-N 2.84Å
211	V	68.5	Low	64.3	Low	26 Å²	26	78.6 Å²	78.6	16%	0.158	38%	0.38	C	S	.	.	H	α-helix	trans	-68.4	-44.3	176.6	176.7	0	0	0	0	111.1	H207 E208 L213 L214 S215 F379 L383	H207-V211 PolarHBondContact O-N 3.46Å; E208-V211 PolarHBondContact O-N 3.31Å; V211-L213 PolarHBondContact O-N 3.26Å; V211-L214 PolarHBondContact O-N 3.45Å; V211-S215 VanDerWaalsContact O-CB 3.31Å; V211-S215 WeakPolarHBondContact O-CB 3.45Å; V211-S215 PolarHBondContact O-N 2.72Å; V211-S215 PolarHBondContact O-OG 2.86Å; V211-F379 HydrophobicContact CG2-CE2 3.68Å; V211-F379 HydrophobicContact CG2-CZ 3.7Å; V211-L383 HydrophobicContact CG1-CD1 4.06Å; V211-L383 HydrophobicContact CG2-CD1 4.31Å
212	D	70.1	Confident	65.7	Low	16 Å²	16	75.5 Å²	75.5	9%	0.086	37%	0.368	C	S	.	.	H	α-helix	trans	-57.5	-36.7	174	-75	1.2	0	0	0	110.8	K204 E208 G216 D217	K204-D212 IonicContact NZ-OD1 2.85Å; K204-D212 PolarHBondContact NZ-OD1 2.96Å; K204-D212 IonicContact NZ-OD2 2.75Å; K204-D212 PolarHBondContact NZ-OD2 3.18Å; E208-D212 VanDerWaalsContact O-CB 3.29Å; E208-D212 WeakPolarHBondContact O-CB 3.29Å; E208-D212 PolarHBondContact O-N 2.73Å; D212-G216 CarbonylContact O-C 3.58Å; D212-G216 WeakPolarHBondContact O-CA 3.38Å; D212-G216 PolarHBondContact O-N 2.94Å; D212-D217 WeakPolarHBondContact CB-O 3.47Å; D212-D217 PolarHBondContact O-N 3.3Å; D212-D217 VanDerWaalsContact O-N 3.07Å
213	L	76.2	Confident	67.4	Low	97 Å²	97	70.5 Å²	70.5	51%	0.508	35%	0.345	S	S	.	.	H	α-helix	trans	-71.7	-41.2	175.6	-178.1	67.9	0	0	0	113.6	H209 I210 V211 L220 Y476	H209-L213 VanDerWaalsContact O-CB 3.31Å; H209-L213 WeakPolarHBondContact O-CB 3.46Å; H209-L213 PolarHBondContact O-N 3.28Å; I210-L213 PolarHBondContact O-N 2.86Å; V211-L213 PolarHBondContact O-N 3.26Å; L213-L220 HydrophobicContact CD1-CD1 3.99Å; L213-L220 HydrophobicContact CD1-CD2 4.03Å; L213-Y476 VanDerWaalsContact O-CE1 3.29Å; L213-Y476 WeakPolarHBondContact O-CE1 3.36Å; L213-Y476 PolarHBondContact O-OH 2.83Å
214	L	73.6	Confident	69.4	Low	57 Å²	57	66 Å²	66	30%	0.298	32%	0.317	S	S	.	.	H	α-helix	trans	-73.1	-40.2	179.6	-74.4	170.3	0	0	0	111.6	I210 V211 Y387 Y476 I480 I484	I210-L214 HydrophobicContact CG2-CD1 3.89Å; I210-L214 HydrophobicContact CG2-CG 4.42Å; I210-L214 WeakPolarHBondContact O-CB 3.35Å; I210-L214 WeakPolarHBondContact O-CG 3.33Å; I210-L214 PolarHBondContact O-N 2.84Å; V211-L214 PolarHBondContact O-N 3.45Å; L214-Y387 PolarHBondContact O-OH 3.41Å; L214-Y387 VanDerWaalsContact O-OH 3.06Å; L214-Y476 WeakPolarHBondContact O-CE1 3.38Å; L214-I480 HydrophobicContact CD2-CG2 3.97Å; L214-I484 HydrophobicContact CD2-CD1 4.14Å
215	S	67.7	Low	70.9	Confident	3 Å²	3	64.5 Å²	64.5	2%	0.021	31%	0.311	C	S	.	.	H	α-helix	trans	-83.6	-17.2	-179	-64.3	0	0	0	0	113.6	V211 D217 E386 Y387 K477	V211-S215 VanDerWaalsContact O-CB 3.31Å; V211-S215 WeakPolarHBondContact O-CB 3.45Å; V211-S215 PolarHBondContact O-N 2.72Å; V211-S215 PolarHBondContact O-OG 2.86Å; S215-D217 VanDerWaalsContact C-N 3.32Å; S215-E386 VanDerWaalsContact CB-OE1 3.3Å; S215-E386 WeakPolarHBondContact CB-OE1 3.44Å; S215-E386 PolarHBondContact OG-OE1 3.39Å; S215-E386 VanDerWaalsContact OG-OE1 3.08Å; S215-E386 PolarHBondContact OG-OE2 3.44Å; S215-E386 VanDerWaalsContact OG-OE2 3.13Å; S215-Y387 WeakPolarHBondContact CA-OH 3.42Å; S215-Y387 PolarHBondContact N-OH 3.38Å; S215-Y387 PolarHBondContact OG-OH 2.98Å; S215-K477 WeakPolarHBondContact O-CG 3.3Å
216	G	68.7	Low	72.2	Confident	1 Å²	1	59 Å²	59	1%	0.01	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	76	19.7	-177.1	0	0	0	0	0	113.6	D212 L226 Q473	D212-G216 CarbonylContact O-C 3.58Å; D212-G216 WeakPolarHBondContact O-CA 3.38Å; D212-G216 PolarHBondContact O-N 2.94Å; G216-L226 WeakPolarHBondContact O-CD1 3.28Å; G216-Q473 PolarHBondContact O-NE2 3.48Å; G216-Q473 VanDerWaalsContact O-NE2 3.11Å
217	D	68.6	Low	73.2	Confident	35 Å²	35	50.6 Å²	50.6	19%	0.187	25%	0.249	C	C	.	.			trans	-99.9	167.9	-178.2	-164.5	19	0	0	0	111.9	D212 S215 I219	D212-D217 WeakPolarHBondContact CB-O 3.47Å; D212-D217 PolarHBondContact O-N 3.3Å; D212-D217 VanDerWaalsContact O-N 3.07Å; S215-D217 VanDerWaalsContact C-N 3.32Å; D217-I219 PolarHBondContact O-N 3.43Å; D217-I219 VanDerWaalsContact O-N 3.16Å
218	G	71.3	Confident	74	Confident	20 Å²	20	45.3 Å²	45.3	21%	0.206	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	-105.3	172.7	0	0	0	0	0	114	L220	G218-L220 VanDerWaalsContact C-N 3.34Å
219	I	66.7	Low	74.7	Confident	97 Å²	97	42.3 Å²	42.3	50%	0.497	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-34.9	-177.2	-59.1	174	0	0	0	110.3	D217 E221 R222	D217-I219 PolarHBondContact O-N 3.43Å; D217-I219 VanDerWaalsContact O-N 3.16Å; I219-E221 VanDerWaalsContact C-N 3.31Å; I219-E221 PolarHBondContact O-N 2.92Å; I219-R222 WeakPolarHBondContact O-CB 3.37Å; I219-R222 PolarHBondContact O-N 3.34Å
220	L	71.8	Confident	75.5	Confident	26 Å²	26	38.9 Å²	38.9	14%	0.136	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-66.7	-32.2	-177.6	-86.8	75.9	0	0	0	112.2	L213 G218 R222 T223 L225 Y476	L213-L220 HydrophobicContact CD1-CD1 3.99Å; L213-L220 HydrophobicContact CD1-CD2 4.03Å; G218-L220 VanDerWaalsContact C-N 3.34Å; L220-R222 PolarHBondContact O-N 3.17Å; L220-T223 PolarHBondContact O-N 2.92Å; L220-T223 PolarHBondContact O-OG1 3.4Å; L220-L225 HydrophobicContact CB-CD2 4.23Å; L220-L225 HydrophobicContact CD2-CD2 3.72Å; L220-L225 HydrophobicContact CG-CD2 4.23Å; L220-Y476 HydrophobicContact CD2-CE1 4.34Å
221	E	71.4	Confident	75.9	Confident	36 Å²	36	39 Å²	39	17%	0.168	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-58.5	-27.4	171.9	-166.8	-178.5	-165.8	0	0	112.6	I219 T223 L226 Q465 T469	I219-E221 VanDerWaalsContact C-N 3.31Å; I219-E221 PolarHBondContact O-N 2.92Å; E221-T223 VanDerWaalsContact C-N 3.35Å; E221-L226 HydrophobicContact CB-CD1 4.26Å; E221-Q465 VanDerWaalsContact CD-NE2 3.28Å; E221-Q465 PolarHBondContact OE1-NE2 2.95Å; E221-Q465 PolarHBondContact OE2-NE2 3Å; E221-T469 HydrophobicContact CG-CG2 4.13Å
222	R	67.4	Low	76.3	Confident	152 Å²	152	39.8 Å²	39.8	57%	0.574	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-89.4	3.2	179.5	-59.2	-175.9	179.8	-157	-0.2	113.9	I219 L220 F229	I219-R222 WeakPolarHBondContact O-CB 3.37Å; I219-R222 PolarHBondContact O-N 3.34Å; L220-R222 PolarHBondContact O-N 3.17Å; R222-F229 WeakPolarHBondContact O-CD2 3.23Å; R222-F229 WeakPolarHBondContact O-CE2 3.37Å
223	T	82.3	Confident	76.6	Confident	53 Å²	53	40.4 Å²	40.4	33%	0.325	21%	0.207	S	C	.	.	S	Bend	trans	-102.4	169.1	-179.5	67.9	0	0	0	0	112	L220 E221 L225 F229	L220-T223 PolarHBondContact O-N 2.92Å; L220-T223 PolarHBondContact O-OG1 3.4Å; E221-T223 VanDerWaalsContact C-N 3.35Å; T223-L225 PolarHBondContact O-N 2.91Å; T223-L225 VanDerWaalsContact OG1-CB 3.25Å; T223-L225 WeakPolarHBondContact OG1-CB 3.46Å; T223-L225 PolarHBondContact OG1-N 3.47Å; T223-F229 WeakPolarHBondContact O-CB 3.45Å; T223-F229 WeakPolarHBondContact O-CD2 3.25Å
224	Y	85.3	Confident	76.9	Confident	73 Å²	73	39.4 Å²	39.4	29%	0.286	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-5.1	174.1	-61.9	-79.5	0	0	0	114.1	M173 I174 F229 Y230	M173-Y224 HydrophobicContact CB-CE1 4.29Å; I174-Y224 HydrophobicContact CG1-CE1 3.99Å; I174-Y224 HydrophobicContact CG1-CE2 4.31Å; Y224-F229 AromaticContact CD1-CD1 3.82Å; Y224-F229 HydrophobicContact CD1-CD1 3.82Å; Y224-F229 AromaticContact CD1-CE1 3.36Å; Y224-F229 HydrophobicContact CD1-CE1 3.36Å; Y224-F229 AromaticContact CD1-CZ 3.9Å; Y224-F229 HydrophobicContact CD1-CZ 3.9Å; Y224-F229 HydrophobicContact CE1-CD1 4.14Å; Y224-F229 AromaticContact CE1-CE1 3.23Å; Y224-F229 HydrophobicContact CE1-CE1 3.23Å; Y224-F229 AromaticContact CE1-CZ 3.6Å; Y224-F229 HydrophobicContact CE1-CZ 3.6Å; Y224-F229 HydrophobicContact CE2-CZ 4.37Å; Y224-F229 HydrophobicContact CG-CE1 4.2Å; Y224-F229 HydrophobicContact CG-CZ 4.41Å; Y224-F229 AromaticContact CZ-CE1 3.97Å; Y224-F229 AromaticContact CZ-CZ 3.84Å; Y224-Y230 PolarHBondContact O-OH 3.49Å
225	L	86.1	Confident	77.3	Confident	14 Å²	14	36.7 Å²	36.7	7%	0.073	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-46.6	-179.6	-176.8	66.1	0	0	0	111.9	L220 T223 Y476 C540 P541 M542 I546	L220-L225 HydrophobicContact CB-CD2 4.23Å; L220-L225 HydrophobicContact CD2-CD2 3.72Å; L220-L225 HydrophobicContact CG-CD2 4.23Å; T223-L225 PolarHBondContact O-N 2.91Å; T223-L225 VanDerWaalsContact OG1-CB 3.25Å; T223-L225 WeakPolarHBondContact OG1-CB 3.46Å; T223-L225 PolarHBondContact OG1-N 3.47Å; L225-Y476 HydrophobicContact CD2-CD2 4.31Å; L225-Y476 HydrophobicContact CD2-CE2 4.29Å; L225-C540 WeakPolarHBondContact CD1-SG 3.5Å; L225-C540 CarbonylContact O-C 3.58Å; L225-C540 VanDerWaalsContact O-CA 3.22Å; L225-C540 WeakPolarHBondContact O-CA 3.35Å; L225-C540 PolarHBondContact O-SG 3.44Å; L225-P541 WeakPolarHBondContact O-CD 3.47Å; L225-M542 HydrophobicContact CD1-CB 3.86Å; L225-I546 HydrophobicContact CD1-CD1 3.57Å
226	L	88.1	Confident	77.9	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.209	C	C	.	.	S	Bend	trans	-106.7	149.5	-166.1	-76.2	164.9	0	0	0	113	G216 E221 G228 F229 Y230 T469 Q473	G216-L226 WeakPolarHBondContact O-CD1 3.28Å; E221-L226 HydrophobicContact CB-CD1 4.26Å; L226-G228 VanDerWaalsContact C-N 3.29Å; L226-G228 PolarHBondContact O-N 3.26Å; L226-F229 WeakPolarHBondContact O-CB 3.39Å; L226-F229 PolarHBondContact O-N 3.46Å; L226-Y230 WeakPolarHBondContact O-CD2 3.12Å; L226-Y230 WeakPolarHBondContact O-CE2 3.42Å; L226-T469 HydrophobicContact CB-CG2 4.07Å; L226-T469 HydrophobicContact CD1-CG2 4.01Å; L226-T469 HydrophobicContact CD2-CG2 4.21Å; L226-T469 HydrophobicContact CG-CG2 4.31Å; L226-Q473 HydrophobicContact CD1-CG 3.91Å; L226-Q473 HydrophobicContact CD2-CG 3.93Å
227	Y	85.4	Confident	78.3	Confident	1 Å²	1	44.4 Å²	44.4	0%	0.004	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-53.8	-39.7	-179.6	176.4	-91.8	0	0	0	113.8	F229 Y230 Y248 E468 Y539 G611 P612 F613	Y227-F229 PolarHBondContact O-N 2.97Å; Y227-Y230 PolarHBondContact O-N 3.38Å; Y227-Y230 VanDerWaalsContact O-N 3.09Å; Y227-Y248 HydrophobicContact CD2-CE1 4.14Å; Y227-Y248 AromaticContact CD2-CZ 3.84Å; Y227-Y248 WeakPolarHBondContact CD2-OH 3.34Å; Y227-Y248 HydrophobicContact CE2-CE1 4.02Å; Y227-E468 HydrophobicContact CD1-CB 3.4Å; Y227-E468 HydrophobicContact CD1-CG 4.09Å; Y227-E468 HydrophobicContact CE1-CB 3.55Å; Y227-E468 HydrophobicContact CE1-CG 3.68Å; Y227-E468 HydrophobicContact CG-CB 4.04Å; Y227-Y539 WeakPolarHBondContact CB-O 3.17Å; Y227-Y539 PolarHBondContact N-O 3.33Å; Y227-G611 VanDerWaalsContact CE1-CA 3.49Å; Y227-P612 HydrophobicContact CD2-CG 4.33Å; Y227-P612 VanDerWaalsContact CE2-CD 3.43Å; Y227-P612 HydrophobicContact CE2-CG 3.52Å; Y227-P612 WeakPolarHBondContact OH-CD 3.41Å; Y227-F613 HydrophobicContact CE2-CD2 4.34Å; Y227-F613 HydrophobicContact CE2-CE2 4.44Å; Y227-F613 WeakPolarHBondContact OH-CD2 3.25Å
228	G	79.3	Confident	78.5	Confident	15 Å²	15	49.1 Å²	49.1	16%	0.155	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-60.8	-17.3	-178	0	0	0	0	0	115.1	L226 Y230 T231 T469	L226-G228 VanDerWaalsContact C-N 3.29Å; L226-G228 PolarHBondContact O-N 3.26Å; G228-Y230 VanDerWaalsContact C-N 3.33Å; G228-T231 WeakPolarHBondContact O-CG2 3.1Å; G228-T469 VanDerWaalsContact CA-OG1 3.25Å; G228-T469 WeakPolarHBondContact CA-OG1 3.22Å; G228-T469 PolarHBondContact N-OG1 3.47Å
229	F	82.3	Confident	78.7	Confident	21 Å²	21	58 Å²	58	9%	0.092	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-69.9	-29.5	176.1	-175	-86.1	0	0	0	113.2	M173 R180 R222 T223 Y224 L226 Y227 T231	M173-F229 HydrophobicContact CE-CD1 4.33Å; M173-F229 HydrophobicContact CE-CE1 4.08Å; R180-F229 VanDerWaalsContact NH1-CZ 3.29Å; R222-F229 WeakPolarHBondContact O-CD2 3.23Å; R222-F229 WeakPolarHBondContact O-CE2 3.37Å; T223-F229 WeakPolarHBondContact O-CB 3.45Å; T223-F229 WeakPolarHBondContact O-CD2 3.25Å; Y224-F229 AromaticContact CD1-CD1 3.82Å; Y224-F229 HydrophobicContact CD1-CD1 3.82Å; Y224-F229 AromaticContact CD1-CE1 3.36Å; Y224-F229 HydrophobicContact CD1-CE1 3.36Å; Y224-F229 AromaticContact CD1-CZ 3.9Å; Y224-F229 HydrophobicContact CD1-CZ 3.9Å; Y224-F229 HydrophobicContact CE1-CD1 4.14Å; Y224-F229 AromaticContact CE1-CE1 3.23Å; Y224-F229 HydrophobicContact CE1-CE1 3.23Å; Y224-F229 AromaticContact CE1-CZ 3.6Å; Y224-F229 HydrophobicContact CE1-CZ 3.6Å; Y224-F229 HydrophobicContact CE2-CZ 4.37Å; Y224-F229 HydrophobicContact CG-CE1 4.2Å; Y224-F229 HydrophobicContact CG-CZ 4.41Å; Y224-F229 AromaticContact CZ-CE1 3.97Å; Y224-F229 AromaticContact CZ-CZ 3.84Å; L226-F229 WeakPolarHBondContact O-CB 3.39Å; L226-F229 PolarHBondContact O-N 3.46Å; Y227-F229 PolarHBondContact O-N 2.97Å; F229-T231 PolarHBondContact O-N 3.25Å
230	Y	85	Confident	79.3	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.287	C	S	.	.			trans	-87.5	69.3	-170	-62	-86.5	0	0	0	111.4	V169 M170 M173 Y224 L226 Y227 G228 L244 P541 G611 P612	V169-Y230 HydrophobicContact CG1-CD1 3.79Å; V169-Y230 HydrophobicContact CG1-CE1 3.58Å; M170-Y230 WeakPolarHBondContact CG-OH 3.12Å; M173-Y230 HydrophobicContact CE-CD1 4.41Å; M173-Y230 HydrophobicContact CG-CD1 3.97Å; M173-Y230 HydrophobicContact CG-CE1 4.23Å; Y224-Y230 PolarHBondContact O-OH 3.49Å; L226-Y230 WeakPolarHBondContact O-CD2 3.12Å; L226-Y230 WeakPolarHBondContact O-CE2 3.42Å; Y227-Y230 PolarHBondContact O-N 3.38Å; Y227-Y230 VanDerWaalsContact O-N 3.09Å; G228-Y230 VanDerWaalsContact C-N 3.33Å; Y230-L244 HydrophobicContact CD1-CD2 4.43Å; Y230-P541 HydrophobicContact CD2-CG 4.43Å; Y230-P541 HydrophobicContact CE2-CB 4.42Å; Y230-P541 HydrophobicContact CE2-CG 3.73Å; Y230-G611 CarbonylContact O-C 3.53Å; Y230-P612 VanDerWaalsContact O-CA 3.27Å; Y230-P612 WeakPolarHBondContact O-CA 3.32Å; Y230-P612 WeakPolarHBondContact O-CD 3.24Å
231	T	77.9	Confident	79.8	Confident	76 Å²	76	61.1 Å²	61.1	47%	0.466	31%	0.305	S	S	.	.			trans	-95.5	-7	-174.1	59.2	0	0	0	0	115.2	G228 F229	G228-T231 WeakPolarHBondContact O-CG2 3.1Å; F229-T231 PolarHBondContact O-N 3.25Å
232	K	77.6	Confident	80.6	Confident	42 Å²	42	61.8 Å²	61.8	18%	0.183	31%	0.307	C	S	.	.			trans	-78.1	134	-178.9	-65.8	-166.5	179.5	-171.2	0	110.4	M173 D176 T178 L244	M173-K232 HydrophobicContact CE-CG 4.4Å; M173-K232 HydrophobicContact SD-CB 4.2Å; M173-K232 HydrophobicContact SD-CD 4.39Å; M173-K232 HydrophobicContact SD-CG 4.45Å; D176-K232 VanDerWaalsContact CG-NZ 3.3Å; D176-K232 IonicContact OD1-NZ 2.75Å; D176-K232 WeakPolarHBondContact OD2-CD 3.48Å; D176-K232 WeakPolarHBondContact OD2-CE 3.5Å; D176-K232 IonicContact OD2-NZ 3.66Å; D176-K232 PolarHBondContact OD2-NZ 2.59Å; T178-K232 PolarHBondContact O-NZ 3.41Å; T178-K232 PolarHBondContact OG1-NZ 3.3Å; K232-L244 WeakPolarHBondContact O-CB 3.46Å; K232-L244 WeakPolarHBondContact O-CD2 3.42Å
233	D	75.4	Confident	81.5	Confident	29 Å²	29	57.2 Å²	57.2	16%	0.155	29%	0.291	C	S	.	.	S	Bend	trans	-87.9	-46.9	179	-172.6	24.6	0	0	0	111.2	L244 P245 K615	D233-L244 PolarHBondContact O-N 3.09Å; D233-L244 VanDerWaalsContact O-N 3.08Å; D233-P245 VanDerWaalsContact O-CD 3.25Å; D233-P245 WeakPolarHBondContact O-CD 3.37Å; D233-P245 WeakPolarHBondContact OD1-CG 3.35Å; D233-K615 HydrophobicContact CB-CD 4.41Å; D233-K615 VanDerWaalsContact OD2-CD 3.29Å; D233-K615 WeakPolarHBondContact OD2-CD 3.26Å; D233-K615 WeakPolarHBondContact OD2-CE 3.38Å; D233-K615 IonicContact OD2-NZ 3.84Å; D233-K615 PolarHBondContact OD2-NZ 3.33Å
234	E	82.8	Confident	81.8	Confident	76 Å²	76	54.7 Å²	54.7	36%	0.355	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	132.1	-179.9	-57.6	-168.6	155.4	0	0	110.6	H236 I241	E234-H236 IonicContact OE2-NE2 2.99Å; E234-I241 HydrophobicContact CB-CG2 4.15Å; E234-I241 HydrophobicContact CG-CG2 4.36Å
235	I	81.9	Confident	82.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	116.8	173	-56.9	169.9	0	0	0	107.3	P172 M173 D176 F237 Y242 L244	P172-I235 HydrophobicContact CB-CD1 3.99Å; M173-I235 HydrophobicContact CG-CD1 4.25Å; M173-I235 HydrophobicContact SD-CD1 3.82Å; D176-I235 HydrophobicContact CB-CG2 3.99Å; I235-F237 HydrophobicContact CB-CE2 4.33Å; I235-F237 HydrophobicContact CG2-CD2 4.31Å; I235-F237 HydrophobicContact CG2-CE1 4.28Å; I235-F237 HydrophobicContact CG2-CE2 3.74Å; I235-F237 HydrophobicContact CG2-CZ 3.72Å; I235-F237 PolarHBondContact O-N 2.75Å; I235-Y242 HydrophobicContact CD1-CD1 4.38Å; I235-Y242 PolarHBondContact N-O 3.15Å; I235-Y242 PolarHBondContact O-N 3.09Å; I235-L244 HydrophobicContact CD1-CD1 4.43Å
236	H	80	Confident	82.2	Confident	108 Å²	108	52.5 Å²	52.5	50%	0.5	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	101.5	-178.4	-66.5	-94.2	0	0	0	109.9	E234	E234-H236 IonicContact OE2-NE2 2.99Å
237	F	78	Confident	82.4	Confident	57 Å²	57	53 Å²	53	25%	0.25	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	154.1	162.8	-63.4	-72.4	0	0	0	109.3	P172 L175 I235 K239 V240 Y242	P172-F237 HydrophobicContact CB-CE2 4.44Å; P172-F237 HydrophobicContact CB-CZ 4.18Å; L175-F237 HydrophobicContact CB-CE1 4.24Å; I235-F237 HydrophobicContact CB-CE2 4.33Å; I235-F237 HydrophobicContact CG2-CD2 4.31Å; I235-F237 HydrophobicContact CG2-CE1 4.28Å; I235-F237 HydrophobicContact CG2-CE2 3.74Å; I235-F237 HydrophobicContact CG2-CZ 3.72Å; I235-F237 PolarHBondContact O-N 2.75Å; F237-K239 PolarHBondContact O-N 3.12Å; F237-V240 WeakPolarHBondContact CB-O 3.21Å; F237-V240 PolarHBondContact N-O 2.99Å; F237-V240 PolarHBondContact O-N 3.01Å; F237-Y242 HydrophobicContact CE2-CG 4.16Å
238	P	73.1	Confident	82.8	Confident	134 Å²	134	52.9 Å²	52.9	87%	0.87	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-13.7	-174.3	16.9	-31	0	0	0	115.9
239	K	74.9	Confident	83.4	Confident	206 Å²	206	52.6 Å²	52.6	90%	0.896	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.5	-6.9	176.7	-66.5	-176.5	179.2	179.4	0	115	F237	F237-K239 PolarHBondContact O-N 3.12Å
240	V	79.3	Confident	83.9	Confident	89 Å²	89	55.7 Å²	55.7	54%	0.539	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	130.7	-170.8	-177.1	0	0	0	0	110.1	F237	F237-V240 WeakPolarHBondContact CB-O 3.21Å; F237-V240 PolarHBondContact N-O 2.99Å; F237-V240 PolarHBondContact O-N 3.01Å
241	I	83.1	Confident	84.3	Confident	100 Å²	100	55.9 Å²	55.9	51%	0.513	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	116.3	170.4	-58	170	0	0	0	107.6	E234	E234-I241 HydrophobicContact CB-CG2 4.15Å; E234-I241 HydrophobicContact CG-CG2 4.36Å
242	Y	86.5	Confident	85.1	Confident	51 Å²	51	52.5 Å²	52.5	20%	0.2	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	109.8	179.9	-167.1	-91.9	0	0	0	110.1	F168 P172 I235 F237 L244 A247	F168-Y242 PolarHBondContact O-OH 2.71Å; P172-Y242 HydrophobicContact CB-CD1 3.97Å; P172-Y242 HydrophobicContact CB-CE1 3.85Å; P172-Y242 HydrophobicContact CG-CD1 4.34Å; P172-Y242 HydrophobicContact CG-CE1 3.75Å; P172-Y242 HydrophobicContact CG-CE2 4.5Å; I235-Y242 HydrophobicContact CD1-CD1 4.38Å; I235-Y242 PolarHBondContact N-O 3.15Å; I235-Y242 PolarHBondContact O-N 3.09Å; F237-Y242 HydrophobicContact CE2-CG 4.16Å; Y242-L244 PolarHBondContact O-N 3.24Å; Y242-A247 HydrophobicContact CE1-CB 3.46Å; Y242-A247 VanDerWaalsContact CE1-CB 3.46Å; Y242-A247 VanDerWaalsContact CZ-CB 3.47Å; Y242-A247 WeakPolarHBondContact OH-CB 3.26Å
243	K	88.1	Confident	85.8	Confident	56 Å²	56	54.8 Å²	54.8	24%	0.243	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	106.5	176.3	-66.4	-170.7	174.3	-172.6	0	109.9	L246 A247	K243-L246 HydrophobicContact CB-CB 4.18Å; K243-A247 PolarHBondContact O-N 3.44Å; K243-A247 VanDerWaalsContact O-N 3.15Å
244	L	88.4	Confident	86.7	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.7	-42	-177.9	-172.7	69.8	0	0	0	113.1	V169 M173 Y230 K232 D233 I235 Y242 L246 A247 Y248	V169-L244 HydrophobicContact CG1-CD1 4.4Å; M173-L244 HydrophobicContact CG-CD1 4.06Å; M173-L244 HydrophobicContact CG-CD2 4.21Å; M173-L244 HydrophobicContact SD-CD1 4.4Å; M173-L244 HydrophobicContact SD-CD2 3.67Å; Y230-L244 HydrophobicContact CD1-CD2 4.43Å; K232-L244 WeakPolarHBondContact O-CB 3.46Å; K232-L244 WeakPolarHBondContact O-CD2 3.42Å; D233-L244 PolarHBondContact O-N 3.09Å; D233-L244 VanDerWaalsContact O-N 3.08Å; I235-L244 HydrophobicContact CD1-CD1 4.43Å; Y242-L244 PolarHBondContact O-N 3.24Å; L244-L246 VanDerWaalsContact C-N 3.33Å; L244-L246 PolarHBondContact O-N 3Å; L244-A247 PolarHBondContact O-N 3.24Å; L244-Y248 WeakPolarHBondContact O-CB 3.32Å; L244-Y248 PolarHBondContact O-N 2.91Å
245	P	90	Very high	87.3	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-64	-38.8	-177.4	-22.6	35.3	0	0	0	112.5	D233 Y248 L249 P612 F613 Y616 A622	D233-P245 VanDerWaalsContact O-CD 3.25Å; D233-P245 WeakPolarHBondContact O-CD 3.37Å; D233-P245 WeakPolarHBondContact OD1-CG 3.35Å; P245-Y248 WeakPolarHBondContact O-CB 3.43Å; P245-Y248 PolarHBondContact O-N 3.35Å; P245-L249 PolarHBondContact O-N 3.13Å; P245-L249 VanDerWaalsContact O-N 3.08Å; P245-P612 HydrophobicContact CB-CB 4.32Å; P245-P612 HydrophobicContact CG-CB 4.27Å; P245-P612 WeakPolarHBondContact CG-O 3.2Å; P245-F613 HydrophobicContact CB-CD1 3.72Å; P245-F613 HydrophobicContact CB-CE1 3.63Å; P245-F613 VanDerWaalsContact O-CE1 3.22Å; P245-F613 WeakPolarHBondContact O-CE1 3.23Å; P245-F613 WeakPolarHBondContact O-CZ 3.46Å; P245-Y616 HydrophobicContact CB-CE2 4.24Å; P245-Y616 HydrophobicContact CG-CE2 4.3Å; P245-A622 HydrophobicContact CB-CB 4.1Å
246	L	90	Very high	87.9	Confident	40 Å²	40	52.2 Å²	52.2	21%	0.209	27%	0.274	C	S	.	.	H	α-helix	trans	-64.8	-47.9	174.4	-179.9	70.1	0	0	0	111.3	K243 L244 Y248 L249 L250 L623 A626	K243-L246 HydrophobicContact CB-CB 4.18Å; L244-L246 VanDerWaalsContact C-N 3.33Å; L244-L246 PolarHBondContact O-N 3Å; L246-Y248 PolarHBondContact O-N 3.38Å; L246-L249 PolarHBondContact O-N 2.87Å; L246-L250 HydrophobicContact CD1-CD1 4.11Å; L246-L250 HydrophobicContact CD1-CG 4.24Å; L246-L250 HydrophobicContact CD2-CD1 4.34Å; L246-L250 HydrophobicContact CG-CD1 3.88Å; L246-L250 HydrophobicContact CG-CG 4.33Å; L246-L250 WeakPolarHBondContact O-CB 3.41Å; L246-L250 WeakPolarHBondContact O-CG 3.33Å; L246-L250 PolarHBondContact O-N 3.31Å; L246-L623 HydrophobicContact CD1-CD1 3.7Å; L246-A626 HydrophobicContact CB-CB 4.45Å; L246-A626 HydrophobicContact CD1-CB 3.74Å; L246-A626 HydrophobicContact CD2-CB 3.56Å; L246-A626 HydrophobicContact CG-CB 4.1Å
247	A	91.8	Very high	88.6	Confident	10 Å²	10	51 Å²	51	8%	0.083	27%	0.271	C	S	.	.	H	α-helix	trans	-59.1	-39	177.6	0	0	0	0	0	111.8	Y242 K243 L244 L250 A251	Y242-A247 HydrophobicContact CE1-CB 3.46Å; Y242-A247 VanDerWaalsContact CE1-CB 3.46Å; Y242-A247 VanDerWaalsContact CZ-CB 3.47Å; Y242-A247 WeakPolarHBondContact OH-CB 3.26Å; K243-A247 PolarHBondContact O-N 3.44Å; K243-A247 VanDerWaalsContact O-N 3.15Å; L244-A247 PolarHBondContact O-N 3.24Å; A247-L250 PolarHBondContact O-N 3.44Å; A247-A251 WeakPolarHBondContact O-CB 3.2Å; A247-A251 PolarHBondContact O-N 3.1Å
248	Y	92.7	Very high	89.3	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.6	-49.7	175.7	-158.3	-88.8	0	0	0	111.6	M165 V169 Y227 L244 P245 L246 A251 T252 F538 P541 P612 F613	M165-Y248 HydrophobicContact CE-CE2 4.2Å; V169-Y248 HydrophobicContact CB-CD2 4.48Å; V169-Y248 HydrophobicContact CG1-CD2 3.64Å; V169-Y248 HydrophobicContact CG1-CE2 3.89Å; V169-Y248 HydrophobicContact CG2-CD2 3.97Å; Y227-Y248 HydrophobicContact CD2-CE1 4.14Å; Y227-Y248 AromaticContact CD2-CZ 3.84Å; Y227-Y248 WeakPolarHBondContact CD2-OH 3.34Å; Y227-Y248 HydrophobicContact CE2-CE1 4.02Å; L244-Y248 WeakPolarHBondContact O-CB 3.32Å; L244-Y248 PolarHBondContact O-N 2.91Å; P245-Y248 WeakPolarHBondContact O-CB 3.43Å; P245-Y248 PolarHBondContact O-N 3.35Å; L246-Y248 PolarHBondContact O-N 3.38Å; Y248-A251 PolarHBondContact O-N 2.9Å; Y248-T252 HydrophobicContact CD1-CG2 4.13Å; Y248-T252 HydrophobicContact CE1-CG2 4.11Å; Y248-T252 WeakPolarHBondContact O-CG2 3.37Å; Y248-T252 PolarHBondContact O-N 2.97Å; Y248-T252 PolarHBondContact O-OG1 3.5Å; Y248-F538 HydrophobicContact CD1-CE2 4.14Å; Y248-F538 AromaticContact CE1-CD2 3.89Å; Y248-F538 HydrophobicContact CE1-CD2 3.89Å; Y248-F538 AromaticContact CE1-CE2 3.81Å; Y248-F538 HydrophobicContact CE1-CE2 3.81Å; Y248-F538 HydrophobicContact CE1-CZ 4.39Å; Y248-F538 WeakPolarHBondContact CE1-O 3.42Å; Y248-F538 PolarHBondContact OH-O 2.71Å; Y248-P541 HydrophobicContact CE2-CG 3.95Å; Y248-P541 WeakPolarHBondContact OH-CG 3.26Å; Y248-P612 HydrophobicContact CD1-CG 4.39Å; Y248-P612 HydrophobicContact CD2-CG 4.27Å; Y248-P612 HydrophobicContact CG-CG 4.17Å; Y248-F613 AromaticContact CD1-CE2 3.76Å; Y248-F613 HydrophobicContact CD1-CE2 3.76Å; Y248-F613 AromaticContact CD1-CZ 3.95Å; Y248-F613 HydrophobicContact CD1-CZ 3.95Å; Y248-F613 HydrophobicContact CE1-CE2 4.4Å; Y248-F613 HydrophobicContact CG-CE2 4.45Å; Y248-F613 HydrophobicContact CG-CZ 4.39Å
249	L	92.8	Very high	90.3	Very high	9 Å²	9	45 Å²	45	5%	0.047	23%	0.234	C	C	.	.	H	α-helix	trans	-66.4	-40.5	179.1	-165.4	155.8	0	0	0	112.2	P245 L246 T252 L253 V601 F613 S619	P245-L249 PolarHBondContact O-N 3.13Å; P245-L249 VanDerWaalsContact O-N 3.08Å; L246-L249 PolarHBondContact O-N 2.87Å; L249-T252 WeakPolarHBondContact CA-OG1 3.24Å; L249-T252 PolarHBondContact O-N 3.04Å; L249-T252 PolarHBondContact O-OG1 3.47Å; L249-L253 WeakPolarHBondContact O-CB 3.34Å; L249-L253 PolarHBondContact O-N 3.26Å; L249-V601 HydrophobicContact CD1-CG1 4.12Å; L249-F613 HydrophobicContact CB-CZ 4.24Å; L249-S619 WeakPolarHBondContact CD1-O 3.1Å
250	L	92.5	Very high	91.2	Very high	85 Å²	85	38.2 Å²	38.2	45%	0.445	21%	0.207	S	C	.	.	H	α-helix	trans	-70.5	-36.6	177.2	-70	178.1	0	0	0	112.3	L246 A247 T252 G254	L246-L250 HydrophobicContact CD1-CD1 4.11Å; L246-L250 HydrophobicContact CD1-CG 4.24Å; L246-L250 HydrophobicContact CD2-CD1 4.34Å; L246-L250 HydrophobicContact CG-CD1 3.88Å; L246-L250 HydrophobicContact CG-CG 4.33Å; L246-L250 WeakPolarHBondContact O-CB 3.41Å; L246-L250 WeakPolarHBondContact O-CG 3.33Å; L246-L250 PolarHBondContact O-N 3.31Å; A247-L250 PolarHBondContact O-N 3.44Å; L250-T252 VanDerWaalsContact C-N 3.31Å; L250-G254 WeakPolarHBondContact O-CA 3.38Å; L250-G254 PolarHBondContact O-N 2.84Å
251	A	94.3	Very high	91.7	Very high	4 Å²	4	39.9 Å²	39.9	3%	0.033	21%	0.212	C	C	.	.	H	α-helix	trans	-65.1	-38.6	174	0	0	0	0	0	110.8	V164 M165 F168 V169 A247 Y248 G254 Y255	V164-A251 HydrophobicContact CG1-CB 4.37Å; M165-A251 HydrophobicContact SD-CB 3.93Å; F168-A251 HydrophobicContact CB-CB 4.08Å; V169-A251 HydrophobicContact CG2-CB 4.03Å; A247-A251 WeakPolarHBondContact O-CB 3.2Å; A247-A251 PolarHBondContact O-N 3.1Å; Y248-A251 PolarHBondContact O-N 2.9Å; A251-G254 PolarHBondContact O-N 3.1Å; A251-Y255 VanDerWaalsContact O-CD1 3.27Å; A251-Y255 WeakPolarHBondContact O-CD1 3.23Å; A251-Y255 PolarHBondContact O-N 3.44Å
252	T	93.1	Very high	92.1	Very high	6 Å²	6	37.5 Å²	37.5	4%	0.037	20%	0.197	C	C	.	.	H	α-helix	trans	-68.5	-46.9	179.1	62.2	0	0	0	0	112.3	Y248 L249 L250 G254 Y255 L256 F538	Y248-T252 HydrophobicContact CD1-CG2 4.13Å; Y248-T252 HydrophobicContact CE1-CG2 4.11Å; Y248-T252 WeakPolarHBondContact O-CG2 3.37Å; Y248-T252 PolarHBondContact O-N 2.97Å; Y248-T252 PolarHBondContact O-OG1 3.5Å; L249-T252 WeakPolarHBondContact CA-OG1 3.24Å; L249-T252 PolarHBondContact O-N 3.04Å; L249-T252 PolarHBondContact O-OG1 3.47Å; L250-T252 VanDerWaalsContact C-N 3.31Å; T252-G254 VanDerWaalsContact C-N 3.28Å; T252-G254 PolarHBondContact O-N 3.26Å; T252-Y255 VanDerWaalsContact CA-CD1 3.46Å; T252-Y255 HydrophobicContact CG2-CE1 3.92Å; T252-Y255 WeakPolarHBondContact O-CD1 3.47Å; T252-L256 WeakPolarHBondContact O-CG 3.38Å; T252-L256 PolarHBondContact O-N 2.99Å; T252-F538 HydrophobicContact CG2-CD2 3.56Å; T252-F538 HydrophobicContact CG2-CE2 4.22Å
253	L	94	Very high	92.2	Very high	90 Å²	90	35.1 Å²	35.1	47%	0.471	19%	0.187	S	C	.	.	H	α-helix	trans	-59.5	-41.9	170.7	-177.3	63.7	0	0	0	111.3	L249 L256 L257	L249-L253 WeakPolarHBondContact O-CB 3.34Å; L249-L253 PolarHBondContact O-N 3.26Å; L253-L256 PolarHBondContact O-N 3.43Å; L253-L257 HydrophobicContact CD1-CD1 4Å; L253-L257 HydrophobicContact CD1-CG 4.13Å; L253-L257 HydrophobicContact CD2-CD1 4.44Å; L253-L257 HydrophobicContact CG-CD1 3.82Å; L253-L257 HydrophobicContact CG-CG 4.34Å; L253-L257 WeakPolarHBondContact O-CB 3.31Å; L253-L257 VanDerWaalsContact O-CG 3.31Å; L253-L257 WeakPolarHBondContact O-CG 3.47Å; L253-L257 PolarHBondContact O-N 3.41Å
254	G	93.7	Very high	92.3	Very high	30 Å²	30	35.4 Å²	35.4	31%	0.309	19%	0.194	S	C	.	.	H	α-helix	trans	-60.3	-48.5	-179	0	0	0	0	0	113.1	L250 A251 T252 L258	L250-G254 WeakPolarHBondContact O-CA 3.38Å; L250-G254 PolarHBondContact O-N 2.84Å; A251-G254 PolarHBondContact O-N 3.1Å; T252-G254 VanDerWaalsContact C-N 3.28Å; T252-G254 PolarHBondContact O-N 3.26Å; G254-L258 WeakPolarHBondContact O-CB 3.17Å; G254-L258 PolarHBondContact O-N 3.21Å
255	Y	95.5	Very high	92.1	Very high	1 Å²	1	42 Å²	42	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-70.4	-35.6	179.6	82.1	-111.3	0	0	0	112.4	I161 M165 A251 T252 L258 S259 W534 T537	I161-Y255 HydrophobicContact CD1-CD2 4.44Å; I161-Y255 HydrophobicContact CG1-CD2 4.49Å; I161-Y255 HydrophobicContact CG2-CD1 4.44Å; I161-Y255 HydrophobicContact CG2-CD2 4.07Å; I161-Y255 HydrophobicContact CG2-CG 3.95Å; M165-Y255 HydrophobicContact SD-CD1 4.1Å; M165-Y255 HydrophobicContact SD-CE1 4.39Å; A251-Y255 VanDerWaalsContact O-CD1 3.27Å; A251-Y255 WeakPolarHBondContact O-CD1 3.23Å; A251-Y255 PolarHBondContact O-N 3.44Å; T252-Y255 VanDerWaalsContact CA-CD1 3.46Å; T252-Y255 HydrophobicContact CG2-CE1 3.92Å; T252-Y255 WeakPolarHBondContact O-CD1 3.47Å; Y255-L258 PolarHBondContact O-N 2.74Å; Y255-S259 WeakPolarHBondContact O-CB 3.3Å; Y255-S259 PolarHBondContact O-N 2.85Å; Y255-S259 PolarHBondContact O-OG 3.4Å; Y255-S259 VanDerWaalsContact O-OG 3.04Å; Y255-W534 PolarHBondContact OH-O 3.09Å; Y255-T537 HydrophobicContact CD1-CG2 4.02Å; Y255-T537 HydrophobicContact CE1-CG2 3.57Å; Y255-T537 HydrophobicContact CE2-CG2 4.47Å
256	L	94.8	Very high	91.8	Very high	20 Å²	20	45.1 Å²	45.1	11%	0.105	23%	0.234	C	C	.	.	H	α-helix	trans	-65.4	-44.7	176.1	-71.3	174.6	0	0	0	111	T252 L253 S259 L260 L590 I597	T252-L256 WeakPolarHBondContact O-CG 3.38Å; T252-L256 PolarHBondContact O-N 2.99Å; L253-L256 PolarHBondContact O-N 3.43Å; L256-S259 PolarHBondContact O-N 3.01Å; L256-S259 PolarHBondContact O-OG 3.07Å; L256-L260 WeakPolarHBondContact O-CB 3.19Å; L256-L260 PolarHBondContact O-N 2.99Å; L256-L590 HydrophobicContact CD2-CD1 3.91Å; L256-I597 HydrophobicContact CD1-CD1 4.11Å; L256-I597 HydrophobicContact CD1-CG2 4.45Å; L256-I597 HydrophobicContact CD2-CD1 4.33Å
257	L	93.6	Very high	91.5	Very high	83 Å²	83	44.1 Å²	44.1	44%	0.435	23%	0.23	S	C	.	.	H	α-helix	trans	-66.1	-42.3	175.5	-72.3	175.5	0	0	0	112	L253 S259 L260 L261	L253-L257 HydrophobicContact CD1-CD1 4Å; L253-L257 HydrophobicContact CD1-CG 4.13Å; L253-L257 HydrophobicContact CD2-CD1 4.44Å; L253-L257 HydrophobicContact CG-CD1 3.82Å; L253-L257 HydrophobicContact CG-CG 4.34Å; L253-L257 WeakPolarHBondContact O-CB 3.31Å; L253-L257 VanDerWaalsContact O-CG 3.31Å; L253-L257 WeakPolarHBondContact O-CG 3.47Å; L253-L257 PolarHBondContact O-N 3.41Å; L257-S259 VanDerWaalsContact C-N 3.35Å; L257-S259 PolarHBondContact O-N 2.92Å; L257-L260 PolarHBondContact O-N 3.18Å; L257-L261 WeakPolarHBondContact O-CB 3.5Å; L257-L261 VanDerWaalsContact O-CG 3.27Å; L257-L261 WeakPolarHBondContact O-CG 3.29Å; L257-L261 PolarHBondContact O-N 3.33Å
258	L	92.7	Very high	91	Very high	63 Å²	63	46.2 Å²	46.2	33%	0.33	25%	0.248	S	C	.	.	H	α-helix	trans	-63.2	-42.8	178.6	-171	147.5	0	0	0	111.2	I160 G254 Y255 W262	I160-L258 HydrophobicContact CG2-CD1 4.14Å; I160-L258 HydrophobicContact CG2-CD2 3.7Å; G254-L258 WeakPolarHBondContact O-CB 3.17Å; G254-L258 PolarHBondContact O-N 3.21Å; Y255-L258 PolarHBondContact O-N 2.74Å; L258-W262 HydrophobicContact CD2-CE3 4.16Å; L258-W262 VanDerWaalsContact O-CB 3.27Å; L258-W262 WeakPolarHBondContact O-CB 3.39Å; L258-W262 PolarHBondContact O-N 3.29Å
259	S	93.9	Very high	90.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.1	-43.6	175	63.7	0	0	0	0	111.9	Y255 L256 L257 W262 I263 L590	Y255-S259 WeakPolarHBondContact O-CB 3.3Å; Y255-S259 PolarHBondContact O-N 2.85Å; Y255-S259 PolarHBondContact O-OG 3.4Å; Y255-S259 VanDerWaalsContact O-OG 3.04Å; L256-S259 PolarHBondContact O-N 3.01Å; L256-S259 PolarHBondContact O-OG 3.07Å; L257-S259 VanDerWaalsContact C-N 3.35Å; L257-S259 PolarHBondContact O-N 2.92Å; S259-W262 PolarHBondContact O-N 3.47Å; S259-I263 WeakPolarHBondContact O-CB 3.25Å; S259-I263 WeakPolarHBondContact O-CD1 3.5Å; S259-I263 WeakPolarHBondContact O-CG1 3.45Å; S259-I263 PolarHBondContact O-N 3.15Å; S259-L590 WeakPolarHBondContact OG-CD1 3.45Å
260	L	93.7	Very high	89.3	Confident	65 Å²	65	48.9 Å²	48.9	34%	0.34	27%	0.273	S	S	.	.	H	α-helix	trans	-57.4	-54.5	174.7	178.8	64.9	0	0	0	111.6	L256 L257 W262 I263 V264 L587 L590	L256-L260 WeakPolarHBondContact O-CB 3.19Å; L256-L260 PolarHBondContact O-N 2.99Å; L257-L260 PolarHBondContact O-N 3.18Å; L260-W262 VanDerWaalsContact C-N 3.3Å; L260-W262 PolarHBondContact O-N 2.79Å; L260-I263 PolarHBondContact O-N 2.65Å; L260-V264 HydrophobicContact CD1-CG2 4.05Å; L260-V264 HydrophobicContact CG-CG2 4.48Å; L260-V264 WeakPolarHBondContact O-CB 3.21Å; L260-V264 VanDerWaalsContact O-CG2 3.26Å; L260-V264 WeakPolarHBondContact O-CG2 3.43Å; L260-V264 PolarHBondContact O-N 3.1Å; L260-L587 HydrophobicContact CD1-CD1 3.47Å; L260-L587 VanDerWaalsContact CD1-CD1 3.47Å; L260-L590 HydrophobicContact CB-CD2 3.74Å; L260-L590 HydrophobicContact CD1-CD2 4.11Å
261	L	90.1	Very high	88.4	Confident	123 Å²	123	49.1 Å²	49.1	64%	0.644	27%	0.271	S	S	*	.	H	α-helix	trans	-60.9	-40.5	-178.2	-70.9	174.5	0	0	0	111.6	L257 K265	L257-L261 WeakPolarHBondContact O-CB 3.5Å; L257-L261 VanDerWaalsContact O-CG 3.27Å; L257-L261 WeakPolarHBondContact O-CG 3.29Å; L257-L261 PolarHBondContact O-N 3.33Å; L261-K265 WeakPolarHBondContact O-CB 3.43Å; L261-K265 PolarHBondContact O-N 3.19Å
262	W	90.9	Very high	87.5	Confident	51 Å²	51	55.7 Å²	55.7	19%	0.193	30%	0.298	C	S	.	.	H	α-helix	trans	-69.8	-43.2	180	-162.1	-0.5	0	0	0	112.1	L123 F153 A156 L157 I160 L258 S259 L260 R266	L123-W262 HydrophobicContact CD1-CH2 4.23Å; L123-W262 HydrophobicContact CD2-CH2 3.8Å; L123-W262 HydrophobicContact CD2-CZ2 3.49Å; L123-W262 VanDerWaalsContact CD2-CZ2 3.49Å; F153-W262 HydrophobicContact CD2-CZ2 4.44Å; F153-W262 AromaticContact CE2-CD2 3.9Å; F153-W262 HydrophobicContact CE2-CD2 3.9Å; F153-W262 AromaticContact CE2-CE2 3.78Å; F153-W262 HydrophobicContact CE2-CE3 4.43Å; F153-W262 HydrophobicContact CE2-CG 4.11Å; F153-W262 HydrophobicContact CE2-CZ2 4.23Å; F153-W262 AromaticContact CE2-NE1 3.9Å; A156-W262 HydrophobicContact CB-CH2 4.07Å; L157-W262 HydrophobicContact CB-CZ3 4.34Å; I160-W262 HydrophobicContact CB-CZ3 4.37Å; I160-W262 HydrophobicContact CD1-CE3 4.2Å; I160-W262 HydrophobicContact CD1-CH2 3.51Å; I160-W262 HydrophobicContact CD1-CZ3 3.25Å; I160-W262 HydrophobicContact CG1-CH2 4.45Å; I160-W262 HydrophobicContact CG1-CZ3 4.07Å; L258-W262 HydrophobicContact CD2-CE3 4.16Å; L258-W262 VanDerWaalsContact O-CB 3.27Å; L258-W262 WeakPolarHBondContact O-CB 3.39Å; L258-W262 PolarHBondContact O-N 3.29Å; S259-W262 PolarHBondContact O-N 3.47Å; L260-W262 VanDerWaalsContact C-N 3.3Å; L260-W262 PolarHBondContact O-N 2.79Å; W262-R266 WeakPolarHBondContact O-CB 3.39Å; W262-R266 PolarHBondContact O-N 3.1Å
263	I	90.3	Very high	86.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61.7	-47.8	175.7	-68.5	164.1	0	0	0	110.2	F153 L157 S259 L260 R266 S267 W534 L586 L587 L590	F153-I263 HydrophobicContact CE1-CG1 4.37Å; F153-I263 HydrophobicContact CZ-CG1 4.12Å; L157-I263 HydrophobicContact CD1-CG1 4.41Å; S259-I263 WeakPolarHBondContact O-CB 3.25Å; S259-I263 WeakPolarHBondContact O-CD1 3.5Å; S259-I263 WeakPolarHBondContact O-CG1 3.45Å; S259-I263 PolarHBondContact O-N 3.15Å; L260-I263 PolarHBondContact O-N 2.65Å; I263-R266 PolarHBondContact O-N 2.88Å; I263-S267 VanDerWaalsContact O-CB 3.32Å; I263-S267 WeakPolarHBondContact O-CB 3.27Å; I263-S267 PolarHBondContact O-N 2.92Å; I263-S267 PolarHBondContact O-OG 2.68Å; I263-W534 HydrophobicContact CD1-CH2 4.06Å; I263-W534 HydrophobicContact CD1-CZ2 3.95Å; I263-L586 HydrophobicContact CD1-CD2 3.83Å; I263-L586 HydrophobicContact CD1-CG 3.88Å; I263-L586 HydrophobicContact CG1-CD2 3.92Å; I263-L586 HydrophobicContact CG1-CG 4.44Å; I263-L587 HydrophobicContact CG2-CB 4.13Å; I263-L587 HydrophobicContact CG2-CD1 4.36Å; I263-L590 HydrophobicContact CD1-CD2 4.14Å
264	V	89.1	Confident	85	Confident	63 Å²	63	61.5 Å²	61.5	38%	0.382	31%	0.314	S	S	.	.	H	α-helix	trans	-64.2	-44.3	179.8	172.2	0	0	0	0	111.6	L260 R266 S267 A268 L587	L260-V264 HydrophobicContact CD1-CG2 4.05Å; L260-V264 HydrophobicContact CG-CG2 4.48Å; L260-V264 WeakPolarHBondContact O-CB 3.21Å; L260-V264 VanDerWaalsContact O-CG2 3.26Å; L260-V264 WeakPolarHBondContact O-CG2 3.43Å; L260-V264 PolarHBondContact O-N 3.1Å; V264-R266 VanDerWaalsContact C-N 3.29Å; V264-R266 PolarHBondContact O-N 3.3Å; V264-S267 WeakPolarHBondContact CA-OG 3.2Å; V264-S267 PolarHBondContact O-N 2.79Å; V264-S267 PolarHBondContact O-OG 3.23Å; V264-A268 VanDerWaalsContact O-CB 3.29Å; V264-A268 WeakPolarHBondContact O-CB 3.26Å; V264-A268 PolarHBondContact O-N 2.87Å; V264-L587 HydrophobicContact CG2-CD1 4.25Å
265	K	85	Confident	83.7	Confident	138 Å²	138	64.4 Å²	64.4	60%	0.6	32%	0.322	S	S	*	.	H	α-helix	trans	-58.2	-44.1	175.8	179.8	-179.8	177.5	179.3	0	111.2	L261 A269	L261-K265 WeakPolarHBondContact O-CB 3.43Å; L261-K265 PolarHBondContact O-N 3.19Å; K265-A269 PolarHBondContact O-N 2.82Å
266	R	84.1	Confident	82.2	Confident	66 Å²	66	69.1 Å²	69.1	25%	0.249	35%	0.347	C	S	.	.	H	α-helix	trans	-71.9	-38	180	-166.7	177.5	171.7	141.2	-8.3	111.8	S149 W262 I263 V264 A269 G270 L583	S149-R266 PolarHBondContact O-NH2 3.33Å; W262-R266 WeakPolarHBondContact O-CB 3.39Å; W262-R266 PolarHBondContact O-N 3.1Å; I263-R266 PolarHBondContact O-N 2.88Å; V264-R266 VanDerWaalsContact C-N 3.29Å; V264-R266 PolarHBondContact O-N 3.3Å; R266-A269 PolarHBondContact O-N 2.94Å; R266-G270 PolarHBondContact O-N 3.01Å; R266-L583 HydrophobicContact CB-CD1 4.16Å; R266-L583 HydrophobicContact CB-CD2 4.5Å; R266-L583 HydrophobicContact CG-CD1 3.74Å; R266-L583 HydrophobicContact CG-CD2 4.34Å
267	S	83.4	Confident	80.4	Confident	19 Å²	19	72.2 Å²	72.2	13%	0.133	36%	0.359	C	S	.	.	H	α-helix	trans	-69.2	-40	178.6	74.9	0	0	0	0	111.4	I263 V264 A269 G270 F271	I263-S267 VanDerWaalsContact O-CB 3.32Å; I263-S267 WeakPolarHBondContact O-CB 3.27Å; I263-S267 PolarHBondContact O-N 2.92Å; I263-S267 PolarHBondContact O-OG 2.68Å; V264-S267 WeakPolarHBondContact CA-OG 3.2Å; V264-S267 PolarHBondContact O-N 2.79Å; V264-S267 PolarHBondContact O-OG 3.23Å; S267-A269 PolarHBondContact O-N 3.41Å; S267-G270 CarbonylContact O-C 3.57Å; S267-G270 WeakPolarHBondContact O-CA 3.32Å; S267-G270 PolarHBondContact O-N 3.48Å; S267-G270 VanDerWaalsContact O-N 3.12Å; S267-F271 WeakPolarHBondContact O-CB 3.42Å; S267-F271 PolarHBondContact O-N 3.18Å
268	A	80.4	Confident	78.7	Confident	55 Å²	55	70.4 Å²	70.4	46%	0.455	35%	0.35	S	S	.	.	H	α-helix	trans	-61.7	-42.2	174.8	0	0	0	0	0	111.9	V264 G270 F271 K272	V264-A268 VanDerWaalsContact O-CB 3.29Å; V264-A268 WeakPolarHBondContact O-CB 3.26Å; V264-A268 PolarHBondContact O-N 2.87Å; A268-G270 VanDerWaalsContact C-N 3.33Å; A268-G270 PolarHBondContact O-N 3.38Å; A268-F271 PolarHBondContact O-N 2.85Å; A268-K272 PolarHBondContact O-N 3.21Å
269	A	78.3	Confident	76.9	Confident	49 Å²	49	73.1 Å²	73.1	41%	0.405	36%	0.361	S	S	.	.	H	α-helix	trans	-63.9	-38.4	173.2	0	0	0	0	0	112.2	K265 R266 S267 R273	K265-A269 PolarHBondContact O-N 2.82Å; R266-A269 PolarHBondContact O-N 2.94Å; S267-A269 PolarHBondContact O-N 3.41Å; A269-R273 WeakPolarHBondContact O-CG 3.26Å; A269-R273 PolarHBondContact O-N 2.94Å
270	G	71.9	Confident	75.1	Confident	16 Å²	16	77.9 Å²	77.9	17%	0.165	39%	0.386	C	S	.	.	H	α-helix	trans	-65	-44.4	173.4	0	0	0	0	0	112.9	R266 S267 A268 R273 H274	R266-G270 PolarHBondContact O-N 3.01Å; S267-G270 CarbonylContact O-C 3.57Å; S267-G270 WeakPolarHBondContact O-CA 3.32Å; S267-G270 PolarHBondContact O-N 3.48Å; S267-G270 VanDerWaalsContact O-N 3.12Å; A268-G270 VanDerWaalsContact C-N 3.33Å; A268-G270 PolarHBondContact O-N 3.38Å; G270-R273 PolarHBondContact O-N 3.42Å; G270-H274 PolarHBondContact O-N 3.28Å
