A0A096N3U9_PAPAN Loading...

Transforming growth factor beta receptor associated protein 1

AlphaFold DB , UniProt , Accession A0A096N3U9, Species PAPAN (Papio anubis, Olive baboon), Gene TGFBRAP1, Length 943 aa.

						>A0A096N3U9_PAPAN|A0A096N3U9|TGFBRAP1
MCVCGCVWRGVCVVFCWGLLLSDGGGQWGNGFFPFFDSIEWFPLMNMLTRESTYHYCNLCFCFFLVPLKISFRLSLPADQPVDMMNIKAFTLVSAVERELLMGDKERINIECVECCGRDLYVGTNDCFVYHFLLEERPVPAGPATFTATKQLHRHLGFKKPVNELRAASALNRLLVLCDNSISLVNMLNLEPVPSGARIKGAATFALNENPVSGDPFCVEVCIISVKRRTIQMFLVYEDRVQIVKEVSTSEQPLAVAVDGHFLCLALTTQYIIHNYSTGVSQDLFPYCSEERPPIVKRIGRQEFLLAGPGGLGMFATVAGISQRAPVHWSENVIGAAVSFPYVIALDDEFITVHSMLDQQQKQTLPFKEGHILQDFEGRVIVATSKGVYILAPLPLEKQIQDLLASRRVEEALVLAKGARRNIPKDKFQVMYRRILQQAGFIQFAQLQFLEAKELFRSGQLDVRELISLYPFLLPTSSSFTRSHPPLHEYADLNQLTQGDQEKMAKCKRFLMSYLNEVRSTEVANGYKEDIDTALLKLYAEADHDSLLDLLVTENFCLLTDSAAWLEKHKKYFALGLLYHYNNQDAAAVQLWVNIVNGDVQDSTRSDLYEYIVDFLTYCLDEELVWAYADWVLQKSEEVGVQVFTKRPLDEQQKNSFNPDDIINCLKKYPKALVKYLEHLVIDKRLQKEEYHTHLAVLYLEEVLQQRASTSGKGAEASETQAKLRRLLQKSDLYRVHFLLERLRGAGLPMESAILHGKLGEHEKALHILVHELRDFAAAEDYCLWCSEGRDPPHRQHLFHTLLAIYLRAGPAAHELAVAAVDLLNHHATEFDAAQVLQMLPDTWSVQLLCPFLMGAMRDSVHARRTMQVALGLARSENLIYTYDKMKLKGSSIRLSDKKLCQICQNPFCEPVFVRYPNGGLVHTHCAASRHTNPSSSSPGTRT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	26.3	Very low	24.6	Very low	250 Å²	250	138.3 Å²	138.3	100%	1.232	81%	0.805	S	S	*	*				0	151.9	0	-76.9	172.8	165	0	0	109
2	C	25.7	Very low	24.4	Very low	122 Å²	122	136.7 Å²	136.7	82%	0.824	81%	0.805	S	S	*	*			trans	-79.4	173.2	172.5	-52.9	0	0	0	0	111.2
3	V	24.7	Very low	24.3	Very low	131 Å²	131	135.2 Å²	135.2	79%	0.794	80%	0.797	S	S	*	*				-179.2	126	114.8	147	0	0	0	0	111.2
4	C	23.5	Very low	24.1	Very low	112 Å²	112	134.9 Å²	134.9	76%	0.757	80%	0.798	S	S	*	*			trans	45.2	153.1	152.7	-61.5	0	0	0	0	122.1
5	G	22.1	Very low	24	Very low	72 Å²	72	139 Å²	139	74%	0.742	80%	0.802	S	S	*	*			cis	-175.5	-160.7	3.2	0	0	0	0	0	110.8
6	C	24.1	Very low	23.9	Very low	107 Å²	107	137.5 Å²	137.5	72%	0.723	80%	0.8	S	S	*	*			cis	-177.7	119.6	-16.5	-108.1	0	0	0	0	107.9
7	V	23.2	Very low	23.8	Very low	145 Å²	145	144.4 Å²	144.4	88%	0.879	81%	0.81	S	S	*	*			trans	-144.1	139.6	156	-178	0	0	0	0	109.1
8	W	23.4	Very low	23.7	Very low	204 Å²	204	139.8 Å²	139.8	77%	0.773	80%	0.8	S	S	*	*			trans	-120	165.8	174.7	-92.7	20.2	0	0	0	107.9
9	R	28.1	Very low	23.8	Very low	189 Å²	189	141 Å²	141	71%	0.713	80%	0.803	S	S	*	*			cis	-158.3	168.3	-2.2	-119.5	-178.3	-177.6	-173.5	0.2	105.2
10	G	24.2	Very low	23.9	Very low	64 Å²	64	141.2 Å²	141.2	66%	0.66	80%	0.801	S	S	*	*			cis	162.7	179.1	-8	0	0	0	0	0	112.7
11	V	25.8	Very low	24	Very low	125 Å²	125	140.5 Å²	140.5	76%	0.758	79%	0.794	S	S	*	*			trans	72.2	134.8	144	-179.9	0	0	0	0	117
12	C	21.3	Very low	23.8	Very low	119 Å²	119	133.9 Å²	133.9	80%	0.804	77%	0.773	S	S	*	*			cis	-131.4	166.1	12.9	-152.3	0	0	0	0	113.1
13	V	23.6	Very low	23.8	Very low	117 Å²	117	134.9 Å²	134.9	71%	0.709	77%	0.77	S	S	*	*			trans	-133.2	147.4	-176	169.2	0	0	0	0	111.2	F15	V13-F15 HydrophobicContact CG1-CD2 4.16Å; V13-F15 HydrophobicContact CG1-CE2 4.39Å
14	V	21.7	Very low	23.8	Very low	132 Å²	132	132.4 Å²	132.4	80%	0.8	77%	0.77	S	S	*	*			trans	-104.2	150.6	169.6	176.5	0	0	0	0	109
15	F	22.1	Very low	23.8	Very low	196 Å²	196	131.3 Å²	131.3	86%	0.86	78%	0.778	S	S	*	*			trans	-123.6	158	177.4	-116	-87.8	0	0	0	113.3	V13	V13-F15 HydrophobicContact CG1-CD2 4.16Å; V13-F15 HydrophobicContact CG1-CE2 4.39Å
16	C	22.8	Very low	23.8	Very low	115 Å²	115	131.9 Å²	131.9	78%	0.777	78%	0.784	S	S	*	*			trans	-119.7	179.6	-160.3	-62.5	0	0	0	0	114.9
17	W	21.8	Very low	23.8	Very low	255 Å²	255	134.7 Å²	134.7	97%	0.966	79%	0.787	S	S	*	*			trans	-41.8	159.3	152.2	-69	-35.7	0	0	0	112.5
18	G	22.6	Very low	23.8	Very low	62 Å²	62	138.4 Å²	138.4	64%	0.639	79%	0.785	S	S	*	*			cis	123.8	169.9	21.1	0	0	0	0	0	110.1
19	L	25.2	Very low	23.8	Very low	162 Å²	162	132.2 Å²	132.2	85%	0.848	79%	0.785	S	S	*	*			trans	70.1	154.1	176.7	-57.9	164.8	0	0	0	115.1
20	L	25.6	Very low	23.6	Very low	144 Å²	144	131 Å²	131	75%	0.754	79%	0.793	S	S	*	*			cis	-151.2	-165	-6.9	-111	163.9	0	0	0	106.5
21	L	26.2	Very low	23.5	Very low	127 Å²	127	131.4 Å²	131.4	67%	0.665	80%	0.797	S	S	*	*			cis	-161.8	148.7	8.3	-146	179.3	0	0	0	108.2
22	S	21.9	Very low	23.3	Very low	112 Å²	112	135.9 Å²	135.9	78%	0.783	81%	0.806	S	S	*	*			trans	-166.4	135.3	142.6	-168.1	0	0	0	0	113.3
23	D	25.4	Very low	23.2	Very low	143 Å²	143	139.4 Å²	139.4	77%	0.765	81%	0.808	S	S	*	*			trans	-65.2	171.7	-172.8	-50.1	-72	0	0	0	117.5
24	G	24.7	Very low	24.1	Very low	78 Å²	78	138.6 Å²	138.6	80%	0.804	81%	0.805	S	S	*	*			cis	156.4	156	-11.1	0	0	0	0	0	116.1
25	G	23.3	Very low	24.2	Very low	89 Å²	89	140 Å²	140	92%	0.918	80%	0.801	S	S	*	*			trans	105.4	151.8	162.8	0	0	0	0	0	119.3
26	G	23.4	Very low	24.3	Very low	84 Å²	84	138.3 Å²	138.3	87%	0.866	79%	0.794	S	S	*	*			trans	133.6	44.8	161.2	0	0	0	0	0	121.9
27	Q	24	Very low	24.3	Very low	167 Å²	167	138.7 Å²	138.7	78%	0.78	79%	0.788	S	S	*	*			trans	-69.5	160.1	-171.9	-165.5	-174.4	35.6	0	0	117.9
28	W	23.3	Very low	24.4	Very low	222 Å²	222	130.5 Å²	130.5	84%	0.841	77%	0.769	S	S	*	*			trans	103.5	129	160	-66.2	85.1	0	0	0	121.1
29	G	22.4	Very low	24.5	Very low	75 Å²	75	135.4 Å²	135.4	77%	0.773	78%	0.779	S	S	*	*			trans	165.4	131.2	166.9	0	0	0	0	0	113.8
30	N	23.3	Very low	24.3	Very low	164 Å²	164	136.9 Å²	136.9	88%	0.877	78%	0.782	S	S	*	*			trans	-108.3	151.6	-174.7	-71.5	-37.5	0	0	0	113.4
31	G	23.1	Very low	24.2	Very low	72 Å²	72	140.2 Å²	140.2	74%	0.742	78%	0.784	S	S	*	*			trans	171.4	87.8	165.1	0	0	0	0	0	119.8
32	F	21.8	Very low	24	Very low	218 Å²	218	142.7 Å²	142.7	96%	0.956	79%	0.79	S	S	*	*			trans	48.5	128.8	147.4	-79.7	-92.8	0	0	0	124.8
33	F	19.8	Very low	24.9	Very low	194 Å²	194	142.7 Å²	142.7	85%	0.851	79%	0.787	S	S	*	*			trans	-75.3	-177.1	156.2	-91.6	-93.9	0	0	0	111.6
34	P	42.7	Very low	24.7	Very low	99 Å²	99	144.2 Å²	144.2	64%	0.643	80%	0.795	S	S	*	*			cis	-132.9	-169.9	18.5	21	9	0	0	0	114.3
35	F	22.5	Very low	24.5	Very low	162 Å²	162	147.7 Å²	147.7	71%	0.711	79%	0.792	S	S	*	*			cis	-152.5	141.8	32	-114.6	-95.9	0	0	0	112.4
36	F	24.5	Very low	24.6	Very low	161 Å²	161	149.5 Å²	149.5	71%	0.706	78%	0.781	S	S	*	*			trans	43.5	144.7	133.9	-71.5	-125.6	0	0	0	119.9
37	D	23.5	Very low	24.5	Very low	122 Å²	122	152.8 Å²	152.8	65%	0.652	78%	0.775	S	S	*	*			cis	-172.7	176.6	6.1	-119.8	26.6	0	0	0	109.7
38	S	23.8	Very low	24.4	Very low	83 Å²	83	152.8 Å²	152.8	58%	0.58	78%	0.78	S	S	*	*			cis	-172.5	164.3	-33.5	51.7	0	0	0	0	109.2
39	I	24	Very low	24.5	Very low	166 Å²	166	147 Å²	147	85%	0.851	77%	0.769	S	S	*	*			trans	174.1	148.8	149.7	-93.8	159.2	0	0	0	108.7
40	E	22.2	Very low	24.5	Very low	192 Å²	192	153.1 Å²	153.1	90%	0.897	77%	0.769	S	S	*	*			trans	-102.6	-170.5	-158.5	-62.7	-170.9	109.4	0	0	116.7
41	W	21.9	Very low	24.5	Very low	214 Å²	214	151.9 Å²	151.9	81%	0.811	76%	0.758	S	S	*	*			trans	-126.7	-178.9	-159.7	-101.8	78.7	0	0	0	113.7
42	F	21.6	Very low	24.4	Very low	180 Å²	180	153.4 Å²	153.4	79%	0.789	76%	0.757	S	S	*	*			trans	88.9	156.3	152.2	-71.7	-55.2	0	0	0	119.7
43	P	41.3	Very low	24.5	Very low	111 Å²	111	148.5 Å²	148.5	72%	0.721	75%	0.745	S	S	*	*			trans	-136.5	-156.1	-145.2	39.8	-16.1	0	0	0	112.3
44	L	21	Very low	24.6	Very low	176 Å²	176	149.1 Å²	149.1	92%	0.921	74%	0.743	S	S	*	*			trans	-155.2	155.4	157.4	-117.7	148	0	0	0	113.3
45	M	22	Very low	23.7	Very low	151 Å²	151	151.3 Å²	151.3	74%	0.744	74%	0.744	S	S	*	*			trans	-152.9	123.8	-173.3	168.6	-172	169.7	0	0	109.3
46	N	24.2	Very low	23.7	Very low	127 Å²	127	153.5 Å²	153.5	68%	0.679	75%	0.749	S	S	*	*			trans	172.6	146.3	132.6	-97.2	-42.5	0	0	0	115.8
47	M	21.3	Very low	23.6	Very low	152 Å²	152	152 Å²	152	75%	0.749	76%	0.758	S	S	*	*			trans	43.3	128.7	144	-58.5	179.1	74	0	0	122
48	L	22	Very low	23.7	Very low	167 Å²	167	153.2 Å²	153.2	87%	0.874	76%	0.764	S	S	*	*				-159.1	156	111.9	-105.1	167.2	0	0	0	113.3
49	T	25.6	Very low	23.7	Very low	100 Å²	100	156 Å²	156	61%	0.613	77%	0.772	S	S	*	*			trans	-81.8	147.6	-155.2	46.1	0	0	0	0	119.5
50	R	22.7	Very low	23.7	Very low	204 Å²	204	154 Å²	154	77%	0.77	77%	0.771	S	S	*	*			trans	66.3	132	131.5	-77.8	-176.3	134.2	153.9	-7.7	125
51	E	23.4	Very low	23.7	Very low	139 Å²	139	153.1 Å²	153.1	65%	0.65	77%	0.765	S	S	*	*				77.1	103.4	128.4	-70.2	164.4	-170.6	0	0	123.9
52	S	21.2	Very low	23.8	Very low	103 Å²	103	148 Å²	148	72%	0.72	76%	0.76	S	S	*	*				84.7	130.2	124.2	73.1	0	0	0	0	124.7
53	T	22.9	Very low	23.9	Very low	116 Å²	116	149 Å²	149	71%	0.712	77%	0.765	S	S	*	*			trans	83.4	109.8	139.8	43.8	0	0	0	0	123.6
54	Y	23.4	Very low	23	Very low	206 Å²	206	152.8 Å²	152.8	81%	0.808	77%	0.77	S	S	*	*			trans	76.5	129.1	137.4	-76.8	-69.2	0	0	0	124.7
55	H	22.5	Very low	23.2	Very low	145 Å²	145	152.5 Å²	152.5	67%	0.671	77%	0.768	S	S	*	*			trans	85.3	119.3	148.9	-78.2	-47.2	0	0	0	123
56	Y	23.3	Very low	23.2	Very low	209 Å²	209	150.7 Å²	150.7	82%	0.82	77%	0.766	S	S	*	*			trans	46.2	106.1	146.7	-70.3	-70.8	0	0	0	120.1
57	C	22.4	Very low	23.3	Very low	130 Å²	130	150.2 Å²	150.2	88%	0.878	77%	0.769	S	S	*	*				-156.3	164.7	107.1	-135.1	0	0	0	0	112.1
58	N	24.5	Very low	23.4	Very low	147 Å²	147	150.1 Å²	150.1	79%	0.786	77%	0.771	S	S	*	*			trans	-76.7	147.3	172.9	-67.7	-49.9	0	0	0	110.9
59	L	24.8	Very low	23.4	Very low	141 Å²	141	152 Å²	152	74%	0.738	77%	0.772	S	S	*	*				-174.8	126.3	117.3	-118.8	85	0	0	0	110.1	F61	L59-F61 HydrophobicContact CD2-CD2 3.86Å; L59-F61 HydrophobicContact CD2-CE2 3.56Å
60	C	22.6	Very low	23.4	Very low	125 Å²	125	154 Å²	154	85%	0.845	78%	0.778	S	S	*	*			trans	-91.8	124.9	163.4	-70.2	0	0	0	0	109.1
61	F	23.2	Very low	23.4	Very low	173 Å²	173	149.4 Å²	149.4	76%	0.759	78%	0.777	S	S	*	*			trans	-109.4	105.6	167	-106.5	-76.2	0	0	0	109.7	L59	L59-F61 HydrophobicContact CD2-CD2 3.86Å; L59-F61 HydrophobicContact CD2-CE2 3.56Å
62	C	24.3	Very low	23.3	Very low	106 Å²	106	151.9 Å²	151.9	72%	0.716	79%	0.786	S	S	*	*			trans	-80	120.7	170.7	-63.5	0	0	0	0	109.5	F64	C62-F64 PolarHBondContact O-N 2.9Å
63	F	22.8	Very low	23.4	Very low	201 Å²	201	158.2 Å²	158.2	88%	0.882	79%	0.794	S	S	*	*			trans	-76.3	112.1	170.7	-95.7	-90.9	0	0	0	110.4
64	F	23.4	Very low	23.5	Very low	190 Å²	190	160.8 Å²	160.8	83%	0.833	80%	0.803	S	S	*	*			trans	-71.8	125.7	164.4	-93.7	-100.3	0	0	0	109.9	C62	C62-F64 PolarHBondContact O-N 2.9Å
65	L	24.3	Very low	23.6	Very low	170 Å²	170	156.4 Å²	156.4	89%	0.89	80%	0.802	S	S	*	*			trans	-89.9	111.7	166.8	-89.3	166.1	0	0	0	109.7
66	V	22.9	Very low	23.7	Very low	113 Å²	113	157.5 Å²	157.5	69%	0.685	81%	0.812	S	S	*	*			trans	-89.4	119.9	174.5	178.2	0	0	0	0	109.5	L68	V66-L68 PolarHBondContact O-N 3.01Å
67	P	25.7	Very low	23.9	Very low	117 Å²	117	153.4 Å²	153.4	76%	0.76	81%	0.811	S	S	*	*			trans	-81.1	106.5	174.4	31	-32	0	0	0	110.9	K69	P67-K69 PolarHBondContact O-N 2.66Å
68	L	23.2	Very low	24.4	Very low	151 Å²	151	152.1 Å²	152.1	79%	0.791	81%	0.81	S	S	*	*			trans	-67.5	112.5	169.8	-86	89.4	0	0	0	110.6	V66 I70	V66-L68 PolarHBondContact O-N 3.01Å; L68-I70 PolarHBondContact O-N 2.9Å
69	K	23	Very low	24.5	Very low	206 Å²	206	152 Å²	152	90%	0.896	81%	0.809	S	S	*	*			trans	-74.1	102.4	163.9	-82.4	-175.6	173	178.6	0	110	P67	P67-K69 PolarHBondContact O-N 2.66Å
70	I	24.3	Very low	24.5	Very low	141 Å²	141	153.4 Å²	153.4	72%	0.723	81%	0.812	S	S	*	*			trans	-77.8	121.8	166.1	-62.9	176.6	0	0	0	108.3	L68 F72	L68-I70 PolarHBondContact O-N 2.9Å; I70-F72 HydrophobicContact CG2-CD2 4.38Å; I70-F72 HydrophobicContact CG2-CE2 4.42Å
71	S	22.5	Very low	24.7	Very low	108 Å²	108	153.4 Å²	153.4	76%	0.755	81%	0.81	S	S	*	*			trans	-97.7	106	-177.2	-174	0	0	0	0	111.3
72	F	23.2	Very low	25	Very low	192 Å²	192	151.6 Å²	151.6	84%	0.842	81%	0.813	S	S	*	*			trans	-82.9	111.7	166.7	-95.1	-88.5	0	0	0	110	I70 L74	I70-F72 HydrophobicContact CG2-CD2 4.38Å; I70-F72 HydrophobicContact CG2-CE2 4.42Å; F72-L74 PolarHBondContact O-N 3.27Å
73	R	22.7	Very low	25.4	Very low	236 Å²	236	152.7 Å²	152.7	89%	0.891	81%	0.812	S	S	*	*			trans	-78.4	113.7	166.6	-79.2	-177.1	170.8	179.1	-2.8	109.8
74	L	24.3	Very low	26.3	Very low	170 Å²	170	151 Å²	151	89%	0.89	81%	0.809	S	S	*	*			trans	-108.9	130.9	156.5	-91.3	164.1	0	0	0	108.5	F72	F72-L74 PolarHBondContact O-N 3.27Å
75	S	25.3	Very low	27.4	Very low	114 Å²	114	149.3 Å²	149.3	80%	0.797	81%	0.805	S	S	*	*			trans	-98.7	116.6	-171.2	52.3	0	0	0	0	112
76	L	24.5	Very low	29.2	Very low	167 Å²	167	144.6 Å²	144.6	87%	0.874	78%	0.781	S	S	*	*			trans	-129.6	159.3	164.9	-83.2	175.8	0	0	0	108.8
77	P	27.4	Very low	31.7	Very low	124 Å²	124	140 Å²	140	81%	0.805	75%	0.752	S	S	*	*			trans	-70.6	154.2	-154	26.1	-35	0	0	0	114.2
78	A	33	Very low	34.5	Very low	103 Å²	103	139.1 Å²	139.1	85%	0.851	74%	0.737	S	S	*	*			trans	-81.2	131	-178.8	0	0	0	0	0	111.6
79	D	26.4	Very low	37.6	Very low	145 Å²	145	131.9 Å²	131.9	78%	0.775	70%	0.699	S	S	*	*			trans	-140.7	116.4	160.4	-133.2	-29.4	0	0	0	109.4
80	Q	26	Very low	40.8	Very low	169 Å²	169	122.2 Å²	122.2	79%	0.79	66%	0.657	S	S	*	*			trans	52.1	138.9	172.5	-52.4	-170.5	15.7	0	0	119.9	V82	Q80-V82 PolarHBondContact O-N 3.49Å; Q80-V82 VanDerWaalsContact O-N 3.17Å
81	P	26.9	Very low	43.9	Very low	125 Å²	125	116.5 Å²	116.5	81%	0.812	63%	0.629	S	S	*	*			trans	-72.3	109.8	169.9	30.7	-32.1	0	0	0	109.7	D83	P81-D83 PolarHBondContact O-N 2.81Å
82	V	28.8	Very low	47.2	Very low	136 Å²	136	113.6 Å²	113.6	82%	0.824	61%	0.605	S	S	*	*			trans	-69.6	100.3	163.7	-179.6	0	0	0	0	107.4	Q80 M84	Q80-V82 PolarHBondContact O-N 3.49Å; Q80-V82 VanDerWaalsContact O-N 3.17Å; V82-M84 PolarHBondContact O-N 3.43Å
83	D	33.7	Very low	50.3	Low	129 Å²	129	105.5 Å²	105.5	69%	0.69	57%	0.57	S	S	*	*			trans	-50.5	124.6	164.3	-98.9	-30.5	0	0	0	108	P81 M85	P81-D83 PolarHBondContact O-N 2.81Å; D83-M85 HydrophobicContact CB-CG 4.49Å; D83-M85 PolarHBondContact O-N 2.87Å
84	M	39.9	Very low	53.4	Low	164 Å²	164	96 Å²	96	81%	0.808	54%	0.54	S	S	*	.			trans	-75.5	75.4	-173.2	-167.1	172.6	69.8	0	0	109.3	V82 N86	V82-M84 PolarHBondContact O-N 3.43Å; M84-N86 PolarHBondContact O-N 3.44Å
85	M	47.8	Very low	56.4	Low	155 Å²	155	88.1 Å²	88.1	76%	0.764	50%	0.5	S	S	*	.			trans	-63	97.6	-168.1	-75.6	-161.8	177.4	0	0	111.7	D83 R408	D83-M85 HydrophobicContact CB-CG 4.49Å; D83-M85 PolarHBondContact O-N 2.87Å; M85-R408 PolarHBondContact O-NH1 2.61Å
86	N	61.4	Low	59.2	Low	71 Å²	71	82.7 Å²	82.7	38%	0.38	46%	0.462	S	S	.	.			trans	-62.9	136.8	165.8	-93.5	-15.2	0	0	0	110.1	M84 K88 K362	M84-N86 PolarHBondContact O-N 3.44Å; N86-K88 PolarHBondContact O-N 2.87Å; N86-K362 CarbonylContact C-O 3.6Å; N86-K362 VanDerWaalsContact CB-O 3.23Å; N86-K362 WeakPolarHBondContact CB-O 3.21Å
87	I	75.4	Confident	61.9	Low	16 Å²	16	79.9 Å²	79.9	8%	0.082	44%	0.444	C	S	.	.			trans	-66.4	123.9	-168.7	-57.5	138.7	0	0	0	109.3	A89 K362 L403 E411	I87-A89 PolarHBondContact O-N 3.22Å; I87-K362 HydrophobicContact CD1-CD 4.11Å; I87-K362 PolarHBondContact N-O 2.87Å; I87-K362 VanDerWaalsContact O-O 3.11Å; I87-L403 HydrophobicContact CD1-CD1 4.33Å; I87-L403 HydrophobicContact CD1-CD2 3.48Å; I87-L403 VanDerWaalsContact CD1-CD2 3.48Å; I87-L403 HydrophobicContact CD1-CG 4.07Å; I87-L403 HydrophobicContact CG1-CD2 3.78Å; I87-L403 HydrophobicContact CG1-CG 4.06Å; I87-L403 HydrophobicContact CG2-CG 4.43Å; I87-E411 WeakPolarHBondContact CD1-OE2 3.46Å
88	K	85.5	Confident	64.2	Low	99 Å²	99	78.6 Å²	78.6	43%	0.43	42%	0.424	S	S	.	.			trans	-76	96.9	179.4	-154.3	-174.8	-172.7	-161.8	0	110	N86 T91 L394	N86-K88 PolarHBondContact O-N 2.87Å; K88-T91 VanDerWaalsContact CE-OG1 3.27Å; K88-T91 WeakPolarHBondContact CE-OG1 3.43Å; K88-T91 PolarHBondContact NZ-OG1 3.49Å; K88-L394 HydrophobicContact CB-CD1 3.91Å; K88-L394 HydrophobicContact CD-CD1 3.78Å; K88-L394 HydrophobicContact CG-CD1 3.65Å; K88-L394 WeakPolarHBondContact O-CD1 3.38Å
89	A	87.1	Confident	66	Low	0 Å²	0	81.6 Å²	81.6	0%	0	42%	0.42	C	S	.	.			trans	-85.4	-34.8	176.4	0	0	0	0	0	112.7	I87 Y342 V353 L394	I87-A89 PolarHBondContact O-N 3.22Å; A89-Y342 HydrophobicContact CB-CD1 4.45Å; A89-Y342 HydrophobicContact CB-CE1 4.05Å; A89-Y342 HydrophobicContact CB-CE2 4.18Å; A89-V353 HydrophobicContact CB-CG1 4.29Å; A89-L394 PolarHBondContact O-N 3.24Å
90	F	90.5	Very high	68.2	Low	2 Å²	2	78.2 Å²	78.2	1%	0.009	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	157.4	-178.7	-64.1	-93.4	0	0	0	111.9	Y342 I344 V353 Q363 L391 A392 P393	F90-Y342 AromaticContact CE2-CD2 3.75Å; F90-Y342 HydrophobicContact CE2-CD2 3.75Å; F90-Y342 AromaticContact CE2-CG 3.92Å; F90-Y342 HydrophobicContact CE2-CG 3.92Å; F90-Y342 HydrophobicContact CZ-CD2 4.02Å; F90-Y342 HydrophobicContact CZ-CG 4.47Å; F90-I344 HydrophobicContact CE2-CD1 4.31Å; F90-I344 HydrophobicContact CE2-CG1 4.47Å; F90-I344 HydrophobicContact CZ-CD1 4.1Å; F90-V353 HydrophobicContact CD2-CG1 3.82Å; F90-V353 HydrophobicContact CD2-CG2 3.97Å; F90-V353 HydrophobicContact CE2-CG1 3.69Å; F90-Q363 PolarHBondContact O-NE2 3.5Å; F90-Q363 PolarHBondContact O-OE1 2.96Å; F90-L391 HydrophobicContact CB-CB 4.34Å; F90-L391 HydrophobicContact CB-CD2 4.26Å; F90-L391 HydrophobicContact CD1-CB 3.93Å; F90-L391 HydrophobicContact CG-CB 4.38Å; F90-A392 CarbonylContact C-O 3.59Å; F90-A392 WeakPolarHBondContact CA-O 3.29Å; F90-P393 HydrophobicContact CD1-CB 4.03Å; F90-P393 HydrophobicContact CE1-CB 3.77Å
91	T	89.9	Confident	70.2	Confident	22 Å²	22	70.6 Å²	70.6	14%	0.135	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	130.5	162.2	-54.8	0	0	0	0	109.2	K88 V93 P143 A392	K88-T91 VanDerWaalsContact CE-OG1 3.27Å; K88-T91 WeakPolarHBondContact CE-OG1 3.43Å; K88-T91 PolarHBondContact NZ-OG1 3.49Å; T91-V93 HydrophobicContact CG2-CG2 4.49Å; T91-P143 HydrophobicContact CG2-CB 4.47Å; T91-P143 HydrophobicContact CG2-CG 4.01Å; T91-A392 PolarHBondContact N-O 3.29Å; T91-A392 PolarHBondContact O-N 3.26Å
92	L	90.6	Very high	72	Confident	47 Å²	47	65.6 Å²	65.6	25%	0.246	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	128.2	171.4	-171.6	73.7	0	0	0	109.4	I351 F367 Y389 L391	L92-I351 HydrophobicContact CD1-CD1 4.32Å; L92-F367 HydrophobicContact CD1-CE2 4.48Å; L92-F367 HydrophobicContact CD2-CD2 3.51Å; L92-F367 HydrophobicContact CD2-CE2 3.91Å; L92-Y389 HydrophobicContact CD1-CG 4.36Å; L92-Y389 HydrophobicContact CD2-CD1 4.38Å; L92-Y389 HydrophobicContact CG-CD1 4.33Å; L92-L391 HydrophobicContact CB-CD2 4.17Å; L92-L391 HydrophobicContact CD1-CD2 3.75Å; L92-L391 HydrophobicContact CD1-CG 4.17Å
93	V	89.7	Confident	73.5	Confident	21 Å²	21	61.2 Å²	61.2	13%	0.127	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	129.9	-178.5	-178.8	0	0	0	0	108.7	T91 F146 Y389 I390 A392	T91-V93 HydrophobicContact CG2-CG2 4.49Å; V93-F146 HydrophobicContact CB-CD2 4.47Å; V93-F146 HydrophobicContact CG1-CD2 4.23Å; V93-Y389 CarbonylContact O-C 3.52Å; V93-Y389 VanDerWaalsContact O-CA 3.27Å; V93-Y389 WeakPolarHBondContact O-CA 3.36Å; V93-I390 PolarHBondContact N-O 2.73Å; V93-I390 PolarHBondContact O-N 3.16Å; V93-A392 HydrophobicContact CG2-CB 3.99Å
94	S	88	Confident	74.5	Confident	36 Å²	36	62.8 Å²	62.8	25%	0.252	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	133.4	171.6	-171.3	0	0	0	0	110	E97	S94-E97 WeakPolarHBondContact CB-OE1 3.36Å; S94-E97 WeakPolarHBondContact OG-CG 3.43Å; S94-E97 PolarHBondContact OG-OE1 3.16Å
95	A	86.4	Confident	75.6	Confident	6 Å²	6	61.2 Å²	61.2	5%	0.05	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	-43.6	-178.4	0	0	0	0	0	112.7	L134 F146 A148 V388 I390	A95-L134 HydrophobicContact CB-CD2 4.3Å; A95-F146 HydrophobicContact CB-CB 4.39Å; A95-A148 WeakPolarHBondContact O-CB 3.48Å; A95-A148 PolarHBondContact O-N 3.21Å; A95-V388 PolarHBondContact N-O 2.75Å; A95-I390 HydrophobicContact CB-CD1 3.69Å; A95-I390 HydrophobicContact CB-CG1 3.83Å
96	V	84.5	Confident	76.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	111.5	172.1	-170.6	0	0	0	0	109.4	L100 L101 L120 F132 A148 G387 V388	V96-L100 HydrophobicContact CG1-CB 4.2Å; V96-L100 HydrophobicContact CG1-CD1 4.5Å; V96-L101 HydrophobicContact CG1-CD1 3.71Å; V96-L101 HydrophobicContact CG1-CG 3.73Å; V96-L120 HydrophobicContact CG2-CD2 3.48Å; V96-L120 VanDerWaalsContact CG2-CD2 3.48Å; V96-F132 HydrophobicContact CG1-CD1 4.45Å; V96-F132 HydrophobicContact CG1-CE1 3.89Å; V96-F132 HydrophobicContact CG1-CE2 4.19Å; V96-F132 HydrophobicContact CG1-CZ 3.75Å; V96-F132 HydrophobicContact CG2-CD2 4.48Å; V96-F132 HydrophobicContact CG2-CG 4.44Å; V96-A148 HydrophobicContact CG2-CB 3.67Å; V96-G387 CarbonylContact O-C 3.46Å; V96-G387 VanDerWaalsContact O-CA 3.29Å; V96-G387 WeakPolarHBondContact O-CA 3.35Å; V96-V388 HydrophobicContact CB-CB 3.96Å; V96-V388 HydrophobicContact CB-CG2 4.14Å; V96-V388 HydrophobicContact CG2-CB 4.14Å; V96-V388 HydrophobicContact CG2-CG2 4.39Å; V96-V388 PolarHBondContact N-O 3.47Å; V96-V388 PolarHBondContact O-N 3.06Å
97	E	81.7	Confident	76.7	Confident	108 Å²	108	68.6 Å²	68.6	51%	0.505	33%	0.332	S	S	.	.			trans	-90.4	158.7	177.9	-63.8	-174.6	174.1	0	0	111.8	S94 E99 L100	S94-E97 WeakPolarHBondContact CB-OE1 3.36Å; S94-E97 WeakPolarHBondContact OG-CG 3.43Å; S94-E97 PolarHBondContact OG-OE1 3.16Å; E97-E99 PolarHBondContact O-N 3.3Å; E97-E99 VanDerWaalsContact O-N 3.08Å; E97-L100 PolarHBondContact O-N 3.45Å
98	R	74.8	Confident	77	Confident	97 Å²	97	68.3 Å²	68.3	37%	0.366	33%	0.331	S	S	.	.	H	α-helix	trans	-48.9	-40.9	-174.5	-172.6	-176.8	168	177.7	-5.6	112.3	L100 L101 M102 E106 K386	R98-L100 PolarHBondContact O-N 2.64Å; R98-L101 PolarHBondContact O-N 2.88Å; R98-M102 HydrophobicContact CG-CB 4.24Å; R98-M102 HydrophobicContact CG-CG 3.76Å; R98-M102 WeakPolarHBondContact O-CB 3.38Å; R98-M102 WeakPolarHBondContact O-CG 3.26Å; R98-M102 PolarHBondContact O-N 2.67Å; R98-E106 IonicContact NH2-OE1 2.6Å; R98-K386 WeakPolarHBondContact CA-O 3.36Å
99	E	70.2	Confident	77.1	Confident	165 Å²	165	66.6 Å²	66.6	77%	0.771	33%	0.326	S	S	*	.	H	α-helix	trans	-58.7	-42	-178.4	-58.7	-174	-179.1	0	0	113.1	E97 L101 G103	E97-E99 PolarHBondContact O-N 3.3Å; E97-E99 VanDerWaalsContact O-N 3.08Å; E99-L101 VanDerWaalsContact C-N 3.33Å; E99-L101 PolarHBondContact O-N 2.92Å; E99-G103 PolarHBondContact O-N 2.93Å
100	L	72.6	Confident	77.3	Confident	75 Å²	75	66.7 Å²	66.7	39%	0.393	33%	0.327	S	S	.	.	H	α-helix	trans	-68.5	-32.4	-177.8	-63.3	173.4	0	0	0	112.4	V96 E97 R98 F132 K150	V96-L100 HydrophobicContact CG1-CB 4.2Å; V96-L100 HydrophobicContact CG1-CD1 4.5Å; E97-L100 PolarHBondContact O-N 3.45Å; R98-L100 PolarHBondContact O-N 2.64Å; L100-F132 HydrophobicContact CB-CE1 4.13Å; L100-K150 VanDerWaalsContact O-CD 3.27Å; L100-K150 WeakPolarHBondContact O-CD 3.26Å; L100-K150 PolarHBondContact O-NZ 2.91Å
101	L	68.3	Low	77.4	Confident	8 Å²	8	69.9 Å²	69.9	4%	0.042	34%	0.341	C	S	.	.	H	α-helix	trans	-80	-49.6	176.8	-78.7	158.1	0	0	0	111.6	V96 R98 E99 I110 V122 Y130 F132 K150	V96-L101 HydrophobicContact CG1-CD1 3.71Å; V96-L101 HydrophobicContact CG1-CG 3.73Å; R98-L101 PolarHBondContact O-N 2.88Å; E99-L101 VanDerWaalsContact C-N 3.33Å; E99-L101 PolarHBondContact O-N 2.92Å; L101-I110 HydrophobicContact CD1-CD1 3.69Å; L101-I110 HydrophobicContact CD1-CG1 4.12Å; L101-V122 HydrophobicContact CD2-CB 4.26Å; L101-V122 HydrophobicContact CD2-CG1 3.95Å; L101-Y130 HydrophobicContact CD2-CD1 4.37Å; L101-Y130 HydrophobicContact CD2-CD2 4.16Å; L101-Y130 HydrophobicContact CD2-CG 4.02Å; L101-F132 HydrophobicContact CD2-CE2 3.74Å; L101-F132 HydrophobicContact CD2-CZ 3.63Å; L101-F132 HydrophobicContact CG-CE2 4.4Å; L101-F132 HydrophobicContact CG-CZ 3.91Å; L101-K150 PolarHBondContact O-NZ 3.48Å
102	M	64.4	Low	77.6	Confident	21 Å²	21	69.1 Å²	69.1	10%	0.103	34%	0.337	C	S	.	.	H	α-helix	trans	-111.7	-40	-147.4	-55.3	-83.9	-80.5	0	0	115.9	R98 K105 I108	R98-M102 HydrophobicContact CG-CB 4.24Å; R98-M102 HydrophobicContact CG-CG 3.76Å; R98-M102 WeakPolarHBondContact O-CB 3.38Å; R98-M102 WeakPolarHBondContact O-CG 3.26Å; R98-M102 PolarHBondContact O-N 2.67Å; M102-K105 WeakPolarHBondContact CE-O 3.43Å; M102-I108 HydrophobicContact CE-CB 3.88Å; M102-I108 WeakPolarHBondContact CE-O 3.26Å; M102-I108 HydrophobicContact SD-CB 3.58Å; M102-I108 VanDerWaalsContact SD-CB 3.58Å; M102-I108 HydrophobicContact SD-CG2 3.78Å
103	G	62.3	Low	77.7	Confident	43 Å²	43	66.9 Å²	66.9	44%	0.443	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	-147.9	-149.5	0	0	0	0	0	112.1	E99 K105	E99-G103 PolarHBondContact O-N 2.93Å; G103-K105 PolarHBondContact O-N 2.84Å
104	D	53	Low	77.9	Confident	162 Å²	162	66.5 Å²	66.5	87%	0.866	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	6.5	-176.6	-59.1	-41.6	0	0	0	115.3	E106	D104-E106 PolarHBondContact O-N 3.49Å
105	K	63.6	Low	78	Confident	132 Å²	132	65 Å²	65	57%	0.574	31%	0.312	S	S	*	.			trans	-77.8	92.3	-174.7	-70	-175.5	-179.8	177	0	112.6	M102 G103 R107 I108	M102-K105 WeakPolarHBondContact CE-O 3.43Å; G103-K105 PolarHBondContact O-N 2.84Å; K105-R107 PolarHBondContact O-N 3.2Å; K105-I108 HydrophobicContact CB-CD1 4.07Å; K105-I108 HydrophobicContact CD-CD1 3.78Å
106	E	61.1	Low	78.2	Confident	155 Å²	155	65.6 Å²	65.6	72%	0.724	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-5.1	-175.7	-54	-147.3	102	0	0	117.8	R98 D104	R98-E106 IonicContact NH2-OE1 2.6Å; D104-E106 PolarHBondContact O-N 3.49Å
107	R	71.7	Confident	78.3	Confident	225 Å²	225	67.2 Å²	67.2	85%	0.849	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-2	-169.4	-62.7	-173.1	-178.5	-174.9	0.4	115.4	K105 N125	K105-R107 PolarHBondContact O-N 3.2Å; R107-N125 PolarHBondContact O-ND2 3.07Å
108	I	81.3	Confident	78.6	Confident	11 Å²	11	70.1 Å²	70.1	6%	0.056	34%	0.338	C	S	.	.			trans	-92.5	133.1	-178.7	-60.1	170.2	0	0	0	108.7	M102 K105 T124 N125 D126	M102-I108 HydrophobicContact CE-CB 3.88Å; M102-I108 WeakPolarHBondContact CE-O 3.26Å; M102-I108 HydrophobicContact SD-CB 3.58Å; M102-I108 VanDerWaalsContact SD-CB 3.58Å; M102-I108 HydrophobicContact SD-CG2 3.78Å; K105-I108 HydrophobicContact CB-CD1 4.07Å; K105-I108 HydrophobicContact CD-CD1 3.78Å; I108-T124 HydrophobicContact CG2-CG2 3.87Å; I108-N125 VanDerWaalsContact CA-OD1 3.27Å; I108-N125 WeakPolarHBondContact CA-OD1 3.28Å; I108-D126 VanDerWaalsContact CD1-OD2 3.29Å; I108-D126 WeakPolarHBondContact CD1-OD2 3.37Å; I108-D126 HydrophobicContact CG1-CB 4.45Å
109	N	88.2	Confident	79.4	Confident	62 Å²	62	67.3 Å²	67.3	33%	0.332	33%	0.33	S	S	.	.			trans	-120.9	148.1	177.8	-71.7	-7	0	0	0	110.1	T124 N125	N109-T124 VanDerWaalsContact O-CA 3.23Å; N109-T124 WeakPolarHBondContact O-CA 3.5Å; N109-T124 WeakPolarHBondContact O-CB 3.48Å; N109-N125 HydrophobicContact CB-CB 4.35Å; N109-N125 VanDerWaalsContact N-CG 3.3Å; N109-N125 PolarHBondContact N-ND2 3.45Å; N109-N125 PolarHBondContact N-OD1 3.26Å; N109-N125 PolarHBondContact O-N 3.13Å; N109-N125 VanDerWaalsContact O-N 3.09Å
110	I	91.7	Very high	80.5	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.015	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	121.7	164.3	-57.4	179.3	0	0	0	108.6	L101 V113 V122 H371 I372 A383 S385 V388	L101-I110 HydrophobicContact CD1-CD1 3.69Å; L101-I110 HydrophobicContact CD1-CG1 4.12Å; I110-V113 HydrophobicContact CG2-CG2 3.72Å; I110-V122 HydrophobicContact CB-CG1 4.45Å; I110-V122 HydrophobicContact CD1-CG1 4.27Å; I110-V122 HydrophobicContact CG1-CG1 4Å; I110-V122 HydrophobicContact CG2-CG1 3.88Å; I110-H371 PolarHBondContact O-CE1 3.25Å; I110-H371 VanDerWaalsContact O-CE1 3.29Å; I110-H371 PolarHBondContact O-NE2 3.45Å; I110-I372 HydrophobicContact CG2-CD1 3.83Å; I110-A383 HydrophobicContact CG2-CB 4.47Å; I110-S385 PolarHBondContact N-O 3.25Å; I110-V388 HydrophobicContact CD1-CG2 3.72Å
111	E	92.2	Very high	81.5	Confident	68 Å²	68	56 Å²	56	32%	0.318	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-36.6	179.3	-63.3	-71	138.8	0	0	111.3	G123 N125 P161 V162 I372	E111-G123 PolarHBondContact N-O 3.35Å; E111-N125 HydrophobicContact CG-CB 3.81Å; E111-N125 WeakPolarHBondContact OE1-CB 3.27Å; E111-P161 HydrophobicContact CG-CB 3.88Å; E111-V162 VanDerWaalsContact CB-O 3.3Å; E111-V162 WeakPolarHBondContact CB-O 3.41Å; E111-I372 WeakPolarHBondContact O-CD1 3.38Å
112	C	92.9	Very high	82.7	Confident	6 Å²	6	55.6 Å²	55.6	4%	0.041	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	158.3	176	58.2	0	0	0	0	112.5	G123 V162 N163	C112-G123 PolarHBondContact N-O 2.97Å; C112-G123 PolarHBondContact O-N 3.49Å; C112-V162 PolarHBondContact SG-O 3.15Å; C112-N163 WeakPolarHBondContact CB-O 3.26Å
113	V	94.2	Very high	84.1	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.006	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	142.6	179.6	-177.7	0	0	0	0	108.9	I110 L120 Y121 I372 Q374 F376 I381 A383 V388	I110-V113 HydrophobicContact CG2-CG2 3.72Å; V113-L120 HydrophobicContact CG1-CD1 3.54Å; V113-Y121 WeakPolarHBondContact CA-O 3.5Å; V113-I372 HydrophobicContact CG2-CD1 4.31Å; V113-Q374 PolarHBondContact O-NE2 3.09Å; V113-F376 WeakPolarHBondContact O-CZ 3.45Å; V113-I381 HydrophobicContact CG1-CG2 4.15Å; V113-A383 HydrophobicContact CG2-CB 4.18Å; V113-V388 HydrophobicContact CG1-CG1 4.32Å; V113-V388 HydrophobicContact CG2-CG2 4.15Å
114	E	92.9	Very high	85.5	Confident	13 Å²	13	52.7 Å²	52.7	6%	0.061	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	141.5	177.1	178.3	71.3	-174.2	0	0	109.3	Y121 L165 R166 A167 L174 F376	E114-Y121 PolarHBondContact N-O 3.24Å; E114-Y121 PolarHBondContact O-N 3.42Å; E114-L165 HydrophobicContact CB-CB 3.63Å; E114-L165 HydrophobicContact CG-CB 4.38Å; E114-R166 VanDerWaalsContact CD-CA 3.46Å; E114-R166 WeakPolarHBondContact OE1-CA 3.36Å; E114-R166 IonicContact OE2-CZ 2.71Å; E114-R166 IonicContact OE2-NH1 2.63Å; E114-R166 PolarHBondContact OE2-NH1 2.98Å; E114-A167 HydrophobicContact CG-CB 3.95Å; E114-A167 PolarHBondContact OE1-N 3.49Å; E114-L174 HydrophobicContact CG-CD1 4.31Å; E114-F376 VanDerWaalsContact OE2-CE1 3.23Å; E114-F376 WeakPolarHBondContact OE2-CE1 3.48Å
115	C	90.8	Very high	87.3	Confident	4 Å²	4	47.1 Å²	47.1	3%	0.027	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135.2	178.4	179.2	0	0	0	0	112.3	D119 L120 F376 R379 I381	C115-D119 WeakPolarHBondContact CA-O 3.47Å; C115-L120 HydrophobicContact CB-CD1 4Å; C115-F376 HydrophobicContact CB-CB 4.02Å; C115-F376 HydrophobicContact CB-CD1 4.49Å; C115-F376 HydrophobicContact CB-CD2 3.76Å; C115-F376 HydrophobicContact CB-CE2 4.33Å; C115-F376 HydrophobicContact CB-CG 3.84Å; C115-F376 WeakPolarHBondContact O-CB 3.44Å; C115-R379 PolarHBondContact SG-NH2 3.39Å; C115-R379 VanDerWaalsContact SG-NH2 3.4Å; C115-I381 HydrophobicContact CB-CD1 3.57Å
116	C	89.8	Confident	88.5	Confident	19 Å²	19	43.1 Å²	43.1	13%	0.128	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	125.2	172.7	178.5	0	0	0	0	110.1	R118 D119 A167 S169 M187	C116-R118 PolarHBondContact O-N 2.8Å; C116-D119 PolarHBondContact N-O 3.03Å; C116-D119 PolarHBondContact O-N 3.13Å; C116-A167 HydrophobicContact CB-CB 3.76Å; C116-S169 WeakPolarHBondContact SG-CB 3.24Å; C116-M187 HydrophobicContact CB-CE 4.09Å