271	F	74.5	Confident	73.3	Confident	90 Å²	90	80.4 Å²	80.4	40%	0.395	39%	0.392	S	S	.	.	H	α-helix	trans	-63.4	-43.6	179.3	-177.8	-113.3	0	0	0	111.9	S267 A268 R273 H274 L275 F580	S267-F271 WeakPolarHBondContact O-CB 3.42Å; S267-F271 PolarHBondContact O-N 3.18Å; A268-F271 PolarHBondContact O-N 2.85Å; F271-R273 VanDerWaalsContact C-N 3.29Å; F271-R273 PolarHBondContact O-N 3.46Å; F271-H274 WeakPolarHBondContact O-CB 3.27Å; F271-H274 PolarHBondContact O-N 2.97Å; F271-H274 VanDerWaalsContact O-N 3.09Å; F271-L275 HydrophobicContact CD1-CD1 3.61Å; F271-L275 HydrophobicContact CD1-CG 4.3Å; F271-L275 HydrophobicContact CD2-CG 4.49Å; F271-L275 HydrophobicContact CE1-CD1 3.14Å; F271-L275 HydrophobicContact CE1-CG 3.9Å; F271-L275 HydrophobicContact CE2-CD1 4.23Å; F271-L275 HydrophobicContact CE2-CD2 4.43Å; F271-L275 HydrophobicContact CE2-CG 4.07Å; F271-L275 HydrophobicContact CG-CD1 4.34Å; F271-L275 HydrophobicContact CZ-CD1 3.49Å; F271-L275 VanDerWaalsContact CZ-CD1 3.49Å; F271-L275 HydrophobicContact CZ-CD2 4.02Å; F271-L275 HydrophobicContact CZ-CG 3.76Å; F271-L275 PolarHBondContact O-N 3.42Å; F271-F580 HydrophobicContact CB-CD2 3.83Å; F271-F580 HydrophobicContact CB-CE2 3.78Å; F271-F580 HydrophobicContact CD2-CD2 4.23Å; F271-F580 HydrophobicContact CD2-CE1 4.44Å; F271-F580 AromaticContact CD2-CE2 3.72Å; F271-F580 HydrophobicContact CD2-CE2 3.72Å; F271-F580 AromaticContact CD2-CZ 3.83Å; F271-F580 HydrophobicContact CD2-CZ 3.83Å; F271-F580 HydrophobicContact CE2-CZ 4.47Å; F271-F580 HydrophobicContact CG-CE2 4.1Å
272	K	74.2	Confident	71.3	Confident	141 Å²	141	84.7 Å²	84.7	61%	0.613	41%	0.405	S	S	*	.	H	α-helix	trans	-56.4	-43.5	174.8	-176.5	177.1	179.9	178.3	0	111.7	A268 I276	A268-K272 PolarHBondContact O-N 3.21Å; K272-I276 HydrophobicContact CG-CD1 3.95Å; K272-I276 WeakPolarHBondContact O-CD1 3.4Å; K272-I276 WeakPolarHBondContact O-CG1 3.41Å; K272-I276 PolarHBondContact O-N 3.22Å
273	R	68.4	Low	69.6	Low	188 Å²	188	89.2 Å²	89.2	71%	0.709	43%	0.429	S	S	*	.	H	α-helix	trans	-68.3	-36	177.1	-67.4	176.7	-172.1	172.2	2.3	112.3	A269 G270 F271 K277	A269-R273 WeakPolarHBondContact O-CG 3.26Å; A269-R273 PolarHBondContact O-N 2.94Å; G270-R273 PolarHBondContact O-N 3.42Å; F271-R273 VanDerWaalsContact C-N 3.29Å; F271-R273 PolarHBondContact O-N 3.46Å; R273-K277 PolarHBondContact O-N 3.2Å
274	H	66.5	Low	68.4	Low	30 Å²	30	90.4 Å²	90.4	14%	0.139	44%	0.437	C	S	.	.	H	α-helix	trans	-65.4	-49.3	176.2	-173.9	-81.6	0	0	0	111.7	G270 F271 I276 K277 D278	G270-H274 PolarHBondContact O-N 3.28Å; F271-H274 WeakPolarHBondContact O-CB 3.27Å; F271-H274 PolarHBondContact O-N 2.97Å; F271-H274 VanDerWaalsContact O-N 3.09Å; H274-I276 PolarHBondContact O-N 2.9Å; H274-K277 PolarHBondContact O-N 2.86Å; H274-D278 IonicContact CE1-OD2 3.23Å; H274-D278 PolarHBondContact CE1-OD2 3Å; H274-D278 VanDerWaalsContact CE1-OD2 3.24Å; H274-D278 IonicContact ND1-OD2 3.24Å; H274-D278 PolarHBondContact O-N 2.78Å
275	L	65.9	Low	67.8	Low	91 Å²	91	90.9 Å²	90.9	48%	0.476	43%	0.434	S	S	.	.	H	α-helix	trans	-56.8	-47.4	178.6	-82.4	170.9	0	0	0	112.5	F271 K277 D278	F271-L275 HydrophobicContact CD1-CD1 3.61Å; F271-L275 HydrophobicContact CD1-CG 4.3Å; F271-L275 HydrophobicContact CD2-CG 4.49Å; F271-L275 HydrophobicContact CE1-CD1 3.14Å; F271-L275 HydrophobicContact CE1-CG 3.9Å; F271-L275 HydrophobicContact CE2-CD1 4.23Å; F271-L275 HydrophobicContact CE2-CD2 4.43Å; F271-L275 HydrophobicContact CE2-CG 4.07Å; F271-L275 HydrophobicContact CG-CD1 4.34Å; F271-L275 HydrophobicContact CZ-CD1 3.49Å; F271-L275 VanDerWaalsContact CZ-CD1 3.49Å; F271-L275 HydrophobicContact CZ-CD2 4.02Å; F271-L275 HydrophobicContact CZ-CG 3.76Å; F271-L275 PolarHBondContact O-N 3.42Å; L275-K277 PolarHBondContact O-N 3.3Å; L275-D278 PolarHBondContact O-N 3.34Å
276	I	64.4	Low	67.4	Low	100 Å²	100	88.1 Å²	88.1	51%	0.513	43%	0.431	S	S	.	.	H	α-helix	trans	-61.7	-33.6	-179.4	-66.7	164.8	0	0	0	111.3	K272 H274	K272-I276 HydrophobicContact CG-CD1 3.95Å; K272-I276 WeakPolarHBondContact O-CD1 3.4Å; K272-I276 WeakPolarHBondContact O-CG1 3.41Å; K272-I276 PolarHBondContact O-N 3.22Å; H274-I276 PolarHBondContact O-N 2.9Å
277	K	57.6	Low	67.1	Low	86 Å²	86	89.9 Å²	89.9	37%	0.374	45%	0.446	S	S	.	.	H	α-helix	trans	-83	-20.2	-176.3	-156.1	175.8	-176.7	-178.8	0	113.6	R273 H274 L275	R273-K277 PolarHBondContact O-N 3.2Å; H274-K277 PolarHBondContact O-N 2.86Å; L275-K277 PolarHBondContact O-N 3.3Å
278	D	57.6	Low	66.8	Low	45 Å²	45	90.4 Å²	90.4	24%	0.241	45%	0.445	C	S	.	.	H	α-helix	trans	-84.6	-18.1	-177.8	-102.6	9.5	0	0	0	113.6	H274 L275 R281 R574	H274-D278 IonicContact CE1-OD2 3.23Å; H274-D278 PolarHBondContact CE1-OD2 3Å; H274-D278 VanDerWaalsContact CE1-OD2 3.24Å; H274-D278 IonicContact ND1-OD2 3.24Å; H274-D278 PolarHBondContact O-N 2.78Å; L275-D278 PolarHBondContact O-N 3.34Å; D278-R281 PolarHBondContact O-NE 3.36Å; D278-R281 VanDerWaalsContact O-NE 3.16Å; D278-R281 PolarHBondContact O-NH2 3.02Å; D278-R281 VanDerWaalsContact O-NH2 3.14Å; D278-R281 IonicContact OD1-CZ 3.39Å; D278-R281 IonicContact OD1-NH1 3.05Å; D278-R281 IonicContact OD1-NH2 2.78Å; D278-R281 PolarHBondContact OD1-NH2 3.28Å; D278-R281 IonicContact OD2-CZ 2.59Å; D278-R281 IonicContact OD2-NH2 3.99Å; D278-R281 PolarHBondContact OD2-NH2 3Å; D278-R574 IonicContact OD1-NH1 3.32Å
279	E	54.9	Low	66.9	Low	120 Å²	120	92.5 Å²	92.5	56%	0.561	45%	0.448	S	S	*	.	S	Bend	trans	-83.4	-20	-177.3	-148	167.2	-171.2	0	0	113.3	R676	E279-R676 IonicContact OE1-CZ 3.15Å; E279-R676 IonicContact OE1-NH1 2.74Å; E279-R676 PolarHBondContact OE1-NH1 3.23Å; E279-R676 IonicContact OE1-NH2 2.69Å; E279-R676 PolarHBondContact OE1-NH2 2.75Å; E279-R676 IonicContact OE2-NH2 3.11Å; E279-R676 PolarHBondContact OE2-NH2 3.05Å; E279-R676 VanDerWaalsContact OE2-NH2 3.11Å
280	D	56.5	Low	67.1	Low	99 Å²	99	98.1 Å²	98.1	53%	0.529	46%	0.463	S	S	.	.			trans	-97	18.6	-174.8	-72.4	-23.7	0	0	0	115	F282 Q283 S284	D280-F282 VanDerWaalsContact C-N 3.32Å; D280-F282 PolarHBondContact O-N 3.46Å; D280-Q283 PolarHBondContact O-N 3.44Å; D280-S284 PolarHBondContact O-N 3.16Å
281	R	55.3	Low	67.5	Low	119 Å²	119	100.3 Å²	100.3	45%	0.449	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-30.4	-169.3	-96.1	-179.9	-80.4	-141.9	-5.7	115.2	D278	D278-R281 PolarHBondContact O-NE 3.36Å; D278-R281 VanDerWaalsContact O-NE 3.16Å; D278-R281 PolarHBondContact O-NH2 3.02Å; D278-R281 VanDerWaalsContact O-NH2 3.14Å; D278-R281 IonicContact OD1-CZ 3.39Å; D278-R281 IonicContact OD1-NH1 3.05Å; D278-R281 IonicContact OD1-NH2 2.78Å; D278-R281 PolarHBondContact OD1-NH2 3.28Å; D278-R281 IonicContact OD2-CZ 2.59Å; D278-R281 IonicContact OD2-NH2 3.99Å; D278-R281 PolarHBondContact OD2-NH2 3Å
282	F	48.8	Very low	67.8	Low	212 Å²	212	96.8 Å²	96.8	93%	0.93	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-18.3	179.9	-71.3	-78.2	0	0	0	114.4	D280	D280-F282 VanDerWaalsContact C-N 3.32Å; D280-F282 PolarHBondContact O-N 3.46Å
283	Q	53.7	Low	68.3	Low	147 Å²	147	94.7 Å²	94.7	69%	0.687	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-9.2	170.1	-111.8	108.1	-16.7	0	0	112.8	D280 N287	D280-Q283 PolarHBondContact O-N 3.44Å; Q283-N287 WeakPolarHBondContact O-CB 3.31Å; Q283-N287 PolarHBondContact O-N 3.49Å
284	S	65.4	Low	69	Low	24 Å²	24	89.3 Å²	89.3	17%	0.168	44%	0.443	C	S	.	.	H	α-helix	trans	-68.2	-49.6	-168.1	172	0	0	0	0	114.8	D280 N287 K288	D280-S284 PolarHBondContact O-N 3.16Å; S284-N287 PolarHBondContact O-N 3.11Å; S284-K288 VanDerWaalsContact O-CB 3.22Å; S284-K288 WeakPolarHBondContact O-CB 3.28Å; S284-K288 WeakPolarHBondContact O-CG 3.37Å; S284-K288 PolarHBondContact O-N 3.15Å; S284-K288 WeakPolarHBondContact OG-CD 3.17Å; S284-K288 WeakPolarHBondContact OG-CE 3.08Å
285	F	76.1	Confident	69.8	Low	74 Å²	74	96.1 Å²	96.1	33%	0.325	47%	0.473	S	S	.	.	H	α-helix	trans	-64.1	-50.4	-173.8	-78	-77.1	0	0	0	112.1	N287 K288 I289 L314 D317	F285-N287 PolarHBondContact O-N 2.96Å; F285-K288 PolarHBondContact O-N 3.01Å; F285-I289 WeakPolarHBondContact O-CB 3.38Å; F285-I289 VanDerWaalsContact O-CG1 3.26Å; F285-I289 WeakPolarHBondContact O-CG1 3.37Å; F285-I289 PolarHBondContact O-N 3.3Å; F285-L314 HydrophobicContact CD1-CD2 3.86Å; F285-L314 HydrophobicContact CE1-CD2 4.24Å; F285-D317 HydrophobicContact CE1-CB 3.64Å; F285-D317 HydrophobicContact CZ-CB 3.52Å
286	C	77.3	Confident	70.8	Confident	80 Å²	80	96.9 Å²	96.9	54%	0.541	48%	0.484	S	S	.	.	H	α-helix	trans	-61.1	-45	176.9	-61.1	0	0	0	0	111.3	K288 I289 F290	C286-K288 VanDerWaalsContact C-N 3.34Å; C286-K288 PolarHBondContact O-N 3.05Å; C286-I289 PolarHBondContact O-N 3.47Å; C286-F290 HydrophobicContact CB-CD2 4.23Å; C286-F290 WeakPolarHBondContact O-CB 2.81Å; C286-F290 WeakPolarHBondContact O-CD2 3.44Å; C286-F290 PolarHBondContact O-N 3.09Å
287	N	77.4	Confident	71.7	Confident	103 Å²	103	94.5 Å²	94.5	55%	0.551	47%	0.472	S	S	*	.	H	α-helix	trans	-66	-35	179	-163.4	37	0	0	0	112.4	Q283 S284 F285 A291 G292	Q283-N287 WeakPolarHBondContact O-CB 3.31Å; Q283-N287 PolarHBondContact O-N 3.49Å; S284-N287 PolarHBondContact O-N 3.11Å; F285-N287 PolarHBondContact O-N 2.96Å; N287-A291 CarbonylContact O-C 3.47Å; N287-A291 VanDerWaalsContact O-C 3.3Å; N287-A291 VanDerWaalsContact O-CA 3.24Å; N287-A291 WeakPolarHBondContact O-CA 2.96Å; N287-A291 VanDerWaalsContact O-CB 3.31Å; N287-A291 WeakPolarHBondContact O-CB 3.24Å; N287-A291 PolarHBondContact O-N 2.88Å; N287-A291 VanDerWaalsContact OD1-CB 3.25Å; N287-A291 WeakPolarHBondContact OD1-CB 3.36Å; N287-G292 PolarHBondContact O-N 3.24Å; N287-G292 VanDerWaalsContact O-N 3.1Å
288	K	78.4	Confident	72.9	Confident	29 Å²	29	97.3 Å²	97.3	13%	0.126	50%	0.496	C	S	.	.	H	α-helix	trans	-68.9	-39.3	174.9	-76.9	174.3	175	-166	0	112.6	S284 F285 C286 G292 E313 D317	S284-K288 VanDerWaalsContact O-CB 3.22Å; S284-K288 WeakPolarHBondContact O-CB 3.28Å; S284-K288 WeakPolarHBondContact O-CG 3.37Å; S284-K288 PolarHBondContact O-N 3.15Å; S284-K288 WeakPolarHBondContact OG-CD 3.17Å; S284-K288 WeakPolarHBondContact OG-CE 3.08Å; F285-K288 PolarHBondContact O-N 3.01Å; C286-K288 VanDerWaalsContact C-N 3.34Å; C286-K288 PolarHBondContact O-N 3.05Å; K288-G292 VanDerWaalsContact O-CA 3.29Å; K288-G292 WeakPolarHBondContact O-CA 3.38Å; K288-G292 PolarHBondContact O-N 3.46Å; K288-E313 WeakPolarHBondContact CE-OE1 3.2Å; K288-E313 VanDerWaalsContact NZ-CG 3.3Å; K288-E313 IonicContact NZ-OE1 2.93Å; K288-E313 PolarHBondContact NZ-OE1 3.1Å; K288-D317 IonicContact NZ-OD1 2.77Å; K288-D317 IonicContact NZ-OD2 3.89Å; K288-D317 PolarHBondContact NZ-OD2 2.95Å
289	I	82.5	Confident	74.3	Confident	100 Å²	100	97.7 Å²	97.7	51%	0.513	50%	0.503	S	S	.	.	H	α-helix	trans	-71.8	-48.9	179	-67.9	168	0	0	0	110.3	F285 C286 L314	F285-I289 WeakPolarHBondContact O-CB 3.38Å; F285-I289 VanDerWaalsContact O-CG1 3.26Å; F285-I289 WeakPolarHBondContact O-CG1 3.37Å; F285-I289 PolarHBondContact O-N 3.3Å; C286-I289 PolarHBondContact O-N 3.47Å; I289-L314 HydrophobicContact CD1-CD2 4.44Å; I289-L314 HydrophobicContact CG1-CD1 4.46Å; I289-L314 HydrophobicContact CG1-CD2 4.17Å
290	F	81.7	Confident	75.7	Confident	166 Å²	166	100 Å²	100	73%	0.728	51%	0.514	S	S	*	.	H	α-helix	trans	-90.9	-31.2	-171.5	-65.5	-66	0	0	0	114.4	C286	C286-F290 HydrophobicContact CB-CD2 4.23Å; C286-F290 WeakPolarHBondContact O-CB 2.81Å; C286-F290 WeakPolarHBondContact O-CD2 3.44Å; C286-F290 PolarHBondContact O-N 3.09Å
291	A	81.1	Confident	76.5	Confident	63 Å²	63	99.6 Å²	99.6	52%	0.521	52%	0.518	S	S	.	.	H	α-helix	trans	-120	4.8	-177.1	0	0	0	0	0	113.6	N287 W293	N287-A291 CarbonylContact O-C 3.47Å; N287-A291 VanDerWaalsContact O-C 3.3Å; N287-A291 VanDerWaalsContact O-CA 3.24Å; N287-A291 WeakPolarHBondContact O-CA 2.96Å; N287-A291 VanDerWaalsContact O-CB 3.31Å; N287-A291 WeakPolarHBondContact O-CB 3.24Å; N287-A291 PolarHBondContact O-N 2.88Å; N287-A291 VanDerWaalsContact OD1-CB 3.25Å; N287-A291 WeakPolarHBondContact OD1-CB 3.36Å; A291-W293 VanDerWaalsContact C-N 3.33Å
292	G	79.1	Confident	77.4	Confident	16 Å²	16	95.4 Å²	95.4	17%	0.165	51%	0.509	C	S	.	.	S	Bend	trans	-76	-20.6	178.5	0	0	0	0	0	113.9	N287 K288 K306	N287-G292 PolarHBondContact O-N 3.24Å; N287-G292 VanDerWaalsContact O-N 3.1Å; K288-G292 VanDerWaalsContact O-CA 3.29Å; K288-G292 WeakPolarHBondContact O-CA 3.38Å; K288-G292 PolarHBondContact O-N 3.46Å; G292-K306 WeakPolarHBondContact O-CE 3.33Å; G292-K306 PolarHBondContact O-NZ 3.04Å
293	W	85.2	Confident	79	Confident	96 Å²	96	86.6 Å²	86.6	36%	0.364	48%	0.476	S	S	.	.			trans	-80.8	134.1	179	-166.6	-99.9	0	0	0	111.4	A291 F295 A303 K306 R307 L310	A291-W293 VanDerWaalsContact C-N 3.33Å; W293-F295 AromaticContact CD1-CD1 3.61Å; W293-F295 AromaticContact CD1-CE1 3.57Å; W293-F295 AromaticContact CD1-CG 3.94Å; W293-F295 AromaticContact CD1-CZ 3.85Å; W293-A303 HydrophobicContact CH2-CB 4.34Å; W293-A303 HydrophobicContact CZ2-CB 4.45Å; W293-K306 HydrophobicContact CE3-CG 4.33Å; W293-K306 HydrophobicContact CZ3-CB 4.45Å; W293-K306 HydrophobicContact CZ3-CG 4.26Å; W293-R307 HydrophobicContact CH2-CB 4.39Å; W293-R307 HydrophobicContact CZ3-CB 4.02Å; W293-L310 HydrophobicContact CE3-CD1 4.01Å
294	D	83.5	Confident	80.2	Confident	75 Å²	75	85.7 Å²	85.7	40%	0.401	47%	0.469	S	S	.	.			trans	-103.3	111.6	174.7	-175.2	-6.5	0	0	0	108.8	C296 I297	D294-C296 PolarHBondContact O-N 2.81Å; D294-C296 WeakPolarHBondContact OD1-CB 3.48Å; D294-C296 PolarHBondContact OD1-N 3.46Å; D294-I297 HydrophobicContact CB-CD1 3.95Å; D294-I297 HydrophobicContact CB-CG1 4.07Å; D294-I297 WeakPolarHBondContact O-CG1 3.29Å
295	F	84.3	Confident	80.6	Confident	174 Å²	174	89.2 Å²	89.2	76%	0.763	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-6.9	-178.6	-64.2	-82.2	0	0	0	113.3	W293 I297	W293-F295 AromaticContact CD1-CD1 3.61Å; W293-F295 AromaticContact CD1-CE1 3.57Å; W293-F295 AromaticContact CD1-CG 3.94Å; W293-F295 AromaticContact CD1-CZ 3.85Å; F295-I297 VanDerWaalsContact C-N 3.27Å; F295-I297 PolarHBondContact O-N 3.46Å
296	C	85.6	Confident	80.8	Confident	107 Å²	107	89.2 Å²	89.2	72%	0.723	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-0.9	177.3	-54.6	0	0	0	0	113.1	D294 T298	D294-C296 PolarHBondContact O-N 2.81Å; D294-C296 WeakPolarHBondContact OD1-CB 3.48Å; D294-C296 PolarHBondContact OD1-N 3.46Å; C296-T298 PolarHBondContact O-N 3.32Å
297	I	84.1	Confident	81.1	Confident	49 Å²	49	92.2 Å²	92.2	25%	0.251	48%	0.483	S	S	.	.			trans	-76.3	114.9	-179	-61.4	173.7	0	0	0	109.8	D294 F295 A302 A303 K306	D294-I297 HydrophobicContact CB-CD1 3.95Å; D294-I297 HydrophobicContact CB-CG1 4.07Å; D294-I297 WeakPolarHBondContact O-CG1 3.29Å; F295-I297 VanDerWaalsContact C-N 3.27Å; F295-I297 PolarHBondContact O-N 3.46Å; I297-A302 HydrophobicContact CG2-CB 3.68Å; I297-A303 HydrophobicContact CG2-CB 4.11Å; I297-K306 HydrophobicContact CD1-CB 3.83Å; I297-K306 HydrophobicContact CD1-CD 4.37Å; I297-K306 HydrophobicContact CD1-CG 3.82Å
298	T	82.5	Confident	81.1	Confident	145 Å²	145	90 Å²	90	89%	0.89	47%	0.471	S	S	*	.			trans	-98.2	-19.2	179.6	54.3	0	0	0	0	113.9	C296	C296-T298 PolarHBondContact O-N 3.32Å
299	S	86	Confident	80.8	Confident	54 Å²	54	91.6 Å²	91.6	38%	0.378	49%	0.486	S	S	.	.			trans	-94.4	133.5	-178.6	63.1	0	0	0	0	112.6	S301 A302 A303	S299-S301 VanDerWaalsContact C-N 3.29Å; S299-S301 PolarHBondContact O-N 3.49Å; S299-A302 PolarHBondContact O-N 2.76Å; S299-A302 WeakPolarHBondContact OG-CB 3.31Å; S299-A303 PolarHBondContact O-N 2.96Å
300	E	84.8	Confident	80.6	Confident	169 Å²	169	88.1 Å²	88.1	79%	0.79	47%	0.469	S	S	*	.	H	α-helix	trans	-62	-37.7	-179.4	-169.5	-175.1	169.9	0	0	112.2	A303 K304	E300-A303 PolarHBondContact O-N 2.95Å; E300-K304 WeakPolarHBondContact O-CB 3.42Å; E300-K304 PolarHBondContact O-N 3.42Å
301	S	74.4	Confident	80.6	Confident	89 Å²	89	84.7 Å²	84.7	62%	0.622	46%	0.457	S	S	*	.	H	α-helix	trans	-63.2	-43.4	176.4	55.1	0	0	0	0	112	S299 K304 Q305	S299-S301 VanDerWaalsContact C-N 3.29Å; S299-S301 PolarHBondContact O-N 3.49Å; S301-K304 PolarHBondContact O-N 3.12Å; S301-Q305 WeakPolarHBondContact O-CB 3.31Å; S301-Q305 PolarHBondContact O-N 3.39Å
302	A	74.1	Confident	80.1	Confident	32 Å²	32	88 Å²	88	26%	0.264	46%	0.457	S	S	.	.	H	α-helix	trans	-70.1	-35.8	176.7	0	0	0	0	0	111.9	I297 S299 Q305 K306	I297-A302 HydrophobicContact CG2-CB 3.68Å; S299-A302 PolarHBondContact O-N 2.76Å; S299-A302 WeakPolarHBondContact OG-CB 3.31Å; A302-Q305 PolarHBondContact O-N 2.76Å; A302-K306 VanDerWaalsContact O-CB 3.28Å; A302-K306 WeakPolarHBondContact O-CB 3.21Å; A302-K306 PolarHBondContact O-N 3.04Å
303	A	81.8	Confident	79.8	Confident	27 Å²	27	90 Å²	90	22%	0.223	46%	0.462	C	S	.	.	H	α-helix	trans	-63.7	-45.5	174.8	0	0	0	0	0	111.2	W293 I297 S299 E300 Q305 K306 R307	W293-A303 HydrophobicContact CH2-CB 4.34Å; W293-A303 HydrophobicContact CZ2-CB 4.45Å; I297-A303 HydrophobicContact CG2-CB 4.11Å; S299-A303 PolarHBondContact O-N 2.96Å; E300-A303 PolarHBondContact O-N 2.95Å; A303-Q305 VanDerWaalsContact C-N 3.33Å; A303-Q305 PolarHBondContact O-N 3.22Å; A303-K306 PolarHBondContact O-N 3.29Å; A303-R307 WeakPolarHBondContact O-CB 3.27Å; A303-R307 PolarHBondContact O-N 3.16Å
304	K	80.1	Confident	79.5	Confident	127 Å²	127	87.7 Å²	87.7	55%	0.552	46%	0.457	S	S	*	.	H	α-helix	trans	-61.5	-41.5	175.4	-169	172.9	-175.4	173	0	111.6	E300 S301 N308	E300-K304 WeakPolarHBondContact O-CB 3.42Å; E300-K304 PolarHBondContact O-N 3.42Å; S301-K304 PolarHBondContact O-N 3.12Å; K304-N308 WeakPolarHBondContact O-CB 3.44Å; K304-N308 PolarHBondContact O-N 2.87Å; K304-N308 PolarHBondContact O-OD1 3.3Å
305	Q	73.8	Confident	79.3	Confident	99 Å²	99	90.1 Å²	90.1	46%	0.463	46%	0.464	S	S	.	.	H	α-helix	trans	-67	-42.8	177.1	-171.5	175.3	-25.4	0	0	112.1	S301 A302 A303 N308 S309	S301-Q305 WeakPolarHBondContact O-CB 3.31Å; S301-Q305 PolarHBondContact O-N 3.39Å; A302-Q305 PolarHBondContact O-N 2.76Å; A303-Q305 VanDerWaalsContact C-N 3.33Å; A303-Q305 PolarHBondContact O-N 3.22Å; Q305-N308 PolarHBondContact O-N 2.86Å; Q305-S309 WeakPolarHBondContact O-CB 3.21Å; Q305-S309 PolarHBondContact O-N 3.08Å
306	K	80.1	Confident	78.7	Confident	73 Å²	73	82.9 Å²	82.9	32%	0.317	43%	0.434	S	S	.	.	H	α-helix	trans	-62.9	-43.8	176.4	-174.6	68.4	176.3	-174.9	0	111.5	G292 W293 I297 A302 A303 S309 L310	G292-K306 WeakPolarHBondContact O-CE 3.33Å; G292-K306 PolarHBondContact O-NZ 3.04Å; W293-K306 HydrophobicContact CE3-CG 4.33Å; W293-K306 HydrophobicContact CZ3-CB 4.45Å; W293-K306 HydrophobicContact CZ3-CG 4.26Å; I297-K306 HydrophobicContact CD1-CB 3.83Å; I297-K306 HydrophobicContact CD1-CD 4.37Å; I297-K306 HydrophobicContact CD1-CG 3.82Å; A302-K306 VanDerWaalsContact O-CB 3.28Å; A302-K306 WeakPolarHBondContact O-CB 3.21Å; A302-K306 PolarHBondContact O-N 3.04Å; A303-K306 PolarHBondContact O-N 3.29Å; K306-S309 PolarHBondContact O-N 3.22Å; K306-L310 HydrophobicContact CG-CD1 4.41Å; K306-L310 PolarHBondContact O-N 3.3Å
307	R	82.8	Confident	78.1	Confident	144 Å²	144	78.8 Å²	78.8	54%	0.543	41%	0.405	S	S	.	.	H	α-helix	trans	-59.4	-50.6	174.5	-174.2	-177.1	71.7	173.8	3	111.7	W293 A303 S309 L310 L311	W293-R307 HydrophobicContact CH2-CB 4.39Å; W293-R307 HydrophobicContact CZ3-CB 4.02Å; A303-R307 WeakPolarHBondContact O-CB 3.27Å; A303-R307 PolarHBondContact O-N 3.16Å; R307-S309 VanDerWaalsContact C-N 3.31Å; R307-S309 PolarHBondContact O-N 3.43Å; R307-L310 PolarHBondContact O-N 2.94Å; R307-L311 WeakPolarHBondContact O-CB 3.49Å; R307-L311 PolarHBondContact O-N 2.85Å
308	N	77.2	Confident	77.9	Confident	56 Å²	56	81.9 Å²	81.9	30%	0.299	42%	0.421	S	S	.	.	H	α-helix	trans	-61.8	-42.1	179.1	-71.6	-3.6	0	0	0	111	K304 Q305 L310 L311 Y312	K304-N308 WeakPolarHBondContact O-CB 3.44Å; K304-N308 PolarHBondContact O-N 2.87Å; K304-N308 PolarHBondContact O-OD1 3.3Å; Q305-N308 PolarHBondContact O-N 2.86Å; N308-L310 PolarHBondContact O-N 2.87Å; N308-L311 PolarHBondContact O-N 3.21Å; N308-Y312 HydrophobicContact CB-CD2 4.4Å; N308-Y312 HydrophobicContact CB-CE2 4.15Å; N308-Y312 WeakPolarHBondContact O-CD2 3.27Å; N308-Y312 PolarHBondContact O-N 3.42Å
309	S	73.3	Confident	77.6	Confident	63 Å²	63	79.2 Å²	79.2	44%	0.441	40%	0.399	S	S	.	.	H	α-helix	trans	-58.9	-47	176.1	-176.2	0	0	0	0	112.3	Q305 K306 R307 Y312 E313	Q305-S309 WeakPolarHBondContact O-CB 3.21Å; Q305-S309 PolarHBondContact O-N 3.08Å; K306-S309 PolarHBondContact O-N 3.22Å; R307-S309 VanDerWaalsContact C-N 3.31Å; R307-S309 PolarHBondContact O-N 3.43Å; S309-Y312 PolarHBondContact O-N 2.92Å; S309-E313 WeakPolarHBondContact O-CB 3.31Å; S309-E313 PolarHBondContact O-N 3.41Å
310	L	78.4	Confident	77	Confident	27 Å²	27	80.2 Å²	80.2	14%	0.141	40%	0.4	C	S	.	.	H	α-helix	trans	-64.3	-43.4	177.9	-77.1	167.6	0	0	0	111.6	W293 K306 R307 N308 Y312 E313 L314	W293-L310 HydrophobicContact CE3-CD1 4.01Å; K306-L310 HydrophobicContact CG-CD1 4.41Å; K306-L310 PolarHBondContact O-N 3.3Å; R307-L310 PolarHBondContact O-N 2.94Å; N308-L310 PolarHBondContact O-N 2.87Å; L310-Y312 PolarHBondContact O-N 3.5Å; L310-E313 PolarHBondContact O-N 3.21Å; L310-L314 WeakPolarHBondContact O-CB 3.34Å; L310-L314 PolarHBondContact O-N 3.33Å
311	L	80.5	Confident	76.6	Confident	94 Å²	94	75.7 Å²	75.7	49%	0.492	38%	0.379	S	S	.	.	H	α-helix	trans	-58.9	-47.6	176.9	-177.6	155.5	0	0	0	111.3	R307 N308 E313 L314 K315	R307-L311 WeakPolarHBondContact O-CB 3.49Å; R307-L311 PolarHBondContact O-N 2.85Å; N308-L311 PolarHBondContact O-N 3.21Å; L311-E313 VanDerWaalsContact C-N 3.35Å; L311-L314 PolarHBondContact O-N 3.11Å; L311-K315 WeakPolarHBondContact O-CB 3.49Å; L311-K315 PolarHBondContact O-N 3.01Å
312	Y	70.8	Confident	76.9	Confident	132 Å²	132	78 Å²	78	52%	0.518	37%	0.374	S	S	.	.	H	α-helix	trans	-65.1	-39.2	178.6	-72.5	-56.5	0	0	0	112	N308 S309 L310 K315 T316	N308-Y312 HydrophobicContact CB-CD2 4.4Å; N308-Y312 HydrophobicContact CB-CE2 4.15Å; N308-Y312 WeakPolarHBondContact O-CD2 3.27Å; N308-Y312 PolarHBondContact O-N 3.42Å; S309-Y312 PolarHBondContact O-N 2.92Å; L310-Y312 PolarHBondContact O-N 3.5Å; Y312-K315 PolarHBondContact O-N 2.89Å; Y312-T316 PolarHBondContact O-N 3.4Å; Y312-T316 PolarHBondContact O-OG1 3.36Å
313	E	73.5	Confident	76.8	Confident	57 Å²	57	78.7 Å²	78.7	27%	0.266	37%	0.372	S	S	.	.	H	α-helix	trans	-67.5	-38.5	178.4	-166.4	175.3	-175.5	0	0	112.4	K288 S309 L310 L311 T316 D317	K288-E313 WeakPolarHBondContact CE-OE1 3.2Å; K288-E313 VanDerWaalsContact NZ-CG 3.3Å; K288-E313 IonicContact NZ-OE1 2.93Å; K288-E313 PolarHBondContact NZ-OE1 3.1Å; S309-E313 WeakPolarHBondContact O-CB 3.31Å; S309-E313 PolarHBondContact O-N 3.41Å; L310-E313 PolarHBondContact O-N 3.21Å; L311-E313 VanDerWaalsContact C-N 3.35Å; E313-T316 VanDerWaalsContact C-OG1 3.3Å; E313-T316 WeakPolarHBondContact CA-OG1 3.29Å; E313-T316 PolarHBondContact O-OG1 2.97Å; E313-D317 VanDerWaalsContact O-CG 3.23Å; E313-D317 PolarHBondContact O-N 3.49Å; E313-D317 VanDerWaalsContact O-N 3.15Å
314	L	77.6	Confident	76.4	Confident	49 Å²	49	81.9 Å²	81.9	26%	0.257	38%	0.382	S	S	.	.	H	α-helix	trans	-66.4	-45	173.1	-84.5	154.5	0	0	0	111.3	F285 I289 L310 L311 T316 D317 L318	F285-L314 HydrophobicContact CD1-CD2 3.86Å; F285-L314 HydrophobicContact CE1-CD2 4.24Å; I289-L314 HydrophobicContact CD1-CD2 4.44Å; I289-L314 HydrophobicContact CG1-CD1 4.46Å; I289-L314 HydrophobicContact CG1-CD2 4.17Å; L310-L314 WeakPolarHBondContact O-CB 3.34Å; L310-L314 PolarHBondContact O-N 3.33Å; L311-L314 PolarHBondContact O-N 3.11Å; L314-T316 VanDerWaalsContact C-N 3.34Å; L314-T316 PolarHBondContact O-N 2.97Å; L314-D317 PolarHBondContact O-N 3.31Å; L314-L318 WeakPolarHBondContact O-CB 3.34Å; L314-L318 PolarHBondContact O-N 3.2Å
315	K	80.2	Confident	76.2	Confident	125 Å²	125	81.5 Å²	81.5	54%	0.543	38%	0.382	S	S	.	.	H	α-helix	trans	-61.6	-40.8	178.3	-169.3	176.5	-177.1	178.7	0	111.8	L311 Y312 E319	L311-K315 WeakPolarHBondContact O-CB 3.49Å; L311-K315 PolarHBondContact O-N 3.01Å; Y312-K315 PolarHBondContact O-N 2.89Å; K315-E319 WeakPolarHBondContact O-CG 3.26Å; K315-E319 PolarHBondContact O-N 3.27Å; K315-E319 VanDerWaalsContact O-N 3.09Å
316	T	70.4	Confident	76.4	Confident	23 Å²	23	82.9 Å²	82.9	14%	0.141	39%	0.386	C	S	.	.	H	α-helix	trans	-61	-48.1	173.8	40.4	0	0	0	0	112.3	Y312 E313 L314 L318 E319 D320 P572	Y312-T316 PolarHBondContact O-N 3.4Å; Y312-T316 PolarHBondContact O-OG1 3.36Å; E313-T316 VanDerWaalsContact C-OG1 3.3Å; E313-T316 WeakPolarHBondContact CA-OG1 3.29Å; E313-T316 PolarHBondContact O-OG1 2.97Å; L314-T316 VanDerWaalsContact C-N 3.34Å; L314-T316 PolarHBondContact O-N 2.97Å; T316-L318 VanDerWaalsContact C-N 3.27Å; T316-L318 PolarHBondContact O-N 3.15Å; T316-E319 PolarHBondContact O-N 3.42Å; T316-D320 WeakPolarHBondContact O-CB 3.4Å; T316-D320 PolarHBondContact O-N 3.33Å; T316-P572 HydrophobicContact CG2-CB 3.41Å; T316-P572 VanDerWaalsContact CG2-CB 3.41Å; T316-P572 HydrophobicContact CG2-CG 3.3Å; T316-P572 WeakPolarHBondContact CG2-O 3.38Å
317	D	74.7	Confident	76	Confident	20 Å²	20	82.4 Å²	82.4	11%	0.107	39%	0.386	C	S	.	.	H	α-helix	trans	-66.4	-36.1	-173.9	-70.9	-6.6	0	0	0	110.5	F285 K288 E313 L314 E321	F285-D317 HydrophobicContact CE1-CB 3.64Å; F285-D317 HydrophobicContact CZ-CB 3.52Å; K288-D317 IonicContact NZ-OD1 2.77Å; K288-D317 IonicContact NZ-OD2 3.89Å; K288-D317 PolarHBondContact NZ-OD2 2.95Å; E313-D317 VanDerWaalsContact O-CG 3.23Å; E313-D317 PolarHBondContact O-N 3.49Å; E313-D317 VanDerWaalsContact O-N 3.15Å; L314-D317 PolarHBondContact O-N 3.31Å; D317-E321 PolarHBondContact O-N 3.48Å; D317-E321 VanDerWaalsContact O-N 3.1Å
318	L	79.3	Confident	75.7	Confident	114 Å²	114	79.1 Å²	79.1	60%	0.597	39%	0.39	S	S	*	.	H	α-helix	trans	-70	-41.6	178.1	-138.9	161.1	0	0	0	112	L314 T316 E321 R322	L314-L318 WeakPolarHBondContact O-CB 3.34Å; L314-L318 PolarHBondContact O-N 3.2Å; T316-L318 VanDerWaalsContact C-N 3.27Å; T316-L318 PolarHBondContact O-N 3.15Å; L318-E321 PolarHBondContact O-N 2.87Å; L318-R322 WeakPolarHBondContact O-CB 3.48Å; L318-R322 PolarHBondContact O-N 3.33Å
319	E	76.7	Confident	75.9	Confident	89 Å²	89	82.8 Å²	82.8	42%	0.416	41%	0.409	S	S	.	.	H	α-helix	trans	-66.2	-40.3	174	-71.3	-67.3	176.4	0	0	112.1	K315 T316 E321 R322 I323	K315-E319 WeakPolarHBondContact O-CG 3.26Å; K315-E319 PolarHBondContact O-N 3.27Å; K315-E319 VanDerWaalsContact O-N 3.09Å; T316-E319 PolarHBondContact O-N 3.42Å; E319-E321 PolarHBondContact O-N 2.93Å; E319-R322 PolarHBondContact O-N 3.36Å; E319-I323 VanDerWaalsContact O-CG1 3.26Å; E319-I323 WeakPolarHBondContact O-CG1 3.4Å; E319-I323 PolarHBondContact O-N 3.41Å
320	D	72.4	Confident	76.2	Confident	76 Å²	76	83 Å²	83	41%	0.406	40%	0.4	S	S	.	.	H	α-helix	trans	-61.3	-42.8	176.4	-87.3	-6.5	0	0	0	111.6	T316 I323 K324	T316-D320 WeakPolarHBondContact O-CB 3.4Å; T316-D320 PolarHBondContact O-N 3.33Å; D320-I323 PolarHBondContact O-N 2.89Å; D320-K324 WeakPolarHBondContact O-CG 3.37Å; D320-K324 PolarHBondContact O-N 3.37Å; D320-K324 VanDerWaalsContact O-N 3.13Å
321	E	75.9	Confident	76.5	Confident	74 Å²	74	85.3 Å²	85.3	35%	0.346	42%	0.416	S	S	.	.	H	α-helix	trans	-68	-41.2	175.1	-73.3	-55.6	140.6	0	0	112.2	D317 L318 E319 I323 K324 Q325	D317-E321 PolarHBondContact O-N 3.48Å; D317-E321 VanDerWaalsContact O-N 3.1Å; L318-E321 PolarHBondContact O-N 2.87Å; E319-E321 PolarHBondContact O-N 2.93Å; E321-I323 VanDerWaalsContact C-N 3.26Å; E321-I323 PolarHBondContact O-N 3.34Å; E321-K324 PolarHBondContact O-N 3.4Å; E321-K324 VanDerWaalsContact O-N 3.1Å; E321-K324 IonicContact OE1-NZ 3.86Å; E321-K324 PolarHBondContact OE1-NZ 3.34Å; E321-Q325 WeakPolarHBondContact O-CG 3.34Å; E321-Q325 PolarHBondContact O-N 3.23Å
322	R	80.9	Confident	76.6	Confident	137 Å²	137	86.6 Å²	86.6	52%	0.517	43%	0.428	S	S	.	.	H	α-helix	trans	-58.5	-39.6	175.5	-170.9	-180	-171.3	169.9	5.1	111.8	L318 E319 K326	L318-R322 WeakPolarHBondContact O-CB 3.48Å; L318-R322 PolarHBondContact O-N 3.33Å; E319-R322 PolarHBondContact O-N 3.36Å; R322-K326 WeakPolarHBondContact O-CG 3.48Å; R322-K326 PolarHBondContact O-N 2.85Å; R322-K326 VanDerWaalsContact O-N 3.09Å
323	I	71.5	Confident	77.1	Confident	46 Å²	46	88.7 Å²	88.7	24%	0.236	44%	0.439	C	S	.	.	H	α-helix	trans	-67.1	-41.4	176.3	-68.8	165.9	0	0	0	110.9	E319 D320 E321 K326 M327 P415	E319-I323 VanDerWaalsContact O-CG1 3.26Å; E319-I323 WeakPolarHBondContact O-CG1 3.4Å; E319-I323 PolarHBondContact O-N 3.41Å; D320-I323 PolarHBondContact O-N 2.89Å; E321-I323 VanDerWaalsContact C-N 3.26Å; E321-I323 PolarHBondContact O-N 3.34Å; I323-K326 PolarHBondContact O-N 3.38Å; I323-M327 HydrophobicContact CG2-CE 3.83Å; I323-M327 WeakPolarHBondContact O-CG 3.2Å; I323-M327 PolarHBondContact O-N 3.49Å; I323-M327 VanDerWaalsContact O-N 3.12Å; I323-P415 HydrophobicContact CD1-CG 3.83Å
324	K	73.5	Confident	77.5	Confident	95 Å²	95	88.8 Å²	88.8	41%	0.413	44%	0.442	S	S	.	.	H	α-helix	trans	-64.2	-42.1	176.5	-70.4	173.9	-163.4	165.8	0	112.4	D320 E321 M327 A328	D320-K324 WeakPolarHBondContact O-CG 3.37Å; D320-K324 PolarHBondContact O-N 3.37Å; D320-K324 VanDerWaalsContact O-N 3.13Å; E321-K324 PolarHBondContact O-N 3.4Å; E321-K324 VanDerWaalsContact O-N 3.1Å; E321-K324 IonicContact OE1-NZ 3.86Å; E321-K324 PolarHBondContact OE1-NZ 3.34Å; K324-M327 WeakPolarHBondContact O-CB 3.41Å; K324-M327 PolarHBondContact O-N 3.24Å; K324-A328 PolarHBondContact O-N 3.2Å
325	Q	77.3	Confident	77.6	Confident	119 Å²	119	90.8 Å²	90.8	56%	0.556	45%	0.448	S	S	*	.	H	α-helix	trans	-58.8	-49	174.8	-73.9	176.3	-18.5	0	0	110.8	E321 M327 A328 D329	E321-Q325 WeakPolarHBondContact O-CG 3.34Å; E321-Q325 PolarHBondContact O-N 3.23Å; Q325-M327 PolarHBondContact O-N 3.07Å; Q325-M327 VanDerWaalsContact O-N 3.09Å; Q325-A328 PolarHBondContact O-N 3.21Å; Q325-D329 PolarHBondContact O-N 3.32Å
326	K	77.8	Confident	77.8	Confident	128 Å²	128	89 Å²	89	56%	0.557	45%	0.451	S	S	*	.	H	α-helix	trans	-56.4	-27.7	173.6	-76.1	-179.8	179.3	-177.5	0	114.1	R322 I323 R330	R322-K326 WeakPolarHBondContact O-CG 3.48Å; R322-K326 PolarHBondContact O-N 2.85Å; R322-K326 VanDerWaalsContact O-N 3.09Å; I323-K326 PolarHBondContact O-N 3.38Å; K326-R330 VanDerWaalsContact O-CG 3.3Å; K326-R330 WeakPolarHBondContact O-CG 3.49Å
327	M	72.2	Confident	78.5	Confident	62 Å²	62	96 Å²	96	31%	0.305	48%	0.475	S	S	.	.	H	α-helix	trans	-81.5	-34	176.2	-70	-176.9	178.6	0	0	112.7	I323 K324 Q325	I323-M327 HydrophobicContact CG2-CE 3.83Å; I323-M327 WeakPolarHBondContact O-CG 3.2Å; I323-M327 PolarHBondContact O-N 3.49Å; I323-M327 VanDerWaalsContact O-N 3.12Å; K324-M327 WeakPolarHBondContact O-CB 3.41Å; K324-M327 PolarHBondContact O-N 3.24Å; Q325-M327 PolarHBondContact O-N 3.07Å; Q325-M327 VanDerWaalsContact O-N 3.09Å
328	A	75.2	Confident	78.9	Confident	76 Å²	76	96 Å²	96	63%	0.628	47%	0.474	S	S	*	.	H	α-helix	trans	-68.8	-38.1	176	0	0	0	0	0	111.6	K324 Q325 R330	K324-A328 PolarHBondContact O-N 3.2Å; Q325-A328 PolarHBondContact O-N 3.21Å; A328-R330 PolarHBondContact O-N 2.9Å
329	D	81.3	Confident	79.1	Confident	133 Å²	133	97.6 Å²	97.6	71%	0.711	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	1.8	-177.4	-63.3	-19.9	0	0	0	114.2	Q325	Q325-D329 PolarHBondContact O-N 3.32Å
330	R	80.4	Confident	79.6	Confident	66 Å²	66	98.8 Å²	98.8	25%	0.249	48%	0.482	C	S	.	.			trans	-76.4	128.4	-177.4	-67.3	-173.7	177.4	177.1	-5	112.6	K326 A328 K335	K326-R330 VanDerWaalsContact O-CG 3.3Å; K326-R330 WeakPolarHBondContact O-CG 3.49Å; A328-R330 PolarHBondContact O-N 2.9Å; R330-K335 HydrophobicContact CB-CG 4.27Å; R330-K335 WeakPolarHBondContact O-CE 3.4Å; R330-K335 PolarHBondContact O-NZ 3.01Å
331	T	84.6	Confident	80.1	Confident	76 Å²	76	98.4 Å²	98.4	47%	0.466	48%	0.48	S	S	.	.			trans	-67.8	160.5	173.7	72.2	0	0	0	0	112.6	K333 D334 K335	T331-K333 PolarHBondContact O-N 3.18Å; T331-D334 PolarHBondContact O-N 3.44Å; T331-D334 VanDerWaalsContact OG1-CG 3.22Å; T331-D334 PolarHBondContact OG1-N 2.99Å; T331-D334 PolarHBondContact OG1-OD2 2.94Å; T331-K335 WeakPolarHBondContact O-CG 3.41Å; T331-K335 PolarHBondContact O-N 3.14Å
332	T	81.4	Confident	80.5	Confident	122 Å²	122	96.3 Å²	96.3	75%	0.748	47%	0.469	S	S	*	.	H	α-helix	trans	-65.2	-35.2	179.9	46.9	0	0	0	0	113.2	K335 C336	T332-K335 WeakPolarHBondContact O-CB 3.31Å; T332-K335 PolarHBondContact O-N 3.41Å; T332-C336 PolarHBondContact O-N 3.39Å
333	K	83	Confident	80.7	Confident	175 Å²	175	94 Å²	94	76%	0.761	47%	0.47	S	S	*	.	H	α-helix	trans	-67.1	-42.7	176.4	-171	175.5	179.7	177.6	0	111.7	T331 K335 C336 R337	T331-K333 PolarHBondContact O-N 3.18Å; K333-K335 VanDerWaalsContact C-N 3.34Å; K333-C336 PolarHBondContact O-N 2.99Å; K333-R337 PolarHBondContact O-N 3.25Å
334	D	80.6	Confident	81.3	Confident	60 Å²	60	96.8 Å²	96.8	32%	0.321	48%	0.484	S	S	.	.	H	α-helix	trans	-66	-38.6	175.3	-66	-37	0	0	0	111.6	T331 R337 I338	T331-D334 PolarHBondContact O-N 3.44Å; T331-D334 VanDerWaalsContact OG1-CG 3.22Å; T331-D334 PolarHBondContact OG1-N 2.99Å; T331-D334 PolarHBondContact OG1-OD2 2.94Å; D334-R337 PolarHBondContact O-N 3.24Å; D334-I338 WeakPolarHBondContact O-CB 3.31Å; D334-I338 WeakPolarHBondContact O-CD1 3.35Å; D334-I338 WeakPolarHBondContact O-CG1 3.4Å; D334-I338 PolarHBondContact O-N 3.37Å
335	K	80.3	Confident	81.8	Confident	90 Å²	90	93.7 Å²	93.7	39%	0.391	47%	0.472	S	S	.	.	H	α-helix	trans	-58.4	-48.9	172.3	-74.9	170.8	-177.7	165.1	0	111	R330 T331 T332 K333 R337 I338 Y339	R330-K335 HydrophobicContact CB-CG 4.27Å; R330-K335 WeakPolarHBondContact O-CE 3.4Å; R330-K335 PolarHBondContact O-NZ 3.01Å; T331-K335 WeakPolarHBondContact O-CG 3.41Å; T331-K335 PolarHBondContact O-N 3.14Å; T332-K335 WeakPolarHBondContact O-CB 3.31Å; T332-K335 PolarHBondContact O-N 3.41Å; K333-K335 VanDerWaalsContact C-N 3.34Å; K335-R337 PolarHBondContact O-N 2.97Å; K335-I338 PolarHBondContact O-N 3.45Å; K335-Y339 WeakPolarHBondContact O-CD2 3.42Å; K335-Y339 PolarHBondContact O-N 3.06Å
336	C	84.8	Confident	82	Confident	88 Å²	88	90.2 Å²	90.2	60%	0.595	46%	0.457	S	S	*	.	H	α-helix	trans	-58.9	-46.9	179	-171.3	0	0	0	0	112	T332 K333 I338 Y339 L340	T332-C336 PolarHBondContact O-N 3.39Å; K333-C336 PolarHBondContact O-N 2.99Å; C336-I338 PolarHBondContact O-N 3.48Å; C336-Y339 PolarHBondContact O-N 2.86Å; C336-L340 WeakPolarHBondContact O-CB 3.41Å; C336-L340 PolarHBondContact O-N 2.88Å
337	R	85.7	Confident	82.4	Confident	170 Å²	170	90.3 Å²	90.3	64%	0.642	46%	0.461	S	S	*	.	H	α-helix	trans	-58.8	-44.8	176.7	-171.4	-178.4	73.1	-173.6	0.2	112.3	K333 D334 K335 L340 L341	K333-R337 PolarHBondContact O-N 3.25Å; D334-R337 PolarHBondContact O-N 3.24Å; K335-R337 PolarHBondContact O-N 2.97Å; R337-L340 PolarHBondContact O-N 2.9Å; R337-L341 WeakPolarHBondContact O-CB 3.48Å; R337-L341 PolarHBondContact O-N 3.09Å
338	I	82.8	Confident	83	Confident	20 Å²	20	92.8 Å²	92.8	10%	0.103	47%	0.47	C	S	.	.	H	α-helix	trans	-66.9	-41.3	179.8	-68.6	167.2	0	0	0	111	D334 K335 C336 L341 R342	D334-I338 WeakPolarHBondContact O-CB 3.31Å; D334-I338 WeakPolarHBondContact O-CD1 3.35Å; D334-I338 WeakPolarHBondContact O-CG1 3.4Å; D334-I338 PolarHBondContact O-N 3.37Å; K335-I338 PolarHBondContact O-N 3.45Å; C336-I338 PolarHBondContact O-N 3.48Å; I338-L341 PolarHBondContact O-N 2.88Å; I338-R342 HydrophobicContact CG2-CG 4.48Å; I338-R342 WeakPolarHBondContact O-CB 3.39Å; I338-R342 WeakPolarHBondContact O-CG 3.45Å; I338-R342 PolarHBondContact O-N 3.35Å
339	Y	83.4	Confident	83.3	Confident	147 Å²	147	89.3 Å²	89.3	58%	0.576	44%	0.441	S	S	*	.	H	α-helix	trans	-65.6	-42.3	176.5	-87.1	-73.1	0	0	0	112.1	K335 C336 R342 V343	K335-Y339 WeakPolarHBondContact O-CD2 3.42Å; K335-Y339 PolarHBondContact O-N 3.06Å; C336-Y339 PolarHBondContact O-N 2.86Å; Y339-R342 WeakPolarHBondContact O-CB 3.39Å; Y339-R342 PolarHBondContact O-N 3.17Å; Y339-V343 WeakPolarHBondContact O-CG2 3.25Å; Y339-V343 PolarHBondContact O-N 3.43Å
340	L	85.6	Confident	83.3	Confident	114 Å²	114	88.2 Å²	88.2	60%	0.597	43%	0.433	S	S	*	.	H	α-helix	trans	-59.7	-47.8	174.5	-169.6	90.2	0	0	0	111.2	C336 R337 R342 V343 I344	C336-L340 WeakPolarHBondContact O-CB 3.41Å; C336-L340 PolarHBondContact O-N 2.88Å; R337-L340 PolarHBondContact O-N 2.9Å; L340-R342 VanDerWaalsContact C-N 3.31Å; L340-R342 PolarHBondContact O-N 3.36Å; L340-V343 PolarHBondContact O-N 3.41Å; L340-V343 VanDerWaalsContact O-N 3.13Å; L340-I344 HydrophobicContact CD2-CD1 4.41Å; L340-I344 HydrophobicContact CG-CD1 4.33Å; L340-I344 WeakPolarHBondContact O-CG1 3.3Å; L340-I344 PolarHBondContact O-N 3.46Å
341	L	84.4	Confident	83.6	Confident	69 Å²	69	87 Å²	87	36%	0.361	44%	0.442	S	S	.	.	H	α-helix	trans	-61.1	-40.1	177.6	-177.2	133.1	0	0	0	111.7	R337 I338 I344 L345 Y410	R337-L341 WeakPolarHBondContact O-CB 3.48Å; R337-L341 PolarHBondContact O-N 3.09Å; I338-L341 PolarHBondContact O-N 2.88Å; L341-I344 PolarHBondContact O-N 3.32Å; L341-L345 HydrophobicContact CD2-CD1 3.45Å; L341-L345 VanDerWaalsContact CD2-CD1 3.45Å; L341-L345 HydrophobicContact CD2-CG 4.4Å; L341-L345 HydrophobicContact CG-CD1 4.02Å; L341-L345 WeakPolarHBondContact O-CB 3.27Å; L341-L345 VanDerWaalsContact O-CG 3.31Å; L341-L345 WeakPolarHBondContact O-CG 3.41Å; L341-L345 PolarHBondContact O-N 3.06Å; L341-Y410 WeakPolarHBondContact CD2-O 3.22Å
342	R	84.6	Confident	83.6	Confident	30 Å²	30	84.4 Å²	84.4	11%	0.113	43%	0.426	C	S	.	.	H	α-helix	trans	-63	-40.9	172.8	-74.7	168.2	-179.1	178.2	1.1	112.5	I338 Y339 L340 I344 L345 N346 E411 D412 Y413	I338-R342 HydrophobicContact CG2-CG 4.48Å; I338-R342 WeakPolarHBondContact O-CB 3.39Å; I338-R342 WeakPolarHBondContact O-CG 3.45Å; I338-R342 PolarHBondContact O-N 3.35Å; Y339-R342 WeakPolarHBondContact O-CB 3.39Å; Y339-R342 PolarHBondContact O-N 3.17Å; L340-R342 VanDerWaalsContact C-N 3.31Å; L340-R342 PolarHBondContact O-N 3.36Å; R342-I344 VanDerWaalsContact C-N 3.34Å; R342-L345 PolarHBondContact O-N 3.01Å; R342-N346 WeakPolarHBondContact O-CB 3.36Å; R342-N346 PolarHBondContact O-N 3.4Å; R342-N346 PolarHBondContact O-ND2 2.63Å; R342-N346 PolarHBondContact O-OD1 3.48Å; R342-E411 HydrophobicContact CG-CB 4.36Å; R342-E411 HydrophobicContact CG-CG 4.37Å; R342-E411 PolarHBondContact NE-O 3.2Å; R342-E411 VanDerWaalsContact NE-O 3.12Å; R342-E411 PolarHBondContact NH2-O 2.86Å; R342-E411 VanDerWaalsContact NH2-O 3.14Å; R342-D412 PolarHBondContact NH2-O 2.99Å; R342-Y413 WeakPolarHBondContact CD-OH 3.4Å; R342-Y413 VanDerWaalsContact CZ-CE1 3.42Å
343	V	83.4	Confident	83.5	Confident	88 Å²	88	78.9 Å²	78.9	53%	0.533	39%	0.391	S	S	.	.	H	α-helix	trans	-61.3	-46.2	176.2	170.2	0	0	0	0	110.3	Y339 L340 N346 M347	Y339-V343 WeakPolarHBondContact O-CG2 3.25Å; Y339-V343 PolarHBondContact O-N 3.43Å; L340-V343 PolarHBondContact O-N 3.41Å; L340-V343 VanDerWaalsContact O-N 3.13Å; V343-N346 PolarHBondContact O-N 2.73Å; V343-M347 WeakPolarHBondContact O-CB 3.33Å; V343-M347 VanDerWaalsContact O-CG 3.31Å; V343-M347 WeakPolarHBondContact O-CG 3.05Å; V343-M347 PolarHBondContact O-N 3.38Å
344	I	85.8	Confident	83.6	Confident	105 Å²	105	73.2 Å²	73.2	54%	0.538	38%	0.377	S	S	.	.	H	α-helix	trans	-62.2	-48	178.4	-65.4	167.2	0	0	0	111.1	L340 L341 R342 N346 M347 F348	L340-I344 HydrophobicContact CD2-CD1 4.41Å; L340-I344 HydrophobicContact CG-CD1 4.33Å; L340-I344 WeakPolarHBondContact O-CG1 3.3Å; L340-I344 PolarHBondContact O-N 3.46Å; L341-I344 PolarHBondContact O-N 3.32Å; R342-I344 VanDerWaalsContact C-N 3.34Å; I344-N346 PolarHBondContact O-N 2.86Å; I344-M347 PolarHBondContact O-N 3.04Å; I344-F348 PolarHBondContact O-N 2.91Å
345	L	83.5	Confident	83.9	Confident	29 Å²	29	72.9 Å²	72.9	15%	0.152	38%	0.383	C	S	.	.	H	α-helix	trans	-66.2	-38	179.5	-70.1	174.9	0	0	0	112.1	L341 R342 F348 V349 I407 E411	L341-L345 HydrophobicContact CD2-CD1 3.45Å; L341-L345 VanDerWaalsContact CD2-CD1 3.45Å; L341-L345 HydrophobicContact CD2-CG 4.4Å; L341-L345 HydrophobicContact CG-CD1 4.02Å; L341-L345 WeakPolarHBondContact O-CB 3.27Å; L341-L345 VanDerWaalsContact O-CG 3.31Å; L341-L345 WeakPolarHBondContact O-CG 3.41Å; L341-L345 PolarHBondContact O-N 3.06Å; R342-L345 PolarHBondContact O-N 3.01Å; L345-F348 PolarHBondContact O-N 3.49Å; L345-V349 VanDerWaalsContact O-CG2 3.29Å; L345-V349 WeakPolarHBondContact O-CG2 3.2Å; L345-V349 PolarHBondContact O-N 3.42Å; L345-I407 HydrophobicContact CB-CG2 3.99Å; L345-I407 HydrophobicContact CD1-CG2 4.28Å; L345-I407 HydrophobicContact CD2-CG2 4.16Å; L345-I407 HydrophobicContact CG-CG2 4.37Å; L345-E411 HydrophobicContact CB-CG 4.19Å; L345-E411 WeakPolarHBondContact CB-OE1 3.37Å; L345-E411 HydrophobicContact CD1-CG 3.47Å; L345-E411 VanDerWaalsContact CD1-CG 3.47Å; L345-E411 HydrophobicContact CG-CG 4.48Å
346	N	81.9	Confident	84	Confident	47 Å²	47	69.5 Å²	69.5	25%	0.251	37%	0.37	S	S	.	.	H	α-helix	trans	-64.5	-39.2	173.8	-67.7	-14.3	0	0	0	111.8	R342 V343 I344 V349 M350 E411 R425	R342-N346 WeakPolarHBondContact O-CB 3.36Å; R342-N346 PolarHBondContact O-N 3.4Å; R342-N346 PolarHBondContact O-ND2 2.63Å; R342-N346 PolarHBondContact O-OD1 3.48Å; V343-N346 PolarHBondContact O-N 2.73Å; I344-N346 PolarHBondContact O-N 2.86Å; N346-V349 PolarHBondContact O-N 3.19Å; N346-M350 WeakPolarHBondContact O-CG 3.2Å; N346-M350 PolarHBondContact O-N 3.45Å; N346-E411 PolarHBondContact OD1-OE1 3.46Å; N346-R425 PolarHBondContact OD1-NH2 3.02Å
347	M	84.9	Confident	83.9	Confident	130 Å²	130	67 Å²	67	64%	0.64	35%	0.35	S	S	*	.	H	α-helix	trans	-64.8	-41.9	174	-76	-59.2	-63.3	0	0	111.6	V343 I344 V349 M350 G351	V343-M347 WeakPolarHBondContact O-CB 3.33Å; V343-M347 VanDerWaalsContact O-CG 3.31Å; V343-M347 WeakPolarHBondContact O-CG 3.05Å; V343-M347 PolarHBondContact O-N 3.38Å; I344-M347 PolarHBondContact O-N 3.04Å; M347-V349 VanDerWaalsContact C-N 3.35Å; M347-V349 PolarHBondContact O-N 3.06Å; M347-M350 PolarHBondContact O-N 3.5Å; M347-G351 PolarHBondContact O-N 3.27Å
348	F	85.8	Confident	83.9	Confident	114 Å²	114	66.6 Å²	66.6	50%	0.5	35%	0.349	S	S	.	.	H	α-helix	trans	-60.9	-43.5	173.5	-179.8	-101.6	0	0	0	111.8	I344 L345 M350 G351 V352 I407	I344-F348 PolarHBondContact O-N 2.91Å; L345-F348 PolarHBondContact O-N 3.49Å; F348-M350 VanDerWaalsContact C-N 3.33Å; F348-M350 PolarHBondContact O-N 3.49Å; F348-G351 PolarHBondContact O-N 3.15Å; F348-G351 VanDerWaalsContact O-N 3.12Å; F348-V352 HydrophobicContact CD1-CG2 4.16Å; F348-V352 HydrophobicContact CE1-CG2 3.7Å; F348-V352 HydrophobicContact CE2-CG2 4.34Å; F348-V352 HydrophobicContact CZ-CG2 3.8Å; F348-V352 WeakPolarHBondContact O-CG2 3.22Å; F348-V352 PolarHBondContact O-N 2.86Å; F348-I407 HydrophobicContact CD1-CD1 3.74Å; F348-I407 HydrophobicContact CD1-CG1 4.46Å; F348-I407 HydrophobicContact CE1-CD1 3.88Å
349	V	80.2	Confident	83.9	Confident	3 Å²	3	68.6 Å²	68.6	2%	0.018	37%	0.365	C	S	.	.	H	α-helix	trans	-58.1	-44.7	174.7	165.9	0	0	0	0	111.3	L345 N346 M347 G351 V352 L353 F404 I407	L345-V349 VanDerWaalsContact O-CG2 3.29Å; L345-V349 WeakPolarHBondContact O-CG2 3.2Å; L345-V349 PolarHBondContact O-N 3.42Å; N346-V349 PolarHBondContact O-N 3.19Å; M347-V349 VanDerWaalsContact C-N 3.35Å; M347-V349 PolarHBondContact O-N 3.06Å; V349-G351 VanDerWaalsContact C-N 3.31Å; V349-G351 PolarHBondContact O-N 2.98Å; V349-V352 PolarHBondContact O-N 3.47Å; V349-L353 HydrophobicContact CG1-CD1 4.05Å; V349-L353 HydrophobicContact CG1-CG 4.47Å; V349-L353 VanDerWaalsContact O-CG 3.27Å; V349-L353 WeakPolarHBondContact O-CG 3.43Å; V349-L353 PolarHBondContact O-N 3.2Å; V349-F404 HydrophobicContact CB-CE1 4.15Å; V349-F404 HydrophobicContact CG1-CD1 4.44Å; V349-F404 HydrophobicContact CG1-CE1 3.55Å; V349-F404 HydrophobicContact CG1-CZ 3.79Å; V349-F404 HydrophobicContact CG2-CD1 4.01Å; V349-F404 HydrophobicContact CG2-CE1 3.8Å; V349-I407 HydrophobicContact CG2-CD1 3.85Å; V349-I407 HydrophobicContact CG2-CG2 4.29Å
350	M	82.8	Confident	83.9	Confident	109 Å²	109	61.6 Å²	61.6	54%	0.537	34%	0.337	S	S	.	.	H	α-helix	trans	-62	-38.5	175.6	-71.6	-57.9	-61.9	0	0	112.3	N346 M347 F348 L353 A354	N346-M350 WeakPolarHBondContact O-CG 3.2Å; N346-M350 PolarHBondContact O-N 3.45Å; M347-M350 PolarHBondContact O-N 3.5Å; F348-M350 VanDerWaalsContact C-N 3.33Å; F348-M350 PolarHBondContact O-N 3.49Å; M350-L353 PolarHBondContact O-N 2.99Å; M350-L353 HydrophobicContact SD-CD1 4.23Å; M350-A354 WeakPolarHBondContact O-CB 3.46Å; M350-A354 PolarHBondContact O-N 2.88Å
351	G	86.8	Confident	83.8	Confident	42 Å²	42	61.5 Å²	61.5	43%	0.433	33%	0.33	S	S	.	.	H	α-helix	trans	-62.9	-45.9	174.2	0	0	0	0	0	113.2	M347 F348 V349 L353 A354 A355	M347-G351 PolarHBondContact O-N 3.27Å; F348-G351 PolarHBondContact O-N 3.15Å; F348-G351 VanDerWaalsContact O-N 3.12Å; V349-G351 VanDerWaalsContact C-N 3.31Å; V349-G351 PolarHBondContact O-N 2.98Å; G351-L353 VanDerWaalsContact C-N 3.31Å; G351-L353 PolarHBondContact O-N 3.05Å; G351-A354 PolarHBondContact O-N 3.1Å; G351-A355 WeakPolarHBondContact O-CB 3.44Å; G351-A355 PolarHBondContact O-N 3.1Å
352	V	83.4	Confident	83.8	Confident	21 Å²	21	61 Å²	61	13%	0.127	33%	0.329	C	S	.	.	H	α-helix	trans	-61	-42.3	175.5	173.3	0	0	0	0	110.8	F348 V349 A355 C356 L403	F348-V352 HydrophobicContact CD1-CG2 4.16Å; F348-V352 HydrophobicContact CE1-CG2 3.7Å; F348-V352 HydrophobicContact CE2-CG2 4.34Å; F348-V352 HydrophobicContact CZ-CG2 3.8Å; F348-V352 WeakPolarHBondContact O-CG2 3.22Å; F348-V352 PolarHBondContact O-N 2.86Å; V349-V352 PolarHBondContact O-N 3.47Å; V352-A355 PolarHBondContact O-N 3.28Å; V352-C356 PolarHBondContact O-N 3.31Å; V352-C356 PolarHBondContact O-SG 3.42Å; V352-L403 HydrophobicContact CG1-CD1 4.07Å
353	L	80.6	Confident	83.8	Confident	5 Å²	5	60 Å²	60	3%	0.026	33%	0.328	C	S	.	.	H	α-helix	trans	-62.1	-47.7	176.3	-70.6	173.5	0	0	0	111.5	V349 M350 G351 A355 C356 F357 T400 F404 F428 M429	V349-L353 HydrophobicContact CG1-CD1 4.05Å; V349-L353 HydrophobicContact CG1-CG 4.47Å; V349-L353 VanDerWaalsContact O-CG 3.27Å; V349-L353 WeakPolarHBondContact O-CG 3.43Å; V349-L353 PolarHBondContact O-N 3.2Å; M350-L353 PolarHBondContact O-N 2.99Å; M350-L353 HydrophobicContact SD-CD1 4.23Å; G351-L353 VanDerWaalsContact C-N 3.31Å; G351-L353 PolarHBondContact O-N 3.05Å; L353-A355 VanDerWaalsContact C-N 3.32Å; L353-A355 PolarHBondContact O-N 3.19Å; L353-C356 PolarHBondContact O-N 3.18Å; L353-F357 HydrophobicContact CB-CE2 3.9Å; L353-F357 WeakPolarHBondContact O-CD2 3.21Å; L353-F357 WeakPolarHBondContact O-CE2 3.47Å; L353-F357 WeakPolarHBondContact O-CG 3.44Å; L353-F357 PolarHBondContact O-N 2.85Å; L353-T400 HydrophobicContact CD2-CG2 4.48Å; L353-F404 HydrophobicContact CD2-CZ 4.15Å; L353-F404 HydrophobicContact CG-CZ 4.4Å; L353-F428 HydrophobicContact CD1-CD1 4.41Å; L353-M429 HydrophobicContact CD2-CB 3.54Å; L353-M429 HydrophobicContact CD2-CG 3.53Å
354	A	84.1	Confident	83.4	Confident	57 Å²	57	55.9 Å²	55.9	47%	0.471	30%	0.302	S	S	.	.	H	α-helix	trans	-59	-42.2	176.6	0	0	0	0	0	112.4	M350 G351 F357 Y358	M350-A354 WeakPolarHBondContact O-CB 3.46Å; M350-A354 PolarHBondContact O-N 2.88Å; G351-A354 PolarHBondContact O-N 3.1Å; A354-F357 PolarHBondContact O-N 3.49Å; A354-Y358 PolarHBondContact O-N 2.69Å
355	A	87	Confident	83	Confident	53 Å²	53	52.3 Å²	52.3	44%	0.438	29%	0.286	S	S	.	.	H	α-helix	trans	-61.7	-46.2	175.2	0	0	0	0	0	111.7	G351 V352 L353 F357 Y358 S359	G351-A355 WeakPolarHBondContact O-CB 3.44Å; G351-A355 PolarHBondContact O-N 3.1Å; V352-A355 PolarHBondContact O-N 3.28Å; L353-A355 VanDerWaalsContact C-N 3.32Å; L353-A355 PolarHBondContact O-N 3.19Å; A355-F357 VanDerWaalsContact C-N 3.32Å; A355-F357 PolarHBondContact O-N 2.93Å; A355-Y358 PolarHBondContact O-N 3.06Å; A355-S359 WeakPolarHBondContact O-CB 3.32Å; A355-S359 PolarHBondContact O-N 3.05Å; A355-S359 PolarHBondContact O-OG 3.09Å
356	C	82.3	Confident	82.9	Confident	18 Å²	18	55.6 Å²	55.6	12%	0.122	30%	0.299	C	S	.	.	H	α-helix	trans	-59.2	-41.8	174.8	-68.9	0	0	0	0	112.1	V352 L353 S359 I360 A396	V352-C356 PolarHBondContact O-N 3.31Å; V352-C356 PolarHBondContact O-SG 3.42Å; L353-C356 PolarHBondContact O-N 3.18Å; C356-S359 PolarHBondContact O-N 3.5Å; C356-I360 WeakPolarHBondContact O-CD1 3.27Å; C356-I360 WeakPolarHBondContact O-CG1 3.44Å; C356-I360 PolarHBondContact O-N 2.92Å; C356-A396 HydrophobicContact CB-CB 4.38Å
357	F	82	Confident	82.6	Confident	37 Å²	37	53.7 Å²	53.7	16%	0.162	29%	0.29	C	S	.	.	H	α-helix	trans	-63.2	-45.6	176.7	-65.8	-47.4	0	0	0	112.6	L353 A354 A355 S359 I360 Y361 F428 T432 V436	L353-F357 HydrophobicContact CB-CE2 3.9Å; L353-F357 WeakPolarHBondContact O-CD2 3.21Å; L353-F357 WeakPolarHBondContact O-CE2 3.47Å; L353-F357 WeakPolarHBondContact O-CG 3.44Å; L353-F357 PolarHBondContact O-N 2.85Å; A354-F357 PolarHBondContact O-N 3.49Å; A355-F357 VanDerWaalsContact C-N 3.32Å; A355-F357 PolarHBondContact O-N 2.93Å; F357-S359 PolarHBondContact O-N 2.89Å; F357-I360 PolarHBondContact O-N 3.21Å; F357-Y361 WeakPolarHBondContact O-CB 3.2Å; F357-Y361 PolarHBondContact O-N 2.99Å; F357-F428 HydrophobicContact CE2-CE1 4.44Å; F357-F428 HydrophobicContact CZ-CE1 4.47Å; F357-T432 HydrophobicContact CD1-CG2 3.43Å; F357-T432 VanDerWaalsContact CD1-CG2 3.43Å; F357-T432 HydrophobicContact CD2-CG2 4.18Å; F357-T432 HydrophobicContact CE1-CG2 3.02Å; F357-T432 HydrophobicContact CE2-CG2 3.79Å; F357-T432 HydrophobicContact CG-CG2 4.05Å; F357-T432 HydrophobicContact CZ-CG2 3.22Å; F357-V436 HydrophobicContact CD1-CG2 4.18Å
358	Y	85.6	Confident	81.7	Confident	161 Å²	161	48.5 Å²	48.5	63%	0.631	26%	0.264	S	S	*	.	H	α-helix	trans	-61.8	-43.8	176.8	-176.4	-104.1	0	0	0	111.7	A354 A355 I360 Y361 V362	A354-Y358 PolarHBondContact O-N 2.69Å; A355-Y358 PolarHBondContact O-N 3.06Å; Y358-I360 PolarHBondContact O-N 2.79Å; Y358-Y361 PolarHBondContact O-N 3.41Å; Y358-V362 HydrophobicContact CD1-CG2 4.27Å; Y358-V362 HydrophobicContact CD2-CG2 4.46Å; Y358-V362 HydrophobicContact CE1-CG2 3.86Å; Y358-V362 HydrophobicContact CE2-CG2 4.07Å; Y358-V362 WeakPolarHBondContact O-CG2 3.39Å; Y358-V362 PolarHBondContact O-N 3.48Å
359	S	84.3	Confident	81	Confident	61 Å²	61	47.8 Å²	47.8	43%	0.427	27%	0.265	S	S	.	.	H	α-helix	trans	-61.2	-41.5	176	-60.9	0	0	0	0	112.7	A355 C356 F357 A363	A355-S359 WeakPolarHBondContact O-CB 3.32Å; A355-S359 PolarHBondContact O-N 3.05Å; A355-S359 PolarHBondContact O-OG 3.09Å; C356-S359 PolarHBondContact O-N 3.5Å; F357-S359 PolarHBondContact O-N 2.89Å; S359-A363 WeakPolarHBondContact O-CB 3.24Å; S359-A363 PolarHBondContact O-N 2.96Å
360	I	83.3	Confident	80.5	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.8	-44.1	177.3	-67.5	162.2	0	0	0	110.5	C356 F357 Y358 A363 T364 V392 I393 V436	C356-I360 WeakPolarHBondContact O-CD1 3.27Å; C356-I360 WeakPolarHBondContact O-CG1 3.44Å; C356-I360 PolarHBondContact O-N 2.92Å; F357-I360 PolarHBondContact O-N 3.21Å; Y358-I360 PolarHBondContact O-N 2.79Å; I360-A363 PolarHBondContact O-N 2.83Å; I360-T364 WeakPolarHBondContact O-CB 3.14Å; I360-T364 PolarHBondContact O-N 3.22Å; I360-T364 PolarHBondContact O-OG1 2.98Å; I360-V392 HydrophobicContact CG1-CG1 3.96Å; I360-I393 HydrophobicContact CD1-CG1 3.98Å; I360-I393 HydrophobicContact CG1-CG1 3.9Å; I360-I393 HydrophobicContact CG2-CD1 4.19Å; I360-I393 HydrophobicContact CG2-CG1 3.94Å; I360-V436 HydrophobicContact CG2-CG1 4.07Å
361	Y	83.1	Confident	79.4	Confident	112 Å²	112	48.2 Å²	48.2	44%	0.439	27%	0.268	S	S	.	.	H	α-helix	trans	-59.9	-50.1	177.7	175.2	-101.9	0	0	0	111.7	F357 Y358 A363 T364 T365	F357-Y361 WeakPolarHBondContact O-CB 3.2Å; F357-Y361 PolarHBondContact O-N 2.99Å; Y358-Y361 PolarHBondContact O-N 3.41Å; Y361-A363 PolarHBondContact O-N 3.48Å; Y361-T364 PolarHBondContact O-N 3.04Å; Y361-T365 HydrophobicContact CD2-CG2 4.4Å; Y361-T365 HydrophobicContact CE1-CG2 4.29Å; Y361-T365 HydrophobicContact CE2-CG2 3.99Å; Y361-T365 WeakPolarHBondContact O-CG2 3.47Å; Y361-T365 PolarHBondContact O-N 2.92Å; Y361-T365 PolarHBondContact O-OG1 3.41Å
362	V	84.4	Confident	78	Confident	59 Å²	59	49.5 Å²	49.5	36%	0.358	27%	0.265	S	S	.	.	H	α-helix	trans	-62.8	-41.9	177.7	173.2	0	0	0	0	111.4	Y358 T364 T365 F366	Y358-V362 HydrophobicContact CD1-CG2 4.27Å; Y358-V362 HydrophobicContact CD2-CG2 4.46Å; Y358-V362 HydrophobicContact CE1-CG2 3.86Å; Y358-V362 HydrophobicContact CE2-CG2 4.07Å; Y358-V362 WeakPolarHBondContact O-CG2 3.39Å; Y358-V362 PolarHBondContact O-N 3.48Å; V362-T364 VanDerWaalsContact C-N 3.31Å; V362-T364 PolarHBondContact O-N 2.9Å; V362-T365 PolarHBondContact O-OG1 3.36Å; V362-T365 VanDerWaalsContact O-OG1 3.13Å; V362-F366 WeakPolarHBondContact O-CB 3.37Å; V362-F366 PolarHBondContact O-N 2.98Å
363	A	83.9	Confident	76.8	Confident	9 Å²	9	58 Å²	58	7%	0.074	30%	0.295	C	S	.	.	H	α-helix	trans	-63.9	-37.5	177.3	0	0	0	0	0	112.3	S359 I360 Y361 S367 L388 V392	S359-A363 WeakPolarHBondContact O-CB 3.24Å; S359-A363 PolarHBondContact O-N 2.96Å; I360-A363 PolarHBondContact O-N 2.83Å; Y361-A363 PolarHBondContact O-N 3.48Å; A363-S367 WeakPolarHBondContact O-CB 3.4Å; A363-S367 PolarHBondContact O-N 3.17Å; A363-L388 HydrophobicContact CB-CD2 4.25Å; A363-L388 HydrophobicContact CB-CG 4.23Å; A363-V392 HydrophobicContact CB-CB 4.12Å; A363-V392 HydrophobicContact CB-CG1 4.32Å; A363-V392 HydrophobicContact CB-CG2 3.78Å
364	T	76.7	Confident	75.4	Confident	1 Å²	1	66 Å²	66	1%	0.006	33%	0.33	C	S	.	.	H	α-helix	trans	-68.8	-50	178.9	-52.2	0	0	0	0	111.1	I360 Y361 V362 F366 S367 Q368 L437 S440	I360-T364 WeakPolarHBondContact O-CB 3.14Å; I360-T364 PolarHBondContact O-N 3.22Å; I360-T364 PolarHBondContact O-OG1 2.98Å; Y361-T364 PolarHBondContact O-N 3.04Å; V362-T364 VanDerWaalsContact C-N 3.31Å; V362-T364 PolarHBondContact O-N 2.9Å; T364-F366 VanDerWaalsContact C-N 3.32Å; T364-F366 PolarHBondContact O-N 2.96Å; T364-S367 PolarHBondContact O-N 3.35Å; T364-Q368 WeakPolarHBondContact O-CG 3.42Å; T364-Q368 PolarHBondContact O-N 3.06Å; T364-Q368 VanDerWaalsContact O-N 3.14Å; T364-Q368 PolarHBondContact O-OE1 3.5Å; T364-L437 HydrophobicContact CG2-CD1 4.14Å; T364-S440 WeakPolarHBondContact CG2-OG 3.47Å
365	T	76.2	Confident	74.1	Confident	30 Å²	30	69.9 Å²	69.9	18%	0.184	34%	0.343	C	S	.	.	H	α-helix	trans	-64.7	-37.9	178.2	55.6	0	0	0	0	111.8	Y361 V362 N369	Y361-T365 HydrophobicContact CD2-CG2 4.4Å; Y361-T365 HydrophobicContact CE1-CG2 4.29Å; Y361-T365 HydrophobicContact CE2-CG2 3.99Å; Y361-T365 WeakPolarHBondContact O-CG2 3.47Å; Y361-T365 PolarHBondContact O-N 2.92Å; Y361-T365 PolarHBondContact O-OG1 3.41Å; V362-T365 PolarHBondContact O-OG1 3.36Å; V362-T365 VanDerWaalsContact O-OG1 3.13Å; T365-N369 WeakPolarHBondContact O-CB 3.33Å; T365-N369 PolarHBondContact O-N 3.38Å; T365-N369 PolarHBondContact O-ND2 3.43Å
366	F	81.3	Confident	72.6	Confident	98 Å²	98	75.9 Å²	75.9	43%	0.43	36%	0.359	S	S	.	.	H	α-helix	trans	-66.7	-47.3	176.1	-176.1	-95.5	0	0	0	112.7	V362 T364 Q368 N369 V370 Y385 L388	V362-F366 WeakPolarHBondContact O-CB 3.37Å; V362-F366 PolarHBondContact O-N 2.98Å; T364-F366 VanDerWaalsContact C-N 3.32Å; T364-F366 PolarHBondContact O-N 2.96Å; F366-Q368 VanDerWaalsContact C-N 3.28Å; F366-Q368 PolarHBondContact O-N 3.19Å; F366-N369 PolarHBondContact O-N 3.27Å; F366-V370 HydrophobicContact CD1-CG2 4.23Å; F366-V370 HydrophobicContact CE1-CG2 3.81Å; F366-V370 HydrophobicContact CE2-CG2 4.18Å; F366-V370 HydrophobicContact CZ-CG2 3.78Å; F366-V370 WeakPolarHBondContact O-CG2 3.5Å; F366-V370 PolarHBondContact O-N 3.01Å; F366-Y385 AromaticContact CE1-CD1 3.93Å; F366-Y385 HydrophobicContact CE1-CD1 3.93Å; F366-Y385 AromaticContact CE1-CE1 3.74Å; F366-Y385 HydrophobicContact CE1-CE1 3.74Å; F366-Y385 HydrophobicContact CZ-CE1 4.38Å; F366-L388 HydrophobicContact CD1-CD2 3.7Å; F366-L388 HydrophobicContact CE1-CD2 4.41Å
367	S	75.5	Confident	71.6	Confident	8 Å²	8	80.2 Å²	80.2	6%	0.056	38%	0.384	C	S	.	.	H	α-helix	trans	-54	-46.1	176.8	176.5	0	0	0	0	111.4	A363 T364 V370 E371 Y385	A363-S367 WeakPolarHBondContact O-CB 3.4Å; A363-S367 PolarHBondContact O-N 3.17Å; T364-S367 PolarHBondContact O-N 3.35Å; S367-V370 PolarHBondContact O-N 3.17Å; S367-E371 PolarHBondContact O-N 3.47Å; S367-E371 VanDerWaalsContact O-N 3.07Å; S367-Y385 WeakPolarHBondContact CB-O 3.3Å; S367-Y385 PolarHBondContact OG-O 2.97Å
368	Q	66.9	Low	70.9	Confident	21 Å²	21	83.2 Å²	83.2	10%	0.098	40%	0.402	C	S	.	.	H	α-helix	trans	-71.5	-38.7	-179.3	-69.4	167.7	-20.7	0	0	113	T364 F366 V370 E371 N372 L441	T364-Q368 WeakPolarHBondContact O-CG 3.42Å; T364-Q368 PolarHBondContact O-N 3.06Å; T364-Q368 VanDerWaalsContact O-N 3.14Å; T364-Q368 PolarHBondContact O-OE1 3.5Å; F366-Q368 VanDerWaalsContact C-N 3.28Å; F366-Q368 PolarHBondContact O-N 3.19Å; Q368-V370 VanDerWaalsContact C-N 3.28Å; Q368-V370 PolarHBondContact O-N 3.3Å; Q368-E371 PolarHBondContact O-N 3.15Å; Q368-N372 PolarHBondContact O-N 3.19Å; Q368-N372 VanDerWaalsContact O-N 3.16Å; Q368-N372 PolarHBondContact O-ND2 3.22Å; Q368-L441 VanDerWaalsContact NE2-CD2 3.27Å
369	N	70.6	Confident	69.8	Low	99 Å²	99	81.3 Å²	81.3	53%	0.529	40%	0.397	S	S	.	.	H	α-helix	trans	-63.4	-34.4	175.7	-77.6	-22.5	0	0	0	112.7	T365 F366	T365-N369 WeakPolarHBondContact O-CB 3.33Å; T365-N369 PolarHBondContact O-N 3.38Å; T365-N369 PolarHBondContact O-ND2 3.43Å; F366-N369 PolarHBondContact O-N 3.27Å
370	V	68.9	Low	69.1	Low	43 Å²	43	83.9 Å²	83.9	26%	0.261	41%	0.405	S	S	.	.	H	α-helix	trans	-75.4	-39.5	177.2	175.5	0	0	0	0	111.2	F366 S367 Q368 N372 R373 Y385	F366-V370 HydrophobicContact CD1-CG2 4.23Å; F366-V370 HydrophobicContact CE1-CG2 3.81Å; F366-V370 HydrophobicContact CE2-CG2 4.18Å; F366-V370 HydrophobicContact CZ-CG2 3.78Å; F366-V370 WeakPolarHBondContact O-CG2 3.5Å; F366-V370 PolarHBondContact O-N 3.01Å; S367-V370 PolarHBondContact O-N 3.17Å; Q368-V370 VanDerWaalsContact C-N 3.28Å; Q368-V370 PolarHBondContact O-N 3.3Å; V370-N372 PolarHBondContact O-N 3.03Å; V370-R373 PolarHBondContact O-N 3.14Å; V370-Y385 HydrophobicContact CG1-CD2 3.61Å; V370-Y385 HydrophobicContact CG1-CE2 4.06Å; V370-Y385 HydrophobicContact CG1-CG 4.02Å
371	E	60.7	Low	68.6	Low	78 Å²	78	86.2 Å²	86.2	36%	0.364	42%	0.419	S	S	.	.	H	α-helix	trans	-57.1	-35.1	173.7	-170.9	171.4	-175.3	0	0	112.2	S367 Q368 R373 H462 R470	S367-E371 PolarHBondContact O-N 3.47Å; S367-E371 VanDerWaalsContact O-N 3.07Å; Q368-E371 PolarHBondContact O-N 3.15Å; E371-R373 VanDerWaalsContact C-N 3.28Å; E371-R373 PolarHBondContact O-N 2.84Å; E371-H462 IonicContact OE1-NE2 2.7Å; E371-R470 VanDerWaalsContact CD-NH2 3.31Å; E371-R470 IonicContact OE1-CZ 2.68Å; E371-R470 IonicContact OE1-NH1 3.78Å; E371-R470 PolarHBondContact OE1-NH1 3.15Å; E371-R470 IonicContact OE1-NH2 3.44Å; E371-R470 PolarHBondContact OE1-NH2 2.9Å; E371-R470 IonicContact OE2-CZ 2.58Å; E371-R470 IonicContact OE2-NH1 3.98Å; E371-R470 IonicContact OE2-NH2 3.78Å; E371-R470 PolarHBondContact OE2-NH2 3.47Å
372	N	58	Low	68	Low	69 Å²	69	83.5 Å²	83.5	37%	0.369	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-18.8	176.1	-73.2	-26.2	0	0	0	114	Q368 V370	Q368-N372 PolarHBondContact O-N 3.19Å; Q368-N372 VanDerWaalsContact O-N 3.16Å; Q368-N372 PolarHBondContact O-ND2 3.22Å; V370-N372 PolarHBondContact O-N 3.03Å
373	R	58	Low	67.3	Low	200 Å²	200	83.3 Å²	83.3	76%	0.755	41%	0.409	S	S	*	.	S	Bend	trans	-96.1	105.2	178.1	-67.8	-129	-86.9	-162.6	-6.5	110.4	V370 E371 N375	V370-R373 PolarHBondContact O-N 3.14Å; E371-R373 VanDerWaalsContact C-N 3.28Å; E371-R373 PolarHBondContact O-N 2.84Å; R373-N375 PolarHBondContact O-N 2.75Å
374	K	51.7	Low	67	Low	172 Å²	172	86.7 Å²	86.7	75%	0.748	43%	0.425	S	S	*	.			trans	-58.5	5	-178	-78.3	-179.2	175.5	174.1	0	117.6	K376	K374-K376 PolarHBondContact O-N 2.92Å
375	N	55.9	Low	67	Low	139 Å²	139	90.6 Å²	90.6	74%	0.743	44%	0.44	S	S	*	.			trans	-82.3	85.7	-178.6	-72.6	-1.8	0	0	0	109.8	R373 V377	R373-N375 PolarHBondContact O-N 2.75Å; N375-V377 WeakPolarHBondContact O-CG2 3.37Å; N375-V377 PolarHBondContact O-N 3.15Å
376	K	55	Low	66.7	Low	179 Å²	179	91.3 Å²	91.3	78%	0.778	44%	0.441	S	S	*	.			trans	-66.7	115	170.3	-67.8	-171.5	174.7	-168.8	0	109	K374	K374-K376 PolarHBondContact O-N 2.92Å
377	V	61.7	Low	66.5	Low	109 Å²	109	87.6 Å²	87.6	66%	0.661	43%	0.425	S	S	*	.			trans	-100.2	-57	-179.6	-164.2	0	0	0	0	110.3	N375	N375-V377 WeakPolarHBondContact O-CG2 3.37Å; N375-V377 PolarHBondContact O-N 3.15Å
378	N	67.6	Low	66.7	Low	100 Å²	100	89 Å²	89	54%	0.535	43%	0.431	S	S	.	.			trans	-147.4	137	-175.2	-71.7	-42.9	0	0	0	111.9	I380 V381 D382	N378-I380 PolarHBondContact O-N 3.12Å; N378-V381 HydrophobicContact CB-CB 4.13Å; N378-V381 HydrophobicContact CB-CG2 3.93Å; N378-V381 PolarHBondContact O-N 2.89Å; N378-V381 VanDerWaalsContact O-N 3.07Å; N378-D382 PolarHBondContact O-N 3.28Å
379	F	63.1	Low	67.3	Low	120 Å²	120	88.4 Å²	88.4	53%	0.526	43%	0.429	S	S	.	.	H	α-helix	trans	-52.1	-46.7	-177.8	170.9	-100.7	0	0	0	114.7	V211 V381 L383	V211-F379 HydrophobicContact CG2-CE2 3.68Å; V211-F379 HydrophobicContact CG2-CZ 3.7Å; F379-V381 VanDerWaalsContact C-N 3.31Å; F379-V381 PolarHBondContact O-N 3.46Å; F379-L383 PolarHBondContact O-N 3.14Å
380	I	69.1	Low	67.6	Low	115 Å²	115	83.9 Å²	83.9	59%	0.59	41%	0.405	S	S	*	.	H	α-helix	trans	-67.1	-37	-178.6	-65.6	173.1	0	0	0	110.9	N378 L383 I384	N378-I380 PolarHBondContact O-N 3.12Å; I380-L383 PolarHBondContact O-N 3.4Å; I380-I384 HydrophobicContact CG2-CD1 3.8Å; I380-I384 HydrophobicContact CG2-CG1 4.47Å; I380-I384 WeakPolarHBondContact O-CD1 3.41Å; I380-I384 VanDerWaalsContact O-CG1 3.23Å; I380-I384 WeakPolarHBondContact O-CG1 3.32Å; I380-I384 PolarHBondContact O-N 3.05Å
381	V	72.4	Confident	68.2	Low	49 Å²	49	84.4 Å²	84.4	30%	0.297	41%	0.406	S	S	.	.	H	α-helix	trans	-72	-41.4	-176.7	175.5	0	0	0	0	110.3	N378 F379 L383 I384 Y385	N378-V381 HydrophobicContact CB-CB 4.13Å; N378-V381 HydrophobicContact CB-CG2 3.93Å; N378-V381 PolarHBondContact O-N 2.89Å; N378-V381 VanDerWaalsContact O-N 3.07Å; F379-V381 VanDerWaalsContact C-N 3.31Å; F379-V381 PolarHBondContact O-N 3.46Å; V381-L383 VanDerWaalsContact C-N 3.34Å; V381-L383 PolarHBondContact O-N 3.27Å; V381-I384 PolarHBondContact O-N 3.29Å; V381-Y385 HydrophobicContact CG1-CD2 3.78Å; V381-Y385 HydrophobicContact CG1-CE2 3.18Å; V381-Y385 WeakPolarHBondContact O-CD2 3.39Å; V381-Y385 PolarHBondContact O-N 3.44Å
382	D	69.6	Low	69.4	Low	56 Å²	56	82.4 Å²	82.4	30%	0.299	40%	0.399	S	S	.	.	H	α-helix	trans	-62.3	-41.5	175.1	-69.1	-5.9	0	0	0	111.4	N378 Y385 E386	N378-D382 PolarHBondContact O-N 3.28Å; D382-Y385 PolarHBondContact O-N 2.89Å; D382-E386 PolarHBondContact O-N 2.91Å
383	L	70	Confident	70.4	Confident	54 Å²	54	79.2 Å²	79.2	28%	0.283	38%	0.382	S	S	.	.	H	α-helix	trans	-65.6	-39.7	175.8	-166.1	73.7	0	0	0	112	V211 F379 I380 V381 Y385 E386 Y387	V211-L383 HydrophobicContact CG1-CD1 4.06Å; V211-L383 HydrophobicContact CG2-CD1 4.31Å; F379-L383 PolarHBondContact O-N 3.14Å; I380-L383 PolarHBondContact O-N 3.4Å; V381-L383 VanDerWaalsContact C-N 3.34Å; V381-L383 PolarHBondContact O-N 3.27Å; L383-Y385 VanDerWaalsContact C-N 3.32Å; L383-Y385 PolarHBondContact O-N 3.46Å; L383-E386 PolarHBondContact O-N 2.99Å; L383-Y387 HydrophobicContact CD1-CD2 3.97Å; L383-Y387 HydrophobicContact CD1-CE2 3.7Å; L383-Y387 HydrophobicContact CG-CD2 4.14Å; L383-Y387 HydrophobicContact CG-CE2 4.33Å; L383-Y387 WeakPolarHBondContact O-CD2 3.25Å; L383-Y387 PolarHBondContact O-N 3.42Å
384	I	77.2	Confident	71.3	Confident	81 Å²	81	70.6 Å²	70.6	42%	0.415	35%	0.352	S	S	.	.	H	α-helix	trans	-63.1	-41.1	175.8	-72.3	166.3	0	0	0	110.6	I380 V381 Y387 L388	I380-I384 HydrophobicContact CG2-CD1 3.8Å; I380-I384 HydrophobicContact CG2-CG1 4.47Å; I380-I384 WeakPolarHBondContact O-CD1 3.41Å; I380-I384 VanDerWaalsContact O-CG1 3.23Å; I380-I384 WeakPolarHBondContact O-CG1 3.32Å; I380-I384 PolarHBondContact O-N 3.05Å; V381-I384 PolarHBondContact O-N 3.29Å; I384-Y387 PolarHBondContact O-N 2.68Å; I384-L388 WeakPolarHBondContact O-CA 3.05Å; I384-L388 WeakPolarHBondContact O-CB 3.32Å; I384-L388 PolarHBondContact O-N 3.21Å
385	Y	76.8	Confident	72.7	Confident	82 Å²	82	67.8 Å²	67.8	32%	0.322	34%	0.343	S	S	.	.	H	α-helix	trans	-67.9	-39	178.1	-67	-40.9	0	0	0	112.7	F366 S367 V370 V381 D382 L383 L388	F366-Y385 AromaticContact CE1-CD1 3.93Å; F366-Y385 HydrophobicContact CE1-CD1 3.93Å; F366-Y385 AromaticContact CE1-CE1 3.74Å; F366-Y385 HydrophobicContact CE1-CE1 3.74Å; F366-Y385 HydrophobicContact CZ-CE1 4.38Å; S367-Y385 WeakPolarHBondContact CB-O 3.3Å; S367-Y385 PolarHBondContact OG-O 2.97Å; V370-Y385 HydrophobicContact CG1-CD2 3.61Å; V370-Y385 HydrophobicContact CG1-CE2 4.06Å; V370-Y385 HydrophobicContact CG1-CG 4.02Å; V381-Y385 HydrophobicContact CG1-CD2 3.78Å; V381-Y385 HydrophobicContact CG1-CE2 3.18Å; V381-Y385 WeakPolarHBondContact O-CD2 3.39Å; V381-Y385 PolarHBondContact O-N 3.44Å; D382-Y385 PolarHBondContact O-N 2.89Å; L383-Y385 VanDerWaalsContact C-N 3.32Å; L383-Y385 PolarHBondContact O-N 3.46Å; Y385-L388 WeakPolarHBondContact O-CB 3.32Å; Y385-L388 PolarHBondContact O-N 2.82Å
386	E	70.9	Confident	73.8	Confident	45 Å²	45	61.7 Å²	61.7	21%	0.21	31%	0.312	C	S	.	.	H	α-helix	trans	-65.7	-38.6	176.8	-165	-170.3	163.6	0	0	112.2	S215 D382 L383 K477	S215-E386 VanDerWaalsContact CB-OE1 3.3Å; S215-E386 WeakPolarHBondContact CB-OE1 3.44Å; S215-E386 PolarHBondContact OG-OE1 3.39Å; S215-E386 VanDerWaalsContact OG-OE1 3.08Å; S215-E386 PolarHBondContact OG-OE2 3.44Å; S215-E386 VanDerWaalsContact OG-OE2 3.13Å; D382-E386 PolarHBondContact O-N 2.91Å; L383-E386 PolarHBondContact O-N 2.99Å; E386-K477 IonicContact OE1-NZ 3.9Å; E386-K477 PolarHBondContact OE1-NZ 3Å
387	Y	76.4	Confident	74.7	Confident	21 Å²	21	53.7 Å²	53.7	8%	0.082	28%	0.277	C	S	.	.	H	α-helix	trans	-90.9	0.1	179.2	-75.7	-96.7	0	0	0	113.5	L214 S215 L383 I384 S390 I391 K477 F481	L214-Y387 PolarHBondContact O-OH 3.41Å; L214-Y387 VanDerWaalsContact O-OH 3.06Å; S215-Y387 WeakPolarHBondContact CA-OH 3.42Å; S215-Y387 PolarHBondContact N-OH 3.38Å; S215-Y387 PolarHBondContact OG-OH 2.98Å; L383-Y387 HydrophobicContact CD1-CD2 3.97Å; L383-Y387 HydrophobicContact CD1-CE2 3.7Å; L383-Y387 HydrophobicContact CG-CD2 4.14Å; L383-Y387 HydrophobicContact CG-CE2 4.33Å; L383-Y387 WeakPolarHBondContact O-CD2 3.25Å; L383-Y387 PolarHBondContact O-N 3.42Å; I384-Y387 PolarHBondContact O-N 2.68Å; Y387-S390 CarbonylContact O-C 3.6Å; Y387-S390 WeakPolarHBondContact O-CA 3.31Å; Y387-S390 WeakPolarHBondContact O-CB 3.38Å; Y387-S390 PolarHBondContact O-N 3.18Å; Y387-I391 VanDerWaalsContact O-CG1 3.3Å; Y387-I391 WeakPolarHBondContact O-CG1 3.31Å; Y387-I391 PolarHBondContact O-N 2.87Å; Y387-K477 HydrophobicContact CE1-CB 4.29Å; Y387-K477 HydrophobicContact CE1-CD 4.19Å; Y387-K477 HydrophobicContact CE1-CG 4.23Å; Y387-F481 HydrophobicContact CD1-CD2 4.11Å; Y387-F481 HydrophobicContact CE1-CD2 4.48Å
388	L	81.1	Confident	75.3	Confident	37 Å²	37	53.5 Å²	53.5	19%	0.194	27%	0.268	C	S	.	.	H	α-helix	trans	-53	-47	-173.9	-172	73.4	0	0	0	113.2	A363 F366 I384 Y385 S390 I391 V392	A363-L388 HydrophobicContact CB-CD2 4.25Å; A363-L388 HydrophobicContact CB-CG 4.23Å; F366-L388 HydrophobicContact CD1-CD2 3.7Å; F366-L388 HydrophobicContact CE1-CD2 4.41Å; I384-L388 WeakPolarHBondContact O-CA 3.05Å; I384-L388 WeakPolarHBondContact O-CB 3.32Å; I384-L388 PolarHBondContact O-N 3.21Å; Y385-L388 WeakPolarHBondContact O-CB 3.32Å; Y385-L388 PolarHBondContact O-N 2.82Å; L388-S390 VanDerWaalsContact C-N 3.32Å; L388-S390 PolarHBondContact O-N 3.43Å; L388-I391 PolarHBondContact O-N 2.92Å; L388-V392 WeakPolarHBondContact O-CG2 3.12Å; L388-V392 PolarHBondContact O-N 3Å
389	P	77.6	Confident	75.8	Confident	8 Å²	8	51.7 Å²	51.7	5%	0.052	26%	0.26	C	S	.	.	H	α-helix	trans	-64.1	-40.7	178.8	-20.4	35.5	0	0	0	111.1	V392 I393	P389-V392 PolarHBondContact O-N 3.36Å; P389-I393 WeakPolarHBondContact O-CB 3.48Å; P389-I393 WeakPolarHBondContact O-CD1 3.38Å; P389-I393 WeakPolarHBondContact O-CG1 3.45Å; P389-I393 PolarHBondContact O-N 3Å
390	S	77.9	Confident	76.2	Confident	4 Å²	4	46 Å²	46	3%	0.028	24%	0.235	C	C	.	.	H	α-helix	trans	-64.9	-39.9	176.3	-63.7	0	0	0	0	112.3	Y387 L388 T394 L478	Y387-S390 CarbonylContact O-C 3.6Å; Y387-S390 WeakPolarHBondContact O-CA 3.31Å; Y387-S390 WeakPolarHBondContact O-CB 3.38Å; Y387-S390 PolarHBondContact O-N 3.18Å; L388-S390 VanDerWaalsContact C-N 3.32Å; L388-S390 PolarHBondContact O-N 3.43Å; S390-T394 WeakPolarHBondContact O-CB 3.12Å; S390-T394 WeakPolarHBondContact O-CG2 3.27Å; S390-T394 PolarHBondContact O-N 3.1Å; S390-T394 PolarHBondContact O-OG1 2.88Å; S390-L478 WeakPolarHBondContact OG-CD2 3.48Å
391	I	82.4	Confident	76.2	Confident	55 Å²	55	41.2 Å²	41.2	28%	0.282	21%	0.212	S	C	.	.	H	α-helix	trans	-65.4	-45.8	176.2	-68	164.4	0	0	0	110.1	Y387 L388 T394 M395 F481	Y387-I391 VanDerWaalsContact O-CG1 3.3Å; Y387-I391 WeakPolarHBondContact O-CG1 3.31Å; Y387-I391 PolarHBondContact O-N 2.87Å; L388-I391 PolarHBondContact O-N 2.92Å; I391-T394 WeakPolarHBondContact CA-OG1 3.38Å; I391-T394 PolarHBondContact O-N 3.33Å; I391-T394 PolarHBondContact O-OG1 3.45Å; I391-M395 HydrophobicContact CG2-CG 4.35Å; I391-M395 VanDerWaalsContact O-CB 3.26Å; I391-M395 WeakPolarHBondContact O-CB 3.38Å; I391-M395 VanDerWaalsContact O-CG 3.24Å; I391-M395 WeakPolarHBondContact O-CG 3.21Å; I391-M395 PolarHBondContact O-N 3.41Å; I391-F481 HydrophobicContact CG1-CZ 4Å
392	V	84.7	Confident	76.2	Confident	36 Å²	36	43 Å²	43	22%	0.218	22%	0.219	C	C	.	.	H	α-helix	trans	-65.9	-42.4	178.8	173.1	0	0	0	0	111	I360 A363 L388 P389 A396	I360-V392 HydrophobicContact CG1-CG1 3.96Å; A363-V392 HydrophobicContact CB-CB 4.12Å; A363-V392 HydrophobicContact CB-CG1 4.32Å; A363-V392 HydrophobicContact CB-CG2 3.78Å; L388-V392 WeakPolarHBondContact O-CG2 3.12Å; L388-V392 PolarHBondContact O-N 3Å; P389-V392 PolarHBondContact O-N 3.36Å; V392-A396 VanDerWaalsContact O-CB 3.26Å; V392-A396 WeakPolarHBondContact O-CB 3.09Å; V392-A396 PolarHBondContact O-N 3.19Å
393	I	79.4	Confident	76.5	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-62	-48	177.1	-70.7	165.4	0	0	0	110.9	I360 P389 A396 N397	I360-I393 HydrophobicContact CD1-CG1 3.98Å; I360-I393 HydrophobicContact CG1-CG1 3.9Å; I360-I393 HydrophobicContact CG2-CD1 4.19Å; I360-I393 HydrophobicContact CG2-CG1 3.94Å; P389-I393 WeakPolarHBondContact O-CB 3.48Å; P389-I393 WeakPolarHBondContact O-CD1 3.38Å; P389-I393 WeakPolarHBondContact O-CG1 3.45Å; P389-I393 PolarHBondContact O-N 3Å; I393-A396 PolarHBondContact O-N 3.46Å; I393-N397 WeakPolarHBondContact CG2-ND2 3.35Å; I393-N397 VanDerWaalsContact O-CB 3.27Å; I393-N397 WeakPolarHBondContact O-CB 3.44Å; I393-N397 PolarHBondContact O-N 2.93Å; I393-N397 PolarHBondContact O-ND2 3.48Å
394	T	77.4	Confident	76.6	Confident	19 Å²	19	41 Å²	41	12%	0.117	21%	0.208	C	C	.	.	H	α-helix	trans	-67.6	-41.2	-180	50	0	0	0	0	112.8	S390 I391 N397 F398 F481 I485	S390-T394 WeakPolarHBondContact O-CB 3.12Å; S390-T394 WeakPolarHBondContact O-CG2 3.27Å; S390-T394 PolarHBondContact O-N 3.1Å; S390-T394 PolarHBondContact O-OG1 2.88Å; I391-T394 WeakPolarHBondContact CA-OG1 3.38Å; I391-T394 PolarHBondContact O-N 3.33Å; I391-T394 PolarHBondContact O-OG1 3.45Å; T394-N397 CarbonylContact O-C 3.58Å; T394-N397 PolarHBondContact O-N 3.25Å; T394-F398 WeakPolarHBondContact O-CB 3.48Å; T394-F398 PolarHBondContact O-N 2.87Å; T394-F481 HydrophobicContact CG2-CD1 3.56Å; T394-F481 HydrophobicContact CG2-CE1 3.51Å; T394-F481 WeakPolarHBondContact OG1-CE1 3.49Å; T394-I485 HydrophobicContact CG2-CG1 4.48Å
395	M	80.6	Confident	76.2	Confident	112 Å²	112	39.2 Å²	39.2	55%	0.552	20%	0.203	S	C	*	.	H	α-helix	trans	-61.7	-44.4	174.4	-76.6	-64.2	-75.7	0	0	111.3	I391 N397 F398 V399	I391-M395 HydrophobicContact CG2-CG 4.35Å; I391-M395 VanDerWaalsContact O-CB 3.26Å; I391-M395 WeakPolarHBondContact O-CB 3.38Å; I391-M395 VanDerWaalsContact O-CG 3.24Å; I391-M395 WeakPolarHBondContact O-CG 3.21Å; I391-M395 PolarHBondContact O-N 3.41Å; M395-N397 PolarHBondContact O-N 2.88Å; M395-F398 PolarHBondContact O-N 2.94Å; M395-V399 WeakPolarHBondContact O-CB 3.42Å; M395-V399 VanDerWaalsContact O-CG2 3.31Å; M395-V399 WeakPolarHBondContact O-CG2 3.48Å; M395-V399 PolarHBondContact O-N 3.42Å
396	A	79.7	Confident	76.1	Confident	12 Å²	12	39 Å²	39	10%	0.099	21%	0.211	C	C	.	.	H	α-helix	trans	-61.3	-45.7	173.6	0	0	0	0	0	110.7	C356 V392 I393 F398 V399 T400 M429	C356-A396 HydrophobicContact CB-CB 4.38Å; V392-A396 VanDerWaalsContact O-CB 3.26Å; V392-A396 WeakPolarHBondContact O-CB 3.09Å; V392-A396 PolarHBondContact O-N 3.19Å; I393-A396 PolarHBondContact O-N 3.46Å; A396-F398 PolarHBondContact O-N 3.44Å; A396-F398 VanDerWaalsContact O-N 3.13Å; A396-V399 PolarHBondContact O-N 3.3Å; A396-T400 VanDerWaalsContact O-CB 3.24Å; A396-T400 WeakPolarHBondContact O-CB 3.44Å; A396-T400 PolarHBondContact O-N 2.88Å; A396-T400 PolarHBondContact O-OG1 3.32Å; A396-M429 HydrophobicContact CB-CE 3.34Å; A396-M429 WeakPolarHBondContact O-CE 3.37Å
397	N	73.9	Confident	76.2	Confident	10 Å²	10	37.4 Å²	37.4	5%	0.053	20%	0.203	C	C	.	.	H	α-helix	trans	-63.2	-19.6	178.6	-73.2	-20.7	0	0	0	113.9	I393 T394 M395 P401 M429 R430	I393-N397 WeakPolarHBondContact CG2-ND2 3.35Å; I393-N397 VanDerWaalsContact O-CB 3.27Å; I393-N397 WeakPolarHBondContact O-CB 3.44Å; I393-N397 PolarHBondContact O-N 2.93Å; I393-N397 PolarHBondContact O-ND2 3.48Å; T394-N397 CarbonylContact O-C 3.58Å; T394-N397 PolarHBondContact O-N 3.25Å; M395-N397 PolarHBondContact O-N 2.88Å; N397-P401 WeakPolarHBondContact O-CD 3.48Å; N397-P401 WeakPolarHBondContact O-CG 3.33Å; N397-M429 WeakPolarHBondContact OD1-CE 3.2Å; N397-M429 PolarHBondContact OD1-SD 2.95Å; N397-R430 PolarHBondContact O-NH2 2.61Å; N397-R430 VanDerWaalsContact OD1-CG 3.24Å; N397-R430 WeakPolarHBondContact OD1-CG 3.5Å
398	F	74.1	Confident	75.8	Confident	106 Å²	106	36.7 Å²	36.7	47%	0.465	20%	0.201	S	C	.	.	H	α-helix	trans	-92.2	-46.2	175.5	178.3	-99.6	0	0	0	112.5	T394 M395 A396 P401 L402	T394-F398 WeakPolarHBondContact O-CB 3.48Å; T394-F398 PolarHBondContact O-N 2.87Å; M395-F398 PolarHBondContact O-N 2.94Å; A396-F398 PolarHBondContact O-N 3.44Å; A396-F398 VanDerWaalsContact O-N 3.13Å; F398-P401 WeakPolarHBondContact O-CD 3.37Å; F398-L402 HydrophobicContact CD1-CD1 4.18Å; F398-L402 HydrophobicContact CE1-CD1 3.71Å; F398-L402 HydrophobicContact CZ-CD1 4.03Å
399	V	77.1	Confident	75.2	Confident	61 Å²	61	40.6 Å²	40.6	37%	0.37	22%	0.222	S	C	.	.	H	α-helix	trans	-73	-41.2	-176.8	173.3	0	0	0	0	111.8	M395 A396 L402 L403	M395-V399 WeakPolarHBondContact O-CB 3.42Å; M395-V399 VanDerWaalsContact O-CG2 3.31Å; M395-V399 WeakPolarHBondContact O-CG2 3.48Å; M395-V399 PolarHBondContact O-N 3.42Å; A396-V399 PolarHBondContact O-N 3.3Å; V399-L402 WeakPolarHBondContact O-CB 3.42Å; V399-L402 PolarHBondContact O-N 2.88Å; V399-L403 HydrophobicContact CG1-CD1 3.91Å; V399-L403 HydrophobicContact CG1-CG 4.14Å; V399-L403 PolarHBondContact O-N 3.46Å
400	T	71.5	Confident	75	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-61	-44.1	-175.8	-57.4	0	0	0	0	113.1	L353 A396 L402 L403 F404 M429	L353-T400 HydrophobicContact CD2-CG2 4.48Å; A396-T400 VanDerWaalsContact O-CB 3.24Å; A396-T400 WeakPolarHBondContact O-CB 3.44Å; A396-T400 PolarHBondContact O-N 2.88Å; A396-T400 PolarHBondContact O-OG1 3.32Å; T400-L402 VanDerWaalsContact C-N 3.29Å; T400-L402 PolarHBondContact O-N 2.75Å; T400-L403 PolarHBondContact O-N 3.08Å; T400-F404 HydrophobicContact CG2-CD1 4.37Å; T400-F404 HydrophobicContact CG2-CD2 3.92Å; T400-F404 HydrophobicContact CG2-CE1 3.78Å; T400-F404 HydrophobicContact CG2-CE2 3.27Å; T400-F404 HydrophobicContact CG2-CG 4.44Å; T400-F404 HydrophobicContact CG2-CZ 3.2Å; T400-F404 VanDerWaalsContact O-CG 3.25Å; T400-F404 WeakPolarHBondContact O-CG 3.45Å; T400-F404 PolarHBondContact O-N 2.76Å; T400-M429 HydrophobicContact CG2-CG 4.23Å
401	P	69.2	Low	74.6	Confident	15 Å²	15	47.2 Å²	47.2	10%	0.097	25%	0.246	C	C	.	.	H	α-helix	trans	-60.7	-33.1	172.3	-24.5	33.6	0	0	0	114.5	N397 F398 S405	N397-P401 WeakPolarHBondContact O-CD 3.48Å; N397-P401 WeakPolarHBondContact O-CG 3.33Å; F398-P401 WeakPolarHBondContact O-CD 3.37Å; P401-S405 WeakPolarHBondContact O-CB 3.38Å; P401-S405 PolarHBondContact O-N 2.73Å
402	L	72.8	Confident	73.9	Confident	85 Å²	85	49 Å²	49	45%	0.445	26%	0.256	S	S	.	.	H	α-helix	trans	-68.1	-47	176.3	-64.3	173.5	0	0	0	110.5	F398 V399 T400 F404 S405 V406	F398-L402 HydrophobicContact CD1-CD1 4.18Å; F398-L402 HydrophobicContact CE1-CD1 3.71Å; F398-L402 HydrophobicContact CZ-CD1 4.03Å; V399-L402 WeakPolarHBondContact O-CB 3.42Å; V399-L402 PolarHBondContact O-N 2.88Å; T400-L402 VanDerWaalsContact C-N 3.29Å; T400-L402 PolarHBondContact O-N 2.75Å; L402-F404 VanDerWaalsContact C-N 3.33Å; L402-F404 PolarHBondContact O-N 3.03Å; L402-S405 PolarHBondContact O-N 3.3Å; L402-S405 PolarHBondContact O-OG 3.4Å; L402-V406 PolarHBondContact O-N 3.4Å
403	L	74.9	Confident	73	Confident	68 Å²	68	49 Å²	49	36%	0.356	25%	0.253	S	S	.	.	H	α-helix	trans	-59	-44.6	174.8	-68.2	175.2	0	0	0	111.4	V352 V399 T400 S405 V406 I407	V352-L403 HydrophobicContact CG1-CD1 4.07Å; V399-L403 HydrophobicContact CG1-CD1 3.91Å; V399-L403 HydrophobicContact CG1-CG 4.14Å; V399-L403 PolarHBondContact O-N 3.46Å; T400-L403 PolarHBondContact O-N 3.08Å; L403-S405 VanDerWaalsContact C-N 3.33Å; L403-S405 PolarHBondContact O-N 3.02Å; L403-V406 PolarHBondContact O-N 3.26Å; L403-I407 WeakPolarHBondContact O-CD1 3.3Å; L403-I407 VanDerWaalsContact O-CG1 3.27Å; L403-I407 WeakPolarHBondContact O-CG1 3.48Å; L403-I407 PolarHBondContact O-N 2.85Å
404	F	72.9	Confident	72.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.3	-40.3	176.5	-65.7	-16.7	0	0	0	112	V349 L353 T400 L402 V406 I407 I408 T422 R425	V349-F404 HydrophobicContact CB-CE1 4.15Å; V349-F404 HydrophobicContact CG1-CD1 4.44Å; V349-F404 HydrophobicContact CG1-CE1 3.55Å; V349-F404 HydrophobicContact CG1-CZ 3.79Å; V349-F404 HydrophobicContact CG2-CD1 4.01Å; V349-F404 HydrophobicContact CG2-CE1 3.8Å; L353-F404 HydrophobicContact CD2-CZ 4.15Å; L353-F404 HydrophobicContact CG-CZ 4.4Å; T400-F404 HydrophobicContact CG2-CD1 4.37Å; T400-F404 HydrophobicContact CG2-CD2 3.92Å; T400-F404 HydrophobicContact CG2-CE1 3.78Å; T400-F404 HydrophobicContact CG2-CE2 3.27Å; T400-F404 HydrophobicContact CG2-CG 4.44Å; T400-F404 HydrophobicContact CG2-CZ 3.2Å; T400-F404 VanDerWaalsContact O-CG 3.25Å; T400-F404 WeakPolarHBondContact O-CG 3.45Å; T400-F404 PolarHBondContact O-N 2.76Å; L402-F404 VanDerWaalsContact C-N 3.33Å; L402-F404 PolarHBondContact O-N 3.03Å; F404-V406 VanDerWaalsContact C-N 3.26Å; F404-V406 PolarHBondContact O-N 3.47Å; F404-I407 HydrophobicContact CD1-CD1 4.17Å; F404-I407 PolarHBondContact O-N 3.37Å; F404-I407 VanDerWaalsContact O-N 3.14Å; F404-I408 HydrophobicContact CB-CD1 4.33Å; F404-I408 WeakPolarHBondContact O-CD1 3.44Å; F404-I408 WeakPolarHBondContact O-CG1 3.45Å; F404-I408 PolarHBondContact O-N 2.7Å; F404-T422 HydrophobicContact CB-CG2 4.01Å; F404-T422 HydrophobicContact CD2-CG2 4.4Å; F404-R425 HydrophobicContact CD2-CB 4.17Å; F404-R425 HydrophobicContact CE2-CB 3.65Å; F404-R425 HydrophobicContact CZ-CB 4.23Å
405	S	68.6	Low	71.4	Confident	45 Å²	45	51.1 Å²	51.1	32%	0.315	27%	0.268	S	S	.	.	H	α-helix	trans	-61.1	-35.2	177.3	75.4	0	0	0	0	112.9	P401 L402 L403 N409	P401-S405 WeakPolarHBondContact O-CB 3.38Å; P401-S405 PolarHBondContact O-N 2.73Å; L402-S405 PolarHBondContact O-N 3.3Å; L402-S405 PolarHBondContact O-OG 3.4Å; L403-S405 VanDerWaalsContact C-N 3.33Å; L403-S405 PolarHBondContact O-N 3.02Å; S405-N409 PolarHBondContact O-ND2 3.3Å
406	V	74	Confident	70.3	Confident	78 Å²	78	48.2 Å²	48.2	47%	0.473	26%	0.262	S	S	.	.	H	α-helix	trans	-69.7	-46.1	173.5	175.5	0	0	0	0	110.2	L402 L403 F404 I408 N409 Y410	L402-V406 PolarHBondContact O-N 3.4Å; L403-V406 PolarHBondContact O-N 3.26Å; F404-V406 VanDerWaalsContact C-N 3.26Å; F404-V406 PolarHBondContact O-N 3.47Å; V406-I408 PolarHBondContact O-N 2.87Å; V406-N409 WeakPolarHBondContact O-CB 3.28Å; V406-N409 PolarHBondContact O-N 3.5Å; V406-Y410 HydrophobicContact CG1-CE2 3.95Å; V406-Y410 WeakPolarHBondContact O-CD2 3.47Å
407	I	74.1	Confident	69.6	Low	11 Å²	11	52 Å²	52	6%	0.056	28%	0.276	C	S	.	.	H	α-helix	trans	-60.6	-42.1	-178.9	-70.7	161.9	0	0	0	112	L345 F348 V349 L403 F404 N409 Y410 E411	L345-I407 HydrophobicContact CB-CG2 3.99Å; L345-I407 HydrophobicContact CD1-CG2 4.28Å; L345-I407 HydrophobicContact CD2-CG2 4.16Å; L345-I407 HydrophobicContact CG-CG2 4.37Å; F348-I407 HydrophobicContact CD1-CD1 3.74Å; F348-I407 HydrophobicContact CD1-CG1 4.46Å; F348-I407 HydrophobicContact CE1-CD1 3.88Å; V349-I407 HydrophobicContact CG2-CD1 3.85Å; V349-I407 HydrophobicContact CG2-CG2 4.29Å; L403-I407 WeakPolarHBondContact O-CD1 3.3Å; L403-I407 VanDerWaalsContact O-CG1 3.27Å; L403-I407 WeakPolarHBondContact O-CG1 3.48Å; L403-I407 PolarHBondContact O-N 2.85Å; F404-I407 HydrophobicContact CD1-CD1 4.17Å; F404-I407 PolarHBondContact O-N 3.37Å; F404-I407 VanDerWaalsContact O-N 3.14Å; I407-N409 VanDerWaalsContact C-N 3.3Å; I407-N409 PolarHBondContact O-N 2.81Å; I407-Y410 WeakPolarHBondContact O-CB 3.39Å; I407-Y410 PolarHBondContact O-N 3.27Å; I407-E411 HydrophobicContact CG2-CG 4.33Å; I407-E411 PolarHBondContact O-N 3.43Å