117	G	86.8	Confident	89.8	Confident	33 Å²	33	35.7 Å²	35.7	34%	0.34	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	-104.2	-175.1	0	0	0	0	0	113	E377 R379	G117-E377 WeakPolarHBondContact CA-OE2 3.44Å; G117-E377 PolarHBondContact N-OE1 3.14Å; G117-E377 VanDerWaalsContact N-OE1 3.12Å; G117-E377 PolarHBondContact N-OE2 2.84Å; G117-R379 VanDerWaalsContact O-CZ 3.22Å; G117-R379 PolarHBondContact O-NH1 3.06Å; G117-R379 PolarHBondContact O-NH2 3.48Å; G117-R379 VanDerWaalsContact O-NH2 3.11Å
118	R	89	Confident	90.7	Very high	169 Å²	169	27.1 Å²	27.1	64%	0.638	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.6	-7	174.4	-65.2	-175.7	-177.3	176.6	-0.6	113.1	C116 L133 L134	C116-R118 PolarHBondContact O-N 2.8Å; R118-L133 HydrophobicContact CB-CD1 3.59Å; R118-L134 WeakPolarHBondContact O-CB 3.4Å; R118-L134 PolarHBondContact O-N 3Å
119	D	91.4	Very high	91.3	Very high	39 Å²	39	26.7 Å²	26.7	21%	0.209	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	118.3	-173.5	-60.1	-74.7	0	0	0	110.2	C115 C116 Y121 H131	C115-D119 WeakPolarHBondContact CA-O 3.47Å; C116-D119 PolarHBondContact N-O 3.03Å; C116-D119 PolarHBondContact O-N 3.13Å; D119-Y121 HydrophobicContact CB-CE2 3.6Å; D119-Y121 WeakPolarHBondContact CB-OH 3.35Å; D119-H131 IonicContact OD1-CD2 2.69Å; D119-H131 IonicContact OD1-CE1 3.12Å; D119-H131 IonicContact OD1-NE2 3.7Å; D119-H131 PolarHBondContact OD1-NE2 2.94Å
120	L	92.4	Very high	91.4	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.5	179.4	178.9	69.9	0	0	0	109.2	V96 V113 C115 V122 F132 L134 I381 V388	V96-L120 HydrophobicContact CG2-CD2 3.48Å; V96-L120 VanDerWaalsContact CG2-CD2 3.48Å; V113-L120 HydrophobicContact CG1-CD1 3.54Å; C115-L120 HydrophobicContact CB-CD1 4Å; L120-V122 HydrophobicContact CG-CG2 4.32Å; L120-F132 HydrophobicContact CB-CB 4.34Å; L120-F132 PolarHBondContact N-O 3.39Å; L120-F132 PolarHBondContact O-N 3.35Å; L120-L134 HydrophobicContact CB-CD1 3.89Å; L120-L134 HydrophobicContact CB-CG 3.99Å; L120-L134 HydrophobicContact CD2-CD1 4.24Å; L120-L134 HydrophobicContact CD2-CD2 4.11Å; L120-L134 HydrophobicContact CD2-CG 4.29Å; L120-L134 HydrophobicContact CG-CD1 4.45Å; L120-I381 HydrophobicContact CD1-CD1 3.85Å; L120-V388 HydrophobicContact CD2-CG1 4.38Å
121	Y	93.6	Very high	91.5	Very high	1 Å²	1	24.6 Å²	24.6	0%	0.004	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.5	179.7	-55.9	-87.1	0	0	0	109.5	V113 E114 D119 Y130 H131 L174 M187 L190	V113-Y121 WeakPolarHBondContact CA-O 3.5Å; E114-Y121 PolarHBondContact N-O 3.24Å; E114-Y121 PolarHBondContact O-N 3.42Å; D119-Y121 HydrophobicContact CB-CE2 3.6Å; D119-Y121 WeakPolarHBondContact CB-OH 3.35Å; Y121-Y130 WeakPolarHBondContact CA-O 3.46Å; Y121-H131 HydrophobicContact CD1-CB 4.08Å; Y121-H131 HydrophobicContact CE1-CB 4.01Å; Y121-H131 AromaticContact CE1-CD2 3.5Å; Y121-H131 VanDerWaalsContact CE1-CD2 3.5Å; Y121-H131 WeakPolarHBondContact CE1-CD2 3.49Å; Y121-H131 AromaticContact CE1-CG 3.83Å; Y121-H131 AromaticContact CZ-CD2 3.74Å; Y121-L174 HydrophobicContact CD1-CD1 4.45Å; Y121-L174 HydrophobicContact CD1-CD2 3.73Å; Y121-L174 HydrophobicContact CD2-CD1 4.09Å; Y121-L174 HydrophobicContact CE1-CD2 4.34Å; Y121-L174 HydrophobicContact CG-CD1 4.01Å; Y121-L174 HydrophobicContact CG-CD2 3.97Å; Y121-M187 HydrophobicContact CE2-CE 3.92Å; Y121-M187 WeakPolarHBondContact OH-CB 3.4Å; Y121-M187 PolarHBondContact OH-O 2.87Å; Y121-L190 HydrophobicContact CD1-CD2 4.14Å; Y121-L190 HydrophobicContact CE1-CD2 4.16Å
122	V	93.5	Very high	91.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	118.7	-178.4	-177.3	0	0	0	0	108.8	L101 I110 L120 V129 Y130 F132 V388	L101-V122 HydrophobicContact CD2-CB 4.26Å; L101-V122 HydrophobicContact CD2-CG1 3.95Å; I110-V122 HydrophobicContact CB-CG1 4.45Å; I110-V122 HydrophobicContact CD1-CG1 4.27Å; I110-V122 HydrophobicContact CG1-CG1 4Å; I110-V122 HydrophobicContact CG2-CG1 3.88Å; L120-V122 HydrophobicContact CG-CG2 4.32Å; V122-V129 WeakPolarHBondContact O-CA 3.48Å; V122-Y130 PolarHBondContact N-O 3.29Å; V122-Y130 PolarHBondContact O-N 2.92Å; V122-F132 HydrophobicContact CB-CE2 4.39Å; V122-F132 HydrophobicContact CG2-CD2 4.2Å; V122-F132 HydrophobicContact CG2-CE2 4.04Å; V122-V388 HydrophobicContact CG2-CG2 4.17Å
123	G	93.6	Very high	91.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	138.9	176.8	0	0	0	0	0	111.1	E111 C112	E111-G123 PolarHBondContact N-O 3.35Å; C112-G123 PolarHBondContact N-O 2.97Å; C112-G123 PolarHBondContact O-N 3.49Å
124	T	92	Very high	91.2	Very high	2 Å²	2	24 Å²	24	1%	0.012	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	162.3	-170.4	50.7	0	0	0	0	113.6	I108 N109 D126 C127 F128 Y130 V162	I108-T124 HydrophobicContact CG2-CG2 3.87Å; N109-T124 VanDerWaalsContact O-CA 3.23Å; N109-T124 WeakPolarHBondContact O-CA 3.5Å; N109-T124 WeakPolarHBondContact O-CB 3.48Å; T124-D126 VanDerWaalsContact C-N 3.26Å; T124-D126 PolarHBondContact O-N 2.84Å; T124-D126 PolarHBondContact OG1-OD1 2.9Å; T124-D126 VanDerWaalsContact OG1-OD1 3.04Å; T124-C127 PolarHBondContact O-N 3.12Å; T124-F128 PolarHBondContact N-O 3.03Å; T124-F128 WeakPolarHBondContact OG1-CB 3.38Å; T124-F128 PolarHBondContact OG1-N 3.43Å; T124-F128 PolarHBondContact OG1-O 3.45Å; T124-Y130 HydrophobicContact CG2-CD2 3.93Å; T124-Y130 HydrophobicContact CG2-CE2 3.66Å; T124-V162 PolarHBondContact O-N 3.45Å
125	N	90.7	Very high	90.9	Very high	45 Å²	45	27 Å²	27	24%	0.241	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-25.7	-179.4	68.2	-16.2	0	0	0	114.1	R107 I108 N109 E111 C127	R107-N125 PolarHBondContact O-ND2 3.07Å; I108-N125 VanDerWaalsContact CA-OD1 3.27Å; I108-N125 WeakPolarHBondContact CA-OD1 3.28Å; N109-N125 HydrophobicContact CB-CB 4.35Å; N109-N125 VanDerWaalsContact N-CG 3.3Å; N109-N125 PolarHBondContact N-ND2 3.45Å; N109-N125 PolarHBondContact N-OD1 3.26Å; N109-N125 PolarHBondContact O-N 3.13Å; N109-N125 VanDerWaalsContact O-N 3.09Å; E111-N125 HydrophobicContact CG-CB 3.81Å; E111-N125 WeakPolarHBondContact OE1-CB 3.27Å; N125-C127 VanDerWaalsContact C-N 3.29Å; N125-C127 PolarHBondContact O-N 3.44Å
126	D	87.8	Confident	90.7	Very high	48 Å²	48	32.3 Å²	32.3	26%	0.257	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	22.2	177.7	75.5	-27.8	0	0	0	113.7	I108 T124 F128 H155	I108-D126 VanDerWaalsContact CD1-OD2 3.29Å; I108-D126 WeakPolarHBondContact CD1-OD2 3.37Å; I108-D126 HydrophobicContact CG1-CB 4.45Å; T124-D126 VanDerWaalsContact C-N 3.26Å; T124-D126 PolarHBondContact O-N 2.84Å; T124-D126 PolarHBondContact OG1-OD1 2.9Å; T124-D126 VanDerWaalsContact OG1-OD1 3.04Å; D126-F128 VanDerWaalsContact C-N 3.3Å; D126-F128 PolarHBondContact O-N 3.24Å; D126-F128 WeakPolarHBondContact OD2-CD2 3.14Å; D126-H155 PolarHBondContact O-CD2 3.34Å; D126-H155 VanDerWaalsContact O-CD2 3.28Å
127	C	89.5	Confident	90.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.177	C	C	.	.	S	Bend	trans	66.7	21.3	173.6	-152.5	0	0	0	0	115.4	T124 N125 H155 L156 F158 K160 C178	T124-C127 PolarHBondContact O-N 3.12Å; N125-C127 VanDerWaalsContact C-N 3.29Å; N125-C127 PolarHBondContact O-N 3.44Å; C127-H155 WeakPolarHBondContact O-CA 3.29Å; C127-L156 PolarHBondContact O-N 3.04Å; C127-F158 WeakPolarHBondContact CB-O 3.42Å; C127-K160 VanDerWaalsContact CB-O 3.3Å; C127-K160 WeakPolarHBondContact CB-O 3.39Å; C127-K160 PolarHBondContact SG-O 3.23Å; C127-C178 VanDerWaalsContact SG-SG 3.66Å
128	F	90.8	Very high	89.5	Confident	45 Å²	45	41 Å²	41	20%	0.197	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	145.6	167.7	-76.2	-103	0	0	0	112.1	T124 D126 Y130 H153 R154 H155	T124-F128 PolarHBondContact N-O 3.03Å; T124-F128 WeakPolarHBondContact OG1-CB 3.38Å; T124-F128 PolarHBondContact OG1-N 3.43Å; T124-F128 PolarHBondContact OG1-O 3.45Å; D126-F128 VanDerWaalsContact C-N 3.3Å; D126-F128 PolarHBondContact O-N 3.24Å; D126-F128 WeakPolarHBondContact OD2-CD2 3.14Å; F128-Y130 HydrophobicContact CB-CD2 4.08Å; F128-Y130 HydrophobicContact CB-CE2 3.45Å; F128-Y130 VanDerWaalsContact CB-CE2 3.45Å; F128-Y130 HydrophobicContact CG-CE2 4.3Å; F128-H153 AromaticContact CD1-CD2 3.7Å; F128-H153 AromaticContact CE1-CD2 3.76Å; F128-R154 WeakPolarHBondContact CA-O 3.18Å; F128-H155 HydrophobicContact CD1-CB 3.99Å; F128-H155 HydrophobicContact CD2-CB 4.14Å; F128-H155 AromaticContact CD2-CD2 3.94Å; F128-H155 HydrophobicContact CE1-CB 3.76Å; F128-H155 HydrophobicContact CE2-CB 3.91Å; F128-H155 AromaticContact CE2-CD2 3.78Å; F128-H155 HydrophobicContact CG-CB 4.19Å; F128-H155 HydrophobicContact CZ-CB 3.72Å
129	V	92.6	Very high	88.7	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	129.3	157.8	178.3	0	0	0	0	108.1	V122 H153 R154 L156 V162 L165 L174 V176 L190	V122-V129 WeakPolarHBondContact O-CA 3.48Å; V129-H153 CarbonylContact O-C 3.44Å; V129-H153 VanDerWaalsContact O-CA 3.23Å; V129-H153 WeakPolarHBondContact O-CA 3.19Å; V129-R154 PolarHBondContact N-O 2.75Å; V129-R154 PolarHBondContact O-N 3.04Å; V129-L156 HydrophobicContact CG2-CD1 3.75Å; V129-L156 HydrophobicContact CG2-CG 4.29Å; V129-V162 HydrophobicContact CG2-CG1 4.25Å; V129-V162 HydrophobicContact CG2-CG2 4.14Å; V129-L165 HydrophobicContact CG1-CD1 4.46Å; V129-L165 HydrophobicContact CG2-CD2 4.08Å; V129-L174 HydrophobicContact CG1-CD2 4.01Å; V129-V176 HydrophobicContact CG2-CG1 4.41Å; V129-L190 HydrophobicContact CB-CD1 4.24Å; V129-L190 HydrophobicContact CG1-CD1 3.98Å; V129-L190 HydrophobicContact CG1-CD2 3.99Å; V129-L190 WeakPolarHBondContact O-CD1 3.48Å
130	Y	91.8	Very high	87	Confident	12 Å²	12	41 Å²	41	5%	0.047	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	138.5	174.4	-63.5	-100.5	0	0	0	109.1	L101 Y121 V122 T124 F128 F132 H153	L101-Y130 HydrophobicContact CD2-CD1 4.37Å; L101-Y130 HydrophobicContact CD2-CD2 4.16Å; L101-Y130 HydrophobicContact CD2-CG 4.02Å; Y121-Y130 WeakPolarHBondContact CA-O 3.46Å; V122-Y130 PolarHBondContact N-O 3.29Å; V122-Y130 PolarHBondContact O-N 2.92Å; T124-Y130 HydrophobicContact CG2-CD2 3.93Å; T124-Y130 HydrophobicContact CG2-CE2 3.66Å; F128-Y130 HydrophobicContact CB-CD2 4.08Å; F128-Y130 HydrophobicContact CB-CE2 3.45Å; F128-Y130 VanDerWaalsContact CB-CE2 3.45Å; F128-Y130 HydrophobicContact CG-CE2 4.3Å; Y130-F132 HydrophobicContact CG-CE2 4.48Å; Y130-H153 HydrophobicContact CD1-CB 3.42Å; Y130-H153 VanDerWaalsContact CD1-CB 3.42Å; Y130-H153 AromaticContact CD1-CG 3.99Å; Y130-H153 HydrophobicContact CE1-CB 3.77Å; Y130-H153 AromaticContact CE1-CD2 3.63Å; Y130-H153 AromaticContact CE1-CG 3.88Å; Y130-H153 HydrophobicContact CG-CB 3.92Å
131	H	93.4	Very high	85.3	Confident	9 Å²	9	44.8 Å²	44.8	4%	0.042	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.2	176.4	167.5	-133.2	0	0	0	109.9	D119 Y121 Q151 L152 L190	D119-H131 IonicContact OD1-CD2 2.69Å; D119-H131 IonicContact OD1-CE1 3.12Å; D119-H131 IonicContact OD1-NE2 3.7Å; D119-H131 PolarHBondContact OD1-NE2 2.94Å; Y121-H131 HydrophobicContact CD1-CB 4.08Å; Y121-H131 HydrophobicContact CE1-CB 4.01Å; Y121-H131 AromaticContact CE1-CD2 3.5Å; Y121-H131 VanDerWaalsContact CE1-CD2 3.5Å; Y121-H131 WeakPolarHBondContact CE1-CD2 3.49Å; Y121-H131 AromaticContact CE1-CG 3.83Å; Y121-H131 AromaticContact CZ-CD2 3.74Å; H131-Q151 WeakPolarHBondContact ND1-CB 3.45Å; H131-Q151 PolarHBondContact O-N 2.84Å; H131-L152 HydrophobicContact CB-CG 4.33Å; H131-L152 PolarHBondContact N-O 3.04Å; H131-L152 WeakPolarHBondContact ND1-CD2 3.33Å; H131-L152 PolarHBondContact O-N 3.34Å; H131-L190 HydrophobicContact CB-CD1 4.08Å
132	F	92.1	Very high	83.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	143.4	177.5	-58.5	-97.6	0	0	0	110.2	V96 L100 L101 L120 V122 Y130 A148 T149 K150	V96-F132 HydrophobicContact CG1-CD1 4.45Å; V96-F132 HydrophobicContact CG1-CE1 3.89Å; V96-F132 HydrophobicContact CG1-CE2 4.19Å; V96-F132 HydrophobicContact CG1-CZ 3.75Å; V96-F132 HydrophobicContact CG2-CD2 4.48Å; V96-F132 HydrophobicContact CG2-CG 4.44Å; L100-F132 HydrophobicContact CB-CE1 4.13Å; L101-F132 HydrophobicContact CD2-CE2 3.74Å; L101-F132 HydrophobicContact CD2-CZ 3.63Å; L101-F132 HydrophobicContact CG-CE2 4.4Å; L101-F132 HydrophobicContact CG-CZ 3.91Å; L120-F132 HydrophobicContact CB-CB 4.34Å; L120-F132 PolarHBondContact N-O 3.39Å; L120-F132 PolarHBondContact O-N 3.35Å; V122-F132 HydrophobicContact CB-CE2 4.39Å; V122-F132 HydrophobicContact CG2-CD2 4.2Å; V122-F132 HydrophobicContact CG2-CE2 4.04Å; Y130-F132 HydrophobicContact CG-CE2 4.48Å; F132-A148 HydrophobicContact CB-CB 4.16Å; F132-A148 HydrophobicContact CD1-CB 4.22Å; F132-A148 HydrophobicContact CG-CB 4.46Å; F132-T149 CarbonylContact C-O 3.6Å; F132-T149 VanDerWaalsContact CA-O 3.24Å; F132-T149 WeakPolarHBondContact CA-O 3.49Å; F132-K150 HydrophobicContact CD1-CB 3.81Å; F132-K150 HydrophobicContact CD1-CG 4.36Å; F132-K150 HydrophobicContact CE1-CB 3.7Å; F132-K150 HydrophobicContact CE1-CD 4.17Å; F132-K150 HydrophobicContact CE1-CG 3.99Å
133	L	91.8	Very high	82.5	Confident	54 Å²	54	47.6 Å²	47.6	28%	0.283	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	118	168.1	-177	72.8	0	0	0	109	R118 T149 Q151	R118-L133 HydrophobicContact CB-CD1 3.59Å; L133-T149 PolarHBondContact N-O 3.42Å; L133-T149 PolarHBondContact O-N 2.95Å; L133-T149 PolarHBondContact O-OG1 3.47Å; L133-T149 VanDerWaalsContact O-OG1 3.12Å; L133-Q151 HydrophobicContact CB-CG 3.89Å
134	L	89.6	Confident	81.6	Confident	9 Å²	9	48.3 Å²	48.3	5%	0.047	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	119.5	174.9	-70.2	171	0	0	0	110.7	A95 R118 L120 A148 I390	A95-L134 HydrophobicContact CB-CD2 4.3Å; R118-L134 WeakPolarHBondContact O-CB 3.4Å; R118-L134 PolarHBondContact O-N 3Å; L120-L134 HydrophobicContact CB-CD1 3.89Å; L120-L134 HydrophobicContact CB-CG 3.99Å; L120-L134 HydrophobicContact CD2-CD1 4.24Å; L120-L134 HydrophobicContact CD2-CD2 4.11Å; L120-L134 HydrophobicContact CD2-CG 4.29Å; L120-L134 HydrophobicContact CG-CD1 4.45Å; L134-A148 HydrophobicContact CD2-CB 3.87Å; L134-I390 HydrophobicContact CD1-CD1 4.11Å; L134-I390 HydrophobicContact CD2-CD1 4.23Å
135	E	87.1	Confident	81	Confident	75 Å²	75	51.1 Å²	51.1	35%	0.35	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	123.5	163.1	-63.3	-171.6	158.3	0	0	109.9	R137 F146 T147	E135-R137 IonicContact OE2-CZ 3.41Å; E135-R137 IonicContact OE2-NE 2.79Å; E135-R137 PolarHBondContact OE2-NE 3.17Å; E135-R137 IonicContact OE2-NH2 2.64Å; E135-R137 PolarHBondContact OE2-NH2 3.17Å; E135-F146 WeakPolarHBondContact O-CA 3.49Å; E135-T147 PolarHBondContact N-O 3.48Å; E135-T147 PolarHBondContact O-N 2.92Å
136	E	84.7	Confident	80.6	Confident	116 Å²	116	50 Å²	50	54%	0.542	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	124.8	167.5	-174	176.7	172.5	0	0	109.7	A144 F146	E136-A144 HydrophobicContact CG-CB 3.83Å; E136-A144 VanDerWaalsContact OE1-CB 3.31Å; E136-A144 WeakPolarHBondContact OE1-CB 3.44Å; E136-F146 HydrophobicContact CB-CD1 4.06Å; E136-F146 HydrophobicContact CB-CE1 3.7Å; E136-F146 HydrophobicContact CB-CZ 4.5Å; E136-F146 HydrophobicContact CG-CD1 4.23Å; E136-F146 HydrophobicContact CG-CE1 3.57Å; E136-F146 HydrophobicContact CG-CZ 3.88Å
137	R	80.1	Confident	80.4	Confident	130 Å²	130	50.1 Å²	50.1	49%	0.491	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	97.6	178.5	-66.1	179.2	-175.9	-169	1.5	108.4	E135 V139 T145 T147	E135-R137 IonicContact OE2-CZ 3.41Å; E135-R137 IonicContact OE2-NE 2.79Å; E135-R137 PolarHBondContact OE2-NE 3.17Å; E135-R137 IonicContact OE2-NH2 2.64Å; E135-R137 PolarHBondContact OE2-NH2 3.17Å; R137-V139 PolarHBondContact O-N 3.33Å; R137-T145 WeakPolarHBondContact CB-OG1 3.5Å; R137-T145 PolarHBondContact N-O 2.93Å; R137-T145 PolarHBondContact O-N 2.9Å; R137-T145 PolarHBondContact O-OG1 3.47Å; R137-T145 VanDerWaalsContact O-OG1 3.04Å; R137-T147 PolarHBondContact NE-OG1 2.95Å
138	P	72.2	Confident	80.2	Confident	106 Å²	106	50.6 Å²	50.6	69%	0.688	29%	0.293	S	S	*	.			trans	-71.1	129	-176.9	28	-34.1	0	0	0	110.9
139	V	72.1	Confident	80.1	Confident	66 Å²	66	51 Å²	51	40%	0.4	30%	0.299	S	S	.	.			trans	-99.6	122.5	177.8	-178.6	0	0	0	0	108.5	R137 A141 G142 T145	R137-V139 PolarHBondContact O-N 3.33Å; V139-A141 PolarHBondContact O-N 3.43Å; V139-G142 PolarHBondContact O-N 2.92Å; V139-G142 VanDerWaalsContact O-N 3.09Å; V139-T145 HydrophobicContact CG2-CG2 4.03Å
140	P	56.8	Low	80	Confident	140 Å²	140	54.9 Å²	54.9	91%	0.909	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-3.8	-165.4	22.8	-34	0	0	0	116.8
141	A	55.3	Low	79.9	Confident	82 Å²	82	59.1 Å²	59.1	68%	0.678	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.5	2.3	173.4	0	0	0	0	0	114.2	V139 K398	V139-A141 PolarHBondContact O-N 3.43Å; A141-K398 PolarHBondContact O-NZ 3.44Å; A141-K398 VanDerWaalsContact O-NZ 3.11Å
142	G	61.7	Low	79.7	Confident	23 Å²	23	61 Å²	61	24%	0.237	35%	0.346	C	S	.	.	S	Bend	trans	-128.6	179.2	-169.2	0	0	0	0	0	113.4	V139	V139-G142 PolarHBondContact O-N 2.92Å; V139-G142 VanDerWaalsContact O-N 3.09Å
143	P	66.8	Low	79.6	Confident	36 Å²	36	65.4 Å²	65.4	23%	0.234	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-62.9	151	168.3	30.3	-35.2	0	0	0	110.2	T91 A392	T91-P143 HydrophobicContact CG2-CB 4.47Å; T91-P143 HydrophobicContact CG2-CG 4.01Å; P143-A392 HydrophobicContact CB-CB 4.07Å
144	A	75.1	Confident	79.5	Confident	16 Å²	16	66.8 Å²	66.8	13%	0.132	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-61.7	139.6	171.5	0	0	0	0	0	110.6	E136 F146	E136-A144 HydrophobicContact CG-CB 3.83Å; E136-A144 VanDerWaalsContact OE1-CB 3.31Å; E136-A144 WeakPolarHBondContact OE1-CB 3.44Å; A144-F146 HydrophobicContact CB-CE2 4.1Å; A144-F146 HydrophobicContact CB-CZ 4.18Å
145	T	80.1	Confident	79.5	Confident	61 Å²	61	70.2 Å²	70.2	37%	0.374	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	142.7	173.7	53.7	0	0	0	0	109.4	R137 V139	R137-T145 WeakPolarHBondContact CB-OG1 3.5Å; R137-T145 PolarHBondContact N-O 2.93Å; R137-T145 PolarHBondContact O-N 2.9Å; R137-T145 PolarHBondContact O-OG1 3.47Å; R137-T145 VanDerWaalsContact O-OG1 3.04Å; V139-T145 HydrophobicContact CG2-CG2 4.03Å
146	F	82.2	Confident	79.4	Confident	20 Å²	20	68.4 Å²	68.4	9%	0.088	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	136.7	-177.3	-66.9	-86.3	0	0	0	110	V93 A95 E135 E136 A144 I390 A392	V93-F146 HydrophobicContact CB-CD2 4.47Å; V93-F146 HydrophobicContact CG1-CD2 4.23Å; A95-F146 HydrophobicContact CB-CB 4.39Å; E135-F146 WeakPolarHBondContact O-CA 3.49Å; E136-F146 HydrophobicContact CB-CD1 4.06Å; E136-F146 HydrophobicContact CB-CE1 3.7Å; E136-F146 HydrophobicContact CB-CZ 4.5Å; E136-F146 HydrophobicContact CG-CD1 4.23Å; E136-F146 HydrophobicContact CG-CE1 3.57Å; E136-F146 HydrophobicContact CG-CZ 3.88Å; A144-F146 HydrophobicContact CB-CE2 4.1Å; A144-F146 HydrophobicContact CB-CZ 4.18Å; F146-I390 HydrophobicContact CB-CD1 3.97Å; F146-I390 HydrophobicContact CD1-CD1 3.79Å; F146-I390 HydrophobicContact CD2-CB 4.13Å; F146-I390 HydrophobicContact CD2-CD1 4Å; F146-I390 HydrophobicContact CD2-CG2 4.05Å; F146-I390 HydrophobicContact CE1-CD1 4.29Å; F146-I390 HydrophobicContact CE2-CB 4.34Å; F146-I390 HydrophobicContact CE2-CD1 4.5Å; F146-I390 HydrophobicContact CE2-CG2 3.75Å; F146-I390 HydrophobicContact CG-CD1 3.63Å; F146-I390 HydrophobicContact CZ-CG2 4.13Å; F146-A392 HydrophobicContact CE2-CB 4.1Å
147	T	81.8	Confident	79.2	Confident	51 Å²	51	65.5 Å²	65.5	31%	0.313	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	115.3	173.5	50	0	0	0	0	109.7	E135 R137	E135-T147 PolarHBondContact N-O 3.48Å; E135-T147 PolarHBondContact O-N 2.92Å; R137-T147 PolarHBondContact NE-OG1 2.95Å
148	A	87.1	Confident	79.3	Confident	11 Å²	11	61.5 Å²	61.5	9%	0.091	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	130.8	175.8	0	0	0	0	0	111.6	A95 V96 F132 L134	A95-A148 WeakPolarHBondContact O-CB 3.48Å; A95-A148 PolarHBondContact O-N 3.21Å; V96-A148 HydrophobicContact CG2-CB 3.67Å; F132-A148 HydrophobicContact CB-CB 4.16Å; F132-A148 HydrophobicContact CD1-CB 4.22Å; F132-A148 HydrophobicContact CG-CB 4.46Å; L134-A148 HydrophobicContact CD2-CB 3.87Å
149	T	88.8	Confident	79.8	Confident	53 Å²	53	66.7 Å²	66.7	33%	0.325	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	123	172.9	57.7	0	0	0	0	109.8	F132 L133 Q151	F132-T149 CarbonylContact C-O 3.6Å; F132-T149 VanDerWaalsContact CA-O 3.24Å; F132-T149 WeakPolarHBondContact CA-O 3.49Å; L133-T149 PolarHBondContact N-O 3.42Å; L133-T149 PolarHBondContact O-N 2.95Å; L133-T149 PolarHBondContact O-OG1 3.47Å; L133-T149 VanDerWaalsContact O-OG1 3.12Å; T149-Q151 PolarHBondContact O-N 3.42Å; T149-Q151 PolarHBondContact OG1-NE2 3.3Å; T149-Q151 VanDerWaalsContact OG1-NE2 3.12Å
150	K	89.3	Confident	80.6	Confident	83 Å²	83	68 Å²	68	36%	0.361	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	117.7	-179.4	-175.7	167.8	-178	165.8	0	110.1	L100 L101 F132	L100-K150 VanDerWaalsContact O-CD 3.27Å; L100-K150 WeakPolarHBondContact O-CD 3.26Å; L100-K150 PolarHBondContact O-NZ 2.91Å; L101-K150 PolarHBondContact O-NZ 3.48Å; F132-K150 HydrophobicContact CD1-CB 3.81Å; F132-K150 HydrophobicContact CD1-CG 4.36Å; F132-K150 HydrophobicContact CE1-CB 3.7Å; F132-K150 HydrophobicContact CE1-CD 4.17Å; F132-K150 HydrophobicContact CE1-CG 3.99Å
151	Q	89.5	Confident	82.3	Confident	100 Å²	100	63.1 Å²	63.1	47%	0.467	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	-59.4	-179.3	-61.5	-60.6	-41.1	0	0	110.2	H131 L133 T149	H131-Q151 WeakPolarHBondContact ND1-CB 3.45Å; H131-Q151 PolarHBondContact O-N 2.84Å; L133-Q151 HydrophobicContact CB-CG 3.89Å; T149-Q151 PolarHBondContact O-N 3.42Å; T149-Q151 PolarHBondContact OG1-NE2 3.3Å; T149-Q151 VanDerWaalsContact OG1-NE2 3.12Å
152	L	90.2	Very high	84.1	Confident	50 Å²	50	59.2 Å²	59.2	26%	0.262	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	177.1	175.6	65.1	133.8	0	0	0	112.5	H131 L188 N189 L190	H131-L152 HydrophobicContact CB-CG 4.33Å; H131-L152 PolarHBondContact N-O 3.04Å; H131-L152 WeakPolarHBondContact ND1-CD2 3.33Å; H131-L152 PolarHBondContact O-N 3.34Å; L152-L188 WeakPolarHBondContact CD2-O 3.47Å; L152-N189 WeakPolarHBondContact CD1-O 3.36Å; L152-L190 HydrophobicContact CD1-CB 3.86Å; L152-L190 HydrophobicContact CD1-CD1 3.87Å; L152-L190 HydrophobicContact CD1-CG 3.82Å; L152-L190 HydrophobicContact CG-CD1 4.3Å
153	H	89.7	Confident	85.5	Confident	92 Å²	92	61.3 Å²	61.3	43%	0.426	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	148.5	171.6	64.5	-50.2	0	0	0	109.8	F128 V129 Y130	F128-H153 AromaticContact CD1-CD2 3.7Å; F128-H153 AromaticContact CE1-CD2 3.76Å; V129-H153 CarbonylContact O-C 3.44Å; V129-H153 VanDerWaalsContact O-CA 3.23Å; V129-H153 WeakPolarHBondContact O-CA 3.19Å; Y130-H153 HydrophobicContact CD1-CB 3.42Å; Y130-H153 VanDerWaalsContact CD1-CB 3.42Å; Y130-H153 AromaticContact CD1-CG 3.99Å; Y130-H153 HydrophobicContact CE1-CB 3.77Å; Y130-H153 AromaticContact CE1-CD2 3.63Å; Y130-H153 AromaticContact CE1-CG 3.88Å; Y130-H153 HydrophobicContact CG-CB 3.92Å
154	R	90	Very high	86.8	Confident	82 Å²	82	61.3 Å²	61.3	31%	0.309	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	140.8	173.6	-174.6	177.6	-81.8	114.3	-10.6	111.7	F128 V129 N189 L190 E191	F128-R154 WeakPolarHBondContact CA-O 3.18Å; V129-R154 PolarHBondContact N-O 2.75Å; V129-R154 PolarHBondContact O-N 3.04Å; R154-N189 PolarHBondContact NH1-O 3.24Å; R154-L190 HydrophobicContact CB-CB 4.29Å; R154-L190 PolarHBondContact NH1-O 3.07Å; R154-E191 IonicContact CZ-OE1 3.82Å; R154-E191 IonicContact NH2-OE1 2.99Å; R154-E191 PolarHBondContact NH2-OE1 2.85Å
155	H	89.2	Confident	87.7	Confident	82 Å²	82	60.6 Å²	60.6	38%	0.38	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	127.4	168.1	178.2	-94.7	0	0	0	110.9	D126 C127 F128 G157 F158	D126-H155 PolarHBondContact O-CD2 3.34Å; D126-H155 VanDerWaalsContact O-CD2 3.28Å; C127-H155 WeakPolarHBondContact O-CA 3.29Å; F128-H155 HydrophobicContact CD1-CB 3.99Å; F128-H155 HydrophobicContact CD2-CB 4.14Å; F128-H155 AromaticContact CD2-CD2 3.94Å; F128-H155 HydrophobicContact CE1-CB 3.76Å; F128-H155 HydrophobicContact CE2-CB 3.91Å; F128-H155 AromaticContact CE2-CD2 3.78Å; F128-H155 HydrophobicContact CG-CB 4.19Å; F128-H155 HydrophobicContact CZ-CB 3.72Å; H155-G157 VanDerWaalsContact C-N 3.33Å; H155-G157 VanDerWaalsContact CE1-CA 3.48Å; H155-G157 WeakPolarHBondContact CE1-CA 3.26Å; H155-G157 PolarHBondContact CE1-N 3.05Å; H155-G157 PolarHBondContact ND1-N 3.21Å; H155-G157 VanDerWaalsContact ND1-N 3.18Å; H155-G157 PolarHBondContact O-N 3.22Å; H155-F158 PolarHBondContact NE2-O 3.37Å
156	L	84.7	Confident	88.4	Confident	36 Å²	36	60 Å²	60	19%	0.188	30%	0.3	C	S	.	.			trans	-84.2	-1.7	-171.8	-60.9	-179.3	0	0	0	115	C127 V129 F158 V162 V176 V185	C127-L156 PolarHBondContact O-N 3.04Å; V129-L156 HydrophobicContact CG2-CD1 3.75Å; V129-L156 HydrophobicContact CG2-CG 4.29Å; L156-F158 HydrophobicContact CB-CD2 4.34Å; L156-V162 HydrophobicContact CD1-CG2 4.4Å; L156-V176 HydrophobicContact CD1-CB 4.14Å; L156-V176 HydrophobicContact CD1-CG1 3.44Å; L156-V176 VanDerWaalsContact CD1-CG1 3.44Å; L156-V176 HydrophobicContact CD1-CG2 4.38Å; L156-V185 HydrophobicContact CD2-CG2 4.33Å
157	G	80.6	Confident	88.8	Confident	56 Å²	56	59.6 Å²	59.6	58%	0.577	30%	0.3	S	S	*	.	S	Bend	trans	94.9	-0	171.3	0	0	0	0	0	115.7	H155	H155-G157 VanDerWaalsContact C-N 3.33Å; H155-G157 VanDerWaalsContact CE1-CA 3.48Å; H155-G157 WeakPolarHBondContact CE1-CA 3.26Å; H155-G157 PolarHBondContact CE1-N 3.05Å; H155-G157 PolarHBondContact ND1-N 3.21Å; H155-G157 VanDerWaalsContact ND1-N 3.18Å; H155-G157 PolarHBondContact O-N 3.22Å
158	F	81.6	Confident	89.3	Confident	45 Å²	45	57.3 Å²	57.3	20%	0.197	29%	0.286	C	S	.	.			trans	-96	173.3	173.9	-50.7	-72.3	0	0	0	111.6	C127 H155 L156 C178 D179 R198	C127-F158 WeakPolarHBondContact CB-O 3.42Å; H155-F158 PolarHBondContact NE2-O 3.37Å; L156-F158 HydrophobicContact CB-CD2 4.34Å; F158-C178 HydrophobicContact CD2-CB 3.99Å; F158-D179 HydrophobicContact CD1-CB 4.44Å; F158-R198 VanDerWaalsContact CE1-NH2 3.32Å; F158-R198 VanDerWaalsContact CZ-CZ 3.45Å; F158-R198 VanDerWaalsContact CZ-NH1 3.3Å; F158-R198 VanDerWaalsContact CZ-NH2 3.33Å
159	K	82.9	Confident	89.3	Confident	215 Å²	215	60.2 Å²	60.2	94%	0.935	31%	0.306	S	S	*	.	S	Bend	trans	-111.1	27.7	175.8	-61.3	-172.9	178.8	-176	0	112.2
160	K	90.3	Very high	89.2	Confident	93 Å²	93	61.1 Å²	61.1	40%	0.404	32%	0.318	S	S	.	.	S	Bend	trans	-132.3	156.2	-173.7	-79.9	-172.3	-179.8	177.1	0	110	C127 C178 D179	C127-K160 VanDerWaalsContact CB-O 3.3Å; C127-K160 WeakPolarHBondContact CB-O 3.39Å; C127-K160 PolarHBondContact SG-O 3.23Å; K160-C178 PolarHBondContact O-SG 3.35Å; K160-D179 HydrophobicContact CD-CB 4Å; K160-D179 WeakPolarHBondContact CD-OD1 3.17Å; K160-D179 WeakPolarHBondContact CE-OD1 3.41Å; K160-D179 IonicContact NZ-OD1 2.67Å; K160-D179 PolarHBondContact NZ-OD1 2.92Å
161	P	91.2	Very high	89.1	Confident	38 Å²	38	57.7 Å²	57.7	25%	0.247	30%	0.304	C	S	.	.			trans	-53.3	152.6	174.7	23.2	-36.3	0	0	0	112.4	E111 N163 C178	E111-P161 HydrophobicContact CG-CB 3.88Å; P161-N163 PolarHBondContact O-N 2.86Å; P161-C178 PolarHBondContact O-SG 3.04Å
162	V	93.6	Very high	89.1	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	106.8	159.4	-173.3	0	0	0	0	107.1	E111 C112 T124 V129 L156 L165 V176	E111-V162 VanDerWaalsContact CB-O 3.3Å; E111-V162 WeakPolarHBondContact CB-O 3.41Å; C112-V162 PolarHBondContact SG-O 3.15Å; T124-V162 PolarHBondContact O-N 3.45Å; V129-V162 HydrophobicContact CG2-CG1 4.25Å; V129-V162 HydrophobicContact CG2-CG2 4.14Å; L156-V162 HydrophobicContact CD1-CG2 4.4Å; V162-L165 HydrophobicContact CG1-CD2 3.86Å; V162-L165 HydrophobicContact CG1-CG 4.05Å; V162-V176 HydrophobicContact CG1-CG1 3.49Å; V162-V176 VanDerWaalsContact CG1-CG1 3.49Å
163	N	92.1	Very high	89.2	Confident	67 Å²	67	54.3 Å²	54.3	36%	0.358	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-42.6	-171.2	-71.5	110	0	0	0	112.7	C112 P161 L177	C112-N163 WeakPolarHBondContact CB-O 3.26Å; P161-N163 PolarHBondContact O-N 2.86Å; N163-L177 HydrophobicContact CB-CD2 4.03Å; N163-L177 HydrophobicContact CB-CG 4.17Å; N163-L177 PolarHBondContact N-O 2.85Å
164	E	93.6	Very high	89.3	Confident	36 Å²	36	50 Å²	50	17%	0.168	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	148.4	179.6	-65.4	177.8	168.9	0	0	110.7	L177 T204 F205	E164-L177 HydrophobicContact CB-CB 3.95Å; E164-L177 HydrophobicContact CB-CD2 4.03Å; E164-L177 HydrophobicContact CG-CD2 3.97Å; E164-L177 PolarHBondContact O-N 2.94Å; E164-T204 WeakPolarHBondContact OE1-CB 3.23Å; E164-T204 PolarHBondContact OE1-OG1 3.11Å; E164-T204 VanDerWaalsContact OE2-CA 3.28Å; E164-T204 WeakPolarHBondContact OE2-CA 3.36Å; E164-T204 PolarHBondContact OE2-OG1 3.39Å; E164-F205 HydrophobicContact CB-CD1 4.32Å; E164-F205 HydrophobicContact CB-CE1 3.8Å; E164-F205 WeakPolarHBondContact OE2-CD1 3.42Å; E164-F205 PolarHBondContact OE2-N 2.92Å
165	L	94.6	Very high	89.5	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	141.9	173.4	-69.4	174.4	0	0	0	108.3	E114 V129 V162 L174 L175 V176	E114-L165 HydrophobicContact CB-CB 3.63Å; E114-L165 HydrophobicContact CG-CB 4.38Å; V129-L165 HydrophobicContact CG1-CD1 4.46Å; V129-L165 HydrophobicContact CG2-CD2 4.08Å; V162-L165 HydrophobicContact CG1-CD2 3.86Å; V162-L165 HydrophobicContact CG1-CG 4.05Å; L165-L174 HydrophobicContact CD2-CD2 3.96Å; L165-L174 HydrophobicContact CD2-CG 4.16Å; L165-L175 WeakPolarHBondContact CA-O 3.47Å; L165-V176 HydrophobicContact CD2-CB 4.02Å; L165-V176 HydrophobicContact CD2-CG1 3.63Å; L165-V176 HydrophobicContact CD2-CG2 3.61Å
166	R	93	Very high	89.8	Confident	50 Å²	50	42.2 Å²	42.2	19%	0.189	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	134.2	169.1	-61.7	-66.9	163	-134.9	5.4	111.6	E114 L175 F205 L207	E114-R166 VanDerWaalsContact CD-CA 3.46Å; E114-R166 WeakPolarHBondContact OE1-CA 3.36Å; E114-R166 IonicContact OE2-CZ 2.71Å; E114-R166 IonicContact OE2-NH1 2.63Å; E114-R166 PolarHBondContact OE2-NH1 2.98Å; R166-L175 HydrophobicContact CB-CB 4.4Å; R166-L175 PolarHBondContact N-O 3.01Å; R166-L175 PolarHBondContact O-N 3.35Å; R166-F205 HydrophobicContact CB-CE2 3.54Å; R166-F205 HydrophobicContact CB-CZ 3.73Å; R166-F205 HydrophobicContact CG-CD2 4.02Å; R166-F205 HydrophobicContact CG-CE1 4.21Å; R166-F205 HydrophobicContact CG-CE2 3.33Å; R166-F205 HydrophobicContact CG-CZ 3.43Å; R166-F205 VanDerWaalsContact CG-CZ 3.43Å; R166-L207 HydrophobicContact CB-CD1 4.09Å; R166-L207 HydrophobicContact CB-CD2 4.13Å; R166-L207 HydrophobicContact CB-CG 4.08Å; R166-L207 HydrophobicContact CG-CG 4.36Å
167	A	92.3	Very high	90.2	Very high	11 Å²	11	40.7 Å²	40.7	9%	0.091	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	108.4	-179	0	0	0	0	0	111.6	E114 C116 S169 L174 M187	E114-A167 HydrophobicContact CG-CB 3.95Å; E114-A167 PolarHBondContact OE1-N 3.49Å; C116-A167 HydrophobicContact CB-CB 3.76Å; A167-S169 VanDerWaalsContact C-N 3.3Å; A167-S169 PolarHBondContact O-N 3.18Å; A167-L174 HydrophobicContact CB-CD1 4.47Å; A167-M187 HydrophobicContact CB-CE 4Å; A167-M187 HydrophobicContact CB-SD 4.43Å