408	I	67.3	Low	69.2	Low	6 Å²	6	53.5 Å²	53.5	3%	0.031	28%	0.282	C	S	.	.	H	α-helix	trans	-70.9	-28.9	-174.8	-58.6	147	0	0	0	112.1	F404 V406 Y410 E411 Y413 E418 T422	F404-I408 HydrophobicContact CB-CD1 4.33Å; F404-I408 WeakPolarHBondContact O-CD1 3.44Å; F404-I408 WeakPolarHBondContact O-CG1 3.45Å; F404-I408 PolarHBondContact O-N 2.7Å; V406-I408 PolarHBondContact O-N 2.87Å; I408-Y410 PolarHBondContact O-N 2.51Å; I408-Y410 VanDerWaalsContact O-N 3.11Å; I408-E411 PolarHBondContact O-N 3.08Å; I408-Y413 HydrophobicContact CG2-CD2 4.49Å; I408-E418 HydrophobicContact CB-CG 4.44Å; I408-E418 HydrophobicContact CD1-CG 4.44Å; I408-E418 HydrophobicContact CG2-CB 3.71Å; I408-E418 HydrophobicContact CG2-CG 3.43Å; I408-E418 VanDerWaalsContact CG2-CG 3.43Å; I408-E418 VanDerWaalsContact CG2-OE1 3.25Å; I408-E418 WeakPolarHBondContact CG2-OE1 3.48Å; I408-T422 HydrophobicContact CD1-CG2 3.72Å; I408-T422 WeakPolarHBondContact CD1-OG1 3.15Å
409	N	69.6	Low	68.7	Low	118 Å²	118	50.4 Å²	50.4	63%	0.631	27%	0.27	S	S	*	.	H	α-helix	trans	-57.5	-24.7	170.9	-72.1	-31	0	0	0	112.1	S405 V406 I407	S405-N409 PolarHBondContact O-ND2 3.3Å; V406-N409 WeakPolarHBondContact O-CB 3.28Å; V406-N409 PolarHBondContact O-N 3.5Å; I407-N409 VanDerWaalsContact C-N 3.3Å; I407-N409 PolarHBondContact O-N 2.81Å
410	Y	72.2	Confident	68.2	Low	152 Å²	152	52.6 Å²	52.6	60%	0.596	27%	0.272	S	S	*	.	H	α-helix	trans	-89.7	-22.4	174.9	-63.7	-81.1	0	0	0	113.7	L341 V406 I407 I408 D412	L341-Y410 WeakPolarHBondContact CD2-O 3.22Å; V406-Y410 HydrophobicContact CG1-CE2 3.95Å; V406-Y410 WeakPolarHBondContact O-CD2 3.47Å; I407-Y410 WeakPolarHBondContact O-CB 3.39Å; I407-Y410 PolarHBondContact O-N 3.27Å; I408-Y410 PolarHBondContact O-N 2.51Å; I408-Y410 VanDerWaalsContact O-N 3.11Å; Y410-D412 VanDerWaalsContact C-N 3.34Å; Y410-D412 PolarHBondContact O-N 2.86Å
411	E	69.8	Low	67.9	Low	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-82	-8.3	-174.4	-68.6	176.9	150.3	0	0	114.2	R342 L345 N346 I407 I408 Y413 R425	R342-E411 HydrophobicContact CG-CB 4.36Å; R342-E411 HydrophobicContact CG-CG 4.37Å; R342-E411 PolarHBondContact NE-O 3.2Å; R342-E411 VanDerWaalsContact NE-O 3.12Å; R342-E411 PolarHBondContact NH2-O 2.86Å; R342-E411 VanDerWaalsContact NH2-O 3.14Å; L345-E411 HydrophobicContact CB-CG 4.19Å; L345-E411 WeakPolarHBondContact CB-OE1 3.37Å; L345-E411 HydrophobicContact CD1-CG 3.47Å; L345-E411 VanDerWaalsContact CD1-CG 3.47Å; L345-E411 HydrophobicContact CG-CG 4.48Å; N346-E411 PolarHBondContact OD1-OE1 3.46Å; I407-E411 HydrophobicContact CG2-CG 4.33Å; I407-E411 PolarHBondContact O-N 3.43Å; I408-E411 PolarHBondContact O-N 3.08Å; E411-Y413 HydrophobicContact CB-CD2 3.48Å; E411-Y413 VanDerWaalsContact CB-CD2 3.48Å; E411-Y413 HydrophobicContact CB-CE2 3.47Å; E411-Y413 VanDerWaalsContact CB-CE2 3.47Å; E411-Y413 HydrophobicContact CB-CG 4.44Å; E411-Y413 HydrophobicContact CG-CD2 4.45Å; E411-Y413 HydrophobicContact CG-CE2 4.04Å; E411-Y413 PolarHBondContact O-N 3.01Å; E411-Y413 VanDerWaalsContact O-N 3.15Å; E411-Y413 WeakPolarHBondContact OE2-CE2 3.25Å; E411-R425 IonicContact OE1-NH1 3.73Å; E411-R425 IonicContact OE1-NH2 3.88Å; E411-R425 IonicContact OE2-NH1 2.71Å; E411-R425 PolarHBondContact OE2-NH1 2.84Å
412	D	67.8	Low	67.6	Low	91 Å²	91	55.8 Å²	55.8	49%	0.487	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.4	47.5	178.7	-84.5	-28.2	0	0	0	112.6	R342 Y410	R342-D412 PolarHBondContact NH2-O 2.99Å; Y410-D412 VanDerWaalsContact C-N 3.34Å; Y410-D412 PolarHBondContact O-N 2.86Å
413	Y	66.9	Low	67.3	Low	37 Å²	37	51.9 Å²	51.9	15%	0.145	27%	0.266	C	S	.	.			trans	-76.3	163.9	174.4	-78	-60.6	0	0	0	111.8	R342 I408 E411 F417 F421	R342-Y413 WeakPolarHBondContact CD-OH 3.4Å; R342-Y413 VanDerWaalsContact CZ-CE1 3.42Å; I408-Y413 HydrophobicContact CG2-CD2 4.49Å; E411-Y413 HydrophobicContact CB-CD2 3.48Å; E411-Y413 VanDerWaalsContact CB-CD2 3.48Å; E411-Y413 HydrophobicContact CB-CE2 3.47Å; E411-Y413 VanDerWaalsContact CB-CE2 3.47Å; E411-Y413 HydrophobicContact CB-CG 4.44Å; E411-Y413 HydrophobicContact CG-CD2 4.45Å; E411-Y413 HydrophobicContact CG-CE2 4.04Å; E411-Y413 PolarHBondContact O-N 3.01Å; E411-Y413 VanDerWaalsContact O-N 3.15Å; E411-Y413 WeakPolarHBondContact OE2-CE2 3.25Å; Y413-F417 AromaticContact CD1-CD1 3.28Å; Y413-F417 HydrophobicContact CD1-CD1 3.28Å; Y413-F417 AromaticContact CD1-CE1 3.55Å; Y413-F417 HydrophobicContact CD1-CE1 3.55Å; Y413-F417 HydrophobicContact CD1-CG 4.31Å; Y413-F417 HydrophobicContact CD2-CD1 4.24Å; Y413-F417 HydrophobicContact CD2-CE1 4.44Å; Y413-F417 AromaticContact CE1-CD1 3.68Å; Y413-F417 HydrophobicContact CE1-CD1 3.68Å; Y413-F417 AromaticContact CE1-CE1 3.38Å; Y413-F417 HydrophobicContact CE1-CE1 3.38Å; Y413-F417 HydrophobicContact CE1-CZ 4.39Å; Y413-F417 HydrophobicContact CE2-CE1 4.28Å; Y413-F417 AromaticContact CG-CD1 3.62Å; Y413-F417 HydrophobicContact CG-CD1 3.62Å; Y413-F417 HydrophobicContact CG-CE1 4.11Å; Y413-F417 AromaticContact CZ-CE1 3.8Å; Y413-F421 HydrophobicContact CE2-CD1 4.24Å; Y413-F421 HydrophobicContact CE2-CE1 4.34Å
414	S	62.5	Low	66.9	Low	37 Å²	37	53.1 Å²	53.1	26%	0.259	27%	0.271	S	S	.	.			trans	-66.3	141.7	165.8	65.1	0	0	0	0	108.2	A416 F417 E418	S414-A416 PolarHBondContact O-N 3.24Å; S414-F417 WeakPolarHBondContact O-CA 3.08Å; S414-F417 PolarHBondContact O-N 3.46Å; S414-F417 WeakPolarHBondContact OG-CB 3.12Å; S414-F417 PolarHBondContact OG-N 3.37Å; S414-E418 PolarHBondContact O-N 3.36Å
415	P	58.8	Low	66.8	Low	29 Å²	29	54.2 Å²	54.2	19%	0.188	28%	0.275	C	S	.	.	H	α-helix	trans	-55.4	-33	-176.2	-26.7	33.4	0	0	0	113.4	I323 I419	I323-P415 HydrophobicContact CD1-CG 3.83Å; P415-I419 WeakPolarHBondContact O-CD1 2.84Å; P415-I419 VanDerWaalsContact O-CG1 3.29Å; P415-I419 WeakPolarHBondContact O-CG1 3.38Å; P415-I419 PolarHBondContact O-N 3.5Å; P415-I419 VanDerWaalsContact O-N 3.14Å
416	A	59.3	Low	66.7	Low	51 Å²	51	52.2 Å²	52.2	42%	0.421	26%	0.261	S	S	.	.	H	α-helix	trans	-72.1	-35.2	176.2	0	0	0	0	0	113.2	S414 R420	S414-A416 PolarHBondContact O-N 3.24Å; A416-R420 WeakPolarHBondContact O-CD 3.4Å; A416-R420 WeakPolarHBondContact O-CG 3.46Å; A416-R420 PolarHBondContact O-N 3.33Å
417	F	64.7	Low	66.4	Low	92 Å²	92	48.8 Å²	48.8	40%	0.404	24%	0.24	S	C	.	.	H	α-helix	trans	-75.6	-42	176	-173.6	-90.4	0	0	0	111.1	Y413 S414 I419 R420 F421	Y413-F417 AromaticContact CD1-CD1 3.28Å; Y413-F417 HydrophobicContact CD1-CD1 3.28Å; Y413-F417 AromaticContact CD1-CE1 3.55Å; Y413-F417 HydrophobicContact CD1-CE1 3.55Å; Y413-F417 HydrophobicContact CD1-CG 4.31Å; Y413-F417 HydrophobicContact CD2-CD1 4.24Å; Y413-F417 HydrophobicContact CD2-CE1 4.44Å; Y413-F417 AromaticContact CE1-CD1 3.68Å; Y413-F417 HydrophobicContact CE1-CD1 3.68Å; Y413-F417 AromaticContact CE1-CE1 3.38Å; Y413-F417 HydrophobicContact CE1-CE1 3.38Å; Y413-F417 HydrophobicContact CE1-CZ 4.39Å; Y413-F417 HydrophobicContact CE2-CE1 4.28Å; Y413-F417 AromaticContact CG-CD1 3.62Å; Y413-F417 HydrophobicContact CG-CD1 3.62Å; Y413-F417 HydrophobicContact CG-CE1 4.11Å; Y413-F417 AromaticContact CZ-CE1 3.8Å; S414-F417 WeakPolarHBondContact O-CA 3.08Å; S414-F417 PolarHBondContact O-N 3.46Å; S414-F417 WeakPolarHBondContact OG-CB 3.12Å; S414-F417 PolarHBondContact OG-N 3.37Å; F417-I419 PolarHBondContact O-N 3.32Å; F417-R420 PolarHBondContact O-N 3.5Å; F417-F421 HydrophobicContact CD1-CB 4.23Å; F417-F421 HydrophobicContact CE1-CB 4Å; F417-F421 HydrophobicContact CE1-CD1 4.3Å; F417-F421 HydrophobicContact CE1-CD2 4.34Å; F417-F421 HydrophobicContact CE1-CG 4.01Å; F417-F421 HydrophobicContact CZ-CD2 4.31Å; F417-F421 HydrophobicContact CZ-CG 4.42Å; F417-F421 WeakPolarHBondContact O-CB 3.12Å; F417-F421 PolarHBondContact O-N 3.3Å
418	E	64.8	Low	66.1	Low	40 Å²	40	53.3 Å²	53.3	19%	0.187	26%	0.26	C	S	.	.	H	α-helix	trans	-47.7	-60.4	170.5	152.2	168.4	-149.1	0	0	110.1	I408 S414 R420 F421 T422	I408-E418 HydrophobicContact CB-CG 4.44Å; I408-E418 HydrophobicContact CD1-CG 4.44Å; I408-E418 HydrophobicContact CG2-CB 3.71Å; I408-E418 HydrophobicContact CG2-CG 3.43Å; I408-E418 VanDerWaalsContact CG2-CG 3.43Å; I408-E418 VanDerWaalsContact CG2-OE1 3.25Å; I408-E418 WeakPolarHBondContact CG2-OE1 3.48Å; S414-E418 PolarHBondContact O-N 3.36Å; E418-R420 VanDerWaalsContact C-N 3.28Å; E418-R420 PolarHBondContact O-N 3.09Å; E418-F421 PolarHBondContact O-N 3.26Å; E418-F421 VanDerWaalsContact O-N 3.15Å; E418-T422 PolarHBondContact O-N 2.95Å; E418-T422 PolarHBondContact O-OG1 2.82Å
419	I	63.2	Low	66.3	Low	41 Å²	41	53.1 Å²	53.1	21%	0.21	26%	0.259	C	S	.	.	H	α-helix	trans	-56.5	-42.8	-177.7	-72.8	168.3	0	0	0	111.9	P415 F417 L423 P520 F573	P415-I419 WeakPolarHBondContact O-CD1 2.84Å; P415-I419 VanDerWaalsContact O-CG1 3.29Å; P415-I419 WeakPolarHBondContact O-CG1 3.38Å; P415-I419 PolarHBondContact O-N 3.5Å; P415-I419 VanDerWaalsContact O-N 3.14Å; F417-I419 PolarHBondContact O-N 3.32Å; I419-L423 WeakPolarHBondContact O-CB 3.49Å; I419-L423 PolarHBondContact O-N 3.29Å; I419-L423 VanDerWaalsContact O-N 3.14Å; I419-P520 HydrophobicContact CB-CG 4.34Å; I419-P520 HydrophobicContact CD1-CG 4.39Å; I419-P520 HydrophobicContact CG1-CG 4.19Å; I419-P520 HydrophobicContact CG2-CB 3.84Å; I419-P520 HydrophobicContact CG2-CG 3.32Å; I419-F573 HydrophobicContact CD1-CD2 3.84Å; I419-F573 HydrophobicContact CD1-CE2 3.58Å; I419-F573 HydrophobicContact CD1-CZ 4.47Å; I419-F573 HydrophobicContact CG2-CE2 4.24Å; I419-F573 HydrophobicContact CG2-CZ 4.18Å
420	R	66.6	Low	66.3	Low	107 Å²	107	48.8 Å²	48.8	40%	0.404	23%	0.234	S	C	.	.	H	α-helix	trans	-69.2	-41.7	-178.7	-70.4	173.9	179.2	-179.1	-0.4	111.9	A416 F417 E418 L423 M424 S577 F581	A416-R420 WeakPolarHBondContact O-CD 3.4Å; A416-R420 WeakPolarHBondContact O-CG 3.46Å; A416-R420 PolarHBondContact O-N 3.33Å; F417-R420 PolarHBondContact O-N 3.5Å; E418-R420 VanDerWaalsContact C-N 3.28Å; E418-R420 PolarHBondContact O-N 3.09Å; R420-L423 PolarHBondContact O-N 3.37Å; R420-M424 WeakPolarHBondContact O-CG 3.42Å; R420-M424 PolarHBondContact O-N 3.47Å; R420-S577 PolarHBondContact NH2-OG 2.88Å; R420-F581 HydrophobicContact CB-CE2 4.05Å; R420-F581 HydrophobicContact CB-CZ 4.17Å; R420-F581 HydrophobicContact CG-CD2 4.09Å; R420-F581 HydrophobicContact CG-CE2 3.63Å; R420-F581 HydrophobicContact CG-CZ 3.86Å
421	F	66	Low	66.1	Low	59 Å²	59	42.7 Å²	42.7	26%	0.259	21%	0.211	S	C	.	.	H	α-helix	trans	-74.9	-42.7	-174.9	-168.1	-123.5	0	0	0	112	Y413 F417 E418 L423 M424 R425	Y413-F421 HydrophobicContact CE2-CD1 4.24Å; Y413-F421 HydrophobicContact CE2-CE1 4.34Å; F417-F421 HydrophobicContact CD1-CB 4.23Å; F417-F421 HydrophobicContact CE1-CB 4Å; F417-F421 HydrophobicContact CE1-CD1 4.3Å; F417-F421 HydrophobicContact CE1-CD2 4.34Å; F417-F421 HydrophobicContact CE1-CG 4.01Å; F417-F421 HydrophobicContact CZ-CD2 4.31Å; F417-F421 HydrophobicContact CZ-CG 4.42Å; F417-F421 WeakPolarHBondContact O-CB 3.12Å; F417-F421 PolarHBondContact O-N 3.3Å; E418-F421 PolarHBondContact O-N 3.26Å; E418-F421 VanDerWaalsContact O-N 3.15Å; F421-L423 PolarHBondContact O-N 3.47Å; F421-M424 PolarHBondContact O-N 2.88Å; F421-R425 VanDerWaalsContact CE1-NE 3.35Å; F421-R425 WeakPolarHBondContact O-CG 3.34Å; F421-R425 PolarHBondContact O-N 3.01Å
422	T	63.4	Low	66.1	Low	25 Å²	25	44 Å²	44	15%	0.153	22%	0.22	C	C	.	.	H	α-helix	trans	-57.8	-41.4	169.6	-42.7	0	0	0	0	110.9	F404 I408 E418 R425 C426	F404-T422 HydrophobicContact CB-CG2 4.01Å; F404-T422 HydrophobicContact CD2-CG2 4.4Å; I408-T422 HydrophobicContact CD1-CG2 3.72Å; I408-T422 WeakPolarHBondContact CD1-OG1 3.15Å; E418-T422 PolarHBondContact O-N 2.95Å; E418-T422 PolarHBondContact O-OG1 2.82Å; T422-R425 PolarHBondContact O-N 3.39Å; T422-C426 WeakPolarHBondContact O-CB 3.38Å; T422-C426 PolarHBondContact O-N 3.33Å; T422-C426 PolarHBondContact O-SG 3.46Å
423	L	66	Low	66.4	Low	2 Å²	2	39.7 Å²	39.7	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-66.8	-44.9	179.7	-166	145.9	0	0	0	110.9	I419 R420 F421 R425 C426 V427 P520 L524 F581 V585	I419-L423 WeakPolarHBondContact O-CB 3.49Å; I419-L423 PolarHBondContact O-N 3.29Å; I419-L423 VanDerWaalsContact O-N 3.14Å; R420-L423 PolarHBondContact O-N 3.37Å; F421-L423 PolarHBondContact O-N 3.47Å; L423-R425 VanDerWaalsContact C-N 3.32Å; L423-R425 PolarHBondContact O-N 3.15Å; L423-C426 PolarHBondContact O-N 3.47Å; L423-V427 HydrophobicContact CD2-CG2 3.78Å; L423-V427 WeakPolarHBondContact O-CB 3.43Å; L423-V427 WeakPolarHBondContact O-CG2 3.3Å; L423-V427 PolarHBondContact O-N 2.9Å; L423-P520 HydrophobicContact CD1-CB 3.9Å; L423-L524 HydrophobicContact CB-CD1 4.38Å; L423-L524 HydrophobicContact CD1-CD1 4.29Å; L423-L524 HydrophobicContact CD1-CD2 4.4Å; L423-L524 HydrophobicContact CD1-CG 3.98Å; L423-L524 HydrophobicContact CD2-CD2 3.97Å; L423-L524 HydrophobicContact CD2-CG 4.47Å; L423-L524 HydrophobicContact CG-CD1 3.93Å; L423-L524 HydrophobicContact CG-CD2 3.64Å; L423-L524 HydrophobicContact CG-CG 3.7Å; L423-F581 HydrophobicContact CB-CE1 4.46Å; L423-F581 HydrophobicContact CB-CZ 4.05Å; L423-F581 HydrophobicContact CD1-CE1 3.5Å; L423-F581 VanDerWaalsContact CD1-CE1 3.5Å; L423-F581 HydrophobicContact CD1-CZ 3.9Å; L423-F581 HydrophobicContact CD2-CE1 4Å; L423-F581 HydrophobicContact CD2-CZ 3.64Å; L423-F581 HydrophobicContact CG-CE1 4.14Å; L423-F581 HydrophobicContact CG-CZ 4.02Å; L423-V585 HydrophobicContact CD2-CB 4.24Å; L423-V585 HydrophobicContact CD2-CG1 3.82Å; L423-V585 HydrophobicContact CD2-CG2 3.45Å; L423-V585 VanDerWaalsContact CD2-CG2 3.45Å
424	M	67	Low	66.6	Low	95 Å²	95	38.3 Å²	38.3	47%	0.468	19%	0.191	S	C	.	.	H	α-helix	trans	-57.6	-42.1	172.8	-71.7	-64	-74.6	0	0	112.6	R420 F421 V427 F428 I588	R420-M424 WeakPolarHBondContact O-CG 3.42Å; R420-M424 PolarHBondContact O-N 3.47Å; F421-M424 PolarHBondContact O-N 2.88Å; M424-V427 PolarHBondContact O-N 3.34Å; M424-F428 WeakPolarHBondContact O-CB 3.31Å; M424-F428 PolarHBondContact O-N 3.24Å; M424-I588 HydrophobicContact CE-CD1 4.45Å; M424-I588 HydrophobicContact SD-CD1 4.34Å
425	R	70.3	Confident	67.1	Low	22 Å²	22	40.3 Å²	40.3	8%	0.083	20%	0.202	C	C	.	.	H	α-helix	trans	-63.9	-45.4	176.4	-71.7	169.1	165.5	179.6	-12.4	112.7	N346 F404 E411 F421 T422 L423 F428 M429	N346-R425 PolarHBondContact OD1-NH2 3.02Å; F404-R425 HydrophobicContact CD2-CB 4.17Å; F404-R425 HydrophobicContact CE2-CB 3.65Å; F404-R425 HydrophobicContact CZ-CB 4.23Å; E411-R425 IonicContact OE1-NH1 3.73Å; E411-R425 IonicContact OE1-NH2 3.88Å; E411-R425 IonicContact OE2-NH1 2.71Å; E411-R425 PolarHBondContact OE2-NH1 2.84Å; F421-R425 VanDerWaalsContact CE1-NE 3.35Å; F421-R425 WeakPolarHBondContact O-CG 3.34Å; F421-R425 PolarHBondContact O-N 3.01Å; T422-R425 PolarHBondContact O-N 3.39Å; L423-R425 VanDerWaalsContact C-N 3.32Å; L423-R425 PolarHBondContact O-N 3.15Å; R425-F428 PolarHBondContact O-N 2.92Å; R425-M429 VanDerWaalsContact O-CB 3.31Å; R425-M429 WeakPolarHBondContact O-CB 3.32Å; R425-M429 PolarHBondContact O-N 3.5Å
426	C	66	Low	67.8	Low	3 Å²	3	40.2 Å²	40.2	2%	0.02	20%	0.201	C	C	.	.	H	α-helix	trans	-67.7	-37	177.5	-72.3	0	0	0	0	112.3	T422 L423 R430 L524	T422-C426 WeakPolarHBondContact O-CB 3.38Å; T422-C426 PolarHBondContact O-N 3.33Å; T422-C426 PolarHBondContact O-SG 3.46Å; L423-C426 PolarHBondContact O-N 3.47Å; C426-R430 WeakPolarHBondContact O-CB 3.4Å; C426-R430 VanDerWaalsContact O-CG 3.29Å; C426-R430 WeakPolarHBondContact O-CG 3.35Å; C426-R430 PolarHBondContact O-N 3.06Å; C426-L524 HydrophobicContact CB-CD1 3.55Å; C426-L524 HydrophobicContact CB-CD2 3.92Å; C426-L524 HydrophobicContact CB-CG 4.34Å
427	V	67.3	Low	68.4	Low	6 Å²	6	38 Å²	38	4%	0.036	18%	0.182	C	C	.	.	H	α-helix	trans	-60.6	-55.6	172.1	169.2	0	0	0	0	108.8	L423 M424 M429 R430 L431 L524 L527 V585	L423-V427 HydrophobicContact CD2-CG2 3.78Å; L423-V427 WeakPolarHBondContact O-CB 3.43Å; L423-V427 WeakPolarHBondContact O-CG2 3.3Å; L423-V427 PolarHBondContact O-N 2.9Å; M424-V427 PolarHBondContact O-N 3.34Å; V427-M429 VanDerWaalsContact C-N 3.29Å; V427-M429 PolarHBondContact O-N 3.18Å; V427-R430 PolarHBondContact O-N 3.32Å; V427-R430 VanDerWaalsContact O-N 3.16Å; V427-L431 HydrophobicContact CB-CD1 4.4Å; V427-L431 HydrophobicContact CG1-CD1 3.24Å; V427-L431 HydrophobicContact CG1-CG 4.11Å; V427-L431 WeakPolarHBondContact O-CB 3.47Å; V427-L431 VanDerWaalsContact O-CD1 3.25Å; V427-L431 WeakPolarHBondContact O-CD1 3.47Å; V427-L431 WeakPolarHBondContact O-CG 3.24Å; V427-L431 PolarHBondContact O-N 2.88Å; V427-L524 HydrophobicContact CB-CD2 4.37Å; V427-L524 HydrophobicContact CG2-CD2 3.29Å; V427-L527 HydrophobicContact CB-CD2 4.46Å; V427-L527 HydrophobicContact CG1-CD2 4.18Å; V427-L527 HydrophobicContact CG2-CD2 3.52Å; V427-V585 HydrophobicContact CG2-CG1 3.83Å
428	F	69.4	Low	68.8	Low	106 Å²	106	35 Å²	35	47%	0.465	17%	0.17	S	C	.	.	H	α-helix	trans	-54.2	-45.4	179.3	-175.9	-99	0	0	0	112.3	L353 F357 M424 R425 R430 L431 T432	L353-F428 HydrophobicContact CD1-CD1 4.41Å; F357-F428 HydrophobicContact CE2-CE1 4.44Å; F357-F428 HydrophobicContact CZ-CE1 4.47Å; M424-F428 WeakPolarHBondContact O-CB 3.31Å; M424-F428 PolarHBondContact O-N 3.24Å; R425-F428 PolarHBondContact O-N 2.92Å; F428-R430 PolarHBondContact O-N 3.01Å; F428-L431 PolarHBondContact O-N 3.05Å; F428-T432 WeakPolarHBondContact O-CB 3.49Å; F428-T432 PolarHBondContact O-N 3.41Å; F428-T432 PolarHBondContact O-OG1 2.99Å
429	M	70.3	Confident	69.3	Low	2 Å²	2	39.3 Å²	39.3	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-60	-47.4	178.3	-176.3	-91.9	-177.6	0	0	112.8	L353 A396 N397 T400 R425 V427 L431 T432 S433	L353-M429 HydrophobicContact CD2-CB 3.54Å; L353-M429 HydrophobicContact CD2-CG 3.53Å; A396-M429 HydrophobicContact CB-CE 3.34Å; A396-M429 WeakPolarHBondContact O-CE 3.37Å; N397-M429 WeakPolarHBondContact OD1-CE 3.2Å; N397-M429 PolarHBondContact OD1-SD 2.95Å; T400-M429 HydrophobicContact CG2-CG 4.23Å; R425-M429 VanDerWaalsContact O-CB 3.31Å; R425-M429 WeakPolarHBondContact O-CB 3.32Å; R425-M429 PolarHBondContact O-N 3.5Å; V427-M429 VanDerWaalsContact C-N 3.29Å; V427-M429 PolarHBondContact O-N 3.18Å; M429-L431 VanDerWaalsContact C-N 3.3Å; M429-L431 PolarHBondContact O-N 3Å; M429-T432 PolarHBondContact O-N 3.29Å; M429-S433 PolarHBondContact O-N 3.3Å; M429-S433 PolarHBondContact O-OG 3.29Å
430	R	70	Confident	69.6	Low	28 Å²	28	37.5 Å²	37.5	11%	0.106	18%	0.177	C	C	.	.	H	α-helix	trans	-69.3	-27.9	178.9	-75.2	175.5	-179.7	-157.2	-3.9	113.6	N397 C426 V427 F428 S433 I434 L524 Y528	N397-R430 PolarHBondContact O-NH2 2.61Å; N397-R430 VanDerWaalsContact OD1-CG 3.24Å; N397-R430 WeakPolarHBondContact OD1-CG 3.5Å; C426-R430 WeakPolarHBondContact O-CB 3.4Å; C426-R430 VanDerWaalsContact O-CG 3.29Å; C426-R430 WeakPolarHBondContact O-CG 3.35Å; C426-R430 PolarHBondContact O-N 3.06Å; V427-R430 PolarHBondContact O-N 3.32Å; V427-R430 VanDerWaalsContact O-N 3.16Å; F428-R430 PolarHBondContact O-N 3.01Å; R430-S433 WeakPolarHBondContact CA-OG 3.4Å; R430-S433 PolarHBondContact O-OG 3.31Å; R430-I434 WeakPolarHBondContact O-CG1 3.37Å; R430-L524 PolarHBondContact NH1-O 3.43Å; R430-Y528 HydrophobicContact CB-CD2 3.92Å; R430-Y528 HydrophobicContact CG-CD2 4.29Å
431	L	68.3	Low	69.7	Low	23 Å²	23	33.4 Å²	33.4	12%	0.12	16%	0.162	C	C	.	.	H	α-helix	trans	-77.3	-46.4	176.4	-69	160.8	0	0	0	110.8	V427 F428 M429 S433 I434 T435 T531 L592	V427-L431 HydrophobicContact CB-CD1 4.4Å; V427-L431 HydrophobicContact CG1-CD1 3.24Å; V427-L431 HydrophobicContact CG1-CG 4.11Å; V427-L431 WeakPolarHBondContact O-CB 3.47Å; V427-L431 VanDerWaalsContact O-CD1 3.25Å; V427-L431 WeakPolarHBondContact O-CD1 3.47Å; V427-L431 WeakPolarHBondContact O-CG 3.24Å; V427-L431 PolarHBondContact O-N 2.88Å; F428-L431 PolarHBondContact O-N 3.05Å; M429-L431 VanDerWaalsContact C-N 3.3Å; M429-L431 PolarHBondContact O-N 3Å; L431-S433 PolarHBondContact O-N 3.12Å; L431-I434 WeakPolarHBondContact O-CB 3.39Å; L431-I434 PolarHBondContact O-N 3.33Å; L431-I434 VanDerWaalsContact O-N 3.12Å; L431-T435 PolarHBondContact O-N 3.46Å; L431-T435 PolarHBondContact O-OG1 3.36Å; L431-T435 VanDerWaalsContact O-OG1 3.09Å; L431-T531 HydrophobicContact CD2-CG2 4.38Å; L431-L592 HydrophobicContact CB-CD1 4.38Å; L431-L592 HydrophobicContact CD1-CD1 3.04Å; L431-L592 HydrophobicContact CD1-CG 4.47Å; L431-L592 HydrophobicContact CD2-CB 4.02Å; L431-L592 HydrophobicContact CD2-CD1 3.46Å; L431-L592 VanDerWaalsContact CD2-CD1 3.46Å; L431-L592 HydrophobicContact CD2-CG 4.4Å; L431-L592 HydrophobicContact CG-CD1 3.73Å
432	T	69.4	Low	69.9	Low	29 Å²	29	34.6 Å²	34.6	18%	0.178	17%	0.165	C	C	.	.	H	α-helix	trans	-67.8	-28.4	179.7	-53.3	0	0	0	0	111.1	F357 F428 M429 T435 V436	F357-T432 HydrophobicContact CD1-CG2 3.43Å; F357-T432 VanDerWaalsContact CD1-CG2 3.43Å; F357-T432 HydrophobicContact CD2-CG2 4.18Å; F357-T432 HydrophobicContact CE1-CG2 3.02Å; F357-T432 HydrophobicContact CE2-CG2 3.79Å; F357-T432 HydrophobicContact CG-CG2 4.05Å; F357-T432 HydrophobicContact CZ-CG2 3.22Å; F428-T432 WeakPolarHBondContact O-CB 3.49Å; F428-T432 PolarHBondContact O-N 3.41Å; F428-T432 PolarHBondContact O-OG1 2.99Å; M429-T432 PolarHBondContact O-N 3.29Å; T432-T435 PolarHBondContact O-N 3.28Å; T432-V436 HydrophobicContact CG2-CG2 4.3Å; T432-V436 WeakPolarHBondContact O-CB 3.35Å; T432-V436 VanDerWaalsContact O-CG2 3.26Å; T432-V436 WeakPolarHBondContact O-CG2 3.37Å; T432-V436 PolarHBondContact O-N 3.39Å
433	S	74.4	Confident	70.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.1	-40.4	170	63.2	0	0	0	0	112.9	M429 R430 L431 L437	M429-S433 PolarHBondContact O-N 3.3Å; M429-S433 PolarHBondContact O-OG 3.29Å; R430-S433 WeakPolarHBondContact CA-OG 3.4Å; R430-S433 PolarHBondContact O-OG 3.31Å; L431-S433 PolarHBondContact O-N 3.12Å; S433-L437 PolarHBondContact O-N 2.97Å; S433-L437 VanDerWaalsContact O-N 3.11Å
434	I	71.7	Confident	69.9	Low	7 Å²	7	37.7 Å²	37.7	4%	0.036	18%	0.184	C	C	.	.	H	α-helix	trans	-65.8	-44.1	172.7	-65.1	169.1	0	0	0	110.6	R430 L431 V436 L437 L438 Y528 I532 I535	R430-I434 WeakPolarHBondContact O-CG1 3.37Å; L431-I434 WeakPolarHBondContact O-CB 3.39Å; L431-I434 PolarHBondContact O-N 3.33Å; L431-I434 VanDerWaalsContact O-N 3.12Å; I434-V436 PolarHBondContact O-N 3.43Å; I434-L437 PolarHBondContact O-N 3.1Å; I434-L438 HydrophobicContact CG2-CD1 3.96Å; I434-L438 HydrophobicContact CG2-CG 4.39Å; I434-L438 WeakPolarHBondContact O-CG 3.48Å; I434-L438 PolarHBondContact O-N 2.82Å; I434-Y528 HydrophobicContact CD1-CD2 3.88Å; I434-Y528 HydrophobicContact CD1-CE2 3.7Å; I434-Y528 HydrophobicContact CG1-CE2 3.88Å; I434-I532 HydrophobicContact CD1-CG1 4.12Å; I434-I535 HydrophobicContact CG2-CD1 3.85Å
435	T	71.3	Confident	69.7	Low	79 Å²	79	35.7 Å²	35.7	49%	0.485	17%	0.174	S	C	.	.	H	α-helix	trans	-62.8	-42.8	178.9	-56.3	0	0	0	0	111.9	L431 T432 L438 Y439	L431-T435 PolarHBondContact O-N 3.46Å; L431-T435 PolarHBondContact O-OG1 3.36Å; L431-T435 VanDerWaalsContact O-OG1 3.09Å; T432-T435 PolarHBondContact O-N 3.28Å; T435-L438 PolarHBondContact O-N 2.91Å; T435-Y439 VanDerWaalsContact O-CB 3.23Å; T435-Y439 WeakPolarHBondContact O-CB 3.29Å; T435-Y439 PolarHBondContact O-N 3.37Å
436	V	75	Confident	69.3	Low	27 Å²	27	37.7 Å²	37.7	16%	0.164	19%	0.187	C	C	.	.	H	α-helix	trans	-64.3	-41.2	176.7	170.9	0	0	0	0	110.9	F357 I360 T432 I434 Y439 S440	F357-V436 HydrophobicContact CD1-CG2 4.18Å; I360-V436 HydrophobicContact CG2-CG1 4.07Å; T432-V436 HydrophobicContact CG2-CG2 4.3Å; T432-V436 WeakPolarHBondContact O-CB 3.35Å; T432-V436 VanDerWaalsContact O-CG2 3.26Å; T432-V436 WeakPolarHBondContact O-CG2 3.37Å; T432-V436 PolarHBondContact O-N 3.39Å; I434-V436 PolarHBondContact O-N 3.43Å; V436-Y439 PolarHBondContact O-N 3.26Å; V436-S440 VanDerWaalsContact O-CB 3.24Å; V436-S440 WeakPolarHBondContact O-CB 3.41Å; V436-S440 PolarHBondContact O-N 3.32Å
437	L	71.8	Confident	68.9	Low	6 Å²	6	44.1 Å²	44.1	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-59.9	-49.2	175.4	-177.6	70.7	0	0	0	111.1	T364 S433 I434 S440 L441 M475 L478	T364-L437 HydrophobicContact CG2-CD1 4.14Å; S433-L437 PolarHBondContact O-N 2.97Å; S433-L437 VanDerWaalsContact O-N 3.11Å; I434-L437 PolarHBondContact O-N 3.1Å; L437-S440 PolarHBondContact O-N 3.27Å; L437-L441 HydrophobicContact CD1-CD1 4.45Å; L437-L441 HydrophobicContact CG-CD1 4.13Å; L437-L441 WeakPolarHBondContact O-CB 3.4Å; L437-L441 WeakPolarHBondContact O-CD1 3.29Å; L437-L441 VanDerWaalsContact O-CG 3.24Å; L437-L441 WeakPolarHBondContact O-CG 3.22Å; L437-L441 PolarHBondContact O-N 3.35Å; L437-M475 HydrophobicContact CD2-CE 4.14Å; L437-L478 HydrophobicContact CD2-CD1 3.78Å
438	L	71.9	Confident	68.2	Low	28 Å²	28	45.9 Å²	45.9	15%	0.147	23%	0.229	C	C	.	.	H	α-helix	trans	-64.9	-40.4	179	-69.1	175.3	0	0	0	112.2	I434 T435 W442 V471 M475 I535 P596	I434-L438 HydrophobicContact CG2-CD1 3.96Å; I434-L438 HydrophobicContact CG2-CG 4.39Å; I434-L438 WeakPolarHBondContact O-CG 3.48Å; I434-L438 PolarHBondContact O-N 2.82Å; T435-L438 PolarHBondContact O-N 2.91Å; L438-W442 WeakPolarHBondContact O-CB 3.17Å; L438-W442 PolarHBondContact O-N 2.96Å; L438-V471 HydrophobicContact CD2-CG1 4.23Å; L438-M475 HydrophobicContact CD2-CE 4.04Å; L438-I535 HydrophobicContact CD1-CG2 4.46Å; L438-P596 HydrophobicContact CD1-CB 3.65Å; L438-P596 HydrophobicContact CD1-CG 3.99Å
439	Y	75.6	Confident	67.5	Low	131 Å²	131	48.8 Å²	48.8	51%	0.514	24%	0.236	S	C	.	.	H	α-helix	trans	-67.1	-42.5	176.8	179.1	-93.8	0	0	0	112	T435 V436 L441 W442 S443	T435-Y439 VanDerWaalsContact O-CB 3.23Å; T435-Y439 WeakPolarHBondContact O-CB 3.29Å; T435-Y439 PolarHBondContact O-N 3.37Å; V436-Y439 PolarHBondContact O-N 3.26Å; Y439-L441 VanDerWaalsContact C-N 3.34Å; Y439-W442 AromaticContact CD2-CE3 3.94Å; Y439-W442 HydrophobicContact CD2-CE3 3.94Å; Y439-W442 HydrophobicContact CD2-CZ3 4.35Å; Y439-W442 AromaticContact CE2-CE3 3.89Å; Y439-W442 HydrophobicContact CE2-CE3 3.89Å; Y439-W442 AromaticContact CE2-CZ3 3.89Å; Y439-W442 HydrophobicContact CE2-CZ3 3.89Å; Y439-W442 CarbonylContact O-C 3.6Å; Y439-W442 WeakPolarHBondContact O-CB 3.45Å; Y439-W442 PolarHBondContact O-N 3.37Å; Y439-W442 VanDerWaalsContact O-N 3.15Å; Y439-S443 WeakPolarHBondContact O-CB 3.36Å; Y439-S443 PolarHBondContact O-N 2.87Å
440	S	70.4	Confident	66.5	Low	3 Å²	3	57 Å²	57	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-64	-41.5	177.3	-173.1	0	0	0	0	111.4	T364 V436 L437 W442	T364-S440 WeakPolarHBondContact CG2-OG 3.47Å; V436-S440 VanDerWaalsContact O-CB 3.24Å; V436-S440 WeakPolarHBondContact O-CB 3.41Å; V436-S440 PolarHBondContact O-N 3.32Å; L437-S440 PolarHBondContact O-N 3.27Å; S440-W442 VanDerWaalsContact C-N 3.31Å
441	L	67.8	Low	65.5	Low	20 Å²	20	61.3 Å²	61.3	11%	0.105	30%	0.3	C	S	.	.	H	α-helix	trans	-63	-40.3	172.4	-71.3	167.3	0	0	0	110.9	Q368 L437 Y439 I445 V471	Q368-L441 VanDerWaalsContact NE2-CD2 3.27Å; L437-L441 HydrophobicContact CD1-CD1 4.45Å; L437-L441 HydrophobicContact CG-CD1 4.13Å; L437-L441 WeakPolarHBondContact O-CB 3.4Å; L437-L441 WeakPolarHBondContact O-CD1 3.29Å; L437-L441 VanDerWaalsContact O-CG 3.24Å; L437-L441 WeakPolarHBondContact O-CG 3.22Å; L437-L441 PolarHBondContact O-N 3.35Å; Y439-L441 VanDerWaalsContact C-N 3.34Å; L441-I445 WeakPolarHBondContact O-CD1 3.09Å; L441-I445 VanDerWaalsContact O-CG1 3.28Å; L441-I445 WeakPolarHBondContact O-CG1 3.28Å; L441-I445 PolarHBondContact O-N 3.11Å; L441-V471 HydrophobicContact CD1-CG2 4.48Å
442	W	70.5	Confident	64.7	Low	85 Å²	85	64.8 Å²	64.8	32%	0.322	32%	0.324	S	S	.	.	H	α-helix	trans	-68.8	-45.8	-179.9	-179.4	65.6	0	0	0	113.9	L438 Y439 S440 Q444 I445 D446 L604	L438-W442 WeakPolarHBondContact O-CB 3.17Å; L438-W442 PolarHBondContact O-N 2.96Å; Y439-W442 AromaticContact CD2-CE3 3.94Å; Y439-W442 HydrophobicContact CD2-CE3 3.94Å; Y439-W442 HydrophobicContact CD2-CZ3 4.35Å; Y439-W442 AromaticContact CE2-CE3 3.89Å; Y439-W442 HydrophobicContact CE2-CE3 3.89Å; Y439-W442 AromaticContact CE2-CZ3 3.89Å; Y439-W442 HydrophobicContact CE2-CZ3 3.89Å; Y439-W442 CarbonylContact O-C 3.6Å; Y439-W442 WeakPolarHBondContact O-CB 3.45Å; Y439-W442 PolarHBondContact O-N 3.37Å; Y439-W442 VanDerWaalsContact O-N 3.15Å; S440-W442 VanDerWaalsContact C-N 3.31Å; W442-Q444 PolarHBondContact O-N 3.38Å; W442-I445 WeakPolarHBondContact O-CA 3.11Å; W442-I445 WeakPolarHBondContact O-CB 3.34Å; W442-I445 PolarHBondContact O-N 3.41Å; W442-D446 PolarHBondContact O-N 3.36Å; W442-L604 VanDerWaalsContact CD1-CD2 3.47Å
443	S	67.7	Low	63.8	Low	52 Å²	52	68 Å²	68	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-57.4	-34.2	-179.1	-174	0	0	0	0	112.2	Y439 E447	Y439-S443 WeakPolarHBondContact O-CB 3.36Å; Y439-S443 PolarHBondContact O-N 2.87Å; S443-E447 PolarHBondContact O-N 3Å
444	Q	61.4	Low	62.4	Low	40 Å²	40	71.8 Å²	71.8	19%	0.187	37%	0.373	C	S	.	.	H	α-helix	trans	-79.5	-26.6	176.9	-71	174.2	8.4	0	0	113.1	W442 C448	W442-Q444 PolarHBondContact O-N 3.38Å; Q444-C448 PolarHBondContact O-N 3.2Å; Q444-C448 PolarHBondContact O-SG 2.99Å
445	I	62.4	Low	61.2	Low	52 Å²	52	77.2 Å²	77.2	27%	0.267	40%	0.402	S	S	.	.	H	α-helix	trans	-66.8	-41.8	171.7	-67.4	162.8	0	0	0	109.9	L441 W442 E447 C448 R449 W467	L441-I445 WeakPolarHBondContact O-CD1 3.09Å; L441-I445 VanDerWaalsContact O-CG1 3.28Å; L441-I445 WeakPolarHBondContact O-CG1 3.28Å; L441-I445 PolarHBondContact O-N 3.11Å; W442-I445 WeakPolarHBondContact O-CA 3.11Å; W442-I445 WeakPolarHBondContact O-CB 3.34Å; W442-I445 PolarHBondContact O-N 3.41Å; I445-E447 VanDerWaalsContact C-N 3.33Å; I445-C448 PolarHBondContact O-N 2.88Å; I445-R449 PolarHBondContact O-N 2.56Å; I445-W467 HydrophobicContact CD1-CB 4.16Å; I445-W467 HydrophobicContact CD1-CD2 3.88Å; I445-W467 HydrophobicContact CD1-CE3 3.67Å; I445-W467 HydrophobicContact CD1-CG 4.1Å; I445-W467 HydrophobicContact CD1-CZ3 4.39Å; I445-W467 HydrophobicContact CG1-CB 4.42Å
446	D	62.8	Low	60.2	Low	64 Å²	64	78.4 Å²	78.4	34%	0.342	41%	0.411	S	S	.	.	H	α-helix	trans	-67.7	-34.7	179.3	-149	37.7	0	0	0	111.6	W442 C448 R449	W442-D446 PolarHBondContact O-N 3.36Å; D446-C448 PolarHBondContact O-N 3.34Å; D446-R449 WeakPolarHBondContact O-CB 3.4Å; D446-R449 PolarHBondContact O-N 3.28Å; D446-R449 WeakPolarHBondContact OD1-CD 3.45Å; D446-R449 IonicContact OD1-CZ 3.23Å; D446-R449 IonicContact OD1-NE 3.08Å; D446-R449 IonicContact OD1-NH1 2.69Å; D446-R449 PolarHBondContact OD1-NH1 3.19Å
447	E	56.8	Low	58.8	Low	139 Å²	139	86.2 Å²	86.2	65%	0.65	44%	0.443	S	S	*	.	H	α-helix	trans	-65.6	-25.9	174.4	-159.9	171.2	-169.5	0	0	112.8	S443 I445 R449	S443-E447 PolarHBondContact O-N 3Å; I445-E447 VanDerWaalsContact C-N 3.33Å; E447-R449 VanDerWaalsContact C-N 3.31Å
448	C	53.8	Low	57.5	Low	43 Å²	43	92.2 Å²	92.2	29%	0.291	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-1.8	173.6	-63.2	0	0	0	0	113.8	Q444 I445 D446 C459	Q444-C448 PolarHBondContact O-N 3.2Å; Q444-C448 PolarHBondContact O-SG 2.99Å; I445-C448 PolarHBondContact O-N 2.88Å; D446-C448 PolarHBondContact O-N 3.34Å; C448-C459 VanDerWaalsContact SG-SG 3.64Å
449	R	53.5	Low	56.5	Low	166 Å²	166	92.9 Å²	92.9	63%	0.626	48%	0.481	S	S	*	.	S	Bend	trans	-79.5	-25.2	-173.6	-167.5	176.9	-174.3	172.3	1.9	113.5	I445 D446 E447	I445-R449 PolarHBondContact O-N 2.56Å; D446-R449 WeakPolarHBondContact O-CB 3.4Å; D446-R449 PolarHBondContact O-N 3.28Å; D446-R449 WeakPolarHBondContact OD1-CD 3.45Å; D446-R449 IonicContact OD1-CZ 3.23Å; D446-R449 IonicContact OD1-NE 3.08Å; D446-R449 IonicContact OD1-NH1 2.69Å; D446-R449 PolarHBondContact OD1-NH1 3.19Å; E447-R449 VanDerWaalsContact C-N 3.31Å
450	E	49.8	Very low	54.8	Low	176 Å²	176	92 Å²	92	82%	0.822	48%	0.481	S	S	*	.	S	Bend	trans	-85.4	-12.6	-166.5	-80.2	-168.6	163.4	0	0	116.3
451	D	48.8	Very low	53.4	Low	118 Å²	118	100.5 Å²	100.5	63%	0.631	51%	0.514	S	S	*	.			trans	-178	105	160	-94.9	-36.1	0	0	0	112.5	C453	D451-C453 PolarHBondContact O-N 3.13Å; D451-C453 VanDerWaalsContact O-N 3.12Å
452	P	51.5	Low	52	Low	96 Å²	96	103 Å²	103	62%	0.623	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-4	-174.8	27.1	-33.5	0	0	0	115
453	C	51.4	Low	50.7	Low	96 Å²	96	103.7 Å²	103.7	65%	0.649	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.2	-5.8	-171.6	-69.9	0	0	0	0	115.6	C192 D451	C192-C453 VanDerWaalsContact SG-SG 3.67Å; D451-C453 PolarHBondContact O-N 3.13Å; D451-C453 VanDerWaalsContact O-N 3.12Å
454	S	45.6	Very low	49.7	Very low	79 Å²	79	104.4 Å²	104.4	55%	0.552	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-29.5	-176.1	-155.6	0	0	0	0	113
455	N	44.5	Very low	49.4	Very low	122 Å²	122	104.5 Å²	104.5	65%	0.652	53%	0.528	S	S	*	.			trans	-130.1	82.8	-177.7	-77	-50	0	0	0	113.6	K457	N455-K457 PolarHBondContact O-N 2.92Å
456	P	50.6	Low	49.9	Very low	103 Å²	103	102.5 Å²	102.5	67%	0.669	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-0.1	-178.3	26.8	-34	0	0	0	115.2
457	K	45.4	Very low	50.5	Low	192 Å²	192	101.5 Å²	101.5	84%	0.835	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-21.5	-179	-75.4	-177.8	179.1	175.5	0	114.4	N455	N455-K457 PolarHBondContact O-N 2.92Å
458	L	45.9	Very low	51.7	Low	132 Å²	132	95 Å²	95	69%	0.691	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-36.8	178.4	-159.6	71.3	0	0	0	111.7	Q460	L458-Q460 PolarHBondContact O-N 2.82Å
459	C	49.3	Very low	53	Low	42 Å²	42	93.1 Å²	93.1	28%	0.284	47%	0.467	S	S	.	.	S	Bend	trans	-95.8	66.6	173.2	-68.3	0	0	0	0	110.8	C448 Y461	C448-C459 VanDerWaalsContact SG-SG 3.64Å; C459-Y461 PolarHBondContact O-N 3.47Å; C459-Y461 VanDerWaalsContact O-N 3.08Å
460	Q	40.3	Very low	54.2	Low	112 Å²	112	87.6 Å²	87.6	52%	0.523	45%	0.446	S	S	.	.			trans	-78.7	97.7	-173.8	-168.6	149.8	26.4	0	0	112.2	L458 H462	L458-Q460 PolarHBondContact O-N 2.82Å; Q460-H462 PolarHBondContact O-N 3.41Å
461	Y	41.4	Very low	55.7	Low	181 Å²	181	79.5 Å²	79.5	71%	0.71	41%	0.409	S	S	*	.	S	Bend	trans	54.5	-28.5	160.8	-123.6	-91.7	0	0	0	119.9	P196 C459	P196-Y461 HydrophobicContact CG-CE1 3.86Å; C459-Y461 PolarHBondContact O-N 3.47Å; C459-Y461 VanDerWaalsContact O-N 3.08Å
462	H	38.1	Very low	57.5	Low	72 Å²	72	73.9 Å²	73.9	33%	0.333	38%	0.379	S	S	.	.	S	Bend	trans	-86.1	-28.5	-178.4	-165.4	52.5	0	0	0	112.3	E371 Q460 L464 Q465	E371-H462 IonicContact OE1-NE2 2.7Å; Q460-H462 PolarHBondContact O-N 3.41Å; H462-L464 PolarHBondContact O-N 3.28Å; H462-Q465 PolarHBondContact CE1-OE1 3.02Å; H462-Q465 PolarHBondContact ND1-OE1 2.98Å; H462-Q465 WeakPolarHBondContact O-CA 3.09Å; H462-Q465 WeakPolarHBondContact O-CB 3.41Å; H462-Q465 PolarHBondContact O-N 2.9Å
463	Y	43.8	Very low	59	Low	100 Å²	100	69.8 Å²	69.8	39%	0.392	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-0.7	175.2	-66.8	-90.4	0	0	0	114	Q465	Y463-Q465 PolarHBondContact O-N 3.35Å
464	L	46.4	Very low	60.5	Low	68 Å²	68	65.9 Å²	65.9	36%	0.356	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-1	160.4	-114.5	87.1	0	0	0	112.4	H462	H462-L464 PolarHBondContact O-N 3.28Å
465	Q	55	Low	62.5	Low	42 Å²	42	62.1 Å²	62.1	20%	0.196	30%	0.297	C	S	.	.	S	Bend	trans	-95.6	135.9	175.4	-154.4	159.8	-7.9	0	0	108.7	E221 H462 Y463 W467	E221-Q465 VanDerWaalsContact CD-NE2 3.28Å; E221-Q465 PolarHBondContact OE1-NE2 2.95Å; E221-Q465 PolarHBondContact OE2-NE2 3Å; H462-Q465 PolarHBondContact CE1-OE1 3.02Å; H462-Q465 PolarHBondContact ND1-OE1 2.98Å; H462-Q465 WeakPolarHBondContact O-CA 3.09Å; H462-Q465 WeakPolarHBondContact O-CB 3.41Å; H462-Q465 PolarHBondContact O-N 2.9Å; Y463-Q465 PolarHBondContact O-N 3.35Å; Q465-W467 PolarHBondContact O-N 3.01Å; Q465-W467 VanDerWaalsContact O-N 3.11Å
466	C	73.2	Confident	64.6	Low	9 Å²	9	57.1 Å²	57.1	6%	0.061	27%	0.269	C	S	.	.			trans	-42.3	109.9	-177.5	-50.2	0	0	0	0	114	E468 T469 R470 C610	C466-E468 PolarHBondContact O-N 3.01Å; C466-T469 VanDerWaalsContact CB-OG1 3.28Å; C466-T469 WeakPolarHBondContact CB-OG1 3.47Å; C466-T469 WeakPolarHBondContact O-CB 3.39Å; C466-T469 PolarHBondContact O-N 2.95Å; C466-R470 PolarHBondContact O-N 3.26Å; C466-R470 VanDerWaalsContact O-N 3.12Å; C466-C610 WeakPolarHBondContact CA-SG 3.44Å; C466-C610 HydrophobicContact CB-CB 4.12Å; C466-C610 WeakPolarHBondContact CB-SG 3.45Å; C466-C610 WeakPolarHBondContact SG-CB 3.39Å; C466-C610 CovalentContact SG-SG 1.95Å; C466-C610 PolarHBondContact SG-SG 3.47Å
467	W	75.9	Confident	66.2	Low	43 Å²	43	52.4 Å²	52.4	16%	0.163	24%	0.238	C	C	.	.	H	α-helix	trans	-61.7	-33.7	179.4	71.4	-99.6	0	0	0	111.5	I445 Q465 T469 R470 V471 Y539 L604 K605 S607	I445-W467 HydrophobicContact CD1-CB 4.16Å; I445-W467 HydrophobicContact CD1-CD2 3.88Å; I445-W467 HydrophobicContact CD1-CE3 3.67Å; I445-W467 HydrophobicContact CD1-CG 4.1Å; I445-W467 HydrophobicContact CD1-CZ3 4.39Å; I445-W467 HydrophobicContact CG1-CB 4.42Å; Q465-W467 PolarHBondContact O-N 3.01Å; Q465-W467 VanDerWaalsContact O-N 3.11Å; W467-T469 VanDerWaalsContact C-N 3.29Å; W467-T469 PolarHBondContact O-N 2.76Å; W467-R470 WeakPolarHBondContact O-CB 3.39Å; W467-R470 PolarHBondContact O-N 3.1Å; W467-R470 VanDerWaalsContact O-N 3.14Å; W467-V471 HydrophobicContact CE3-CG2 3.99Å; W467-V471 HydrophobicContact CZ3-CG2 4.2Å; W467-V471 WeakPolarHBondContact O-CG2 3.43Å; W467-V471 PolarHBondContact O-N 3.41Å; W467-Y539 HydrophobicContact CH2-CE1 4.44Å; W467-Y539 HydrophobicContact CZ3-CE1 4.13Å; W467-L604 HydrophobicContact CH2-CB 4.2Å; W467-L604 HydrophobicContact CH2-CD1 3.58Å; W467-L604 HydrophobicContact CZ2-CB 4.1Å; W467-L604 HydrophobicContact CZ2-CD1 4.25Å; W467-L604 HydrophobicContact CZ3-CD1 4.19Å; W467-K605 PolarHBondContact NE1-O 3.15Å; W467-S607 PolarHBondContact N-OG 3.43Å; W467-S607 PolarHBondContact NE1-OG 2.98Å
468	E	81.4	Confident	68.1	Low	4 Å²	4	43.4 Å²	43.4	2%	0.019	20%	0.199	C	C	.	.	H	α-helix	trans	-63.3	-36.9	176.5	-61.5	91.3	153.3	0	0	111.9	Y227 C466 R470 V471 G472 Y539 P606 S607	Y227-E468 HydrophobicContact CD1-CB 3.4Å; Y227-E468 HydrophobicContact CD1-CG 4.09Å; Y227-E468 HydrophobicContact CE1-CB 3.55Å; Y227-E468 HydrophobicContact CE1-CG 3.68Å; Y227-E468 HydrophobicContact CG-CB 4.04Å; C466-E468 PolarHBondContact O-N 3.01Å; E468-R470 VanDerWaalsContact C-N 3.34Å; E468-V471 PolarHBondContact O-N 3.38Å; E468-G472 PolarHBondContact O-N 3.31Å; E468-Y539 HydrophobicContact CB-CD1 4.06Å; E468-Y539 HydrophobicContact CB-CE1 4.4Å; E468-Y539 HydrophobicContact CG-CE1 4.5Å; E468-Y539 WeakPolarHBondContact O-CD1 3.37Å; E468-P606 VanDerWaalsContact OE1-CA 3.25Å; E468-P606 WeakPolarHBondContact OE1-CA 3.46Å; E468-S607 PolarHBondContact OE1-N 3.14Å; E468-S607 WeakPolarHBondContact OE2-CB 3.48Å; E468-S607 PolarHBondContact OE2-OG 3.18Å
469	T	80.9	Confident	70.2	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.012	17%	0.167	C	C	.	.	H	α-helix	trans	-69.2	-38.1	176.2	-61.9	0	0	0	0	110.2	E221 L226 G228 C466 W467 G472 Q473	E221-T469 HydrophobicContact CG-CG2 4.13Å; L226-T469 HydrophobicContact CB-CG2 4.07Å; L226-T469 HydrophobicContact CD1-CG2 4.01Å; L226-T469 HydrophobicContact CD2-CG2 4.21Å; L226-T469 HydrophobicContact CG-CG2 4.31Å; G228-T469 VanDerWaalsContact CA-OG1 3.25Å; G228-T469 WeakPolarHBondContact CA-OG1 3.22Å; G228-T469 PolarHBondContact N-OG1 3.47Å; C466-T469 VanDerWaalsContact CB-OG1 3.28Å; C466-T469 WeakPolarHBondContact CB-OG1 3.47Å; C466-T469 WeakPolarHBondContact O-CB 3.39Å; C466-T469 PolarHBondContact O-N 2.95Å; W467-T469 VanDerWaalsContact C-N 3.29Å; W467-T469 PolarHBondContact O-N 2.76Å; T469-G472 CarbonylContact O-C 3.54Å; T469-G472 WeakPolarHBondContact O-CA 3.22Å; T469-G472 PolarHBondContact O-N 3.31Å; T469-G472 VanDerWaalsContact O-N 3.15Å; T469-Q473 WeakPolarHBondContact O-CG 3.34Å; T469-Q473 PolarHBondContact O-N 3.01Å