168	A	90.9	Very high	90.8	Very high	2 Å²	2	38 Å²	38	2%	0.017	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	73.7	166.1	0	0	0	0	0	109.4	A170 L171 N172 R173 L175 V219	A168-A170 VanDerWaalsContact C-N 3.31Å; A168-A170 PolarHBondContact O-N 3.16Å; A168-L171 HydrophobicContact CB-CB 4.36Å; A168-L171 HydrophobicContact CB-CD1 4.07Å; A168-L171 HydrophobicContact CB-CG 4.33Å; A168-L171 PolarHBondContact O-N 2.9Å; A168-N172 PolarHBondContact O-N 3.45Å; A168-R173 CarbonylContact C-O 3.48Å; A168-R173 WeakPolarHBondContact CA-O 3.36Å; A168-R173 HydrophobicContact CB-CB 4.5Å; A168-R173 WeakPolarHBondContact CB-O 3.5Å; A168-R173 PolarHBondContact N-O 2.95Å; A168-R173 PolarHBondContact O-N 2.91Å; A168-L175 HydrophobicContact CB-CD1 3.59Å; A168-V219 HydrophobicContact CB-CB 4.49Å; A168-V219 HydrophobicContact CB-CG2 4Å
169	S	87.6	Confident	91.1	Very high	73 Å²	73	39.1 Å²	39.1	51%	0.51	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-55.1	-41.3	-174.3	59.9	0	0	0	0	113.6	C116 A167 L171 N172	C116-S169 WeakPolarHBondContact SG-CB 3.24Å; A167-S169 VanDerWaalsContact C-N 3.3Å; A167-S169 PolarHBondContact O-N 3.18Å; S169-L171 PolarHBondContact O-N 3.33Å; S169-L171 VanDerWaalsContact O-N 3.1Å; S169-N172 PolarHBondContact O-N 3.45Å
170	A	85.7	Confident	91.5	Very high	72 Å²	72	32.2 Å²	32.2	60%	0.595	18%	0.181	S	C	*	.	G	3₁₀ helix	trans	-59.2	-19.9	175.6	0	0	0	0	0	114.3	A168	A168-A170 VanDerWaalsContact C-N 3.31Å; A168-A170 PolarHBondContact O-N 3.16Å
171	L	88.1	Confident	91.5	Very high	11 Å²	11	28 Å²	28	6%	0.058	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-107.7	-2.7	178.6	-51.6	178.6	0	0	0	112.7	A168 S169 R173 F217 V219 V236	A168-L171 HydrophobicContact CB-CB 4.36Å; A168-L171 HydrophobicContact CB-CD1 4.07Å; A168-L171 HydrophobicContact CB-CG 4.33Å; A168-L171 PolarHBondContact O-N 2.9Å; S169-L171 PolarHBondContact O-N 3.33Å; S169-L171 VanDerWaalsContact O-N 3.1Å; L171-R173 HydrophobicContact CB-CB 4.17Å; L171-R173 HydrophobicContact CB-CG 3.98Å; L171-R173 WeakPolarHBondContact O-CG 3.39Å; L171-R173 PolarHBondContact O-N 3.37Å; L171-R173 PolarHBondContact O-NH1 3.28Å; L171-F217 WeakPolarHBondContact CD2-O 3.42Å; L171-V219 HydrophobicContact CD1-CB 4.34Å; L171-V219 HydrophobicContact CD1-CG2 3.96Å; L171-V219 HydrophobicContact CG-CG2 4.07Å; L171-V236 HydrophobicContact CD1-CB 4.48Å; L171-V236 HydrophobicContact CD1-CG1 3.97Å; L171-V236 WeakPolarHBondContact CD1-O 3.33Å
172	N	89.6	Confident	91.6	Very high	56 Å²	56	26.4 Å²	26.4	30%	0.299	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	35	-167.2	-163.5	18.1	0	0	0	112.4	A168 S169 M187 L188	A168-N172 PolarHBondContact O-N 3.45Å; S169-N172 PolarHBondContact O-N 3.45Å; N172-M187 PolarHBondContact O-N 2.9Å; N172-M187 VanDerWaalsContact O-N 3.1Å; N172-M187 WeakPolarHBondContact OD1-CB 3.3Å; N172-L188 WeakPolarHBondContact ND2-CD1 3.38Å
173	R	91.9	Very high	91.5	Very high	23 Å²	23	27.3 Å²	27.3	9%	0.087	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	136.5	-177.3	-64	-50.6	-176.3	-93.8	12.4	112.6	A168 L171 L184 V185 M187 E238	A168-R173 CarbonylContact C-O 3.48Å; A168-R173 WeakPolarHBondContact CA-O 3.36Å; A168-R173 HydrophobicContact CB-CB 4.5Å; A168-R173 WeakPolarHBondContact CB-O 3.5Å; A168-R173 PolarHBondContact N-O 2.95Å; A168-R173 PolarHBondContact O-N 2.91Å; L171-R173 HydrophobicContact CB-CB 4.17Å; L171-R173 HydrophobicContact CB-CG 3.98Å; L171-R173 WeakPolarHBondContact O-CG 3.39Å; L171-R173 PolarHBondContact O-N 3.37Å; L171-R173 PolarHBondContact O-NH1 3.28Å; R173-L184 HydrophobicContact CB-CD2 4.27Å; R173-V185 CarbonylContact C-O 3.42Å; R173-V185 VanDerWaalsContact CA-O 3.29Å; R173-V185 WeakPolarHBondContact CA-O 3.34Å; R173-M187 VanDerWaalsContact C-CG 3.48Å; R173-E238 IonicContact CZ-OE1 3.72Å; R173-E238 PolarHBondContact NE-O 3.29Å; R173-E238 IonicContact NH1-OE1 2.7Å; R173-E238 PolarHBondContact NH1-OE1 3.05Å; R173-E238 IonicContact NH2-OE1 3.25Å; R173-E238 PolarHBondContact NH2-OE1 3.11Å
174	L	93	Very high	91.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	122.4	167.2	-168.4	68.3	0	0	0	107.7	E114 Y121 V129 L165 A167 V176 V185 M187 L190	E114-L174 HydrophobicContact CG-CD1 4.31Å; Y121-L174 HydrophobicContact CD1-CD1 4.45Å; Y121-L174 HydrophobicContact CD1-CD2 3.73Å; Y121-L174 HydrophobicContact CD2-CD1 4.09Å; Y121-L174 HydrophobicContact CE1-CD2 4.34Å; Y121-L174 HydrophobicContact CG-CD1 4.01Å; Y121-L174 HydrophobicContact CG-CD2 3.97Å; V129-L174 HydrophobicContact CG1-CD2 4.01Å; L165-L174 HydrophobicContact CD2-CD2 3.96Å; L165-L174 HydrophobicContact CD2-CG 4.16Å; A167-L174 HydrophobicContact CB-CD1 4.47Å; L174-V176 HydrophobicContact CD2-CG2 4.12Å; L174-V176 HydrophobicContact CG-CG2 4.04Å; L174-V185 HydrophobicContact CB-CB 4.41Å; L174-V185 PolarHBondContact N-O 2.9Å; L174-V185 PolarHBondContact O-N 2.81Å; L174-M187 HydrophobicContact CB-CG 3.97Å; L174-L190 HydrophobicContact CD2-CD2 3.97Å
175	L	93.8	Very high	91.3	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	123.9	171.5	-77.8	69.1	0	0	0	107.4	L165 R166 A168 I182 L184 F205 L207 V221 V236	L165-L175 WeakPolarHBondContact CA-O 3.47Å; R166-L175 HydrophobicContact CB-CB 4.4Å; R166-L175 PolarHBondContact N-O 3.01Å; R166-L175 PolarHBondContact O-N 3.35Å; A168-L175 HydrophobicContact CB-CD1 3.59Å; L175-I182 HydrophobicContact CB-CG2 3.95Å; L175-I182 HydrophobicContact CD2-CG2 4.34Å; L175-I182 HydrophobicContact CG-CG2 4.24Å; L175-L184 HydrophobicContact CD1-CD2 3.68Å; L175-L184 HydrophobicContact CG-CD2 3.74Å; L175-F205 HydrophobicContact CB-CE2 3.52Å; L175-F205 HydrophobicContact CB-CZ 3.61Å; L175-F205 HydrophobicContact CD2-CD2 4.21Å; L175-F205 HydrophobicContact CD2-CE2 3.61Å; L175-F205 HydrophobicContact CG-CE2 4.21Å; L175-L207 HydrophobicContact CD2-CD2 4.28Å; L175-V221 HydrophobicContact CD2-CG1 4.24Å; L175-V221 HydrophobicContact CD2-CG2 3.97Å; L175-V236 HydrophobicContact CD2-CG2 4.38Å
176	V	94.1	Very high	91.2	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	117.2	-175.7	-170.1	0	0	0	0	111.3	V129 L156 V162 L165 L174 I182 S183 V185	V129-V176 HydrophobicContact CG2-CG1 4.41Å; L156-V176 HydrophobicContact CD1-CB 4.14Å; L156-V176 HydrophobicContact CD1-CG1 3.44Å; L156-V176 VanDerWaalsContact CD1-CG1 3.44Å; L156-V176 HydrophobicContact CD1-CG2 4.38Å; V162-V176 HydrophobicContact CG1-CG1 3.49Å; V162-V176 VanDerWaalsContact CG1-CG1 3.49Å; L165-V176 HydrophobicContact CD2-CB 4.02Å; L165-V176 HydrophobicContact CD2-CG1 3.63Å; L165-V176 HydrophobicContact CD2-CG2 3.61Å; L174-V176 HydrophobicContact CD2-CG2 4.12Å; L174-V176 HydrophobicContact CG-CG2 4.04Å; V176-I182 CarbonylContact O-C 3.54Å; V176-I182 WeakPolarHBondContact O-CA 3.28Å; V176-S183 PolarHBondContact N-O 3.4Å; V176-S183 PolarHBondContact O-N 3.32Å; V176-V185 HydrophobicContact CG2-CB 4.14Å; V176-V185 HydrophobicContact CG2-CG2 3.77Å
177	L	94.2	Very high	91	Very high	3 Å²	3	22.5 Å²	22.5	2%	0.016	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	114.4	173.8	179.1	66.8	0	0	0	110.2	N163 E164 I182 A202 A203 F205	N163-L177 HydrophobicContact CB-CD2 4.03Å; N163-L177 HydrophobicContact CB-CG 4.17Å; N163-L177 PolarHBondContact N-O 2.85Å; E164-L177 HydrophobicContact CB-CB 3.95Å; E164-L177 HydrophobicContact CB-CD2 4.03Å; E164-L177 HydrophobicContact CG-CD2 3.97Å; E164-L177 PolarHBondContact O-N 2.94Å; L177-I182 HydrophobicContact CB-CG1 4.2Å; L177-I182 HydrophobicContact CD1-CG1 3.78Å; L177-A202 HydrophobicContact CD1-CB 3.9Å; L177-A203 WeakPolarHBondContact CD2-O 3.27Å; L177-F205 HydrophobicContact CB-CD1 4.28Å; L177-F205 HydrophobicContact CB-CE1 3.86Å
178	C	92.2	Very high	90.8	Very high	1 Å²	1	27 Å²	27	1%	0.007	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	140.9	170.6	-172.3	0	0	0	0	110	C127 F158 K160 P161 N180 S181	C127-C178 VanDerWaalsContact SG-SG 3.66Å; F158-C178 HydrophobicContact CD2-CB 3.99Å; K160-C178 PolarHBondContact O-SG 3.35Å; P161-C178 PolarHBondContact O-SG 3.04Å; C178-N180 PolarHBondContact O-N 3.41Å; C178-S181 PolarHBondContact N-O 3.14Å; C178-S181 PolarHBondContact O-N 2.85Å
179	D	89.5	Confident	90.7	Very high	67 Å²	67	29.6 Å²	29.6	36%	0.358	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	51.1	-176.8	-166.2	27.6	0	0	0	112.9	F158 K160 S181	F158-D179 HydrophobicContact CD1-CB 4.44Å; K160-D179 HydrophobicContact CD-CB 4Å; K160-D179 WeakPolarHBondContact CD-OD1 3.17Å; K160-D179 WeakPolarHBondContact CE-OD1 3.41Å; K160-D179 IonicContact NZ-OD1 2.67Å; K160-D179 PolarHBondContact NZ-OD1 2.92Å; D179-S181 PolarHBondContact O-N 3.45Å; D179-S181 VanDerWaalsContact O-N 3.17Å
180	N	90.6	Very high	90.8	Very high	71 Å²	71	26.2 Å²	26.2	38%	0.38	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	34.4	-179.8	-59.3	10.4	0	0	0	113.5	C178 G201 A202 V226	C178-N180 PolarHBondContact O-N 3.41Å; N180-G201 CarbonylContact O-C 3.59Å; N180-G201 WeakPolarHBondContact O-CA 3.34Å; N180-G201 PolarHBondContact O-N 2.88Å; N180-A202 CarbonylContact C-O 3.56Å; N180-A202 VanDerWaalsContact CA-O 3.23Å; N180-A202 WeakPolarHBondContact CA-O 3.48Å; N180-A202 WeakPolarHBondContact CB-O 3.19Å; N180-A202 PolarHBondContact O-N 3.12Å; N180-V226 HydrophobicContact CB-CG2 4.21Å
181	S	91.2	Very high	90.9	Very high	4 Å²	4	27.1 Å²	27.1	3%	0.028	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	131.2	-173.7	-174.5	0	0	0	0	112	C178 D179 R198 I199	C178-S181 PolarHBondContact N-O 3.14Å; C178-S181 PolarHBondContact O-N 2.85Å; D179-S181 PolarHBondContact O-N 3.45Å; D179-S181 VanDerWaalsContact O-N 3.17Å; S181-R198 VanDerWaalsContact OG-CG 3.25Å; S181-R198 WeakPolarHBondContact OG-CG 3.28Å; S181-R198 PolarHBondContact OG-NE 2.89Å; S181-I199 CarbonylContact C-O 3.36Å; S181-I199 WeakPolarHBondContact CA-O 3.28Å; S181-I199 WeakPolarHBondContact CB-O 3.28Å; S181-I199 PolarHBondContact OG-O 3.42Å
182	I	92.7	Very high	90.8	Very high	5 Å²	5	30.4 Å²	30.4	3%	0.026	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	123.8	-180	-60.9	164.1	0	0	0	108.7	L175 V176 L177 R198 I199 A202 F205 I223	L175-I182 HydrophobicContact CB-CG2 3.95Å; L175-I182 HydrophobicContact CD2-CG2 4.34Å; L175-I182 HydrophobicContact CG-CG2 4.24Å; V176-I182 CarbonylContact O-C 3.54Å; V176-I182 WeakPolarHBondContact O-CA 3.28Å; L177-I182 HydrophobicContact CB-CG1 4.2Å; L177-I182 HydrophobicContact CD1-CG1 3.78Å; I182-R198 CarbonylContact O-C 3.52Å; I182-R198 WeakPolarHBondContact O-CA 3.45Å; I182-R198 WeakPolarHBondContact O-CG 3.48Å; I182-I199 HydrophobicContact CB-CB 4.46Å; I182-I199 PolarHBondContact N-O 2.81Å; I182-I199 PolarHBondContact O-N 3.06Å; I182-A202 HydrophobicContact CD1-CB 3.84Å; I182-A202 HydrophobicContact CG1-CB 3.99Å; I182-F205 HydrophobicContact CD1-CB 3.71Å; I182-F205 HydrophobicContact CD1-CD1 3.51Å; I182-F205 HydrophobicContact CD1-CD2 3.94Å; I182-F205 HydrophobicContact CD1-CE1 4.08Å; I182-F205 HydrophobicContact CD1-CE2 4.43Å; I182-F205 HydrophobicContact CD1-CG 3.44Å; I182-F205 VanDerWaalsContact CD1-CG 3.44Å; I182-F205 HydrophobicContact CG1-CD1 3.98Å; I182-F205 HydrophobicContact CG1-CE1 4.14Å; I182-F205 HydrophobicContact CG1-CG 4.37Å; I182-F205 HydrophobicContact CG2-CZ 4.49Å; I182-I223 HydrophobicContact CD1-CD1 3.66Å; I182-I223 HydrophobicContact CD1-CG1 3.91Å
183	S	91.1	Very high	90.6	Very high	19 Å²	19	28.7 Å²	28.7	13%	0.133	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	138.9	176.7	-51.7	0	0	0	0	109.6	V176	V176-S183 PolarHBondContact N-O 3.4Å; V176-S183 PolarHBondContact O-N 3.32Å
184	L	91.1	Very high	89.5	Confident	7 Å²	7	34 Å²	34	4%	0.037	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	131.1	173.2	-67.8	169.2	0	0	0	110.6	R173 L175 P192 V193 A197 V236 V241	R173-L184 HydrophobicContact CB-CD2 4.27Å; L175-L184 HydrophobicContact CD1-CD2 3.68Å; L175-L184 HydrophobicContact CG-CD2 3.74Å; L184-P192 WeakPolarHBondContact O-CA 3.27Å; L184-V193 HydrophobicContact CB-CB 4.2Å; L184-V193 HydrophobicContact CB-CG2 3.65Å; L184-V193 PolarHBondContact O-N 2.66Å; L184-A197 HydrophobicContact CD1-CB 3.96Å; L184-V236 HydrophobicContact CD1-CG1 4.07Å; L184-V236 HydrophobicContact CD2-CG1 3.66Å; L184-V236 HydrophobicContact CG-CG1 4.47Å; L184-V241 HydrophobicContact CD1-CG1 3.99Å
185	V	91.2	Very high	88.3	Confident	3 Å²	3	37.4 Å²	37.4	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	141.8	-179.6	176.1	0	0	0	0	108.4	L156 R173 L174 V176 L190 E191	L156-V185 HydrophobicContact CD2-CG2 4.33Å; R173-V185 CarbonylContact C-O 3.42Å; R173-V185 VanDerWaalsContact CA-O 3.29Å; R173-V185 WeakPolarHBondContact CA-O 3.34Å; L174-V185 HydrophobicContact CB-CB 4.41Å; L174-V185 PolarHBondContact N-O 2.9Å; L174-V185 PolarHBondContact O-N 2.81Å; V176-V185 HydrophobicContact CG2-CB 4.14Å; V176-V185 HydrophobicContact CG2-CG2 3.77Å; V185-L190 HydrophobicContact CG1-CB 4.2Å; V185-L190 HydrophobicContact CG1-CD2 4.09Å; V185-E191 CarbonylContact C-O 3.42Å; V185-E191 WeakPolarHBondContact CA-O 3.48Å
186	N	90.8	Very high	86.9	Confident	34 Å²	34	40.2 Å²	40.2	18%	0.182	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	132.6	174	177.4	-64.4	0	0	0	110.3	L188 N189 L190 E191	N186-L188 PolarHBondContact OD1-N 3.25Å; N186-N189 WeakPolarHBondContact CB-OD1 3.5Å; N186-N189 PolarHBondContact OD1-N 2.92Å; N186-N189 PolarHBondContact OD1-OD1 3.09Å; N186-L190 WeakPolarHBondContact O-CA 3.45Å; N186-L190 PolarHBondContact O-N 3.48Å; N186-E191 PolarHBondContact N-O 2.73Å
187	M	90.5	Very high	85.8	Confident	9 Å²	9	40.9 Å²	40.9	4%	0.044	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-40.6	-174.8	-75.7	172.3	70.3	0	0	113.4	C116 Y121 A167 N172 R173 L174	C116-M187 HydrophobicContact CB-CE 4.09Å; Y121-M187 HydrophobicContact CE2-CE 3.92Å; Y121-M187 WeakPolarHBondContact OH-CB 3.4Å; Y121-M187 PolarHBondContact OH-O 2.87Å; A167-M187 HydrophobicContact CB-CE 4Å; A167-M187 HydrophobicContact CB-SD 4.43Å; N172-M187 PolarHBondContact O-N 2.9Å; N172-M187 VanDerWaalsContact O-N 3.1Å; N172-M187 WeakPolarHBondContact OD1-CB 3.3Å; R173-M187 VanDerWaalsContact C-CG 3.48Å; L174-M187 HydrophobicContact CB-CG 3.97Å
188	L	86.8	Confident	85.3	Confident	106 Å²	106	44.7 Å²	44.7	56%	0.555	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-29.3	-171.6	-61.8	176.2	0	0	0	114.4	L152 N172 N186	L152-L188 WeakPolarHBondContact CD2-O 3.47Å; N172-L188 WeakPolarHBondContact ND2-CD1 3.38Å; N186-L188 PolarHBondContact OD1-N 3.25Å
189	N	88.7	Confident	85.1	Confident	56 Å²	56	45.3 Å²	45.3	30%	0.299	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.6	-0.1	-176.9	81.3	-7.8	0	0	0	114.3	L152 R154 N186 E191	L152-N189 WeakPolarHBondContact CD1-O 3.36Å; R154-N189 PolarHBondContact NH1-O 3.24Å; N186-N189 WeakPolarHBondContact CB-OD1 3.5Å; N186-N189 PolarHBondContact OD1-N 2.92Å; N186-N189 PolarHBondContact OD1-OD1 3.09Å; N189-E191 VanDerWaalsContact C-N 3.27Å; N189-E191 PolarHBondContact ND2-OE2 3.27Å; N189-E191 PolarHBondContact O-N 3.49Å; N189-E191 VanDerWaalsContact OD1-CB 3.3Å; N189-E191 WeakPolarHBondContact OD1-CB 3.43Å; N189-E191 WeakPolarHBondContact OD1-CG 3.39Å; N189-E191 PolarHBondContact OD1-N 3.13Å
190	L	89.8	Confident	85.1	Confident	1 Å²	1	50 Å²	50	1%	0.005	29%	0.286	C	S	.	.			trans	54.3	30.2	-176.5	-62.3	-180	0	0	0	115.4	Y121 V129 H131 L152 R154 L174 V185 N186	Y121-L190 HydrophobicContact CD1-CD2 4.14Å; Y121-L190 HydrophobicContact CE1-CD2 4.16Å; V129-L190 HydrophobicContact CB-CD1 4.24Å; V129-L190 HydrophobicContact CG1-CD1 3.98Å; V129-L190 HydrophobicContact CG1-CD2 3.99Å; V129-L190 WeakPolarHBondContact O-CD1 3.48Å; H131-L190 HydrophobicContact CB-CD1 4.08Å; L152-L190 HydrophobicContact CD1-CB 3.86Å; L152-L190 HydrophobicContact CD1-CD1 3.87Å; L152-L190 HydrophobicContact CD1-CG 3.82Å; L152-L190 HydrophobicContact CG-CD1 4.3Å; R154-L190 HydrophobicContact CB-CB 4.29Å; R154-L190 PolarHBondContact NH1-O 3.07Å; L174-L190 HydrophobicContact CD2-CD2 3.97Å; V185-L190 HydrophobicContact CG1-CB 4.2Å; V185-L190 HydrophobicContact CG1-CD2 4.09Å; N186-L190 WeakPolarHBondContact O-CA 3.45Å; N186-L190 PolarHBondContact O-N 3.48Å
191	E	88.9	Confident	85.1	Confident	92 Å²	92	48.1 Å²	48.1	43%	0.43	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-89	135.5	177	-70.2	178.4	172.3	0	0	112.6	R154 V185 N186 N189	R154-E191 IonicContact CZ-OE1 3.82Å; R154-E191 IonicContact NH2-OE1 2.99Å; R154-E191 PolarHBondContact NH2-OE1 2.85Å; V185-E191 CarbonylContact C-O 3.42Å; V185-E191 WeakPolarHBondContact CA-O 3.48Å; N186-E191 PolarHBondContact N-O 2.73Å; N189-E191 VanDerWaalsContact C-N 3.27Å; N189-E191 PolarHBondContact ND2-OE2 3.27Å; N189-E191 PolarHBondContact O-N 3.49Å; N189-E191 VanDerWaalsContact OD1-CB 3.3Å; N189-E191 WeakPolarHBondContact OD1-CB 3.43Å; N189-E191 WeakPolarHBondContact OD1-CG 3.39Å; N189-E191 PolarHBondContact OD1-N 3.13Å
192	P	85.8	Confident	85.1	Confident	80 Å²	80	48 Å²	48	52%	0.519	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-68	139.8	175.7	29.7	-34.5	0	0	0	110.7	L184 P194	L184-P192 WeakPolarHBondContact O-CA 3.27Å; P192-P194 WeakPolarHBondContact O-CD 3.3Å
193	V	84.2	Confident	85.1	Confident	20 Å²	20	49.9 Å²	49.9	12%	0.121	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-64.8	122.7	-176.1	-179	0	0	0	0	110.7	L184 S195 G196	L184-V193 HydrophobicContact CB-CB 4.2Å; L184-V193 HydrophobicContact CB-CG2 3.65Å; L184-V193 PolarHBondContact O-N 2.66Å; V193-S195 WeakPolarHBondContact CG1-OG 3.01Å; V193-S195 PolarHBondContact O-N 3.1Å; V193-G196 PolarHBondContact O-N 2.95Å
194	P	70	Confident	85.1	Confident	134 Å²	134	50.1 Å²	50.1	87%	0.87	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-18.3	-171.7	-28	36	0	0	0	116.4	P192 G196	P192-P194 WeakPolarHBondContact O-CD 3.3Å; P194-G196 PolarHBondContact O-N 3.37Å
195	S	66.6	Low	85.3	Confident	71 Å²	71	50 Å²	50	50%	0.497	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-12.4	179.3	63.4	0	0	0	0	114.2	V193 A197 D239	V193-S195 WeakPolarHBondContact CG1-OG 3.01Å; V193-S195 PolarHBondContact O-N 3.1Å; S195-A197 VanDerWaalsContact C-N 3.28Å; S195-A197 PolarHBondContact O-N 3.43Å; S195-A197 PolarHBondContact OG-N 3.27Å; S195-D239 VanDerWaalsContact CB-O 3.27Å; S195-D239 WeakPolarHBondContact CB-O 3.45Å; S195-D239 PolarHBondContact OG-O 2.97Å
196	G	64.3	Low	85.4	Confident	60 Å²	60	50.7 Å²	50.7	62%	0.619	30%	0.304	S	S	*	.			trans	73.5	18.3	-176.9	0	0	0	0	0	114	V193 P194 R198	V193-G196 PolarHBondContact O-N 2.95Å; P194-G196 PolarHBondContact O-N 3.37Å; G196-R198 VanDerWaalsContact C-N 3.3Å; G196-R198 PolarHBondContact O-N 3.3Å
197	A	71.2	Confident	85.4	Confident	15 Å²	15	50.9 Å²	50.9	12%	0.124	31%	0.305	C	S	.	.			trans	-62.9	84.7	175	0	0	0	0	0	111.7	L184 S195 V241	L184-A197 HydrophobicContact CD1-CB 3.96Å; S195-A197 VanDerWaalsContact C-N 3.28Å; S195-A197 PolarHBondContact O-N 3.43Å; S195-A197 PolarHBondContact OG-N 3.27Å; A197-V241 HydrophobicContact CB-CG1 4.47Å; A197-V241 HydrophobicContact CB-CG2 4.44Å
198	R	83.5	Confident	85.5	Confident	84 Å²	84	50.8 Å²	50.8	32%	0.317	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	119.3	-173.2	178.5	176	178.7	-171.5	5.6	110.8	F158 S181 I182 G196	F158-R198 VanDerWaalsContact CE1-NH2 3.32Å; F158-R198 VanDerWaalsContact CZ-CZ 3.45Å; F158-R198 VanDerWaalsContact CZ-NH1 3.3Å; F158-R198 VanDerWaalsContact CZ-NH2 3.33Å; S181-R198 VanDerWaalsContact OG-CG 3.25Å; S181-R198 WeakPolarHBondContact OG-CG 3.28Å; S181-R198 PolarHBondContact OG-NE 2.89Å; I182-R198 CarbonylContact O-C 3.52Å; I182-R198 WeakPolarHBondContact O-CA 3.45Å; I182-R198 WeakPolarHBondContact O-CG 3.48Å; G196-R198 VanDerWaalsContact C-N 3.3Å; G196-R198 PolarHBondContact O-N 3.3Å
199	I	89.4	Confident	85.5	Confident	13 Å²	13	51.3 Å²	51.3	7%	0.067	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	131.2	-179	-53.8	171.8	0	0	0	108.7	S181 I182 I223 F234 V241	S181-I199 CarbonylContact C-O 3.36Å; S181-I199 WeakPolarHBondContact CA-O 3.28Å; S181-I199 WeakPolarHBondContact CB-O 3.28Å; S181-I199 PolarHBondContact OG-O 3.42Å; I182-I199 HydrophobicContact CB-CB 4.46Å; I182-I199 PolarHBondContact N-O 2.81Å; I182-I199 PolarHBondContact O-N 3.06Å; I199-I223 HydrophobicContact CB-CD1 4.4Å; I199-I223 HydrophobicContact CD1-CD1 3.49Å; I199-I223 VanDerWaalsContact CD1-CD1 3.49Å; I199-I223 HydrophobicContact CG2-CD1 3.92Å; I199-F234 HydrophobicContact CD1-CB 4.38Å; I199-F234 HydrophobicContact CD1-CD1 3.79Å; I199-F234 HydrophobicContact CD1-CD2 4.24Å; I199-F234 HydrophobicContact CD1-CE1 4.05Å; I199-F234 HydrophobicContact CD1-CE2 4.43Å; I199-F234 HydrophobicContact CD1-CG 3.9Å; I199-F234 HydrophobicContact CD1-CZ 4.36Å; I199-F234 HydrophobicContact CG1-CD1 4.36Å; I199-F234 HydrophobicContact CG1-CE1 4.17Å; I199-F234 HydrophobicContact CG1-CZ 4.48Å; I199-F234 HydrophobicContact CG2-CE1 4.22Å; I199-F234 HydrophobicContact CG2-CE2 3.97Å; I199-F234 HydrophobicContact CG2-CZ 3.69Å; I199-V241 HydrophobicContact CD1-CB 4.26Å; I199-V241 HydrophobicContact CD1-CG1 4.14Å; I199-V241 HydrophobicContact CD1-CG2 4.49Å; I199-V241 HydrophobicContact CG1-CB 4.26Å; I199-V241 HydrophobicContact CG1-CG1 4.29Å; I199-V241 HydrophobicContact CG1-CG2 3.94Å
200	K	89.3	Confident	85.5	Confident	167 Å²	167	50.9 Å²	50.9	73%	0.726	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	141.4	-173.9	-65.7	178.5	-178.9	175.3	0	111.7
201	G	89.3	Confident	85.3	Confident	31 Å²	31	54.2 Å²	54.2	32%	0.32	32%	0.323	S	S	.	.	S	Bend	trans	86.4	22.5	178.1	0	0	0	0	0	114.3	N180 S225 V226	N180-G201 CarbonylContact O-C 3.59Å; N180-G201 WeakPolarHBondContact O-CA 3.34Å; N180-G201 PolarHBondContact O-N 2.88Å; G201-S225 WeakPolarHBondContact O-CA 3.35Å; G201-V226 WeakPolarHBondContact O-CG2 3.35Å; G201-V226 PolarHBondContact O-N 2.96Å
202	A	91.9	Very high	85.2	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	138.3	174.5	0	0	0	0	0	110.8	L177 N180 I182 I223 I224 V226	L177-A202 HydrophobicContact CD1-CB 3.9Å; N180-A202 CarbonylContact C-O 3.56Å; N180-A202 VanDerWaalsContact CA-O 3.23Å; N180-A202 WeakPolarHBondContact CA-O 3.48Å; N180-A202 WeakPolarHBondContact CB-O 3.19Å; N180-A202 PolarHBondContact O-N 3.12Å; I182-A202 HydrophobicContact CD1-CB 3.84Å; I182-A202 HydrophobicContact CG1-CB 3.99Å; A202-I223 HydrophobicContact CB-CG2 3.54Å; A202-I224 WeakPolarHBondContact CA-O 3.29Å; A202-V226 VanDerWaalsContact C-CG2 3.46Å; A202-V226 WeakPolarHBondContact O-CG2 3.23Å
203	A	92	Very high	85	Confident	45 Å²	45	50.7 Å²	50.7	37%	0.372	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-44	175.3	0	0	0	0	0	112	L177 I224 V226	L177-A203 WeakPolarHBondContact CD2-O 3.27Å; A203-I224 HydrophobicContact CB-CB 4.43Å; A203-I224 HydrophobicContact CB-CG2 3.9Å; A203-I224 PolarHBondContact N-O 2.96Å; A203-V226 HydrophobicContact CB-CG2 3.67Å
204	T	92.7	Very high	84.5	Confident	25 Å²	25	53.7 Å²	53.7	15%	0.153	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	158.9	179.2	173.3	0	0	0	0	107.8	E164 I224	E164-T204 WeakPolarHBondContact OE1-CB 3.23Å; E164-T204 PolarHBondContact OE1-OG1 3.11Å; E164-T204 VanDerWaalsContact OE2-CA 3.28Å; E164-T204 WeakPolarHBondContact OE2-CA 3.36Å; E164-T204 PolarHBondContact OE2-OG1 3.39Å; T204-I224 HydrophobicContact CG2-CB 3.89Å; T204-I224 HydrophobicContact CG2-CD1 3.7Å; T204-I224 HydrophobicContact CG2-CG1 4.17Å; T204-I224 HydrophobicContact CG2-CG2 4.44Å; T204-I224 PolarHBondContact O-N 3.33Å; T204-I224 VanDerWaalsContact O-N 3.1Å
205	F	94.3	Very high	85.3	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.018	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	150.6	178.2	73.7	-71.5	0	0	0	115.6	E164 R166 L175 L177 I182 V221 C222 I223	E164-F205 HydrophobicContact CB-CD1 4.32Å; E164-F205 HydrophobicContact CB-CE1 3.8Å; E164-F205 WeakPolarHBondContact OE2-CD1 3.42Å; E164-F205 PolarHBondContact OE2-N 2.92Å; R166-F205 HydrophobicContact CB-CE2 3.54Å; R166-F205 HydrophobicContact CB-CZ 3.73Å; R166-F205 HydrophobicContact CG-CD2 4.02Å; R166-F205 HydrophobicContact CG-CE1 4.21Å; R166-F205 HydrophobicContact CG-CE2 3.33Å; R166-F205 HydrophobicContact CG-CZ 3.43Å; R166-F205 VanDerWaalsContact CG-CZ 3.43Å; L175-F205 HydrophobicContact CB-CE2 3.52Å; L175-F205 HydrophobicContact CB-CZ 3.61Å; L175-F205 HydrophobicContact CD2-CD2 4.21Å; L175-F205 HydrophobicContact CD2-CE2 3.61Å; L175-F205 HydrophobicContact CG-CE2 4.21Å; L177-F205 HydrophobicContact CB-CD1 4.28Å; L177-F205 HydrophobicContact CB-CE1 3.86Å; I182-F205 HydrophobicContact CD1-CB 3.71Å; I182-F205 HydrophobicContact CD1-CD1 3.51Å; I182-F205 HydrophobicContact CD1-CD2 3.94Å; I182-F205 HydrophobicContact CD1-CE1 4.08Å; I182-F205 HydrophobicContact CD1-CE2 4.43Å; I182-F205 HydrophobicContact CD1-CG 3.44Å; I182-F205 VanDerWaalsContact CD1-CG 3.44Å; I182-F205 HydrophobicContact CG1-CD1 3.98Å; I182-F205 HydrophobicContact CG1-CE1 4.14Å; I182-F205 HydrophobicContact CG1-CG 4.37Å; I182-F205 HydrophobicContact CG2-CZ 4.49Å; F205-V221 HydrophobicContact CB-CG1 4.35Å; F205-V221 HydrophobicContact CD2-CG1 3.68Å; F205-V221 HydrophobicContact CG-CG1 4.49Å; F205-C222 CarbonylContact C-O 3.09Å; F205-C222 VanDerWaalsContact CA-O 3.27Å; F205-C222 WeakPolarHBondContact CA-O 3.28Å; F205-C222 WeakPolarHBondContact CB-O 3.34Å; F205-I223 HydrophobicContact CB-CG1 3.85Å
206	A	93.1	Very high	86	Confident	17 Å²	17	51 Å²	51	14%	0.14	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	143.1	178.1	0	0	0	0	0	111.3	C222 V256 V258	A206-C222 PolarHBondContact N-O 3.29Å; A206-C222 PolarHBondContact O-N 2.9Å; A206-V256 HydrophobicContact CB-CG1 4.24Å; A206-V258 HydrophobicContact CB-CG1 4.33Å
207	L	92.2	Very high	87	Confident	38 Å²	38	55.5 Å²	55.5	20%	0.199	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	144.8	171.1	-54	-174.9	0	0	0	110	R166 L175 E209 V219 V221	R166-L207 HydrophobicContact CB-CD1 4.09Å; R166-L207 HydrophobicContact CB-CD2 4.13Å; R166-L207 HydrophobicContact CB-CG 4.08Å; R166-L207 HydrophobicContact CG-CG 4.36Å; L175-L207 HydrophobicContact CD2-CD2 4.28Å; L207-E209 PolarHBondContact O-N 3.13Å; L207-V219 HydrophobicContact CD2-CG1 4.13Å; L207-V221 HydrophobicContact CD2-CG1 4.25Å; L207-V221 HydrophobicContact CD2-CG2 3.71Å
208	N	91.7	Very high	87.9	Confident	8 Å²	8	55.4 Å²	55.4	4%	0.043	32%	0.322	C	S	.	.			trans	-84.6	100.6	169.6	-167	0.8	0	0	0	110.4	N210 P211 E220 V258 G260	N208-N210 PolarHBondContact ND2-O 3.36Å; N208-N210 PolarHBondContact O-N 3.44Å; N208-N210 VanDerWaalsContact OD1-C 3.27Å; N208-N210 PolarHBondContact OD1-N 3.41Å; N208-N210 VanDerWaalsContact OD1-N 3.1Å; N208-N210 PolarHBondContact OD1-O 3.44Å; N208-N210 VanDerWaalsContact OD1-O 3.1Å; N208-P211 WeakPolarHBondContact O-CD 3.34Å; N208-E220 HydrophobicContact CB-CB 4.02Å; N208-E220 HydrophobicContact CB-CG 4.12Å; N208-E220 PolarHBondContact N-O 3.09Å; N208-E220 PolarHBondContact ND2-OE2 2.94Å; N208-V258 HydrophobicContact CB-CG1 4.01Å; N208-V258 HydrophobicContact CB-CG2 4.08Å; N208-G260 PolarHBondContact ND2-O 3.01Å; N208-G260 PolarHBondContact OD1-N 3.34Å
209	E	86.3	Confident	88.2	Confident	117 Å²	117	52.5 Å²	52.5	55%	0.547	31%	0.313	S	S	.	.	S	Bend	trans	-67.5	-7.1	175.1	-64.4	174.8	-172.8	0	0	113.5	L207 R298	L207-E209 PolarHBondContact O-N 3.13Å; E209-R298 WeakPolarHBondContact OE2-CD 3.3Å; E209-R298 IonicContact OE2-CZ 2.67Å; E209-R298 IonicContact OE2-NE 3.57Å; E209-R298 IonicContact OE2-NH1 2.68Å; E209-R298 PolarHBondContact OE2-NH1 2.99Å
210	N	88.8	Confident	88.4	Confident	47 Å²	47	52.2 Å²	52.2	25%	0.251	31%	0.312	S	S	.	.	S	Bend	trans	-133.7	66	176.9	-172.5	29.9	0	0	0	108.6	N208 D259 G260	N208-N210 PolarHBondContact ND2-O 3.36Å; N208-N210 PolarHBondContact O-N 3.44Å; N208-N210 VanDerWaalsContact OD1-C 3.27Å; N208-N210 PolarHBondContact OD1-N 3.41Å; N208-N210 VanDerWaalsContact OD1-N 3.1Å; N208-N210 PolarHBondContact OD1-O 3.44Å; N208-N210 VanDerWaalsContact OD1-O 3.1Å; N210-D259 WeakPolarHBondContact CB-OD1 3.47Å; N210-D259 VanDerWaalsContact ND2-CG 3.34Å; N210-D259 PolarHBondContact ND2-OD1 2.74Å; N210-D259 VanDerWaalsContact ND2-OD1 3.15Å; N210-D259 PolarHBondContact ND2-OD2 2.91Å; N210-G260 WeakPolarHBondContact O-CA 3.35Å; N210-G260 PolarHBondContact O-N 3.04Å; N210-G260 VanDerWaalsContact O-N 3.09Å
211	P	85.9	Confident	88.6	Confident	70 Å²	70	44.3 Å²	44.3	46%	0.455	28%	0.277	S	S	.	.			trans	-62.3	143.6	-166.2	25.8	-35	0	0	0	112.6	N208 E220	N208-P211 WeakPolarHBondContact O-CD 3.34Å; P211-E220 HydrophobicContact CB-CB 4.38Å
212	V	87.4	Confident	88.8	Confident	61 Å²	61	42.8 Å²	42.8	37%	0.37	26%	0.262	S	S	.	.	S	Bend	trans	-78.9	-27.6	175.2	170.5	0	0	0	0	111.6	E220 G260 H261 Y276	V212-E220 PolarHBondContact N-OE2 2.95Å; V212-G260 VanDerWaalsContact CG2-C 3.43Å; V212-H261 WeakPolarHBondContact CG1-CE1 3.5Å; V212-Y276 VanDerWaalsContact CG2-OH 3.3Å; V212-Y276 WeakPolarHBondContact CG2-OH 3.36Å
213	S	80.2	Confident	89	Confident	37 Å²	37	42.9 Å²	42.9	26%	0.259	26%	0.263	S	S	.	.			trans	-71	131.4	174.2	-172.2	0	0	0	0	111.2	D215 C218	S213-D215 VanDerWaalsContact C-N 3.27Å; S213-D215 WeakPolarHBondContact OG-CB 3.4Å; S213-D215 PolarHBondContact OG-N 3.06Å; S213-C218 PolarHBondContact OG-SG 3.38Å
214	G	75.4	Confident	89.1	Confident	83 Å²	83	40.8 Å²	40.8	86%	0.856	25%	0.245	S	C	*	.			trans	-82.7	2.5	170.2	0	0	0	0	0	114.4	P216	G214-P216 WeakPolarHBondContact O-CD 3.31Å
215	D	84.9	Confident	89	Confident	55 Å²	55	40.1 Å²	40.1	29%	0.294	24%	0.241	S	C	.	.			trans	-85.4	112.3	178.7	178.7	1.6	0	0	0	110.6	S213 F217 C218 Y237	S213-D215 VanDerWaalsContact C-N 3.27Å; S213-D215 WeakPolarHBondContact OG-CB 3.4Å; S213-D215 PolarHBondContact OG-N 3.06Å; D215-F217 PolarHBondContact O-N 3.37Å; D215-F217 WeakPolarHBondContact OD1-CB 3.5Å; D215-F217 PolarHBondContact OD1-N 3.17Å; D215-C218 PolarHBondContact O-SG 3.12Å; D215-Y237 WeakPolarHBondContact OD2-CE1 3.4Å
216	P	81.3	Confident	88.6	Confident	94 Å²	94	42.3 Å²	42.3	61%	0.61	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-7.4	-177.8	32.8	-36.7	0	0	0	113.8	G214 C218	G214-P216 WeakPolarHBondContact O-CD 3.31Å; P216-C218 VanDerWaalsContact C-N 3.34Å
217	F	86.3	Confident	87.6	Confident	154 Å²	154	50.5 Å²	50.5	68%	0.675	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	18.4	179.6	-55.6	-73.9	0	0	0	113	L171 D215 Y237	L171-F217 WeakPolarHBondContact CD2-O 3.42Å; D215-F217 PolarHBondContact O-N 3.37Å; D215-F217 WeakPolarHBondContact OD1-CB 3.5Å; D215-F217 PolarHBondContact OD1-N 3.17Å; F217-Y237 WeakPolarHBondContact O-CD1 3.29Å
218	C	89.1	Confident	86.7	Confident	14 Å²	14	56 Å²	56	10%	0.095	31%	0.306	C	S	.	.			trans	-138.8	159.2	175.1	73.9	0	0	0	0	112.1	S213 D215 P216 V236 Y237	S213-C218 PolarHBondContact OG-SG 3.38Å; D215-C218 PolarHBondContact O-SG 3.12Å; P216-C218 VanDerWaalsContact C-N 3.34Å; C218-V236 CarbonylContact C-O 3.6Å; C218-V236 WeakPolarHBondContact CA-O 3.35Å; C218-V236 WeakPolarHBondContact CB-O 3.39Å; C218-Y237 HydrophobicContact CB-CD1 3.78Å; C218-Y237 HydrophobicContact CB-CE1 3.57Å; C218-Y237 HydrophobicContact CB-CE2 4.47Å; C218-Y237 HydrophobicContact CB-CG 4.33Å
219	V	91.7	Very high	86.6	Confident	22 Å²	22	62.2 Å²	62.2	13%	0.133	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	130.5	170.1	179.1	0	0	0	0	108.6	A168 L171 L207 V221 V236	A168-V219 HydrophobicContact CB-CB 4.49Å; A168-V219 HydrophobicContact CB-CG2 4Å; L171-V219 HydrophobicContact CD1-CB 4.34Å; L171-V219 HydrophobicContact CD1-CG2 3.96Å; L171-V219 HydrophobicContact CG-CG2 4.07Å; L207-V219 HydrophobicContact CD2-CG1 4.13Å; V219-V221 HydrophobicContact CG1-CG2 4.14Å; V219-V236 PolarHBondContact N-O 3.4Å; V219-V236 PolarHBondContact O-N 2.95Å
220	E	92.7	Very high	86.8	Confident	8 Å²	8	57.3 Å²	57.3	4%	0.037	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	127.5	175.2	-178	173.3	-147.3	0	0	110.1	N208 P211 V212 M233 F234 L235 Y276	N208-E220 HydrophobicContact CB-CB 4.02Å; N208-E220 HydrophobicContact CB-CG 4.12Å; N208-E220 PolarHBondContact N-O 3.09Å; N208-E220 PolarHBondContact ND2-OE2 2.94Å; P211-E220 HydrophobicContact CB-CB 4.38Å; V212-E220 PolarHBondContact N-OE2 2.95Å; E220-M233 HydrophobicContact CG-CE 3.69Å; E220-F234 CarbonylContact C-O 3.54Å; E220-F234 WeakPolarHBondContact CA-O 3.4Å; E220-L235 HydrophobicContact CB-CD2 3.9Å; E220-L235 HydrophobicContact CG-CD2 4.34Å; E220-Y276 PolarHBondContact OE1-OH 3.24Å
221	V	93.3	Very high	87	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	125.9	-171.2	-173.6	0	0	0	0	110.1	L175 F205 L207 V219 I223 F234 V236	L175-V221 HydrophobicContact CD2-CG1 4.24Å; L175-V221 HydrophobicContact CD2-CG2 3.97Å; F205-V221 HydrophobicContact CB-CG1 4.35Å; F205-V221 HydrophobicContact CD2-CG1 3.68Å; F205-V221 HydrophobicContact CG-CG1 4.49Å; L207-V221 HydrophobicContact CD2-CG1 4.25Å; L207-V221 HydrophobicContact CD2-CG2 3.71Å; V219-V221 HydrophobicContact CG1-CG2 4.14Å; V221-I223 HydrophobicContact CG1-CD1 4.39Å; V221-I223 HydrophobicContact CG1-CG1 4.04Å; V221-F234 PolarHBondContact N-O 3.47Å; V221-F234 PolarHBondContact O-N 3.15Å; V221-V236 HydrophobicContact CB-CG2 4.18Å; V221-V236 HydrophobicContact CG2-CB 4.27Å; V221-V236 HydrophobicContact CG2-CG2 3.58Å
222	C	94.5	Very high	87.4	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	122.9	176.9	-178	0	0	0	0	109.9	F205 A206 I231 M233 V256 V258	F205-C222 CarbonylContact C-O 3.09Å; F205-C222 VanDerWaalsContact CA-O 3.27Å; F205-C222 WeakPolarHBondContact CA-O 3.28Å; F205-C222 WeakPolarHBondContact CB-O 3.34Å; A206-C222 PolarHBondContact N-O 3.29Å; A206-C222 PolarHBondContact O-N 2.9Å; C222-I231 WeakPolarHBondContact SG-CG2 3.4Å; C222-M233 HydrophobicContact CB-CE 4.05Å; C222-M233 HydrophobicContact CB-SD 3.67Å; C222-V256 VanDerWaalsContact SG-CG2 3.53Å; C222-V258 HydrophobicContact CB-CB 4.45Å; C222-V258 HydrophobicContact CB-CG1 3.98Å
223	I	94.8	Very high	87.7	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	128.7	-175.6	-63.5	173.7	0	0	0	110.3	I182 I199 A202 F205 V221 I231 Q232 F234	I182-I223 HydrophobicContact CD1-CD1 3.66Å; I182-I223 HydrophobicContact CD1-CG1 3.91Å; I199-I223 HydrophobicContact CB-CD1 4.4Å; I199-I223 HydrophobicContact CD1-CD1 3.49Å; I199-I223 VanDerWaalsContact CD1-CD1 3.49Å; I199-I223 HydrophobicContact CG2-CD1 3.92Å; A202-I223 HydrophobicContact CB-CG2 3.54Å; F205-I223 HydrophobicContact CB-CG1 3.85Å; V221-I223 HydrophobicContact CG1-CD1 4.39Å; V221-I223 HydrophobicContact CG1-CG1 4.04Å; I223-I231 CarbonylContact O-C 3.35Å; I223-I231 WeakPolarHBondContact O-CA 3.46Å; I223-Q232 PolarHBondContact N-O 3.4Å; I223-Q232 PolarHBondContact O-N 3.14Å; I223-F234 HydrophobicContact CD1-CD2 3.65Å; I223-F234 HydrophobicContact CD1-CE2 3.94Å; I223-F234 HydrophobicContact CD1-CG 4.33Å; I223-F234 HydrophobicContact CG1-CD2 4.36Å
224	I	94.3	Very high	88.3	Confident	1 Å²	1	49 Å²	49	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	130.5	169.9	-73.4	176.6	0	0	0	109.8	A202 A203 T204 I231 P253 V256	A202-I224 WeakPolarHBondContact CA-O 3.29Å; A203-I224 HydrophobicContact CB-CB 4.43Å; A203-I224 HydrophobicContact CB-CG2 3.9Å; A203-I224 PolarHBondContact N-O 2.96Å; T204-I224 HydrophobicContact CG2-CB 3.89Å; T204-I224 HydrophobicContact CG2-CD1 3.7Å; T204-I224 HydrophobicContact CG2-CG1 4.17Å; T204-I224 HydrophobicContact CG2-CG2 4.44Å; T204-I224 PolarHBondContact O-N 3.33Å; T204-I224 VanDerWaalsContact O-N 3.1Å; I224-I231 HydrophobicContact CG1-CG1 4.24Å; I224-P253 HydrophobicContact CD1-CB 3.84Å; I224-P253 HydrophobicContact CD1-CG 4.22Å; I224-P253 HydrophobicContact CG1-CB 4.26Å; I224-P253 HydrophobicContact CG1-CG 4.11Å; I224-P253 HydrophobicContact CG2-CG 4.11Å; I224-P253 WeakPolarHBondContact CG2-O 3.4Å; I224-V256 HydrophobicContact CD1-CB 4.02Å; I224-V256 HydrophobicContact CD1-CG1 3.8Å; I224-V256 HydrophobicContact CG1-CB 4.45Å; I224-V256 HydrophobicContact CG1-CG1 3.96Å
225	S	91.4	Very high	89.1	Confident	10 Å²	10	46 Å²	46	7%	0.07	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	132.6	177.2	-167.5	0	0	0	0	112.8	G201 K227 T230 Q252	G201-S225 WeakPolarHBondContact O-CA 3.35Å; S225-K227 VanDerWaalsContact C-N 3.28Å; S225-K227 PolarHBondContact O-N 3.07Å; S225-T230 VanDerWaalsContact CB-O 3.32Å; S225-T230 WeakPolarHBondContact CB-O 3.35Å; S225-T230 PolarHBondContact N-O 2.99Å; S225-Q252 PolarHBondContact O-NE2 2.87Å
226	V	85	Confident	89.4	Confident	51 Å²	51	43.4 Å²	43.4	31%	0.309	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-24.4	-178.5	178.4	0	0	0	0	113.7	N180 G201 A202 A203	N180-V226 HydrophobicContact CB-CG2 4.21Å; G201-V226 WeakPolarHBondContact O-CG2 3.35Å; G201-V226 PolarHBondContact O-N 2.96Å; A202-V226 VanDerWaalsContact C-CG2 3.46Å; A202-V226 WeakPolarHBondContact O-CG2 3.23Å; A203-V226 HydrophobicContact CB-CG2 3.67Å
227	K	72.8	Confident	89.8	Confident	189 Å²	189	40.2 Å²	40.2	82%	0.822	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-131.4	12	-164.2	-66.9	-163.9	174.1	-171.7	0	115.7	S225	S225-K227 VanDerWaalsContact C-N 3.28Å; S225-K227 PolarHBondContact O-N 3.07Å
228	R	73.3	Confident	89.8	Confident	154 Å²	154	37.9 Å²	37.9	58%	0.581	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-134.7	-11.1	-166.2	-73.1	-172	173	-168.8	-2	117.1	T230 E246	R228-T230 HydrophobicContact CB-CG2 4.01Å; R228-T230 VanDerWaalsContact CB-OG1 3.23Å; R228-T230 WeakPolarHBondContact CB-OG1 3.48Å; R228-T230 PolarHBondContact O-N 2.89Å; R228-E246 IonicContact NH1-OE1 3.53Å; R228-E246 PolarHBondContact NH1-OE1 2.8Å; R228-E246 IonicContact NH1-OE2 3.01Å
229	R	89.3	Confident	89.5	Confident	138 Å²	138	41 Å²	41	52%	0.521	19%	0.185	S	C	.	.	S	Bend	trans	50.3	42.2	-162.4	-53.7	-176.3	-174.7	-175.4	4.3	111	T249 S250 E251 Q252	R229-T249 PolarHBondContact O-N 3.05Å; R229-T249 PolarHBondContact O-OG1 3.03Å; R229-T249 VanDerWaalsContact O-OG1 3.08Å; R229-S250 WeakPolarHBondContact CD-O 3.33Å; R229-S250 PolarHBondContact NH1-O 2.85Å; R229-E251 WeakPolarHBondContact CB-O 3.46Å; R229-Q252 HydrophobicContact CG-CB 4.38Å
230	T	91.1	Very high	89.2	Confident	13 Å²	13	45.7 Å²	45.7	8%	0.08	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	148.5	176.8	60.1	0	0	0	0	111.8	S225 R228 E246 V247	S225-T230 VanDerWaalsContact CB-O 3.32Å; S225-T230 WeakPolarHBondContact CB-O 3.35Å; S225-T230 PolarHBondContact N-O 2.99Å; R228-T230 HydrophobicContact CB-CG2 4.01Å; R228-T230 VanDerWaalsContact CB-OG1 3.23Å; R228-T230 WeakPolarHBondContact CB-OG1 3.48Å; R228-T230 PolarHBondContact O-N 2.89Å; T230-E246 VanDerWaalsContact CB-OE1 3.32Å; T230-E246 WeakPolarHBondContact CB-OE1 3.23Å; T230-E246 HydrophobicContact CG2-CG 3.91Å; T230-E246 PolarHBondContact OG1-OE1 3.04Å; T230-V247 CarbonylContact C-O 3.01Å; T230-V247 WeakPolarHBondContact CA-O 3.38Å; T230-V247 WeakPolarHBondContact CB-O 3.24Å
231	I	93.1	Very high	89	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	137.5	168.4	-62.9	150.3	0	0	0	107	C222 I223 I224 E246 V247 T249 P253 L263 L265	C222-I231 WeakPolarHBondContact SG-CG2 3.4Å; I223-I231 CarbonylContact O-C 3.35Å; I223-I231 WeakPolarHBondContact O-CA 3.46Å; I224-I231 HydrophobicContact CG1-CG1 4.24Å; I231-E246 WeakPolarHBondContact O-CA 3.22Å; I231-V247 HydrophobicContact CB-CB 4.44Å; I231-V247 PolarHBondContact N-O 2.92Å; I231-V247 PolarHBondContact O-N 3.37Å; I231-T249 HydrophobicContact CD1-CG2 3.72Å; I231-P253 HydrophobicContact CD1-CB 4.4Å; I231-P253 HydrophobicContact CD1-CG 4.06Å; I231-P253 HydrophobicContact CG1-CG 3.82Å; I231-L263 HydrophobicContact CD1-CD1 4.21Å; I231-L263 HydrophobicContact CG2-CD1 3.97Å; I231-L265 HydrophobicContact CD1-CD1 3.45Å; I231-L265 VanDerWaalsContact CD1-CD1 3.45Å; I231-L265 HydrophobicContact CD1-CD2 3.46Å; I231-L265 VanDerWaalsContact CD1-CD2 3.46Å; I231-L265 HydrophobicContact CD1-CG 4.11Å; I231-L265 HydrophobicContact CG1-CD2 4.45Å
232	Q	93.5	Very high	88.9	Confident	23 Å²	23	52.2 Å²	52.2	11%	0.107	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	121.2	-177.5	-65.2	179.5	-9.8	0	0	109.5	I223 F234 I243 K245 E246	I223-Q232 PolarHBondContact N-O 3.4Å; I223-Q232 PolarHBondContact O-N 3.14Å; Q232-F234 HydrophobicContact CB-CD2 4.02Å; Q232-F234 HydrophobicContact CB-CE2 3.51Å; Q232-F234 HydrophobicContact CB-CZ 4.49Å; Q232-F234 HydrophobicContact CG-CE2 4.49Å; Q232-I243 HydrophobicContact CB-CD1 4.06Å; Q232-I243 HydrophobicContact CG-CD1 3.98Å; Q232-K245 CarbonylContact C-O 3.6Å; Q232-K245 WeakPolarHBondContact CA-O 3.39Å; Q232-E246 HydrophobicContact CG-CB 4.31Å; Q232-E246 HydrophobicContact CG-CG 3.93Å; Q232-E246 VanDerWaalsContact NE2-CD 3.33Å; Q232-E246 PolarHBondContact NE2-OE1 3.15Å
233	M	92.9	Very high	88.7	Confident	0 Å²	0	56 Å²	56	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	121.8	172.5	-59.3	-56.6	-64	0	0	108.9	E220 C222 V244 K245 V258 L263 Y276	E220-M233 HydrophobicContact CG-CE 3.69Å; C222-M233 HydrophobicContact CB-CE 4.05Å; C222-M233 HydrophobicContact CB-SD 3.67Å; M233-V244 PolarHBondContact O-N 2.87Å; M233-K245 HydrophobicContact CB-CB 4.11Å; M233-K245 HydrophobicContact CG-CB 4.25Å; M233-K245 PolarHBondContact N-O 2.81Å; M233-K245 PolarHBondContact O-N 3.03Å; M233-V258 HydrophobicContact CE-CG2 4.31Å; M233-L263 HydrophobicContact SD-CD2 4Å; M233-Y276 HydrophobicContact CE-CE1 4.02Å; M233-Y276 HydrophobicContact CG-CD2 4.06Å; M233-Y276 HydrophobicContact CG-CE1 4.48Å; M233-Y276 HydrophobicContact CG-CE2 4.02Å; M233-Y276 HydrophobicContact CG-CG 4.31Å; M233-Y276 HydrophobicContact SD-CE1 4.37Å
234	F	92.8	Very high	88.5	Confident	19 Å²	19	59.6 Å²	59.6	8%	0.083	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	144.9	176.5	-76.2	-100.3	0	0	0	111.2	I199 E220 V221 I223 Q232 V241 Q242 I243	I199-F234 HydrophobicContact CD1-CB 4.38Å; I199-F234 HydrophobicContact CD1-CD1 3.79Å; I199-F234 HydrophobicContact CD1-CD2 4.24Å; I199-F234 HydrophobicContact CD1-CE1 4.05Å; I199-F234 HydrophobicContact CD1-CE2 4.43Å; I199-F234 HydrophobicContact CD1-CG 3.9Å; I199-F234 HydrophobicContact CD1-CZ 4.36Å; I199-F234 HydrophobicContact CG1-CD1 4.36Å; I199-F234 HydrophobicContact CG1-CE1 4.17Å; I199-F234 HydrophobicContact CG1-CZ 4.48Å; I199-F234 HydrophobicContact CG2-CE1 4.22Å; I199-F234 HydrophobicContact CG2-CE2 3.97Å; I199-F234 HydrophobicContact CG2-CZ 3.69Å; E220-F234 CarbonylContact C-O 3.54Å; E220-F234 WeakPolarHBondContact CA-O 3.4Å; V221-F234 PolarHBondContact N-O 3.47Å; V221-F234 PolarHBondContact O-N 3.15Å; I223-F234 HydrophobicContact CD1-CD2 3.65Å; I223-F234 HydrophobicContact CD1-CE2 3.94Å; I223-F234 HydrophobicContact CD1-CG 4.33Å; I223-F234 HydrophobicContact CG1-CD2 4.36Å; Q232-F234 HydrophobicContact CB-CD2 4.02Å; Q232-F234 HydrophobicContact CB-CE2 3.51Å; Q232-F234 HydrophobicContact CB-CZ 4.49Å; Q232-F234 HydrophobicContact CG-CE2 4.49Å; F234-V241 HydrophobicContact CD1-CB 4.46Å; F234-Q242 CarbonylContact C-O 3.59Å; F234-Q242 WeakPolarHBondContact CA-O 3.42Å; F234-I243 HydrophobicContact CD1-CB 4.1Å; F234-I243 HydrophobicContact CE1-CB 3.81Å; F234-I243 HydrophobicContact CE1-CG1 4.48Å; F234-I243 HydrophobicContact CE2-CD1 4.43Å; F234-I243 HydrophobicContact CE2-CG1 4.44Å; F234-I243 HydrophobicContact CZ-CB 4.1Å; F234-I243 HydrophobicContact CZ-CD1 4.26Å; F234-I243 HydrophobicContact CZ-CG1 4.32Å
235	L	92.3	Very high	88.4	Confident	19 Å²	19	63.7 Å²	63.7	10%	0.099	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	122.4	156.5	-65.6	173.9	0	0	0	108.3	E220 Y237 Q242 V244	E220-L235 HydrophobicContact CB-CD2 3.9Å; E220-L235 HydrophobicContact CG-CD2 4.34Å; L235-Y237 HydrophobicContact CB-CE2 3.93Å; L235-Q242 PolarHBondContact N-O 3.25Å; L235-Q242 PolarHBondContact O-N 2.88Å; L235-V244 HydrophobicContact CB-CG2 4.39Å; L235-V244 HydrophobicContact CD1-CG2 3.71Å; L235-V244 HydrophobicContact CG-CG2 3.63Å
236	V	91.3	Very high	88.4	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.006	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	126.3	176.1	178.2	0	0	0	0	107.6	L171 L175 L184 C218 V219 V221 V241	L171-V236 HydrophobicContact CD1-CB 4.48Å; L171-V236 HydrophobicContact CD1-CG1 3.97Å; L171-V236 WeakPolarHBondContact CD1-O 3.33Å; L175-V236 HydrophobicContact CD2-CG2 4.38Å; L184-V236 HydrophobicContact CD1-CG1 4.07Å; L184-V236 HydrophobicContact CD2-CG1 3.66Å; L184-V236 HydrophobicContact CG-CG1 4.47Å; C218-V236 CarbonylContact C-O 3.6Å; C218-V236 WeakPolarHBondContact CA-O 3.35Å; C218-V236 WeakPolarHBondContact CB-O 3.39Å; V219-V236 PolarHBondContact N-O 3.4Å; V219-V236 PolarHBondContact O-N 2.95Å; V221-V236 HydrophobicContact CB-CG2 4.18Å; V221-V236 HydrophobicContact CG2-CB 4.27Å; V221-V236 HydrophobicContact CG2-CG2 3.58Å; V236-V241 HydrophobicContact CG1-CG1 4.3Å; V236-V241 HydrophobicContact CG2-CG1 4.11Å
237	Y	90.3	Very high	88.8	Confident	27 Å²	27	64.9 Å²	64.9	11%	0.106	29%	0.294	C	S	.	.			trans	-110.7	178.2	174.1	-65.3	-89	0	0	0	109.3	D215 F217 C218 L235 D239 R240	D215-Y237 WeakPolarHBondContact OD2-CE1 3.4Å; F217-Y237 WeakPolarHBondContact O-CD1 3.29Å; C218-Y237 HydrophobicContact CB-CD1 3.78Å; C218-Y237 HydrophobicContact CB-CE1 3.57Å; C218-Y237 HydrophobicContact CB-CE2 4.47Å; C218-Y237 HydrophobicContact CB-CG 4.33Å; L235-Y237 HydrophobicContact CB-CE2 3.93Å; Y237-D239 VanDerWaalsContact C-N 3.29Å; Y237-D239 PolarHBondContact O-N 3.43Å; Y237-R240 WeakPolarHBondContact CB-O 3.35Å; Y237-R240 HydrophobicContact CD2-CG 3.82Å; Y237-R240 HydrophobicContact CG-CG 4.05Å; Y237-R240 PolarHBondContact N-O 3.1Å
238	E	85.9	Confident	89.6	Confident	105 Å²	105	60.5 Å²	60.5	49%	0.491	29%	0.288	S	S	.	.	S	Bend	trans	-59.3	-37.6	179.4	-175.7	169.9	-164.2	0	0	113.7	R173	R173-E238 IonicContact CZ-OE1 3.72Å; R173-E238 PolarHBondContact NE-O 3.29Å; R173-E238 IonicContact NH1-OE1 2.7Å; R173-E238 PolarHBondContact NH1-OE1 3.05Å; R173-E238 IonicContact NH2-OE1 3.25Å; R173-E238 PolarHBondContact NH2-OE1 3.11Å
239	D	83.2	Confident	90.5	Very high	80 Å²	80	54.1 Å²	54.1	43%	0.428	27%	0.266	S	S	.	.	S	Bend	trans	-118	-15.3	-170.9	73.5	-38.2	0	0	0	114.5	S195 Y237	S195-D239 VanDerWaalsContact CB-O 3.27Å; S195-D239 WeakPolarHBondContact CB-O 3.45Å; S195-D239 PolarHBondContact OG-O 2.97Å; Y237-D239 VanDerWaalsContact C-N 3.29Å; Y237-D239 PolarHBondContact O-N 3.43Å
240	R	85.6	Confident	90.4	Very high	120 Å²	120	51.2 Å²	51.2	45%	0.453	27%	0.267	S	S	.	.			trans	-144.8	162.8	-170	69	-175.3	179	-83.5	0.3	112.8	Y237	Y237-R240 WeakPolarHBondContact CB-O 3.35Å; Y237-R240 HydrophobicContact CD2-CG 3.82Å; Y237-R240 HydrophobicContact CG-CG 4.05Å; Y237-R240 PolarHBondContact N-O 3.1Å
241	V	89.6	Confident	90.4	Very high	45 Å²	45	52.6 Å²	52.6	27%	0.273	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.3	174	-67.3	0	0	0	0	110.2	L184 A197 I199 F234 V236	L184-V241 HydrophobicContact CD1-CG1 3.99Å; A197-V241 HydrophobicContact CB-CG1 4.47Å; A197-V241 HydrophobicContact CB-CG2 4.44Å; I199-V241 HydrophobicContact CD1-CB 4.26Å; I199-V241 HydrophobicContact CD1-CG1 4.14Å; I199-V241 HydrophobicContact CD1-CG2 4.49Å; I199-V241 HydrophobicContact CG1-CB 4.26Å; I199-V241 HydrophobicContact CG1-CG1 4.29Å; I199-V241 HydrophobicContact CG1-CG2 3.94Å; F234-V241 HydrophobicContact CD1-CB 4.46Å; V236-V241 HydrophobicContact CG1-CG1 4.3Å; V236-V241 HydrophobicContact CG2-CG1 4.11Å
242	Q	90.1	Very high	90.3	Very high	100 Å²	100	54.7 Å²	54.7	47%	0.467	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	128	-178.6	175.1	175.7	-15.4	0	0	110	F234 L235	F234-Q242 CarbonylContact C-O 3.59Å; F234-Q242 WeakPolarHBondContact CA-O 3.42Å; L235-Q242 PolarHBondContact N-O 3.25Å; L235-Q242 PolarHBondContact O-N 2.88Å
243	I	90.8	Very high	90.3	Very high	80 Å²	80	53.7 Å²	53.7	41%	0.41	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	134.1	169.4	-169.3	167.9	0	0	0	109.9	Q232 F234 E246	Q232-I243 HydrophobicContact CB-CD1 4.06Å; Q232-I243 HydrophobicContact CG-CD1 3.98Å; F234-I243 HydrophobicContact CD1-CB 4.1Å; F234-I243 HydrophobicContact CE1-CB 3.81Å; F234-I243 HydrophobicContact CE1-CG1 4.48Å; F234-I243 HydrophobicContact CE2-CD1 4.43Å; F234-I243 HydrophobicContact CE2-CG1 4.44Å; F234-I243 HydrophobicContact CZ-CB 4.1Å; F234-I243 HydrophobicContact CZ-CD1 4.26Å; F234-I243 HydrophobicContact CZ-CG1 4.32Å; I243-E246 HydrophobicContact CD1-CB 4.4Å
244	V	91	Very high	90.2	Very high	77 Å²	77	56.8 Å²	56.8	47%	0.467	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	-40.1	177.9	174.6	0	0	0	0	111.4	M233 L235	M233-V244 PolarHBondContact O-N 2.87Å; L235-V244 HydrophobicContact CB-CG2 4.39Å; L235-V244 HydrophobicContact CD1-CG2 3.71Å; L235-V244 HydrophobicContact CG-CG2 3.63Å
245	K	90.8	Very high	90.2	Very high	86 Å²	86	56.7 Å²	56.7	37%	0.374	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	135.6	-177	-171.6	78.7	178.1	-159.6	0	110	Q232 M233 V247 Y276	Q232-K245 CarbonylContact C-O 3.6Å; Q232-K245 WeakPolarHBondContact CA-O 3.39Å; M233-K245 HydrophobicContact CB-CB 4.11Å; M233-K245 HydrophobicContact CG-CB 4.25Å; M233-K245 PolarHBondContact N-O 2.81Å; M233-K245 PolarHBondContact O-N 3.03Å; K245-V247 HydrophobicContact CG-CG2 3.77Å; K245-Y276 HydrophobicContact CB-CD2 4.42Å; K245-Y276 WeakPolarHBondContact CE-O 3.46Å; K245-Y276 HydrophobicContact CG-CD2 4.26Å; K245-Y276 PolarHBondContact NZ-O 3.43Å
246	E	92.6	Very high	90.3	Very high	77 Å²	77	56.5 Å²	56.5	36%	0.36	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	137	158.9	-173.8	158.8	-149.9	0	0	108	R228 T230 I231 Q232 I243	R228-E246 IonicContact NH1-OE1 3.53Å; R228-E246 PolarHBondContact NH1-OE1 2.8Å; R228-E246 IonicContact NH1-OE2 3.01Å; T230-E246 VanDerWaalsContact CB-OE1 3.32Å; T230-E246 WeakPolarHBondContact CB-OE1 3.23Å; T230-E246 HydrophobicContact CG2-CG 3.91Å; T230-E246 PolarHBondContact OG1-OE1 3.04Å; I231-E246 WeakPolarHBondContact O-CA 3.22Å; Q232-E246 HydrophobicContact CG-CB 4.31Å; Q232-E246 HydrophobicContact CG-CG 3.93Å; Q232-E246 VanDerWaalsContact NE2-CD 3.33Å; Q232-E246 PolarHBondContact NE2-OE1 3.15Å; I243-E246 HydrophobicContact CD1-CB 4.4Å
247	V	91.9	Very high	90.4	Very high	9 Å²	9	56.8 Å²	56.8	6%	0.055	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	125.1	-177.4	177.1	0	0	0	0	107.6	T230 I231 K245 H274	T230-V247 CarbonylContact C-O 3.01Å; T230-V247 WeakPolarHBondContact CA-O 3.38Å; T230-V247 WeakPolarHBondContact CB-O 3.24Å; I231-V247 HydrophobicContact CB-CB 4.44Å; I231-V247 PolarHBondContact N-O 2.92Å; I231-V247 PolarHBondContact O-N 3.37Å; K245-V247 HydrophobicContact CG-CG2 3.77Å; V247-H274 WeakPolarHBondContact CG1-NE2 3.38Å
248	S	91.4	Very high	90.6	Very high	98 Å²	98	55.7 Å²	55.7	69%	0.685	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	129.6	175	52.9	0	0	0	0	111.5
249	T	90.3	Very high	91	Very high	19 Å²	19	50.7 Å²	50.7	12%	0.117	27%	0.271	C	S	.	.			trans	-101.4	157.5	174.6	48.7	0	0	0	0	111.2	R229 I231 E251 P253 L265 L267	R229-T249 PolarHBondContact O-N 3.05Å; R229-T249 PolarHBondContact O-OG1 3.03Å; R229-T249 VanDerWaalsContact O-OG1 3.08Å; I231-T249 HydrophobicContact CD1-CG2 3.72Å; T249-E251 WeakPolarHBondContact CB-O 3.47Å; T249-E251 PolarHBondContact OG1-O 3.47Å; T249-P253 WeakPolarHBondContact OG1-CD 3.48Å; T249-L265 HydrophobicContact CG2-CD1 4.23Å; T249-L267 HydrophobicContact CG2-CD2 4.36Å
250	S	88.4	Confident	91.5	Very high	77 Å²	77	47.3 Å²	47.3	54%	0.538	26%	0.256	S	S	.	.	S	Bend	trans	-60.1	-46.6	175.6	44	0	0	0	0	111.8	R229	R229-S250 WeakPolarHBondContact CD-O 3.33Å; R229-S250 PolarHBondContact NH1-O 2.85Å
251	E	90.9	Very high	91.9	Very high	42 Å²	42	45.1 Å²	45.1	20%	0.196	25%	0.251	C	S	.	.	S	Bend	trans	-113.1	178.8	179	-59.9	-171.2	169.3	0	0	111.7	R229 T249 P253 L267 T268 T269	R229-E251 WeakPolarHBondContact CB-O 3.46Å; T249-E251 WeakPolarHBondContact CB-O 3.47Å; T249-E251 PolarHBondContact OG1-O 3.47Å; E251-P253 WeakPolarHBondContact O-CD 3.37Å; E251-L267 HydrophobicContact CB-CB 4.07Å; E251-L267 HydrophobicContact CB-CD1 4.22Å; E251-L267 HydrophobicContact CB-CD2 4.49Å; E251-L267 HydrophobicContact CB-CG 4.5Å; E251-L267 HydrophobicContact CG-CD1 4.46Å; E251-L267 WeakPolarHBondContact OE2-CB 3.24Å; E251-T268 VanDerWaalsContact CD-OG1 3.31Å; E251-T268 WeakPolarHBondContact OE2-CA 3.39Å; E251-T268 PolarHBondContact OE2-N 2.87Å; E251-T268 PolarHBondContact OE2-OG1 3.43Å; E251-T269 WeakPolarHBondContact OE1-CB 3.28Å; E251-T269 VanDerWaalsContact OE1-CG2 3.23Å; E251-T269 WeakPolarHBondContact OE1-CG2 3.42Å; E251-T269 PolarHBondContact OE1-OG1 3.42Å; E251-T269 PolarHBondContact OE2-N 3.2Å; E251-T269 PolarHBondContact OE2-OG1 2.9Å; E251-T269 VanDerWaalsContact OE2-OG1 3.13Å
252	Q	90.6	Very high	92.1	Very high	45 Å²	45	45 Å²	45	21%	0.21	25%	0.246	C	C	.	.			trans	-76.1	122.5	170.2	180	60.6	39.7	0	0	109.2	S225 R229 T268	S225-Q252 PolarHBondContact O-NE2 2.87Å; R229-Q252 HydrophobicContact CG-CB 4.38Å; Q252-T268 PolarHBondContact O-N 3.07Å
253	P	92.9	Very high	92.4	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	22%	0.224	C	C	.	.			trans	-75.8	145.6	170.9	27.6	-24.3	0	0	0	109.7	I224 I231 T249 E251 A266 L267	I224-P253 HydrophobicContact CD1-CB 3.84Å; I224-P253 HydrophobicContact CD1-CG 4.22Å; I224-P253 HydrophobicContact CG1-CB 4.26Å; I224-P253 HydrophobicContact CG1-CG 4.11Å; I224-P253 HydrophobicContact CG2-CG 4.11Å; I224-P253 WeakPolarHBondContact CG2-O 3.4Å; I231-P253 HydrophobicContact CD1-CB 4.4Å; I231-P253 HydrophobicContact CD1-CG 4.06Å; I231-P253 HydrophobicContact CG1-CG 3.82Å; T249-P253 WeakPolarHBondContact OG1-CD 3.48Å; E251-P253 WeakPolarHBondContact O-CD 3.37Å; P253-A266 CarbonylContact C-O 3.5Å; P253-A266 VanDerWaalsContact CA-O 3.32Å; P253-A266 WeakPolarHBondContact CA-O 3.34Å; P253-L267 HydrophobicContact CB-CD2 4Å
254	L	91.7	Very high	92.6	Very high	65 Å²	65	36.4 Å²	36.4	34%	0.34	21%	0.205	S	C	.	.			trans	-114.7	-36	-174.6	-60.7	176.6	0	0	0	112.4	A266 T268 Y287 P294	L254-A266 PolarHBondContact N-O 2.79Å; L254-T268 HydrophobicContact CD1-CG2 4.02Å; L254-T268 HydrophobicContact CD2-CG2 4.4Å; L254-T268 HydrophobicContact CG-CG2 4.33Å; L254-Y287 HydrophobicContact CD1-CE1 4.43Å; L254-P294 HydrophobicContact CB-CG 3.91Å
255	A	92.5	Very high	92.8	Very high	18 Å²	18	32.8 Å²	32.8	15%	0.149	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	153.8	172.9	0	0	0	0	0	111	A266 P294 V296	A255-A266 HydrophobicContact CB-CB 4.24Å; A255-A266 PolarHBondContact O-N 3.25Å; A255-P294 HydrophobicContact CB-CB 4.04Å; A255-P294 HydrophobicContact CB-CG 3.81Å; A255-V296 HydrophobicContact CB-CB 4.4Å; A255-V296 HydrophobicContact CB-CG2 4.01Å
256	V	94.4	Very high	93	Very high	14 Å²	14	28.7 Å²	28.7	9%	0.085	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	140	-179.3	57	0	0	0	0	111.8	A206 C222 I224 L263 C264 L265	A206-V256 HydrophobicContact CB-CG1 4.24Å; C222-V256 VanDerWaalsContact SG-CG2 3.53Å; I224-V256 HydrophobicContact CD1-CB 4.02Å; I224-V256 HydrophobicContact CD1-CG1 3.8Å; I224-V256 HydrophobicContact CG1-CB 4.45Å; I224-V256 HydrophobicContact CG1-CG1 3.96Å; V256-L263 HydrophobicContact CG2-CB 4.48Å; V256-C264 WeakPolarHBondContact CA-O 3.49Å; V256-L265 HydrophobicContact CB-CD2 3.63Å; V256-L265 HydrophobicContact CG2-CD2 3.44Å; V256-L265 VanDerWaalsContact CG2-CD2 3.44Å
257	A	94.4	Very high	93	Very high	8 Å²	8	25 Å²	25	7%	0.066	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	153.3	157.7	0	0	0	0	0	109.4	L263 C264 V296 R298 F304	A257-L263 WeakPolarHBondContact O-CA 3.36Å; A257-C264 PolarHBondContact N-O 2.93Å; A257-C264 PolarHBondContact O-N 3.46Å; A257-V296 HydrophobicContact CB-CG1 3.71Å; A257-R298 HydrophobicContact CB-CB 4.36Å; A257-F304 HydrophobicContact CB-CD1 3.87Å; A257-F304 HydrophobicContact CB-CE1 3.85Å
258	V	94.6	Very high	92.9	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.018	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	138.6	-174.7	49.4	0	0	0	0	111.1	A206 N208 C222 M233 F262 L263	A206-V258 HydrophobicContact CB-CG1 4.33Å; N208-V258 HydrophobicContact CB-CG1 4.01Å; N208-V258 HydrophobicContact CB-CG2 4.08Å; C222-V258 HydrophobicContact CB-CB 4.45Å; C222-V258 HydrophobicContact CB-CG1 3.98Å; M233-V258 HydrophobicContact CE-CG2 4.31Å; V258-F262 WeakPolarHBondContact CA-O 3.42Å; V258-L263 HydrophobicContact CB-CD2 3.8Å; V258-L263 HydrophobicContact CG2-CD2 3.7Å
259	D	94.1	Very high	92.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	111.7	169.5	-176.2	79.5	0	0	0	109.6	N210 H261 F262 R298 Q302 F304	N210-D259 WeakPolarHBondContact CB-OD1 3.47Å; N210-D259 VanDerWaalsContact ND2-CG 3.34Å; N210-D259 PolarHBondContact ND2-OD1 2.74Å; N210-D259 VanDerWaalsContact ND2-OD1 3.15Å; N210-D259 PolarHBondContact ND2-OD2 2.91Å; D259-H261 PolarHBondContact O-N 3.37Å; D259-F262 PolarHBondContact N-O 3.42Å; D259-F262 PolarHBondContact O-N 3.42Å; D259-F262 VanDerWaalsContact O-N 3.08Å; D259-R298 IonicContact OD1-CZ 2.94Å; D259-R298 IonicContact OD1-NE 3.65Å; D259-R298 PolarHBondContact OD1-NE 3.24Å; D259-R298 IonicContact OD1-NH2 3.89Å; D259-R298 PolarHBondContact OD1-NH2 3.37Å; D259-Q302 PolarHBondContact OD2-N 3.05Å; D259-F304 HydrophobicContact CB-CE1 4.45Å; D259-F304 HydrophobicContact CB-CZ 3.96Å
260	G	92.8	Very high	93	Very high	10 Å²	10	26.9 Å²	26.9	10%	0.103	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	-130.3	-174.4	0	0	0	0	0	111	N208 N210 V212 F262 Y276	N208-G260 PolarHBondContact ND2-O 3.01Å; N208-G260 PolarHBondContact OD1-N 3.34Å; N210-G260 WeakPolarHBondContact O-CA 3.35Å; N210-G260 PolarHBondContact O-N 3.04Å; N210-G260 VanDerWaalsContact O-N 3.09Å; V212-G260 VanDerWaalsContact CG2-C 3.43Å; G260-F262 PolarHBondContact O-N 2.92Å; G260-Y276 WeakPolarHBondContact O-CE1 3.34Å; G260-Y276 PolarHBondContact O-OH 2.98Å
261	H	93.1	Very high	93.3	Very high	74 Å²	74	23.2 Å²	23.2	34%	0.343	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-2.3	178.5	-64.2	-60.5	0	0	0	115.4	V212 D259 N275 Y276	V212-H261 WeakPolarHBondContact CG1-CE1 3.5Å; D259-H261 PolarHBondContact O-N 3.37Å; H261-N275 WeakPolarHBondContact O-CA 3.42Å; H261-Y276 VanDerWaalsContact C-CE1 3.47Å; H261-Y276 VanDerWaalsContact CA-CE1 3.47Å; H261-Y276 WeakPolarHBondContact O-CD1 3.42Å; H261-Y276 WeakPolarHBondContact O-CE1 3.42Å; H261-Y276 PolarHBondContact O-N 3.5Å
262	F	95.3	Very high	93.5	Very high	42 Å²	42	21.4 Å²	21.4	18%	0.184	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.5	-169.6	-60	-87.7	0	0	0	111.9	V258 D259 G260 I273 N275 Q302 V318	V258-F262 WeakPolarHBondContact CA-O 3.42Å; D259-F262 PolarHBondContact N-O 3.42Å; D259-F262 PolarHBondContact O-N 3.42Å; D259-F262 VanDerWaalsContact O-N 3.08Å; G260-F262 PolarHBondContact O-N 2.92Å; F262-I273 HydrophobicContact CD1-CG2 4.34Å; F262-N275 HydrophobicContact CD1-CB 3.93Å; F262-N275 HydrophobicContact CE1-CB 3.99Å; F262-N275 WeakPolarHBondContact CE1-ND2 3.34Å; F262-N275 WeakPolarHBondContact CZ-ND2 3.38Å; F262-Q302 HydrophobicContact CD2-CG 4.47Å; F262-V318 HydrophobicContact CB-CB 4.46Å; F262-V318 HydrophobicContact CB-CG1 3.62Å; F262-V318 HydrophobicContact CD1-CB 3.66Å; F262-V318 HydrophobicContact CD1-CG1 3.76Å; F262-V318 HydrophobicContact CD1-CG2 4.47Å; F262-V318 HydrophobicContact CD2-CB 4.22Å; F262-V318 HydrophobicContact CD2-CG1 3.71Å; F262-V318 HydrophobicContact CE1-CB 3.8Å; F262-V318 HydrophobicContact CE1-CG1 4.29Å; F262-V318 HydrophobicContact CE1-CG2 4.16Å; F262-V318 HydrophobicContact CE2-CB 4.36Å; F262-V318 HydrophobicContact CE2-CG1 4.26Å; F262-V318 HydrophobicContact CE2-CG2 4.28Å; F262-V318 HydrophobicContact CG-CB 3.87Å; F262-V318 HydrophobicContact CG-CG1 3.42Å; F262-V318 VanDerWaalsContact CG-CG1 3.42Å; F262-V318 HydrophobicContact CZ-CB 4.15Å; F262-V318 HydrophobicContact CZ-CG2 4.07Å
263	L	94.9	Very high	93.8	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	123.9	171.4	-49.6	178.7	0	0	0	108.2	I231 M233 V256 A257 V258 L265 I273 H274 Y276	I231-L263 HydrophobicContact CD1-CD1 4.21Å; I231-L263 HydrophobicContact CG2-CD1 3.97Å; M233-L263 HydrophobicContact SD-CD2 4Å; V256-L263 HydrophobicContact CG2-CB 4.48Å; A257-L263 WeakPolarHBondContact O-CA 3.36Å; V258-L263 HydrophobicContact CB-CD2 3.8Å; V258-L263 HydrophobicContact CG2-CD2 3.7Å; L263-L265 HydrophobicContact CB-CD1 4.2Å; L263-L265 HydrophobicContact CB-CD2 4.14Å; L263-L265 HydrophobicContact CB-CG 4Å; L263-I273 CarbonylContact O-C 3.57Å; L263-I273 WeakPolarHBondContact O-CA 3.45Å; L263-H274 PolarHBondContact N-O 2.91Å; L263-H274 PolarHBondContact O-N 2.86Å; L263-Y276 HydrophobicContact CD1-CD1 4.33Å; L263-Y276 HydrophobicContact CD2-CD1 3.94Å; L263-Y276 HydrophobicContact CD2-CE1 4.19Å; L263-Y276 HydrophobicContact CG-CD1 3.93Å
264	C	95.9	Very high	93.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	131.2	162.1	-163.8	0	0	0	0	108	V256 A257 V296 F304	V256-C264 WeakPolarHBondContact CA-O 3.49Å; A257-C264 PolarHBondContact N-O 2.93Å; A257-C264 PolarHBondContact O-N 3.46Å; C264-V296 HydrophobicContact CB-CG1 3.93Å; C264-F304 HydrophobicContact CB-CB 4.22Å; C264-F304 HydrophobicContact CB-CD1 3.6Å; C264-F304 HydrophobicContact CB-CD2 3.74Å; C264-F304 HydrophobicContact CB-CE1 3.78Å; C264-F304 HydrophobicContact CB-CE2 3.91Å; C264-F304 HydrophobicContact CB-CG 3.57Å; C264-F304 HydrophobicContact CB-CZ 3.93Å
265	L	94.9	Very high	94	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	132.7	-164.5	-63.1	171.3	0	0	0	111.1	I231 T249 V256 L263 Y271 I272 H274	I231-L265 HydrophobicContact CD1-CD1 3.45Å; I231-L265 VanDerWaalsContact CD1-CD1 3.45Å; I231-L265 HydrophobicContact CD1-CD2 3.46Å; I231-L265 VanDerWaalsContact CD1-CD2 3.46Å; I231-L265 HydrophobicContact CD1-CG 4.11Å; I231-L265 HydrophobicContact CG1-CD2 4.45Å; T249-L265 HydrophobicContact CG2-CD1 4.23Å; V256-L265 HydrophobicContact CB-CD2 3.63Å; V256-L265 HydrophobicContact CG2-CD2 3.44Å; V256-L265 VanDerWaalsContact CG2-CD2 3.44Å; L263-L265 HydrophobicContact CB-CD1 4.2Å; L263-L265 HydrophobicContact CB-CD2 4.14Å; L263-L265 HydrophobicContact CB-CG 4Å; L265-Y271 WeakPolarHBondContact O-CA 3.49Å; L265-I272 HydrophobicContact CB-CG1 3.83Å; L265-I272 HydrophobicContact CD1-CD1 4.06Å; L265-I272 HydrophobicContact CD1-CG1 4.06Å; L265-I272 HydrophobicContact CG-CG1 4.47Å; L265-I272 PolarHBondContact N-O 2.89Å; L265-I272 PolarHBondContact O-N 3.25Å; L265-H274 HydrophobicContact CD1-CB 4.05Å