470	R	78.7	Confident	72.1	Confident	50 Å²	50	36.8 Å²	36.8	19%	0.189	16%	0.161	C	C	.	.	H	α-helix	trans	-63.6	-43.2	175.5	-173.3	61.2	-174	-132.4	-6.2	111.9	E371 C466 W467 E468 G472 Q473 E474	E371-R470 VanDerWaalsContact CD-NH2 3.31Å; E371-R470 IonicContact OE1-CZ 2.68Å; E371-R470 IonicContact OE1-NH1 3.78Å; E371-R470 PolarHBondContact OE1-NH1 3.15Å; E371-R470 IonicContact OE1-NH2 3.44Å; E371-R470 PolarHBondContact OE1-NH2 2.9Å; E371-R470 IonicContact OE2-CZ 2.58Å; E371-R470 IonicContact OE2-NH1 3.98Å; E371-R470 IonicContact OE2-NH2 3.78Å; E371-R470 PolarHBondContact OE2-NH2 3.47Å; C466-R470 PolarHBondContact O-N 3.26Å; C466-R470 VanDerWaalsContact O-N 3.12Å; W467-R470 WeakPolarHBondContact O-CB 3.39Å; W467-R470 PolarHBondContact O-N 3.1Å; W467-R470 VanDerWaalsContact O-N 3.14Å; E468-R470 VanDerWaalsContact C-N 3.34Å; R470-G472 VanDerWaalsContact C-N 3.28Å; R470-G472 PolarHBondContact O-N 2.91Å; R470-Q473 WeakPolarHBondContact O-CB 3.44Å; R470-Q473 PolarHBondContact O-N 2.78Å; R470-Q473 VanDerWaalsContact O-N 3.15Å; R470-E474 IonicContact CZ-OE1 3.05Å; R470-E474 IonicContact NE-OE1 3.58Å; R470-E474 PolarHBondContact NE-OE1 3.31Å; R470-E474 IonicContact NH2-OE1 3.96Å; R470-E474 PolarHBondContact NH2-OE1 3.41Å; R470-E474 WeakPolarHBondContact O-CG 3.37Å; R470-E474 PolarHBondContact O-N 3.03Å
471	V	81.8	Confident	74.3	Confident	7 Å²	7	33.2 Å²	33.2	4%	0.042	14%	0.144	C	C	.	.	H	α-helix	trans	-59.4	-41.4	172.8	177.5	0	0	0	0	110.8	L438 L441 W467 E468 Q473 E474 M475 Y539	L438-V471 HydrophobicContact CD2-CG1 4.23Å; L441-V471 HydrophobicContact CD1-CG2 4.48Å; W467-V471 HydrophobicContact CE3-CG2 3.99Å; W467-V471 HydrophobicContact CZ3-CG2 4.2Å; W467-V471 WeakPolarHBondContact O-CG2 3.43Å; W467-V471 PolarHBondContact O-N 3.41Å; E468-V471 PolarHBondContact O-N 3.38Å; V471-Q473 PolarHBondContact O-N 3.45Å; V471-E474 PolarHBondContact O-N 2.88Å; V471-M475 WeakPolarHBondContact O-CG 3.08Å; V471-M475 PolarHBondContact O-N 3.19Å; V471-Y539 HydrophobicContact CB-CD1 4.18Å; V471-Y539 HydrophobicContact CB-CD2 4.46Å; V471-Y539 HydrophobicContact CB-CE1 4.37Å; V471-Y539 HydrophobicContact CB-CG 4.23Å; V471-Y539 HydrophobicContact CG1-CD1 4.18Å; V471-Y539 HydrophobicContact CG1-CD2 3.63Å; V471-Y539 HydrophobicContact CG1-CE1 4.22Å; V471-Y539 HydrophobicContact CG1-CE2 3.68Å; V471-Y539 HydrophobicContact CG1-CG 3.89Å
472	G	86.6	Confident	76.4	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.5	-40.8	174.1	0	0	0	0	0	113.8	E468 T469 R470 M475 Y476	E468-G472 PolarHBondContact O-N 3.31Å; T469-G472 CarbonylContact O-C 3.54Å; T469-G472 WeakPolarHBondContact O-CA 3.22Å; T469-G472 PolarHBondContact O-N 3.31Å; T469-G472 VanDerWaalsContact O-N 3.15Å; R470-G472 VanDerWaalsContact C-N 3.28Å; R470-G472 PolarHBondContact O-N 2.91Å; G472-M475 PolarHBondContact O-N 2.83Å; G472-Y476 WeakPolarHBondContact O-CB 3.39Å; G472-Y476 PolarHBondContact O-N 3.42Å
473	Q	83.8	Confident	79	Confident	9 Å²	9	24.3 Å²	24.3	4%	0.042	11%	0.109	C	C	.	.	H	α-helix	trans	-64.1	-43.7	175.4	-73.2	171.7	-26.6	0	0	111.7	G216 L226 T469 R470 V471 M475 Y476 K477	G216-Q473 PolarHBondContact O-NE2 3.48Å; G216-Q473 VanDerWaalsContact O-NE2 3.11Å; L226-Q473 HydrophobicContact CD1-CG 3.91Å; L226-Q473 HydrophobicContact CD2-CG 3.93Å; T469-Q473 WeakPolarHBondContact O-CG 3.34Å; T469-Q473 PolarHBondContact O-N 3.01Å; R470-Q473 WeakPolarHBondContact O-CB 3.44Å; R470-Q473 PolarHBondContact O-N 2.78Å; R470-Q473 VanDerWaalsContact O-N 3.15Å; V471-Q473 PolarHBondContact O-N 3.45Å; Q473-M475 PolarHBondContact O-N 3.45Å; Q473-Y476 WeakPolarHBondContact O-CB 3.39Å; Q473-Y476 PolarHBondContact O-N 3.36Å; Q473-K477 WeakPolarHBondContact O-CB 3.37Å; Q473-K477 WeakPolarHBondContact O-CG 3.47Å; Q473-K477 PolarHBondContact O-N 2.93Å
474	E	82.1	Confident	81.1	Confident	15 Å²	15	23 Å²	23	7%	0.07	11%	0.108	C	C	.	.	H	α-helix	trans	-63.1	-42.1	176.1	-63.4	-51.8	144.2	0	0	111.9	R470 V471 Y476 K477 L478	R470-E474 IonicContact CZ-OE1 3.05Å; R470-E474 IonicContact NE-OE1 3.58Å; R470-E474 PolarHBondContact NE-OE1 3.31Å; R470-E474 IonicContact NH2-OE1 3.96Å; R470-E474 PolarHBondContact NH2-OE1 3.41Å; R470-E474 WeakPolarHBondContact O-CG 3.37Å; R470-E474 PolarHBondContact O-N 3.03Å; V471-E474 PolarHBondContact O-N 2.88Å; E474-Y476 VanDerWaalsContact C-N 3.33Å; E474-Y476 PolarHBondContact O-N 2.89Å; E474-K477 VanDerWaalsContact CD-CE 3.47Å; E474-K477 PolarHBondContact O-N 3.25Å; E474-K477 VanDerWaalsContact OE1-CE 3.27Å; E474-K477 WeakPolarHBondContact OE1-CE 3.46Å; E474-K477 IonicContact OE1-NZ 3.55Å; E474-K477 PolarHBondContact OE1-NZ 2.9Å; E474-K477 VanDerWaalsContact OE2-CE 3.32Å; E474-K477 WeakPolarHBondContact OE2-CE 3.33Å; E474-K477 IonicContact OE2-NZ 3.36Å; E474-K477 PolarHBondContact OE2-NZ 3.36Å; E474-L478 WeakPolarHBondContact O-CB 3.26Å; E474-L478 VanDerWaalsContact O-CG 3.3Å; E474-L478 WeakPolarHBondContact O-CG 3.26Å; E474-L478 PolarHBondContact O-N 3.12Å
475	M	87.1	Confident	83	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-65	-36.3	176.1	-65.2	-61.4	127.4	0	0	112.6	L437 L438 V471 G472 Q473 L478 T479 I532 I535 L543	L437-M475 HydrophobicContact CD2-CE 4.14Å; L438-M475 HydrophobicContact CD2-CE 4.04Å; V471-M475 WeakPolarHBondContact O-CG 3.08Å; V471-M475 PolarHBondContact O-N 3.19Å; G472-M475 PolarHBondContact O-N 2.83Å; Q473-M475 PolarHBondContact O-N 3.45Å; M475-L478 HydrophobicContact CE-CD1 4.24Å; M475-L478 HydrophobicContact SD-CD1 4.44Å; M475-T479 WeakPolarHBondContact O-CB 3.34Å; M475-T479 PolarHBondContact O-N 2.9Å; M475-T479 VanDerWaalsContact O-N 3.14Å; M475-T479 PolarHBondContact O-OG1 3.28Å; M475-I532 HydrophobicContact CB-CG2 4.28Å; M475-I532 HydrophobicContact SD-CG2 4.11Å; M475-I535 HydrophobicContact SD-CG2 4.29Å; M475-L543 HydrophobicContact CB-CD2 4.4Å
476	Y	89	Confident	84.5	Confident	17 Å²	17	20.7 Å²	20.7	7%	0.067	10%	0.096	C	C	.	.	H	α-helix	trans	-64.8	-51.4	172.7	171	-97.8	0	0	0	111.3	L213 L214 L220 L225 G472 Q473 E474 L478 T479 I480 I546	L213-Y476 VanDerWaalsContact O-CE1 3.29Å; L213-Y476 WeakPolarHBondContact O-CE1 3.36Å; L213-Y476 PolarHBondContact O-OH 2.83Å; L214-Y476 WeakPolarHBondContact O-CE1 3.38Å; L220-Y476 HydrophobicContact CD2-CE1 4.34Å; L225-Y476 HydrophobicContact CD2-CD2 4.31Å; L225-Y476 HydrophobicContact CD2-CE2 4.29Å; G472-Y476 WeakPolarHBondContact O-CB 3.39Å; G472-Y476 PolarHBondContact O-N 3.42Å; Q473-Y476 WeakPolarHBondContact O-CB 3.39Å; Q473-Y476 PolarHBondContact O-N 3.36Å; E474-Y476 VanDerWaalsContact C-N 3.33Å; E474-Y476 PolarHBondContact O-N 2.89Å; Y476-L478 VanDerWaalsContact C-N 3.34Å; Y476-L478 PolarHBondContact O-N 3.1Å; Y476-T479 WeakPolarHBondContact O-CB 2.94Å; Y476-T479 PolarHBondContact O-N 3.4Å; Y476-I480 HydrophobicContact CD1-CG1 4.42Å; Y476-I480 HydrophobicContact CD2-CG1 4.21Å; Y476-I480 HydrophobicContact CE1-CG1 4Å; Y476-I480 HydrophobicContact CE2-CD1 3.98Å; Y476-I480 HydrophobicContact CE2-CG1 3.76Å; Y476-I480 WeakPolarHBondContact O-CG1 3.24Å; Y476-I480 PolarHBondContact O-N 3.06Å; Y476-I546 HydrophobicContact CD2-CD1 3.78Å; Y476-I546 HydrophobicContact CE2-CD1 3.68Å
477	K	84.6	Confident	85.4	Confident	3 Å²	3	23.3 Å²	23.3	1%	0.013	11%	0.11	C	C	.	.	H	α-helix	trans	-53.6	-48.6	176.5	-80.3	-172	-83.7	-178.7	0	111.5	S215 E386 Y387 Q473 E474 T479 I480 F481	S215-K477 WeakPolarHBondContact O-CG 3.3Å; E386-K477 IonicContact OE1-NZ 3.9Å; E386-K477 PolarHBondContact OE1-NZ 3Å; Y387-K477 HydrophobicContact CE1-CB 4.29Å; Y387-K477 HydrophobicContact CE1-CD 4.19Å; Y387-K477 HydrophobicContact CE1-CG 4.23Å; Q473-K477 WeakPolarHBondContact O-CB 3.37Å; Q473-K477 WeakPolarHBondContact O-CG 3.47Å; Q473-K477 PolarHBondContact O-N 2.93Å; E474-K477 VanDerWaalsContact CD-CE 3.47Å; E474-K477 PolarHBondContact O-N 3.25Å; E474-K477 VanDerWaalsContact OE1-CE 3.27Å; E474-K477 WeakPolarHBondContact OE1-CE 3.46Å; E474-K477 IonicContact OE1-NZ 3.55Å; E474-K477 PolarHBondContact OE1-NZ 2.9Å; E474-K477 VanDerWaalsContact OE2-CE 3.32Å; E474-K477 WeakPolarHBondContact OE2-CE 3.33Å; E474-K477 IonicContact OE2-NZ 3.36Å; E474-K477 PolarHBondContact OE2-NZ 3.36Å; K477-T479 VanDerWaalsContact C-N 3.3Å; K477-T479 PolarHBondContact O-N 2.89Å; K477-I480 PolarHBondContact O-N 3.08Å; K477-F481 WeakPolarHBondContact O-CB 3.37Å; K477-F481 PolarHBondContact O-N 3.15Å
478	L	85.6	Confident	86	Confident	4 Å²	4	22.7 Å²	22.7	2%	0.021	11%	0.114	C	C	.	.	H	α-helix	trans	-59.1	-39.9	176.6	-73.1	172.6	0	0	0	112.4	S390 L437 E474 M475 Y476 D482 I532	S390-L478 WeakPolarHBondContact OG-CD2 3.48Å; L437-L478 HydrophobicContact CD2-CD1 3.78Å; E474-L478 WeakPolarHBondContact O-CB 3.26Å; E474-L478 VanDerWaalsContact O-CG 3.3Å; E474-L478 WeakPolarHBondContact O-CG 3.26Å; E474-L478 PolarHBondContact O-N 3.12Å; M475-L478 HydrophobicContact CE-CD1 4.24Å; M475-L478 HydrophobicContact SD-CD1 4.44Å; Y476-L478 VanDerWaalsContact C-N 3.34Å; Y476-L478 PolarHBondContact O-N 3.1Å; L478-D482 WeakPolarHBondContact O-CB 3.4Å; L478-D482 PolarHBondContact O-N 2.82Å; L478-I532 HydrophobicContact CB-CD1 4.08Å
479	T	89.4	Confident	86.2	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.006	12%	0.124	C	C	.	.	H	α-helix	trans	-68.7	-42.9	-179.6	-60.9	0	0	0	0	112.4	M475 Y476 K477 F483 I532 L543 I546 K550	M475-T479 WeakPolarHBondContact O-CB 3.34Å; M475-T479 PolarHBondContact O-N 2.9Å; M475-T479 VanDerWaalsContact O-N 3.14Å; M475-T479 PolarHBondContact O-OG1 3.28Å; Y476-T479 WeakPolarHBondContact O-CB 2.94Å; Y476-T479 PolarHBondContact O-N 3.4Å; K477-T479 VanDerWaalsContact C-N 3.3Å; K477-T479 PolarHBondContact O-N 2.89Å; T479-F483 PolarHBondContact O-N 2.8Å; T479-I532 VanDerWaalsContact OG1-CG2 3.32Å; T479-I532 WeakPolarHBondContact OG1-CG2 3.11Å; T479-L543 HydrophobicContact CG2-CD1 4.32Å; T479-I546 HydrophobicContact CG2-CG2 4.34Å; T479-K550 HydrophobicContact CG2-CD 4.17Å
480	I	89.9	Confident	86.5	Confident	34 Å²	34	24.8 Å²	24.8	17%	0.174	13%	0.127	C	C	.	.	H	α-helix	trans	-69.3	-44.6	177.6	-62.6	-57.7	0	0	0	110.3	L214 Y476 K477 D482 F483 I484 I546	L214-I480 HydrophobicContact CD2-CG2 3.97Å; Y476-I480 HydrophobicContact CD1-CG1 4.42Å; Y476-I480 HydrophobicContact CD2-CG1 4.21Å; Y476-I480 HydrophobicContact CE1-CG1 4Å; Y476-I480 HydrophobicContact CE2-CD1 3.98Å; Y476-I480 HydrophobicContact CE2-CG1 3.76Å; Y476-I480 WeakPolarHBondContact O-CG1 3.24Å; Y476-I480 PolarHBondContact O-N 3.06Å; K477-I480 PolarHBondContact O-N 3.08Å; I480-D482 PolarHBondContact O-N 3.08Å; I480-F483 WeakPolarHBondContact O-CB 3.48Å; I480-F483 PolarHBondContact O-N 2.85Å; I480-F483 VanDerWaalsContact O-N 3.14Å; I480-I484 HydrophobicContact CG2-CD1 3.88Å; I480-I484 HydrophobicContact CG2-CG1 4.46Å; I480-I484 WeakPolarHBondContact O-CG1 3.29Å; I480-I484 PolarHBondContact O-N 3.38Å; I480-I546 HydrophobicContact CD1-CG2 4.02Å
481	F	85.1	Confident	86.9	Confident	36 Å²	36	26.4 Å²	26.4	16%	0.158	14%	0.138	C	C	.	.	H	α-helix	trans	-63.5	-42.2	179.2	-167.7	-102.2	0	0	0	111.9	Y387 I391 T394 K477 F483 I484 I485	Y387-F481 HydrophobicContact CD1-CD2 4.11Å; Y387-F481 HydrophobicContact CE1-CD2 4.48Å; I391-F481 HydrophobicContact CG1-CZ 4Å; T394-F481 HydrophobicContact CG2-CD1 3.56Å; T394-F481 HydrophobicContact CG2-CE1 3.51Å; T394-F481 WeakPolarHBondContact OG1-CE1 3.49Å; K477-F481 WeakPolarHBondContact O-CB 3.37Å; K477-F481 PolarHBondContact O-N 3.15Å; F481-F483 VanDerWaalsContact C-N 3.29Å; F481-F483 PolarHBondContact O-N 3.4Å; F481-I484 PolarHBondContact O-N 3.32Å; F481-I484 VanDerWaalsContact O-N 3.17Å; F481-I485 HydrophobicContact CD1-CG1 3.95Å; F481-I485 HydrophobicContact CE1-CD1 3.92Å; F481-I485 HydrophobicContact CE1-CG1 3.62Å; F481-I485 HydrophobicContact CZ-CD1 3.86Å; F481-I485 HydrophobicContact CZ-CG1 4.02Å; F481-I485 WeakPolarHBondContact O-CG1 3.48Å; F481-I485 PolarHBondContact O-N 2.99Å
482	D	87	Confident	87.2	Confident	12 Å²	12	33.5 Å²	33.5	6%	0.064	17%	0.169	C	C	.	.	H	α-helix	trans	-55.9	-43	171.8	178.8	68.3	0	0	0	111.9	L478 I480 I485 I486 K550	L478-D482 WeakPolarHBondContact O-CB 3.4Å; L478-D482 PolarHBondContact O-N 2.82Å; I480-D482 PolarHBondContact O-N 3.08Å; D482-I485 PolarHBondContact O-N 2.58Å; D482-I486 VanDerWaalsContact O-CG1 3.29Å; D482-I486 WeakPolarHBondContact O-CG1 3.42Å; D482-I486 PolarHBondContact O-N 3.37Å; D482-K550 IonicContact OD2-NZ 2.63Å; D482-K550 PolarHBondContact OD2-NZ 3.34Å
483	F	90.9	Very high	87.1	Confident	54 Å²	54	36.7 Å²	36.7	24%	0.237	19%	0.188	C	C	.	.	H	α-helix	trans	-64.3	-43.9	175.4	-178.9	-118.5	0	0	0	112.8	T479 I480 F481 I485 I486 L487 K550 C553 V554 I557	T479-F483 PolarHBondContact O-N 2.8Å; I480-F483 WeakPolarHBondContact O-CB 3.48Å; I480-F483 PolarHBondContact O-N 2.85Å; I480-F483 VanDerWaalsContact O-N 3.14Å; F481-F483 VanDerWaalsContact C-N 3.29Å; F481-F483 PolarHBondContact O-N 3.4Å; F483-I485 VanDerWaalsContact C-N 3.33Å; F483-I485 PolarHBondContact O-N 2.87Å; F483-I486 PolarHBondContact O-N 3.36Å; F483-L487 PolarHBondContact O-N 3.22Å; F483-K550 HydrophobicContact CB-CD 3.93Å; F483-K550 HydrophobicContact CB-CG 3.99Å; F483-K550 HydrophobicContact CD2-CG 3.73Å; F483-K550 HydrophobicContact CG-CG 4.09Å; F483-C553 HydrophobicContact CE2-CB 3.66Å; F483-C553 HydrophobicContact CZ-CB 3.75Å; F483-V554 HydrophobicContact CD2-CG2 4.14Å; F483-V554 HydrophobicContact CE2-CG2 4.28Å; F483-I557 HydrophobicContact CE2-CD1 3.92Å; F483-I557 HydrophobicContact CZ-CD1 4.25Å
484	I	89.3	Confident	87.2	Confident	73 Å²	73	37.2 Å²	37.2	37%	0.374	19%	0.191	S	C	.	.	H	α-helix	trans	-61.7	-42.6	177.4	-68	168.2	0	0	0	110.3	L214 I480 F481 L487 A488	L214-I484 HydrophobicContact CD2-CD1 4.14Å; I480-I484 HydrophobicContact CG2-CD1 3.88Å; I480-I484 HydrophobicContact CG2-CG1 4.46Å; I480-I484 WeakPolarHBondContact O-CG1 3.29Å; I480-I484 PolarHBondContact O-N 3.38Å; F481-I484 PolarHBondContact O-N 3.32Å; F481-I484 VanDerWaalsContact O-N 3.17Å; I484-L487 PolarHBondContact O-N 3.5Å; I484-A488 VanDerWaalsContact O-CB 3.26Å; I484-A488 WeakPolarHBondContact O-CB 3.13Å; I484-A488 PolarHBondContact O-N 3.18Å
485	I	85.4	Confident	87.4	Confident	55 Å²	55	41.3 Å²	41.3	28%	0.282	21%	0.208	S	C	.	.	H	α-helix	trans	-64.4	-44.1	177.7	-68.7	-62.3	0	0	0	111.2	T394 F481 D482 F483 L487 A488 V489	T394-I485 HydrophobicContact CG2-CG1 4.48Å; F481-I485 HydrophobicContact CD1-CG1 3.95Å; F481-I485 HydrophobicContact CE1-CD1 3.92Å; F481-I485 HydrophobicContact CE1-CG1 3.62Å; F481-I485 HydrophobicContact CZ-CD1 3.86Å; F481-I485 HydrophobicContact CZ-CG1 4.02Å; F481-I485 WeakPolarHBondContact O-CG1 3.48Å; F481-I485 PolarHBondContact O-N 2.99Å; D482-I485 PolarHBondContact O-N 2.58Å; F483-I485 VanDerWaalsContact C-N 3.33Å; F483-I485 PolarHBondContact O-N 2.87Å; I485-L487 VanDerWaalsContact C-N 3.28Å; I485-L487 PolarHBondContact O-N 3.24Å; I485-A488 PolarHBondContact O-N 3.39Å; I485-V489 HydrophobicContact CG2-CG2 4.19Å; I485-V489 WeakPolarHBondContact O-CB 3.25Å; I485-V489 VanDerWaalsContact O-CG2 3.31Å; I485-V489 WeakPolarHBondContact O-CG2 3.21Å; I485-V489 PolarHBondContact O-N 3.42Å
486	I	87.6	Confident	87.3	Confident	6 Å²	6	43.5 Å²	43.5	3%	0.031	22%	0.222	C	C	.	.	H	α-helix	trans	-56.2	-47.1	174.7	-70.1	162.3	0	0	0	110.3	D482 F483 T490 E525 V554	D482-I486 VanDerWaalsContact O-CG1 3.29Å; D482-I486 WeakPolarHBondContact O-CG1 3.42Å; D482-I486 PolarHBondContact O-N 3.37Å; F483-I486 PolarHBondContact O-N 3.36Å; I486-T490 WeakPolarHBondContact O-CG2 3.46Å; I486-T490 PolarHBondContact O-N 2.99Å; I486-T490 VanDerWaalsContact O-N 3.1Å; I486-T490 PolarHBondContact O-OG1 2.95Å; I486-E525 HydrophobicContact CD1-CG 4.14Å; I486-E525 HydrophobicContact CG1-CG 4.26Å; I486-E525 WeakPolarHBondContact CG1-OE1 3.41Å; I486-V554 HydrophobicContact CD1-CG2 4.1Å; I486-V554 HydrophobicContact CG2-CG2 4.33Å
487	L	90.5	Very high	87.1	Confident	65 Å²	65	45.2 Å²	45.2	34%	0.34	23%	0.229	S	C	.	.	H	α-helix	trans	-63.1	-48.6	178.5	-174.7	66.8	0	0	0	111.3	F483 I484 I485 V489 T490 I491 I557	F483-L487 PolarHBondContact O-N 3.22Å; I484-L487 PolarHBondContact O-N 3.5Å; I485-L487 VanDerWaalsContact C-N 3.28Å; I485-L487 PolarHBondContact O-N 3.24Å; L487-V489 PolarHBondContact O-N 2.68Å; L487-T490 PolarHBondContact O-N 3.3Å; L487-T490 PolarHBondContact O-OG1 3.47Å; L487-I491 HydrophobicContact CD1-CD1 3.72Å; L487-I491 HydrophobicContact CD1-CG1 4.32Å; L487-I491 HydrophobicContact CD2-CD1 4.47Å; L487-I491 HydrophobicContact CG-CD1 3.78Å; L487-I491 WeakPolarHBondContact O-CG1 3.31Å; L487-I491 PolarHBondContact O-N 3.01Å; L487-I557 HydrophobicContact CD1-CD1 3.93Å
488	A	88.9	Confident	87	Confident	30 Å²	30	47.7 Å²	47.7	25%	0.248	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-44.4	-179.3	0	0	0	0	0	112	I484 I485 T490 I491 F492	I484-A488 VanDerWaalsContact O-CB 3.26Å; I484-A488 WeakPolarHBondContact O-CB 3.13Å; I484-A488 PolarHBondContact O-N 3.18Å; I485-A488 PolarHBondContact O-N 3.39Å; A488-T490 VanDerWaalsContact C-N 3.32Å; A488-T490 PolarHBondContact O-N 2.84Å; A488-I491 PolarHBondContact O-N 2.92Å; A488-F492 HydrophobicContact CB-CD2 4.06Å; A488-F492 HydrophobicContact CB-CE2 4.5Å; A488-F492 VanDerWaalsContact O-CB 3.31Å; A488-F492 WeakPolarHBondContact O-CB 3.27Å; A488-F492 WeakPolarHBondContact O-CD2 3.43Å; A488-F492 PolarHBondContact O-N 2.99Å
489	V	85.4	Confident	86.9	Confident	39 Å²	39	50.4 Å²	50.4	24%	0.236	25%	0.253	C	S	.	.	I	π-helix	trans	-61.9	-41.9	175.8	171.7	0	0	0	0	110.5	I485 L487 I491 V493 E494	I485-V489 HydrophobicContact CG2-CG2 4.19Å; I485-V489 WeakPolarHBondContact O-CB 3.25Å; I485-V489 VanDerWaalsContact O-CG2 3.31Å; I485-V489 WeakPolarHBondContact O-CG2 3.21Å; I485-V489 PolarHBondContact O-N 3.42Å; L487-V489 PolarHBondContact O-N 2.68Å; V489-I491 PolarHBondContact O-N 3.38Å; V489-V493 HydrophobicContact CG1-CB 4.25Å; V489-V493 HydrophobicContact CG1-CG2 4.47Å; V489-V493 WeakPolarHBondContact O-CA 3.29Å; V489-V493 VanDerWaalsContact O-CB 3.24Å; V489-V493 WeakPolarHBondContact O-CB 3.44Å; V489-V493 PolarHBondContact O-N 3.47Å; V489-E494 HydrophobicContact CG1-CG 4.47Å; V489-E494 PolarHBondContact O-N 3.03Å
490	T	86.8	Confident	86.7	Confident	11 Å²	11	54.5 Å²	54.5	7%	0.067	27%	0.274	C	S	.	.	I	π-helix	trans	-66.5	-37.7	179.1	63.8	0	0	0	0	113	I486 L487 A488 E494 F495 I557	I486-T490 WeakPolarHBondContact O-CG2 3.46Å; I486-T490 PolarHBondContact O-N 2.99Å; I486-T490 VanDerWaalsContact O-N 3.1Å; I486-T490 PolarHBondContact O-OG1 2.95Å; L487-T490 PolarHBondContact O-N 3.3Å; L487-T490 PolarHBondContact O-OG1 3.47Å; A488-T490 VanDerWaalsContact C-N 3.32Å; A488-T490 PolarHBondContact O-N 2.84Å; T490-E494 WeakPolarHBondContact CG2-OE2 3.31Å; T490-F495 PolarHBondContact O-N 2.68Å; T490-I557 HydrophobicContact CG2-CG2 3.58Å
491	I	88.6	Confident	86.3	Confident	84 Å²	84	54.8 Å²	54.8	43%	0.431	28%	0.277	S	S	.	.	I	π-helix	trans	-84.3	-42	-177.1	-65.8	176.3	0	0	0	112.7	L487 A488 V489 P496	L487-I491 HydrophobicContact CD1-CD1 3.72Å; L487-I491 HydrophobicContact CD1-CG1 4.32Å; L487-I491 HydrophobicContact CD2-CD1 4.47Å; L487-I491 HydrophobicContact CG-CD1 3.78Å; L487-I491 WeakPolarHBondContact O-CG1 3.31Å; L487-I491 PolarHBondContact O-N 3.01Å; A488-I491 PolarHBondContact O-N 2.92Å; V489-I491 PolarHBondContact O-N 3.38Å; I491-P496 WeakPolarHBondContact O-CD 3.26Å; I491-P496 WeakPolarHBondContact O-CG 3.32Å
492	F	87.6	Confident	86.1	Confident	155 Å²	155	60.2 Å²	60.2	68%	0.68	30%	0.301	S	S	*	.	I	π-helix	trans	-100.6	-18.7	-171.5	-63.4	-69.3	0	0	0	113.8	A488 P496	A488-F492 HydrophobicContact CB-CD2 4.06Å; A488-F492 HydrophobicContact CB-CE2 4.5Å; A488-F492 VanDerWaalsContact O-CB 3.31Å; A488-F492 WeakPolarHBondContact O-CB 3.27Å; A488-F492 WeakPolarHBondContact O-CD2 3.43Å; A488-F492 PolarHBondContact O-N 2.99Å; F492-P496 VanDerWaalsContact O-CG 3.3Å; F492-P496 WeakPolarHBondContact O-CG 3.4Å
493	V	84.3	Confident	85.9	Confident	68 Å²	68	66.7 Å²	66.7	41%	0.412	33%	0.329	S	S	.	.	I	π-helix	trans	-109.8	-58.4	178.7	-174	0	0	0	0	110.5	V489 R497	V489-V493 HydrophobicContact CG1-CB 4.25Å; V489-V493 HydrophobicContact CG1-CG2 4.47Å; V489-V493 WeakPolarHBondContact O-CA 3.29Å; V489-V493 VanDerWaalsContact O-CB 3.24Å; V489-V493 WeakPolarHBondContact O-CB 3.44Å; V489-V493 PolarHBondContact O-N 3.47Å; V493-R497 WeakPolarHBondContact O-CB 3.37Å; V493-R497 PolarHBondContact O-N 3.05Å
494	E	85.7	Confident	85.4	Confident	20 Å²	20	66.5 Å²	66.5	9%	0.093	33%	0.334	C	S	.	.	I	π-helix	trans	-68.6	-46.1	-172.2	-61.1	176.1	171.8	0	0	112.6	V489 T490 K498 S561 N565	V489-E494 HydrophobicContact CG1-CG 4.47Å; V489-E494 PolarHBondContact O-N 3.03Å; T490-E494 WeakPolarHBondContact CG2-OE2 3.31Å; E494-K498 PolarHBondContact O-N 3.3Å; E494-S561 VanDerWaalsContact OE2-CB 3.25Å; E494-S561 WeakPolarHBondContact OE2-CB 3.49Å; E494-S561 PolarHBondContact OE2-OG 2.92Å; E494-N565 HydrophobicContact CB-CB 4.49Å
495	F	85.8	Confident	84.8	Confident	101 Å²	101	69.4 Å²	69.4	44%	0.443	35%	0.35	S	S	.	.	H	α-helix	trans	-69.9	-46.2	-179	-179.1	-93.3	0	0	0	113.3	T490 R497 K498 M499	T490-F495 PolarHBondContact O-N 2.68Å; F495-R497 PolarHBondContact O-N 3.15Å; F495-K498 WeakPolarHBondContact O-CB 3.47Å; F495-K498 PolarHBondContact O-N 3.19Å; F495-M499 HydrophobicContact CD1-CG 4.33Å; F495-M499 HydrophobicContact CE1-CG 3.96Å; F495-M499 HydrophobicContact CE1-SD 4.44Å; F495-M499 HydrophobicContact CZ-CG 4.28Å; F495-M499 HydrophobicContact CZ-SD 4.28Å; F495-M499 PolarHBondContact O-N 3.08Å; F495-M499 VanDerWaalsContact O-N 3.08Å
496	P	85.7	Confident	84.6	Confident	45 Å²	45	69.7 Å²	69.7	29%	0.292	36%	0.356	S	S	.	.	H	α-helix	trans	-66.7	-36.9	177.1	-27.6	40.8	0	0	0	112.2	I491 F492 K498 M499 L500	I491-P496 WeakPolarHBondContact O-CD 3.26Å; I491-P496 WeakPolarHBondContact O-CG 3.32Å; F492-P496 VanDerWaalsContact O-CG 3.3Å; F492-P496 WeakPolarHBondContact O-CG 3.4Å; P496-K498 PolarHBondContact O-N 3.37Å; P496-M499 PolarHBondContact O-N 3.42Å; P496-L500 WeakPolarHBondContact O-CB 3.1Å; P496-L500 WeakPolarHBondContact O-CG 3.43Å; P496-L500 PolarHBondContact O-N 3.09Å
497	R	84.7	Confident	84.1	Confident	53 Å²	53	74.7 Å²	74.7	20%	0.2	39%	0.389	C	S	.	.	H	α-helix	trans	-56.3	-41.9	173.3	-179.3	175.3	176.1	171.7	4.2	111.5	V493 F495 V501 W512 G513	V493-R497 WeakPolarHBondContact O-CB 3.37Å; V493-R497 PolarHBondContact O-N 3.05Å; F495-R497 PolarHBondContact O-N 3.15Å; R497-V501 VanDerWaalsContact O-CG2 3.28Å; R497-V501 WeakPolarHBondContact O-CG2 3.11Å; R497-V501 PolarHBondContact O-N 2.89Å; R497-W512 PolarHBondContact NH2-O 3.42Å; R497-G513 PolarHBondContact NE-O 3.45Å; R497-G513 PolarHBondContact NH2-O 3.3Å
498	K	83.4	Confident	83.3	Confident	55 Å²	55	77.3 Å²	77.3	24%	0.239	40%	0.403	C	S	.	.	H	α-helix	trans	-63.9	-45	174.3	-176.6	-154.3	177.7	175	0	111.8	E494 F495 P496 V501 K502 L514 K564	E494-K498 PolarHBondContact O-N 3.3Å; F495-K498 WeakPolarHBondContact O-CB 3.47Å; F495-K498 PolarHBondContact O-N 3.19Å; P496-K498 PolarHBondContact O-N 3.37Å; K498-V501 PolarHBondContact O-N 2.75Å; K498-K502 WeakPolarHBondContact O-CB 3.3Å; K498-K502 PolarHBondContact O-N 3.49Å; K498-L514 HydrophobicContact CG-CD2 4.37Å; K498-K564 VanDerWaalsContact CD-O 3.32Å; K498-K564 WeakPolarHBondContact CD-O 3.31Å; K498-K564 WeakPolarHBondContact CE-O 3.23Å; K498-K564 PolarHBondContact NZ-O 3.1Å
499	M	82.9	Confident	82.6	Confident	61 Å²	61	76.7 Å²	76.7	30%	0.3	40%	0.396	S	S	.	.	H	α-helix	trans	-60.1	-48.3	177.7	-67.5	-74.2	88.8	0	0	111.2	F495 P496 V501 K502 F503	F495-M499 HydrophobicContact CD1-CG 4.33Å; F495-M499 HydrophobicContact CE1-CG 3.96Å; F495-M499 HydrophobicContact CE1-SD 4.44Å; F495-M499 HydrophobicContact CZ-CG 4.28Å; F495-M499 HydrophobicContact CZ-SD 4.28Å; F495-M499 PolarHBondContact O-N 3.08Å; F495-M499 VanDerWaalsContact O-N 3.08Å; P496-M499 PolarHBondContact O-N 3.42Å; M499-V501 PolarHBondContact O-N 3.33Å; M499-K502 PolarHBondContact O-N 3.31Å; M499-K502 VanDerWaalsContact O-N 3.12Å; M499-F503 HydrophobicContact CB-CD2 4.33Å; M499-F503 HydrophobicContact CE-CD2 4.37Å; M499-F503 HydrophobicContact CE-CE2 3.74Å; M499-F503 WeakPolarHBondContact O-CB 3.47Å; M499-F503 VanDerWaalsContact O-CD2 3.26Å; M499-F503 WeakPolarHBondContact O-CD2 3.44Å; M499-F503 PolarHBondContact O-N 3.33Å; M499-F503 HydrophobicContact SD-CD2 4.12Å; M499-F503 HydrophobicContact SD-CE2 3.6Å; M499-F503 VanDerWaalsContact SD-CE2 3.6Å
500	L	84.3	Confident	82	Confident	88 Å²	88	81.6 Å²	81.6	46%	0.461	41%	0.414	S	S	.	.	H	α-helix	trans	-58.3	-45.4	177.9	-73.6	168.1	0	0	0	112.4	P496 K502 C504 T509	P496-L500 WeakPolarHBondContact O-CB 3.1Å; P496-L500 WeakPolarHBondContact O-CG 3.43Å; P496-L500 PolarHBondContact O-N 3.09Å; L500-K502 VanDerWaalsContact C-N 3.3Å; L500-K502 PolarHBondContact O-N 2.75Å; L500-C504 WeakPolarHBondContact O-CA 3.46Å; L500-C504 VanDerWaalsContact O-CB 3.3Å; L500-C504 WeakPolarHBondContact O-CB 3.4Å; L500-C504 PolarHBondContact O-N 3.14Å; L500-T509 HydrophobicContact CB-CG2 4.49Å
501	V	83	Confident	81.3	Confident	39 Å²	39	88.3 Å²	88.3	24%	0.236	45%	0.447	C	S	.	.	H	α-helix	trans	-68	-29.9	178.4	175	0	0	0	0	112.2	R497 K498 M499 L514	R497-V501 VanDerWaalsContact O-CG2 3.28Å; R497-V501 WeakPolarHBondContact O-CG2 3.11Å; R497-V501 PolarHBondContact O-N 2.89Å; K498-V501 PolarHBondContact O-N 2.75Å; M499-V501 PolarHBondContact O-N 3.33Å; V501-L514 HydrophobicContact CG1-CD1 4.09Å; V501-L514 HydrophobicContact CG1-CG 4.04Å
502	K	80.5	Confident	80.4	Confident	151 Å²	151	92.9 Å²	92.9	66%	0.657	46%	0.459	S	S	*	.	H	α-helix	trans	-82	-33.8	-179.6	-170.2	178	178.4	-172.1	0	113.1	K498 M499 L500	K498-K502 WeakPolarHBondContact O-CB 3.3Å; K498-K502 PolarHBondContact O-N 3.49Å; M499-K502 PolarHBondContact O-N 3.31Å; M499-K502 VanDerWaalsContact O-N 3.12Å; L500-K502 VanDerWaalsContact C-N 3.3Å; L500-K502 PolarHBondContact O-N 2.75Å
503	F	82.6	Confident	79.7	Confident	147 Å²	147	86.1 Å²	86.1	65%	0.645	43%	0.433	S	S	*	.	H	α-helix	trans	-106.3	-21.9	-171.8	-70.3	-75	0	0	0	114.1	M499	M499-F503 HydrophobicContact CB-CD2 4.33Å; M499-F503 HydrophobicContact CE-CD2 4.37Å; M499-F503 HydrophobicContact CE-CE2 3.74Å; M499-F503 WeakPolarHBondContact O-CB 3.47Å; M499-F503 VanDerWaalsContact O-CD2 3.26Å; M499-F503 WeakPolarHBondContact O-CD2 3.44Å; M499-F503 PolarHBondContact O-N 3.33Å; M499-F503 HydrophobicContact SD-CD2 4.12Å; M499-F503 HydrophobicContact SD-CE2 3.6Å; M499-F503 VanDerWaalsContact SD-CE2 3.6Å
504	C	79.9	Confident	79.2	Confident	50 Å²	50	86.1 Å²	86.1	34%	0.338	43%	0.43	S	S	.	.			trans	-113	114.8	179.7	-61.7	0	0	0	0	111.4	L500 C506 T509	L500-C504 WeakPolarHBondContact O-CA 3.46Å; L500-C504 VanDerWaalsContact O-CB 3.3Å; L500-C504 WeakPolarHBondContact O-CB 3.4Å; L500-C504 PolarHBondContact O-N 3.14Å; C504-C506 PolarHBondContact O-N 3.07Å; C504-T509 HydrophobicContact CB-CG2 4.18Å; C504-T509 PolarHBondContact O-OG1 3.45Å
505	D	76.3	Confident	78.6	Confident	134 Å²	134	87.7 Å²	87.7	72%	0.717	44%	0.437	S	S	*	.			trans	-86.4	37.4	178.1	-104.2	-45.2	0	0	0	113.4	K510	D505-K510 WeakPolarHBondContact OD1-CE 3.46Å; D505-K510 IonicContact OD1-NZ 3.33Å; D505-K510 PolarHBondContact OD1-NZ 3.25Å; D505-K510 VanDerWaalsContact OD1-NZ 3.08Å
506	C	81.4	Confident	78.2	Confident	62 Å²	62	85.7 Å²	85.7	42%	0.419	43%	0.43	S	S	.	.			trans	-77.8	148.6	178.5	-58	0	0	0	0	111.6	C504 L508 T509 K510	C504-C506 PolarHBondContact O-N 3.07Å; C506-L508 PolarHBondContact O-N 3.13Å; C506-T509 HydrophobicContact CB-CG2 4.34Å; C506-T509 PolarHBondContact N-OG1 3.21Å; C506-T509 VanDerWaalsContact N-OG1 3.08Å; C506-T509 PolarHBondContact O-N 3.16Å; C506-T509 VanDerWaalsContact O-N 3.1Å; C506-T509 PolarHBondContact O-OG1 3.17Å; C506-K510 PolarHBondContact O-N 2.86Å
507	P	77.6	Confident	78	Confident	110 Å²	110	84 Å²	84	71%	0.714	42%	0.418	S	S	*	.	H	α-helix	trans	-60.1	-32.7	173.6	20.4	-29.8	0	0	0	112.3	K510 M511	P507-K510 PolarHBondContact O-N 3.32Å; P507-M511 WeakPolarHBondContact O-CB 3.2Å; P507-M511 PolarHBondContact O-N 3.21Å
508	L	73.1	Confident	77.5	Confident	120 Å²	120	83.2 Å²	83.2	63%	0.628	42%	0.42	S	S	*	.	H	α-helix	trans	-64.1	-41.4	173.1	-75.6	161.2	0	0	0	112.7	C506 M511 W512	C506-L508 PolarHBondContact O-N 3.13Å; L508-M511 HydrophobicContact CD2-CE 4.08Å; L508-M511 PolarHBondContact O-N 3.49Å; L508-W512 WeakPolarHBondContact O-CB 3.49Å; L508-W512 PolarHBondContact O-N 2.9Å
509	T	74.4	Confident	77.2	Confident	18 Å²	18	81.1 Å²	81.1	11%	0.11	41%	0.412	C	S	.	.	H	α-helix	trans	-72.9	-32.4	178.7	48.3	0	0	0	0	112	L500 C504 C506 W512 G513	L500-T509 HydrophobicContact CB-CG2 4.49Å; C504-T509 HydrophobicContact CB-CG2 4.18Å; C504-T509 PolarHBondContact O-OG1 3.45Å; C506-T509 HydrophobicContact CB-CG2 4.34Å; C506-T509 PolarHBondContact N-OG1 3.21Å; C506-T509 VanDerWaalsContact N-OG1 3.08Å; C506-T509 PolarHBondContact O-N 3.16Å; C506-T509 VanDerWaalsContact O-N 3.1Å; C506-T509 PolarHBondContact O-OG1 3.17Å; T509-W512 PolarHBondContact O-N 3.41Å; T509-G513 PolarHBondContact O-N 2.99Å
510	K	72.4	Confident	76.7	Confident	141 Å²	141	79 Å²	79	61%	0.613	40%	0.403	S	S	*	.	H	α-helix	trans	-66.6	-39	170.8	-74.9	179.7	-179.5	166.8	0	112.4	D505 C506 P507	D505-K510 WeakPolarHBondContact OD1-CE 3.46Å; D505-K510 IonicContact OD1-NZ 3.33Å; D505-K510 PolarHBondContact OD1-NZ 3.25Å; D505-K510 VanDerWaalsContact OD1-NZ 3.08Å; C506-K510 PolarHBondContact O-N 2.86Å; P507-K510 PolarHBondContact O-N 3.32Å
511	M	72.3	Confident	76.2	Confident	153 Å²	153	78.7 Å²	78.7	75%	0.754	40%	0.399	S	S	*	.	H	α-helix	trans	-67.9	-41	174.7	-174	174.9	68	0	0	111.9	P507 L508	P507-M511 WeakPolarHBondContact O-CB 3.2Å; P507-M511 PolarHBondContact O-N 3.21Å; L508-M511 HydrophobicContact CD2-CE 4.08Å; L508-M511 PolarHBondContact O-N 3.49Å
512	W	69.9	Low	76.2	Confident	179 Å²	179	77.5 Å²	77.5	68%	0.678	39%	0.391	S	S	*	.	H	α-helix	trans	-67.3	-40.2	178.4	-146.9	-22.3	0	0	0	111.6	R497 L508 T509	R497-W512 PolarHBondContact NH2-O 3.42Å; L508-W512 WeakPolarHBondContact O-CB 3.49Å; L508-W512 PolarHBondContact O-N 2.9Å; T509-W512 PolarHBondContact O-N 3.41Å
513	G	73.3	Confident	76.2	Confident	14 Å²	14	70.4 Å²	70.4	14%	0.144	36%	0.36	C	S	.	.			trans	63.7	172.2	173.1	0	0	0	0	0	115.3	R497 T509	R497-G513 PolarHBondContact NE-O 3.45Å; R497-G513 PolarHBondContact NH2-O 3.3Å; T509-G513 PolarHBondContact O-N 2.99Å
514	L	73.1	Confident	75.9	Confident	67 Å²	67	63.8 Å²	63.8	35%	0.351	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-68.6	141.3	174.9	-80.1	129.6	0	0	0	111.7	K498 V501 E516 R567	K498-L514 HydrophobicContact CG-CD2 4.37Å; V501-L514 HydrophobicContact CG1-CD1 4.09Å; V501-L514 HydrophobicContact CG1-CG 4.04Å; L514-E516 PolarHBondContact O-N 3.44Å; L514-R567 HydrophobicContact CB-CB 4.2Å; L514-R567 HydrophobicContact CB-CG 4.31Å
515	Q	74.8	Confident	75.9	Confident	53 Å²	53	63.1 Å²	63.1	25%	0.248	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-61.2	131.9	176.4	-179.7	69.1	48.9	0	0	110.9	C566 R567	Q515-C566 WeakPolarHBondContact O-CA 3.26Å; Q515-R567 PolarHBondContact O-N 3.22Å; Q515-R567 VanDerWaalsContact O-N 3.08Å
516	E	77.4	Confident	76.4	Confident	59 Å²	59	57 Å²	57	28%	0.276	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-89.9	141.7	168.3	-67.1	-168.1	170.1	0	0	110.8	L514 S518 R567 T570	L514-E516 PolarHBondContact O-N 3.44Å; E516-S518 PolarHBondContact O-N 3.16Å; E516-S518 VanDerWaalsContact O-N 3.09Å; E516-R567 HydrophobicContact CG-CG 3.84Å; E516-R567 VanDerWaalsContact CG-NE 3.26Å; E516-R567 IonicContact OE1-CZ 3.88Å; E516-R567 VanDerWaalsContact OE1-CZ 3.23Å; E516-R567 IonicContact OE1-NE 3.63Å; E516-R567 PolarHBondContact OE1-NE 3.21Å; E516-R567 IonicContact OE1-NH2 2.79Å; E516-R567 PolarHBondContact OE1-NH2 2.91Å; E516-T570 WeakPolarHBondContact OE1-CG2 3.44Å; E516-T570 PolarHBondContact OE1-OG1 3.05Å; E516-T570 VanDerWaalsContact OE1-OG1 3.06Å
517	F	80.3	Confident	76.6	Confident	10 Å²	10	54.3 Å²	54.3	4%	0.044	27%	0.272	C	S	.	.			trans	-77.9	92.8	174.4	-172.7	-96	0	0	0	110.6	I144 Y147 I519 N522 K558 L562 C566	I144-F517 HydrophobicContact CD1-CD1 4.13Å; I144-F517 HydrophobicContact CG1-CD1 4.1Å; I144-F517 HydrophobicContact CG2-CD1 4.43Å; I144-F517 HydrophobicContact CG2-CE1 4.25Å; Y147-F517 HydrophobicContact CD1-CE1 4.15Å; Y147-F517 AromaticContact CD1-CZ 3.77Å; Y147-F517 HydrophobicContact CD1-CZ 3.77Å; Y147-F517 HydrophobicContact CD2-CZ 4.49Å; Y147-F517 AromaticContact CE1-CZ 3.75Å; Y147-F517 HydrophobicContact CE1-CZ 3.75Å; Y147-F517 HydrophobicContact CE2-CZ 4.45Å; Y147-F517 HydrophobicContact CG-CE1 4.24Å; Y147-F517 HydrophobicContact CG-CZ 4.16Å; F517-I519 HydrophobicContact CD1-CG1 4.08Å; F517-I519 HydrophobicContact CE1-CG1 4.09Å; F517-I519 PolarHBondContact O-N 3.31Å; F517-N522 WeakPolarHBondContact CE2-ND2 3.38Å; F517-N522 HydrophobicContact CZ-CB 4.25Å; F517-K558 HydrophobicContact CE2-CD 4.5Å; F517-L562 HydrophobicContact CB-CD1 3.74Å; F517-L562 HydrophobicContact CD1-CD1 4.27Å; F517-L562 HydrophobicContact CD2-CD1 4.1Å; F517-L562 HydrophobicContact CG-CD1 3.77Å; F517-C566 HydrophobicContact CB-CB 4.22Å
518	S	74.9	Confident	76.8	Confident	37 Å²	37	49.4 Å²	49.4	26%	0.259	24%	0.24	S	C	.	.			trans	-76.6	103.5	177	-175.8	0	0	0	0	110.9	E516 Q521 N522	E516-S518 PolarHBondContact O-N 3.16Å; E516-S518 VanDerWaalsContact O-N 3.09Å; S518-Q521 PolarHBondContact O-N 3.49Å; S518-N522 PolarHBondContact O-N 3.43Å; S518-N522 PolarHBondContact O-ND2 3.35Å
519	I	77.5	Confident	77.5	Confident	11 Å²	11	43.7 Å²	43.7	6%	0.056	21%	0.21	C	C	.	.	H	α-helix	trans	-56.7	-48.3	179.4	-58	163.1	0	0	0	111.9	I144 F517 Q521 N522 V523 F573 F582	I144-I519 HydrophobicContact CG1-CD1 4.12Å; I144-I519 HydrophobicContact CG1-CG1 4.3Å; F517-I519 HydrophobicContact CD1-CG1 4.08Å; F517-I519 HydrophobicContact CE1-CG1 4.09Å; F517-I519 PolarHBondContact O-N 3.31Å; I519-Q521 PolarHBondContact O-N 2.96Å; I519-N522 PolarHBondContact O-N 3.17Å; I519-V523 HydrophobicContact CG2-CG2 4.03Å; I519-V523 VanDerWaalsContact O-CG2 3.31Å; I519-V523 WeakPolarHBondContact O-CG2 3.4Å; I519-V523 PolarHBondContact O-N 3.07Å; I519-F573 HydrophobicContact CD1-CB 4.36Å; I519-F573 HydrophobicContact CD1-CD1 4.32Å; I519-F582 HydrophobicContact CG2-CE1 4.4Å; I519-F582 HydrophobicContact CG2-CE2 4.08Å; I519-F582 HydrophobicContact CG2-CZ 3.51Å
520	P	72.3	Confident	78.4	Confident	17 Å²	17	42.9 Å²	42.9	11%	0.11	20%	0.204	C	C	.	.	H	α-helix	trans	-61.1	-40.3	-175.6	-24.1	36.1	0	0	0	113.5	I419 L423 V523 L524	I419-P520 HydrophobicContact CB-CG 4.34Å; I419-P520 HydrophobicContact CD1-CG 4.39Å; I419-P520 HydrophobicContact CG1-CG 4.19Å; I419-P520 HydrophobicContact CG2-CB 3.84Å; I419-P520 HydrophobicContact CG2-CG 3.32Å; L423-P520 HydrophobicContact CD1-CB 3.9Å; P520-V523 PolarHBondContact O-N 3.31Å; P520-L524 WeakPolarHBondContact O-CD1 3.49Å; P520-L524 VanDerWaalsContact O-CG 3.3Å; P520-L524 WeakPolarHBondContact O-CG 3.22Å; P520-L524 PolarHBondContact O-N 2.67Å
521	Q	73.9	Confident	79.2	Confident	80 Å²	80	36.3 Å²	36.3	37%	0.374	18%	0.176	S	C	.	.	H	α-helix	trans	-65.7	-44.9	178.9	-70.6	172.9	-9.2	0	0	111.7	S518 I519 V523 L524 E525	S518-Q521 PolarHBondContact O-N 3.49Å; I519-Q521 PolarHBondContact O-N 2.96Å; Q521-V523 VanDerWaalsContact C-N 3.33Å; Q521-V523 PolarHBondContact O-N 2.9Å; Q521-L524 WeakPolarHBondContact O-CB 3.31Å; Q521-L524 PolarHBondContact O-N 3.17Å; Q521-E525 PolarHBondContact O-N 3.39Å
522	N	82.1	Confident	80	Confident	15 Å²	15	29 Å²	29	8%	0.08	14%	0.141	C	C	.	.	H	α-helix	trans	-67.5	-33	177	-70.5	-71.6	0	0	0	112.1	Y147 F517 S518 I519 I526 K558	Y147-N522 HydrophobicContact CD2-CB 4.16Å; Y147-N522 HydrophobicContact CE2-CB 3.48Å; Y147-N522 VanDerWaalsContact CE2-CB 3.48Å; F517-N522 WeakPolarHBondContact CE2-ND2 3.38Å; F517-N522 HydrophobicContact CZ-CB 4.25Å; S518-N522 PolarHBondContact O-N 3.43Å; S518-N522 PolarHBondContact O-ND2 3.35Å; I519-N522 PolarHBondContact O-N 3.17Å; N522-I526 WeakPolarHBondContact O-CG1 3.24Å; N522-I526 PolarHBondContact O-N 3.27Å; N522-K558 WeakPolarHBondContact OD1-CE 3.47Å; N522-K558 PolarHBondContact OD1-NZ 2.53Å
523	V	80.6	Confident	81.1	Confident	2 Å²	2	20.5 Å²	20.5	1%	0.012	11%	0.108	C	C	.	.	H	α-helix	trans	-68.8	-38.4	175	171.3	0	0	0	0	111.6	Y147 F150 I519 P520 Q521 E525 I526 L527 F582	Y147-V523 HydrophobicContact CD2-CG2 3.84Å; F150-V523 HydrophobicContact CD1-CG1 4.48Å; F150-V523 HydrophobicContact CE1-CG1 4.09Å; I519-V523 HydrophobicContact CG2-CG2 4.03Å; I519-V523 VanDerWaalsContact O-CG2 3.31Å; I519-V523 WeakPolarHBondContact O-CG2 3.4Å; I519-V523 PolarHBondContact O-N 3.07Å; P520-V523 PolarHBondContact O-N 3.31Å; Q521-V523 VanDerWaalsContact C-N 3.33Å; Q521-V523 PolarHBondContact O-N 2.9Å; V523-E525 VanDerWaalsContact C-N 3.34Å; V523-E525 PolarHBondContact O-N 3.08Å; V523-I526 WeakPolarHBondContact O-CB 3.44Å; V523-I526 PolarHBondContact O-N 2.93Å; V523-L527 PolarHBondContact O-N 3.33Å; V523-F582 HydrophobicContact CB-CD1 4.33Å; V523-F582 HydrophobicContact CB-CE1 4.35Å; V523-F582 HydrophobicContact CG1-CB 4.33Å; V523-F582 HydrophobicContact CG1-CD1 3.73Å; V523-F582 HydrophobicContact CG1-CE1 4.23Å; V523-F582 HydrophobicContact CG1-CG 4.03Å; V523-F582 HydrophobicContact CG2-CD1 4.08Å; V523-F582 HydrophobicContact CG2-CD2 4.25Å; V523-F582 HydrophobicContact CG2-CE1 3.89Å; V523-F582 HydrophobicContact CG2-CE2 4.07Å; V523-F582 HydrophobicContact CG2-CG 4.27Å; V523-F582 HydrophobicContact CG2-CZ 3.9Å
524	L	76.4	Confident	82.1	Confident	7 Å²	7	19.9 Å²	19.9	4%	0.037	10%	0.101	C	C	.	.	H	α-helix	trans	-61.6	-40.7	175.7	-81.2	163.7	0	0	0	112.9	L423 C426 V427 R430 P520 Q521 I526 L527 Y528	L423-L524 HydrophobicContact CB-CD1 4.38Å; L423-L524 HydrophobicContact CD1-CD1 4.29Å; L423-L524 HydrophobicContact CD1-CD2 4.4Å; L423-L524 HydrophobicContact CD1-CG 3.98Å; L423-L524 HydrophobicContact CD2-CD2 3.97Å; L423-L524 HydrophobicContact CD2-CG 4.47Å; L423-L524 HydrophobicContact CG-CD1 3.93Å; L423-L524 HydrophobicContact CG-CD2 3.64Å; L423-L524 HydrophobicContact CG-CG 3.7Å; C426-L524 HydrophobicContact CB-CD1 3.55Å; C426-L524 HydrophobicContact CB-CD2 3.92Å; C426-L524 HydrophobicContact CB-CG 4.34Å; V427-L524 HydrophobicContact CB-CD2 4.37Å; V427-L524 HydrophobicContact CG2-CD2 3.29Å; R430-L524 PolarHBondContact NH1-O 3.43Å; P520-L524 WeakPolarHBondContact O-CD1 3.49Å; P520-L524 VanDerWaalsContact O-CG 3.3Å; P520-L524 WeakPolarHBondContact O-CG 3.22Å; P520-L524 PolarHBondContact O-N 2.67Å; Q521-L524 WeakPolarHBondContact O-CB 3.31Å; Q521-L524 PolarHBondContact O-N 3.17Å; L524-I526 VanDerWaalsContact C-N 3.35Å; L524-L527 PolarHBondContact O-N 3.22Å; L524-Y528 PolarHBondContact O-N 2.98Å
525	E	79.6	Confident	83	Confident	36 Å²	36	16.9 Å²	16.9	17%	0.168	9%	0.086	C	C	.	.	H	α-helix	trans	-61	-46.5	175.5	-172.3	171.1	-135.8	0	0	111	I486 Q521 V523 L527 Y528 G529 K558	I486-E525 HydrophobicContact CD1-CG 4.14Å; I486-E525 HydrophobicContact CG1-CG 4.26Å; I486-E525 WeakPolarHBondContact CG1-OE1 3.41Å; Q521-E525 PolarHBondContact O-N 3.39Å; V523-E525 VanDerWaalsContact C-N 3.34Å; V523-E525 PolarHBondContact O-N 3.08Å; E525-L527 PolarHBondContact O-N 2.95Å; E525-Y528 PolarHBondContact O-N 2.88Å; E525-G529 PolarHBondContact O-N 3.48Å; E525-K558 IonicContact OE2-NZ 2.94Å
526	I	87.2	Confident	83.8	Confident	5 Å²	5	14.4 Å²	14.4	3%	0.026	7%	0.074	C	C	.	.	H	α-helix	trans	-60	-44.9	174.3	-70.2	174.3	0	0	0	111.8	Y147 F150 L151 L154 N522 V523 L524 Y528 G529 Q530 Y551	Y147-I526 HydrophobicContact CD2-CD1 4.1Å; Y147-I526 HydrophobicContact CE2-CD1 3.25Å; Y147-I526 HydrophobicContact CE2-CG1 4.37Å; F150-I526 HydrophobicContact CD1-CG2 4.26Å; F150-I526 HydrophobicContact CE1-CG2 3.76Å; L151-I526 HydrophobicContact CB-CD1 4.35Å; L151-I526 HydrophobicContact CD1-CD1 3.9Å; L151-I526 HydrophobicContact CD1-CG1 4.38Å; L154-I526 HydrophobicContact CD1-CB 4.46Å; L154-I526 HydrophobicContact CD1-CG2 2.95Å; L154-I526 HydrophobicContact CG-CG2 4.43Å; N522-I526 WeakPolarHBondContact O-CG1 3.24Å; N522-I526 PolarHBondContact O-N 3.27Å; V523-I526 WeakPolarHBondContact O-CB 3.44Å; V523-I526 PolarHBondContact O-N 2.93Å; L524-I526 VanDerWaalsContact C-N 3.35Å; I526-Y528 PolarHBondContact O-N 3.42Å; I526-G529 PolarHBondContact O-N 3.14Å; I526-Q530 PolarHBondContact O-N 2.97Å; I526-Y551 HydrophobicContact CG1-CE1 4.41Å; I526-Y551 HydrophobicContact CG2-CE1 4.13Å; I526-Y551 PolarHBondContact O-OH 3.14Å
527	L	85.1	Confident	84.6	Confident	7 Å²	7	11.6 Å²	11.6	4%	0.037	6%	0.061	C	C	.	.	H	α-helix	trans	-59.1	-47.5	179.8	178	75.3	0	0	0	111.9	V427 V523 L524 E525 G529 Q530 T531 V585 L586	V427-L527 HydrophobicContact CB-CD2 4.46Å; V427-L527 HydrophobicContact CG1-CD2 4.18Å; V427-L527 HydrophobicContact CG2-CD2 3.52Å; V523-L527 PolarHBondContact O-N 3.33Å; L524-L527 PolarHBondContact O-N 3.22Å; E525-L527 PolarHBondContact O-N 2.95Å; L527-G529 VanDerWaalsContact C-N 3.34Å; L527-G529 PolarHBondContact O-N 2.99Å; L527-Q530 WeakPolarHBondContact O-CA 3.36Å; L527-Q530 WeakPolarHBondContact O-CB 3.31Å; L527-Q530 PolarHBondContact O-N 2.88Å; L527-T531 PolarHBondContact O-N 3.42Å; L527-T531 PolarHBondContact O-OG1 3.25Å; L527-V585 HydrophobicContact CD1-CG1 4.13Å; L527-V585 HydrophobicContact CD2-CG1 3.35Å; L527-V585 HydrophobicContact CG-CG1 4.28Å; L527-L586 HydrophobicContact CD1-CB 4.34Å; L527-L586 HydrophobicContact CD1-CD1 3.82Å
528	Y	82.6	Confident	85.1	Confident	7 Å²	7	11.2 Å²	11.2	3%	0.027	6%	0.059	C	C	.	.	H	α-helix	trans	-57.9	-46.6	178.7	170.5	-105.4	0	0	0	111.9	R430 I434 L524 E525 I526 Q530 T531 I532	R430-Y528 HydrophobicContact CB-CD2 3.92Å; R430-Y528 HydrophobicContact CG-CD2 4.29Å; I434-Y528 HydrophobicContact CD1-CD2 3.88Å; I434-Y528 HydrophobicContact CD1-CE2 3.7Å; I434-Y528 HydrophobicContact CG1-CE2 3.88Å; L524-Y528 PolarHBondContact O-N 2.98Å; E525-Y528 PolarHBondContact O-N 2.88Å; I526-Y528 PolarHBondContact O-N 3.42Å; Y528-Q530 PolarHBondContact O-N 3.49Å; Y528-T531 WeakPolarHBondContact CA-OG1 3.3Å; Y528-T531 PolarHBondContact O-N 3.25Å; Y528-T531 PolarHBondContact O-OG1 2.91Å; Y528-I532 HydrophobicContact CD1-CD1 3.94Å; Y528-I532 HydrophobicContact CD2-CD1 4.35Å; Y528-I532 HydrophobicContact CE1-CD1 3.41Å; Y528-I532 VanDerWaalsContact CE1-CD1 3.41Å; Y528-I532 HydrophobicContact CE2-CD1 3.9Å; Y528-I532 HydrophobicContact CG-CD1 4.38Å; Y528-I532 WeakPolarHBondContact O-CG1 3.39Å; Y528-I532 PolarHBondContact O-N 3.49Å; Y528-I532 VanDerWaalsContact O-N 3.09Å
529	G	87.9	Confident	85.9	Confident	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-60.1	-34.2	173.6	0	0	0	0	0	112.9	E525 I526 L527 C533 Y551	E525-G529 PolarHBondContact O-N 3.48Å; I526-G529 PolarHBondContact O-N 3.14Å; L527-G529 VanDerWaalsContact C-N 3.34Å; L527-G529 PolarHBondContact O-N 2.99Å; G529-C533 PolarHBondContact O-N 3.4Å; G529-Y551 WeakPolarHBondContact CA-OH 3.47Å
530	Q	92.6	Very high	86.6	Confident	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-74.7	-37	-179.4	-171.1	60.1	43	0	0	112	L154 L157 N158 I526 L527 Y528 I532 C533 W534 Y551 L586	L154-Q530 HydrophobicContact CD2-CG 3.98Å; L157-Q530 VanDerWaalsContact CD2-NE2 3.27Å; N158-Q530 PolarHBondContact ND2-OE1 2.84Å; N158-Q530 PolarHBondContact OD1-NE2 3.3Å; N158-Q530 PolarHBondContact OD1-OE1 2.92Å; I526-Q530 PolarHBondContact O-N 2.97Å; L527-Q530 WeakPolarHBondContact O-CA 3.36Å; L527-Q530 WeakPolarHBondContact O-CB 3.31Å; L527-Q530 PolarHBondContact O-N 2.88Å; Y528-Q530 PolarHBondContact O-N 3.49Å; Q530-I532 VanDerWaalsContact C-N 3.35Å; Q530-C533 WeakPolarHBondContact O-CB 3.29Å; Q530-C533 PolarHBondContact O-N 2.9Å; Q530-W534 HydrophobicContact CG-CD2 4.17Å; Q530-W534 HydrophobicContact CG-CE3 4.25Å; Q530-W534 HydrophobicContact CG-CH2 3.78Å; Q530-W534 HydrophobicContact CG-CZ2 3.66Å; Q530-W534 HydrophobicContact CG-CZ3 4.04Å; Q530-W534 PolarHBondContact O-N 3.36Å; Q530-Y551 PolarHBondContact N-OH 2.84Å; Q530-L586 HydrophobicContact CB-CD1 4.33Å; Q530-L586 HydrophobicContact CG-CD1 3.89Å
531	T	89	Confident	87.6	Confident	4 Å²	4	8.6 Å²	8.6	3%	0.025	4%	0.041	C	C	.	.	H	α-helix	trans	-64.3	-40.6	173.4	47.9	0	0	0	0	111.7	L431 L527 Y528 C533 W534 I535	L431-T531 HydrophobicContact CD2-CG2 4.38Å; L527-T531 PolarHBondContact O-N 3.42Å; L527-T531 PolarHBondContact O-OG1 3.25Å; Y528-T531 WeakPolarHBondContact CA-OG1 3.3Å; Y528-T531 PolarHBondContact O-N 3.25Å; Y528-T531 PolarHBondContact O-OG1 2.91Å; T531-C533 VanDerWaalsContact C-N 3.33Å; T531-C533 PolarHBondContact O-N 3.36Å; T531-W534 HydrophobicContact CG2-CE3 4.31Å; T531-W534 HydrophobicContact CG2-CZ3 4.31Å; T531-W534 PolarHBondContact O-N 3.31Å; T531-I535 WeakPolarHBondContact O-CG1 3.09Å; T531-I535 PolarHBondContact O-N 2.58Å; T531-I535 VanDerWaalsContact O-N 3.1Å
532	I	89.1	Confident	88.4	Confident	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-62.3	-42.6	172.5	-67.8	165	0	0	0	110.4	I434 M475 L478 T479 Y528 Q530 W534 I535 G536 L543	I434-I532 HydrophobicContact CD1-CG1 4.12Å; M475-I532 HydrophobicContact CB-CG2 4.28Å; M475-I532 HydrophobicContact SD-CG2 4.11Å; L478-I532 HydrophobicContact CB-CD1 4.08Å; T479-I532 VanDerWaalsContact OG1-CG2 3.32Å; T479-I532 WeakPolarHBondContact OG1-CG2 3.11Å; Y528-I532 HydrophobicContact CD1-CD1 3.94Å; Y528-I532 HydrophobicContact CD2-CD1 4.35Å; Y528-I532 HydrophobicContact CE1-CD1 3.41Å; Y528-I532 VanDerWaalsContact CE1-CD1 3.41Å; Y528-I532 HydrophobicContact CE2-CD1 3.9Å; Y528-I532 HydrophobicContact CG-CD1 4.38Å; Y528-I532 WeakPolarHBondContact O-CG1 3.39Å; Y528-I532 PolarHBondContact O-N 3.49Å; Y528-I532 VanDerWaalsContact O-N 3.09Å; Q530-I532 VanDerWaalsContact C-N 3.35Å; I532-W534 PolarHBondContact O-N 3.45Å; I532-I535 PolarHBondContact O-N 3.14Å; I532-G536 WeakPolarHBondContact O-CA 3.36Å; I532-G536 PolarHBondContact O-N 2.65Å; I532-L543 HydrophobicContact CG2-CD2 4.48Å
533	C	93.9	Very high	89	Confident	0 Å²	0	6.8 Å²	6.8	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-57.9	-47.2	176.8	-172.3	0	0	0	0	111.4	N158 G529 Q530 T531 T537 C547	N158-C533 PolarHBondContact OD1-SG 3.49Å; G529-C533 PolarHBondContact O-N 3.4Å; Q530-C533 WeakPolarHBondContact O-CB 3.29Å; Q530-C533 PolarHBondContact O-N 2.9Å; T531-C533 VanDerWaalsContact C-N 3.33Å; T531-C533 PolarHBondContact O-N 3.36Å; C533-T537 WeakPolarHBondContact O-CB 3.48Å; C533-T537 PolarHBondContact O-N 3.47Å; C533-T537 PolarHBondContact O-OG1 2.95Å; C533-C547 HydrophobicContact CB-CB 4.35Å; C533-C547 VanDerWaalsContact SG-SG 3.64Å
534	W	94.4	Very high	89.8	Confident	0 Å²	0	6.7 Å²	6.7	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-65.5	-44.9	-178.6	-70.3	-40	0	0	0	113.7	L157 Y255 I263 Q530 T531 I532 L586 L590 A593	L157-W534 HydrophobicContact CD2-CZ2 4.44Å; Y255-W534 PolarHBondContact OH-O 3.09Å; I263-W534 HydrophobicContact CD1-CH2 4.06Å; I263-W534 HydrophobicContact CD1-CZ2 3.95Å; Q530-W534 HydrophobicContact CG-CD2 4.17Å; Q530-W534 HydrophobicContact CG-CE3 4.25Å; Q530-W534 HydrophobicContact CG-CH2 3.78Å; Q530-W534 HydrophobicContact CG-CZ2 3.66Å; Q530-W534 HydrophobicContact CG-CZ3 4.04Å; Q530-W534 PolarHBondContact O-N 3.36Å; T531-W534 HydrophobicContact CG2-CE3 4.31Å; T531-W534 HydrophobicContact CG2-CZ3 4.31Å; T531-W534 PolarHBondContact O-N 3.31Å; I532-W534 PolarHBondContact O-N 3.45Å; W534-L586 HydrophobicContact CH2-CD1 3.4Å; W534-L586 HydrophobicContact CH2-CG 3.8Å; W534-L586 HydrophobicContact CZ2-CD1 4.16Å; W534-L586 HydrophobicContact CZ3-CD1 4.11Å; W534-L590 HydrophobicContact CD2-CD1 3.69Å; W534-L590 HydrophobicContact CE3-CB 4.15Å; W534-L590 HydrophobicContact CE3-CD1 3.92Å; W534-L590 HydrophobicContact CG-CD1 4.15Å; W534-L590 HydrophobicContact CH2-CB 3.71Å; W534-L590 HydrophobicContact CH2-CD1 4.19Å; W534-L590 HydrophobicContact CH2-CG 4.47Å; W534-L590 HydrophobicContact CZ2-CB 4.31Å; W534-L590 HydrophobicContact CZ2-CD1 4Å; W534-L590 HydrophobicContact CZ3-CB 3.66Å; W534-L590 HydrophobicContact CZ3-CD1 4.2Å; W534-A593 HydrophobicContact CB-CB 3.68Å; W534-A593 HydrophobicContact CE3-CB 4.08Å; W534-A593 HydrophobicContact CG-CB 4.5Å
535	I	90.6	Very high	90.7	Very high	5 Å²	5	7.1 Å²	7.1	3%	0.026	4%	0.037	C	C	.	.	H	α-helix	trans	-65.8	-49.5	176.7	-63.9	170.5	0	0	0	109.7	I434 L438 M475 T531 I532 T537 F538 Y539 A593 P596	I434-I535 HydrophobicContact CG2-CD1 3.85Å; L438-I535 HydrophobicContact CD1-CG2 4.46Å; M475-I535 HydrophobicContact SD-CG2 4.29Å; T531-I535 WeakPolarHBondContact O-CG1 3.09Å; T531-I535 PolarHBondContact O-N 2.58Å; T531-I535 VanDerWaalsContact O-N 3.1Å; I532-I535 PolarHBondContact O-N 3.14Å; I535-T537 VanDerWaalsContact C-N 3.32Å; I535-T537 PolarHBondContact O-N 3.18Å; I535-F538 PolarHBondContact O-N 3.47Å; I535-Y539 HydrophobicContact CG2-CE2 4.35Å; I535-Y539 WeakPolarHBondContact O-CD2 3.25Å; I535-A593 HydrophobicContact CD1-CB 4.39Å; I535-A593 HydrophobicContact CG1-CB 3.76Å; I535-P596 HydrophobicContact CD1-CG 4Å; I535-P596 HydrophobicContact CG1-CG 4.12Å
536	G	91.4	Very high	91.4	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-69.1	-23.9	-176.2	0	0	0	0	0	114	I532 F538 Y539 C540	I532-G536 WeakPolarHBondContact O-CA 3.36Å; I532-G536 PolarHBondContact O-N 2.65Å; G536-F538 PolarHBondContact O-N 2.72Å; G536-Y539 CarbonylContact O-C 3.04Å; G536-Y539 PolarHBondContact O-N 3.28Å; G536-C540 CarbonylContact O-C 3.57Å; G536-C540 WeakPolarHBondContact O-CA 3.14Å; G536-C540 WeakPolarHBondContact O-CB 3.47Å; G536-C540 PolarHBondContact O-N 3.21Å
537	T	94.2	Very high	91.8	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-58.5	-33.4	176.2	-59.2	0	0	0	0	112	I161 M165 Y255 C533 I535 P544	I161-T537 HydrophobicContact CG2-CG2 3.93Å; M165-T537 HydrophobicContact CE-CG2 4.43Å; M165-T537 HydrophobicContact CG-CG2 3.67Å; M165-T537 HydrophobicContact SD-CG2 4.12Å; Y255-T537 HydrophobicContact CD1-CG2 4.02Å; Y255-T537 HydrophobicContact CE1-CG2 3.57Å; Y255-T537 HydrophobicContact CE2-CG2 4.47Å; C533-T537 WeakPolarHBondContact O-CB 3.48Å; C533-T537 PolarHBondContact O-N 3.47Å; C533-T537 PolarHBondContact O-OG1 2.95Å; I535-T537 VanDerWaalsContact C-N 3.32Å; I535-T537 PolarHBondContact O-N 3.18Å; T537-P544 HydrophobicContact CG2-CG 3.76Å; T537-P544 WeakPolarHBondContact OG1-CG 3.16Å
538	F	92.8	Very high	92.3	Very high	2 Å²	2	7.6 Å²	7.6	1%	0.009	4%	0.041	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-28.1	176.8	-178.9	-95.1	0	0	0	113.3	Y248 T252 I535 G536 I597 V601 F613	Y248-F538 HydrophobicContact CD1-CE2 4.14Å; Y248-F538 AromaticContact CE1-CD2 3.89Å; Y248-F538 HydrophobicContact CE1-CD2 3.89Å; Y248-F538 AromaticContact CE1-CE2 3.81Å; Y248-F538 HydrophobicContact CE1-CE2 3.81Å; Y248-F538 HydrophobicContact CE1-CZ 4.39Å; Y248-F538 WeakPolarHBondContact CE1-O 3.42Å; Y248-F538 PolarHBondContact OH-O 2.71Å; T252-F538 HydrophobicContact CG2-CD2 3.56Å; T252-F538 HydrophobicContact CG2-CE2 4.22Å; I535-F538 PolarHBondContact O-N 3.47Å; G536-F538 PolarHBondContact O-N 2.72Å; F538-I597 HydrophobicContact CD2-CG2 4.46Å; F538-V601 HydrophobicContact CE2-CG2 3.9Å; F538-V601 HydrophobicContact CZ-CG2 3.99Å; F538-F613 HydrophobicContact CE2-CE2 4.42Å; F538-F613 HydrophobicContact CZ-CE2 4.25Å
539	Y	90.7	Very high	92.9	Very high	10 Å²	10	12.5 Å²	12.5	4%	0.039	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-18.7	-179	-57.9	-75.1	0	0	0	113.1	Y227 W467 E468 V471 I535 G536 S600	Y227-Y539 WeakPolarHBondContact CB-O 3.17Å; Y227-Y539 PolarHBondContact N-O 3.33Å; W467-Y539 HydrophobicContact CH2-CE1 4.44Å; W467-Y539 HydrophobicContact CZ3-CE1 4.13Å; E468-Y539 HydrophobicContact CB-CD1 4.06Å; E468-Y539 HydrophobicContact CB-CE1 4.4Å; E468-Y539 HydrophobicContact CG-CE1 4.5Å; E468-Y539 WeakPolarHBondContact O-CD1 3.37Å; V471-Y539 HydrophobicContact CB-CD1 4.18Å; V471-Y539 HydrophobicContact CB-CD2 4.46Å; V471-Y539 HydrophobicContact CB-CE1 4.37Å; V471-Y539 HydrophobicContact CB-CG 4.23Å; V471-Y539 HydrophobicContact CG1-CD1 4.18Å; V471-Y539 HydrophobicContact CG1-CD2 3.63Å; V471-Y539 HydrophobicContact CG1-CE1 4.22Å; V471-Y539 HydrophobicContact CG1-CE2 3.68Å; V471-Y539 HydrophobicContact CG1-CG 3.89Å; I535-Y539 HydrophobicContact CG2-CE2 4.35Å; I535-Y539 WeakPolarHBondContact O-CD2 3.25Å; G536-Y539 CarbonylContact O-C 3.04Å; G536-Y539 PolarHBondContact O-N 3.28Å; Y539-S600 VanDerWaalsContact OH-CB 3.24Å; Y539-S600 WeakPolarHBondContact OH-CB 3.34Å; Y539-S600 PolarHBondContact OH-OG 3.39Å
540	C	91.9	Very high	93.2	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.068	C	C	.	.			trans	-142	84.5	-176.3	-178.7	0	0	0	0	108.5	L225 G536 M542 L543	L225-C540 WeakPolarHBondContact CD1-SG 3.5Å; L225-C540 CarbonylContact O-C 3.58Å; L225-C540 VanDerWaalsContact O-CA 3.22Å; L225-C540 WeakPolarHBondContact O-CA 3.35Å; L225-C540 PolarHBondContact O-SG 3.44Å; G536-C540 CarbonylContact O-C 3.57Å; G536-C540 WeakPolarHBondContact O-CA 3.14Å; G536-C540 WeakPolarHBondContact O-CB 3.47Å; G536-C540 PolarHBondContact O-N 3.21Å; C540-M542 PolarHBondContact O-N 3.49Å; C540-M542 VanDerWaalsContact O-N 3.11Å; C540-L543 HydrophobicContact CB-CB 4.06Å; C540-L543 WeakPolarHBondContact O-CB 3.27Å; C540-L543 PolarHBondContact O-N 3.21Å
541	P	92.6	Very high	93.3	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-24.6	-174.4	-31.6	39.5	0	0	0	115.7	M165 L225 Y230 Y248 P544	M165-P541 HydrophobicContact CE-CB 3.79Å; M165-P541 HydrophobicContact CE-CG 4.06Å; L225-P541 WeakPolarHBondContact O-CD 3.47Å; Y230-P541 HydrophobicContact CD2-CG 4.43Å; Y230-P541 HydrophobicContact CE2-CB 4.42Å; Y230-P541 HydrophobicContact CE2-CG 3.73Å; Y248-P541 HydrophobicContact CE2-CG 3.95Å; Y248-P541 WeakPolarHBondContact OH-CG 3.26Å; P541-P544 WeakPolarHBondContact O-CD 3.4Å
542	M	92.3	Very high	93.6	Very high	57 Å²	57	16.7 Å²	16.7	28%	0.281	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-2.8	175.3	-69.2	-151.7	85.7	0	0	114.1	F162 M170 L225 C540 P544 A545 I546	F162-M542 HydrophobicContact CE2-CE 3.75Å; F162-M542 HydrophobicContact CZ-CE 4.23Å; M170-M542 HydrophobicContact CE-CG 4.21Å; M170-M542 HydrophobicContact SD-CE 4.29Å; M170-M542 HydrophobicContact SD-CG 3.63Å; M170-M542 HydrophobicContact SD-SD 4.28Å; L225-M542 HydrophobicContact CD1-CB 3.86Å; C540-M542 PolarHBondContact O-N 3.49Å; C540-M542 VanDerWaalsContact O-N 3.11Å; M542-P544 VanDerWaalsContact C-CD 3.43Å; M542-P544 VanDerWaalsContact C-N 3.32Å; M542-A545 HydrophobicContact CE-CB 4.44Å; M542-A545 WeakPolarHBondContact O-CB 3.37Å; M542-A545 PolarHBondContact O-N 3.31Å; M542-I546 PolarHBondContact O-N 3.11Å
543	L	94	Very high	93.8	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-54.7	-40.3	177.9	-164.5	68.1	0	0	0	113.3	M475 T479 I532 C540 A545 I546 C547	M475-L543 HydrophobicContact CB-CD2 4.4Å; T479-L543 HydrophobicContact CG2-CD1 4.32Å; I532-L543 HydrophobicContact CG2-CD2 4.48Å; C540-L543 HydrophobicContact CB-CB 4.06Å; C540-L543 WeakPolarHBondContact O-CB 3.27Å; C540-L543 PolarHBondContact O-N 3.21Å; L543-A545 VanDerWaalsContact C-N 3.26Å; L543-A545 PolarHBondContact O-N 3.4Å; L543-I546 WeakPolarHBondContact O-CB 3.5Å; L543-I546 PolarHBondContact O-N 3.16Å; L543-I546 VanDerWaalsContact O-N 3.1Å; L543-C547 PolarHBondContact O-N 3.08Å; L543-C547 PolarHBondContact O-SG 2.81Å; L543-C547 VanDerWaalsContact O-SG 3.36Å
544	P	96.4	Very high	93.8	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.2	-31.9	174.8	-26	36.4	0	0	0	114.3	I161 F162 T537 P541 M542 T548	I161-P544 HydrophobicContact CB-CB 4.13Å; I161-P544 HydrophobicContact CB-CG 4.29Å; I161-P544 HydrophobicContact CG2-CB 3.94Å; I161-P544 HydrophobicContact CG2-CG 3.54Å; F162-P544 HydrophobicContact CB-CB 3.95Å; T537-P544 HydrophobicContact CG2-CG 3.76Å; T537-P544 WeakPolarHBondContact OG1-CG 3.16Å; P541-P544 WeakPolarHBondContact O-CD 3.4Å; M542-P544 VanDerWaalsContact C-CD 3.43Å; M542-P544 VanDerWaalsContact C-N 3.32Å; P544-T548 WeakPolarHBondContact O-CB 3.4Å; P544-T548 PolarHBondContact O-N 3.06Å; P544-T548 PolarHBondContact O-OG1 3.24Å
545	A	95.7	Very high	93.8	Very high	16 Å²	16	19 Å²	19	13%	0.132	10%	0.1	C	C	.	.	H	α-helix	trans	-67.5	-45.7	174.2	0	0	0	0	0	110.8	F162 M542 L543 C547 T548 I549	F162-A545 HydrophobicContact CD2-CB 3.63Å; F162-A545 HydrophobicContact CE2-CB 3.84Å; F162-A545 HydrophobicContact CG-CB 3.99Å; F162-A545 HydrophobicContact CZ-CB 4.39Å; M542-A545 HydrophobicContact CE-CB 4.44Å; M542-A545 WeakPolarHBondContact O-CB 3.37Å; M542-A545 PolarHBondContact O-N 3.31Å; L543-A545 VanDerWaalsContact C-N 3.26Å; L543-A545 PolarHBondContact O-N 3.4Å; A545-C547 VanDerWaalsContact C-N 3.34Å; A545-C547 PolarHBondContact O-N 2.89Å; A545-T548 WeakPolarHBondContact O-CB 3.32Å; A545-T548 PolarHBondContact O-N 2.72Å; A545-T548 VanDerWaalsContact O-N 3.15Å; A545-I549 WeakPolarHBondContact O-CG1 3.16Å; A545-I549 PolarHBondContact O-N 3.48Å
546	I	95	Very high	93.9	Very high	38 Å²	38	23.2 Å²	23.2	20%	0.195	12%	0.116	C	C	.	.	H	α-helix	trans	-60.9	-44.8	175.9	-62.6	162.8	0	0	0	110.1	L225 Y476 T479 I480 M542 L543 T548 I549 K550	L225-I546 HydrophobicContact CD1-CD1 3.57Å; Y476-I546 HydrophobicContact CD2-CD1 3.78Å; Y476-I546 HydrophobicContact CE2-CD1 3.68Å; T479-I546 HydrophobicContact CG2-CG2 4.34Å; I480-I546 HydrophobicContact CD1-CG2 4.02Å; M542-I546 PolarHBondContact O-N 3.11Å; L543-I546 WeakPolarHBondContact O-CB 3.5Å; L543-I546 PolarHBondContact O-N 3.16Å; L543-I546 VanDerWaalsContact O-N 3.1Å; I546-T548 VanDerWaalsContact C-N 3.3Å; I546-T548 PolarHBondContact O-N 3.36Å; I546-I549 PolarHBondContact O-N 2.86Å; I546-K550 WeakPolarHBondContact O-CB 3.16Å; I546-K550 PolarHBondContact O-N 3.17Å
547	C	95.6	Very high	93.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.3	-35.1	175.7	-68	0	0	0	0	112.5	C533 L543 A545 K550 Y551	C533-C547 HydrophobicContact CB-CB 4.35Å; C533-C547 VanDerWaalsContact SG-SG 3.64Å; L543-C547 PolarHBondContact O-N 3.08Å; L543-C547 PolarHBondContact O-SG 2.81Å; L543-C547 VanDerWaalsContact O-SG 3.36Å; A545-C547 VanDerWaalsContact C-N 3.34Å; A545-C547 PolarHBondContact O-N 2.89Å; C547-K550 PolarHBondContact O-N 2.94Å; C547-Y551 HydrophobicContact CB-CD2 4.46Å; C547-Y551 HydrophobicContact CB-CE2 4.31Å; C547-Y551 WeakPolarHBondContact O-CB 3.49Å; C547-Y551 WeakPolarHBondContact O-CD2 3.34Å; C547-Y551 PolarHBondContact O-N 2.93Å
548	T	95.3	Very high	93.8	Very high	20 Å²	20	25 Å²	25	12%	0.123	13%	0.125	C	C	.	.	H	α-helix	trans	-62.9	-47.5	174.6	-58.8	0	0	0	0	110.6	V155 N158 L159 P544 A545 I546 F552	V155-T548 HydrophobicContact CG1-CG2 3.99Å; N158-T548 WeakPolarHBondContact CB-OG1 3.45Å; L159-T548 HydrophobicContact CB-CG2 4.23Å; L159-T548 HydrophobicContact CD1-CG2 4.48Å; L159-T548 PolarHBondContact N-OG1 3.44Å; P544-T548 WeakPolarHBondContact O-CB 3.4Å; P544-T548 PolarHBondContact O-N 3.06Å; P544-T548 PolarHBondContact O-OG1 3.24Å; A545-T548 WeakPolarHBondContact O-CB 3.32Å; A545-T548 PolarHBondContact O-N 2.72Å; A545-T548 VanDerWaalsContact O-N 3.15Å; I546-T548 VanDerWaalsContact C-N 3.3Å; I546-T548 PolarHBondContact O-N 3.36Å; T548-F552 WeakPolarHBondContact O-CB 3.5Å; T548-F552 PolarHBondContact O-N 2.99Å
549	I	95.5	Very high	93.7	Very high	111 Å²	111	26.3 Å²	26.3	57%	0.569	13%	0.131	S	C	*	.	H	α-helix	trans	-63.1	-45.9	175.3	-63.6	167.7	0	0	0	110.3	A545 I546 Y551 F552 C553	A545-I549 WeakPolarHBondContact O-CG1 3.16Å; A545-I549 PolarHBondContact O-N 3.48Å; I546-I549 PolarHBondContact O-N 2.86Å; I549-Y551 PolarHBondContact O-N 3.41Å; I549-F552 WeakPolarHBondContact O-CB 3.27Å; I549-F552 PolarHBondContact O-N 3.26Å; I549-C553 PolarHBondContact O-N 3.36Å; I549-C553 PolarHBondContact O-SG 3.1Å; I549-C553 VanDerWaalsContact O-SG 3.41Å
550	K	94.6	Very high	93.7	Very high	8 Å²	8	31 Å²	31	4%	0.035	16%	0.156	C	C	.	.	H	α-helix	trans	-53.1	-56.1	176.8	-175.1	-179.3	82.9	165.1	0	110.9	T479 D482 F483 I546 C547 F552 C553 V554	T479-K550 HydrophobicContact CG2-CD 4.17Å; D482-K550 IonicContact OD2-NZ 2.63Å; D482-K550 PolarHBondContact OD2-NZ 3.34Å; F483-K550 HydrophobicContact CB-CD 3.93Å; F483-K550 HydrophobicContact CB-CG 3.99Å; F483-K550 HydrophobicContact CD2-CG 3.73Å; F483-K550 HydrophobicContact CG-CG 4.09Å; I546-K550 WeakPolarHBondContact O-CB 3.16Å; I546-K550 PolarHBondContact O-N 3.17Å; C547-K550 PolarHBondContact O-N 2.94Å; K550-F552 VanDerWaalsContact C-N 3.27Å; K550-F552 PolarHBondContact O-N 2.78Å; K550-C553 PolarHBondContact O-N 3.29Å; K550-V554 HydrophobicContact CG-CG2 4.28Å; K550-V554 WeakPolarHBondContact O-CB 3.38Å; K550-V554 VanDerWaalsContact O-CG2 3.24Å; K550-V554 WeakPolarHBondContact O-CG2 3.19Å; K550-V554 PolarHBondContact O-N 3.02Å
551	Y	95.1	Very high	93.5	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.016	16%	0.157	C	C	.	.	H	α-helix	trans	-68	-28	-177.6	-70.4	-50.4	0	0	0	113.1	L151 N158 I526 G529 Q530 C547 I549 F555	L151-Y551 HydrophobicContact CD1-CD1 3.63Å; L151-Y551 HydrophobicContact CD1-CE1 4.49Å; L151-Y551 HydrophobicContact CD1-CG 4.01Å; N158-Y551 VanDerWaalsContact ND2-CD2 3.31Å; N158-Y551 WeakPolarHBondContact ND2-CD2 3.45Å; N158-Y551 WeakPolarHBondContact ND2-CE2 3.24Å; I526-Y551 HydrophobicContact CG1-CE1 4.41Å; I526-Y551 HydrophobicContact CG2-CE1 4.13Å; I526-Y551 PolarHBondContact O-OH 3.14Å; G529-Y551 WeakPolarHBondContact CA-OH 3.47Å; Q530-Y551 PolarHBondContact N-OH 2.84Å; C547-Y551 HydrophobicContact CB-CD2 4.46Å; C547-Y551 HydrophobicContact CB-CE2 4.31Å; C547-Y551 WeakPolarHBondContact O-CB 3.49Å; C547-Y551 WeakPolarHBondContact O-CD2 3.34Å; C547-Y551 PolarHBondContact O-N 2.93Å; I549-Y551 PolarHBondContact O-N 3.41Å; Y551-F555 PolarHBondContact O-N 3.36Å
552	F	94.3	Very high	93.3	Very high	80 Å²	80	31.1 Å²	31.1	35%	0.351	16%	0.157	S	C	.	.	H	α-helix	trans	-64.2	-47.8	170	-174.1	-83.2	0	0	0	111.9	L128 W129 T548 I549 K550 F555 Y556	L128-F552 HydrophobicContact CD1-CE2 4.31Å; L128-F552 HydrophobicContact CD2-CD2 4.17Å; L128-F552 HydrophobicContact CD2-CE2 4.03Å; W129-F552 HydrophobicContact CH2-CB 4.26Å; W129-F552 AromaticContact CH2-CD2 3.44Å; W129-F552 HydrophobicContact CH2-CD2 3.44Å; W129-F552 VanDerWaalsContact CH2-CD2 3.44Å; W129-F552 HydrophobicContact CH2-CE2 4.01Å; W129-F552 AromaticContact CH2-CG 3.99Å; W129-F552 HydrophobicContact CH2-CG 3.99Å; W129-F552 HydrophobicContact CZ2-CD1 4.44Å; W129-F552 AromaticContact CZ2-CD2 3.23Å; W129-F552 HydrophobicContact CZ2-CD2 3.23Å; W129-F552 AromaticContact CZ2-CE2 3.34Å; W129-F552 HydrophobicContact CZ2-CE2 3.34Å; W129-F552 AromaticContact CZ2-CG 3.82Å; W129-F552 HydrophobicContact CZ2-CG 3.82Å; W129-F552 HydrophobicContact CZ2-CZ 4.02Å; T548-F552 WeakPolarHBondContact O-CB 3.5Å; T548-F552 PolarHBondContact O-N 2.99Å; I549-F552 WeakPolarHBondContact O-CB 3.27Å; I549-F552 PolarHBondContact O-N 3.26Å; K550-F552 VanDerWaalsContact C-N 3.27Å; K550-F552 PolarHBondContact O-N 2.78Å; F552-F555 WeakPolarHBondContact O-CB 3.44Å; F552-F555 PolarHBondContact O-N 2.78Å; F552-Y556 HydrophobicContact CD1-CD2 4.28Å; F552-Y556 HydrophobicContact CD1-CE2 4.09Å; F552-Y556 HydrophobicContact CE1-CD2 4.04Å; F552-Y556 AromaticContact CE1-CE2 3.5Å; F552-Y556 HydrophobicContact CE1-CE2 3.5Å; F552-Y556 HydrophobicContact CE2-CE2 4.29Å; F552-Y556 AromaticContact CZ-CE2 3.61Å; F552-Y556 HydrophobicContact CZ-CE2 3.61Å; F552-Y556 WeakPolarHBondContact O-CD2 3.49Å
553	C	94.4	Very high	93	Very high	45 Å²	45	31.2 Å²	31.2	30%	0.304	16%	0.158	S	C	.	.	H	α-helix	trans	-63.2	-45.5	174.5	-66.9	0	0	0	0	111.9	F483 I549 K550 F555 Y556 I557	F483-C553 HydrophobicContact CE2-CB 3.66Å; F483-C553 HydrophobicContact CZ-CB 3.75Å; I549-C553 PolarHBondContact O-N 3.36Å; I549-C553 PolarHBondContact O-SG 3.1Å; I549-C553 VanDerWaalsContact O-SG 3.41Å; K550-C553 PolarHBondContact O-N 3.29Å; C553-F555 PolarHBondContact O-N 3.43Å; C553-Y556 PolarHBondContact O-N 2.95Å; C553-Y556 VanDerWaalsContact O-N 3.1Å; C553-I557 HydrophobicContact CB-CD1 4.47Å; C553-I557 WeakPolarHBondContact O-CG1 3.44Å; C553-I557 PolarHBondContact O-N 2.69Å
554	V	93.8	Very high	92.6	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.018	19%	0.185	C	C	.	.	H	α-helix	trans	-58.2	-35.1	177.9	170.3	0	0	0	0	111.4	L151 F483 I486 K550 Y556 I557 K558	L151-V554 HydrophobicContact CD2-CG1 4.3Å; F483-V554 HydrophobicContact CD2-CG2 4.14Å; F483-V554 HydrophobicContact CE2-CG2 4.28Å; I486-V554 HydrophobicContact CD1-CG2 4.1Å; I486-V554 HydrophobicContact CG2-CG2 4.33Å; K550-V554 HydrophobicContact CG-CG2 4.28Å; K550-V554 WeakPolarHBondContact O-CB 3.38Å; K550-V554 VanDerWaalsContact O-CG2 3.24Å; K550-V554 WeakPolarHBondContact O-CG2 3.19Å; K550-V554 PolarHBondContact O-N 3.02Å; V554-Y556 PolarHBondContact O-N 3.06Å; V554-I557 PolarHBondContact O-N 2.99Å; V554-K558 HydrophobicContact CG1-CG 3.94Å; V554-K558 VanDerWaalsContact O-CB 3.32Å; V554-K558 WeakPolarHBondContact O-CB 3.21Å; V554-K558 WeakPolarHBondContact O-CG 3.22Å; V554-K558 PolarHBondContact O-N 3Å
555	F	93.6	Very high	91.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-56.8	-50.1	175.1	-177.5	-83.2	0	0	0	111.5	W129 D132 I133 F148 L151 Y551 F552 C553 K559	W129-F555 HydrophobicContact CB-CE1 3.74Å; W129-F555 HydrophobicContact CB-CE2 4.02Å; W129-F555 HydrophobicContact CB-CZ 3.36Å; W129-F555 AromaticContact CD1-CE1 3.6Å; W129-F555 AromaticContact CD2-CD1 3.52Å; W129-F555 HydrophobicContact CD2-CD1 3.52Å; W129-F555 AromaticContact CD2-CD2 3.85Å; W129-F555 HydrophobicContact CD2-CD2 3.85Å; W129-F555 AromaticContact CD2-CE1 3.45Å; W129-F555 HydrophobicContact CD2-CE1 3.45Å; W129-F555 VanDerWaalsContact CD2-CE1 3.45Å; W129-F555 AromaticContact CD2-CE2 3.77Å; W129-F555 HydrophobicContact CD2-CE2 3.77Å; W129-F555 AromaticContact CD2-CG 3.76Å; W129-F555 HydrophobicContact CD2-CG 3.76Å; W129-F555 AromaticContact CD2-CZ 3.6Å; W129-F555 HydrophobicContact CD2-CZ 3.6Å; W129-F555 AromaticContact CE2-CD1 3.48Å; W129-F555 VanDerWaalsContact CE2-CD1 3.48Å; W129-F555 AromaticContact CE2-CE1 3.79Å; W129-F555 AromaticContact CE2-CG 3.87Å; W129-F555 HydrophobicContact CE3-CB 4.42Å; W129-F555 AromaticContact CE3-CD1 3.9Å; W129-F555 HydrophobicContact CE3-CD1 3.9Å; W129-F555 AromaticContact CE3-CD2 3.35Å; W129-F555 HydrophobicContact CE3-CD2 3.35Å; W129-F555 HydrophobicContact CE3-CE1 4Å; W129-F555 AromaticContact CE3-CE2 3.44Å; W129-F555 HydrophobicContact CE3-CE2 3.44Å; W129-F555 VanDerWaalsContact CE3-CE2 3.44Å; W129-F555 AromaticContact CE3-CG 3.62Å; W129-F555 HydrophobicContact CE3-CG 3.62Å; W129-F555 AromaticContact CE3-CZ 3.81Å; W129-F555 HydrophobicContact CE3-CZ 3.81Å; W129-F555 AromaticContact CG-CD1 3.9Å; W129-F555 HydrophobicContact CG-CD1 3.9Å; W129-F555 AromaticContact CG-CE1 3.32Å; W129-F555 HydrophobicContact CG-CE1 3.32Å; W129-F555 HydrophobicContact CG-CE2 4.05Å; W129-F555 AromaticContact CG-CZ 3.44Å; W129-F555 HydrophobicContact CG-CZ 3.44Å; W129-F555 VanDerWaalsContact CG-CZ 3.44Å; W129-F555 HydrophobicContact CH2-CB 3.7Å; W129-F555 HydrophobicContact CH2-CD1 4.21Å; W129-F555 HydrophobicContact CH2-CD2 4.16Å; W129-F555 AromaticContact CH2-CG 3.76Å; W129-F555 HydrophobicContact CH2-CG 3.76Å; W129-F555 HydrophobicContact CZ2-CB 3.95Å; W129-F555 AromaticContact CZ2-CD1 3.82Å; W129-F555 HydrophobicContact CZ2-CD1 3.82Å; W129-F555 AromaticContact CZ2-CG 3.86Å; W129-F555 HydrophobicContact CZ2-CG 3.86Å; W129-F555 HydrophobicContact CZ3-CB 3.93Å; W129-F555 HydrophobicContact CZ3-CD1 4.24Å; W129-F555 AromaticContact CZ3-CD2 3.54Å; W129-F555 HydrophobicContact CZ3-CD2 3.54Å; W129-F555 HydrophobicContact CZ3-CE2 4.12Å; W129-F555 AromaticContact CZ3-CG 3.63Å; W129-F555 HydrophobicContact CZ3-CG 3.63Å; W129-F555 AromaticContact NE1-CD1 3.85Å; W129-F555 AromaticContact NE1-CE1 3.88Å; D132-F555 HydrophobicContact CB-CE1 4.46Å; D132-F555 HydrophobicContact CB-CZ 4.41Å; I133-F555 HydrophobicContact CD1-CE2 4.33Å; I133-F555 HydrophobicContact CG1-CE2 4.2Å; I133-F555 HydrophobicContact CG1-CZ 4.11Å; F148-F555 HydrophobicContact CB-CE2 4.01Å; F148-F555 AromaticContact CD1-CD2 3.75Å; F148-F555 HydrophobicContact CD1-CD2 3.75Å; F148-F555 AromaticContact CD1-CE2 3.48Å; F148-F555 HydrophobicContact CD1-CE2 3.48Å; F148-F555 VanDerWaalsContact CD1-CE2 3.48Å; F148-F555 HydrophobicContact CD1-CG 4.48Å; F148-F555 AromaticContact CD1-CZ 3.99Å; F148-F555 HydrophobicContact CD1-CZ 3.99Å; F148-F555 HydrophobicContact CE1-CD2 4.46Å; F148-F555 HydrophobicContact CE1-CE2 4.39Å; F148-F555 HydrophobicContact CG-CE2 4.16Å; L151-F555 HydrophobicContact CD2-CB 3.78Å; L151-F555 HydrophobicContact CD2-CD2 3.95Å; L151-F555 HydrophobicContact CD2-CG 4.32Å; L151-F555 HydrophobicContact CG-CD2 4.41Å; Y551-F555 PolarHBondContact O-N 3.36Å; F552-F555 WeakPolarHBondContact O-CB 3.44Å; F552-F555 PolarHBondContact O-N 2.78Å; C553-F555 PolarHBondContact O-N 3.43Å; F555-K559 HydrophobicContact CE1-CD 4.38Å; F555-K559 WeakPolarHBondContact O-CB 3.27Å; F555-K559 PolarHBondContact O-N 2.69Å
556	Y	92.5	Very high	91.2	Very high	93 Å²	93	38.1 Å²	38.1	37%	0.365	19%	0.187	S	C	.	.	H	α-helix	trans	-71.3	-41.8	-180	-73.4	-77.7	0	0	0	112.5	W129 F552 C553 V554 K558 K559 L560	W129-Y556 AromaticContact CE2-CE2 3.83Å; W129-Y556 HydrophobicContact CZ2-CD2 4.31Å; W129-Y556 AromaticContact CZ2-CE2 3.7Å; W129-Y556 HydrophobicContact CZ2-CE2 3.7Å; W129-Y556 AromaticContact NE1-CE2 3.44Å; W129-Y556 AromaticContact NE1-CZ 3.17Å; W129-Y556 PolarHBondContact NE1-OH 3.08Å; F552-Y556 HydrophobicContact CD1-CD2 4.28Å; F552-Y556 HydrophobicContact CD1-CE2 4.09Å; F552-Y556 HydrophobicContact CE1-CD2 4.04Å; F552-Y556 AromaticContact CE1-CE2 3.5Å; F552-Y556 HydrophobicContact CE1-CE2 3.5Å; F552-Y556 HydrophobicContact CE2-CE2 4.29Å; F552-Y556 AromaticContact CZ-CE2 3.61Å; F552-Y556 HydrophobicContact CZ-CE2 3.61Å; F552-Y556 WeakPolarHBondContact O-CD2 3.49Å; C553-Y556 PolarHBondContact O-N 2.95Å; C553-Y556 VanDerWaalsContact O-N 3.1Å; V554-Y556 PolarHBondContact O-N 3.06Å; Y556-K558 PolarHBondContact O-N 3.18Å; Y556-K559 PolarHBondContact O-N 2.99Å; Y556-L560 WeakPolarHBondContact O-CB 3.24Å; Y556-L560 VanDerWaalsContact O-CG 3.32Å; Y556-L560 WeakPolarHBondContact O-CG 3.36Å; Y556-L560 PolarHBondContact O-N 3.21Å
557	I	92.4	Very high	90.3	Very high	30 Å²	30	41 Å²	41	15%	0.154	20%	0.196	C	C	.	.	H	α-helix	trans	-58.2	-50.6	177.3	-67.7	165.8	0	0	0	110.2	F483 L487 T490 C553 V554 L560 S561	F483-I557 HydrophobicContact CE2-CD1 3.92Å; F483-I557 HydrophobicContact CZ-CD1 4.25Å; L487-I557 HydrophobicContact CD1-CD1 3.93Å; T490-I557 HydrophobicContact CG2-CG2 3.58Å; C553-I557 HydrophobicContact CB-CD1 4.47Å; C553-I557 WeakPolarHBondContact O-CG1 3.44Å; C553-I557 PolarHBondContact O-N 2.69Å; V554-I557 PolarHBondContact O-N 2.99Å; I557-L560 PolarHBondContact O-N 2.84Å; I557-S561 WeakPolarHBondContact O-CB 3.32Å; I557-S561 PolarHBondContact O-N 2.8Å
558	K	91.1	Very high	89	Confident	7 Å²	7	45 Å²	45	3%	0.03	22%	0.221	C	C	.	.	H	α-helix	trans	-71.6	-31.6	-179.5	-66.6	-75.4	-178.1	174.1	0	112.3	Y147 F148 F517 N522 E525 V554 Y556 L562	Y147-K558 HydrophobicContact CE1-CB 4.37Å; F148-K558 HydrophobicContact CE1-CB 4.48Å; F517-K558 HydrophobicContact CE2-CD 4.5Å; N522-K558 WeakPolarHBondContact OD1-CE 3.47Å; N522-K558 PolarHBondContact OD1-NZ 2.53Å; E525-K558 IonicContact OE2-NZ 2.94Å; V554-K558 HydrophobicContact CG1-CG 3.94Å; V554-K558 VanDerWaalsContact O-CB 3.32Å; V554-K558 WeakPolarHBondContact O-CB 3.21Å; V554-K558 WeakPolarHBondContact O-CG 3.22Å; V554-K558 PolarHBondContact O-N 3Å; Y556-K558 PolarHBondContact O-N 3.18Å; K558-L562 VanDerWaalsContact O-CB 3.26Å; K558-L562 WeakPolarHBondContact O-CB 3.39Å; K558-L562 PolarHBondContact O-N 2.7Å
559	K	90.9	Very high	87.4	Confident	31 Å²	31	46.1 Å²	46.1	14%	0.135	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-48	169.9	175.4	-178.5	176.2	-164.6	0	111.1	D132 I136 F148 F555 Y556 L562 I563	D132-K559 HydrophobicContact CB-CD 4.4Å; D132-K559 VanDerWaalsContact CG-NZ 3.32Å; D132-K559 IonicContact OD1-NZ 3.44Å; D132-K559 PolarHBondContact OD1-NZ 3.02Å; I136-K559 HydrophobicContact CD1-CD 4.44Å; I136-K559 HydrophobicContact CD1-CG 4.11Å; F148-K559 HydrophobicContact CE1-CB 4.2Å; F148-K559 HydrophobicContact CZ-CB 4.41Å; F555-K559 HydrophobicContact CE1-CD 4.38Å; F555-K559 WeakPolarHBondContact O-CB 3.27Å; F555-K559 PolarHBondContact O-N 2.69Å; Y556-K559 PolarHBondContact O-N 2.99Å; K559-L562 PolarHBondContact O-N 3.1Å; K559-I563 HydrophobicContact CD-CD1 4.49Å; K559-I563 HydrophobicContact CG-CD1 3.79Å; K559-I563 WeakPolarHBondContact O-CG1 3.39Å; K559-I563 PolarHBondContact O-N 3.43Å
560	L	90.3	Very high	85.4	Confident	107 Å²	107	45.4 Å²	45.4	56%	0.56	23%	0.234	S	C	*	.	H	α-helix	trans	-64.2	-46.5	178.7	-72.9	173	0	0	0	111.2	Y556 I557 L562 I563 K564	Y556-L560 WeakPolarHBondContact O-CB 3.24Å; Y556-L560 VanDerWaalsContact O-CG 3.32Å; Y556-L560 WeakPolarHBondContact O-CG 3.36Å; Y556-L560 PolarHBondContact O-N 3.21Å; I557-L560 PolarHBondContact O-N 2.84Å; L560-L562 VanDerWaalsContact C-N 3.35Å; L560-L562 PolarHBondContact O-N 3.26Å; L560-I563 PolarHBondContact O-N 3.26Å; L560-K564 VanDerWaalsContact O-CB 3.27Å; L560-K564 WeakPolarHBondContact O-CB 3.44Å; L560-K564 PolarHBondContact O-N 3.14Å
561	S	88.7	Confident	83.6	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-56.7	-46.8	174.8	171.9	0	0	0	0	111.8	E494 I557 I563 N565 C566	E494-S561 VanDerWaalsContact OE2-CB 3.25Å; E494-S561 WeakPolarHBondContact OE2-CB 3.49Å; E494-S561 PolarHBondContact OE2-OG 2.92Å; I557-S561 WeakPolarHBondContact O-CB 3.32Å; I557-S561 PolarHBondContact O-N 2.8Å; S561-I563 PolarHBondContact O-N 2.94Å; S561-N565 WeakPolarHBondContact O-CA 3.4Å; S561-N565 VanDerWaalsContact O-CB 3.3Å; S561-N565 WeakPolarHBondContact O-CB 3.4Å; S561-N565 PolarHBondContact O-N 3.35Å; S561-C566 PolarHBondContact O-N 3.02Å; S561-C566 VanDerWaalsContact O-N 3.08Å
562	L	88.6	Confident	81.5	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.1	-47.9	179.1	178.4	70.4	0	0	0	112.7	I136 F140 I144 F148 F517 K558 K559 L560 C566	I136-L562 HydrophobicContact CG2-CD2 3.74Å; F140-L562 HydrophobicContact CD1-CD1 4.14Å; F140-L562 HydrophobicContact CD1-CG 4.43Å; F140-L562 HydrophobicContact CD2-CD2 3.8Å; F140-L562 HydrophobicContact CD2-CG 4.09Å; F140-L562 HydrophobicContact CE1-CD1 4.08Å; F140-L562 HydrophobicContact CE1-CG 4.19Å; F140-L562 HydrophobicContact CE2-CD2 3.95Å; F140-L562 HydrophobicContact CE2-CG 3.82Å; F140-L562 HydrophobicContact CG-CD1 4.4Å; F140-L562 HydrophobicContact CG-CD2 4.22Å; F140-L562 HydrophobicContact CG-CG 4.39Å; F140-L562 HydrophobicContact CZ-CD1 4.29Å; F140-L562 HydrophobicContact CZ-CD2 4.48Å; F140-L562 HydrophobicContact CZ-CG 3.88Å; F140-L562 WeakPolarHBondContact CZ-O 3.24Å; I144-L562 HydrophobicContact CD1-CD1 3.78Å; I144-L562 HydrophobicContact CD1-CD2 4.43Å; I144-L562 HydrophobicContact CG2-CD2 3.57Å; F148-L562 HydrophobicContact CE2-CD2 3.75Å; F148-L562 HydrophobicContact CZ-CD2 4.19Å; F517-L562 HydrophobicContact CB-CD1 3.74Å; F517-L562 HydrophobicContact CD1-CD1 4.27Å; F517-L562 HydrophobicContact CD2-CD1 4.1Å; F517-L562 HydrophobicContact CG-CD1 3.77Å; K558-L562 VanDerWaalsContact O-CB 3.26Å; K558-L562 WeakPolarHBondContact O-CB 3.39Å; K558-L562 PolarHBondContact O-N 2.7Å; K559-L562 PolarHBondContact O-N 3.1Å; L560-L562 VanDerWaalsContact C-N 3.35Å; L560-L562 PolarHBondContact O-N 3.26Å; L562-C566 HydrophobicContact CD1-CB 4.26Å
563	I	85.6	Confident	79.5	Confident	60 Å²	60	54.4 Å²	54.4	31%	0.308	27%	0.274	S	S	.	.	H	α-helix	trans	-73.4	-35.6	-175	-66.1	170.6	0	0	0	111.3	M139 F140 K559 L560 S561	M139-I563 HydrophobicContact CE-CD1 4.16Å; M139-I563 HydrophobicContact CE-CG1 4.1Å; F140-I563 HydrophobicContact CE2-CG1 4.21Å; K559-I563 HydrophobicContact CD-CD1 4.49Å; K559-I563 HydrophobicContact CG-CD1 3.79Å; K559-I563 WeakPolarHBondContact O-CG1 3.39Å; K559-I563 PolarHBondContact O-N 3.43Å; L560-I563 PolarHBondContact O-N 3.26Å; S561-I563 PolarHBondContact O-N 2.94Å
564	K	84.8	Confident	77.6	Confident	129 Å²	129	55.5 Å²	55.5	56%	0.561	27%	0.272	S	S	*	.	H	α-helix	trans	-102.4	-34.4	-171.4	-60.9	-64	-174.2	178.7	0	113.5	K498 L560	K498-K564 VanDerWaalsContact CD-O 3.32Å; K498-K564 WeakPolarHBondContact CD-O 3.31Å; K498-K564 WeakPolarHBondContact CE-O 3.23Å; K498-K564 PolarHBondContact NZ-O 3.1Å; L560-K564 VanDerWaalsContact O-CB 3.27Å; L560-K564 WeakPolarHBondContact O-CB 3.44Å; L560-K564 PolarHBondContact O-N 3.14Å
565	N	82.5	Confident	75.4	Confident	15 Å²	15	56.1 Å²	56.1	8%	0.08	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-31.2	-169	-61.2	-12.9	0	0	0	113.7	E494 S561	E494-N565 HydrophobicContact CB-CB 4.49Å; S561-N565 WeakPolarHBondContact O-CA 3.4Å; S561-N565 VanDerWaalsContact O-CB 3.3Å; S561-N565 WeakPolarHBondContact O-CB 3.4Å; S561-N565 PolarHBondContact O-N 3.35Å
566	C	81.4	Confident	73.3	Confident	16 Å²	16	57.7 Å²	57.7	11%	0.108	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-90.2	148.3	-174.6	-61.1	0	0	0	0	113.4	Q515 F517 S561 L562	Q515-C566 WeakPolarHBondContact O-CA 3.26Å; F517-C566 HydrophobicContact CB-CB 4.22Å; S561-C566 PolarHBondContact O-N 3.02Å; S561-C566 VanDerWaalsContact O-N 3.08Å; L562-C566 HydrophobicContact CD1-CB 4.26Å
567	R	76.5	Confident	71.6	Confident	100 Å²	100	54.3 Å²	54.3	38%	0.377	28%	0.279	S	S	.	.	B	Isolated β-bridge	trans	-84.7	149.6	161.7	73.5	177.8	-172.5	-162.4	-3.1	110.2	L514 Q515 E516 A569	L514-R567 HydrophobicContact CB-CB 4.2Å; L514-R567 HydrophobicContact CB-CG 4.31Å; Q515-R567 PolarHBondContact O-N 3.22Å; Q515-R567 VanDerWaalsContact O-N 3.08Å; E516-R567 HydrophobicContact CG-CG 3.84Å; E516-R567 VanDerWaalsContact CG-NE 3.26Å; E516-R567 IonicContact OE1-CZ 3.88Å; E516-R567 VanDerWaalsContact OE1-CZ 3.23Å; E516-R567 IonicContact OE1-NE 3.63Å; E516-R567 PolarHBondContact OE1-NE 3.21Å; E516-R567 IonicContact OE1-NH2 2.79Å; E516-R567 PolarHBondContact OE1-NH2 2.91Å; R567-A569 PolarHBondContact O-N 3.13Å
568	P	66.5	Low	70.3	Confident	82 Å²	82	52.9 Å²	52.9	53%	0.532	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-57.8	140.4	172.1	24.1	-32.6	0	0	0	110.2	F140 T570	F140-P568 HydrophobicContact CD1-CB 4.17Å; F140-P568 HydrophobicContact CE1-CB 4.5Å; P568-T570 PolarHBondContact O-N 3.42Å
569	A	61.9	Low	69.4	Low	44 Å²	44	54.9 Å²	54.9	36%	0.364	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-60.5	129.2	-178.4	0	0	0	0	0	110.5	R567 R571	R567-A569 PolarHBondContact O-N 3.13Å; A569-R571 VanDerWaalsContact C-N 3.26Å; A569-R571 PolarHBondContact O-N 3.44Å
570	T	54.4	Low	68.7	Low	96 Å²	96	56.9 Å²	56.9	59%	0.589	29%	0.291	S	S	*	.	S	Bend	trans	-69.4	-25.8	179.7	49.6	0	0	0	0	112.5	E516 P568 P572	E516-T570 WeakPolarHBondContact OE1-CG2 3.44Å; E516-T570 PolarHBondContact OE1-OG1 3.05Å; E516-T570 VanDerWaalsContact OE1-OG1 3.06Å; P568-T570 PolarHBondContact O-N 3.42Å; T570-P572 VanDerWaalsContact O-CD 3.24Å; T570-P572 WeakPolarHBondContact O-CD 2.93Å
571	R	56.7	Low	68	Low	170 Å²	170	53 Å²	53	64%	0.642	27%	0.27	S	S	*	.	S	Bend	trans	-106.6	100	175.1	-66.6	-174.2	-177.7	176.4	2	110.8	A569 F573	A569-R571 VanDerWaalsContact C-N 3.26Å; A569-R571 PolarHBondContact O-N 3.44Å; R571-F573 PolarHBondContact O-N 2.85Å
572	P	51.4	Low	67.7	Low	59 Å²	59	53 Å²	53	38%	0.383	27%	0.269	S	S	.	.			trans	-58.8	119.2	174.8	5.7	-15.9	0	0	0	112.1	T316 T570	T316-P572 HydrophobicContact CG2-CB 3.41Å; T316-P572 VanDerWaalsContact CG2-CB 3.41Å; T316-P572 HydrophobicContact CG2-CG 3.3Å; T316-P572 WeakPolarHBondContact CG2-O 3.38Å; T570-P572 VanDerWaalsContact O-CD 3.24Å; T570-P572 WeakPolarHBondContact O-CD 2.93Å
573	F	52.1	Low	67.5	Low	53 Å²	53	53.2 Å²	53.2	23%	0.232	27%	0.271	C	S	.	.			trans	-90.8	127.8	178.7	-168.1	-119.7	0	0	0	110.6	I419 I519 R571 A575 S578 F582	I419-F573 HydrophobicContact CD1-CD2 3.84Å; I419-F573 HydrophobicContact CD1-CE2 3.58Å; I419-F573 HydrophobicContact CD1-CZ 4.47Å; I419-F573 HydrophobicContact CG2-CE2 4.24Å; I419-F573 HydrophobicContact CG2-CZ 4.18Å; I519-F573 HydrophobicContact CD1-CB 4.36Å; I519-F573 HydrophobicContact CD1-CD1 4.32Å; R571-F573 PolarHBondContact O-N 2.85Å; F573-A575 PolarHBondContact O-N 2.96Å; F573-A575 VanDerWaalsContact O-N 3.11Å; F573-S578 WeakPolarHBondContact CD1-OG 3.39Å; F573-S578 WeakPolarHBondContact CE1-OG 3.14Å; F573-F582 HydrophobicContact CE1-CZ 4.26Å
574	R	53.8	Low	67.3	Low	68 Å²	68	51.7 Å²	51.7	26%	0.257	27%	0.269	S	S	.	.			trans	-72.3	104.2	-174	-163.2	176.8	-169.4	-145.3	2.4	112.3	D278 S576 S577 S578	D278-R574 IonicContact OD1-NH1 3.32Å; R574-S576 VanDerWaalsContact C-N 3.27Å; R574-S576 PolarHBondContact O-N 3.31Å; R574-S577 PolarHBondContact O-N 3.5Å; R574-S577 VanDerWaalsContact O-N 3.16Å; R574-S578 PolarHBondContact O-N 3.44Å; R574-S578 PolarHBondContact O-OG 2.95Å