266	A	94.4	Very high	94	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	117.6	159.7	0	0	0	0	0	108.7	P253 L254 A255 Y271 Y287 P294 V296	P253-A266 CarbonylContact C-O 3.5Å; P253-A266 VanDerWaalsContact CA-O 3.32Å; P253-A266 WeakPolarHBondContact CA-O 3.34Å; L254-A266 PolarHBondContact N-O 2.79Å; A255-A266 HydrophobicContact CB-CB 4.24Å; A255-A266 PolarHBondContact O-N 3.25Å; A266-Y271 HydrophobicContact CB-CD1 3.85Å; A266-Y271 HydrophobicContact CB-CE1 3.62Å; A266-Y287 HydrophobicContact CB-CE1 4.47Å; A266-P294 HydrophobicContact CB-CB 3.39Å; A266-P294 HydrophobicContact CB-CG 4.28Å; A266-V296 HydrophobicContact CB-CG2 3.86Å
267	L	92.7	Very high	93.8	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.112	C	C	.	.			trans	-86.8	-174.7	164.7	-57.7	-174.6	0	0	0	109.8	T249 E251 P253 Q270 I272 Y287	T249-L267 HydrophobicContact CG2-CD2 4.36Å; E251-L267 HydrophobicContact CB-CB 4.07Å; E251-L267 HydrophobicContact CB-CD1 4.22Å; E251-L267 HydrophobicContact CB-CD2 4.49Å; E251-L267 HydrophobicContact CB-CG 4.5Å; E251-L267 HydrophobicContact CG-CD1 4.46Å; E251-L267 WeakPolarHBondContact OE2-CB 3.24Å; P253-L267 HydrophobicContact CB-CD2 4Å; L267-Q270 HydrophobicContact CB-CG 4.45Å; L267-Q270 VanDerWaalsContact CB-O 3.31Å; L267-Q270 WeakPolarHBondContact CB-O 3.24Å; L267-Q270 HydrophobicContact CD1-CG 4.15Å; L267-Q270 PolarHBondContact N-O 2.75Å; L267-I272 HydrophobicContact CD1-CD1 4.13Å; L267-I272 HydrophobicContact CD1-CG1 4.41Å; L267-I272 HydrophobicContact CD1-CG2 4.04Å; L267-I272 HydrophobicContact CG-CD1 4.5Å; L267-I272 HydrophobicContact CG-CG1 4.42Å; L267-Y287 WeakPolarHBondContact O-CD1 3.39Å; L267-Y287 WeakPolarHBondContact O-CE1 3.42Å
268	T	90.5	Very high	93.7	Very high	46 Å²	46	24 Å²	24	28%	0.282	14%	0.136	S	C	.	.	S	Bend	trans	-70.1	-30.3	175	33.8	0	0	0	0	113.5	E251 Q252 L254 S289	E251-T268 VanDerWaalsContact CD-OG1 3.31Å; E251-T268 WeakPolarHBondContact OE2-CA 3.39Å; E251-T268 PolarHBondContact OE2-N 2.87Å; E251-T268 PolarHBondContact OE2-OG1 3.43Å; Q252-T268 PolarHBondContact O-N 3.07Å; L254-T268 HydrophobicContact CD1-CG2 4.02Å; L254-T268 HydrophobicContact CD2-CG2 4.4Å; L254-T268 HydrophobicContact CG-CG2 4.33Å; T268-S289 PolarHBondContact O-N 3.07Å; T268-S289 PolarHBondContact O-OG 3.45Å
269	T	90.9	Very high	93.5	Very high	72 Å²	72	26 Å²	26	44%	0.442	16%	0.158	S	C	.	.	S	Bend	trans	-118.5	-9.8	-176	68.9	0	0	0	0	115.8	E251 P286 Y287	E251-T269 WeakPolarHBondContact OE1-CB 3.28Å; E251-T269 VanDerWaalsContact OE1-CG2 3.23Å; E251-T269 WeakPolarHBondContact OE1-CG2 3.42Å; E251-T269 PolarHBondContact OE1-OG1 3.42Å; E251-T269 PolarHBondContact OE2-N 3.2Å; E251-T269 PolarHBondContact OE2-OG1 2.9Å; E251-T269 VanDerWaalsContact OE2-OG1 3.13Å; T269-P286 WeakPolarHBondContact O-CA 3.4Å; T269-Y287 CarbonylContact C-O 3.49Å; T269-Y287 WeakPolarHBondContact CA-O 3.45Å; T269-Y287 PolarHBondContact O-N 3.38Å
270	Q	92.9	Very high	93.4	Very high	47 Å²	47	30.4 Å²	30.4	22%	0.22	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162	158.7	-174.6	56.5	171.4	26.4	0	0	113.7	L267 I272 D283 F285	L267-Q270 HydrophobicContact CB-CG 4.45Å; L267-Q270 VanDerWaalsContact CB-O 3.31Å; L267-Q270 WeakPolarHBondContact CB-O 3.24Å; L267-Q270 HydrophobicContact CD1-CG 4.15Å; L267-Q270 PolarHBondContact N-O 2.75Å; Q270-I272 HydrophobicContact CG-CG2 4.09Å; Q270-I272 VanDerWaalsContact NE2-CG2 3.25Å; Q270-D283 PolarHBondContact NE2-OD1 2.92Å; Q270-F285 WeakPolarHBondContact CA-O 3.37Å
271	Y	95	Very high	93.4	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	138.6	164.8	-67.4	-87.1	0	0	0	111.1	L265 A266 L284 F285 Y287 I295 V296 L306 A307	L265-Y271 WeakPolarHBondContact O-CA 3.49Å; A266-Y271 HydrophobicContact CB-CD1 3.85Å; A266-Y271 HydrophobicContact CB-CE1 3.62Å; Y271-L284 WeakPolarHBondContact O-CB 3.48Å; Y271-L284 PolarHBondContact O-N 3.38Å; Y271-F285 AromaticContact CD2-CD2 3.8Å; Y271-F285 HydrophobicContact CD2-CD2 3.8Å; Y271-F285 AromaticContact CD2-CE2 3.3Å; Y271-F285 HydrophobicContact CD2-CE2 3.3Å; Y271-F285 HydrophobicContact CD2-CZ 4.01Å; Y271-F285 HydrophobicContact CE2-CD2 4.45Å; Y271-F285 AromaticContact CE2-CE2 3.71Å; Y271-F285 HydrophobicContact CE2-CE2 3.71Å; Y271-F285 HydrophobicContact CE2-CZ 4.48Å; Y271-F285 HydrophobicContact CG-CE2 4.16Å; Y271-F285 PolarHBondContact N-O 3.22Å; Y271-Y287 HydrophobicContact CD2-CG 4.15Å; Y271-Y287 VanDerWaalsContact CE2-CB 3.49Å; Y271-Y287 HydrophobicContact CE2-CD1 4.35Å; Y271-Y287 AromaticContact CE2-CD2 3.75Å; Y271-Y287 HydrophobicContact CE2-CD2 3.75Å; Y271-Y287 AromaticContact CE2-CG 3.58Å; Y271-Y287 HydrophobicContact CE2-CG 3.58Å; Y271-I295 PolarHBondContact OH-N 3.04Å; Y271-V296 HydrophobicContact CD1-CG2 4.05Å; Y271-V296 HydrophobicContact CE1-CG2 3.7Å; Y271-L306 HydrophobicContact CD1-CD1 4.33Å; Y271-L306 HydrophobicContact CD1-CD2 3.7Å; Y271-L306 HydrophobicContact CD1-CG 4.47Å; Y271-L306 HydrophobicContact CE1-CD2 3.88Å; Y271-L306 HydrophobicContact CG-CD1 4.29Å; Y271-L306 HydrophobicContact CG-CD2 4.44Å; Y271-A307 WeakPolarHBondContact CE2-O 3.37Å; Y271-A307 PolarHBondContact OH-O 3.12Å
272	I	95.2	Very high	93.4	Very high	5 Å²	5	34.1 Å²	34.1	3%	0.026	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	161	176	74	166.8	0	0	0	111.8	L265 L267 Q270 H274 Q282 D283	L265-I272 HydrophobicContact CB-CG1 3.83Å; L265-I272 HydrophobicContact CD1-CD1 4.06Å; L265-I272 HydrophobicContact CD1-CG1 4.06Å; L265-I272 HydrophobicContact CG-CG1 4.47Å; L265-I272 PolarHBondContact N-O 2.89Å; L265-I272 PolarHBondContact O-N 3.25Å; L267-I272 HydrophobicContact CD1-CD1 4.13Å; L267-I272 HydrophobicContact CD1-CG1 4.41Å; L267-I272 HydrophobicContact CD1-CG2 4.04Å; L267-I272 HydrophobicContact CG-CD1 4.5Å; L267-I272 HydrophobicContact CG-CG1 4.42Å; Q270-I272 HydrophobicContact CG-CG2 4.09Å; Q270-I272 VanDerWaalsContact NE2-CG2 3.25Å; I272-H274 HydrophobicContact CD1-CB 4.43Å; I272-Q282 CarbonylContact C-O 3.51Å; I272-Q282 WeakPolarHBondContact CA-O 3.3Å; I272-D283 HydrophobicContact CG2-CB 4.48Å; I272-D283 VanDerWaalsContact CG2-OD1 3.24Å; I272-D283 WeakPolarHBondContact CG2-OD1 3.34Å
273	I	96	Very high	93.3	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	128.5	162.7	-60	-179.3	0	0	0	108.2	F262 L263 S281 Q282 L284 T317	F262-I273 HydrophobicContact CD1-CG2 4.34Å; L263-I273 CarbonylContact O-C 3.57Å; L263-I273 WeakPolarHBondContact O-CA 3.45Å; I273-S281 CarbonylContact O-C 3.51Å; I273-S281 WeakPolarHBondContact O-CA 3.36Å; I273-Q282 PolarHBondContact N-O 3.22Å; I273-Q282 PolarHBondContact O-N 2.95Å; I273-L284 HydrophobicContact CD1-CD1 4.17Å; I273-L284 HydrophobicContact CD1-CD2 3.99Å; I273-L284 HydrophobicContact CG1-CD1 3.92Å; I273-L284 HydrophobicContact CG1-CD2 4.06Å; I273-L284 HydrophobicContact CG1-CG 4.22Å; I273-T317 WeakPolarHBondContact CD1-O 3.44Å
274	H	94.8	Very high	93.2	Very high	16 Å²	16	38 Å²	38	7%	0.074	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	128.4	178.7	-177.5	80.4	0	0	0	111	V247 L263 L265 I272 G279 V280 S281	V247-H274 WeakPolarHBondContact CG1-NE2 3.38Å; L263-H274 PolarHBondContact N-O 2.91Å; L263-H274 PolarHBondContact O-N 2.86Å; L265-H274 HydrophobicContact CD1-CB 4.05Å; I272-H274 HydrophobicContact CD1-CB 4.43Å; H274-G279 PolarHBondContact CE1-O 2.83Å; H274-V280 WeakPolarHBondContact CA-O 3.39Å; H274-S281 PolarHBondContact ND1-OG 2.91Å
275	N	94.2	Very high	92.9	Very high	16 Å²	16	39.9 Å²	39.9	9%	0.086	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	111.7	172.7	-178.5	-49.2	0	0	0	110	H261 F262 S277 T278 G279 V280	H261-N275 WeakPolarHBondContact O-CA 3.42Å; F262-N275 HydrophobicContact CD1-CB 3.93Å; F262-N275 HydrophobicContact CE1-CB 3.99Å; F262-N275 WeakPolarHBondContact CE1-ND2 3.34Å; F262-N275 WeakPolarHBondContact CZ-ND2 3.38Å; N275-S277 VanDerWaalsContact C-N 3.3Å; N275-S277 PolarHBondContact O-N 3.39Å; N275-S277 PolarHBondContact OD1-N 2.97Å; N275-S277 PolarHBondContact OD1-OG 3.4Å; N275-T278 WeakPolarHBondContact CB-OG1 3.47Å; N275-T278 VanDerWaalsContact CG-OG1 3.3Å; N275-T278 PolarHBondContact OD1-N 3.44Å; N275-T278 PolarHBondContact OD1-OG1 3.27Å; N275-G279 VanDerWaalsContact O-CA 3.29Å; N275-G279 WeakPolarHBondContact O-CA 3.49Å; N275-G279 PolarHBondContact O-N 3.36Å; N275-V280 PolarHBondContact N-O 3.01Å
276	Y	91.8	Very high	92.6	Very high	12 Å²	12	44.9 Å²	44.9	5%	0.047	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-9.4	-173.4	67.8	-92.7	0	0	0	114.9	V212 E220 M233 K245 G260 H261 L263	V212-Y276 VanDerWaalsContact CG2-OH 3.3Å; V212-Y276 WeakPolarHBondContact CG2-OH 3.36Å; E220-Y276 PolarHBondContact OE1-OH 3.24Å; M233-Y276 HydrophobicContact CE-CE1 4.02Å; M233-Y276 HydrophobicContact CG-CD2 4.06Å; M233-Y276 HydrophobicContact CG-CE1 4.48Å; M233-Y276 HydrophobicContact CG-CE2 4.02Å; M233-Y276 HydrophobicContact CG-CG 4.31Å; M233-Y276 HydrophobicContact SD-CE1 4.37Å; K245-Y276 HydrophobicContact CB-CD2 4.42Å; K245-Y276 WeakPolarHBondContact CE-O 3.46Å; K245-Y276 HydrophobicContact CG-CD2 4.26Å; K245-Y276 PolarHBondContact NZ-O 3.43Å; G260-Y276 WeakPolarHBondContact O-CE1 3.34Å; G260-Y276 PolarHBondContact O-OH 2.98Å; H261-Y276 VanDerWaalsContact C-CE1 3.47Å; H261-Y276 VanDerWaalsContact CA-CE1 3.47Å; H261-Y276 WeakPolarHBondContact O-CD1 3.42Å; H261-Y276 WeakPolarHBondContact O-CE1 3.42Å; H261-Y276 PolarHBondContact O-N 3.5Å; L263-Y276 HydrophobicContact CD1-CD1 4.33Å; L263-Y276 HydrophobicContact CD2-CD1 3.94Å; L263-Y276 HydrophobicContact CD2-CE1 4.19Å; L263-Y276 HydrophobicContact CG-CD1 3.93Å
277	S	92.3	Very high	92.2	Very high	62 Å²	62	46.1 Å²	46.1	43%	0.434	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-39.6	173.8	68.3	0	0	0	0	112.2	N275	N275-S277 VanDerWaalsContact C-N 3.3Å; N275-S277 PolarHBondContact O-N 3.39Å; N275-S277 PolarHBondContact OD1-N 2.97Å; N275-S277 PolarHBondContact OD1-OG 3.4Å
278	T	91.8	Very high	91.7	Very high	94 Å²	94	48.3 Å²	48.3	58%	0.577	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-21.4	176.7	65.7	0	0	0	0	114.1	N275 V280	N275-T278 WeakPolarHBondContact CB-OG1 3.47Å; N275-T278 VanDerWaalsContact CG-OG1 3.3Å; N275-T278 PolarHBondContact OD1-N 3.44Å; N275-T278 PolarHBondContact OD1-OG1 3.27Å; T278-V280 VanDerWaalsContact C-N 3.29Å; T278-V280 PolarHBondContact OG1-N 3.45Å
279	G	88.9	Confident	91.3	Very high	47 Å²	47	48.3 Å²	48.3	49%	0.485	29%	0.291	S	S	.	.			trans	78.6	5.7	-174.2	0	0	0	0	0	114.6	H274 N275	H274-G279 PolarHBondContact CE1-O 2.83Å; N275-G279 VanDerWaalsContact O-CA 3.29Å; N275-G279 WeakPolarHBondContact O-CA 3.49Å; N275-G279 PolarHBondContact O-N 3.36Å
280	V	92.5	Very high	90.7	Very high	92 Å²	92	53.9 Å²	53.9	56%	0.558	31%	0.312	S	S	*	.			trans	-77.9	128.6	-179.2	177.9	0	0	0	0	110.6	H274 N275 T278	H274-V280 WeakPolarHBondContact CA-O 3.39Å; N275-V280 PolarHBondContact N-O 3.01Å; T278-V280 VanDerWaalsContact C-N 3.29Å; T278-V280 PolarHBondContact OG1-N 3.45Å
281	S	92.8	Very high	89.9	Confident	64 Å²	64	58.2 Å²	58.2	45%	0.448	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	145.3	167.8	-60.8	0	0	0	0	110.8	I273 H274	I273-S281 CarbonylContact O-C 3.51Å; I273-S281 WeakPolarHBondContact O-CA 3.36Å; H274-S281 PolarHBondContact ND1-OG 2.91Å
282	Q	93.9	Very high	89.2	Confident	98 Å²	98	61.9 Å²	61.9	46%	0.458	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	117.7	170.1	175.2	58.2	64.4	0	0	108.3	I272 I273	I272-Q282 CarbonylContact C-O 3.51Å; I272-Q282 WeakPolarHBondContact CA-O 3.3Å; I273-Q282 PolarHBondContact N-O 3.22Å; I273-Q282 PolarHBondContact O-N 2.95Å
283	D	93.3	Very high	88.6	Confident	85 Å²	85	65 Å²	65	46%	0.455	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	146.8	174.3	-52.9	-57.7	0	0	0	110.4	Q270 I272	Q270-D283 PolarHBondContact NE2-OD1 2.92Å; I272-D283 HydrophobicContact CG2-CB 4.48Å; I272-D283 VanDerWaalsContact CG2-OD1 3.24Å; I272-D283 WeakPolarHBondContact CG2-OD1 3.34Å
284	L	92	Very high	88.4	Confident	38 Å²	38	66.5 Å²	66.5	20%	0.199	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	-70.6	-179.3	-57.4	-176.6	0	0	0	112.1	Y271 I273 L306 A316 G320	Y271-L284 WeakPolarHBondContact O-CB 3.48Å; Y271-L284 PolarHBondContact O-N 3.38Å; I273-L284 HydrophobicContact CD1-CD1 4.17Å; I273-L284 HydrophobicContact CD1-CD2 3.99Å; I273-L284 HydrophobicContact CG1-CD1 3.92Å; I273-L284 HydrophobicContact CG1-CD2 4.06Å; I273-L284 HydrophobicContact CG1-CG 4.22Å; L284-L306 HydrophobicContact CD1-CD1 3.33Å; L284-A316 HydrophobicContact CD1-CB 3.98Å; L284-G320 VanDerWaalsContact CD2-CA 3.49Å
285	F	90.7	Very high	88.3	Confident	39 Å²	39	66.2 Å²	66.2	17%	0.171	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	156.7	-179.7	49.8	-98.6	0	0	0	111.5	Q270 Y271 L306 M314	Q270-F285 WeakPolarHBondContact CA-O 3.37Å; Y271-F285 AromaticContact CD2-CD2 3.8Å; Y271-F285 HydrophobicContact CD2-CD2 3.8Å; Y271-F285 AromaticContact CD2-CE2 3.3Å; Y271-F285 HydrophobicContact CD2-CE2 3.3Å; Y271-F285 HydrophobicContact CD2-CZ 4.01Å; Y271-F285 HydrophobicContact CE2-CD2 4.45Å; Y271-F285 AromaticContact CE2-CE2 3.71Å; Y271-F285 HydrophobicContact CE2-CE2 3.71Å; Y271-F285 HydrophobicContact CE2-CZ 4.48Å; Y271-F285 HydrophobicContact CG-CE2 4.16Å; Y271-F285 PolarHBondContact N-O 3.22Å; F285-L306 HydrophobicContact CE1-CD1 4.06Å; F285-L306 HydrophobicContact CZ-CB 3.78Å; F285-L306 HydrophobicContact CZ-CD1 3.89Å; F285-M314 HydrophobicContact CE1-CB 3.88Å; F285-M314 HydrophobicContact CE1-CG 4.04Å; F285-M314 HydrophobicContact CZ-CB 3.86Å; F285-M314 HydrophobicContact CZ-CG 3.98Å
286	P	87.8	Confident	88.2	Confident	105 Å²	105	66.5 Å²	66.5	68%	0.682	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.9	155.1	178.2	-21.8	34.3	0	0	0	113.6	T269	T269-P286 WeakPolarHBondContact O-CA 3.4Å
287	Y	85.8	Confident	88.2	Confident	27 Å²	27	67.8 Å²	67.8	11%	0.106	38%	0.384	C	S	.	.			trans	-153.2	144.8	-179	159.1	-109.2	0	0	0	109.7	L254 A266 L267 T269 Y271 S289 R292 P294	L254-Y287 HydrophobicContact CD1-CE1 4.43Å; A266-Y287 HydrophobicContact CB-CE1 4.47Å; L267-Y287 WeakPolarHBondContact O-CD1 3.39Å; L267-Y287 WeakPolarHBondContact O-CE1 3.42Å; T269-Y287 CarbonylContact C-O 3.49Å; T269-Y287 WeakPolarHBondContact CA-O 3.45Å; T269-Y287 PolarHBondContact O-N 3.38Å; Y271-Y287 HydrophobicContact CD2-CG 4.15Å; Y271-Y287 VanDerWaalsContact CE2-CB 3.49Å; Y271-Y287 HydrophobicContact CE2-CD1 4.35Å; Y271-Y287 AromaticContact CE2-CD2 3.75Å; Y271-Y287 HydrophobicContact CE2-CD2 3.75Å; Y271-Y287 AromaticContact CE2-CG 3.58Å; Y271-Y287 HydrophobicContact CE2-CG 3.58Å; Y287-S289 WeakPolarHBondContact OH-CA 3.48Å; Y287-R292 WeakPolarHBondContact CE2-O 3.38Å; Y287-R292 PolarHBondContact OH-O 3.14Å; Y287-P294 HydrophobicContact CE1-CB 3.98Å; Y287-P294 HydrophobicContact CE2-CB 4.49Å; Y287-P294 WeakPolarHBondContact OH-CB 3.22Å; Y287-P294 VanDerWaalsContact OH-CD 3.24Å; Y287-P294 WeakPolarHBondContact OH-CD 3.43Å; Y287-P294 VanDerWaalsContact OH-N 3.15Å
288	C	82.3	Confident	88.2	Confident	45 Å²	45	66.9 Å²	66.9	30%	0.304	37%	0.371	S	S	.	.			trans	-114.2	108.2	-178.8	-172.3	0	0	0	0	110.7	E290 E291	C288-E290 PolarHBondContact O-N 3.3Å; C288-E291 HydrophobicContact CB-CB 4.2Å; C288-E291 HydrophobicContact CB-CG 3.98Å; C288-E291 WeakPolarHBondContact CB-OE1 3.27Å; C288-E291 PolarHBondContact O-N 3.43Å; C288-E291 PolarHBondContact SG-OE1 3.3Å; C288-E291 VanDerWaalsContact SG-OE1 3.36Å
289	S	81.3	Confident	88.1	Confident	46 Å²	46	64 Å²	64	32%	0.322	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-10.1	179.6	63.5	0	0	0	0	115.2	T268 Y287	T268-S289 PolarHBondContact O-N 3.07Å; T268-S289 PolarHBondContact O-OG 3.45Å; Y287-S289 WeakPolarHBondContact OH-CA 3.48Å
290	E	78.8	Confident	87.9	Confident	189 Å²	189	62.7 Å²	62.7	88%	0.883	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-20.5	174.2	-59.9	-170.7	168.5	0	0	112.5	C288	C288-E290 PolarHBondContact O-N 3.3Å
291	E	77.6	Confident	87.7	Confident	139 Å²	139	67.8 Å²	67.8	65%	0.65	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-46.3	-176.7	-71.7	169.7	-148.3	0	0	113.1	C288	C288-E291 HydrophobicContact CB-CB 4.2Å; C288-E291 HydrophobicContact CB-CG 3.98Å; C288-E291 WeakPolarHBondContact CB-OE1 3.27Å; C288-E291 PolarHBondContact O-N 3.43Å; C288-E291 PolarHBondContact SG-OE1 3.3Å; C288-E291 VanDerWaalsContact SG-OE1 3.36Å
292	R	78.8	Confident	87.7	Confident	77 Å²	77	69.3 Å²	69.3	29%	0.291	35%	0.347	S	S	.	.	S	Bend	trans	-148.6	147.5	-168.1	-58.1	179.7	-161.1	178.8	9.8	111.5	Y287 E331	Y287-R292 WeakPolarHBondContact CE2-O 3.38Å; Y287-R292 PolarHBondContact OH-O 3.14Å; R292-E331 VanDerWaalsContact CD-O 3.28Å; R292-E331 WeakPolarHBondContact CD-O 3.34Å; R292-E331 VanDerWaalsContact CZ-O 3.32Å; R292-E331 IonicContact CZ-OE2 3.23Å; R292-E331 VanDerWaalsContact CZ-OE2 3.23Å; R292-E331 PolarHBondContact NE-O 3.11Å; R292-E331 PolarHBondContact NH1-O 3.01Å; R292-E331 IonicContact NH1-OE2 2.82Å; R292-E331 PolarHBondContact NH1-OE2 3.01Å; R292-E331 IonicContact NH2-OE2 2.72Å; R292-E331 PolarHBondContact NH2-OE2 3.05Å
293	P	84.3	Confident	87.6	Confident	69 Å²	69	65.8 Å²	65.8	45%	0.448	33%	0.331	S	S	.	.			trans	-62.2	146.7	173.7	28	-35	0	0	0	111.3
294	P	90.4	Very high	87.6	Confident	36 Å²	36	61.8 Å²	61.8	23%	0.234	31%	0.309	C	S	.	.			trans	-77.8	127.9	-178.5	28.4	-31	0	0	0	111.1	L254 A255 A266 Y287	L254-P294 HydrophobicContact CB-CG 3.91Å; A255-P294 HydrophobicContact CB-CB 4.04Å; A255-P294 HydrophobicContact CB-CG 3.81Å; A266-P294 HydrophobicContact CB-CB 3.39Å; A266-P294 HydrophobicContact CB-CG 4.28Å; Y287-P294 HydrophobicContact CE1-CB 3.98Å; Y287-P294 HydrophobicContact CE2-CB 4.49Å; Y287-P294 WeakPolarHBondContact OH-CB 3.22Å; Y287-P294 VanDerWaalsContact OH-CD 3.24Å; Y287-P294 WeakPolarHBondContact OH-CD 3.43Å; Y287-P294 VanDerWaalsContact OH-N 3.15Å
295	I	92.1	Very high	87.7	Confident	10 Å²	10	60 Å²	60	5%	0.051	30%	0.3	C	S	.	.			trans	-104.3	114.5	174.8	-60	-178.4	0	0	0	108.5	Y271 L306 A307 V333 A336	Y271-I295 PolarHBondContact OH-N 3.04Å; I295-L306 WeakPolarHBondContact O-CA 3.44Å; I295-A307 HydrophobicContact CB-CB 3.89Å; I295-A307 HydrophobicContact CD1-CB 4.25Å; I295-A307 HydrophobicContact CG1-CB 4.21Å; I295-A307 PolarHBondContact O-N 3.04Å; I295-V333 HydrophobicContact CD1-CB 4.37Å; I295-V333 HydrophobicContact CD1-CG1 3.88Å; I295-V333 HydrophobicContact CD1-CG2 3.75Å; I295-A336 HydrophobicContact CG2-CB 3.87Å
296	V	93.8	Very high	87.9	Confident	22 Å²	22	58.1 Å²	58.1	13%	0.133	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	110.5	172.5	-171.9	0	0	0	0	108.8	A255 A257 C264 A266 Y271 L306	A255-V296 HydrophobicContact CB-CB 4.4Å; A255-V296 HydrophobicContact CB-CG2 4.01Å; A257-V296 HydrophobicContact CB-CG1 3.71Å; C264-V296 HydrophobicContact CB-CG1 3.93Å; A266-V296 HydrophobicContact CB-CG2 3.86Å; Y271-V296 HydrophobicContact CD1-CG2 4.05Å; Y271-V296 HydrophobicContact CE1-CG2 3.7Å; V296-L306 HydrophobicContact CB-CD2 4.18Å; V296-L306 HydrophobicContact CG1-CD2 3.94Å; V296-L306 HydrophobicContact CG2-CD2 3.96Å
297	K	92.1	Very high	88.1	Confident	39 Å²	39	54 Å²	54	17%	0.17	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	132	-179.4	-180	65.4	-170.2	-168.7	0	111.1	I299 F304 L305 D375	K297-I299 HydrophobicContact CG-CG2 4.4Å; K297-F304 CarbonylContact O-C 3.59Å; K297-F304 VanDerWaalsContact O-CA 3.32Å; K297-F304 WeakPolarHBondContact O-CA 3.34Å; K297-L305 PolarHBondContact N-O 3.35Å; K297-L305 PolarHBondContact O-N 3.37Å; K297-D375 WeakPolarHBondContact CE-OD1 3.41Å; K297-D375 WeakPolarHBondContact CE-OD2 3.44Å; K297-D375 IonicContact NZ-OD1 3.48Å; K297-D375 PolarHBondContact NZ-OD1 3.19Å; K297-D375 IonicContact NZ-OD2 2.74Å; K297-D375 PolarHBondContact NZ-OD2 2.91Å
298	R	91.6	Very high	88.2	Confident	44 Å²	44	53.1 Å²	53.1	17%	0.166	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	131.7	167.5	-179.5	-174.7	-179.1	-94.3	-0.1	109.2	E209 A257 D259 F304	E209-R298 WeakPolarHBondContact OE2-CD 3.3Å; E209-R298 IonicContact OE2-CZ 2.67Å; E209-R298 IonicContact OE2-NE 3.57Å; E209-R298 IonicContact OE2-NH1 2.68Å; E209-R298 PolarHBondContact OE2-NH1 2.99Å; A257-R298 HydrophobicContact CB-CB 4.36Å; D259-R298 IonicContact OD1-CZ 2.94Å; D259-R298 IonicContact OD1-NE 3.65Å; D259-R298 PolarHBondContact OD1-NE 3.24Å; D259-R298 IonicContact OD1-NH2 3.89Å; D259-R298 PolarHBondContact OD1-NH2 3.37Å; R298-F304 HydrophobicContact CB-CD1 4.22Å; R298-F304 HydrophobicContact CB-CE1 4.24Å; R298-F304 HydrophobicContact CG-CE1 4.49Å
299	I	88.5	Confident	88.3	Confident	33 Å²	33	55.3 Å²	55.3	17%	0.169	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	-11.7	-179.9	73	169.3	0	0	0	113.6	K297 E303 L305 F315 V338	K297-I299 HydrophobicContact CG-CG2 4.4Å; I299-E303 HydrophobicContact CD1-CG 3.92Å; I299-E303 HydrophobicContact CG1-CB 4.11Å; I299-E303 HydrophobicContact CG1-CG 3.81Å; I299-E303 WeakPolarHBondContact CG1-O 3.43Å; I299-E303 PolarHBondContact N-O 2.94Å; I299-L305 HydrophobicContact CG2-CB 3.5Å; I299-L305 HydrophobicContact CG2-CD2 4.46Å; I299-F315 HydrophobicContact CD1-CD1 3.47Å; I299-F315 VanDerWaalsContact CD1-CD1 3.47Å; I299-F315 HydrophobicContact CD1-CE1 3.78Å; I299-V338 HydrophobicContact CB-CG2 4.33Å; I299-V338 HydrophobicContact CG2-CB 4.45Å; I299-V338 HydrophobicContact CG2-CG2 3.6Å
300	G	86.5	Confident	88.5	Confident	19 Å²	19	55.7 Å²	55.7	20%	0.196	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.5	-178.3	177.8	0	0	0	0	0	110.8	Q302 E303	G300-Q302 PolarHBondContact O-N 2.83Å; G300-E303 PolarHBondContact N-O 2.91Å; G300-E303 PolarHBondContact O-N 2.97Å
301	R	88.5	Confident	89	Confident	199 Å²	199	46.8 Å²	46.8	75%	0.751	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	124.9	168.3	-72.8	-179.7	174	170.3	-1.3	108.6	E303	R301-E303 PolarHBondContact O-N 2.97Å; R301-E303 VanDerWaalsContact O-N 3.16Å
302	Q	90.8	Very high	89.6	Confident	97 Å²	97	42.1 Å²	42.1	45%	0.453	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	24.6	179	-59.5	-178.2	-1	0	0	115.2	D259 F262 G300 T317 V318	D259-Q302 PolarHBondContact OD2-N 3.05Å; F262-Q302 HydrophobicContact CD2-CG 4.47Å; G300-Q302 PolarHBondContact O-N 2.83Å; Q302-T317 VanDerWaalsContact O-CA 3.27Å; Q302-T317 WeakPolarHBondContact O-CA 3.35Å; Q302-V318 HydrophobicContact CB-CB 4.32Å; Q302-V318 HydrophobicContact CB-CG1 3.6Å; Q302-V318 HydrophobicContact CB-CG2 3.83Å; Q302-V318 HydrophobicContact CG-CG1 3.93Å; Q302-V318 HydrophobicContact CG-CG2 4.14Å; Q302-V318 PolarHBondContact O-N 3.48Å; Q302-V318 VanDerWaalsContact O-N 3.13Å
303	E	92.5	Very high	90.3	Very high	24 Å²	24	38.5 Å²	38.5	11%	0.112	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	128.3	-178.2	-164.1	-176.3	-158.5	0	0	111	I299 G300 R301 R324	I299-E303 HydrophobicContact CD1-CG 3.92Å; I299-E303 HydrophobicContact CG1-CB 4.11Å; I299-E303 HydrophobicContact CG1-CG 3.81Å; I299-E303 WeakPolarHBondContact CG1-O 3.43Å; I299-E303 PolarHBondContact N-O 2.94Å; G300-E303 PolarHBondContact N-O 2.91Å; G300-E303 PolarHBondContact O-N 2.97Å; R301-E303 PolarHBondContact O-N 2.97Å; R301-E303 VanDerWaalsContact O-N 3.16Å; E303-R324 IonicContact OE1-CZ 2.74Å; E303-R324 VanDerWaalsContact OE1-CZ 3.25Å; E303-R324 IonicContact OE1-NE 3.8Å; E303-R324 PolarHBondContact OE1-NE 3.05Å; E303-R324 IonicContact OE1-NH2 3.48Å; E303-R324 PolarHBondContact OE1-NH2 3.47Å; E303-R324 IonicContact OE2-CZ 2.93Å; E303-R324 IonicContact OE2-NE 3.35Å; E303-R324 IonicContact OE2-NH2 3.79Å; E303-R324 PolarHBondContact OE2-NH2 2.93Å
304	F	94.2	Very high	90.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	155.6	-175.6	-57	-85.5	0	0	0	111.6	A257 D259 C264 K297 R298 F315 A316 V318	A257-F304 HydrophobicContact CB-CD1 3.87Å; A257-F304 HydrophobicContact CB-CE1 3.85Å; D259-F304 HydrophobicContact CB-CE1 4.45Å; D259-F304 HydrophobicContact CB-CZ 3.96Å; C264-F304 HydrophobicContact CB-CB 4.22Å; C264-F304 HydrophobicContact CB-CD1 3.6Å; C264-F304 HydrophobicContact CB-CD2 3.74Å; C264-F304 HydrophobicContact CB-CE1 3.78Å; C264-F304 HydrophobicContact CB-CE2 3.91Å; C264-F304 HydrophobicContact CB-CG 3.57Å; C264-F304 HydrophobicContact CB-CZ 3.93Å; K297-F304 CarbonylContact O-C 3.59Å; K297-F304 VanDerWaalsContact O-CA 3.32Å; K297-F304 WeakPolarHBondContact O-CA 3.34Å; R298-F304 HydrophobicContact CB-CD1 4.22Å; R298-F304 HydrophobicContact CB-CE1 4.24Å; R298-F304 HydrophobicContact CG-CE1 4.49Å; F304-F315 WeakPolarHBondContact O-CA 3.36Å; F304-A316 PolarHBondContact N-O 3.01Å; F304-A316 PolarHBondContact O-N 2.83Å; F304-V318 HydrophobicContact CE2-CG1 4.08Å
305	L	94.3	Very high	90.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	134.6	172.3	170.7	66.2	0	0	0	109.2	K297 I299 M314 F315 W329 A336 V338 V343	K297-L305 PolarHBondContact N-O 3.35Å; K297-L305 PolarHBondContact O-N 3.37Å; I299-L305 HydrophobicContact CG2-CB 3.5Å; I299-L305 HydrophobicContact CG2-CD2 4.46Å; L305-M314 WeakPolarHBondContact CA-O 3.29Å; L305-F315 HydrophobicContact CD1-CD1 4.15Å; L305-F315 HydrophobicContact CD1-CE1 3.9Å; L305-F315 HydrophobicContact CD1-CZ 4.44Å; L305-W329 HydrophobicContact CD1-CH2 3.9Å; L305-W329 HydrophobicContact CD1-CZ3 4.1Å; L305-W329 HydrophobicContact CD2-CH2 4.26Å; L305-W329 HydrophobicContact CD2-CZ3 4.13Å; L305-W329 HydrophobicContact CG-CH2 4.13Å; L305-W329 HydrophobicContact CG-CZ3 4.42Å; L305-A336 HydrophobicContact CD2-CB 4.12Å; L305-V338 HydrophobicContact CD2-CG2 4.07Å; L305-V343 HydrophobicContact CD2-CG1 3.76Å; L305-V343 HydrophobicContact CD2-CG2 4.08Å
306	L	94.1	Very high	90.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	150.4	-173	-61.2	176.5	0	0	0	111.9	Y271 L284 F285 I295 V296 G308 M314 A316	Y271-L306 HydrophobicContact CD1-CD1 4.33Å; Y271-L306 HydrophobicContact CD1-CD2 3.7Å; Y271-L306 HydrophobicContact CD1-CG 4.47Å; Y271-L306 HydrophobicContact CE1-CD2 3.88Å; Y271-L306 HydrophobicContact CG-CD1 4.29Å; Y271-L306 HydrophobicContact CG-CD2 4.44Å; L284-L306 HydrophobicContact CD1-CD1 3.33Å; F285-L306 HydrophobicContact CE1-CD1 4.06Å; F285-L306 HydrophobicContact CZ-CB 3.78Å; F285-L306 HydrophobicContact CZ-CD1 3.89Å; I295-L306 WeakPolarHBondContact O-CA 3.44Å; V296-L306 HydrophobicContact CB-CD2 4.18Å; V296-L306 HydrophobicContact CG1-CD2 3.94Å; V296-L306 HydrophobicContact CG2-CD2 3.96Å; L306-G308 PolarHBondContact O-N 3.25Å; L306-M314 HydrophobicContact CB-CB 4.45Å; L306-M314 PolarHBondContact N-O 3.38Å; L306-M314 PolarHBondContact O-N 2.72Å; L306-A316 HydrophobicContact CD1-CB 4.01Å
307	A	91.7	Very high	90.9	Very high	18 Å²	18	35.2 Å²	35.2	15%	0.149	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	103.1	167.1	0	0	0	0	0	110.9	Y271 I295 W329	Y271-A307 WeakPolarHBondContact CE2-O 3.37Å; Y271-A307 PolarHBondContact OH-O 3.12Å; I295-A307 HydrophobicContact CB-CB 3.89Å; I295-A307 HydrophobicContact CD1-CB 4.25Å; I295-A307 HydrophobicContact CG1-CB 4.21Å; I295-A307 PolarHBondContact O-N 3.04Å; A307-W329 HydrophobicContact CB-CZ2 4.27Å
308	G	87.9	Confident	90.9	Very high	9 Å²	9	34.6 Å²	34.6	9%	0.093	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	167.8	171	0	0	0	0	0	113.5	L306 L312	L306-G308 PolarHBondContact O-N 3.25Å; G308-L312 WeakPolarHBondContact CA-O 3.44Å; G308-L312 PolarHBondContact N-O 2.73Å
309	P	85.6	Confident	90.9	Very high	91 Å²	91	35.6 Å²	35.6	59%	0.591	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	149	-179.6	27.2	-35.6	0	0	0	112.1	L312	P309-L312 WeakPolarHBondContact O-CG 3.22Å
310	G	85.4	Confident	90.9	Very high	54 Å²	54	35.3 Å²	35.3	56%	0.557	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.6	31	174.2	0	0	0	0	0	115.3
311	G	87.6	Confident	91	Very high	3 Å²	3	39.3 Å²	39.3	3%	0.031	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	31	177.6	0	0	0	0	0	114.2	W329	G311-W329 PolarHBondContact O-N 3.11Å
312	L	91.1	Very high	91	Very high	41 Å²	41	32.4 Å²	32.4	22%	0.215	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	124	-179.5	-64.5	178.8	0	0	0	112.2	G308 P309 M314 P326	G308-L312 WeakPolarHBondContact CA-O 3.44Å; G308-L312 PolarHBondContact N-O 2.73Å; P309-L312 WeakPolarHBondContact O-CG 3.22Å; L312-M314 HydrophobicContact CB-CG 4.31Å; L312-M314 HydrophobicContact CB-SD 4.14Å; L312-M314 HydrophobicContact CD1-SD 4.41Å; L312-M314 PolarHBondContact O-N 2.83Å; L312-P326 HydrophobicContact CB-CB 4.46Å; L312-P326 HydrophobicContact CD2-CB 4.47Å; L312-P326 HydrophobicContact CD2-CG 4.38Å
313	G	92.7	Very high	90.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	100.1	163.9	0	0	0	0	0	110	P326 V327	G313-P326 VanDerWaalsContact O-CA 3.3Å; G313-P326 WeakPolarHBondContact O-CA 3.38Å; G313-P326 WeakPolarHBondContact O-CB 3.47Å; G313-V327 PolarHBondContact N-O 3.35Å; G313-V327 PolarHBondContact O-N 3.14Å; G313-V327 VanDerWaalsContact O-N 3.12Å
314	M	92.3	Very high	90.4	Very high	47 Å²	47	36.2 Å²	36.2	23%	0.232	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	129.2	-175.6	-67.5	-62	-64.1	0	0	111.1	F285 L305 L306 L312 P326	F285-M314 HydrophobicContact CE1-CB 3.88Å; F285-M314 HydrophobicContact CE1-CG 4.04Å; F285-M314 HydrophobicContact CZ-CB 3.86Å; F285-M314 HydrophobicContact CZ-CG 3.98Å; L305-M314 WeakPolarHBondContact CA-O 3.29Å; L306-M314 HydrophobicContact CB-CB 4.45Å; L306-M314 PolarHBondContact N-O 3.38Å; L306-M314 PolarHBondContact O-N 2.72Å; L312-M314 HydrophobicContact CB-CG 4.31Å; L312-M314 HydrophobicContact CB-SD 4.14Å; L312-M314 HydrophobicContact CD1-SD 4.41Å; L312-M314 PolarHBondContact O-N 2.83Å; M314-P326 HydrophobicContact SD-CB 3.67Å; M314-P326 HydrophobicContact SD-CG 4.14Å
315	F	93.4	Very high	90.1	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.018	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	128.9	171.8	-58.1	-72.1	0	0	0	109.7	I299 F304 L305 S322 R324 A325 V327 V343 M356	I299-F315 HydrophobicContact CD1-CD1 3.47Å; I299-F315 VanDerWaalsContact CD1-CD1 3.47Å; I299-F315 HydrophobicContact CD1-CE1 3.78Å; F304-F315 WeakPolarHBondContact O-CA 3.36Å; L305-F315 HydrophobicContact CD1-CD1 4.15Å; L305-F315 HydrophobicContact CD1-CE1 3.9Å; L305-F315 HydrophobicContact CD1-CZ 4.44Å; F315-S322 WeakPolarHBondContact O-CA 3.19Å; F315-S322 WeakPolarHBondContact O-CB 3.39Å; F315-S322 PolarHBondContact O-OG 3.49Å; F315-S322 VanDerWaalsContact O-OG 3.08Å; F315-R324 HydrophobicContact CB-CB 4.35Å; F315-R324 HydrophobicContact CD2-CB 3.69Å; F315-R324 HydrophobicContact CD2-CG 4.48Å; F315-R324 HydrophobicContact CE2-CB 4.31Å; F315-R324 HydrophobicContact CG-CB 4.16Å; F315-A325 WeakPolarHBondContact CD2-O 3.32Å; F315-A325 WeakPolarHBondContact CE2-O 3.08Å; F315-V327 HydrophobicContact CE2-CG1 4.16Å; F315-V327 HydrophobicContact CZ-CG1 4.09Å; F315-V327 HydrophobicContact CZ-CG2 4.46Å; F315-V343 HydrophobicContact CE1-CG2 4.19Å; F315-V343 HydrophobicContact CZ-CG2 4.18Å; F315-M356 HydrophobicContact CE1-CG 4.32Å; F315-M356 HydrophobicContact CE1-SD 4.23Å; F315-M356 HydrophobicContact CZ-CG 4.06Å
316	A	94.3	Very high	90	Very high	5 Å²	5	40.4 Å²	40.4	4%	0.041	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	126.3	-178.8	0	0	0	0	0	110.9	L284 F304 L306	L284-A316 HydrophobicContact CD1-CB 3.98Å; F304-A316 PolarHBondContact N-O 3.01Å; F304-A316 PolarHBondContact O-N 2.83Å; L306-A316 HydrophobicContact CD1-CB 4.01Å
317	T	94.4	Very high	89.9	Confident	13 Å²	13	40.4 Å²	40.4	8%	0.08	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	164.2	169.4	64.2	0	0	0	0	111.1	I273 Q302 A319 G320 I321 Q323	I273-T317 WeakPolarHBondContact CD1-O 3.44Å; Q302-T317 VanDerWaalsContact O-CA 3.27Å; Q302-T317 WeakPolarHBondContact O-CA 3.35Å; T317-A319 PolarHBondContact O-N 3.34Å; T317-G320 PolarHBondContact O-N 2.97Å; T317-I321 WeakPolarHBondContact CB-O 3.27Å; T317-I321 PolarHBondContact N-O 3.43Å; T317-I321 WeakPolarHBondContact OG1-CG1 3.42Å; T317-I321 PolarHBondContact OG1-O 2.95Å; T317-Q323 HydrophobicContact CG2-CG 3.81Å
318	V	92.2	Very high	89.9	Confident	25 Å²	25	45.4 Å²	45.4	15%	0.152	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-15.4	179	-63.8	0	0	0	0	115.7	F262 Q302 F304 G320	F262-V318 HydrophobicContact CB-CB 4.46Å; F262-V318 HydrophobicContact CB-CG1 3.62Å; F262-V318 HydrophobicContact CD1-CB 3.66Å; F262-V318 HydrophobicContact CD1-CG1 3.76Å; F262-V318 HydrophobicContact CD1-CG2 4.47Å; F262-V318 HydrophobicContact CD2-CB 4.22Å; F262-V318 HydrophobicContact CD2-CG1 3.71Å; F262-V318 HydrophobicContact CE1-CB 3.8Å; F262-V318 HydrophobicContact CE1-CG1 4.29Å; F262-V318 HydrophobicContact CE1-CG2 4.16Å; F262-V318 HydrophobicContact CE2-CB 4.36Å; F262-V318 HydrophobicContact CE2-CG1 4.26Å; F262-V318 HydrophobicContact CE2-CG2 4.28Å; F262-V318 HydrophobicContact CG-CB 3.87Å; F262-V318 HydrophobicContact CG-CG1 3.42Å; F262-V318 VanDerWaalsContact CG-CG1 3.42Å; F262-V318 HydrophobicContact CZ-CB 4.15Å; F262-V318 HydrophobicContact CZ-CG2 4.07Å; Q302-V318 HydrophobicContact CB-CB 4.32Å; Q302-V318 HydrophobicContact CB-CG1 3.6Å; Q302-V318 HydrophobicContact CB-CG2 3.83Å; Q302-V318 HydrophobicContact CG-CG1 3.93Å; Q302-V318 HydrophobicContact CG-CG2 4.14Å; Q302-V318 PolarHBondContact O-N 3.48Å; Q302-V318 VanDerWaalsContact O-N 3.13Å; F304-V318 HydrophobicContact CE2-CG1 4.08Å; V318-G320 VanDerWaalsContact C-N 3.32Å
319	A	91.1	Very high	90.1	Very high	65 Å²	65	46 Å²	46	54%	0.537	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	7.5	173.8	0	0	0	0	0	113.5	T317 I321	T317-A319 PolarHBondContact O-N 3.34Å; A319-I321 HydrophobicContact CB-CG1 4.32Å; A319-I321 PolarHBondContact O-N 3.37Å
320	G	88.3	Confident	90.2	Very high	28 Å²	28	43 Å²	43	29%	0.289	26%	0.259	S	S	.	.	S	Bend	trans	77.2	-3.3	-178.3	0	0	0	0	0	115.5	L284 T317 V318	L284-G320 VanDerWaalsContact CD2-CA 3.49Å; T317-G320 PolarHBondContact O-N 2.97Å; V318-G320 VanDerWaalsContact C-N 3.32Å
321	I	89.3	Confident	90.3	Very high	103 Å²	103	44.9 Å²	44.9	53%	0.528	25%	0.254	S	S	.	.			trans	-95.8	147.1	-179.9	64.8	177.6	0	0	0	111.8	T317 A319	T317-I321 WeakPolarHBondContact CB-O 3.27Å; T317-I321 PolarHBondContact N-O 3.43Å; T317-I321 WeakPolarHBondContact OG1-CG1 3.42Å; T317-I321 PolarHBondContact OG1-O 2.95Å; A319-I321 HydrophobicContact CB-CG1 4.32Å; A319-I321 PolarHBondContact O-N 3.37Å
322	S	87.6	Confident	90.2	Very high	53 Å²	53	49.4 Å²	49.4	37%	0.371	28%	0.277	S	S	.	.			trans	-83	142.3	164.9	-173.3	0	0	0	0	111.1	F315 R324	F315-S322 WeakPolarHBondContact O-CA 3.19Å; F315-S322 WeakPolarHBondContact O-CB 3.39Å; F315-S322 PolarHBondContact O-OG 3.49Å; F315-S322 VanDerWaalsContact O-OG 3.08Å; S322-R324 PolarHBondContact OG-N 3.46Å; S322-R324 PolarHBondContact OG-O 3.14Å
323	Q	85.4	Confident	90.2	Very high	147 Å²	147	47.9 Å²	47.9	69%	0.687	27%	0.27	S	S	*	.	S	Bend	trans	-102.4	0.4	167.7	-67.4	-176.1	3.7	0	0	113	T317	T317-Q323 HydrophobicContact CG2-CG 3.81Å
324	R	85.1	Confident	90.1	Very high	55 Å²	55	51 Å²	51	21%	0.208	29%	0.285	C	S	.	.	S	Bend	trans	-138	151.2	-174.1	-49.5	-173.5	-163.3	-159	13.8	110.9	E303 F315 S322	E303-R324 IonicContact OE1-CZ 2.74Å; E303-R324 VanDerWaalsContact OE1-CZ 3.25Å; E303-R324 IonicContact OE1-NE 3.8Å; E303-R324 PolarHBondContact OE1-NE 3.05Å; E303-R324 IonicContact OE1-NH2 3.48Å; E303-R324 PolarHBondContact OE1-NH2 3.47Å; E303-R324 IonicContact OE2-CZ 2.93Å; E303-R324 IonicContact OE2-NE 3.35Å; E303-R324 IonicContact OE2-NH2 3.79Å; E303-R324 PolarHBondContact OE2-NH2 2.93Å; F315-R324 HydrophobicContact CB-CB 4.35Å; F315-R324 HydrophobicContact CD2-CB 3.69Å; F315-R324 HydrophobicContact CD2-CG 4.48Å; F315-R324 HydrophobicContact CE2-CB 4.31Å; F315-R324 HydrophobicContact CG-CB 4.16Å; S322-R324 PolarHBondContact OG-N 3.46Å; S322-R324 PolarHBondContact OG-O 3.14Å
325	A	88.4	Confident	90	Very high	51 Å²	51	49.4 Å²	49.4	42%	0.421	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-65.2	144.8	166.2	0	0	0	0	0	109.8	F315 Q359	F315-A325 WeakPolarHBondContact CD2-O 3.32Å; F315-A325 WeakPolarHBondContact CE2-O 3.08Å; A325-Q359 HydrophobicContact CB-CG 3.88Å; A325-Q359 VanDerWaalsContact O-CG 3.29Å; A325-Q359 WeakPolarHBondContact O-CG 3.47Å
326	P	91.3	Very high	90	Very high	37 Å²	37	49.7 Å²	49.7	24%	0.24	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-69.4	149.6	179.6	29.2	-34.8	0	0	0	111.7	L312 G313 M314	L312-P326 HydrophobicContact CB-CB 4.46Å; L312-P326 HydrophobicContact CD2-CB 4.47Å; L312-P326 HydrophobicContact CD2-CG 4.38Å; G313-P326 VanDerWaalsContact O-CA 3.3Å; G313-P326 WeakPolarHBondContact O-CA 3.38Å; G313-P326 WeakPolarHBondContact O-CB 3.47Å; M314-P326 HydrophobicContact SD-CB 3.67Å; M314-P326 HydrophobicContact SD-CG 4.14Å
327	V	92.8	Very high	90	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	145.6	167.4	-67	0	0	0	0	109.5	G313 F315 W329 H354	G313-V327 PolarHBondContact N-O 3.35Å; G313-V327 PolarHBondContact O-N 3.14Å; G313-V327 VanDerWaalsContact O-N 3.12Å; F315-V327 HydrophobicContact CE2-CG1 4.16Å; F315-V327 HydrophobicContact CZ-CG1 4.09Å; F315-V327 HydrophobicContact CZ-CG2 4.46Å; V327-W329 HydrophobicContact CG2-CD2 4.48Å; V327-W329 HydrophobicContact CG2-CE3 3.87Å; V327-W329 HydrophobicContact CG2-CZ3 4.22Å; V327-H354 HydrophobicContact CB-CB 4.09Å; V327-H354 HydrophobicContact CG1-CB 3.93Å
328	H	91.3	Very high	89.8	Confident	123 Å²	123	49.6 Å²	49.6	57%	0.569	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	120.5	174.2	-64.9	60.8	0	0	0	108	H354	H328-H354 PolarHBondContact O-CE1 3.07Å; H328-H354 PolarHBondContact O-ND1 2.91Å
329	W	92.2	Very high	89.6	Confident	20 Å²	20	49.3 Å²	49.3	8%	0.076	28%	0.282	C	S	.	.			trans	-128.8	-176.8	-178.9	57.4	31.6	0	0	0	110.7	L305 A307 G311 V327 V333 A336 V343 A345 H354	L305-W329 HydrophobicContact CD1-CH2 3.9Å; L305-W329 HydrophobicContact CD1-CZ3 4.1Å; L305-W329 HydrophobicContact CD2-CH2 4.26Å; L305-W329 HydrophobicContact CD2-CZ3 4.13Å; L305-W329 HydrophobicContact CG-CH2 4.13Å; L305-W329 HydrophobicContact CG-CZ3 4.42Å; A307-W329 HydrophobicContact CB-CZ2 4.27Å; G311-W329 PolarHBondContact O-N 3.11Å; V327-W329 HydrophobicContact CG2-CD2 4.48Å; V327-W329 HydrophobicContact CG2-CE3 3.87Å; V327-W329 HydrophobicContact CG2-CZ3 4.22Å; W329-V333 HydrophobicContact CZ2-CG1 4.3Å; W329-A336 HydrophobicContact CH2-CB 3.97Å; W329-A336 HydrophobicContact CZ3-CB 3.91Å; W329-V343 HydrophobicContact CE3-CG1 4.16Å; W329-V343 HydrophobicContact CZ3-CG1 3.75Å; W329-A345 HydrophobicContact CB-CB 4.25Å; W329-A345 HydrophobicContact CD2-CB 4.28Å; W329-A345 HydrophobicContact CE3-CB 3.83Å; W329-A345 HydrophobicContact CZ3-CB 4.48Å; W329-H354 VanDerWaalsContact CB-NE2 3.26Å; W329-H354 WeakPolarHBondContact CB-NE2 3.39Å
330	S	88.4	Confident	89.3	Confident	28 Å²	28	49.1 Å²	49.1	20%	0.196	27%	0.27	C	S	.	.			trans	-61.1	146.8	176.4	-176.7	0	0	0	0	111.7	N332 D347	S330-N332 VanDerWaalsContact C-N 3.27Å; S330-N332 PolarHBondContact O-N 3.35Å; S330-N332 PolarHBondContact OG-N 3.25Å; S330-D347 WeakPolarHBondContact CB-OD2 3.2Å; S330-D347 VanDerWaalsContact OG-CG 3.24Å; S330-D347 PolarHBondContact OG-OD1 3.29Å; S330-D347 PolarHBondContact OG-OD2 3.25Å
331	E	86.6	Confident	89.3	Confident	94 Å²	94	48 Å²	48	44%	0.439	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-32.1	172.1	-75.2	-138.9	-128.8	0	0	112.4	R292 V333	R292-E331 VanDerWaalsContact CD-O 3.28Å; R292-E331 WeakPolarHBondContact CD-O 3.34Å; R292-E331 VanDerWaalsContact CZ-O 3.32Å; R292-E331 IonicContact CZ-OE2 3.23Å; R292-E331 VanDerWaalsContact CZ-OE2 3.23Å; R292-E331 PolarHBondContact NE-O 3.11Å; R292-E331 PolarHBondContact NH1-O 3.01Å; R292-E331 IonicContact NH1-OE2 2.82Å; R292-E331 PolarHBondContact NH1-OE2 3.01Å; R292-E331 IonicContact NH2-OE2 2.72Å; R292-E331 PolarHBondContact NH2-OE2 3.05Å; E331-V333 VanDerWaalsContact C-N 3.26Å; E331-V333 PolarHBondContact O-N 3.44Å
332	N	87.2	Confident	89.4	Confident	99 Å²	99	43.7 Å²	43.7	53%	0.529	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	17.1	-175.3	-61.9	-19.5	0	0	0	113.8	S330 I334 D347	S330-N332 VanDerWaalsContact C-N 3.27Å; S330-N332 PolarHBondContact O-N 3.35Å; S330-N332 PolarHBondContact OG-N 3.25Å; N332-I334 WeakPolarHBondContact O-CG1 3.29Å; N332-I334 PolarHBondContact O-N 3.11Å; N332-D347 WeakPolarHBondContact CB-OD2 3.34Å
333	V	90.6	Very high	89.6	Confident	9 Å²	9	41.1 Å²	41.1	6%	0.055	22%	0.217	C	C	.	.			trans	-53.6	120.9	-175	61.7	0	0	0	0	112.4	I295 W329 E331 G335 A345 L346 D347	I295-V333 HydrophobicContact CD1-CB 4.37Å; I295-V333 HydrophobicContact CD1-CG1 3.88Å; I295-V333 HydrophobicContact CD1-CG2 3.75Å; W329-V333 HydrophobicContact CZ2-CG1 4.3Å; E331-V333 VanDerWaalsContact C-N 3.26Å; E331-V333 PolarHBondContact O-N 3.44Å; V333-G335 WeakPolarHBondContact CG2-O 3.42Å; V333-A345 HydrophobicContact CG2-CB 3.89Å; V333-L346 CarbonylContact C-O 3.53Å; V333-L346 WeakPolarHBondContact CA-O 3.39Å; V333-D347 PolarHBondContact N-OD2 3.29Å
334	I	90.1	Very high	90.1	Very high	64 Å²	64	34.1 Å²	34.1	33%	0.328	18%	0.184	S	C	.	.			trans	-89	-31.5	-176.1	-53.3	178.3	0	0	0	110.5	N332 L346 D348	N332-I334 WeakPolarHBondContact O-CG1 3.29Å; N332-I334 PolarHBondContact O-N 3.11Å; I334-L346 PolarHBondContact N-O 2.98Å; I334-D348 HydrophobicContact CD1-CB 4.17Å
335	G	90.9	Very high	90.5	Very high	14 Å²	14	31.6 Å²	31.6	14%	0.144	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	164.2	178.4	0	0	0	0	0	113	V333 L346	V333-G335 WeakPolarHBondContact CG2-O 3.42Å; G335-L346 PolarHBondContact O-N 3.41Å
336	A	93.7	Very high	90.8	Very high	11 Å²	11	29.2 Å²	29.2	9%	0.091	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	142.9	176.7	0	0	0	0	0	111.6	I295 L305 W329 I344	I295-A336 HydrophobicContact CG2-CB 3.87Å; L305-A336 HydrophobicContact CD2-CB 4.12Å; W329-A336 HydrophobicContact CH2-CB 3.97Å; W329-A336 HydrophobicContact CZ3-CB 3.91Å; A336-I344 CarbonylContact C-O 3.6Å; A336-I344 VanDerWaalsContact CA-O 3.27Å; A336-I344 WeakPolarHBondContact CA-O 3.47Å
337	A	93.2	Very high	90.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	160.5	176.4	0	0	0	0	0	110.5	I344 L373 D375 V380	A337-I344 PolarHBondContact N-O 3.18Å; A337-I344 PolarHBondContact O-N 2.84Å; A337-L373 HydrophobicContact CB-CD1 3.81Å; A337-L373 HydrophobicContact CB-CD2 4.07Å; A337-L373 HydrophobicContact CB-CG 3.67Å; A337-D375 VanDerWaalsContact CA-OD1 3.25Å; A337-D375 WeakPolarHBondContact CA-OD1 3.4Å; A337-D375 HydrophobicContact CB-CB 4.09Å; A337-D375 VanDerWaalsContact CB-OD1 3.31Å; A337-D375 WeakPolarHBondContact CB-OD1 3.37Å; A337-V380 HydrophobicContact CB-CG1 3.85Å
338	V	90.2	Very high	90.5	Very high	16 Å²	16	32 Å²	32	10%	0.097	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	131.8	-176.2	-179.4	0	0	0	0	112.1	I299 L305 V343 M356 D375	I299-V338 HydrophobicContact CB-CG2 4.33Å; I299-V338 HydrophobicContact CG2-CB 4.45Å; I299-V338 HydrophobicContact CG2-CG2 3.6Å; L305-V338 HydrophobicContact CD2-CG2 4.07Å; V338-V343 HydrophobicContact CG2-CG2 4.23Å; V338-M356 HydrophobicContact CG1-CE 3.61Å; V338-M356 HydrophobicContact CG1-SD 4.35Å; V338-D375 PolarHBondContact N-OD1 3.36Å; V338-D375 WeakPolarHBondContact O-CB 3.39Å
339	S	89.3	Confident	90.4	Very high	18 Å²	18	30.8 Å²	30.8	13%	0.126	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	91.5	171.7	-174.1	0	0	0	0	107.8	Y342 G378	S339-Y342 CarbonylContact C-O 3.59Å; S339-Y342 PolarHBondContact N-O 2.91Å; S339-Y342 WeakPolarHBondContact O-CA 3.44Å; S339-Y342 PolarHBondContact O-N 3.13Å; S339-G378 PolarHBondContact OG-O 3.16Å
340	F	84.5	Confident	90.4	Very high	61 Å²	61	32.6 Å²	32.6	27%	0.268	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	127.9	-166.9	180	-84.5	0	0	0	112.1	M356 R421	F340-M356 HydrophobicContact CB-CE 4.17Å; F340-M356 HydrophobicContact CD2-CE 3.68Å; F340-M356 HydrophobicContact CG-CE 4.31Å; F340-R421 HydrophobicContact CE1-CB 4.43Å; F340-R421 HydrophobicContact CE1-CG 4.47Å
341	P	87.1	Confident	90.8	Very high	4 Å²	4	31.3 Å²	31.3	3%	0.026	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	cis	-91	11.8	16.4	35.6	-37.5	0	0	0	116.9	M356 L357 L415	P341-M356 VanDerWaalsContact C-CE 3.44Å; P341-M356 VanDerWaalsContact O-CB 3.27Å; P341-M356 WeakPolarHBondContact O-CB 3.38Å; P341-M356 WeakPolarHBondContact O-CE 3.3Å; P341-M356 WeakPolarHBondContact O-CG 3.43Å; P341-M356 PolarHBondContact O-N 2.95Å; P341-L357 HydrophobicContact CB-CD1 3.83Å; P341-L357 HydrophobicContact CB-CD2 4.32Å; P341-L357 HydrophobicContact CB-CG 3.9Å; P341-L357 HydrophobicContact CG-CD1 4.3Å; P341-L415 HydrophobicContact CG-CD1 3.8Å
342	Y	91	Very high	91.1	Very high	13 Å²	13	27 Å²	27	5%	0.051	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	147.2	-172.4	-51.6	-80.3	0	0	0	114.4	A89 F90 S339 V353 H354 K362 Q399 L415	A89-Y342 HydrophobicContact CB-CD1 4.45Å; A89-Y342 HydrophobicContact CB-CE1 4.05Å; A89-Y342 HydrophobicContact CB-CE2 4.18Å; F90-Y342 AromaticContact CE2-CD2 3.75Å; F90-Y342 HydrophobicContact CE2-CD2 3.75Å; F90-Y342 AromaticContact CE2-CG 3.92Å; F90-Y342 HydrophobicContact CE2-CG 3.92Å; F90-Y342 HydrophobicContact CZ-CD2 4.02Å; F90-Y342 HydrophobicContact CZ-CG 4.47Å; S339-Y342 CarbonylContact C-O 3.59Å; S339-Y342 PolarHBondContact N-O 2.91Å; S339-Y342 WeakPolarHBondContact O-CA 3.44Å; S339-Y342 PolarHBondContact O-N 3.13Å; Y342-V353 HydrophobicContact CD1-CG1 3.77Å; Y342-V353 HydrophobicContact CG-CG1 3.89Å; Y342-H354 CarbonylContact C-O 3.55Å; Y342-H354 VanDerWaalsContact CA-O 3.28Å; Y342-H354 WeakPolarHBondContact CA-O 3.43Å; Y342-K362 HydrophobicContact CE1-CG 4.38Å; Y342-Q399 PolarHBondContact OH-OE1 2.67Å; Y342-L415 WeakPolarHBondContact OH-CD1 3.29Å
343	V	92.8	Very high	91.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	129.6	160.4	170.9	0	0	0	0	107.6	L305 F315 W329 V338 H354 M356	L305-V343 HydrophobicContact CD2-CG1 3.76Å; L305-V343 HydrophobicContact CD2-CG2 4.08Å; F315-V343 HydrophobicContact CE1-CG2 4.19Å; F315-V343 HydrophobicContact CZ-CG2 4.18Å; W329-V343 HydrophobicContact CE3-CG1 4.16Å; W329-V343 HydrophobicContact CZ3-CG1 3.75Å; V338-V343 HydrophobicContact CG2-CG2 4.23Å; V343-H354 PolarHBondContact N-O 3.26Å; V343-H354 PolarHBondContact O-N 3.48Å; V343-M356 HydrophobicContact CG2-CG 3.59Å; V343-M356 HydrophobicContact CG2-SD 3.93Å
344	I	95.2	Very high	91.6	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	131.4	174	-59.7	76.9	0	0	0	106.8	F90 A336 A337 I351 T352 L373 V380 L391	F90-I344 HydrophobicContact CE2-CD1 4.31Å; F90-I344 HydrophobicContact CE2-CG1 4.47Å; F90-I344 HydrophobicContact CZ-CD1 4.1Å; A336-I344 CarbonylContact C-O 3.6Å; A336-I344 VanDerWaalsContact CA-O 3.27Å; A336-I344 WeakPolarHBondContact CA-O 3.47Å; A337-I344 PolarHBondContact N-O 3.18Å; A337-I344 PolarHBondContact O-N 2.84Å; I344-I351 HydrophobicContact CG2-CG2 3.41Å; I344-I351 VanDerWaalsContact CG2-CG2 3.41Å; I344-T352 WeakPolarHBondContact CA-O 3.43Å; I344-L373 HydrophobicContact CB-CD2 4.38Å; I344-L373 HydrophobicContact CG2-CD1 4.07Å; I344-L373 HydrophobicContact CG2-CD2 3.92Å; I344-V380 HydrophobicContact CD1-CG2 4.09Å; I344-L391 HydrophobicContact CG1-CD1 4.43Å; I344-L391 HydrophobicContact CG2-CD1 3.82Å
345	A	94.4	Very high	91.6	Very high	2 Å²	2	19.2 Å²	19.2	2%	0.017	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.9	173.2	0	0	0	0	0	109.9	W329 V333 I351 T352	W329-A345 HydrophobicContact CB-CB 4.25Å; W329-A345 HydrophobicContact CD2-CB 4.28Å; W329-A345 HydrophobicContact CE3-CB 3.83Å; W329-A345 HydrophobicContact CZ3-CB 4.48Å; V333-A345 HydrophobicContact CG2-CB 3.89Å; A345-I351 CarbonylContact O-C 3.6Å; A345-I351 WeakPolarHBondContact O-CA 3.5Å; A345-T352 PolarHBondContact N-O 2.66Å; A345-T352 PolarHBondContact O-N 3.12Å
346	L	94.6	Very high	91.4	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	127.3	176.2	173.3	65.7	0	0	0	109.7	V333 I334 G335 I351 F367 L373 V382	V333-L346 CarbonylContact C-O 3.53Å; V333-L346 WeakPolarHBondContact CA-O 3.39Å; I334-L346 PolarHBondContact N-O 2.98Å; G335-L346 PolarHBondContact O-N 3.41Å; L346-I351 HydrophobicContact CD1-CG1 3.83Å; L346-F367 HydrophobicContact CD1-CD1 3.9Å; L346-F367 HydrophobicContact CD1-CE1 4.38Å; L346-L373 HydrophobicContact CB-CB 3.86Å; L346-L373 HydrophobicContact CB-CD2 3.69Å; L346-L373 HydrophobicContact CB-CG 4.35Å; L346-L373 HydrophobicContact CD2-CB 3.86Å; L346-V382 HydrophobicContact CD1-CG1 4.17Å; L346-V382 HydrophobicContact CD2-CG1 4.16Å
347	D	91.4	Very high	91.1	Very high	5 Å²	5	20.9 Å²	20.9	3%	0.027	11%	0.105	C	C	.	.			trans	-110.7	-175	170.9	-149.8	-116.2	0	0	0	109.6	S330 N332 V333 F350	S330-D347 WeakPolarHBondContact CB-OD2 3.2Å; S330-D347 VanDerWaalsContact OG-CG 3.24Å; S330-D347 PolarHBondContact OG-OD1 3.29Å; S330-D347 PolarHBondContact OG-OD2 3.25Å; N332-D347 WeakPolarHBondContact CB-OD2 3.34Å; V333-D347 PolarHBondContact N-OD2 3.29Å; D347-F350 WeakPolarHBondContact CA-O 3.44Å; D347-F350 HydrophobicContact CB-CD1 4.47Å; D347-F350 HydrophobicContact CB-CD2 3.71Å; D347-F350 HydrophobicContact CB-CE1 4.26Å; D347-F350 HydrophobicContact CB-CE2 3.48Å; D347-F350 VanDerWaalsContact CB-CE2 3.48Å; D347-F350 HydrophobicContact CB-CG 4.21Å; D347-F350 HydrophobicContact CB-CZ 3.77Å; D347-F350 VanDerWaalsContact CB-O 3.32Å; D347-F350 WeakPolarHBondContact CB-O 3.49Å; D347-F350 PolarHBondContact N-O 3.29Å; D347-F350 WeakPolarHBondContact OD1-CE1 3.47Å; D347-F350 VanDerWaalsContact OD1-CZ 3.31Å; D347-F350 WeakPolarHBondContact OD1-CZ 3.29Å
348	D	85.8	Confident	90.7	Very high	89 Å²	89	22.8 Å²	22.8	48%	0.476	12%	0.115	S	C	.	.	S	Bend	trans	-79.3	-29.7	-177.8	69.4	-11.6	0	0	0	113.9	I334	I334-D348 HydrophobicContact CD1-CB 4.17Å
349	E	89.2	Confident	90.6	Very high	98 Å²	98	24.7 Å²	24.7	46%	0.458	12%	0.123	S	C	.	.	S	Bend	trans	-106.4	-17.1	177.1	-62.5	-141.7	131.8	0	0	115.2	F367 K368	E349-F367 CarbonylContact C-O 3.5Å; E349-F367 CarbonylContact O-C 3.58Å; E349-F367 PolarHBondContact O-N 2.95Å; E349-K368 VanDerWaalsContact CD-NZ 3.28Å; E349-K368 IonicContact OE1-NZ 3.94Å; E349-K368 PolarHBondContact OE1-NZ 3.44Å; E349-K368 IonicContact OE2-NZ 3.47Å
350	F	93.3	Very high	90.6	Very high	59 Å²	59	28.2 Å²	28.2	26%	0.259	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	160.6	-171.2	56.8	-100.7	0	0	0	115.1	D347 T352 T364 L365 F367	D347-F350 WeakPolarHBondContact CA-O 3.44Å; D347-F350 HydrophobicContact CB-CD1 4.47Å; D347-F350 HydrophobicContact CB-CD2 3.71Å; D347-F350 HydrophobicContact CB-CE1 4.26Å; D347-F350 HydrophobicContact CB-CE2 3.48Å; D347-F350 VanDerWaalsContact CB-CE2 3.48Å; D347-F350 HydrophobicContact CB-CG 4.21Å; D347-F350 HydrophobicContact CB-CZ 3.77Å; D347-F350 VanDerWaalsContact CB-O 3.32Å; D347-F350 WeakPolarHBondContact CB-O 3.49Å; D347-F350 PolarHBondContact N-O 3.29Å; D347-F350 WeakPolarHBondContact OD1-CE1 3.47Å; D347-F350 VanDerWaalsContact OD1-CZ 3.31Å; D347-F350 WeakPolarHBondContact OD1-CZ 3.29Å; F350-T352 HydrophobicContact CD2-CG2 3.79Å; F350-T352 HydrophobicContact CE2-CG2 3.86Å; F350-T364 HydrophobicContact CB-CG2 4.01Å; F350-T364 HydrophobicContact CD2-CG2 4.4Å; F350-T364 HydrophobicContact CG-CG2 4.3Å; F350-L365 CarbonylContact C-O 3.4Å; F350-L365 WeakPolarHBondContact CA-O 3.33Å; F350-F367 PolarHBondContact N-O 2.89Å
351	I	95	Very high	90.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.1	167.1	-61.8	155.5	0	0	0	107.9	L92 I344 A345 L346 T364 L365 F367 V382 L391	L92-I351 HydrophobicContact CD1-CD1 4.32Å; I344-I351 HydrophobicContact CG2-CG2 3.41Å; I344-I351 VanDerWaalsContact CG2-CG2 3.41Å; A345-I351 CarbonylContact O-C 3.6Å; A345-I351 WeakPolarHBondContact O-CA 3.5Å; L346-I351 HydrophobicContact CD1-CG1 3.83Å; I351-T364 CarbonylContact O-C 3.58Å; I351-T364 WeakPolarHBondContact O-CA 3.44Å; I351-L365 HydrophobicContact CB-CB 4.29Å; I351-L365 PolarHBondContact N-O 3.18Å; I351-L365 PolarHBondContact O-N 2.88Å; I351-F367 HydrophobicContact CD1-CB 3.67Å; I351-F367 HydrophobicContact CD1-CD1 3.82Å; I351-F367 HydrophobicContact CD1-CD2 4.31Å; I351-F367 HydrophobicContact CD1-CG 3.67Å; I351-F367 HydrophobicContact CG1-CB 3.93Å; I351-F367 HydrophobicContact CG1-CD1 4.14Å; I351-F367 HydrophobicContact CG1-CG 4.24Å; I351-V382 HydrophobicContact CD1-CB 4.46Å; I351-V382 HydrophobicContact CD1-CG1 4.14Å; I351-V382 HydrophobicContact CD1-CG2 4.03Å; I351-L391 HydrophobicContact CD1-CD2 4.46Å; I351-L391 HydrophobicContact CG2-CD1 4.17Å
352	T	94.2	Very high	91	Very high	5 Å²	5	29.3 Å²	29.3	3%	0.031	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	145.6	170.2	49	0	0	0	0	111.4	I344 A345 F350 H354 Q361 T364	I344-T352 WeakPolarHBondContact CA-O 3.43Å; A345-T352 PolarHBondContact N-O 2.66Å; A345-T352 PolarHBondContact O-N 3.12Å; F350-T352 HydrophobicContact CD2-CG2 3.79Å; F350-T352 HydrophobicContact CE2-CG2 3.86Å; T352-H354 WeakPolarHBondContact CB-NE2 3.37Å; T352-H354 PolarHBondContact OG1-NE2 2.93Å; T352-Q361 HydrophobicContact CG2-CG 4.45Å; T352-T364 HydrophobicContact CG2-CG2 4.24Å
353	V	94.4	Very high	91.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	118.2	176.8	-173.5	0	0	0	0	108.4	A89 F90 Y342 K362 Q363	A89-V353 HydrophobicContact CB-CG1 4.29Å; F90-V353 HydrophobicContact CD2-CG1 3.82Å; F90-V353 HydrophobicContact CD2-CG2 3.97Å; F90-V353 HydrophobicContact CE2-CG1 3.69Å; Y342-V353 HydrophobicContact CD1-CG1 3.77Å; Y342-V353 HydrophobicContact CG-CG1 3.89Å; V353-K362 PolarHBondContact O-N 3.37Å; V353-Q363 HydrophobicContact CB-CB 4Å; V353-Q363 HydrophobicContact CG2-CB 4.09Å; V353-Q363 PolarHBondContact N-O 2.92Å; V353-Q363 PolarHBondContact O-N 3.08Å
354	H	92.5	Very high	91.1	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	139.1	-178.2	-56.1	-79.6	0	0	0	110.2	V327 H328 W329 Y342 V343 T352 Q360 Q361	V327-H354 HydrophobicContact CB-CB 4.09Å; V327-H354 HydrophobicContact CG1-CB 3.93Å; H328-H354 PolarHBondContact O-CE1 3.07Å; H328-H354 PolarHBondContact O-ND1 2.91Å; W329-H354 VanDerWaalsContact CB-NE2 3.26Å; W329-H354 WeakPolarHBondContact CB-NE2 3.39Å; Y342-H354 CarbonylContact C-O 3.55Å; Y342-H354 VanDerWaalsContact CA-O 3.28Å; Y342-H354 WeakPolarHBondContact CA-O 3.43Å; V343-H354 PolarHBondContact N-O 3.26Å; V343-H354 PolarHBondContact O-N 3.48Å; T352-H354 WeakPolarHBondContact CB-NE2 3.37Å; T352-H354 PolarHBondContact OG1-NE2 2.93Å; H354-Q360 WeakPolarHBondContact CA-O 3.32Å; H354-Q361 VanDerWaalsContact CE1-CB 3.41Å; H354-Q361 WeakPolarHBondContact CE1-CB 3.41Å; H354-Q361 VanDerWaalsContact CE1-CG 3.43Å; H354-Q361 WeakPolarHBondContact CE1-CG 3.49Å; H354-Q361 PolarHBondContact CE1-OE1 3.32Å; H354-Q361 WeakPolarHBondContact ND1-CA 3.37Å; H354-Q361 WeakPolarHBondContact ND1-CB 3.4Å
355	S	90.2	Very high	91	Very high	6 Å²	6	33.3 Å²	33.3	4%	0.042	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	128.5	176.9	151.8	0	0	0	0	110.7	L357 D358 Q359 Q360	S355-L357 PolarHBondContact O-N 3.23Å; S355-L357 PolarHBondContact OG-N 3.25Å; S355-D358 WeakPolarHBondContact CB-OD1 3.47Å; S355-D358 PolarHBondContact OG-N 3.1Å; S355-D358 PolarHBondContact OG-OD1 2.99Å; S355-Q359 WeakPolarHBondContact O-CA 3.32Å; S355-Q359 PolarHBondContact O-N 3.05Å; S355-Q360 PolarHBondContact N-O 3.22Å
356	M	87.9	Confident	90.9	Very high	6 Å²	6	38.5 Å²	38.5	3%	0.03	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-8.6	174.3	-67.2	-173.8	-88.1	0	0	113.6	F315 V338 F340 P341 V343 Q359	F315-M356 HydrophobicContact CE1-CG 4.32Å; F315-M356 HydrophobicContact CE1-SD 4.23Å; F315-M356 HydrophobicContact CZ-CG 4.06Å; V338-M356 HydrophobicContact CG1-CE 3.61Å; V338-M356 HydrophobicContact CG1-SD 4.35Å; F340-M356 HydrophobicContact CB-CE 4.17Å; F340-M356 HydrophobicContact CD2-CE 3.68Å; F340-M356 HydrophobicContact CG-CE 4.31Å; P341-M356 VanDerWaalsContact C-CE 3.44Å; P341-M356 VanDerWaalsContact O-CB 3.27Å; P341-M356 WeakPolarHBondContact O-CB 3.38Å; P341-M356 WeakPolarHBondContact O-CE 3.3Å; P341-M356 WeakPolarHBondContact O-CG 3.43Å; P341-M356 PolarHBondContact O-N 2.95Å; V343-M356 HydrophobicContact CG2-CG 3.59Å; V343-M356 HydrophobicContact CG2-SD 3.93Å; M356-Q359 PolarHBondContact O-NE2 2.92Å
357	L	87.3	Confident	90.8	Very high	55 Å²	55	39 Å²	39	29%	0.288	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-41.1	-173.1	-56	177.7	0	0	0	112	P341 S355 Q359 V414	P341-L357 HydrophobicContact CB-CD1 3.83Å; P341-L357 HydrophobicContact CB-CD2 4.32Å; P341-L357 HydrophobicContact CB-CG 3.9Å; P341-L357 HydrophobicContact CG-CD1 4.3Å; S355-L357 PolarHBondContact O-N 3.23Å; S355-L357 PolarHBondContact OG-N 3.25Å; L357-Q359 VanDerWaalsContact C-NE2 3.29Å; L357-Q359 PolarHBondContact O-NE2 3.08Å; L357-V414 HydrophobicContact CB-CG1 3.54Å; L357-V414 HydrophobicContact CD1-CG1 4.03Å; L357-V414 HydrophobicContact CG-CG1 4.42Å
358	D	85.6	Confident	90.7	Very high	39 Å²	39	44.7 Å²	44.7	21%	0.209	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.5	6.5	-177.3	58.2	13.1	0	0	0	113.3	S355 Q360 K362	S355-D358 WeakPolarHBondContact CB-OD1 3.47Å; S355-D358 PolarHBondContact OG-N 3.1Å; S355-D358 PolarHBondContact OG-OD1 2.99Å; D358-Q360 PolarHBondContact O-N 3.15Å; D358-Q360 PolarHBondContact OD1-N 2.82Å; D358-K362 VanDerWaalsContact CG-NZ 3.35Å; D358-K362 WeakPolarHBondContact OD1-CE 3.11Å; D358-K362 IonicContact OD1-NZ 3.98Å; D358-K362 PolarHBondContact OD1-NZ 2.86Å; D358-K362 WeakPolarHBondContact OD2-CE 3.44Å; D358-K362 IonicContact OD2-NZ 2.93Å; D358-K362 PolarHBondContact OD2-NZ 3.26Å
359	Q	88.1	Confident	90.8	Very high	57 Å²	57	45.7 Å²	45.7	27%	0.266	23%	0.229	S	C	.	.			trans	60.5	10.8	173.9	-59.9	76.5	58.8	0	0	115.7	A325 S355 M356 L357	A325-Q359 HydrophobicContact CB-CG 3.88Å; A325-Q359 VanDerWaalsContact O-CG 3.29Å; A325-Q359 WeakPolarHBondContact O-CG 3.47Å; S355-Q359 WeakPolarHBondContact O-CA 3.32Å; S355-Q359 PolarHBondContact O-N 3.05Å; M356-Q359 PolarHBondContact O-NE2 2.92Å; L357-Q359 VanDerWaalsContact C-NE2 3.29Å; L357-Q359 PolarHBondContact O-NE2 3.08Å
360	Q	88.4	Confident	90.7	Very high	91 Å²	91	41.2 Å²	41.2	43%	0.425	21%	0.209	S	C	.	.			trans	-86.8	145.4	178.9	-67.7	178.4	1.4	0	0	112.5	H354 S355 D358 K362	H354-Q360 WeakPolarHBondContact CA-O 3.32Å; S355-Q360 PolarHBondContact N-O 3.22Å; D358-Q360 PolarHBondContact O-N 3.15Å; D358-Q360 PolarHBondContact OD1-N 2.82Å; Q360-K362 HydrophobicContact CB-CD 4.12Å; Q360-K362 PolarHBondContact O-N 3.29Å
361	Q	91.1	Very high	90.5	Very high	80 Å²	80	42 Å²	42	37%	0.374	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	119.3	162.2	-172.9	171.4	-38.2	0	0	109.3	T352 H354 T364	T352-Q361 HydrophobicContact CG2-CG 4.45Å; H354-Q361 VanDerWaalsContact CE1-CB 3.41Å; H354-Q361 WeakPolarHBondContact CE1-CB 3.41Å; H354-Q361 VanDerWaalsContact CE1-CG 3.43Å; H354-Q361 WeakPolarHBondContact CE1-CG 3.49Å; H354-Q361 PolarHBondContact CE1-OE1 3.32Å; H354-Q361 WeakPolarHBondContact ND1-CA 3.37Å; H354-Q361 WeakPolarHBondContact ND1-CB 3.4Å; Q361-T364 PolarHBondContact NE2-OG1 3.46Å
362	K	89.4	Confident	90.3	Very high	9 Å²	9	42.7 Å²	42.7	4%	0.039	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-27.3	-177.8	-58.7	-50.6	-168.4	174.4	0	113.1	N86 I87 Y342 V353 D358 Q360 E411	N86-K362 CarbonylContact C-O 3.6Å; N86-K362 VanDerWaalsContact CB-O 3.23Å; N86-K362 WeakPolarHBondContact CB-O 3.21Å; I87-K362 HydrophobicContact CD1-CD 4.11Å; I87-K362 PolarHBondContact N-O 2.87Å; I87-K362 VanDerWaalsContact O-O 3.11Å; Y342-K362 HydrophobicContact CE1-CG 4.38Å; V353-K362 PolarHBondContact O-N 3.37Å; D358-K362 VanDerWaalsContact CG-NZ 3.35Å; D358-K362 WeakPolarHBondContact OD1-CE 3.11Å; D358-K362 IonicContact OD1-NZ 3.98Å; D358-K362 PolarHBondContact OD1-NZ 2.86Å; D358-K362 WeakPolarHBondContact OD2-CE 3.44Å; D358-K362 IonicContact OD2-NZ 2.93Å; D358-K362 PolarHBondContact OD2-NZ 3.26Å; Q360-K362 HydrophobicContact CB-CD 4.12Å; Q360-K362 PolarHBondContact O-N 3.29Å; K362-E411 IonicContact NZ-OE2 3.54Å; K362-E411 PolarHBondContact NZ-OE2 3.28Å
363	Q	91.8	Very high	90.3	Very high	11 Å²	11	43.2 Å²	43.2	5%	0.051	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	150	-179.3	-166.4	179	-7.6	0	0	111.5	F90 V353 L365	F90-Q363 PolarHBondContact O-NE2 3.5Å; F90-Q363 PolarHBondContact O-OE1 2.96Å; V353-Q363 HydrophobicContact CB-CB 4Å; V353-Q363 HydrophobicContact CG2-CB 4.09Å; V353-Q363 PolarHBondContact N-O 2.92Å; V353-Q363 PolarHBondContact O-N 3.08Å; Q363-L365 HydrophobicContact CG-CG 4.42Å
364	T	93.8	Very high	90.1	Very high	62 Å²	62	45.2 Å²	45.2	38%	0.38	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	141	163.1	-49.5	0	0	0	0	108.4	F350 I351 T352 Q361	F350-T364 HydrophobicContact CB-CG2 4.01Å; F350-T364 HydrophobicContact CD2-CG2 4.4Å; F350-T364 HydrophobicContact CG-CG2 4.3Å; I351-T364 CarbonylContact O-C 3.58Å; I351-T364 WeakPolarHBondContact O-CA 3.44Å; T352-T364 HydrophobicContact CG2-CG2 4.24Å; Q361-T364 PolarHBondContact NE2-OG1 3.46Å
365	L	92.3	Very high	90	Very high	24 Å²	24	46.6 Å²	46.6	13%	0.126	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	122.9	175	-73.7	167.6	0	0	0	108.5	F350 I351 Q363 F367 L391	F350-L365 CarbonylContact C-O 3.4Å; F350-L365 WeakPolarHBondContact CA-O 3.33Å; I351-L365 HydrophobicContact CB-CB 4.29Å; I351-L365 PolarHBondContact N-O 3.18Å; I351-L365 PolarHBondContact O-N 2.88Å; Q363-L365 HydrophobicContact CG-CG 4.42Å; L365-F367 PolarHBondContact O-N 2.82Å; L365-L391 HydrophobicContact CD1-CD2 3.5Å
366	P	92.1	Very high	89.7	Confident	111 Å²	111	47.1 Å²	47.1	72%	0.721	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	128.7	175.8	28.5	-33.4	0	0	0	109.9