575	A	48.5	Very low	67.1	Low	16 Å²	16	45.8 Å²	45.8	13%	0.132	24%	0.244	C	C	.	.	H	α-helix	trans	-51.5	-30.2	-174.1	0	0	0	0	0	117.3	T142 F573 N579	T142-A575 VanDerWaalsContact C-CB 3.5Å; T142-A575 WeakPolarHBondContact O-CB 3.38Å; T142-A575 WeakPolarHBondContact OG1-CB 3.27Å; F573-A575 PolarHBondContact O-N 2.96Å; F573-A575 VanDerWaalsContact O-N 3.11Å; A575-N579 PolarHBondContact O-N 3.49Å; A575-N579 PolarHBondContact O-ND2 2.9Å
576	S	48.6	Very low	67.3	Low	32 Å²	32	45.1 Å²	45.1	22%	0.224	24%	0.24	C	C	.	.	H	α-helix	trans	-76	-27.4	-177.2	57.1	0	0	0	0	113.7	R574	R574-S576 VanDerWaalsContact C-N 3.27Å; R574-S576 PolarHBondContact O-N 3.31Å
577	S	57.6	Low	67.7	Low	23 Å²	23	46.4 Å²	46.4	16%	0.161	25%	0.246	C	C	.	.	H	α-helix	trans	-79.6	-36	173.3	177.8	0	0	0	0	111	R420 R574 F581	R420-S577 PolarHBondContact NH2-OG 2.88Å; R574-S577 PolarHBondContact O-N 3.5Å; R574-S577 VanDerWaalsContact O-N 3.16Å; S577-F581 WeakPolarHBondContact O-CB 3.45Å; S577-F581 PolarHBondContact O-N 3.12Å; S577-F581 VanDerWaalsContact O-N 3.15Å
578	S	65	Low	68	Low	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-47.3	-175.7	-38.1	0	0	0	0	113.6	F573 R574 F580 F581 F582	F573-S578 WeakPolarHBondContact CD1-OG 3.39Å; F573-S578 WeakPolarHBondContact CE1-OG 3.14Å; R574-S578 PolarHBondContact O-N 3.44Å; R574-S578 PolarHBondContact O-OG 2.95Å; S578-F580 PolarHBondContact O-N 2.93Å; S578-F581 PolarHBondContact O-N 3.01Å; S578-F582 WeakPolarHBondContact O-CD1 3.48Å; S578-F582 VanDerWaalsContact O-CD2 3.28Å; S578-F582 WeakPolarHBondContact O-CD2 3.42Å; S578-F582 WeakPolarHBondContact O-CG 3.25Å; S578-F582 PolarHBondContact O-N 3Å
579	N	71.8	Confident	68.8	Low	49 Å²	49	40.7 Å²	40.7	26%	0.262	22%	0.218	S	C	.	.	H	α-helix	trans	-64.6	-40.9	-176.3	-79.9	-56.2	0	0	0	113	S146 A575 L583	S146-N579 WeakPolarHBondContact CB-OD1 3.2Å; S146-N579 PolarHBondContact OG-ND2 2.85Å; A575-N579 PolarHBondContact O-N 3.49Å; A575-N579 PolarHBondContact O-ND2 2.9Å; N579-L583 WeakPolarHBondContact O-CD1 3.44Å; N579-L583 VanDerWaalsContact O-CG 3.31Å; N579-L583 WeakPolarHBondContact O-CG 3.36Å; N579-L583 PolarHBondContact O-N 2.97Å
580	F	76.5	Confident	70.1	Confident	72 Å²	72	38.8 Å²	38.8	32%	0.316	20%	0.201	S	C	.	.	H	α-helix	trans	-64.4	-44.8	174.8	170.2	-104.7	0	0	0	110.6	F271 S578 L583 G584	F271-F580 HydrophobicContact CB-CD2 3.83Å; F271-F580 HydrophobicContact CB-CE2 3.78Å; F271-F580 HydrophobicContact CD2-CD2 4.23Å; F271-F580 HydrophobicContact CD2-CE1 4.44Å; F271-F580 AromaticContact CD2-CE2 3.72Å; F271-F580 HydrophobicContact CD2-CE2 3.72Å; F271-F580 AromaticContact CD2-CZ 3.83Å; F271-F580 HydrophobicContact CD2-CZ 3.83Å; F271-F580 HydrophobicContact CE2-CZ 4.47Å; F271-F580 HydrophobicContact CG-CE2 4.1Å; S578-F580 PolarHBondContact O-N 2.93Å; F580-L583 PolarHBondContact O-N 3.35Å; F580-G584 PolarHBondContact O-N 3.09Å
581	F	75.2	Confident	71.7	Confident	26 Å²	26	39.1 Å²	39.1	11%	0.114	20%	0.199	C	C	.	.	H	α-helix	trans	-61.9	-45.3	178.8	175	-107.2	0	0	0	112.8	R420 L423 S577 S578 L583 G584 V585	R420-F581 HydrophobicContact CB-CE2 4.05Å; R420-F581 HydrophobicContact CB-CZ 4.17Å; R420-F581 HydrophobicContact CG-CD2 4.09Å; R420-F581 HydrophobicContact CG-CE2 3.63Å; R420-F581 HydrophobicContact CG-CZ 3.86Å; L423-F581 HydrophobicContact CB-CE1 4.46Å; L423-F581 HydrophobicContact CB-CZ 4.05Å; L423-F581 HydrophobicContact CD1-CE1 3.5Å; L423-F581 VanDerWaalsContact CD1-CE1 3.5Å; L423-F581 HydrophobicContact CD1-CZ 3.9Å; L423-F581 HydrophobicContact CD2-CE1 4Å; L423-F581 HydrophobicContact CD2-CZ 3.64Å; L423-F581 HydrophobicContact CG-CE1 4.14Å; L423-F581 HydrophobicContact CG-CZ 4.02Å; S577-F581 WeakPolarHBondContact O-CB 3.45Å; S577-F581 PolarHBondContact O-N 3.12Å; S577-F581 VanDerWaalsContact O-N 3.15Å; S578-F581 PolarHBondContact O-N 3.01Å; F581-L583 VanDerWaalsContact C-N 3.32Å; F581-L583 PolarHBondContact O-N 3.45Å; F581-G584 PolarHBondContact O-N 2.8Å; F581-V585 HydrophobicContact CD2-CG2 4.3Å; F581-V585 HydrophobicContact CE1-CG2 4.25Å; F581-V585 HydrophobicContact CE2-CG2 3.92Å; F581-V585 HydrophobicContact CZ-CG2 3.91Å; F581-V585 WeakPolarHBondContact O-CG2 3.46Å; F581-V585 PolarHBondContact O-N 3.34Å
582	F	81.6	Confident	72.8	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.009	19%	0.186	C	C	.	.	H	α-helix	trans	-61.6	-40.1	177.4	-57.5	-24.8	0	0	0	112.2	F150 I519 V523 F573 S578 L586	F150-F582 HydrophobicContact CD2-CB 4.14Å; F150-F582 HydrophobicContact CE2-CB 4.14Å; F150-F582 HydrophobicContact CG-CB 4.5Å; F150-F582 HydrophobicContact CZ-CB 4.5Å; I519-F582 HydrophobicContact CG2-CE1 4.4Å; I519-F582 HydrophobicContact CG2-CE2 4.08Å; I519-F582 HydrophobicContact CG2-CZ 3.51Å; V523-F582 HydrophobicContact CB-CD1 4.33Å; V523-F582 HydrophobicContact CB-CE1 4.35Å; V523-F582 HydrophobicContact CG1-CB 4.33Å; V523-F582 HydrophobicContact CG1-CD1 3.73Å; V523-F582 HydrophobicContact CG1-CE1 4.23Å; V523-F582 HydrophobicContact CG1-CG 4.03Å; V523-F582 HydrophobicContact CG2-CD1 4.08Å; V523-F582 HydrophobicContact CG2-CD2 4.25Å; V523-F582 HydrophobicContact CG2-CE1 3.89Å; V523-F582 HydrophobicContact CG2-CE2 4.07Å; V523-F582 HydrophobicContact CG2-CG 4.27Å; V523-F582 HydrophobicContact CG2-CZ 3.9Å; F573-F582 HydrophobicContact CE1-CZ 4.26Å; S578-F582 WeakPolarHBondContact O-CD1 3.48Å; S578-F582 VanDerWaalsContact O-CD2 3.28Å; S578-F582 WeakPolarHBondContact O-CD2 3.42Å; S578-F582 WeakPolarHBondContact O-CG 3.25Å; S578-F582 PolarHBondContact O-N 3Å; F582-L586 VanDerWaalsContact O-CB 3.3Å; F582-L586 WeakPolarHBondContact O-CB 3.44Å; F582-L586 PolarHBondContact O-N 2.87Å
583	L	84.4	Confident	74.5	Confident	6 Å²	6	31.6 Å²	31.6	3%	0.031	17%	0.168	C	C	.	.	H	α-helix	trans	-69.7	-35.4	175.8	-68.7	166.9	0	0	0	112.4	F150 F153 R266 N579 F580 F581 L586 L587	F150-L583 HydrophobicContact CE2-CD2 4.47Å; F153-L583 HydrophobicContact CD1-CD2 4.41Å; F153-L583 HydrophobicContact CE1-CD2 3.99Å; R266-L583 HydrophobicContact CB-CD1 4.16Å; R266-L583 HydrophobicContact CB-CD2 4.5Å; R266-L583 HydrophobicContact CG-CD1 3.74Å; R266-L583 HydrophobicContact CG-CD2 4.34Å; N579-L583 WeakPolarHBondContact O-CD1 3.44Å; N579-L583 VanDerWaalsContact O-CG 3.31Å; N579-L583 WeakPolarHBondContact O-CG 3.36Å; N579-L583 PolarHBondContact O-N 2.97Å; F580-L583 PolarHBondContact O-N 3.35Å; F581-L583 VanDerWaalsContact C-N 3.32Å; F581-L583 PolarHBondContact O-N 3.45Å; L583-L586 PolarHBondContact O-N 2.89Å; L583-L587 PolarHBondContact O-N 2.84Å
584	G	81.9	Confident	76.2	Confident	27 Å²	27	31 Å²	31	28%	0.278	17%	0.169	S	C	.	.	H	α-helix	trans	-64.7	-43.8	174.3	0	0	0	0	0	112.3	F580 F581 L587 I588	F580-G584 PolarHBondContact O-N 3.09Å; F581-G584 PolarHBondContact O-N 2.8Å; G584-L587 WeakPolarHBondContact O-CB 3.39Å; G584-L587 PolarHBondContact O-N 3.02Å; G584-I588 PolarHBondContact O-N 2.98Å; G584-I588 VanDerWaalsContact O-N 3.17Å
585	V	80.1	Confident	77.7	Confident	6 Å²	6	34.1 Å²	34.1	4%	0.036	19%	0.185	C	C	.	.	H	α-helix	trans	-64.6	-41.6	174.9	172.5	0	0	0	0	111.3	L423 V427 L527 F581 L587 I588 G589	L423-V585 HydrophobicContact CD2-CB 4.24Å; L423-V585 HydrophobicContact CD2-CG1 3.82Å; L423-V585 HydrophobicContact CD2-CG2 3.45Å; L423-V585 VanDerWaalsContact CD2-CG2 3.45Å; V427-V585 HydrophobicContact CG2-CG1 3.83Å; L527-V585 HydrophobicContact CD1-CG1 4.13Å; L527-V585 HydrophobicContact CD2-CG1 3.35Å; L527-V585 HydrophobicContact CG-CG1 4.28Å; F581-V585 HydrophobicContact CD2-CG2 4.3Å; F581-V585 HydrophobicContact CE1-CG2 4.25Å; F581-V585 HydrophobicContact CE2-CG2 3.92Å; F581-V585 HydrophobicContact CZ-CG2 3.91Å; F581-V585 WeakPolarHBondContact O-CG2 3.46Å; F581-V585 PolarHBondContact O-N 3.34Å; V585-L587 VanDerWaalsContact C-N 3.27Å; V585-L587 PolarHBondContact O-N 3.41Å; V585-I588 WeakPolarHBondContact O-CB 3.49Å; V585-I588 PolarHBondContact O-N 3.44Å; V585-G589 PolarHBondContact O-N 3.35Å
586	L	87.6	Confident	79.3	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60	-38	175.5	-174.6	65.7	0	0	0	112.2	F150 F153 L154 I263 L527 Q530 W534 F582 L583 G589 L590	F150-L586 HydrophobicContact CE2-CB 4.36Å; F150-L586 HydrophobicContact CE2-CD2 3.81Å; F150-L586 HydrophobicContact CZ-CB 4.27Å; F150-L586 HydrophobicContact CZ-CD1 4.32Å; F150-L586 HydrophobicContact CZ-CD2 4.04Å; F150-L586 HydrophobicContact CZ-CG 4.45Å; F153-L586 HydrophobicContact CD1-CD2 4.44Å; F153-L586 HydrophobicContact CE1-CD2 3.71Å; L154-L586 HydrophobicContact CD2-CD1 4.23Å; L154-L586 HydrophobicContact CD2-CD2 3.98Å; I263-L586 HydrophobicContact CD1-CD2 3.83Å; I263-L586 HydrophobicContact CD1-CG 3.88Å; I263-L586 HydrophobicContact CG1-CD2 3.92Å; I263-L586 HydrophobicContact CG1-CG 4.44Å; L527-L586 HydrophobicContact CD1-CB 4.34Å; L527-L586 HydrophobicContact CD1-CD1 3.82Å; Q530-L586 HydrophobicContact CB-CD1 4.33Å; Q530-L586 HydrophobicContact CG-CD1 3.89Å; W534-L586 HydrophobicContact CH2-CD1 3.4Å; W534-L586 HydrophobicContact CH2-CG 3.8Å; W534-L586 HydrophobicContact CZ2-CD1 4.16Å; W534-L586 HydrophobicContact CZ3-CD1 4.11Å; F582-L586 VanDerWaalsContact O-CB 3.3Å; F582-L586 WeakPolarHBondContact O-CB 3.44Å; F582-L586 PolarHBondContact O-N 2.87Å; L583-L586 PolarHBondContact O-N 2.89Å; L586-G589 PolarHBondContact O-N 2.88Å; L586-L590 PolarHBondContact O-N 3.36Å
587	L	88.8	Confident	81.2	Confident	44 Å²	44	33.4 Å²	33.4	23%	0.23	18%	0.178	C	C	.	.	H	α-helix	trans	-63.7	-41.3	174.8	-177.1	66.5	0	0	0	112.1	L260 I263 V264 L583 G584 V585 G589 L590 I591	L260-L587 HydrophobicContact CD1-CD1 3.47Å; L260-L587 VanDerWaalsContact CD1-CD1 3.47Å; I263-L587 HydrophobicContact CG2-CB 4.13Å; I263-L587 HydrophobicContact CG2-CD1 4.36Å; V264-L587 HydrophobicContact CG2-CD1 4.25Å; L583-L587 PolarHBondContact O-N 2.84Å; G584-L587 WeakPolarHBondContact O-CB 3.39Å; G584-L587 PolarHBondContact O-N 3.02Å; V585-L587 VanDerWaalsContact C-N 3.27Å; V585-L587 PolarHBondContact O-N 3.41Å; L587-G589 VanDerWaalsContact C-N 3.32Å; L587-G589 PolarHBondContact O-N 2.92Å; L587-L590 PolarHBondContact O-N 3.29Å; L587-I591 HydrophobicContact CG-CD1 4.37Å; L587-I591 WeakPolarHBondContact O-CG1 3.26Å; L587-I591 PolarHBondContact O-N 3.39Å
588	I	83.5	Confident	82.6	Confident	62 Å²	62	35.8 Å²	35.8	32%	0.318	19%	0.194	S	C	.	.	H	α-helix	trans	-60.1	-45.8	174.1	-65.4	168.2	0	0	0	110	M424 G584 V585 L590 I591 L592	M424-I588 HydrophobicContact CE-CD1 4.45Å; M424-I588 HydrophobicContact SD-CD1 4.34Å; G584-I588 PolarHBondContact O-N 2.98Å; G584-I588 VanDerWaalsContact O-N 3.17Å; V585-I588 WeakPolarHBondContact O-CB 3.49Å; V585-I588 PolarHBondContact O-N 3.44Å; I588-L590 VanDerWaalsContact C-N 3.27Å; I588-L590 PolarHBondContact O-N 2.92Å; I588-I591 PolarHBondContact O-N 3.12Å; I588-L592 HydrophobicContact CG2-CD1 3.77Å; I588-L592 WeakPolarHBondContact O-CD1 3.25Å; I588-L592 VanDerWaalsContact O-CG 3.28Å; I588-L592 WeakPolarHBondContact O-CG 3.36Å; I588-L592 PolarHBondContact O-N 3.38Å; I588-L592 VanDerWaalsContact O-N 3.1Å
589	G	83.3	Confident	83.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-57.5	-38.6	175.3	0	0	0	0	0	113.1	V585 L586 L587 L592 A593	V585-G589 PolarHBondContact O-N 3.35Å; L586-G589 PolarHBondContact O-N 2.88Å; L587-G589 VanDerWaalsContact C-N 3.32Å; L587-G589 PolarHBondContact O-N 2.92Å; G589-L592 PolarHBondContact O-N 3.34Å; G589-A593 PolarHBondContact O-N 2.81Å
590	L	90.1	Very high	84.1	Confident	3 Å²	3	36 Å²	36	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-67.6	-46.1	178.7	-178.7	64.3	0	0	0	111.8	L256 S259 L260 I263 W534 L586 L587 I588 L592 A593 C594	L256-L590 HydrophobicContact CD2-CD1 3.91Å; S259-L590 WeakPolarHBondContact OG-CD1 3.45Å; L260-L590 HydrophobicContact CB-CD2 3.74Å; L260-L590 HydrophobicContact CD1-CD2 4.11Å; I263-L590 HydrophobicContact CD1-CD2 4.14Å; W534-L590 HydrophobicContact CD2-CD1 3.69Å; W534-L590 HydrophobicContact CE3-CB 4.15Å; W534-L590 HydrophobicContact CE3-CD1 3.92Å; W534-L590 HydrophobicContact CG-CD1 4.15Å; W534-L590 HydrophobicContact CH2-CB 3.71Å; W534-L590 HydrophobicContact CH2-CD1 4.19Å; W534-L590 HydrophobicContact CH2-CG 4.47Å; W534-L590 HydrophobicContact CZ2-CB 4.31Å; W534-L590 HydrophobicContact CZ2-CD1 4Å; W534-L590 HydrophobicContact CZ3-CB 3.66Å; W534-L590 HydrophobicContact CZ3-CD1 4.2Å; L586-L590 PolarHBondContact O-N 3.36Å; L587-L590 PolarHBondContact O-N 3.29Å; I588-L590 VanDerWaalsContact C-N 3.27Å; I588-L590 PolarHBondContact O-N 2.92Å; L590-L592 PolarHBondContact O-N 3.44Å; L590-A593 PolarHBondContact O-N 3.07Å; L590-A593 VanDerWaalsContact O-N 3.12Å; L590-C594 PolarHBondContact O-N 3.4Å; L590-C594 PolarHBondContact O-SG 3.06Å
591	I	86.9	Confident	84.6	Confident	104 Å²	104	33.4 Å²	33.4	53%	0.533	19%	0.185	S	C	.	.	H	α-helix	trans	-56.7	-41.1	177.1	-67.5	166.3	0	0	0	110.3	L587 I588 C594 F595	L587-I591 HydrophobicContact CG-CD1 4.37Å; L587-I591 WeakPolarHBondContact O-CG1 3.26Å; L587-I591 PolarHBondContact O-N 3.39Å; I588-I591 PolarHBondContact O-N 3.12Å; I591-C594 WeakPolarHBondContact O-CB 3.42Å; I591-C594 PolarHBondContact O-N 2.7Å; I591-F595 PolarHBondContact O-N 2.98Å
592	L	80.7	Confident	85.1	Confident	70 Å²	70	34.9 Å²	34.9	37%	0.366	20%	0.202	S	C	.	.	H	α-helix	trans	-73.3	-29.9	179.9	-68	167.5	0	0	0	113.4	L431 I588 G589 L590 P596	L431-L592 HydrophobicContact CB-CD1 4.38Å; L431-L592 HydrophobicContact CD1-CD1 3.04Å; L431-L592 HydrophobicContact CD1-CG 4.47Å; L431-L592 HydrophobicContact CD2-CB 4.02Å; L431-L592 HydrophobicContact CD2-CD1 3.46Å; L431-L592 VanDerWaalsContact CD2-CD1 3.46Å; L431-L592 HydrophobicContact CD2-CG 4.4Å; L431-L592 HydrophobicContact CG-CD1 3.73Å; I588-L592 HydrophobicContact CG2-CD1 3.77Å; I588-L592 WeakPolarHBondContact O-CD1 3.25Å; I588-L592 VanDerWaalsContact O-CG 3.28Å; I588-L592 WeakPolarHBondContact O-CG 3.36Å; I588-L592 PolarHBondContact O-N 3.38Å; I588-L592 VanDerWaalsContact O-N 3.1Å; G589-L592 PolarHBondContact O-N 3.34Å; L590-L592 PolarHBondContact O-N 3.44Å; L592-P596 WeakPolarHBondContact O-CD 3.39Å
593	A	86.5	Confident	85.1	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-69.9	-33.5	170.7	0	0	0	0	0	112	W534 I535 G589 L590 F595 P596 I597	W534-A593 HydrophobicContact CB-CB 3.68Å; W534-A593 HydrophobicContact CE3-CB 4.08Å; W534-A593 HydrophobicContact CG-CB 4.5Å; I535-A593 HydrophobicContact CD1-CB 4.39Å; I535-A593 HydrophobicContact CG1-CB 3.76Å; G589-A593 PolarHBondContact O-N 2.81Å; L590-A593 PolarHBondContact O-N 3.07Å; L590-A593 VanDerWaalsContact O-N 3.12Å; A593-F595 VanDerWaalsContact C-N 3.31Å; A593-F595 PolarHBondContact O-N 2.85Å; A593-P596 WeakPolarHBondContact O-CD 3.46Å; A593-P596 WeakPolarHBondContact O-CG 3.5Å; A593-I597 WeakPolarHBondContact O-CD1 3.43Å; A593-I597 VanDerWaalsContact O-CG1 3.3Å; A593-I597 WeakPolarHBondContact O-CG1 3.47Å
594	C	87.8	Confident	84.9	Confident	39 Å²	39	42.1 Å²	42.1	26%	0.264	24%	0.237	S	C	.	.	H	α-helix	trans	-64.4	-34.8	176	-66.7	0	0	0	0	112.4	L590 I591 I597 S598	L590-C594 PolarHBondContact O-N 3.4Å; L590-C594 PolarHBondContact O-SG 3.06Å; I591-C594 WeakPolarHBondContact O-CB 3.42Å; I591-C594 PolarHBondContact O-N 2.7Å; C594-I597 PolarHBondContact O-N 3.09Å; C594-S598 WeakPolarHBondContact O-CB 3.44Å; C594-S598 PolarHBondContact O-N 2.85Å; C594-S598 PolarHBondContact O-OG 3.45Å
595	F	84.7	Confident	84.7	Confident	135 Å²	135	46.2 Å²	46.2	59%	0.592	25%	0.247	S	C	*	.	H	α-helix	trans	-57.2	-57.6	-177.1	-177	-99.5	0	0	0	114.3	I591 A593 I597 S598 I599	I591-F595 PolarHBondContact O-N 2.98Å; A593-F595 VanDerWaalsContact C-N 3.31Å; A593-F595 PolarHBondContact O-N 2.85Å; F595-I597 VanDerWaalsContact C-N 3.33Å; F595-I597 PolarHBondContact O-N 3.22Å; F595-S598 PolarHBondContact O-N 3.48Å; F595-I599 HydrophobicContact CD1-CD1 3.88Å; F595-I599 HydrophobicContact CD2-CD1 4.47Å; F595-I599 HydrophobicContact CE1-CD1 3.37Å; F595-I599 HydrophobicContact CE2-CD1 4.03Å; F595-I599 HydrophobicContact CG-CD1 4.42Å; F595-I599 HydrophobicContact CZ-CD1 3.47Å; F595-I599 VanDerWaalsContact CZ-CD1 3.47Å; F595-I599 WeakPolarHBondContact O-CG1 3.17Å; F595-I599 PolarHBondContact O-N 3.47Å; F595-I599 VanDerWaalsContact O-N 3.08Å
596	P	82.4	Confident	84.6	Confident	27 Å²	27	46.2 Å²	46.2	18%	0.175	25%	0.247	C	C	.	.	H	α-helix	trans	-66.8	-31.7	178.8	27.2	-34.7	0	0	0	112.9	L438 I535 L592 A593 S600	L438-P596 HydrophobicContact CD1-CB 3.65Å; L438-P596 HydrophobicContact CD1-CG 3.99Å; I535-P596 HydrophobicContact CD1-CG 4Å; I535-P596 HydrophobicContact CG1-CG 4.12Å; L592-P596 WeakPolarHBondContact O-CD 3.39Å; A593-P596 WeakPolarHBondContact O-CD 3.46Å; A593-P596 WeakPolarHBondContact O-CG 3.5Å; P596-S600 VanDerWaalsContact O-CB 3.27Å; P596-S600 WeakPolarHBondContact O-CB 3.33Å; P596-S600 PolarHBondContact O-N 3.07Å
597	I	87.9	Confident	84	Confident	6 Å²	6	47.1 Å²	47.1	3%	0.031	25%	0.254	C	S	.	.	H	α-helix	trans	-66.1	-45.2	175.5	-62.8	170.2	0	0	0	110.2	L256 F538 A593 C594 F595 I599 S600 V601	L256-I597 HydrophobicContact CD1-CD1 4.11Å; L256-I597 HydrophobicContact CD1-CG2 4.45Å; L256-I597 HydrophobicContact CD2-CD1 4.33Å; F538-I597 HydrophobicContact CD2-CG2 4.46Å; A593-I597 WeakPolarHBondContact O-CD1 3.43Å; A593-I597 VanDerWaalsContact O-CG1 3.3Å; A593-I597 WeakPolarHBondContact O-CG1 3.47Å; C594-I597 PolarHBondContact O-N 3.09Å; F595-I597 VanDerWaalsContact C-N 3.33Å; F595-I597 PolarHBondContact O-N 3.22Å; I597-I599 PolarHBondContact O-N 3.04Å; I597-S600 WeakPolarHBondContact O-CB 3.3Å; I597-S600 PolarHBondContact O-N 3.26Å; I597-V601 HydrophobicContact CG2-CG2 4.36Å; I597-V601 WeakPolarHBondContact O-CG2 3.22Å; I597-V601 PolarHBondContact O-N 2.98Å
598	S	87.4	Confident	83.1	Confident	72 Å²	72	50.5 Å²	50.5	50%	0.503	27%	0.268	S	S	.	.	H	α-helix	trans	-62.6	-42.5	178.2	-67.2	0	0	0	0	112	C594 F595 S600 V601 A602	C594-S598 WeakPolarHBondContact O-CB 3.44Å; C594-S598 PolarHBondContact O-N 2.85Å; C594-S598 PolarHBondContact O-OG 3.45Å; F595-S598 PolarHBondContact O-N 3.48Å; S598-S600 VanDerWaalsContact C-N 3.33Å; S598-V601 PolarHBondContact O-N 3.19Å; S598-A602 WeakPolarHBondContact O-CB 3.25Å; S598-A602 PolarHBondContact O-N 3.15Å
599	I	84.8	Confident	82.2	Confident	51 Å²	51	49.8 Å²	49.8	26%	0.262	27%	0.271	S	S	.	.	H	α-helix	trans	-61.5	-44.8	174	-68.4	171.7	0	0	0	110.4	F595 I597 V601 A602 Q603 L604	F595-I599 HydrophobicContact CD1-CD1 3.88Å; F595-I599 HydrophobicContact CD2-CD1 4.47Å; F595-I599 HydrophobicContact CE1-CD1 3.37Å; F595-I599 HydrophobicContact CE2-CD1 4.03Å; F595-I599 HydrophobicContact CG-CD1 4.42Å; F595-I599 HydrophobicContact CZ-CD1 3.47Å; F595-I599 VanDerWaalsContact CZ-CD1 3.47Å; F595-I599 WeakPolarHBondContact O-CG1 3.17Å; F595-I599 PolarHBondContact O-N 3.47Å; F595-I599 VanDerWaalsContact O-N 3.08Å; I597-I599 PolarHBondContact O-N 3.04Å; I599-V601 PolarHBondContact O-N 2.99Å; I599-A602 PolarHBondContact O-N 2.86Å; I599-Q603 PolarHBondContact O-N 2.99Å; I599-L604 PolarHBondContact O-N 3.35Å
600	S	83.4	Confident	81.8	Confident	4 Å²	4	50.1 Å²	50.1	3%	0.028	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-42.5	178.5	-174.3	0	0	0	0	113.1	Y539 P596 I597 S598 L604	Y539-S600 VanDerWaalsContact OH-CB 3.24Å; Y539-S600 WeakPolarHBondContact OH-CB 3.34Å; Y539-S600 PolarHBondContact OH-OG 3.39Å; P596-S600 VanDerWaalsContact O-CB 3.27Å; P596-S600 WeakPolarHBondContact O-CB 3.33Å; P596-S600 PolarHBondContact O-N 3.07Å; I597-S600 WeakPolarHBondContact O-CB 3.3Å; I597-S600 PolarHBondContact O-N 3.26Å; S598-S600 VanDerWaalsContact C-N 3.33Å; S600-L604 WeakPolarHBondContact O-CB 3.22Å
601	V	87.6	Confident	81.4	Confident	16 Å²	16	50 Å²	50	10%	0.097	27%	0.273	C	S	.	.	H	α-helix	trans	-74	-37.2	-179.9	172.7	0	0	0	0	112.4	L249 F538 I597 S598 I599 W620	L249-V601 HydrophobicContact CD1-CG1 4.12Å; F538-V601 HydrophobicContact CE2-CG2 3.9Å; F538-V601 HydrophobicContact CZ-CG2 3.99Å; I597-V601 HydrophobicContact CG2-CG2 4.36Å; I597-V601 WeakPolarHBondContact O-CG2 3.22Å; I597-V601 PolarHBondContact O-N 2.98Å; S598-V601 PolarHBondContact O-N 3.19Å; I599-V601 PolarHBondContact O-N 2.99Å; V601-W620 HydrophobicContact CG1-CB 4.33Å; V601-W620 HydrophobicContact CG1-CE3 4.23Å; V601-W620 PolarHBondContact O-N 3Å; V601-W620 VanDerWaalsContact O-N 3.17Å
602	A	86.4	Confident	81.3	Confident	57 Å²	57	45.2 Å²	45.2	47%	0.471	25%	0.249	S	C	.	.	H	α-helix	trans	-92.4	-37.5	-170.3	0	0	0	0	0	114.6	S598 I599	S598-A602 WeakPolarHBondContact O-CB 3.25Å; S598-A602 PolarHBondContact O-N 3.15Å; I599-A602 PolarHBondContact O-N 2.86Å
603	Q	81.9	Confident	81.5	Confident	135 Å²	135	41.9 Å²	41.9	63%	0.631	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.9	-25.7	-169.8	-62.6	-173.8	3.4	0	0	113.6	I599	I599-Q603 PolarHBondContact O-N 2.99Å
604	L	78.3	Confident	81.1	Confident	26 Å²	26	43.3 Å²	43.3	14%	0.136	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-84.6	132.4	-175.9	-56.4	-175.1	0	0	0	111.5	W442 W467 I599 S600	W442-L604 VanDerWaalsContact CD1-CD2 3.47Å; W467-L604 HydrophobicContact CH2-CB 4.2Å; W467-L604 HydrophobicContact CH2-CD1 3.58Å; W467-L604 HydrophobicContact CZ2-CB 4.1Å; W467-L604 HydrophobicContact CZ2-CD1 4.25Å; W467-L604 HydrophobicContact CZ3-CD1 4.19Å; I599-L604 PolarHBondContact O-N 3.35Å; S600-L604 WeakPolarHBondContact O-CB 3.22Å
605	K	78.8	Confident	80.7	Confident	113 Å²	113	48.5 Å²	48.5	49%	0.491	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-75.7	122.9	172.6	-174.5	171	-176	177.7	0	109.1	W467 N617	W467-K605 PolarHBondContact NE1-O 3.15Å; K605-N617 WeakPolarHBondContact CA-O 3.44Å; K605-N617 WeakPolarHBondContact CG-O 3.35Å
606	P	78.6	Confident	80.6	Confident	6 Å²	6	44.1 Å²	44.1	4%	0.039	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-69.2	153.3	179.5	29.1	-32.8	0	0	0	111	E468 Q608 F613 Y616 N617	E468-P606 VanDerWaalsContact OE1-CA 3.25Å; E468-P606 WeakPolarHBondContact OE1-CA 3.46Å; P606-Q608 PolarHBondContact O-N 3.48Å; P606-F613 HydrophobicContact CB-CB 3.83Å; P606-F613 HydrophobicContact CG-CB 3.92Å; P606-F613 VanDerWaalsContact CG-O 3.22Å; P606-F613 WeakPolarHBondContact CG-O 3.26Å; P606-Y616 VanDerWaalsContact CG-O 3.25Å; P606-Y616 WeakPolarHBondContact CG-O 3.24Å; P606-N617 VanDerWaalsContact CD-O 3.23Å; P606-N617 WeakPolarHBondContact CD-O 3.34Å
607	S	73.9	Confident	80.6	Confident	19 Å²	19	47.3 Å²	47.3	13%	0.133	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-60.9	126.3	175.6	-68.1	0	0	0	0	111	W467 E468 A609	W467-S607 PolarHBondContact N-OG 3.43Å; W467-S607 PolarHBondContact NE1-OG 2.98Å; E468-S607 PolarHBondContact OE1-N 3.14Å; E468-S607 WeakPolarHBondContact OE2-CB 3.48Å; E468-S607 PolarHBondContact OE2-OG 3.18Å; S607-A609 PolarHBondContact O-N 3.35Å
608	Q	69.3	Low	80.4	Confident	114 Å²	114	48.5 Å²	48.5	53%	0.533	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-17.8	175.9	-66.1	-164.1	-12	0	0	113.4	P606	P606-Q608 PolarHBondContact O-N 3.48Å
609	A	65.6	Low	80.4	Confident	47 Å²	47	45.3 Å²	45.3	39%	0.388	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-19.9	-179.2	0	0	0	0	0	113.3	S607	S607-A609 PolarHBondContact O-N 3.35Å
610	C	75.2	Confident	80.5	Confident	8 Å²	8	49.5 Å²	49.5	5%	0.054	25%	0.253	C	S	.	.	S	Bend	trans	-170.9	168.6	-166.7	53.1	0	0	0	0	115.3	C466	C466-C610 WeakPolarHBondContact CA-SG 3.44Å; C466-C610 HydrophobicContact CB-CB 4.12Å; C466-C610 WeakPolarHBondContact CB-SG 3.45Å; C466-C610 WeakPolarHBondContact SG-CB 3.39Å; C466-C610 CovalentContact SG-SG 1.95Å; C466-C610 PolarHBondContact SG-SG 3.47Å
611	G	81.2	Confident	80.7	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.266	C	S	.	.	S	Bend	trans	83.4	169.7	-179.5	0	0	0	0	0	114	Y227 Y230 F613 S614	Y227-G611 VanDerWaalsContact CE1-CA 3.49Å; Y230-G611 CarbonylContact O-C 3.53Å; G611-F613 VanDerWaalsContact C-N 3.31Å; G611-F613 PolarHBondContact O-N 2.84Å; G611-S614 PolarHBondContact O-N 3.37Å; G611-S614 PolarHBondContact O-OG 3.44Å
612	P	84.1	Confident	80.7	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.019	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-34	-175.4	21.5	-35	0	0	0	112.3	Y227 Y230 P245 Y248 S614	Y227-P612 HydrophobicContact CD2-CG 4.33Å; Y227-P612 VanDerWaalsContact CE2-CD 3.43Å; Y227-P612 HydrophobicContact CE2-CG 3.52Å; Y227-P612 WeakPolarHBondContact OH-CD 3.41Å; Y230-P612 VanDerWaalsContact O-CA 3.27Å; Y230-P612 WeakPolarHBondContact O-CA 3.32Å; Y230-P612 WeakPolarHBondContact O-CD 3.24Å; P245-P612 HydrophobicContact CB-CB 4.32Å; P245-P612 HydrophobicContact CG-CB 4.27Å; P245-P612 WeakPolarHBondContact CG-O 3.2Å; Y248-P612 HydrophobicContact CD1-CG 4.39Å; Y248-P612 HydrophobicContact CD2-CG 4.27Å; Y248-P612 HydrophobicContact CG-CG 4.17Å; P612-S614 VanDerWaalsContact C-N 3.34Å; P612-S614 PolarHBondContact O-N 3.28Å
613	F	86.6	Confident	80.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	12.6	-174.3	-55	-68	0	0	0	114.4	Y227 P245 Y248 L249 F538 P606 G611 K615 Y616 S619 A622	Y227-F613 HydrophobicContact CE2-CD2 4.34Å; Y227-F613 HydrophobicContact CE2-CE2 4.44Å; Y227-F613 WeakPolarHBondContact OH-CD2 3.25Å; P245-F613 HydrophobicContact CB-CD1 3.72Å; P245-F613 HydrophobicContact CB-CE1 3.63Å; P245-F613 VanDerWaalsContact O-CE1 3.22Å; P245-F613 WeakPolarHBondContact O-CE1 3.23Å; P245-F613 WeakPolarHBondContact O-CZ 3.46Å; Y248-F613 AromaticContact CD1-CE2 3.76Å; Y248-F613 HydrophobicContact CD1-CE2 3.76Å; Y248-F613 AromaticContact CD1-CZ 3.95Å; Y248-F613 HydrophobicContact CD1-CZ 3.95Å; Y248-F613 HydrophobicContact CE1-CE2 4.4Å; Y248-F613 HydrophobicContact CG-CE2 4.45Å; Y248-F613 HydrophobicContact CG-CZ 4.39Å; L249-F613 HydrophobicContact CB-CZ 4.24Å; F538-F613 HydrophobicContact CE2-CE2 4.42Å; F538-F613 HydrophobicContact CZ-CE2 4.25Å; P606-F613 HydrophobicContact CB-CB 3.83Å; P606-F613 HydrophobicContact CG-CB 3.92Å; P606-F613 VanDerWaalsContact CG-O 3.22Å; P606-F613 WeakPolarHBondContact CG-O 3.26Å; G611-F613 VanDerWaalsContact C-N 3.31Å; G611-F613 PolarHBondContact O-N 2.84Å; F613-K615 PolarHBondContact O-N 3.49Å; F613-Y616 PolarHBondContact O-N 2.92Å; F613-S619 WeakPolarHBondContact CD2-OG 3.23Å; F613-A622 HydrophobicContact CD1-CB 4.07Å; F613-A622 HydrophobicContact CE1-CB 3.94Å
614	S	78.3	Confident	80.8	Confident	31 Å²	31	47.1 Å²	47.1	22%	0.217	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-22.3	-172.8	53.8	0	0	0	0	115.8	G611 P612	G611-S614 PolarHBondContact O-N 3.37Å; G611-S614 PolarHBondContact O-OG 3.44Å; P612-S614 VanDerWaalsContact C-N 3.34Å; P612-S614 PolarHBondContact O-N 3.28Å
615	K	79.1	Confident	81.1	Confident	149 Å²	149	47.4 Å²	47.4	65%	0.648	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-10	178.6	-63.1	-173.5	-172.3	174.7	0	114.6	D233 F613	D233-K615 HydrophobicContact CB-CD 4.41Å; D233-K615 VanDerWaalsContact OD2-CD 3.29Å; D233-K615 WeakPolarHBondContact OD2-CD 3.26Å; D233-K615 WeakPolarHBondContact OD2-CE 3.38Å; D233-K615 IonicContact OD2-NZ 3.84Å; D233-K615 PolarHBondContact OD2-NZ 3.33Å; F613-K615 PolarHBondContact O-N 3.49Å
616	Y	81.7	Confident	81.4	Confident	43 Å²	43	42.6 Å²	42.6	17%	0.169	22%	0.224	C	C	.	.	S	Bend	trans	-104	153.3	-175.8	-61.3	-83.6	0	0	0	110.7	P245 P606 F613 T618 E621 A622 A625	P245-Y616 HydrophobicContact CB-CE2 4.24Å; P245-Y616 HydrophobicContact CG-CE2 4.3Å; P606-Y616 VanDerWaalsContact CG-O 3.25Å; P606-Y616 WeakPolarHBondContact CG-O 3.24Å; F613-Y616 PolarHBondContact O-N 2.92Å; Y616-T618 VanDerWaalsContact CB-O 3.32Å; Y616-T618 WeakPolarHBondContact CB-O 3.5Å; Y616-E621 HydrophobicContact CD1-CB 3.76Å; Y616-E621 HydrophobicContact CG-CB 4.35Å; Y616-A622 HydrophobicContact CD2-CB 4.33Å; Y616-A622 HydrophobicContact CE1-CB 4.41Å; Y616-A622 HydrophobicContact CE2-CB 4.09Å; Y616-A625 HydrophobicContact CE1-CB 3.96Å
617	N	81.8	Confident	81.7	Confident	93 Å²	93	43.1 Å²	43.1	50%	0.497	23%	0.227	S	C	.	.	S	Bend	trans	-79	-28.1	174.6	-73.4	-35.4	0	0	0	111.6	K605 P606 E621	K605-N617 WeakPolarHBondContact CA-O 3.44Å; K605-N617 WeakPolarHBondContact CG-O 3.35Å; P606-N617 VanDerWaalsContact CD-O 3.23Å; P606-N617 WeakPolarHBondContact CD-O 3.34Å; N617-E621 WeakPolarHBondContact CB-OE1 3.42Å; N617-E621 PolarHBondContact N-OE2 3.02Å
618	T	85.2	Confident	82.2	Confident	31 Å²	31	47.2 Å²	47.2	19%	0.19	24%	0.244	C	C	.	.	S	Bend	trans	-135.4	149.3	171.2	59	0	0	0	0	109.8	Y616 W620 E621	Y616-T618 VanDerWaalsContact CB-O 3.32Å; Y616-T618 WeakPolarHBondContact CB-O 3.5Å; T618-W620 PolarHBondContact O-N 2.59Å; T618-E621 PolarHBondContact N-OE1 3.04Å; T618-E621 WeakPolarHBondContact O-CB 3.32Å; T618-E621 PolarHBondContact O-N 2.8Å; T618-E621 VanDerWaalsContact O-N 3.16Å; T618-E621 VanDerWaalsContact OG1-CG 3.31Å; T618-E621 WeakPolarHBondContact OG1-CG 3.31Å; T618-E621 PolarHBondContact OG1-OE1 3.02Å
619	S	87.5	Confident	82.8	Confident	6 Å²	6	45.1 Å²	45.1	4%	0.042	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-61.5	-28.6	177.6	-57.3	0	0	0	0	111.9	L249 F613 E621	L249-S619 WeakPolarHBondContact CD1-O 3.1Å; F613-S619 WeakPolarHBondContact CD2-OG 3.23Å; S619-E621 VanDerWaalsContact C-N 3.34Å; S619-E621 PolarHBondContact O-N 3.39Å
620	W	87.1	Confident	83.7	Confident	139 Å²	139	46.2 Å²	46.2	53%	0.527	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-63.2	-32.3	176.6	-176.2	-106.1	0	0	0	113.8	V601 T618 A622 L623 P624	V601-W620 HydrophobicContact CG1-CB 4.33Å; V601-W620 HydrophobicContact CG1-CE3 4.23Å; V601-W620 PolarHBondContact O-N 3Å; V601-W620 VanDerWaalsContact O-N 3.17Å; T618-W620 PolarHBondContact O-N 2.59Å; W620-A622 PolarHBondContact O-N 3.48Å; W620-A622 VanDerWaalsContact O-N 3.13Å; W620-L623 HydrophobicContact CH2-CD2 3.68Å; W620-L623 HydrophobicContact CZ2-CD2 3.99Å; W620-L623 HydrophobicContact CZ3-CD2 3.99Å; W620-L623 PolarHBondContact O-N 3.24Å; W620-L623 VanDerWaalsContact O-N 3.07Å; W620-P624 WeakPolarHBondContact O-CD 3.49Å
621	E	87.8	Confident	84.2	Confident	65 Å²	65	50 Å²	50	30%	0.304	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-60.6	-22.7	-178.6	-80.9	159.1	-146.5	0	0	114	Y616 N617 T618 S619 L623 P624 A625	Y616-E621 HydrophobicContact CD1-CB 3.76Å; Y616-E621 HydrophobicContact CG-CB 4.35Å; N617-E621 WeakPolarHBondContact CB-OE1 3.42Å; N617-E621 PolarHBondContact N-OE2 3.02Å; T618-E621 PolarHBondContact N-OE1 3.04Å; T618-E621 WeakPolarHBondContact O-CB 3.32Å; T618-E621 PolarHBondContact O-N 2.8Å; T618-E621 VanDerWaalsContact O-N 3.16Å; T618-E621 VanDerWaalsContact OG1-CG 3.31Å; T618-E621 WeakPolarHBondContact OG1-CG 3.31Å; T618-E621 PolarHBondContact OG1-OE1 3.02Å; S619-E621 VanDerWaalsContact C-N 3.34Å; S619-E621 PolarHBondContact O-N 3.39Å; E621-L623 PolarHBondContact O-N 3.38Å; E621-P624 VanDerWaalsContact O-CD 3.26Å; E621-P624 WeakPolarHBondContact O-CD 3.43Å; E621-P624 WeakPolarHBondContact O-CG 3.26Å; E621-A625 VanDerWaalsContact O-CB 3.26Å; E621-A625 WeakPolarHBondContact O-CB 3.49Å; E621-A625 PolarHBondContact O-N 2.99Å; E621-A625 VanDerWaalsContact O-N 3.14Å
622	A	85.9	Confident	84.5	Confident	2 Å²	2	57.4 Å²	57.4	2%	0.017	30%	0.304	C	S	.	.	H	α-helix	trans	-60.9	-29.3	175.4	0	0	0	0	0	112.7	P245 F613 Y616 W620 A626	P245-A622 HydrophobicContact CB-CB 4.1Å; F613-A622 HydrophobicContact CD1-CB 4.07Å; F613-A622 HydrophobicContact CE1-CB 3.94Å; Y616-A622 HydrophobicContact CD2-CB 4.33Å; Y616-A622 HydrophobicContact CE1-CB 4.41Å; Y616-A622 HydrophobicContact CE2-CB 4.09Å; W620-A622 PolarHBondContact O-N 3.48Å; W620-A622 VanDerWaalsContact O-N 3.13Å; A622-A626 WeakPolarHBondContact O-CB 3.21Å; A622-A626 PolarHBondContact O-N 2.94Å
623	L	86.8	Confident	84.5	Confident	44 Å²	44	62 Å²	62	23%	0.23	34%	0.336	C	S	.	.	H	α-helix	trans	-72.5	-57.6	179.5	-175.1	65.7	0	0	0	112.8	L246 W620 E621 A625 A626 V627	L246-L623 HydrophobicContact CD1-CD1 3.7Å; W620-L623 HydrophobicContact CH2-CD2 3.68Å; W620-L623 HydrophobicContact CZ2-CD2 3.99Å; W620-L623 HydrophobicContact CZ3-CD2 3.99Å; W620-L623 PolarHBondContact O-N 3.24Å; W620-L623 VanDerWaalsContact O-N 3.07Å; E621-L623 PolarHBondContact O-N 3.38Å; L623-A625 VanDerWaalsContact C-N 3.32Å; L623-A625 PolarHBondContact O-N 3.04Å; L623-A626 WeakPolarHBondContact O-CB 3.46Å; L623-A626 PolarHBondContact O-N 2.77Å; L623-A626 VanDerWaalsContact O-N 3.15Å; L623-V627 WeakPolarHBondContact O-CG2 3.24Å; L623-V627 PolarHBondContact O-N 2.9Å
624	P	84.5	Confident	84.4	Confident	50 Å²	50	63.7 Å²	63.7	33%	0.325	35%	0.35	S	S	.	.	H	α-helix	trans	-61.7	-37.6	176.7	24.3	-32.5	0	0	0	112.2	W620 E621 A626 V627 E628	W620-P624 WeakPolarHBondContact O-CD 3.49Å; E621-P624 VanDerWaalsContact O-CD 3.26Å; E621-P624 WeakPolarHBondContact O-CD 3.43Å; E621-P624 WeakPolarHBondContact O-CG 3.26Å; P624-A626 VanDerWaalsContact C-N 3.26Å; P624-A626 PolarHBondContact O-N 3.47Å; P624-V627 PolarHBondContact O-N 2.88Å; P624-E628 WeakPolarHBondContact O-CG 3.41Å; P624-E628 PolarHBondContact O-N 3.36Å
625	A	84.9	Confident	84.8	Confident	32 Å²	32	66.3 Å²	66.3	26%	0.264	36%	0.355	S	S	.	.	H	α-helix	trans	-61.2	-34.2	175.2	0	0	0	0	0	112.7	Y616 E621 L623 A629	Y616-A625 HydrophobicContact CE1-CB 3.96Å; E621-A625 VanDerWaalsContact O-CB 3.26Å; E621-A625 WeakPolarHBondContact O-CB 3.49Å; E621-A625 PolarHBondContact O-N 2.99Å; E621-A625 VanDerWaalsContact O-N 3.14Å; L623-A625 VanDerWaalsContact C-N 3.32Å; L623-A625 PolarHBondContact O-N 3.04Å; A625-A629 PolarHBondContact O-N 3.45Å
626	A	83.8	Confident	85.2	Confident	12 Å²	12	64.4 Å²	64.4	10%	0.099	35%	0.352	C	S	.	.	H	α-helix	trans	-72.8	-37.8	172.2	0	0	0	0	0	112.8	L246 A622 L623 P624 E628 A629	L246-A626 HydrophobicContact CB-CB 4.45Å; L246-A626 HydrophobicContact CD1-CB 3.74Å; L246-A626 HydrophobicContact CD2-CB 3.56Å; L246-A626 HydrophobicContact CG-CB 4.1Å; A622-A626 WeakPolarHBondContact O-CB 3.21Å; A622-A626 PolarHBondContact O-N 2.94Å; L623-A626 WeakPolarHBondContact O-CB 3.46Å; L623-A626 PolarHBondContact O-N 2.77Å; L623-A626 VanDerWaalsContact O-N 3.15Å; P624-A626 VanDerWaalsContact C-N 3.26Å; P624-A626 PolarHBondContact O-N 3.47Å; A626-E628 VanDerWaalsContact C-N 3.29Å; A626-E628 PolarHBondContact O-N 2.93Å; A626-A629 PolarHBondContact O-N 3.37Å; A626-A629 VanDerWaalsContact O-N 3.15Å
627	V	85.3	Confident	85.4	Confident	17 Å²	17	66.4 Å²	66.4	10%	0.103	37%	0.369	C	S	.	.	H	α-helix	trans	-64.2	-36.2	176.4	173.2	0	0	0	0	111.2	L623 P624 A629 L630 R635 I638 Y639	L623-V627 WeakPolarHBondContact O-CG2 3.24Å; L623-V627 PolarHBondContact O-N 2.9Å; P624-V627 PolarHBondContact O-N 2.88Å; V627-A629 VanDerWaalsContact C-N 3.31Å; V627-A629 PolarHBondContact O-N 3.43Å; V627-L630 WeakPolarHBondContact O-CB 3.21Å; V627-L630 PolarHBondContact O-N 3Å; V627-R635 HydrophobicContact CG1-CG 4.43Å; V627-I638 HydrophobicContact CG1-CB 4.23Å; V627-I638 HydrophobicContact CG1-CD1 4.2Å; V627-I638 HydrophobicContact CG1-CG2 3.88Å; V627-I638 HydrophobicContact CG2-CD1 4.26Å; V627-I638 HydrophobicContact CG2-CG2 4.16Å; V627-Y639 HydrophobicContact CG1-CE2 4.37Å
628	E	85	Confident	85.5	Confident	106 Å²	106	65 Å²	65	50%	0.495	36%	0.36	S	S	.	.	H	α-helix	trans	-67.7	-29.6	173.8	-73	177.5	-171.8	0	0	112.5	P624 A626 L630 R635	P624-E628 WeakPolarHBondContact O-CG 3.41Å; P624-E628 PolarHBondContact O-N 3.36Å; A626-E628 VanDerWaalsContact C-N 3.29Å; A626-E628 PolarHBondContact O-N 2.93Å; E628-L630 PolarHBondContact O-N 3.11Å; E628-R635 VanDerWaalsContact O-CZ 3.31Å; E628-R635 PolarHBondContact O-NH2 3.49Å
629	A	82.6	Confident	85.6	Confident	69 Å²	69	68.7 Å²	68.7	57%	0.57	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-8.9	175.7	0	0	0	0	0	114	A625 A626 V627	A625-A629 PolarHBondContact O-N 3.45Å; A626-A629 PolarHBondContact O-N 3.37Å; A626-A629 VanDerWaalsContact O-N 3.15Å; V627-A629 VanDerWaalsContact C-N 3.31Å; V627-A629 PolarHBondContact O-N 3.43Å
630	L	83.4	Confident	85.6	Confident	70 Å²	70	74.7 Å²	74.7	37%	0.366	40%	0.397	S	S	.	.	S	Bend	trans	-79.1	156.6	-179.6	-72.9	169.6	0	0	0	113.1	V627 E628 A634 I638	V627-L630 WeakPolarHBondContact O-CB 3.21Å; V627-L630 PolarHBondContact O-N 3Å; E628-L630 PolarHBondContact O-N 3.11Å; L630-A634 HydrophobicContact CB-CB 4.32Å; L630-I638 HydrophobicContact CD1-CD1 3.64Å
631	P	86.4	Confident	85.5	Confident	89 Å²	89	72.4 Å²	72.4	58%	0.578	40%	0.395	S	S	*	.			trans	-59.8	149.6	173.9	25.3	-34.7	0	0	0	111.8	S633 A634 R635	P631-S633 VanDerWaalsContact C-N 3.25Å; P631-S633 PolarHBondContact O-N 3.44Å; P631-S633 VanDerWaalsContact O-N 3.09Å; P631-A634 HydrophobicContact CG-CB 4.16Å; P631-A634 PolarHBondContact O-N 2.89Å; P631-R635 PolarHBondContact O-N 2.88Å
632	Q	87.3	Confident	85.3	Confident	155 Å²	155	73 Å²	73	72%	0.724	41%	0.411	S	S	*	.	H	α-helix	trans	-50.2	-41	-172.6	-71.4	173.2	-13	0	0	113.5	A634 R635 N636	Q632-A634 PolarHBondContact O-N 2.79Å; Q632-R635 PolarHBondContact O-N 3.41Å; Q632-N636 WeakPolarHBondContact O-CB 3.49Å; Q632-N636 PolarHBondContact O-N 2.96Å; Q632-N636 PolarHBondContact O-OD1 2.91Å
633	S	84.6	Confident	85.5	Confident	98 Å²	98	74.7 Å²	74.7	69%	0.685	42%	0.423	S	S	*	.	H	α-helix	trans	-63.3	-42.9	179	-48.5	0	0	0	0	113	P631 V637	P631-S633 VanDerWaalsContact C-N 3.25Å; P631-S633 PolarHBondContact O-N 3.44Å; P631-S633 VanDerWaalsContact O-N 3.09Å; S633-V637 WeakPolarHBondContact O-CG2 3.48Å; S633-V637 PolarHBondContact O-N 3.15Å
634	A	83.3	Confident	85.7	Confident	36 Å²	36	80.3 Å²	80.3	30%	0.298	45%	0.448	S	S	.	.	H	α-helix	trans	-71.4	-40	179.2	0	0	0	0	0	111.1	L630 P631 Q632 N636 V637 I638	L630-A634 HydrophobicContact CB-CB 4.32Å; P631-A634 HydrophobicContact CG-CB 4.16Å; P631-A634 PolarHBondContact O-N 2.89Å; Q632-A634 PolarHBondContact O-N 2.79Å; A634-N636 PolarHBondContact O-N 2.81Å; A634-V637 PolarHBondContact O-N 3.27Å; A634-I638 WeakPolarHBondContact O-CG1 3.45Å; A634-I638 PolarHBondContact O-N 2.97Å; A634-I638 VanDerWaalsContact O-N 3.07Å
635	R	87	Confident	85.8	Confident	86 Å²	86	82.1 Å²	82.1	33%	0.325	46%	0.458	S	S	.	.	H	α-helix	trans	-57.4	-48.8	175.6	-171	-169.1	-62.5	-174	8.7	111.6	V627 E628 P631 Q632 V637 I638 Y639	V627-R635 HydrophobicContact CG1-CG 4.43Å; E628-R635 VanDerWaalsContact O-CZ 3.31Å; E628-R635 PolarHBondContact O-NH2 3.49Å; P631-R635 PolarHBondContact O-N 2.88Å; Q632-R635 PolarHBondContact O-N 3.41Å; R635-V637 VanDerWaalsContact C-N 3.32Å; R635-V637 PolarHBondContact O-N 2.95Å; R635-I638 PolarHBondContact O-N 3.41Å; R635-Y639 HydrophobicContact CG-CD2 3.65Å; R635-Y639 HydrophobicContact CG-CE2 3.38Å; R635-Y639 VanDerWaalsContact O-CD2 3.27Å; R635-Y639 WeakPolarHBondContact O-CD2 3.29Å; R635-Y639 PolarHBondContact O-N 3.31Å
636	N	86.6	Confident	86.1	Confident	109 Å²	109	83.8 Å²	83.8	58%	0.583	46%	0.459	S	S	*	.	H	α-helix	trans	-62.6	-37.5	-179.7	-70.1	-2.6	0	0	0	112.5	Q632 A634 F640	Q632-N636 WeakPolarHBondContact O-CB 3.49Å; Q632-N636 PolarHBondContact O-N 2.96Å; Q632-N636 PolarHBondContact O-OD1 2.91Å; A634-N636 PolarHBondContact O-N 2.81Å; N636-F640 VanDerWaalsContact O-CB 3.31Å; N636-F640 WeakPolarHBondContact O-CB 3.34Å; N636-F640 PolarHBondContact O-N 3.21Å
637	V	86.1	Confident	86.2	Confident	86 Å²	86	85.8 Å²	85.8	52%	0.521	48%	0.476	S	S	.	.	H	α-helix	trans	-65.9	-42.6	176	172.1	0	0	0	0	111.4	S633 A634 R635 F640 L641	S633-V637 WeakPolarHBondContact O-CG2 3.48Å; S633-V637 PolarHBondContact O-N 3.15Å; A634-V637 PolarHBondContact O-N 3.27Å; R635-V637 VanDerWaalsContact C-N 3.32Å; R635-V637 PolarHBondContact O-N 2.95Å; V637-F640 PolarHBondContact O-N 2.85Å; V637-L641 HydrophobicContact CG1-CD1 3.94Å; V637-L641 WeakPolarHBondContact O-CG 3.31Å; V637-L641 PolarHBondContact O-N 3.4Å
638	I	85.5	Confident	86.5	Confident	63 Å²	63	90.2 Å²	90.2	32%	0.323	50%	0.498	S	S	.	.	H	α-helix	trans	-66.5	-44.9	179.4	-66.6	168.8	0	0	0	110.8	V627 L630 A634 R635 F640 L641 A642	V627-I638 HydrophobicContact CG1-CB 4.23Å; V627-I638 HydrophobicContact CG1-CD1 4.2Å; V627-I638 HydrophobicContact CG1-CG2 3.88Å; V627-I638 HydrophobicContact CG2-CD1 4.26Å; V627-I638 HydrophobicContact CG2-CG2 4.16Å; L630-I638 HydrophobicContact CD1-CD1 3.64Å; A634-I638 WeakPolarHBondContact O-CG1 3.45Å; A634-I638 PolarHBondContact O-N 2.97Å; A634-I638 VanDerWaalsContact O-N 3.07Å; R635-I638 PolarHBondContact O-N 3.41Å; I638-F640 VanDerWaalsContact C-N 3.33Å; I638-F640 PolarHBondContact O-N 2.94Å; I638-L641 PolarHBondContact O-N 2.92Å; I638-A642 WeakPolarHBondContact O-CB 3.46Å; I638-A642 PolarHBondContact O-N 2.89Å