367	F	92.4	Very high	89.1	Confident	12 Å²	12	52.9 Å²	52.9	5%	0.053	26%	0.264	C	S	.	.			trans	-158.1	102.1	-176	-172.3	-106.7	0	0	0	110.2	L92 L346 E349 F350 I351 L365 V382 T384 Y389	L92-F367 HydrophobicContact CD1-CE2 4.48Å; L92-F367 HydrophobicContact CD2-CD2 3.51Å; L92-F367 HydrophobicContact CD2-CE2 3.91Å; L346-F367 HydrophobicContact CD1-CD1 3.9Å; L346-F367 HydrophobicContact CD1-CE1 4.38Å; E349-F367 CarbonylContact C-O 3.5Å; E349-F367 CarbonylContact O-C 3.58Å; E349-F367 PolarHBondContact O-N 2.95Å; F350-F367 PolarHBondContact N-O 2.89Å; I351-F367 HydrophobicContact CD1-CB 3.67Å; I351-F367 HydrophobicContact CD1-CD1 3.82Å; I351-F367 HydrophobicContact CD1-CD2 4.31Å; I351-F367 HydrophobicContact CD1-CG 3.67Å; I351-F367 HydrophobicContact CG1-CB 3.93Å; I351-F367 HydrophobicContact CG1-CD1 4.14Å; I351-F367 HydrophobicContact CG1-CG 4.24Å; L365-F367 PolarHBondContact O-N 2.82Å; F367-V382 HydrophobicContact CD1-CG1 4.04Å; F367-V382 HydrophobicContact CE1-CB 4.17Å; F367-V382 HydrophobicContact CE1-CG1 3.43Å; F367-V382 VanDerWaalsContact CE1-CG1 3.43Å; F367-V382 HydrophobicContact CZ-CB 4.2Å; F367-V382 HydrophobicContact CZ-CG1 3.96Å; F367-T384 HydrophobicContact CE1-CG2 3.92Å; F367-T384 HydrophobicContact CE2-CG2 4.07Å; F367-T384 HydrophobicContact CZ-CG2 3.49Å; F367-T384 VanDerWaalsContact CZ-CG2 3.49Å; F367-Y389 HydrophobicContact CE2-CD1 4.43Å; F367-Y389 AromaticContact CE2-CD2 3.58Å; F367-Y389 HydrophobicContact CE2-CD2 3.58Å; F367-Y389 AromaticContact CE2-CE2 3.8Å; F367-Y389 HydrophobicContact CE2-CE2 3.8Å; F367-Y389 AromaticContact CE2-CG 3.94Å; F367-Y389 HydrophobicContact CE2-CG 3.94Å; F367-Y389 AromaticContact CZ-CD2 3.67Å; F367-Y389 HydrophobicContact CZ-CD2 3.67Å; F367-Y389 HydrophobicContact CZ-CE2 4.01Å; F367-Y389 HydrophobicContact CZ-CG 4.35Å
368	K	89.9	Confident	88.5	Confident	124 Å²	124	52.2 Å²	52.2	54%	0.539	27%	0.271	S	S	.	.			trans	-96.4	155.2	-176	-55	-158.9	175.7	-146.8	0	112	E349 G370 T384	E349-K368 VanDerWaalsContact CD-NZ 3.28Å; E349-K368 IonicContact OE1-NZ 3.94Å; E349-K368 PolarHBondContact OE1-NZ 3.44Å; E349-K368 IonicContact OE2-NZ 3.47Å; K368-G370 PolarHBondContact O-N 2.94Å; K368-T384 WeakPolarHBondContact O-CG2 3.49Å
369	E	87.1	Confident	88.5	Confident	110 Å²	110	52.8 Å²	52.8	51%	0.514	27%	0.271	S	S	.	.	S	Bend	trans	59.7	22.8	-175.9	-52.4	-175.3	171.7	0	0	114.1	T384 K386	E369-T384 HydrophobicContact CB-CG2 4.39Å; E369-T384 VanDerWaalsContact O-CA 3.28Å; E369-T384 WeakPolarHBondContact O-CA 3.48Å; E369-T384 WeakPolarHBondContact O-CB 3.2Å; E369-T384 WeakPolarHBondContact O-CG2 3.45Å; E369-K386 VanDerWaalsContact CD-NZ 3.26Å; E369-K386 IonicContact OE1-NZ 2.72Å; E369-K386 PolarHBondContact OE1-NZ 3.07Å; E369-K386 IonicContact OE2-NZ 3.51Å; E369-K386 PolarHBondContact OE2-NZ 3.25Å
370	G	88	Confident	88.7	Confident	4 Å²	4	50.1 Å²	50.1	4%	0.041	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	127.7	176.1	0	0	0	0	0	111.7	K368	K368-G370 PolarHBondContact O-N 2.94Å
371	H	88.9	Confident	88.9	Confident	76 Å²	76	45.9 Å²	45.9	35%	0.352	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	-5.9	179.9	72.4	-55	0	0	0	114.3	I110 A383 S385	I110-H371 PolarHBondContact O-CE1 3.25Å; I110-H371 VanDerWaalsContact O-CE1 3.29Å; I110-H371 PolarHBondContact O-NE2 3.45Å; H371-A383 PolarHBondContact N-O 3.44Å; H371-A383 VanDerWaalsContact N-O 3.15Å; H371-A383 PolarHBondContact ND1-O 3.41Å; H371-S385 PolarHBondContact CE1-N 3.2Å; H371-S385 VanDerWaalsContact CE1-N 3.34Å; H371-S385 PolarHBondContact ND1-N 3.3Å
372	I	91.7	Very high	89.1	Confident	14 Å²	14	42.1 Å²	42.1	7%	0.072	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	126.2	177.5	-60.7	166.8	0	0	0	108.8	I110 E111 V113 Q374 V382 A383	I110-I372 HydrophobicContact CG2-CD1 3.83Å; E111-I372 WeakPolarHBondContact O-CD1 3.38Å; V113-I372 HydrophobicContact CG2-CD1 4.31Å; I372-Q374 HydrophobicContact CG2-CG 4.33Å; I372-V382 CarbonylContact O-C 3.55Å; I372-V382 VanDerWaalsContact O-CA 3.26Å; I372-V382 WeakPolarHBondContact O-CA 3.34Å; I372-V382 VanDerWaalsContact O-CG1 3.23Å; I372-V382 WeakPolarHBondContact O-CG1 3.42Å; I372-A383 HydrophobicContact CB-CB 4.08Å; I372-A383 HydrophobicContact CD1-CB 4.2Å; I372-A383 PolarHBondContact N-O 2.69Å; I372-A383 PolarHBondContact O-N 2.89Å
373	L	93.4	Very high	89.2	Confident	15 Å²	15	41.7 Å²	41.7	8%	0.079	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	119.9	169.2	171.5	63.7	0	0	0	108.9	A337 I344 L346 V380 V382	A337-L373 HydrophobicContact CB-CD1 3.81Å; A337-L373 HydrophobicContact CB-CD2 4.07Å; A337-L373 HydrophobicContact CB-CG 3.67Å; I344-L373 HydrophobicContact CB-CD2 4.38Å; I344-L373 HydrophobicContact CG2-CD1 4.07Å; I344-L373 HydrophobicContact CG2-CD2 3.92Å; L346-L373 HydrophobicContact CB-CB 3.86Å; L346-L373 HydrophobicContact CB-CD2 3.69Å; L346-L373 HydrophobicContact CB-CG 4.35Å; L346-L373 HydrophobicContact CD2-CB 3.86Å; L373-V380 HydrophobicContact CD1-CG1 3.54Å; L373-V382 HydrophobicContact CD1-CG1 4.44Å; L373-V382 HydrophobicContact CD1-CG2 3.87Å
374	Q	90.1	Very high	89.2	Confident	42 Å²	42	41.6 Å²	41.6	20%	0.196	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	141.1	179.5	-62.7	-171.2	56.2	0	0	111.8	V113 I372 F376 I381	V113-Q374 PolarHBondContact O-NE2 3.09Å; I372-Q374 HydrophobicContact CG2-CG 4.33Å; Q374-F376 HydrophobicContact CB-CD2 4.47Å; Q374-F376 HydrophobicContact CB-CE1 4.32Å; Q374-F376 HydrophobicContact CB-CE2 3.58Å; Q374-F376 HydrophobicContact CB-CZ 3.48Å; Q374-F376 VanDerWaalsContact CB-CZ 3.48Å; Q374-F376 HydrophobicContact CG-CZ 4.29Å; Q374-I381 PolarHBondContact N-O 3.14Å; Q374-I381 PolarHBondContact O-N 3.43Å
375	D	89.6	Confident	89	Confident	31 Å²	31	39.8 Å²	39.8	17%	0.166	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	139.6	169.4	54.8	-83.2	0	0	0	112.6	K297 A337 V338 R379 V380	K297-D375 WeakPolarHBondContact CE-OD1 3.41Å; K297-D375 WeakPolarHBondContact CE-OD2 3.44Å; K297-D375 IonicContact NZ-OD1 3.48Å; K297-D375 PolarHBondContact NZ-OD1 3.19Å; K297-D375 IonicContact NZ-OD2 2.74Å; K297-D375 PolarHBondContact NZ-OD2 2.91Å; A337-D375 VanDerWaalsContact CA-OD1 3.25Å; A337-D375 WeakPolarHBondContact CA-OD1 3.4Å; A337-D375 HydrophobicContact CB-CB 4.09Å; A337-D375 VanDerWaalsContact CB-OD1 3.31Å; A337-D375 WeakPolarHBondContact CB-OD1 3.37Å; V338-D375 PolarHBondContact N-OD1 3.36Å; V338-D375 WeakPolarHBondContact O-CB 3.39Å; D375-R379 CarbonylContact C-O 3.48Å; D375-R379 WeakPolarHBondContact CA-O 3.2Å; D375-V380 HydrophobicContact CB-CG2 4.19Å
376	F	83.9	Confident	88.7	Confident	17 Å²	17	42.5 Å²	42.5	8%	0.075	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	116.8	-179.1	-54.8	-75.7	0	0	0	109.6	V113 E114 C115 Q374 G378 R379 I381	V113-F376 WeakPolarHBondContact O-CZ 3.45Å; E114-F376 VanDerWaalsContact OE2-CE1 3.23Å; E114-F376 WeakPolarHBondContact OE2-CE1 3.48Å; C115-F376 HydrophobicContact CB-CB 4.02Å; C115-F376 HydrophobicContact CB-CD1 4.49Å; C115-F376 HydrophobicContact CB-CD2 3.76Å; C115-F376 HydrophobicContact CB-CE2 4.33Å; C115-F376 HydrophobicContact CB-CG 3.84Å; C115-F376 WeakPolarHBondContact O-CB 3.44Å; Q374-F376 HydrophobicContact CB-CD2 4.47Å; Q374-F376 HydrophobicContact CB-CE1 4.32Å; Q374-F376 HydrophobicContact CB-CE2 3.58Å; Q374-F376 HydrophobicContact CB-CZ 3.48Å; Q374-F376 VanDerWaalsContact CB-CZ 3.48Å; Q374-F376 HydrophobicContact CG-CZ 4.29Å; F376-G378 PolarHBondContact O-N 3.45Å; F376-R379 PolarHBondContact N-O 3.05Å; F376-R379 WeakPolarHBondContact O-CB 3.39Å; F376-R379 PolarHBondContact O-N 3.06Å; F376-I381 HydrophobicContact CD2-CB 4.28Å; F376-I381 HydrophobicContact CD2-CD1 3.69Å; F376-I381 HydrophobicContact CD2-CG1 3.91Å; F376-I381 HydrophobicContact CE2-CB 4.13Å; F376-I381 HydrophobicContact CE2-CD1 3.98Å; F376-I381 HydrophobicContact CE2-CG1 4.22Å
377	E	76.4	Confident	88.6	Confident	126 Å²	126	37.3 Å²	37.3	59%	0.589	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	25.8	177.5	-57.2	171.2	171.4	0	0	114.3	G117 R379	G117-E377 WeakPolarHBondContact CA-OE2 3.44Å; G117-E377 PolarHBondContact N-OE1 3.14Å; G117-E377 VanDerWaalsContact N-OE1 3.12Å; G117-E377 PolarHBondContact N-OE2 2.84Å; E377-R379 IonicContact OE2-CZ 3.51Å; E377-R379 IonicContact OE2-NH1 2.73Å; E377-R379 PolarHBondContact OE2-NH1 3.44Å; E377-R379 VanDerWaalsContact OE2-NH1 3.12Å; E377-R379 IonicContact OE2-NH2 3.21Å; E377-R379 PolarHBondContact OE2-NH2 2.98Å
378	G	75.4	Confident	88.6	Confident	42 Å²	42	36.8 Å²	36.8	43%	0.433	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.6	-11.4	-176.4	0	0	0	0	0	115.9	S339 F376	S339-G378 PolarHBondContact OG-O 3.16Å; F376-G378 PolarHBondContact O-N 3.45Å
379	R	85.6	Confident	88.7	Confident	51 Å²	51	34 Å²	34	19%	0.192	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	137.8	167	-61.1	179.6	-63.8	-77.9	-6.4	109	C115 G117 D375 F376 E377	C115-R379 PolarHBondContact SG-NH2 3.39Å; C115-R379 VanDerWaalsContact SG-NH2 3.4Å; G117-R379 VanDerWaalsContact O-CZ 3.22Å; G117-R379 PolarHBondContact O-NH1 3.06Å; G117-R379 PolarHBondContact O-NH2 3.48Å; G117-R379 VanDerWaalsContact O-NH2 3.11Å; D375-R379 CarbonylContact C-O 3.48Å; D375-R379 WeakPolarHBondContact CA-O 3.2Å; F376-R379 PolarHBondContact N-O 3.05Å; F376-R379 WeakPolarHBondContact O-CB 3.39Å; F376-R379 PolarHBondContact O-N 3.06Å; E377-R379 IonicContact OE2-CZ 3.51Å; E377-R379 IonicContact OE2-NH1 2.73Å; E377-R379 PolarHBondContact OE2-NH1 3.44Å; E377-R379 VanDerWaalsContact OE2-NH1 3.12Å; E377-R379 IonicContact OE2-NH2 3.21Å; E377-R379 PolarHBondContact OE2-NH2 2.98Å
380	V	92.2	Very high	88.9	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.8	175.1	-173.9	0	0	0	0	109.2	A337 I344 L373 D375 L391	A337-V380 HydrophobicContact CB-CG1 3.85Å; I344-V380 HydrophobicContact CD1-CG2 4.09Å; L373-V380 HydrophobicContact CD1-CG1 3.54Å; D375-V380 HydrophobicContact CB-CG2 4.19Å; V380-L391 HydrophobicContact CB-CB 4.2Å; V380-L391 HydrophobicContact CB-CD1 4.43Å; V380-L391 HydrophobicContact CG1-CD1 3.96Å; V380-L391 PolarHBondContact O-N 2.93Å
381	I	92.7	Very high	89.1	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.01	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	136.6	-177.8	-58	-170.6	0	0	0	108.9	V113 C115 L120 Q374 F376 V388 Y389 I390	V113-I381 HydrophobicContact CG1-CG2 4.15Å; C115-I381 HydrophobicContact CB-CD1 3.57Å; L120-I381 HydrophobicContact CD1-CD1 3.85Å; Q374-I381 PolarHBondContact N-O 3.14Å; Q374-I381 PolarHBondContact O-N 3.43Å; F376-I381 HydrophobicContact CD2-CB 4.28Å; F376-I381 HydrophobicContact CD2-CD1 3.69Å; F376-I381 HydrophobicContact CD2-CG1 3.91Å; F376-I381 HydrophobicContact CE2-CB 4.13Å; F376-I381 HydrophobicContact CE2-CD1 3.98Å; F376-I381 HydrophobicContact CE2-CG1 4.22Å; I381-V388 HydrophobicContact CG2-CG1 3.45Å; I381-V388 VanDerWaalsContact CG2-CG1 3.45Å; I381-Y389 WeakPolarHBondContact CA-O 3.48Å; I381-Y389 WeakPolarHBondContact CG2-O 3.33Å; I381-I390 HydrophobicContact CG1-CG1 4.34Å
382	V	94.1	Very high	89	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	137.6	175.1	-152	0	0	0	0	108.3	L346 I351 F367 I372 L373 Y389 L391	L346-V382 HydrophobicContact CD1-CG1 4.17Å; L346-V382 HydrophobicContact CD2-CG1 4.16Å; I351-V382 HydrophobicContact CD1-CB 4.46Å; I351-V382 HydrophobicContact CD1-CG1 4.14Å; I351-V382 HydrophobicContact CD1-CG2 4.03Å; F367-V382 HydrophobicContact CD1-CG1 4.04Å; F367-V382 HydrophobicContact CE1-CB 4.17Å; F367-V382 HydrophobicContact CE1-CG1 3.43Å; F367-V382 VanDerWaalsContact CE1-CG1 3.43Å; F367-V382 HydrophobicContact CZ-CB 4.2Å; F367-V382 HydrophobicContact CZ-CG1 3.96Å; I372-V382 CarbonylContact O-C 3.55Å; I372-V382 VanDerWaalsContact O-CA 3.26Å; I372-V382 WeakPolarHBondContact O-CA 3.34Å; I372-V382 VanDerWaalsContact O-CG1 3.23Å; I372-V382 WeakPolarHBondContact O-CG1 3.42Å; L373-V382 HydrophobicContact CD1-CG1 4.44Å; L373-V382 HydrophobicContact CD1-CG2 3.87Å; V382-Y389 PolarHBondContact N-O 3.1Å; V382-Y389 WeakPolarHBondContact O-CA 3.41Å; V382-Y389 WeakPolarHBondContact O-CB 3.33Å; V382-Y389 PolarHBondContact O-N 3.35Å; V382-Y389 VanDerWaalsContact O-O 3.06Å; V382-L391 HydrophobicContact CG2-CD1 3.62Å; V382-L391 HydrophobicContact CG2-CG 3.83Å
383	A	92.5	Very high	88.8	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	148.9	176	0	0	0	0	0	112	I110 V113 H371 I372 G387 V388	I110-A383 HydrophobicContact CG2-CB 4.47Å; V113-A383 HydrophobicContact CG2-CB 4.18Å; H371-A383 PolarHBondContact N-O 3.44Å; H371-A383 VanDerWaalsContact N-O 3.15Å; H371-A383 PolarHBondContact ND1-O 3.41Å; I372-A383 HydrophobicContact CB-CB 4.08Å; I372-A383 HydrophobicContact CD1-CB 4.2Å; I372-A383 PolarHBondContact N-O 2.69Å; I372-A383 PolarHBondContact O-N 2.89Å; A383-G387 WeakPolarHBondContact CA-O 3.47Å; A383-G387 WeakPolarHBondContact CB-O 3.31Å; A383-V388 HydrophobicContact CB-CG2 4.3Å
384	T	91.8	Very high	88.5	Confident	10 Å²	10	28 Å²	28	6%	0.061	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	174.7	161.5	71.9	0	0	0	0	108.8	F367 K368 E369 K386 G387 Y389	F367-T384 HydrophobicContact CE1-CG2 3.92Å; F367-T384 HydrophobicContact CE2-CG2 4.07Å; F367-T384 HydrophobicContact CZ-CG2 3.49Å; F367-T384 VanDerWaalsContact CZ-CG2 3.49Å; K368-T384 WeakPolarHBondContact O-CG2 3.49Å; E369-T384 HydrophobicContact CB-CG2 4.39Å; E369-T384 VanDerWaalsContact O-CA 3.28Å; E369-T384 WeakPolarHBondContact O-CA 3.48Å; E369-T384 WeakPolarHBondContact O-CB 3.2Å; E369-T384 WeakPolarHBondContact O-CG2 3.45Å; T384-K386 PolarHBondContact O-N 3.26Å; T384-K386 PolarHBondContact OG1-N 2.93Å; T384-G387 PolarHBondContact N-O 3.11Å; T384-G387 PolarHBondContact OG1-N 3.31Å; T384-Y389 HydrophobicContact CG2-CE2 4.14Å
385	S	88.6	Confident	88.2	Confident	24 Å²	24	29.3 Å²	29.3	17%	0.168	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-21.9	172.9	57.3	0	0	0	0	114.9	I110 H371	I110-S385 PolarHBondContact N-O 3.25Å; H371-S385 PolarHBondContact CE1-N 3.2Å; H371-S385 VanDerWaalsContact CE1-N 3.34Å; H371-S385 PolarHBondContact ND1-N 3.3Å
386	K	86.6	Confident	87.9	Confident	81 Å²	81	29.1 Å²	29.1	35%	0.352	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-9.8	-167.4	-62.4	145.4	-168.9	165.3	0	115	R98 E369 T384	R98-K386 WeakPolarHBondContact CA-O 3.36Å; E369-K386 VanDerWaalsContact CD-NZ 3.26Å; E369-K386 IonicContact OE1-NZ 2.72Å; E369-K386 PolarHBondContact OE1-NZ 3.07Å; E369-K386 IonicContact OE2-NZ 3.51Å; E369-K386 PolarHBondContact OE2-NZ 3.25Å; T384-K386 PolarHBondContact O-N 3.26Å; T384-K386 PolarHBondContact OG1-N 2.93Å
387	G	89.6	Confident	87.9	Confident	2 Å²	2	32.7 Å²	32.7	2%	0.021	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170	159.5	-175.1	0	0	0	0	0	114.8	V96 A383 T384	V96-G387 CarbonylContact O-C 3.46Å; V96-G387 VanDerWaalsContact O-CA 3.29Å; V96-G387 WeakPolarHBondContact O-CA 3.35Å; A383-G387 WeakPolarHBondContact CA-O 3.47Å; A383-G387 WeakPolarHBondContact CB-O 3.31Å; T384-G387 PolarHBondContact N-O 3.11Å; T384-G387 PolarHBondContact OG1-N 3.31Å
388	V	91.8	Very high	88.4	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	133.3	-176.8	-170.7	0	0	0	0	110.4	A95 V96 I110 V113 L120 V122 I381 A383	A95-V388 PolarHBondContact N-O 2.75Å; V96-V388 HydrophobicContact CB-CB 3.96Å; V96-V388 HydrophobicContact CB-CG2 4.14Å; V96-V388 HydrophobicContact CG2-CB 4.14Å; V96-V388 HydrophobicContact CG2-CG2 4.39Å; V96-V388 PolarHBondContact N-O 3.47Å; V96-V388 PolarHBondContact O-N 3.06Å; I110-V388 HydrophobicContact CD1-CG2 3.72Å; V113-V388 HydrophobicContact CG1-CG1 4.32Å; V113-V388 HydrophobicContact CG2-CG2 4.15Å; L120-V388 HydrophobicContact CD2-CG1 4.38Å; V122-V388 HydrophobicContact CG2-CG2 4.17Å; I381-V388 HydrophobicContact CG2-CG1 3.45Å; I381-V388 VanDerWaalsContact CG2-CG1 3.45Å; A383-V388 HydrophobicContact CB-CG2 4.3Å
389	Y	92.2	Very high	89	Confident	66 Å²	66	29.1 Å²	29.1	26%	0.259	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	152.2	-176.8	-55	-97.8	0	0	0	110.3	L92 V93 F367 I381 V382 T384	L92-Y389 HydrophobicContact CD1-CG 4.36Å; L92-Y389 HydrophobicContact CD2-CD1 4.38Å; L92-Y389 HydrophobicContact CG-CD1 4.33Å; V93-Y389 CarbonylContact O-C 3.52Å; V93-Y389 VanDerWaalsContact O-CA 3.27Å; V93-Y389 WeakPolarHBondContact O-CA 3.36Å; F367-Y389 HydrophobicContact CE2-CD1 4.43Å; F367-Y389 AromaticContact CE2-CD2 3.58Å; F367-Y389 HydrophobicContact CE2-CD2 3.58Å; F367-Y389 AromaticContact CE2-CE2 3.8Å; F367-Y389 HydrophobicContact CE2-CE2 3.8Å; F367-Y389 AromaticContact CE2-CG 3.94Å; F367-Y389 HydrophobicContact CE2-CG 3.94Å; F367-Y389 AromaticContact CZ-CD2 3.67Å; F367-Y389 HydrophobicContact CZ-CD2 3.67Å; F367-Y389 HydrophobicContact CZ-CE2 4.01Å; F367-Y389 HydrophobicContact CZ-CG 4.35Å; I381-Y389 WeakPolarHBondContact CA-O 3.48Å; I381-Y389 WeakPolarHBondContact CG2-O 3.33Å; V382-Y389 PolarHBondContact N-O 3.1Å; V382-Y389 WeakPolarHBondContact O-CA 3.41Å; V382-Y389 WeakPolarHBondContact O-CB 3.33Å; V382-Y389 PolarHBondContact O-N 3.35Å; V382-Y389 VanDerWaalsContact O-O 3.06Å; T384-Y389 HydrophobicContact CG2-CE2 4.14Å
390	I	91.4	Very high	89.2	Confident	3 Å²	3	26.7 Å²	26.7	2%	0.015	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	130.8	176.8	-63.1	172.2	0	0	0	108.3	V93 A95 L134 F146 I381 A392	V93-I390 PolarHBondContact N-O 2.73Å; V93-I390 PolarHBondContact O-N 3.16Å; A95-I390 HydrophobicContact CB-CD1 3.69Å; A95-I390 HydrophobicContact CB-CG1 3.83Å; L134-I390 HydrophobicContact CD1-CD1 4.11Å; L134-I390 HydrophobicContact CD2-CD1 4.23Å; F146-I390 HydrophobicContact CB-CD1 3.97Å; F146-I390 HydrophobicContact CD1-CD1 3.79Å; F146-I390 HydrophobicContact CD2-CB 4.13Å; F146-I390 HydrophobicContact CD2-CD1 4Å; F146-I390 HydrophobicContact CD2-CG2 4.05Å; F146-I390 HydrophobicContact CE1-CD1 4.29Å; F146-I390 HydrophobicContact CE2-CB 4.34Å; F146-I390 HydrophobicContact CE2-CD1 4.5Å; F146-I390 HydrophobicContact CE2-CG2 3.75Å; F146-I390 HydrophobicContact CG-CD1 3.63Å; F146-I390 HydrophobicContact CZ-CG2 4.13Å; I381-I390 HydrophobicContact CG1-CG1 4.34Å; I390-A392 PolarHBondContact O-N 3.07Å
391	L	91.9	Very high	89	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	94.3	167.8	-72.8	168.5	0	0	0	108	F90 L92 I344 I351 L365 V380 V382 P393	F90-L391 HydrophobicContact CB-CB 4.34Å; F90-L391 HydrophobicContact CB-CD2 4.26Å; F90-L391 HydrophobicContact CD1-CB 3.93Å; F90-L391 HydrophobicContact CG-CB 4.38Å; L92-L391 HydrophobicContact CB-CD2 4.17Å; L92-L391 HydrophobicContact CD1-CD2 3.75Å; L92-L391 HydrophobicContact CD1-CG 4.17Å; I344-L391 HydrophobicContact CG1-CD1 4.43Å; I344-L391 HydrophobicContact CG2-CD1 3.82Å; I351-L391 HydrophobicContact CD1-CD2 4.46Å; I351-L391 HydrophobicContact CG2-CD1 4.17Å; L365-L391 HydrophobicContact CD1-CD2 3.5Å; V380-L391 HydrophobicContact CB-CB 4.2Å; V380-L391 HydrophobicContact CB-CD1 4.43Å; V380-L391 HydrophobicContact CG1-CD1 3.96Å; V380-L391 PolarHBondContact O-N 2.93Å; V382-L391 HydrophobicContact CG2-CD1 3.62Å; V382-L391 HydrophobicContact CG2-CG 3.83Å; L391-P393 WeakPolarHBondContact O-CD 3.33Å
392	A	88.8	Confident	88.8	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.008	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	116.8	177.4	0	0	0	0	0	109.8	F90 T91 V93 P143 F146 I390	F90-A392 CarbonylContact C-O 3.59Å; F90-A392 WeakPolarHBondContact CA-O 3.29Å; T91-A392 PolarHBondContact N-O 3.29Å; T91-A392 PolarHBondContact O-N 3.26Å; V93-A392 HydrophobicContact CG2-CB 3.99Å; P143-A392 HydrophobicContact CB-CB 4.07Å; F146-A392 HydrophobicContact CE2-CB 4.1Å; I390-A392 PolarHBondContact O-N 3.07Å
393	P	86.9	Confident	88.6	Confident	72 Å²	72	34 Å²	34	47%	0.468	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	143.7	176.2	28.2	-33.7	0	0	0	110.8	F90 L391	F90-P393 HydrophobicContact CD1-CB 4.03Å; F90-P393 HydrophobicContact CE1-CB 3.77Å; L391-P393 WeakPolarHBondContact O-CD 3.33Å
394	L	86.6	Confident	88.5	Confident	16 Å²	16	34.3 Å²	34.3	8%	0.084	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-86.2	141.9	171.4	-78.3	153	0	0	0	110.2	K88 A89 L396 Q399	K88-L394 HydrophobicContact CB-CD1 3.91Å; K88-L394 HydrophobicContact CD-CD1 3.78Å; K88-L394 HydrophobicContact CG-CD1 3.65Å; K88-L394 WeakPolarHBondContact O-CD1 3.38Å; A89-L394 PolarHBondContact O-N 3.24Å; L394-L396 PolarHBondContact O-N 3.3Å; L394-Q399 HydrophobicContact CB-CG 4.2Å; L394-Q399 PolarHBondContact O-NE2 2.96Å
395	P	84.8	Confident	88.3	Confident	69 Å²	69	37.4 Å²	37.4	45%	0.448	20%	0.202	S	C	.	.	P	Polyproline II helix	trans	-52.5	133.3	179.6	-28.1	35.4	0	0	0	112.3	E397 K398 Q399	P395-E397 PolarHBondContact O-N 3.02Å; P395-K398 HydrophobicContact CB-CB 4.45Å; P395-K398 WeakPolarHBondContact O-CB 3.43Å; P395-K398 PolarHBondContact O-N 3.21Å; P395-Q399 PolarHBondContact O-N 3.33Å; P395-Q399 VanDerWaalsContact O-N 3.1Å
396	L	83.4	Confident	88.2	Confident	28 Å²	28	39.3 Å²	39.3	15%	0.147	22%	0.215	C	C	.	.	H	α-helix	trans	-61	-34.4	-175.8	-68.8	171.1	0	0	0	111.3	L394 K398 Q399 I400 L415 A419	L394-L396 PolarHBondContact O-N 3.3Å; L396-K398 VanDerWaalsContact C-N 3.29Å; L396-K398 PolarHBondContact O-N 2.71Å; L396-Q399 PolarHBondContact O-N 3.35Å; L396-I400 WeakPolarHBondContact O-CB 3.22Å; L396-I400 WeakPolarHBondContact O-CD1 3.07Å; L396-I400 WeakPolarHBondContact O-CG1 3.22Å; L396-I400 PolarHBondContact O-N 3.35Å; L396-L415 HydrophobicContact CD2-CD1 4.02Å; L396-A419 HydrophobicContact CD1-CB 3.95Å
397	E	83.3	Confident	88.3	Confident	92 Å²	92	43.7 Å²	43.7	43%	0.43	23%	0.23	S	C	.	.	H	α-helix	trans	-52.5	-47.2	171.8	-64.8	63.9	-146.2	0	0	111.2	P395 Q401 M431	P395-E397 PolarHBondContact O-N 3.02Å; E397-Q401 WeakPolarHBondContact O-CG 3.49Å; E397-Q401 PolarHBondContact O-N 3.3Å; E397-Q401 VanDerWaalsContact O-N 3.1Å; E397-M431 HydrophobicContact CB-CE 4.33Å; E397-M431 HydrophobicContact CG-CE 3.74Å; E397-M431 HydrophobicContact CG-SD 4.49Å
398	K	85.9	Confident	88.2	Confident	90 Å²	90	46.7 Å²	46.7	39%	0.391	24%	0.24	S	C	.	.	H	α-helix	trans	-69.9	-47.2	-179.5	-173.3	173	-177.3	175.3	0	110.9	A141 P395 L396 I400 Q401 D402	A141-K398 PolarHBondContact O-NZ 3.44Å; A141-K398 VanDerWaalsContact O-NZ 3.11Å; P395-K398 HydrophobicContact CB-CB 4.45Å; P395-K398 WeakPolarHBondContact O-CB 3.43Å; P395-K398 PolarHBondContact O-N 3.21Å; L396-K398 VanDerWaalsContact C-N 3.29Å; L396-K398 PolarHBondContact O-N 2.71Å; K398-I400 PolarHBondContact O-N 2.89Å; K398-Q401 PolarHBondContact O-N 3.11Å; K398-Q401 VanDerWaalsContact O-N 3.07Å; K398-D402 WeakPolarHBondContact O-CB 3.49Å; K398-D402 PolarHBondContact O-N 3.15Å
399	Q	88.8	Confident	88.2	Confident	2 Å²	2	47 Å²	47	1%	0.009	24%	0.242	C	C	.	.	H	α-helix	trans	-57.3	-37.6	177	-62	-170.1	52.6	0	0	112.5	Y342 L394 P395 L396 L403 L415	Y342-Q399 PolarHBondContact OH-OE1 2.67Å; L394-Q399 HydrophobicContact CB-CG 4.2Å; L394-Q399 PolarHBondContact O-NE2 2.96Å; P395-Q399 PolarHBondContact O-N 3.33Å; P395-Q399 VanDerWaalsContact O-N 3.1Å; L396-Q399 PolarHBondContact O-N 3.35Å; Q399-L403 VanDerWaalsContact O-CB 3.32Å; Q399-L403 WeakPolarHBondContact O-CB 3.27Å; Q399-L403 WeakPolarHBondContact O-CG 3.4Å; Q399-L403 PolarHBondContact O-N 3.49Å; Q399-L415 HydrophobicContact CB-CD2 3.91Å
400	I	89.3	Confident	88	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-70.1	-40.6	176	-67.3	161.2	0	0	0	111.5	L396 K398 L403 L404 A412 L415 A416 M431 I435	L396-I400 WeakPolarHBondContact O-CB 3.22Å; L396-I400 WeakPolarHBondContact O-CD1 3.07Å; L396-I400 WeakPolarHBondContact O-CG1 3.22Å; L396-I400 PolarHBondContact O-N 3.35Å; K398-I400 PolarHBondContact O-N 2.89Å; I400-L403 WeakPolarHBondContact O-CB 3.4Å; I400-L403 PolarHBondContact O-N 3.4Å; I400-L404 HydrophobicContact CG2-CD1 4.14Å; I400-L404 VanDerWaalsContact O-CG 3.3Å; I400-L404 WeakPolarHBondContact O-CG 3.3Å; I400-L404 PolarHBondContact O-N 3.18Å; I400-A412 HydrophobicContact CG2-CB 4.42Å; I400-L415 HydrophobicContact CD1-CG 4.48Å; I400-L415 HydrophobicContact CG1-CB 4.35Å; I400-L415 HydrophobicContact CG1-CD2 3.93Å; I400-L415 HydrophobicContact CG1-CG 4.03Å; I400-A416 HydrophobicContact CD1-CB 3.9Å; I400-M431 HydrophobicContact CD1-CE 3.92Å; I400-I435 HydrophobicContact CD1-CD1 4.29Å; I400-I435 HydrophobicContact CG2-CD1 3.82Å; I400-I435 HydrophobicContact CG2-CG1 3.95Å; I400-I435 HydrophobicContact CG2-CG2 4.16Å
401	Q	89	Confident	87.8	Confident	78 Å²	78	52.8 Å²	52.8	36%	0.364	27%	0.271	S	S	.	.	H	α-helix	trans	-68.7	-39.4	175.9	-65.2	-63.1	-63.3	0	0	112	E397 K398 L403 L404 A405	E397-Q401 WeakPolarHBondContact O-CG 3.49Å; E397-Q401 PolarHBondContact O-N 3.3Å; E397-Q401 VanDerWaalsContact O-N 3.1Å; K398-Q401 PolarHBondContact O-N 3.11Å; K398-Q401 VanDerWaalsContact O-N 3.07Å; Q401-L403 VanDerWaalsContact C-N 3.3Å; Q401-L403 PolarHBondContact O-N 3.47Å; Q401-L404 PolarHBondContact O-N 3.41Å; Q401-A405 WeakPolarHBondContact O-CB 3.26Å; Q401-A405 PolarHBondContact O-N 3.08Å
402	D	88.3	Confident	87.8	Confident	75 Å²	75	52.7 Å²	52.7	40%	0.401	27%	0.271	S	S	.	.	H	α-helix	trans	-62.1	-37.9	174.1	-63.3	-18.5	0	0	0	111.2	K398 S406	K398-D402 WeakPolarHBondContact O-CB 3.49Å; K398-D402 PolarHBondContact O-N 3.15Å; D402-S406 WeakPolarHBondContact O-CB 3.36Å; D402-S406 PolarHBondContact O-N 2.82Å; D402-S406 PolarHBondContact O-OG 3.25Å
403	L	89.3	Confident	87.9	Confident	3 Å²	3	53.6 Å²	53.6	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-64.6	-42.9	171.3	-90.2	165.6	0	0	0	113.4	I87 Q399 I400 Q401 S406 R407 R408 E411 A412 L415	I87-L403 HydrophobicContact CD1-CD1 4.33Å; I87-L403 HydrophobicContact CD1-CD2 3.48Å; I87-L403 VanDerWaalsContact CD1-CD2 3.48Å; I87-L403 HydrophobicContact CD1-CG 4.07Å; I87-L403 HydrophobicContact CG1-CD2 3.78Å; I87-L403 HydrophobicContact CG1-CG 4.06Å; I87-L403 HydrophobicContact CG2-CG 4.43Å; Q399-L403 VanDerWaalsContact O-CB 3.32Å; Q399-L403 WeakPolarHBondContact O-CB 3.27Å; Q399-L403 WeakPolarHBondContact O-CG 3.4Å; Q399-L403 PolarHBondContact O-N 3.49Å; I400-L403 WeakPolarHBondContact O-CB 3.4Å; I400-L403 PolarHBondContact O-N 3.4Å; Q401-L403 VanDerWaalsContact C-N 3.3Å; Q401-L403 PolarHBondContact O-N 3.47Å; L403-S406 WeakPolarHBondContact CA-OG 3.39Å; L403-S406 PolarHBondContact O-OG 3.17Å; L403-S406 VanDerWaalsContact O-OG 3.08Å; L403-R407 PolarHBondContact O-N 3.11Å; L403-R408 HydrophobicContact CD2-CB 3.57Å; L403-R408 HydrophobicContact CD2-CG 4.48Å; L403-R408 PolarHBondContact O-N 2.78Å; L403-E411 HydrophobicContact CD1-CB 4.39Å; L403-E411 HydrophobicContact CD2-CB 3.7Å; L403-A412 HydrophobicContact CB-CB 3.89Å; L403-L415 HydrophobicContact CD1-CB 4.47Å; L403-L415 HydrophobicContact CD1-CD2 3.84Å
404	L	90.2	Very high	88.1	Confident	7 Å²	7	52.5 Å²	52.5	4%	0.037	27%	0.267	C	S	.	.	H	α-helix	trans	-67.5	-42.1	176.8	-70.9	167.7	0	0	0	111.5	I400 Q401 S406 R407 A412 I435 Q438 A439 I442	I400-L404 HydrophobicContact CG2-CD1 4.14Å; I400-L404 VanDerWaalsContact O-CG 3.3Å; I400-L404 WeakPolarHBondContact O-CG 3.3Å; I400-L404 PolarHBondContact O-N 3.18Å; Q401-L404 PolarHBondContact O-N 3.41Å; L404-S406 VanDerWaalsContact C-N 3.35Å; L404-S406 PolarHBondContact O-N 3.27Å; L404-R407 WeakPolarHBondContact O-CA 3.31Å; L404-R407 PolarHBondContact O-N 3.06Å; L404-A412 HydrophobicContact CD2-CB 3.86Å; L404-A412 HydrophobicContact CG-CB 3.98Å; L404-I435 HydrophobicContact CD1-CG2 4.41Å; L404-Q438 HydrophobicContact CD1-CB 4.1Å; L404-A439 HydrophobicContact CD2-CB 4.21Å; L404-I442 HydrophobicContact CB-CD1 3.93Å; L404-I442 HydrophobicContact CD2-CD1 3.81Å; L404-I442 HydrophobicContact CG-CD1 4.47Å; L404-I442 VanDerWaalsContact O-CD1 3.3Å; L404-I442 WeakPolarHBondContact O-CD1 3.44Å
405	A	88	Confident	88.2	Confident	74 Å²	74	52.3 Å²	52.3	61%	0.612	27%	0.266	S	S	*	.	H	α-helix	trans	-62.7	-39.7	176.2	0	0	0	0	0	112.2	Q401 R407	Q401-A405 WeakPolarHBondContact O-CB 3.26Å; Q401-A405 PolarHBondContact O-N 3.08Å; A405-R407 PolarHBondContact O-N 3.13Å
406	S	86.8	Confident	88.4	Confident	64 Å²	64	49 Å²	49	45%	0.448	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	6.5	170.8	57	0	0	0	0	114.3	D402 L403 L404 R408	D402-S406 WeakPolarHBondContact O-CB 3.36Å; D402-S406 PolarHBondContact O-N 2.82Å; D402-S406 PolarHBondContact O-OG 3.25Å; L403-S406 WeakPolarHBondContact CA-OG 3.39Å; L403-S406 PolarHBondContact O-OG 3.17Å; L403-S406 VanDerWaalsContact O-OG 3.08Å; L404-S406 VanDerWaalsContact C-N 3.35Å; L404-S406 PolarHBondContact O-N 3.27Å; S406-R408 PolarHBondContact O-N 2.93Å
407	R	88.1	Confident	88.6	Confident	174 Å²	174	53.4 Å²	53.4	66%	0.657	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	15.6	177.9	-51.6	179.9	-177	-178.9	-0.4	115	L403 L404 A405 V409 I442	L403-R407 PolarHBondContact O-N 3.11Å; L404-R407 WeakPolarHBondContact O-CA 3.31Å; L404-R407 PolarHBondContact O-N 3.06Å; A405-R407 PolarHBondContact O-N 3.13Å; R407-V409 PolarHBondContact O-N 2.65Å; R407-I442 HydrophobicContact CB-CG2 4.13Å; R407-I442 HydrophobicContact CG-CG2 4.26Å
408	R	87.8	Confident	88.6	Confident	64 Å²	64	49.5 Å²	49.5	24%	0.242	25%	0.248	C	C	.	.			trans	-83.5	61.4	179.9	-66.1	171.4	73.2	160.4	4.1	110.8	M85 L403 S406 E410 E411 A412	M85-R408 PolarHBondContact O-NH1 2.61Å; L403-R408 HydrophobicContact CD2-CB 3.57Å; L403-R408 HydrophobicContact CD2-CG 4.48Å; L403-R408 PolarHBondContact O-N 2.78Å; S406-R408 PolarHBondContact O-N 2.93Å; R408-E410 PolarHBondContact O-N 3.24Å; R408-E411 IonicContact CZ-OE1 3.84Å; R408-E411 IonicContact CZ-OE2 2.99Å; R408-E411 IonicContact NE-OE1 2.79Å; R408-E411 PolarHBondContact NE-OE1 3.27Å; R408-E411 IonicContact NE-OE2 2.74Å; R408-E411 IonicContact NH2-OE1 3.18Å; R408-E411 PolarHBondContact NH2-OE1 2.83Å; R408-E411 IonicContact NH2-OE2 3.96Å; R408-E411 PolarHBondContact NH2-OE2 2.98Å; R408-E411 PolarHBondContact O-N 3.49Å; R408-A412 PolarHBondContact O-N 3Å; R408-A412 VanDerWaalsContact O-N 3.07Å
409	V	90.7	Very high	88.3	Confident	7 Å²	7	45.4 Å²	45.4	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-58	-44.1	-169.2	172.3	0	0	0	0	113.4	R407 E411 A412 L413 A439 I442 Q443 L455	R407-V409 PolarHBondContact O-N 2.65Å; V409-E411 PolarHBondContact O-N 3.41Å; V409-A412 WeakPolarHBondContact O-CB 3.42Å; V409-A412 PolarHBondContact O-N 2.88Å; V409-L413 HydrophobicContact CG1-CD1 3.83Å; V409-L413 HydrophobicContact CG1-CG 4.4Å; V409-L413 WeakPolarHBondContact O-CG 3.39Å; V409-L413 PolarHBondContact O-N 2.87Å; V409-A439 HydrophobicContact CG1-CB 3.65Å; V409-I442 HydrophobicContact CG2-CB 3.99Å; V409-I442 HydrophobicContact CG2-CD1 4.24Å; V409-I442 HydrophobicContact CG2-CG2 3.6Å; V409-Q443 HydrophobicContact CG1-CG 4.41Å; V409-L455 HydrophobicContact CG1-CD1 4.47Å
410	E	89.5	Confident	88	Confident	157 Å²	157	53.5 Å²	53.5	73%	0.734	26%	0.261	S	S	*	.	H	α-helix	trans	-61	-47	-178.4	-63.1	-175.4	171.4	0	0	111.9	R408 A412 L413 V414	R408-E410 PolarHBondContact O-N 3.24Å; E410-A412 PolarHBondContact O-N 2.88Å; E410-L413 PolarHBondContact O-N 3.41Å; E410-V414 WeakPolarHBondContact O-CG2 3.3Å; E410-V414 PolarHBondContact O-N 2.87Å