639	Y	86.4	Confident	86.7	Confident	109 Å²	109	88.6 Å²	88.6	43%	0.427	50%	0.498	S	S	.	.	H	α-helix	trans	-66	-34	176.2	-76.9	-63.2	0	0	0	113	V627 R635 A642 S643	V627-Y639 HydrophobicContact CG1-CE2 4.37Å; R635-Y639 HydrophobicContact CG-CD2 3.65Å; R635-Y639 HydrophobicContact CG-CE2 3.38Å; R635-Y639 VanDerWaalsContact O-CD2 3.27Å; R635-Y639 WeakPolarHBondContact O-CD2 3.29Å; R635-Y639 PolarHBondContact O-N 3.31Å; Y639-A642 PolarHBondContact O-N 3.3Å; Y639-S643 PolarHBondContact O-N 2.96Å
640	F	86.9	Confident	87	Confident	131 Å²	131	91 Å²	91	58%	0.575	50%	0.496	S	S	*	.	H	α-helix	trans	-63	-45.2	172.2	177.3	-98.1	0	0	0	111.7	N636 V637 I638 A642 S643 F646	N636-F640 VanDerWaalsContact O-CB 3.31Å; N636-F640 WeakPolarHBondContact O-CB 3.34Å; N636-F640 PolarHBondContact O-N 3.21Å; V637-F640 PolarHBondContact O-N 2.85Å; I638-F640 VanDerWaalsContact C-N 3.33Å; I638-F640 PolarHBondContact O-N 2.94Å; F640-A642 VanDerWaalsContact C-N 3.33Å; F640-A642 PolarHBondContact O-N 2.87Å; F640-S643 VanDerWaalsContact O-CB 3.27Å; F640-S643 WeakPolarHBondContact O-CB 3.4Å; F640-S643 PolarHBondContact O-N 3.29Å; F640-F646 HydrophobicContact CD1-CD2 4.49Å; F640-F646 AromaticContact CE1-CD2 3.85Å; F640-F646 HydrophobicContact CE1-CD2 3.85Å; F640-F646 HydrophobicContact CE1-CE2 4.38Å; F640-F646 HydrophobicContact CZ-CD2 4.33Å; F640-F646 VanDerWaalsContact O-CB 3.31Å; F640-F646 WeakPolarHBondContact O-CB 3.31Å
641	L	85.1	Confident	87.2	Confident	91 Å²	91	94.1 Å²	94.1	48%	0.476	51%	0.507	S	S	.	.	H	α-helix	trans	-64.8	-35	175.8	-77.4	160.5	0	0	0	112.8	V637 I638 S643 F646	V637-L641 HydrophobicContact CG1-CD1 3.94Å; V637-L641 WeakPolarHBondContact O-CG 3.31Å; V637-L641 PolarHBondContact O-N 3.4Å; I638-L641 PolarHBondContact O-N 2.92Å; L641-S643 VanDerWaalsContact C-N 3.29Å; L641-F646 HydrophobicContact CD2-CD1 4.27Å; L641-F646 HydrophobicContact CD2-CE1 3.67Å; L641-F646 HydrophobicContact CD2-CE2 4.23Å; L641-F646 HydrophobicContact CD2-CZ 3.64Å; L641-F646 VanDerWaalsContact O-CD1 3.24Å; L641-F646 WeakPolarHBondContact O-CD1 3.43Å
642	A	83.7	Confident	87.5	Confident	77 Å²	77	93.4 Å²	93.4	64%	0.636	50%	0.501	S	S	*	.	H	α-helix	trans	-81.6	-5.8	177.9	0	0	0	0	0	113.4	I638 Y639 F640	I638-A642 WeakPolarHBondContact O-CB 3.46Å; I638-A642 PolarHBondContact O-N 2.89Å; Y639-A642 PolarHBondContact O-N 3.3Å; F640-A642 VanDerWaalsContact C-N 3.33Å; F640-A642 PolarHBondContact O-N 2.87Å
643	S	91	Very high	87.7	Confident	39 Å²	39	90.4 Å²	90.4	27%	0.273	49%	0.493	S	S	.	.	S	Bend	trans	-67.1	139.6	-179.7	-174.3	0	0	0	0	111.3	Y639 F640 L641 T645 F646 A647	Y639-S643 PolarHBondContact O-N 2.96Å; F640-S643 VanDerWaalsContact O-CB 3.27Å; F640-S643 WeakPolarHBondContact O-CB 3.4Å; F640-S643 PolarHBondContact O-N 3.29Å; L641-S643 VanDerWaalsContact C-N 3.29Å; S643-T645 PolarHBondContact O-N 3.04Å; S643-T645 PolarHBondContact OG-N 3.41Å; S643-T645 PolarHBondContact OG-OG1 2.73Å; S643-F646 PolarHBondContact O-N 2.98Å; S643-A647 PolarHBondContact O-N 3.19Å; S643-A647 VanDerWaalsContact O-N 3.09Å
644	E	90.4	Very high	87.8	Confident	162 Å²	162	88.3 Å²	88.3	76%	0.757	48%	0.476	S	S	*	.	H	α-helix	trans	-54.4	-34.6	173.3	-61.5	-179.8	-179.8	0	0	111.8	A647 I648	E644-A647 PolarHBondContact O-N 3.07Å; E644-I648 VanDerWaalsContact O-CG1 3.27Å; E644-I648 WeakPolarHBondContact O-CG1 3.3Å; E644-I648 PolarHBondContact O-N 3.11Å
645	T	87.6	Confident	88	Confident	88 Å²	88	88.3 Å²	88.3	54%	0.54	47%	0.473	S	S	.	.	H	α-helix	trans	-65.1	-40	178.1	61.3	0	0	0	0	112.8	S643 S649	S643-T645 PolarHBondContact O-N 3.04Å; S643-T645 PolarHBondContact OG-N 3.41Å; S643-T645 PolarHBondContact OG-OG1 2.73Å; T645-S649 WeakPolarHBondContact O-CB 3.41Å; T645-S649 PolarHBondContact O-N 3.34Å; T645-S649 PolarHBondContact O-OG 3.43Å
646	F	90.8	Very high	88.2	Confident	66 Å²	66	89.6 Å²	89.6	29%	0.289	49%	0.486	S	S	.	.	H	α-helix	trans	-69	-42.2	175.2	179.7	-96.2	0	0	0	110.7	F640 L641 S643 I648 S649 F650	F640-F646 HydrophobicContact CD1-CD2 4.49Å; F640-F646 AromaticContact CE1-CD2 3.85Å; F640-F646 HydrophobicContact CE1-CD2 3.85Å; F640-F646 HydrophobicContact CE1-CE2 4.38Å; F640-F646 HydrophobicContact CZ-CD2 4.33Å; F640-F646 VanDerWaalsContact O-CB 3.31Å; F640-F646 WeakPolarHBondContact O-CB 3.31Å; L641-F646 HydrophobicContact CD2-CD1 4.27Å; L641-F646 HydrophobicContact CD2-CE1 3.67Å; L641-F646 HydrophobicContact CD2-CE2 4.23Å; L641-F646 HydrophobicContact CD2-CZ 3.64Å; L641-F646 VanDerWaalsContact O-CD1 3.24Å; L641-F646 WeakPolarHBondContact O-CD1 3.43Å; S643-F646 PolarHBondContact O-N 2.98Å; F646-I648 PolarHBondContact O-N 3.26Å; F646-S649 PolarHBondContact O-N 2.91Å; F646-F650 HydrophobicContact CE1-CB 4.41Å; F646-F650 VanDerWaalsContact O-CB 3.23Å; F646-F650 WeakPolarHBondContact O-CB 3.44Å; F646-F650 PolarHBondContact O-N 3.13Å
647	A	85.8	Confident	88.3	Confident	55 Å²	55	86.9 Å²	86.9	46%	0.455	48%	0.479	S	S	.	.	H	α-helix	trans	-60.3	-46.5	177.8	0	0	0	0	0	112.1	S643 E644 F650 F651	S643-A647 PolarHBondContact O-N 3.19Å; S643-A647 VanDerWaalsContact O-N 3.09Å; E644-A647 PolarHBondContact O-N 3.07Å; A647-F650 PolarHBondContact O-N 3.08Å; A647-F651 WeakPolarHBondContact O-CB 2.75Å; A647-F651 PolarHBondContact O-N 3.06Å
648	I	90.6	Very high	88.3	Confident	110 Å²	110	87.5 Å²	87.5	56%	0.564	48%	0.477	S	S	*	.	H	α-helix	trans	-63.1	-46.5	176.6	-66.1	164.4	0	0	0	110.5	E644 F646 F650 F651 V652	E644-I648 VanDerWaalsContact O-CG1 3.27Å; E644-I648 WeakPolarHBondContact O-CG1 3.3Å; E644-I648 PolarHBondContact O-N 3.11Å; F646-I648 PolarHBondContact O-N 3.26Å; I648-F650 PolarHBondContact O-N 3.16Å; I648-F651 WeakPolarHBondContact O-CB 3.28Å; I648-F651 PolarHBondContact O-N 3.18Å; I648-V652 WeakPolarHBondContact O-CG2 3.27Å; I648-V652 PolarHBondContact O-N 2.87Å
649	S	89.3	Confident	88.6	Confident	71 Å²	71	90.8 Å²	90.8	50%	0.497	49%	0.49	S	S	.	.	H	α-helix	trans	-61.9	-44.1	179.4	-60.1	0	0	0	0	111.8	T645 F646 V652 V653	T645-S649 WeakPolarHBondContact O-CB 3.41Å; T645-S649 PolarHBondContact O-N 3.34Å; T645-S649 PolarHBondContact O-OG 3.43Å; F646-S649 PolarHBondContact O-N 2.91Å; S649-V652 PolarHBondContact O-N 2.98Å; S649-V653 WeakPolarHBondContact O-CG2 3.5Å; S649-V653 PolarHBondContact O-N 2.93Å
650	F	88.5	Confident	88.9	Confident	121 Å²	121	93.1 Å²	93.1	53%	0.531	50%	0.499	S	S	.	.	H	α-helix	trans	-62.1	-44.6	175.5	-178.7	-101.1	0	0	0	111.3	F646 A647 I648 V652 V653 T654	F646-F650 HydrophobicContact CE1-CB 4.41Å; F646-F650 VanDerWaalsContact O-CB 3.23Å; F646-F650 WeakPolarHBondContact O-CB 3.44Å; F646-F650 PolarHBondContact O-N 3.13Å; A647-F650 PolarHBondContact O-N 3.08Å; I648-F650 PolarHBondContact O-N 3.16Å; F650-V652 PolarHBondContact O-N 2.8Å; F650-V653 PolarHBondContact O-N 3.39Å; F650-T654 HydrophobicContact CD1-CG2 4.15Å; F650-T654 HydrophobicContact CE1-CG2 3.71Å; F650-T654 HydrophobicContact CE2-CG2 4.12Å; F650-T654 HydrophobicContact CZ-CG2 3.69Å; F650-T654 WeakPolarHBondContact O-CG2 3.34Å; F650-T654 PolarHBondContact O-N 3.43Å; F650-T654 PolarHBondContact O-OG1 3.3Å; F650-T654 VanDerWaalsContact O-OG1 3.04Å
651	F	88.9	Confident	88.8	Confident	134 Å²	134	91 Å²	91	59%	0.588	50%	0.496	S	S	*	.	H	α-helix	trans	-57.4	-48.6	176.3	-178.2	-102.8	0	0	0	111.7	A647 I648 V653 T654 C655	A647-F651 WeakPolarHBondContact O-CB 2.75Å; A647-F651 PolarHBondContact O-N 3.06Å; I648-F651 WeakPolarHBondContact O-CB 3.28Å; I648-F651 PolarHBondContact O-N 3.18Å; F651-V653 PolarHBondContact O-N 2.78Å; F651-T654 VanDerWaalsContact CA-OG1 3.31Å; F651-T654 WeakPolarHBondContact CA-OG1 2.77Å; F651-T654 PolarHBondContact O-N 3.45Å; F651-T654 PolarHBondContact O-OG1 3.12Å; F651-C655 VanDerWaalsContact CZ-SG 3.59Å; F651-C655 WeakPolarHBondContact O-CB 3.32Å; F651-C655 PolarHBondContact O-N 3.11Å; F651-C655 PolarHBondContact O-SG 1.95Å
652	V	92.2	Very high	88.7	Confident	74 Å²	74	91.6 Å²	91.6	45%	0.448	50%	0.499	S	S	.	.	H	α-helix	trans	-58.7	-47	176.9	173.1	0	0	0	0	111.4	I648 S649 F650 T654 C655 L656	I648-V652 WeakPolarHBondContact O-CG2 3.27Å; I648-V652 PolarHBondContact O-N 2.87Å; S649-V652 PolarHBondContact O-N 2.98Å; F650-V652 PolarHBondContact O-N 2.8Å; V652-T654 VanDerWaalsContact C-N 3.34Å; V652-T654 PolarHBondContact O-N 3.14Å; V652-C655 PolarHBondContact O-N 3.05Å; V652-L656 HydrophobicContact CG1-CD1 4.17Å; V652-L656 WeakPolarHBondContact O-CG 3.37Å; V652-L656 PolarHBondContact O-N 3.32Å
653	V	92.3	Very high	89	Confident	93 Å²	93	91 Å²	91	56%	0.564	49%	0.494	S	S	*	.	H	α-helix	trans	-61.6	-42.4	177.6	172	0	0	0	0	111.2	S649 F650 F651 L656 A657	S649-V653 WeakPolarHBondContact O-CG2 3.5Å; S649-V653 PolarHBondContact O-N 2.93Å; F650-V653 PolarHBondContact O-N 3.39Å; F651-V653 PolarHBondContact O-N 2.78Å; V653-L656 PolarHBondContact O-N 3.33Å; V653-A657 WeakPolarHBondContact O-CB 3.49Å; V653-A657 PolarHBondContact O-N 3.42Å
654	T	86.3	Confident	88.9	Confident	54 Å²	54	92.2 Å²	92.2	33%	0.331	50%	0.497	S	S	.	.	H	α-helix	trans	-67	-37.5	176.7	50.7	0	0	0	0	112.9	F650 F651 V652 A657 M658	F650-T654 HydrophobicContact CD1-CG2 4.15Å; F650-T654 HydrophobicContact CE1-CG2 3.71Å; F650-T654 HydrophobicContact CE2-CG2 4.12Å; F650-T654 HydrophobicContact CZ-CG2 3.69Å; F650-T654 WeakPolarHBondContact O-CG2 3.34Å; F650-T654 PolarHBondContact O-N 3.43Å; F650-T654 PolarHBondContact O-OG1 3.3Å; F650-T654 VanDerWaalsContact O-OG1 3.04Å; F651-T654 VanDerWaalsContact CA-OG1 3.31Å; F651-T654 WeakPolarHBondContact CA-OG1 2.77Å; F651-T654 PolarHBondContact O-N 3.45Å; F651-T654 PolarHBondContact O-OG1 3.12Å; V652-T654 VanDerWaalsContact C-N 3.34Å; V652-T654 PolarHBondContact O-N 3.14Å; T654-A657 PolarHBondContact O-N 3.02Å; T654-M658 VanDerWaalsContact O-CB 3.28Å; T654-M658 WeakPolarHBondContact O-CB 3.46Å; T654-M658 PolarHBondContact O-N 2.91Å
655	C	86.4	Confident	88.3	Confident	35 Å²	35	87.2 Å²	87.2	24%	0.236	48%	0.483	C	S	.	.	H	α-helix	trans	-62.7	-46.9	173.4	-77.3	0	0	0	0	111	F651 V652 A657 M658 F659	F651-C655 VanDerWaalsContact CZ-SG 3.59Å; F651-C655 WeakPolarHBondContact O-CB 3.32Å; F651-C655 PolarHBondContact O-N 3.11Å; F651-C655 PolarHBondContact O-SG 1.95Å; V652-C655 PolarHBondContact O-N 3.05Å; C655-A657 VanDerWaalsContact C-N 3.34Å; C655-A657 PolarHBondContact O-N 3.37Å; C655-M658 PolarHBondContact O-N 2.9Å; C655-F659 WeakPolarHBondContact O-CD2 3.34Å; C655-F659 PolarHBondContact O-N 2.78Å
656	L	92.9	Very high	88.2	Confident	114 Å²	114	84.7 Å²	84.7	60%	0.597	48%	0.475	S	S	*	.	H	α-helix	trans	-60.5	-42.9	175.6	-70.7	173.9	0	0	0	112	V652 V653 M658 F659 Y660	V652-L656 HydrophobicContact CG1-CD1 4.17Å; V652-L656 WeakPolarHBondContact O-CG 3.37Å; V652-L656 PolarHBondContact O-N 3.32Å; V653-L656 PolarHBondContact O-N 3.33Å; L656-M658 VanDerWaalsContact C-N 3.34Å; L656-M658 PolarHBondContact O-N 3.4Å; L656-F659 PolarHBondContact O-N 2.69Å; L656-Y660 WeakPolarHBondContact O-CB 3.39Å; L656-Y660 PolarHBondContact O-N 3.44Å
657	A	87.1	Confident	88.2	Confident	52 Å²	52	83.9 Å²	83.9	43%	0.43	48%	0.48	S	S	.	.	H	α-helix	trans	-63	-40.7	175.1	0	0	0	0	0	111.8	V653 T654 C655 Y660 V661	V653-A657 WeakPolarHBondContact O-CB 3.49Å; V653-A657 PolarHBondContact O-N 3.42Å; T654-A657 PolarHBondContact O-N 3.02Å; C655-A657 VanDerWaalsContact C-N 3.34Å; C655-A657 PolarHBondContact O-N 3.37Å; A657-Y660 WeakPolarHBondContact O-CB 3.41Å; A657-Y660 PolarHBondContact O-N 3.25Å; A657-V661 VanDerWaalsContact O-CG2 3.3Å; A657-V661 WeakPolarHBondContact O-CG2 3.41Å; A657-V661 PolarHBondContact O-N 3.48Å
658	M	87	Confident	88.1	Confident	99 Å²	99	86.3 Å²	86.3	49%	0.488	48%	0.482	S	S	.	.	H	α-helix	trans	-64.6	-46.5	177.2	-171.4	-85.9	-83.3	0	0	111.2	T654 C655 L656 Y660 V661 I662	T654-M658 VanDerWaalsContact O-CB 3.28Å; T654-M658 WeakPolarHBondContact O-CB 3.46Å; T654-M658 PolarHBondContact O-N 2.91Å; C655-M658 PolarHBondContact O-N 2.9Å; L656-M658 VanDerWaalsContact C-N 3.34Å; L656-M658 PolarHBondContact O-N 3.4Å; M658-Y660 VanDerWaalsContact C-N 3.32Å; M658-Y660 PolarHBondContact O-N 2.9Å; M658-V661 PolarHBondContact O-N 2.96Å; M658-I662 WeakPolarHBondContact O-CG1 3.5Å; M658-I662 PolarHBondContact O-N 3.27Å; M658-I662 HydrophobicContact SD-CD1 3.22Å; M658-I662 WeakPolarHBondContact SD-CD1 3.3Å; M658-I662 HydrophobicContact SD-CG1 3.92Å
659	F	91.3	Very high	87.7	Confident	132 Å²	132	87.9 Å²	87.9	58%	0.579	49%	0.485	S	S	*	.	H	α-helix	trans	-59.2	-42.4	173.1	-79.8	-64.5	0	0	0	112.3	C655 L656 V661 I662 A663	C655-F659 WeakPolarHBondContact O-CD2 3.34Å; C655-F659 PolarHBondContact O-N 2.78Å; L656-F659 PolarHBondContact O-N 2.69Å; F659-V661 PolarHBondContact O-N 3.38Å; F659-I662 PolarHBondContact O-N 3.19Å; F659-A663 WeakPolarHBondContact O-CB 3.38Å; F659-A663 PolarHBondContact O-N 3.37Å
660	Y	93.3	Very high	87.7	Confident	158 Å²	158	91.9 Å²	91.9	62%	0.62	49%	0.493	S	S	*	.	H	α-helix	trans	-60.1	-44.9	175.5	176.3	-99.7	0	0	0	111.8	L656 A657 M658 A663 L664	L656-Y660 WeakPolarHBondContact O-CB 3.39Å; L656-Y660 PolarHBondContact O-N 3.44Å; A657-Y660 WeakPolarHBondContact O-CB 3.41Å; A657-Y660 PolarHBondContact O-N 3.25Å; M658-Y660 VanDerWaalsContact C-N 3.32Å; M658-Y660 PolarHBondContact O-N 2.9Å; Y660-A663 PolarHBondContact O-N 3.05Å; Y660-L664 HydrophobicContact CE1-CD2 4.29Å; Y660-L664 VanDerWaalsContact O-CB 3.27Å; Y660-L664 WeakPolarHBondContact O-CB 3.28Å; Y660-L664 PolarHBondContact O-N 3.22Å
661	V	85	Confident	87.8	Confident	87 Å²	87	89.4 Å²	89.4	53%	0.527	49%	0.488	S	S	.	.	H	α-helix	trans	-66.2	-39.4	177.9	172.7	0	0	0	0	111.6	A657 M658 F659 L664 A665	A657-V661 VanDerWaalsContact O-CG2 3.3Å; A657-V661 WeakPolarHBondContact O-CG2 3.41Å; A657-V661 PolarHBondContact O-N 3.48Å; M658-V661 PolarHBondContact O-N 2.96Å; F659-V661 PolarHBondContact O-N 3.38Å; V661-L664 PolarHBondContact O-N 2.95Å; V661-A665 WeakPolarHBondContact O-CB 3.18Å; V661-A665 PolarHBondContact O-N 3.3Å
662	I	83.1	Confident	87.4	Confident	102 Å²	102	87.2 Å²	87.2	52%	0.523	48%	0.481	S	S	.	.	H	α-helix	trans	-63	-46.8	174.5	-70.6	-177.7	0	0	0	110.8	M658 F659 L664 A665 G666	M658-I662 WeakPolarHBondContact O-CG1 3.5Å; M658-I662 PolarHBondContact O-N 3.27Å; M658-I662 HydrophobicContact SD-CD1 3.22Å; M658-I662 WeakPolarHBondContact SD-CD1 3.3Å; M658-I662 HydrophobicContact SD-CG1 3.92Å; F659-I662 PolarHBondContact O-N 3.19Å; I662-L664 VanDerWaalsContact C-N 3.31Å; I662-L664 PolarHBondContact O-N 3.14Å; I662-A665 PolarHBondContact O-N 3.44Å; I662-G666 PolarHBondContact O-N 3.47Å
663	A	88.8	Confident	87	Confident	64 Å²	64	87.2 Å²	87.2	53%	0.529	48%	0.479	S	S	.	.	H	α-helix	trans	-61.2	-42	177.3	0	0	0	0	0	111.3	F659 Y660 G666 A667	F659-A663 WeakPolarHBondContact O-CB 3.38Å; F659-A663 PolarHBondContact O-N 3.37Å; Y660-A663 PolarHBondContact O-N 3.05Å; A663-G666 PolarHBondContact O-N 2.9Å; A663-A667 PolarHBondContact O-N 3.04Å
664	L	88.6	Confident	86.9	Confident	65 Å²	65	88.4 Å²	88.4	34%	0.34	48%	0.478	S	S	.	.	H	α-helix	trans	-63.8	-42.2	175.8	-175.3	63.4	0	0	0	111.9	Y660 V661 I662 G666 A667 H668	Y660-L664 HydrophobicContact CE1-CD2 4.29Å; Y660-L664 VanDerWaalsContact O-CB 3.27Å; Y660-L664 WeakPolarHBondContact O-CB 3.28Å; Y660-L664 PolarHBondContact O-N 3.22Å; V661-L664 PolarHBondContact O-N 2.95Å; I662-L664 VanDerWaalsContact C-N 3.31Å; I662-L664 PolarHBondContact O-N 3.14Å; L664-G666 VanDerWaalsContact C-N 3.33Å; L664-G666 PolarHBondContact O-N 2.99Å; L664-A667 PolarHBondContact O-N 3.29Å; L664-H668 PolarHBondContact O-CD2 2.86Å; L664-H668 PolarHBondContact O-N 3.35Å
665	A	78.8	Confident	87	Confident	57 Å²	57	91 Å²	91	47%	0.471	49%	0.49	S	S	.	.	H	α-helix	trans	-62.4	-40.6	174.4	0	0	0	0	0	111.5	V661 I662 H668 K669	V661-A665 WeakPolarHBondContact O-CB 3.18Å; V661-A665 PolarHBondContact O-N 3.3Å; I662-A665 PolarHBondContact O-N 3.44Å; A665-H668 PolarHBondContact O-N 3.18Å; A665-K669 WeakPolarHBondContact O-CB 3.37Å; A665-K669 PolarHBondContact O-N 3.45Å
666	G	86.1	Confident	86.9	Confident	35 Å²	35	94.5 Å²	94.5	36%	0.361	50%	0.498	S	S	.	.	H	α-helix	trans	-61.9	-43.1	173.2	0	0	0	0	0	113.1	I662 A663 L664 K669 K670	I662-G666 PolarHBondContact O-N 3.47Å; A663-G666 PolarHBondContact O-N 2.9Å; L664-G666 VanDerWaalsContact C-N 3.33Å; L664-G666 PolarHBondContact O-N 2.99Å; G666-K669 PolarHBondContact O-N 3.24Å; G666-K670 PolarHBondContact O-N 2.88Å; G666-K670 VanDerWaalsContact O-N 3.13Å
667	A	90	Very high	86.6	Confident	49 Å²	49	95.3 Å²	95.3	41%	0.405	50%	0.499	S	S	.	.	H	α-helix	trans	-64.7	-46.1	175.5	0	0	0	0	0	111.9	A663 L664 K669 K670 V671	A663-A667 PolarHBondContact O-N 3.04Å; L664-A667 PolarHBondContact O-N 3.29Å; A667-K669 VanDerWaalsContact C-N 3.3Å; A667-K669 PolarHBondContact O-N 3.4Å; A667-K670 PolarHBondContact O-N 3.4Å; A667-V671 WeakPolarHBondContact O-CG2 3.49Å; A667-V671 PolarHBondContact O-N 3.04Å
668	H	84.2	Confident	86.6	Confident	106 Å²	106	100.2 Å²	100.2	49%	0.491	51%	0.51	S	S	.	.	H	α-helix	trans	-61.4	-37.5	175.1	-76.4	-42.4	0	0	0	112.4	L664 A665 K670 V671 I672	L664-H668 PolarHBondContact O-CD2 2.86Å; L664-H668 PolarHBondContact O-N 3.35Å; A665-H668 PolarHBondContact O-N 3.18Å; H668-K670 PolarHBondContact O-N 2.78Å; H668-V671 PolarHBondContact O-N 3.16Å; H668-I672 WeakPolarHBondContact O-CB 3.48Å; H668-I672 VanDerWaalsContact O-CG1 3.25Å; H668-I672 WeakPolarHBondContact O-CG1 3.47Å; H668-I672 PolarHBondContact O-N 2.79Å
669	K	82.1	Confident	86.4	Confident	143 Å²	143	101.4 Å²	101.4	62%	0.622	52%	0.518	S	S	*	.	H	α-helix	trans	-60.3	-44.3	173.8	-173.6	179.4	-179.7	-178.4	0	111.9	A665 G666 A667 I672 N673	A665-K669 WeakPolarHBondContact O-CB 3.37Å; A665-K669 PolarHBondContact O-N 3.45Å; G666-K669 PolarHBondContact O-N 3.24Å; A667-K669 VanDerWaalsContact C-N 3.3Å; A667-K669 PolarHBondContact O-N 3.4Å; K669-I672 PolarHBondContact O-N 3.01Å; K669-N673 PolarHBondContact O-N 3.41Å
670	K	88.6	Confident	86	Confident	155 Å²	155	99.3 Å²	99.3	67%	0.674	52%	0.516	S	S	*	.	H	α-helix	trans	-60.6	-45.2	174.8	-72.7	-177.2	179	-178.7	0	111.7	G666 A667 H668 I672 N673 Q674	G666-K670 PolarHBondContact O-N 2.88Å; G666-K670 VanDerWaalsContact O-N 3.13Å; A667-K670 PolarHBondContact O-N 3.4Å; H668-K670 PolarHBondContact O-N 2.78Å; K670-I672 PolarHBondContact O-N 3.06Å; K670-N673 PolarHBondContact O-N 2.98Å; K670-Q674 WeakPolarHBondContact O-CG 3.37Å; K670-Q674 PolarHBondContact O-N 3.48Å
671	V	91.1	Very high	85.6	Confident	70 Å²	70	96.8 Å²	96.8	42%	0.424	51%	0.511	S	S	.	.	H	α-helix	trans	-60.6	-45.7	176.7	172.7	0	0	0	0	110.9	A667 H668 N673 Q674 L675	A667-V671 WeakPolarHBondContact O-CG2 3.49Å; A667-V671 PolarHBondContact O-N 3.04Å; H668-V671 PolarHBondContact O-N 3.16Å; V671-N673 VanDerWaalsContact C-N 3.34Å; V671-N673 PolarHBondContact O-N 3.35Å; V671-Q674 PolarHBondContact O-N 2.95Å; V671-L675 HydrophobicContact CG1-CD1 3.55Å; V671-L675 VanDerWaalsContact O-CD1 3.3Å; V671-L675 WeakPolarHBondContact O-CD1 3.08Å; V671-L675 PolarHBondContact O-N 3.25Å
672	I	81	Confident	85.7	Confident	87 Å²	87	97.1 Å²	97.1	45%	0.446	51%	0.507	S	S	.	.	H	α-helix	trans	-59.9	-43.2	177.2	-70.2	165.1	0	0	0	111.2	H668 K669 K670 L675 R676	H668-I672 WeakPolarHBondContact O-CB 3.48Å; H668-I672 VanDerWaalsContact O-CG1 3.25Å; H668-I672 WeakPolarHBondContact O-CG1 3.47Å; H668-I672 PolarHBondContact O-N 2.79Å; K669-I672 PolarHBondContact O-N 3.01Å; K670-I672 PolarHBondContact O-N 3.06Å; I672-L675 PolarHBondContact O-N 3Å; I672-R676 PolarHBondContact O-N 3.43Å
673	N	83.2	Confident	85.6	Confident	74 Å²	74	93.8 Å²	93.8	40%	0.396	50%	0.497	S	S	.	.	H	α-helix	trans	-62	-44.4	177.5	-73.9	-2.5	0	0	0	111.9	K669 K670 V671 L675 R676 E677	K669-N673 PolarHBondContact O-N 3.41Å; K670-N673 PolarHBondContact O-N 2.98Å; V671-N673 VanDerWaalsContact C-N 3.34Å; V671-N673 PolarHBondContact O-N 3.35Å; N673-L675 VanDerWaalsContact C-N 3.32Å; N673-L675 PolarHBondContact O-N 3.18Å; N673-R676 WeakPolarHBondContact O-CB 3Å; N673-R676 PolarHBondContact O-N 2.95Å; N673-R676 VanDerWaalsContact O-N 3.14Å; N673-E677 PolarHBondContact O-N 2.75Å
674	Q	90.8	Very high	85.4	Confident	118 Å²	118	95.8 Å²	95.8	55%	0.551	50%	0.496	S	S	*	.	H	α-helix	trans	-62.2	-39	175.1	-71.4	179.9	-20.7	0	0	112.4	K670 V671 R676 E677 K678	K670-Q674 WeakPolarHBondContact O-CG 3.37Å; K670-Q674 PolarHBondContact O-N 3.48Å; V671-Q674 PolarHBondContact O-N 2.95Å; Q674-R676 VanDerWaalsContact C-N 3.34Å; Q674-E677 PolarHBondContact O-N 3.5Å; Q674-K678 WeakPolarHBondContact O-CG 3.29Å; Q674-K678 PolarHBondContact O-N 2.66Å
675	L	88.3	Confident	85.4	Confident	109 Å²	109	97.3 Å²	97.3	57%	0.571	50%	0.504	S	S	*	.	H	α-helix	trans	-64.4	-38	174.2	-92	126.7	0	0	0	111.9	V671 I672 N673 K678 L679	V671-L675 HydrophobicContact CG1-CD1 3.55Å; V671-L675 VanDerWaalsContact O-CD1 3.3Å; V671-L675 WeakPolarHBondContact O-CD1 3.08Å; V671-L675 PolarHBondContact O-N 3.25Å; I672-L675 PolarHBondContact O-N 3Å; N673-L675 VanDerWaalsContact C-N 3.32Å; N673-L675 PolarHBondContact O-N 3.18Å; L675-K678 PolarHBondContact O-N 3.44Å; L675-L679 WeakPolarHBondContact O-CB 3.04Å; L675-L679 PolarHBondContact O-N 3.43Å
676	R	83.1	Confident	85.7	Confident	109 Å²	109	100.9 Å²	100.9	41%	0.411	51%	0.509	S	S	.	.	H	α-helix	trans	-65	-45.9	175.2	-78.8	-173	171.9	156.5	11.8	112.3	E279 I672 N673 Q674 K678 L679 V680	E279-R676 IonicContact OE1-CZ 3.15Å; E279-R676 IonicContact OE1-NH1 2.74Å; E279-R676 PolarHBondContact OE1-NH1 3.23Å; E279-R676 IonicContact OE1-NH2 2.69Å; E279-R676 PolarHBondContact OE1-NH2 2.75Å; E279-R676 IonicContact OE2-NH2 3.11Å; E279-R676 PolarHBondContact OE2-NH2 3.05Å; E279-R676 VanDerWaalsContact OE2-NH2 3.11Å; I672-R676 PolarHBondContact O-N 3.43Å; N673-R676 WeakPolarHBondContact O-CB 3Å; N673-R676 PolarHBondContact O-N 2.95Å; N673-R676 VanDerWaalsContact O-N 3.14Å; Q674-R676 VanDerWaalsContact C-N 3.34Å; R676-K678 VanDerWaalsContact C-N 3.32Å; R676-K678 PolarHBondContact O-N 3.14Å; R676-L679 WeakPolarHBondContact O-CB 3.23Å; R676-L679 PolarHBondContact O-N 3.41Å; R676-L679 VanDerWaalsContact O-N 3.09Å; R676-V680 WeakPolarHBondContact O-CG2 3.46Å; R676-V680 PolarHBondContact O-N 3.03Å
677	E	87.8	Confident	85.3	Confident	131 Å²	131	108.5 Å²	108.5	61%	0.612	53%	0.527	S	S	*	.	H	α-helix	trans	-57.7	-46.5	175.4	-75.4	173.3	-175.8	0	0	110.9	N673 Q674 L679 V680 M681	N673-E677 PolarHBondContact O-N 2.75Å; Q674-E677 PolarHBondContact O-N 3.5Å; E677-L679 VanDerWaalsContact C-N 3.28Å; E677-L679 PolarHBondContact O-N 2.93Å; E677-V680 PolarHBondContact O-N 3.29Å; E677-M681 WeakPolarHBondContact O-CG 3.43Å; E677-M681 PolarHBondContact O-N 3.31Å
678	K	86.8	Confident	85.2	Confident	154 Å²	154	111.8 Å²	111.8	67%	0.67	53%	0.532	S	S	*	.	H	α-helix	trans	-58.3	-38.7	174.5	-76	-177.4	178.7	-178.3	0	113.1	Q674 L675 R676 M681 E682	Q674-K678 WeakPolarHBondContact O-CG 3.29Å; Q674-K678 PolarHBondContact O-N 2.66Å; L675-K678 PolarHBondContact O-N 3.44Å; R676-K678 VanDerWaalsContact C-N 3.32Å; R676-K678 PolarHBondContact O-N 3.14Å; K678-M681 PolarHBondContact O-N 3.35Å; K678-E682 PolarHBondContact O-N 3.42Å
679	L	83.3	Confident	85.4	Confident	124 Å²	124	111.9 Å²	111.9	65%	0.649	54%	0.536	S	S	*	.	H	α-helix	trans	-68.7	-38.2	179	-145.2	160.4	0	0	0	111.3	L675 R676 E677 G683	L675-L679 WeakPolarHBondContact O-CB 3.04Å; L675-L679 PolarHBondContact O-N 3.43Å; R676-L679 WeakPolarHBondContact O-CB 3.23Å; R676-L679 PolarHBondContact O-N 3.41Å; R676-L679 VanDerWaalsContact O-N 3.09Å; E677-L679 VanDerWaalsContact C-N 3.28Å; E677-L679 PolarHBondContact O-N 2.93Å; L679-G683 PolarHBondContact O-N 3.47Å
680	V	83	Confident	85.6	Confident	88 Å²	88	109.9 Å²	109.9	53%	0.533	53%	0.531	S	S	.	.	H	α-helix	trans	-65.6	-45.5	173.7	175.2	0	0	0	0	110.8	R676 E677 G683 Q684	R676-V680 WeakPolarHBondContact O-CG2 3.46Å; R676-V680 PolarHBondContact O-N 3.03Å; E677-V680 PolarHBondContact O-N 3.29Å; V680-G683 CarbonylContact O-C 3.45Å; V680-G683 WeakPolarHBondContact O-CA 3.38Å; V680-G683 PolarHBondContact O-N 3.04Å; V680-G683 VanDerWaalsContact O-N 3.1Å; V680-Q684 WeakPolarHBondContact O-CG 3.49Å; V680-Q684 PolarHBondContact O-N 3.37Å
681	M	84.4	Confident	85.3	Confident	105 Å²	105	108.2 Å²	108.2	52%	0.517	53%	0.526	S	S	.	.	H	α-helix	trans	-61.5	-47.4	177.1	-67.4	-61.4	-63.6	0	0	111.8	E677 K678 G683 Q684 D685	E677-M681 WeakPolarHBondContact O-CG 3.43Å; E677-M681 PolarHBondContact O-N 3.31Å; K678-M681 PolarHBondContact O-N 3.35Å; M681-G683 PolarHBondContact O-N 3.35Å; M681-Q684 PolarHBondContact O-N 3.19Å; M681-Q684 VanDerWaalsContact O-N 3.09Å; M681-D685 PolarHBondContact O-N 2.91Å
682	E	85.9	Confident	85.1	Confident	95 Å²	95	110.3 Å²	110.3	44%	0.444	53%	0.529	S	S	.	.	H	α-helix	trans	-59	-35.3	173.1	-86.5	-163.5	159	0	0	111.9	R33 K678 K686	R33-E682 IonicContact NH1-OE1 3.83Å; K678-E682 PolarHBondContact O-N 3.42Å; E682-K686 WeakPolarHBondContact O-CB 3.5Å; E682-K686 VanDerWaalsContact O-CG 3.29Å; E682-K686 WeakPolarHBondContact O-CG 2.95Å; E682-K686 PolarHBondContact O-N 3.13Å
683	G	82.6	Confident	85.2	Confident	32 Å²	32	111 Å²	111	33%	0.33	53%	0.533	S	S	.	.	H	α-helix	trans	-65.3	-40.6	174.8	0	0	0	0	0	112.9	L679 V680 M681 R687	L679-G683 PolarHBondContact O-N 3.47Å; V680-G683 CarbonylContact O-C 3.45Å; V680-G683 WeakPolarHBondContact O-CA 3.38Å; V680-G683 PolarHBondContact O-N 3.04Å; V680-G683 VanDerWaalsContact O-N 3.1Å; M681-G683 PolarHBondContact O-N 3.35Å; G683-R687 WeakPolarHBondContact O-CG 3.39Å; G683-R687 PolarHBondContact O-N 2.88Å; G683-R687 VanDerWaalsContact O-N 3.16Å
684	Q	83.9	Confident	84.9	Confident	106 Å²	106	110.9 Å²	110.9	50%	0.495	54%	0.537	S	S	.	.	H	α-helix	trans	-67.5	-46.1	175.5	-72.1	177.9	-17	0	0	111.6	V680 M681 K686 R687 F688	V680-Q684 WeakPolarHBondContact O-CG 3.49Å; V680-Q684 PolarHBondContact O-N 3.37Å; M681-Q684 PolarHBondContact O-N 3.19Å; M681-Q684 VanDerWaalsContact O-N 3.09Å; Q684-K686 VanDerWaalsContact C-N 3.32Å; Q684-K686 PolarHBondContact O-N 3.07Å; Q684-R687 WeakPolarHBondContact O-CB 3.38Å; Q684-R687 PolarHBondContact O-N 2.72Å; Q684-R687 VanDerWaalsContact O-N 3.13Å; Q684-F688 WeakPolarHBondContact O-CB 3.36Å; Q684-F688 PolarHBondContact O-N 3.44Å
685	D	88.7	Confident	84.4	Confident	97 Å²	97	109.7 Å²	109.7	52%	0.519	53%	0.532	S	S	.	.	H	α-helix	trans	-59.5	-41.9	177.1	-81.7	-5.9	0	0	0	111.9	M681 F688 L689	M681-D685 PolarHBondContact O-N 2.91Å; D685-F688 PolarHBondContact O-N 2.91Å; D685-L689 PolarHBondContact O-N 2.89Å
686	K	84.7	Confident	83.7	Confident	132 Å²	132	107.9 Å²	107.9	57%	0.574	53%	0.532	S	S	*	.	H	α-helix	trans	-62.5	-43	175	-77	177	-177.1	176.3	0	112.1	E682 Q684 F688 L689 I690	E682-K686 WeakPolarHBondContact O-CB 3.5Å; E682-K686 VanDerWaalsContact O-CG 3.29Å; E682-K686 WeakPolarHBondContact O-CG 2.95Å; E682-K686 PolarHBondContact O-N 3.13Å; Q684-K686 VanDerWaalsContact C-N 3.32Å; Q684-K686 PolarHBondContact O-N 3.07Å; K686-F688 VanDerWaalsContact C-N 3.34Å; K686-L689 PolarHBondContact O-N 3.33Å; K686-I690 WeakPolarHBondContact O-CD1 3.12Å; K686-I690 VanDerWaalsContact O-CG1 3.23Å; K686-I690 WeakPolarHBondContact O-CG1 3.18Å; K686-I690 PolarHBondContact O-N 2.82Å
687	R	78.7	Confident	83	Confident	194 Å²	194	110.9 Å²	110.9	73%	0.732	55%	0.551	S	S	*	*	H	α-helix	trans	-63.6	-42.1	176.1	-75.1	178.4	179.8	-176.8	0.4	111.3	G683 Q684 I690 Q691	G683-R687 WeakPolarHBondContact O-CG 3.39Å; G683-R687 PolarHBondContact O-N 2.88Å; G683-R687 VanDerWaalsContact O-N 3.16Å; Q684-R687 WeakPolarHBondContact O-CB 3.38Å; Q684-R687 PolarHBondContact O-N 2.72Å; Q684-R687 VanDerWaalsContact O-N 3.13Å; R687-I690 PolarHBondContact O-N 2.68Å; R687-Q691 WeakPolarHBondContact O-CB 3.32Å; R687-Q691 PolarHBondContact O-N 3.18Å
688	F	87.4	Confident	81.4	Confident	118 Å²	118	108.6 Å²	108.6	52%	0.518	55%	0.55	S	S	.	.	H	α-helix	trans	-60.7	-45.6	175.4	178.9	-99.4	0	0	0	111.7	Q684 D685 K686 Q691 K692	Q684-F688 WeakPolarHBondContact O-CB 3.36Å; Q684-F688 PolarHBondContact O-N 3.44Å; D685-F688 PolarHBondContact O-N 2.91Å; K686-F688 VanDerWaalsContact C-N 3.34Å; F688-Q691 PolarHBondContact O-N 3.47Å; F688-K692 HydrophobicContact CD1-CG 4.49Å; F688-K692 HydrophobicContact CE1-CG 4.07Å; F688-K692 HydrophobicContact CZ-CG 4.08Å; F688-K692 PolarHBondContact O-N 2.87Å
689	L	87.8	Confident	79.9	Confident	108 Å²	108	106.2 Å²	106.2	57%	0.565	55%	0.548	S	S	*	.	H	α-helix	trans	-60.7	-45.9	174.7	-109.9	99.2	0	0	0	112.1	D685 K686 Q691 K692 L693	D685-L689 PolarHBondContact O-N 2.89Å; K686-L689 PolarHBondContact O-N 3.33Å; L689-Q691 VanDerWaalsContact C-N 3.3Å; L689-Q691 PolarHBondContact O-N 3.28Å; L689-K692 PolarHBondContact O-N 3.46Å; L689-L693 WeakPolarHBondContact O-CB 3.43Å; L689-L693 WeakPolarHBondContact O-CG 3.47Å; L689-L693 PolarHBondContact O-N 3.03Å
690	I	85.8	Confident	78.2	Confident	102 Å²	102	105.4 Å²	105.4	52%	0.523	55%	0.55	S	S	.	.	H	α-helix	trans	-60	-43	177.4	-69.5	164.7	0	0	0	110.2	K686 R687 K692 L693 C694	K686-I690 WeakPolarHBondContact O-CD1 3.12Å; K686-I690 VanDerWaalsContact O-CG1 3.23Å; K686-I690 WeakPolarHBondContact O-CG1 3.18Å; K686-I690 PolarHBondContact O-N 2.82Å; R687-I690 PolarHBondContact O-N 2.68Å; I690-K692 PolarHBondContact O-N 3.48Å; I690-L693 PolarHBondContact O-N 2.97Å; I690-C694 PolarHBondContact O-N 3.1Å; I690-C694 PolarHBondContact O-SG 3.37Å; I690-C694 VanDerWaalsContact O-SG 3.4Å
691	Q	84	Confident	76.7	Confident	119 Å²	119	108.2 Å²	108.2	56%	0.556	57%	0.567	S	S	*	*	H	α-helix	trans	-63.2	-41.4	178	-170.6	174.1	-2.4	0	0	111.9	R687 F688 L689 C694 Q695	R687-Q691 WeakPolarHBondContact O-CB 3.32Å; R687-Q691 PolarHBondContact O-N 3.18Å; F688-Q691 PolarHBondContact O-N 3.47Å; L689-Q691 VanDerWaalsContact C-N 3.3Å; L689-Q691 PolarHBondContact O-N 3.28Å; Q691-C694 PolarHBondContact O-N 2.68Å; Q691-Q695 WeakPolarHBondContact O-CB 3.21Å; Q691-Q695 WeakPolarHBondContact O-CG 3.1Å; Q691-Q695 PolarHBondContact O-N 3.34Å
692	K	86.3	Confident	74.6	Confident	115 Å²	115	107.7 Å²	107.7	50%	0.5	58%	0.579	S	S	.	*	H	α-helix	trans	-65.2	-39.1	173.9	-75.6	-69.4	-176.2	-174.4	0	112.6	F688 L689 I690 Q695 A696	F688-K692 HydrophobicContact CD1-CG 4.49Å; F688-K692 HydrophobicContact CE1-CG 4.07Å; F688-K692 HydrophobicContact CZ-CG 4.08Å; F688-K692 PolarHBondContact O-N 2.87Å; L689-K692 PolarHBondContact O-N 3.46Å; I690-K692 PolarHBondContact O-N 3.48Å; K692-Q695 PolarHBondContact O-N 3.01Å; K692-A696 WeakPolarHBondContact O-CB 3.22Å; K692-A696 PolarHBondContact O-N 3.31Å
693	L	83.4	Confident	72.6	Confident	100 Å²	100	112.6 Å²	112.6	52%	0.524	60%	0.599	S	S	.	*	H	α-helix	trans	-65.6	-43.8	175.3	-73.9	169.4	0	0	0	111.8	L689 I690 Q695 A696 Q697	L689-L693 WeakPolarHBondContact O-CB 3.43Å; L689-L693 WeakPolarHBondContact O-CG 3.47Å; L689-L693 PolarHBondContact O-N 3.03Å; I690-L693 PolarHBondContact O-N 2.97Å; L693-Q695 VanDerWaalsContact C-N 3.35Å; L693-Q695 PolarHBondContact O-N 3.07Å; L693-A696 PolarHBondContact O-N 3.07Å; L693-Q697 PolarHBondContact O-N 2.96Å
694	C	76.5	Confident	70.3	Confident	72 Å²	72	116.7 Å²	116.7	49%	0.486	62%	0.623	S	S	.	*	H	α-helix	trans	-62.5	-41.2	174.1	-71.2	0	0	0	0	111.8	I690 Q691 Q697 S698	I690-C694 PolarHBondContact O-N 3.1Å; I690-C694 PolarHBondContact O-SG 3.37Å; I690-C694 VanDerWaalsContact O-SG 3.4Å; Q691-C694 PolarHBondContact O-N 2.68Å; C694-Q697 PolarHBondContact O-N 3.25Å; C694-S698 WeakPolarHBondContact O-CB 3.36Å; C694-S698 PolarHBondContact O-N 3.39Å; C694-S698 PolarHBondContact O-OG 3.08Å
695	Q	79.6	Confident	68	Low	94 Å²	94	116.1 Å²	116.1	44%	0.439	64%	0.636	S	S	.	*	H	α-helix	trans	-62.4	-44	174.8	-78.5	178.5	-10	0	0	111.9	Q691 K692 L693 Q697 S698 V699	Q691-Q695 WeakPolarHBondContact O-CB 3.21Å; Q691-Q695 WeakPolarHBondContact O-CG 3.1Å; Q691-Q695 PolarHBondContact O-N 3.34Å; K692-Q695 PolarHBondContact O-N 3.01Å; L693-Q695 VanDerWaalsContact C-N 3.35Å; L693-Q695 PolarHBondContact O-N 3.07Å; Q695-Q697 VanDerWaalsContact C-N 3.33Å; Q695-Q697 PolarHBondContact O-N 3.38Å; Q695-S698 WeakPolarHBondContact CA-OG 3.24Å; Q695-S698 PolarHBondContact O-N 3.16Å; Q695-S698 VanDerWaalsContact O-N 3.09Å; Q695-S698 PolarHBondContact O-OG 3.07Å; Q695-V699 PolarHBondContact O-N 3.38Å
696	A	74.4	Confident	66	Low	70 Å²	70	117.2 Å²	117.2	58%	0.579	65%	0.648	S	S	*	*	H	α-helix	trans	-64	-35.3	177.2	0	0	0	0	0	112.8	K692 L693 S698	K692-A696 WeakPolarHBondContact O-CB 3.22Å; K692-A696 PolarHBondContact O-N 3.31Å; L693-A696 PolarHBondContact O-N 3.07Å; A696-S698 VanDerWaalsContact C-N 3.33Å
697	Q	67.1	Low	63.5	Low	172 Å²	172	120.7 Å²	120.7	80%	0.804	67%	0.667	S	S	*	*	H	α-helix	trans	-70.8	-26.3	172	-85.8	-178.8	-24.5	0	0	113.4	L693 C694 Q695	L693-Q697 PolarHBondContact O-N 2.96Å; C694-Q697 PolarHBondContact O-N 3.25Å; Q695-Q697 VanDerWaalsContact C-N 3.33Å; Q695-Q697 PolarHBondContact O-N 3.38Å
698	S	56	Low	61.3	Low	84 Å²	84	118.5 Å²	118.5	59%	0.587	67%	0.668	S	S	*	*	H	α-helix	trans	-82	-7.5	179.5	69.4	0	0	0	0	114.7	C694 Q695 A696 P700	C694-S698 WeakPolarHBondContact O-CB 3.36Å; C694-S698 PolarHBondContact O-N 3.39Å; C694-S698 PolarHBondContact O-OG 3.08Å; Q695-S698 WeakPolarHBondContact CA-OG 3.24Å; Q695-S698 PolarHBondContact O-N 3.16Å; Q695-S698 VanDerWaalsContact O-N 3.09Å; Q695-S698 PolarHBondContact O-OG 3.07Å; A696-S698 VanDerWaalsContact C-N 3.33Å; S698-P700 VanDerWaalsContact O-CD 3.24Å; S698-P700 WeakPolarHBondContact O-CD 3.44Å
699	V	54.7	Low	58.7	Low	104 Å²	104	121 Å²	121	63%	0.63	68%	0.681	S	S	*	*	S	Bend	trans	-74.3	113.8	173.1	-179	0	0	0	0	108.8	Q695	Q695-V699 PolarHBondContact O-N 3.38Å
700	P	48.2	Very low	55.8	Low	106 Å²	106	120.7 Å²	120.7	69%	0.688	69%	0.689	S	S	*	*			trans	-72.3	134	175.3	-3.9	21.4	0	0	0	108.9	S698 A702	S698-P700 VanDerWaalsContact O-CD 3.24Å; S698-P700 WeakPolarHBondContact O-CD 3.44Å; P700-A702 PolarHBondContact O-N 3.05Å
701	V	51	Low	54.2	Low	148 Å²	148	121.3 Å²	121.3	90%	0.897	70%	0.699	S	S	*	*			trans	-56.7	102	165.5	175.9	0	0	0	0	108.4
702	A	40.5	Very low	51.5	Low	93 Å²	93	121.2 Å²	121.2	77%	0.769	71%	0.712	S	S	*	*			trans	-107.7	93.7	178.6	0	0	0	0	0	111.3	P700	P700-A702 PolarHBondContact O-N 3.05Å
703	K	43.3	Very low	48.7	Very low	198 Å²	198	126 Å²	126	86%	0.861	73%	0.727	S	S	*	*			trans	34.1	126.3	141.8	-65.8	179.5	176.8	179	0	121
704	S	33.9	Very low	46	Very low	119 Å²	119	129.2 Å²	129.2	83%	0.832	74%	0.739	S	S	*	*			trans	-61.4	140.7	151.8	47.7	0	0	0	0	112.3
705	A	36.1	Very low	43.6	Very low	93 Å²	93	131 Å²	131	77%	0.769	75%	0.752	S	S	*	*			trans	-90	-171.5	-172.3	0	0	0	0	0	113.5
706	P	47.6	Very low	41.9	Very low	120 Å²	120	131.7 Å²	131.7	78%	0.779	77%	0.765	S	S	*	*				-120.7	166	-107.1	32.8	-12.9	0	0	0	115
707	Q	30.8	Very low	39.6	Very low	206 Å²	206	132.5 Å²	132.5	96%	0.963	77%	0.766	S	S	*	*			trans	-139.1	153.8	156.9	-86.3	-158.8	-10.5	0	0	113
708	L	33.8	Very low	37.7	Very low	147 Å²	147	134.8 Å²	134.8	77%	0.77	77%	0.769	S	S	*	*			trans	-80	140.9	-157.1	-149.4	81.2	0	0	0	114.4
709	H	31.6	Very low	36.3	Very low	170 Å²	170	139.5 Å²	139.5	79%	0.787	78%	0.781	S	S	*	*				165	156.3	125.5	-94.7	-69.4	0	0	0	113.3
710	S	27.5	Very low	35.1	Very low	103 Å²	103	141.6 Å²	141.6	72%	0.72	79%	0.794	S	S	*	*			trans	-84.4	-165.1	-163.1	54.3	0	0	0	0	115.4
711	P	52.4	Low	34.1	Very low	114 Å²	114	141.2 Å²	141.2	74%	0.74	79%	0.794	S	S	*	*				-115.7	160.8	-94	35.5	-18.1	0	0	0	113.3
712	S	25.8	Very low	33	Very low	117 Å²	117	144.2 Å²	144.2	82%	0.818	80%	0.796	S	S	*	*			trans	163.2	143.2	137.6	51.5	0	0	0	0	115.7
713	R	28.6	Very low	32.4	Very low	217 Å²	217	144.6 Å²	144.6	82%	0.819	79%	0.793	S	S	*	*			trans	53.4	128.3	145.1	-90.1	-176	173.4	-177.7	-1.7	123.7
714	Q	26.4	Very low	31.9	Very low	167 Å²	167	140.3 Å²	140.3	78%	0.78	79%	0.788	S	S	*	*			trans	89.5	126	137.6	-74.9	172.9	-20.9	0	0	120.1
715	S	26.8	Very low	31.6	Very low	109 Å²	109	141.7 Å²	141.7	76%	0.762	79%	0.786	S	S	*	*			trans	-75.1	-174.8	172.1	46.6	0	0	0	0	112.3
716	P	42.3	Very low	31.3	Very low	108 Å²	108	147 Å²	147	70%	0.701	79%	0.792	S	S	*	*			cis	-137	179.2	-3.5	31.3	-8.2	0	0	0	116.5
717	S	27.4	Very low	30.3	Very low	88 Å²	88	148.3 Å²	148.3	62%	0.615	79%	0.793	S	S	*	*			trans	76.3	137.4	151.2	69.2	0	0	0	0	118.1
718	Y	27.8	Very low	30.4	Very low	220 Å²	220	148.1 Å²	148.1	86%	0.863	79%	0.792	S	S	*	*			cis	-139.5	138.2	27.4	-79	-98.1	0	0	0	112.6
719	H	26.1	Very low	30.4	Very low	183 Å²	183	144.8 Å²	144.8	85%	0.847	79%	0.785	S	S	*	*			trans	-80.6	131.7	166.8	-84.8	-97.5	0	0	0	110.6
720	T	28.9	Very low	30.3	Very low	147 Å²	147	143 Å²	143	90%	0.902	79%	0.786	S	S	*	*			trans	-123.8	106.5	144.4	46.2	0	0	0	0	107.6
721	S	27.5	Very low	30.4	Very low	98 Å²	98	144.9 Å²	144.9	69%	0.685	79%	0.793	S	S	*	*			trans	-81.1	118	178.7	48.5	0	0	0	0	110.1
722	F	28.5	Very low	29.4	Very low	212 Å²	212	146.2 Å²	146.2	93%	0.93	79%	0.793	S	S	*	*			trans	-115	95.5	150.6	-115	-89.2	0	0	0	107.2	S724	F722-S724 PolarHBondContact O-N 2.99Å
723	S	27.8	Very low	29.6	Very low	101 Å²	101	145.2 Å²	145.2	71%	0.706	79%	0.791	S	S	*	*			trans	-76.7	111.5	171.9	43.9	0	0	0	0	109.2	N725	S723-N725 PolarHBondContact O-N 3.12Å
724	S	31.3	Very low	29.6	Very low	108 Å²	108	143.1 Å²	143.1	76%	0.755	79%	0.791	S	S	*	*			trans	-82.6	83.5	164.8	55.9	0	0	0	0	109.3	F722 F726	F722-S724 PolarHBondContact O-N 2.99Å; S724-F726 PolarHBondContact O-N 3.28Å
725	N	28.3	Very low	29.7	Very low	148 Å²	148	140.5 Å²	140.5	79%	0.791	79%	0.791	S	S	*	*			trans	-80	92.4	160.3	-89.5	-13.3	0	0	0	108.4	S723	S723-N725 PolarHBondContact O-N 3.12Å
726	F	30.5	Very low	30	Very low	203 Å²	203	140.3 Å²	140.3	89%	0.89	79%	0.787	S	S	*	*			trans	-98.9	104.8	158.8	-103.6	-84.4	0	0	0	107.8	S724 E728	S724-F726 PolarHBondContact O-N 3.28Å; F726-E728 PolarHBondContact O-N 2.98Å
727	N	27.1	Very low	29.5	Very low	149 Å²	149	141.2 Å²	141.2	80%	0.797	79%	0.793	S	S	*	*			trans	-66.2	115.7	168.7	-90.3	-14	0	0	0	109.4	A729	N727-A729 PolarHBondContact O-N 3Å
728	E	31.7	Very low	29.6	Very low	202 Å²	202	144.5 Å²	144.5	94%	0.944	80%	0.804	S	S	*	*	S	Bend	trans	-66.7	81.3	156	-80.2	-175.4	136.4	0	0	109.4	F726	F726-E728 PolarHBondContact O-N 2.98Å
729	A	34.3	Very low	29.6	Very low	77 Å²	77	138.8 Å²	138.8	64%	0.636	80%	0.796	S	S	*	*			trans	-167.4	63.9	165.5	0	0	0	0	0	112.5	N727	N727-A729 PolarHBondContact O-N 3Å
730	V	30.3	Very low	29.8	Very low	133 Å²	133	135 Å²	135	81%	0.806	79%	0.789	S	S	*	*			trans	-141	84.5	153	-175.6	0	0	0	0	108.1	L732	V730-L732 PolarHBondContact O-N 3.27Å
731	V	27.9	Very low	29.7	Very low	142 Å²	142	134.6 Å²	134.6	86%	0.861	79%	0.787	S	S	*	*			trans	-69.2	112.4	166.7	172.8	0	0	0	0	107.5	A733	V731-A733 PolarHBondContact O-N 3.01Å
732	L	32.5	Very low	29.7	Very low	142 Å²	142	138.8 Å²	138.8	74%	0.743	80%	0.796	S	S	*	*			trans	-75.1	103.9	171.6	-80.7	164.1	0	0	0	109.5	V730 H734	V730-L732 PolarHBondContact O-N 3.27Å; L732-H734 PolarHBondContact O-N 2.82Å
733	A	29.2	Very low	29.8	Very low	95 Å²	95	138.8 Å²	138.8	79%	0.785	81%	0.813	S	S	*	*			trans	-72.9	114	160.1	0	0	0	0	0	109.1	V731	V731-A733 PolarHBondContact O-N 3.01Å
734	H	29.7	Very low	29.9	Very low	174 Å²	174	140.7 Å²	140.7	81%	0.806	82%	0.818	S	S	*	*			trans	-105	122.2	158.1	-88.2	-63.8	0	0	0	108.3	L732	L732-H734 PolarHBondContact O-N 2.82Å
735	S	28.3	Very low	29.9	Very low	112 Å²	112	142.4 Å²	142.4	78%	0.783	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-76.9	149.9	172.5	34	0	0	0	0	111.8
736	P	32	Very low	30	Very low	105 Å²	105	142.1 Å²	142.1	68%	0.682	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-82.6	163.9	-177	33.6	-33.8	0	0	0	112.8
737	P	33.2	Very low	29.9	Very low	126 Å²	126	138.5 Å²	138.5	82%	0.818	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-84.5	117.9	179.8	32.7	-28.4	0	0	0	110.4
738	N	28.4	Very low	30.1	Very low	158 Å²	158	137.9 Å²	137.9	85%	0.845	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-84.9	143.3	168.3	-83.7	-9	0	0	0	111.7
739	S	29.3	Very low	30	Very low	100 Å²	100	133.6 Å²	133.6	70%	0.699	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-67.3	149.4	-176.6	54.9	0	0	0	0	115.2
740	S	28.6	Very low	29.7	Very low	102 Å²	102	137.6 Å²	137.6	71%	0.713	83%	0.825	S	S	*	*			trans	37.7	122.3	137.4	62	0	0	0	0	121.4
741	T	28.3	Very low	29.6	Very low	140 Å²	140	138 Å²	138	86%	0.859	83%	0.826	S	S	*	*			trans	-155.3	106.8	136.2	33.9	0	0	0	0	108.4
742	H	27.6	Very low	29.8	Very low	185 Å²	185	137.7 Å²	137.7	86%	0.856	82%	0.823	S	S	*	*				-5	115	113	-82.3	-87.8	0	0	0	115.3
743	V	30.6	Very low	29.5	Very low	213 Å²	213	137.3 Å²	137.3	100%	1.291	83%	0.831	S	S	*	*				-157	0	97.9	161.5	0	0	0	0	107.6

Retrieved 743 of 743 residues in 310.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).