411	E	87.6	Confident	87.3	Confident	33 Å²	33	62.3 Å²	62.3	15%	0.154	29%	0.294	C	S	.	.	H	α-helix	trans	-65	-38.9	177.7	-65.3	177.8	-111	0	0	111.8	I87 K362 L403 R408 V409 L413 V414 L415	I87-E411 WeakPolarHBondContact CD1-OE2 3.46Å; K362-E411 IonicContact NZ-OE2 3.54Å; K362-E411 PolarHBondContact NZ-OE2 3.28Å; L403-E411 HydrophobicContact CD1-CB 4.39Å; L403-E411 HydrophobicContact CD2-CB 3.7Å; R408-E411 IonicContact CZ-OE1 3.84Å; R408-E411 IonicContact CZ-OE2 2.99Å; R408-E411 IonicContact NE-OE1 2.79Å; R408-E411 PolarHBondContact NE-OE1 3.27Å; R408-E411 IonicContact NE-OE2 2.74Å; R408-E411 IonicContact NH2-OE1 3.18Å; R408-E411 PolarHBondContact NH2-OE1 2.83Å; R408-E411 IonicContact NH2-OE2 3.96Å; R408-E411 PolarHBondContact NH2-OE2 2.98Å; R408-E411 PolarHBondContact O-N 3.49Å; V409-E411 PolarHBondContact O-N 3.41Å; E411-L413 VanDerWaalsContact C-N 3.29Å; E411-L413 PolarHBondContact O-N 3.31Å; E411-V414 PolarHBondContact O-N 3.13Å; E411-L415 WeakPolarHBondContact O-CB 3.4Å; E411-L415 PolarHBondContact O-N 3.29Å
412	A	90.8	Very high	86.4	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-56.9	-44.5	173	0	0	0	0	0	111.4	I400 L403 L404 R408 V409 E410 A416	I400-A412 HydrophobicContact CG2-CB 4.42Å; L403-A412 HydrophobicContact CB-CB 3.89Å; L404-A412 HydrophobicContact CD2-CB 3.86Å; L404-A412 HydrophobicContact CG-CB 3.98Å; R408-A412 PolarHBondContact O-N 3Å; R408-A412 VanDerWaalsContact O-N 3.07Å; V409-A412 WeakPolarHBondContact O-CB 3.42Å; V409-A412 PolarHBondContact O-N 2.88Å; E410-A412 PolarHBondContact O-N 2.88Å; A412-A416 WeakPolarHBondContact O-CB 3.2Å; A412-A416 PolarHBondContact O-N 3.43Å
413	L	91.5	Very high	86	Confident	19 Å²	19	61.2 Å²	61.2	10%	0.099	29%	0.29	C	S	.	.	H	α-helix	trans	-73.6	-35.2	-180	-66.7	171.8	0	0	0	112.7	V409 E410 E411 K417 Y432 I435 L436 A439 L455	V409-L413 HydrophobicContact CG1-CD1 3.83Å; V409-L413 HydrophobicContact CG1-CG 4.4Å; V409-L413 WeakPolarHBondContact O-CG 3.39Å; V409-L413 PolarHBondContact O-N 2.87Å; E410-L413 PolarHBondContact O-N 3.41Å; E411-L413 VanDerWaalsContact C-N 3.29Å; E411-L413 PolarHBondContact O-N 3.31Å; L413-K417 WeakPolarHBondContact O-CB 3.5Å; L413-K417 WeakPolarHBondContact O-CD 3.41Å; L413-K417 WeakPolarHBondContact O-CG 3.25Å; L413-K417 PolarHBondContact O-N 2.8Å; L413-Y432 HydrophobicContact CD2-CE2 4.47Å; L413-I435 HydrophobicContact CD2-CG2 3.91Å; L413-L436 HydrophobicContact CD2-CD2 3.69Å; L413-L436 HydrophobicContact CD2-CG 4.38Å; L413-A439 HydrophobicContact CD1-CB 4.49Å; L413-A439 HydrophobicContact CD2-CB 4.49Å; L413-L455 HydrophobicContact CD1-CD2 3.75Å
414	V	90	Very high	85.9	Confident	49 Å²	49	65 Å²	65	30%	0.297	32%	0.315	S	S	.	.	H	α-helix	trans	-65	-48.6	173	168.6	0	0	0	0	110.6	L357 E410 E411 A416 K417 G418	L357-V414 HydrophobicContact CB-CG1 3.54Å; L357-V414 HydrophobicContact CD1-CG1 4.03Å; L357-V414 HydrophobicContact CG-CG1 4.42Å; E410-V414 WeakPolarHBondContact O-CG2 3.3Å; E410-V414 PolarHBondContact O-N 2.87Å; E411-V414 PolarHBondContact O-N 3.13Å; V414-A416 PolarHBondContact O-N 3.28Å; V414-K417 PolarHBondContact O-N 3.49Å; V414-G418 PolarHBondContact O-N 2.72Å
415	L	88.4	Confident	85.7	Confident	12 Å²	12	72.2 Å²	72.2	6%	0.063	35%	0.346	C	S	.	.	H	α-helix	trans	-62.4	-44.4	177.6	-176.2	57.3	0	0	0	111.5	P341 Y342 L396 Q399 I400 L403 E411 K417 G418 A419	P341-L415 HydrophobicContact CG-CD1 3.8Å; Y342-L415 WeakPolarHBondContact OH-CD1 3.29Å; L396-L415 HydrophobicContact CD2-CD1 4.02Å; Q399-L415 HydrophobicContact CB-CD2 3.91Å; I400-L415 HydrophobicContact CD1-CG 4.48Å; I400-L415 HydrophobicContact CG1-CB 4.35Å; I400-L415 HydrophobicContact CG1-CD2 3.93Å; I400-L415 HydrophobicContact CG1-CG 4.03Å; L403-L415 HydrophobicContact CD1-CB 4.47Å; L403-L415 HydrophobicContact CD1-CD2 3.84Å; E411-L415 WeakPolarHBondContact O-CB 3.4Å; E411-L415 PolarHBondContact O-N 3.29Å; L415-K417 PolarHBondContact O-N 3.09Å; L415-G418 WeakPolarHBondContact O-CA 3.41Å; L415-G418 PolarHBondContact O-N 3.39Å; L415-G418 VanDerWaalsContact O-N 3.14Å; L415-A419 PolarHBondContact O-N 2.9Å
416	A	89.4	Confident	85.6	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.008	35%	0.347	C	S	.	.	H	α-helix	trans	-60.6	-44.6	175.1	0	0	0	0	0	112.1	I400 A412 V414 G418 A419 F428 Y432 I435	I400-A416 HydrophobicContact CD1-CB 3.9Å; A412-A416 WeakPolarHBondContact O-CB 3.2Å; A412-A416 PolarHBondContact O-N 3.43Å; V414-A416 PolarHBondContact O-N 3.28Å; A416-G418 VanDerWaalsContact C-N 3.28Å; A416-G418 PolarHBondContact O-N 3.46Å; A416-A419 PolarHBondContact O-N 3.12Å; A416-F428 WeakPolarHBondContact O-CE2 3.21Å; A416-F428 WeakPolarHBondContact O-CZ 3.48Å; A416-Y432 HydrophobicContact CB-CD2 3.99Å; A416-Y432 HydrophobicContact CB-CE2 4.17Å; A416-I435 HydrophobicContact CB-CD1 4Å; A416-I435 HydrophobicContact CB-CG2 4.38Å
417	K	88.3	Confident	85.6	Confident	120 Å²	120	78.6 Å²	78.6	52%	0.522	36%	0.358	S	S	.	.	H	α-helix	trans	-60.2	-37.4	173.9	-73.6	163.9	-172	171.7	0	111.9	L413 V414 L415 R420 Y432	L413-K417 WeakPolarHBondContact O-CB 3.5Å; L413-K417 WeakPolarHBondContact O-CD 3.41Å; L413-K417 WeakPolarHBondContact O-CG 3.25Å; L413-K417 PolarHBondContact O-N 2.8Å; V414-K417 PolarHBondContact O-N 3.49Å; L415-K417 PolarHBondContact O-N 3.09Å; K417-R420 VanDerWaalsContact O-CB 3.26Å; K417-R420 WeakPolarHBondContact O-CB 3.46Å; K417-Y432 WeakPolarHBondContact CE-OH 3.25Å; K417-Y432 HydrophobicContact CG-CE2 3.97Å
418	G	82.8	Confident	85.6	Confident	10 Å²	10	71.1 Å²	71.1	10%	0.103	33%	0.33	C	S	.	.	H	α-helix	trans	-64.6	-41.4	174.7	0	0	0	0	0	113.7	V414 L415 A416 R420 R421	V414-G418 PolarHBondContact O-N 2.72Å; L415-G418 WeakPolarHBondContact O-CA 3.41Å; L415-G418 PolarHBondContact O-N 3.39Å; L415-G418 VanDerWaalsContact O-N 3.14Å; A416-G418 VanDerWaalsContact C-N 3.28Å; A416-G418 PolarHBondContact O-N 3.46Å; G418-R420 PolarHBondContact O-N 3.2Å; G418-R421 PolarHBondContact O-N 3.37Å
419	A	80.8	Confident	85.6	Confident	3 Å²	3	72.7 Å²	72.7	3%	0.025	34%	0.34	C	S	.	.	H	α-helix	trans	-60.6	-17.5	179.7	0	0	0	0	0	114.1	L396 L415 A416 R421 N422 I423	L396-A419 HydrophobicContact CD1-CB 3.95Å; L415-A419 PolarHBondContact O-N 2.9Å; A416-A419 PolarHBondContact O-N 3.12Å; A419-R421 PolarHBondContact O-N 3.03Å; A419-N422 PolarHBondContact O-N 3.43Å; A419-I423 HydrophobicContact CB-CD1 4.13Å; A419-I423 PolarHBondContact O-N 3.05Å
420	R	81.1	Confident	85.6	Confident	172 Å²	172	77.6 Å²	77.6	65%	0.649	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-24.6	176.2	-170.3	179.4	179.2	-161.6	2.6	114.4	K417 G418 N422 F428	K417-R420 VanDerWaalsContact O-CB 3.26Å; K417-R420 WeakPolarHBondContact O-CB 3.46Å; G418-R420 PolarHBondContact O-N 3.2Å; R420-N422 VanDerWaalsContact C-N 3.32Å; R420-F428 HydrophobicContact CB-CD1 4.37Å; R420-F428 HydrophobicContact CB-CD2 4.21Å; R420-F428 HydrophobicContact CB-CE1 3.98Å; R420-F428 HydrophobicContact CB-CE2 3.82Å; R420-F428 HydrophobicContact CB-CG 4.48Å; R420-F428 HydrophobicContact CB-CZ 3.69Å; R420-F428 HydrophobicContact CG-CD1 3.96Å; R420-F428 HydrophobicContact CG-CE1 3.84Å; R420-F428 HydrophobicContact CG-CE2 4.44Å; R420-F428 HydrophobicContact CG-CG 4.32Å; R420-F428 HydrophobicContact CG-CZ 4.1Å
421	R	74.2	Confident	85.6	Confident	187 Å²	187	72 Å²	72	71%	0.706	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-25.4	175.6	-68.6	-172.3	178.2	-174.4	-3	113.4	F340 G418 A419	F340-R421 HydrophobicContact CE1-CB 4.43Å; F340-R421 HydrophobicContact CE1-CG 4.47Å; G418-R421 PolarHBondContact O-N 3.37Å; A419-R421 PolarHBondContact O-N 3.03Å
422	N	71.6	Confident	85.8	Confident	99 Å²	99	72.8 Å²	72.8	53%	0.529	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-11.1	-168.1	-59	3.9	0	0	0	112.8	A419 R420	A419-N422 PolarHBondContact O-N 3.43Å; R420-N422 VanDerWaalsContact C-N 3.32Å
423	I	79.8	Confident	85.8	Confident	30 Å²	30	77.4 Å²	77.4	15%	0.154	36%	0.364	C	S	.	.	S	Bend	trans	-119.2	133.7	-171.2	-56.2	177.4	0	0	0	110.3	A419 K427 F428 M431	A419-I423 HydrophobicContact CB-CD1 4.13Å; A419-I423 PolarHBondContact O-N 3.05Å; I423-K427 HydrophobicContact CG2-CB 4.05Å; I423-F428 HydrophobicContact CB-CB 4.24Å; I423-F428 HydrophobicContact CB-CD2 4.3Å; I423-F428 HydrophobicContact CD1-CD2 4.42Å; I423-F428 HydrophobicContact CG2-CB 3.91Å; I423-M431 HydrophobicContact CD1-CE 4.43Å; I423-M431 HydrophobicContact CD1-SD 3.75Å
424	P	85.9	Confident	85.8	Confident	83 Å²	83	80 Å²	80	54%	0.539	37%	0.372	S	S	.	.			trans	-54.6	138.8	174	-26.8	35.3	0	0	0	112.6	D426 K427 F428	P424-D426 PolarHBondContact O-N 2.72Å; P424-K427 PolarHBondContact O-N 2.99Å; P424-F428 WeakPolarHBondContact O-CB 3.47Å; P424-F428 PolarHBondContact O-N 3.2Å
425	K	86	Confident	85.9	Confident	158 Å²	158	77.9 Å²	77.9	69%	0.687	36%	0.359	S	S	*	.	H	α-helix	trans	-49.2	-40.1	-168.6	-69.7	179.4	-178.8	174.1	0	114.4	Q429	K425-Q429 WeakPolarHBondContact O-CG 3.43Å; K425-Q429 PolarHBondContact O-N 3Å
426	D	86	Confident	86.2	Confident	118 Å²	118	77.7 Å²	77.7	63%	0.631	36%	0.358	S	S	*	.	H	α-helix	trans	-79.3	-43.8	-171.9	-40.1	-57.5	0	0	0	111	P424 F428 Q429 V430	P424-D426 PolarHBondContact O-N 2.72Å; D426-F428 VanDerWaalsContact C-N 3.28Å; D426-F428 PolarHBondContact O-N 3.06Å; D426-Q429 PolarHBondContact O-N 2.91Å; D426-V430 PolarHBondContact O-N 2.92Å
427	K	86.6	Confident	86.5	Confident	154 Å²	154	79.1 Å²	79.1	67%	0.67	37%	0.365	S	S	*	.	H	α-helix	trans	-59.2	-42.1	169.6	-69.3	-172.4	175.1	-174.2	0	111.1	I423 P424 V430 M431	I423-K427 HydrophobicContact CG2-CB 4.05Å; P424-K427 PolarHBondContact O-N 2.99Å; K427-V430 PolarHBondContact O-N 3.19Å; K427-M431 WeakPolarHBondContact O-CB 3.39Å; K427-M431 PolarHBondContact O-N 3.34Å
428	F	88.8	Confident	86.7	Confident	18 Å²	18	74.4 Å²	74.4	8%	0.079	34%	0.344	C	S	.	.	H	α-helix	trans	-60.6	-44.2	176.6	-178.1	-97.4	0	0	0	112.2	A416 R420 I423 P424 D426 V430 M431 Y432	A416-F428 WeakPolarHBondContact O-CE2 3.21Å; A416-F428 WeakPolarHBondContact O-CZ 3.48Å; R420-F428 HydrophobicContact CB-CD1 4.37Å; R420-F428 HydrophobicContact CB-CD2 4.21Å; R420-F428 HydrophobicContact CB-CE1 3.98Å; R420-F428 HydrophobicContact CB-CE2 3.82Å; R420-F428 HydrophobicContact CB-CG 4.48Å; R420-F428 HydrophobicContact CB-CZ 3.69Å; R420-F428 HydrophobicContact CG-CD1 3.96Å; R420-F428 HydrophobicContact CG-CE1 3.84Å; R420-F428 HydrophobicContact CG-CE2 4.44Å; R420-F428 HydrophobicContact CG-CG 4.32Å; R420-F428 HydrophobicContact CG-CZ 4.1Å; I423-F428 HydrophobicContact CB-CB 4.24Å; I423-F428 HydrophobicContact CB-CD2 4.3Å; I423-F428 HydrophobicContact CD1-CD2 4.42Å; I423-F428 HydrophobicContact CG2-CB 3.91Å; P424-F428 WeakPolarHBondContact O-CB 3.47Å; P424-F428 PolarHBondContact O-N 3.2Å; D426-F428 VanDerWaalsContact C-N 3.28Å; D426-F428 PolarHBondContact O-N 3.06Å; F428-V430 PolarHBondContact O-N 3.48Å; F428-M431 PolarHBondContact O-N 3.48Å; F428-Y432 HydrophobicContact CE1-CD2 4.42Å; F428-Y432 HydrophobicContact CE1-CG 4.05Å; F428-Y432 AromaticContact CZ-CD2 3.92Å; F428-Y432 HydrophobicContact CZ-CD2 3.92Å; F428-Y432 AromaticContact CZ-CG 3.98Å; F428-Y432 HydrophobicContact CZ-CG 3.98Å; F428-Y432 WeakPolarHBondContact O-CB 3.38Å; F428-Y432 PolarHBondContact O-N 2.94Å
429	Q	88.8	Confident	87.3	Confident	97 Å²	97	73.9 Å²	73.9	45%	0.453	34%	0.339	S	S	.	.	H	α-helix	trans	-62.1	-44.3	178.9	-79.6	-178.6	68.4	0	0	112.7	K425 D426 Y432 R433	K425-Q429 WeakPolarHBondContact O-CG 3.43Å; K425-Q429 PolarHBondContact O-N 3Å; D426-Q429 PolarHBondContact O-N 2.91Å; Q429-Y432 PolarHBondContact O-N 3.44Å; Q429-R433 WeakPolarHBondContact O-CB 3.44Å; Q429-R433 VanDerWaalsContact O-CG 3.29Å; Q429-R433 WeakPolarHBondContact O-CG 3.34Å; Q429-R433 PolarHBondContact O-N 2.97Å
430	V	89.4	Confident	88	Confident	109 Å²	109	73.8 Å²	73.8	66%	0.661	34%	0.338	S	S	*	.	H	α-helix	trans	-63.9	-46.9	178.4	177.3	0	0	0	0	110.9	D426 K427 F428 R434	D426-V430 PolarHBondContact O-N 2.92Å; K427-V430 PolarHBondContact O-N 3.19Å; F428-V430 PolarHBondContact O-N 3.48Å; V430-R434 PolarHBondContact O-N 3.07Å
431	M	89.1	Confident	88.6	Confident	40 Å²	40	65.7 Å²	65.7	20%	0.197	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-47.7	176.1	-179.7	-173.5	177.3	0	0	111.9	E397 I400 I423 K427 F428 R434 I435	E397-M431 HydrophobicContact CB-CE 4.33Å; E397-M431 HydrophobicContact CG-CE 3.74Å; E397-M431 HydrophobicContact CG-SD 4.49Å; I400-M431 HydrophobicContact CD1-CE 3.92Å; I423-M431 HydrophobicContact CD1-CE 4.43Å; I423-M431 HydrophobicContact CD1-SD 3.75Å; K427-M431 WeakPolarHBondContact O-CB 3.39Å; K427-M431 PolarHBondContact O-N 3.34Å; F428-M431 PolarHBondContact O-N 3.48Å; M431-R434 WeakPolarHBondContact O-CB 3.31Å; M431-R434 PolarHBondContact O-N 3.34Å; M431-I435 HydrophobicContact CE-CD1 3.99Å; M431-I435 HydrophobicContact CG-CD1 3.8Å; M431-I435 WeakPolarHBondContact O-CD1 3.38Å; M431-I435 WeakPolarHBondContact O-CG1 3.19Å; M431-I435 PolarHBondContact O-N 3.02Å
432	Y	91.8	Very high	89.4	Confident	50 Å²	50	58.2 Å²	58.2	20%	0.196	28%	0.282	C	S	.	.	H	α-helix	trans	-69.5	-37.4	-175.4	-174.3	-107.2	0	0	0	112.7	L413 A416 K417 F428 Q429 I435 L436	L413-Y432 HydrophobicContact CD2-CE2 4.47Å; A416-Y432 HydrophobicContact CB-CD2 3.99Å; A416-Y432 HydrophobicContact CB-CE2 4.17Å; K417-Y432 WeakPolarHBondContact CE-OH 3.25Å; K417-Y432 HydrophobicContact CG-CE2 3.97Å; F428-Y432 HydrophobicContact CE1-CD2 4.42Å; F428-Y432 HydrophobicContact CE1-CG 4.05Å; F428-Y432 AromaticContact CZ-CD2 3.92Å; F428-Y432 HydrophobicContact CZ-CD2 3.92Å; F428-Y432 AromaticContact CZ-CG 3.98Å; F428-Y432 HydrophobicContact CZ-CG 3.98Å; F428-Y432 WeakPolarHBondContact O-CB 3.38Å; F428-Y432 PolarHBondContact O-N 2.94Å; Q429-Y432 PolarHBondContact O-N 3.44Å; Y432-I435 PolarHBondContact O-N 3.39Å; Y432-L436 HydrophobicContact CD1-CD1 3.84Å; Y432-L436 HydrophobicContact CD1-CG 4.39Å; Y432-L436 HydrophobicContact CE1-CD1 3.51Å; Y432-L436 HydrophobicContact CE1-CD2 4.43Å; Y432-L436 HydrophobicContact CE1-CG 4.05Å; Y432-L436 WeakPolarHBondContact O-CG 3.5Å; Y432-L436 PolarHBondContact O-N 3.42Å
433	R	91.7	Very high	90.5	Very high	97 Å²	97	54.3 Å²	54.3	37%	0.366	26%	0.26	S	S	.	.	H	α-helix	trans	-59.7	-45.7	170.7	-74.7	175	-173.6	-151.8	-3.2	111.7	Q429 I435 L436 Q437	Q429-R433 WeakPolarHBondContact O-CB 3.44Å; Q429-R433 VanDerWaalsContact O-CG 3.29Å; Q429-R433 WeakPolarHBondContact O-CG 3.34Å; Q429-R433 PolarHBondContact O-N 2.97Å; R433-I435 VanDerWaalsContact C-N 3.34Å; R433-I435 PolarHBondContact O-N 2.89Å; R433-L436 WeakPolarHBondContact O-CB 3.35Å; R433-L436 PolarHBondContact O-N 3.1Å; R433-Q437 VanDerWaalsContact O-CG 3.3Å; R433-Q437 WeakPolarHBondContact O-CG 3.33Å; R433-Q437 PolarHBondContact O-N 3.4Å
434	R	91.6	Very high	91.1	Very high	72 Å²	72	52.9 Å²	52.9	27%	0.272	25%	0.253	S	S	.	.	H	α-helix	trans	-60.7	-42.8	177	-173.2	179.5	174	91.9	19.8	111.9	V430 M431 Q437 Q438 P485 P486 L487	V430-R434 PolarHBondContact O-N 3.07Å; M431-R434 WeakPolarHBondContact O-CB 3.31Å; M431-R434 PolarHBondContact O-N 3.34Å; R434-Q437 PolarHBondContact O-N 3Å; R434-Q438 WeakPolarHBondContact O-CG 3.24Å; R434-Q438 PolarHBondContact O-N 3.24Å; R434-P485 PolarHBondContact NH1-O 3.33Å; R434-P485 VanDerWaalsContact NH2-C 3.33Å; R434-P485 PolarHBondContact NH2-O 2.91Å; R434-P486 PolarHBondContact NH2-O 3.1Å; R434-P486 VanDerWaalsContact NH2-O 3.12Å; R434-L487 HydrophobicContact CG-CD2 3.94Å
435	I	92.9	Very high	91.3	Very high	5 Å²	5	50.8 Å²	50.8	3%	0.026	24%	0.242	C	C	.	.	H	α-helix	trans	-61.4	-43.7	174.8	-69.2	159.9	0	0	0	111.2	I400 L404 L413 A416 M431 Y432 R433 Q437 Q438 A439	I400-I435 HydrophobicContact CD1-CD1 4.29Å; I400-I435 HydrophobicContact CG2-CD1 3.82Å; I400-I435 HydrophobicContact CG2-CG1 3.95Å; I400-I435 HydrophobicContact CG2-CG2 4.16Å; L404-I435 HydrophobicContact CD1-CG2 4.41Å; L413-I435 HydrophobicContact CD2-CG2 3.91Å; A416-I435 HydrophobicContact CB-CD1 4Å; A416-I435 HydrophobicContact CB-CG2 4.38Å; M431-I435 HydrophobicContact CE-CD1 3.99Å; M431-I435 HydrophobicContact CG-CD1 3.8Å; M431-I435 WeakPolarHBondContact O-CD1 3.38Å; M431-I435 WeakPolarHBondContact O-CG1 3.19Å; M431-I435 PolarHBondContact O-N 3.02Å; Y432-I435 PolarHBondContact O-N 3.39Å; R433-I435 VanDerWaalsContact C-N 3.34Å; R433-I435 PolarHBondContact O-N 2.89Å; I435-Q437 PolarHBondContact O-N 3.03Å; I435-Q438 PolarHBondContact O-N 3.02Å; I435-A439 VanDerWaalsContact O-CB 3.22Å; I435-A439 WeakPolarHBondContact O-CB 3.45Å; I435-A439 PolarHBondContact O-N 3.03Å
436	L	94.8	Very high	91.5	Very high	8 Å²	8	47.1 Å²	47.1	4%	0.042	23%	0.228	C	C	.	.	H	α-helix	trans	-62.4	-40	175.6	-72.9	168.9	0	0	0	112.4	L413 Y432 R433 A439 G440 L455	L413-L436 HydrophobicContact CD2-CD2 3.69Å; L413-L436 HydrophobicContact CD2-CG 4.38Å; Y432-L436 HydrophobicContact CD1-CD1 3.84Å; Y432-L436 HydrophobicContact CD1-CG 4.39Å; Y432-L436 HydrophobicContact CE1-CD1 3.51Å; Y432-L436 HydrophobicContact CE1-CD2 4.43Å; Y432-L436 HydrophobicContact CE1-CG 4.05Å; Y432-L436 WeakPolarHBondContact O-CG 3.5Å; Y432-L436 PolarHBondContact O-N 3.42Å; R433-L436 WeakPolarHBondContact O-CB 3.35Å; R433-L436 PolarHBondContact O-N 3.1Å; L436-A439 PolarHBondContact O-N 3.45Å; L436-G440 PolarHBondContact O-N 3.09Å; L436-L455 HydrophobicContact CD2-CD2 3.58Å
437	Q	93.9	Very high	91.7	Very high	32 Å²	32	44.2 Å²	44.2	15%	0.15	21%	0.211	C	C	.	.	H	α-helix	trans	-64.3	-49.4	176.2	-68.6	165.7	-7.2	0	0	111.4	R433 R434 I435 A439 G440 F441 G459 Q460 L461 L487	R433-Q437 VanDerWaalsContact O-CG 3.3Å; R433-Q437 WeakPolarHBondContact O-CG 3.33Å; R433-Q437 PolarHBondContact O-N 3.4Å; R434-Q437 PolarHBondContact O-N 3Å; I435-Q437 PolarHBondContact O-N 3.03Å; Q437-A439 PolarHBondContact O-N 2.88Å; Q437-G440 PolarHBondContact O-N 3.16Å; Q437-F441 WeakPolarHBondContact O-CD2 3.43Å; Q437-F441 PolarHBondContact O-N 3.4Å; Q437-G459 PolarHBondContact NE2-O 3.36Å; Q437-Q460 PolarHBondContact NE2-O 2.9Å; Q437-L461 HydrophobicContact CB-CD1 4.33Å; Q437-L461 HydrophobicContact CG-CB 4.23Å; Q437-L461 HydrophobicContact CG-CD1 4.04Å; Q437-L487 HydrophobicContact CB-CD1 4.13Å; Q437-L487 HydrophobicContact CB-CD2 3.92Å
438	Q	93.9	Very high	92.1	Very high	20 Å²	20	40.5 Å²	40.5	9%	0.093	20%	0.197	C	C	.	.	H	α-helix	trans	-58.1	-45.8	174.8	-68.7	-179.6	-82.1	0	0	111.6	L404 R434 I435 G440 F441 I442 L487	L404-Q438 HydrophobicContact CD1-CB 4.1Å; R434-Q438 WeakPolarHBondContact O-CG 3.24Å; R434-Q438 PolarHBondContact O-N 3.24Å; I435-Q438 PolarHBondContact O-N 3.02Å; Q438-G440 VanDerWaalsContact C-N 3.35Å; Q438-G440 PolarHBondContact O-N 2.8Å; Q438-F441 PolarHBondContact O-N 2.99Å; Q438-I442 WeakPolarHBondContact O-CG1 3.35Å; Q438-I442 PolarHBondContact O-N 3.21Å; Q438-L487 HydrophobicContact CG-CD2 3.83Å
439	A	94.6	Very high	92.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-57.9	-44.8	175	0	0	0	0	0	112.1	L404 V409 L413 I435 L436 Q437 F441 I442 Q443 L455	L404-A439 HydrophobicContact CD2-CB 4.21Å; V409-A439 HydrophobicContact CG1-CB 3.65Å; L413-A439 HydrophobicContact CD1-CB 4.49Å; L413-A439 HydrophobicContact CD2-CB 4.49Å; I435-A439 VanDerWaalsContact O-CB 3.22Å; I435-A439 WeakPolarHBondContact O-CB 3.45Å; I435-A439 PolarHBondContact O-N 3.03Å; L436-A439 PolarHBondContact O-N 3.45Å; Q437-A439 PolarHBondContact O-N 2.88Å; A439-F441 VanDerWaalsContact C-N 3.35Å; A439-F441 PolarHBondContact O-N 2.96Å; A439-I442 PolarHBondContact O-N 3.43Å; A439-Q443 WeakPolarHBondContact O-CG 3.46Å; A439-Q443 PolarHBondContact O-N 2.88Å; A439-L455 HydrophobicContact CB-CD1 4.05Å; A439-L455 HydrophobicContact CB-CD2 4.33Å
440	G	94.7	Very high	92.5	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.8	-41.7	176.3	0	0	0	0	0	112.8	L436 Q437 Q438 I442 Q443 F444 F456	L436-G440 PolarHBondContact O-N 3.09Å; Q437-G440 PolarHBondContact O-N 3.16Å; Q438-G440 VanDerWaalsContact C-N 3.35Å; Q438-G440 PolarHBondContact O-N 2.8Å; G440-I442 VanDerWaalsContact C-N 3.33Å; G440-I442 PolarHBondContact O-N 2.84Å; G440-Q443 PolarHBondContact O-N 3.07Å; G440-F444 WeakPolarHBondContact O-CB 3.3Å; G440-F444 PolarHBondContact O-N 2.92Å; G440-F456 WeakPolarHBondContact O-CZ 3.29Å
441	F	93.8	Very high	92.7	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.009	20%	0.199	C	C	.	.	H	α-helix	trans	-69.1	-28.4	176.3	-75.9	-65.7	0	0	0	113.8	Q437 Q438 A439 A445 F456 L461 E465 L466 L469 L487 H488 Y490	Q437-F441 WeakPolarHBondContact O-CD2 3.43Å; Q437-F441 PolarHBondContact O-N 3.4Å; Q438-F441 PolarHBondContact O-N 2.99Å; A439-F441 VanDerWaalsContact C-N 3.35Å; A439-F441 PolarHBondContact O-N 2.96Å; F441-A445 VanDerWaalsContact O-CB 3.28Å; F441-A445 WeakPolarHBondContact O-CB 3.16Å; F441-A445 PolarHBondContact O-N 3.31Å; F441-F456 HydrophobicContact CD1-CE1 4.02Å; F441-F456 AromaticContact CD1-CZ 3.91Å; F441-F456 HydrophobicContact CD1-CZ 3.91Å; F441-F456 HydrophobicContact CD2-CE1 4.01Å; F441-F456 HydrophobicContact CE1-CE1 4.18Å; F441-F456 HydrophobicContact CE1-CZ 4.16Å; F441-F456 HydrophobicContact CE2-CE1 4.16Å; F441-F456 AromaticContact CG-CE1 3.93Å; F441-F456 HydrophobicContact CG-CE1 3.93Å; F441-F456 HydrophobicContact CG-CZ 4.19Å; F441-F456 HydrophobicContact CZ-CE1 4.24Å; F441-L461 HydrophobicContact CE1-CD2 4.4Å; F441-L461 HydrophobicContact CE2-CD1 3.71Å; F441-L461 HydrophobicContact CE2-CD2 4.01Å; F441-L461 HydrophobicContact CZ-CD1 3.91Å; F441-L461 HydrophobicContact CZ-CD2 3.64Å; F441-L461 HydrophobicContact CZ-CG 4.44Å; F441-E465 HydrophobicContact CZ-CB 3.82Å; F441-L466 HydrophobicContact CD1-CD2 4.35Å; F441-L466 HydrophobicContact CE1-CD2 3.7Å; F441-L466 HydrophobicContact CE1-CG 3.95Å; F441-L466 HydrophobicContact CZ-CG 4.33Å; F441-L469 HydrophobicContact CE1-CD1 4.44Å; F441-L487 HydrophobicContact CD2-CB 3.79Å; F441-L487 HydrophobicContact CE2-CB 3.77Å; F441-L487 HydrophobicContact CE2-CD1 4Å; F441-H488 HydrophobicContact CB-CB 3.92Å; F441-H488 HydrophobicContact CD1-CB 4.44Å; F441-H488 AromaticContact CD1-CD2 3.68Å; F441-H488 AromaticContact CD2-CD2 3.9Å; F441-H488 AromaticContact CE1-CD2 3.68Å; F441-H488 AromaticContact CE2-CD2 3.92Å; F441-H488 HydrophobicContact CG-CB 4.07Å; F441-H488 AromaticContact CG-CD2 3.8Å; F441-H488 AromaticContact CZ-CD2 3.81Å; F441-Y490 WeakPolarHBondContact CD1-OH 3.41Å; F441-Y490 PolarHBondContact O-OH 3.24Å
442	I	92.6	Very high	92.9	Very high	31 Å²	31	39.9 Å²	39.9	16%	0.159	19%	0.189	C	C	.	.	H	α-helix	trans	-70.3	-44.1	171.6	-67.4	158.8	0	0	0	110.5	L404 R407 V409 Q438 A439 G440 A445 Q446	L404-I442 HydrophobicContact CB-CD1 3.93Å; L404-I442 HydrophobicContact CD2-CD1 3.81Å; L404-I442 HydrophobicContact CG-CD1 4.47Å; L404-I442 VanDerWaalsContact O-CD1 3.3Å; L404-I442 WeakPolarHBondContact O-CD1 3.44Å; R407-I442 HydrophobicContact CB-CG2 4.13Å; R407-I442 HydrophobicContact CG-CG2 4.26Å; V409-I442 HydrophobicContact CG2-CB 3.99Å; V409-I442 HydrophobicContact CG2-CD1 4.24Å; V409-I442 HydrophobicContact CG2-CG2 3.6Å; Q438-I442 WeakPolarHBondContact O-CG1 3.35Å; Q438-I442 PolarHBondContact O-N 3.21Å; A439-I442 PolarHBondContact O-N 3.43Å; G440-I442 VanDerWaalsContact C-N 3.33Å; G440-I442 PolarHBondContact O-N 2.84Å; I442-A445 WeakPolarHBondContact O-CB 3.26Å; I442-A445 PolarHBondContact O-N 2.89Å; I442-Q446 WeakPolarHBondContact O-CG 3.26Å; I442-Q446 PolarHBondContact O-N 2.96Å; I442-Q446 VanDerWaalsContact O-N 3.07Å
443	Q	93.4	Very high	93	Very high	17 Å²	17	38.9 Å²	38.9	8%	0.079	19%	0.186	C	C	.	.	H	α-helix	trans	-68.9	-39.3	178.1	-61.8	-60.3	67.7	0	0	111.9	V409 A439 G440 A445 Q446 L447 Q448 E451 A452 L455	V409-Q443 HydrophobicContact CG1-CG 4.41Å; A439-Q443 WeakPolarHBondContact O-CG 3.46Å; A439-Q443 PolarHBondContact O-N 2.88Å; G440-Q443 PolarHBondContact O-N 3.07Å; Q443-A445 VanDerWaalsContact C-N 3.29Å; Q443-A445 PolarHBondContact O-N 3.25Å; Q443-Q446 CarbonylContact O-C 3.59Å; Q443-Q446 WeakPolarHBondContact O-CA 3.22Å; Q443-Q446 PolarHBondContact O-N 3.12Å; Q443-L447 PolarHBondContact O-N 3.01Å; Q443-L447 VanDerWaalsContact O-N 3.16Å; Q443-Q448 HydrophobicContact CB-CB 4.11Å; Q443-Q448 PolarHBondContact O-N 3.46Å; Q443-E451 HydrophobicContact CB-CB 4.39Å; Q443-E451 HydrophobicContact CG-CB 4.36Å; Q443-A452 HydrophobicContact CB-CB 4.03Å; Q443-L455 HydrophobicContact CB-CD1 4.4Å; Q443-L455 HydrophobicContact CG-CD1 3.71Å
444	F	93	Very high	93	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-58.4	-41.6	170.6	176.6	-102.8	0	0	0	111.4	G440 Q446 L447 F449 A452 F456 L469 L493 L496 C507 F510	G440-F444 WeakPolarHBondContact O-CB 3.3Å; G440-F444 PolarHBondContact O-N 2.92Å; F444-Q446 VanDerWaalsContact C-N 3.26Å; F444-Q446 PolarHBondContact O-N 3.14Å; F444-L447 PolarHBondContact O-N 3.46Å; F444-F449 AromaticContact CD2-CD1 3.97Å; F444-F449 HydrophobicContact CD2-CD1 3.97Å; F444-F449 AromaticContact CD2-CE1 3.77Å; F444-F449 HydrophobicContact CD2-CE1 3.77Å; F444-F449 HydrophobicContact CE2-CD1 4.28Å; F444-F449 AromaticContact CE2-CE1 3.74Å; F444-F449 HydrophobicContact CE2-CE1 3.74Å; F444-A452 HydrophobicContact CB-CB 4.04Å; F444-F456 HydrophobicContact CB-CE2 4.25Å; F444-F456 HydrophobicContact CB-CZ 4.04Å; F444-L469 HydrophobicContact CE1-CD1 3.96Å; F444-L493 HydrophobicContact CE1-CD1 4.44Å; F444-L493 HydrophobicContact CZ-CD1 4.29Å; F444-L496 HydrophobicContact CD1-CD2 3.88Å; F444-L496 HydrophobicContact CE1-CD2 3.56Å; F444-L496 HydrophobicContact CZ-CD2 4.5Å; F444-C507 HydrophobicContact CE2-CB 4.31Å; F444-C507 HydrophobicContact CZ-CB 4.05Å; F444-F510 AromaticContact CD2-CD1 3.71Å; F444-F510 HydrophobicContact CD2-CD1 3.71Å; F444-F510 AromaticContact CD2-CE1 3.62Å; F444-F510 HydrophobicContact CD2-CE1 3.62Å; F444-F510 HydrophobicContact CD2-CZ 4.36Å; F444-F510 AromaticContact CE2-CD1 3.46Å; F444-F510 HydrophobicContact CE2-CD1 3.46Å; F444-F510 VanDerWaalsContact CE2-CD1 3.46Å; F444-F510 AromaticContact CE2-CE1 3.77Å; F444-F510 HydrophobicContact CE2-CE1 3.77Å; F444-F510 HydrophobicContact CE2-CG 4.34Å
445	A	90.1	Very high	93.1	Very high	38 Å²	38	38.8 Å²	38.8	31%	0.314	19%	0.193	S	C	.	.	H	α-helix	trans	-67	-23.2	175.1	0	0	0	0	0	114.3	F441 I442 Q443 L447 Y490 L496	F441-A445 VanDerWaalsContact O-CB 3.28Å; F441-A445 WeakPolarHBondContact O-CB 3.16Å; F441-A445 PolarHBondContact O-N 3.31Å; I442-A445 WeakPolarHBondContact O-CB 3.26Å; I442-A445 PolarHBondContact O-N 2.89Å; Q443-A445 VanDerWaalsContact C-N 3.29Å; Q443-A445 PolarHBondContact O-N 3.25Å; A445-L447 VanDerWaalsContact C-N 3.34Å; A445-Y490 HydrophobicContact CB-CE1 3.95Å; A445-L496 HydrophobicContact CB-CD1 3.56Å
446	Q	90.3	Very high	93.1	Very high	82 Å²	82	38.6 Å²	38.6	38%	0.383	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	3.8	171.1	-66.3	-176.2	52.2	0	0	113.2	I442 Q443 F444 Q448	I442-Q446 WeakPolarHBondContact O-CG 3.26Å; I442-Q446 PolarHBondContact O-N 2.96Å; I442-Q446 VanDerWaalsContact O-N 3.07Å; Q443-Q446 CarbonylContact O-C 3.59Å; Q443-Q446 WeakPolarHBondContact O-CA 3.22Å; Q443-Q446 PolarHBondContact O-N 3.12Å; F444-Q446 VanDerWaalsContact C-N 3.26Å; F444-Q446 PolarHBondContact O-N 3.14Å; Q446-Q448 HydrophobicContact CB-CG 4.33Å; Q446-Q448 PolarHBondContact O-N 3.46Å
447	L	91	Very high	92.9	Very high	56 Å²	56	44.7 Å²	44.7	29%	0.293	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	18	-172.9	-45.6	174.8	0	0	0	113.7	Q443 F444 A445 F449 K503	Q443-L447 PolarHBondContact O-N 3.01Å; Q443-L447 VanDerWaalsContact O-N 3.16Å; F444-L447 PolarHBondContact O-N 3.46Å; A445-L447 VanDerWaalsContact C-N 3.34Å; L447-F449 HydrophobicContact CB-CE2 3.89Å; L447-F449 HydrophobicContact CB-CZ 4.04Å; L447-F449 HydrophobicContact CD2-CE1 4.38Å; L447-F449 HydrophobicContact CD2-CE2 4.31Å; L447-F449 HydrophobicContact CD2-CZ 3.69Å; L447-F449 HydrophobicContact CG-CZ 4.46Å; L447-F449 WeakPolarHBondContact O-CD2 3.45Å; L447-F449 PolarHBondContact O-N 2.91Å; L447-K503 HydrophobicContact CD1-CD 4.24Å; L447-K503 HydrophobicContact CD1-CG 4.04Å
448	Q	93.2	Very high	92.8	Very high	77 Å²	77	46.3 Å²	46.3	36%	0.36	23%	0.23	S	C	.	.			trans	-80.3	73	171.9	-73.2	-166.7	-8.5	0	0	109.4	Q443 Q446 E451 A452	Q443-Q448 HydrophobicContact CB-CB 4.11Å; Q443-Q448 PolarHBondContact O-N 3.46Å; Q446-Q448 HydrophobicContact CB-CG 4.33Å; Q446-Q448 PolarHBondContact O-N 3.46Å; Q448-E451 WeakPolarHBondContact CA-OE2 3.45Å; Q448-E451 HydrophobicContact CB-CB 4.31Å; Q448-E451 HydrophobicContact CB-CG 4.39Å; Q448-E451 WeakPolarHBondContact CB-OE2 3.49Å; Q448-A452 VanDerWaalsContact O-CB 3.25Å; Q448-A452 WeakPolarHBondContact O-CB 3.47Å; Q448-A452 PolarHBondContact O-N 2.81Å
449	F	93.9	Very high	92.5	Very high	41 Å²	41	45.4 Å²	45.4	18%	0.18	23%	0.225	C	C	.	.	H	α-helix	trans	-70.4	-30.9	-167.5	-68.5	-58.1	0	0	0	114.4	F444 L447 K453 K506 F510	F444-F449 AromaticContact CD2-CD1 3.97Å; F444-F449 HydrophobicContact CD2-CD1 3.97Å; F444-F449 AromaticContact CD2-CE1 3.77Å; F444-F449 HydrophobicContact CD2-CE1 3.77Å; F444-F449 HydrophobicContact CE2-CD1 4.28Å; F444-F449 AromaticContact CE2-CE1 3.74Å; F444-F449 HydrophobicContact CE2-CE1 3.74Å; L447-F449 HydrophobicContact CB-CE2 3.89Å; L447-F449 HydrophobicContact CB-CZ 4.04Å; L447-F449 HydrophobicContact CD2-CE1 4.38Å; L447-F449 HydrophobicContact CD2-CE2 4.31Å; L447-F449 HydrophobicContact CD2-CZ 3.69Å; L447-F449 HydrophobicContact CG-CZ 4.46Å; L447-F449 WeakPolarHBondContact O-CD2 3.45Å; L447-F449 PolarHBondContact O-N 2.91Å; F449-K453 VanDerWaalsContact O-CB 3.28Å; F449-K453 WeakPolarHBondContact O-CB 2.91Å; F449-K453 PolarHBondContact O-N 3.11Å; F449-K506 HydrophobicContact CE2-CB 3.95Å; F449-K506 HydrophobicContact CZ-CB 4.1Å; F449-F510 HydrophobicContact CB-CD2 3.66Å; F449-F510 HydrophobicContact CB-CE2 4.17Å; F449-F510 HydrophobicContact CB-CG 4.36Å; F449-F510 HydrophobicContact CD1-CB 3.55Å; F449-F510 HydrophobicContact CD1-CD1 4.04Å; F449-F510 AromaticContact CD1-CD2 3.56Å; F449-F510 HydrophobicContact CD1-CD2 3.56Å; F449-F510 HydrophobicContact CD1-CE2 4.23Å; F449-F510 AromaticContact CD1-CG 3.41Å; F449-F510 HydrophobicContact CD1-CG 3.41Å; F449-F510 VanDerWaalsContact CD1-CG 3.41Å; F449-F510 HydrophobicContact CE1-CB 3.76Å; F449-F510 HydrophobicContact CE1-CD1 4.35Å; F449-F510 AromaticContact CE1-CG 3.95Å; F449-F510 HydrophobicContact CE1-CG 3.95Å; F449-F510 HydrophobicContact CG-CB 4.05Å; F449-F510 AromaticContact CG-CD2 3.9Å; F449-F510 HydrophobicContact CG-CD2 3.9Å; F449-F510 HydrophobicContact CG-CG 4.09Å; F449-F510 HydrophobicContact CZ-CB 4.4Å; F449-F510 VanDerWaalsContact O-CE2 3.3Å; F449-F510 WeakPolarHBondContact O-CE2 3.34Å
450	L	93	Very high	92.3	Very high	126 Å²	126	50.1 Å²	50.1	66%	0.66	25%	0.247	S	C	*	.	H	α-helix	trans	-73.7	-45	-179.4	-63	176.2	0	0	0	110	K453 E454	L450-K453 WeakPolarHBondContact O-CB 3.49Å; L450-K453 PolarHBondContact O-N 3.26Å; L450-E454 PolarHBondContact O-N 3.07Å; L450-E454 VanDerWaalsContact O-N 3.12Å
451	E	93	Very high	92.1	Very high	84 Å²	84	50.2 Å²	50.2	39%	0.393	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-47.1	176.3	-57.5	74.1	-168	0	0	110.2	Q443 Q448 K453 E454 L455	Q443-E451 HydrophobicContact CB-CB 4.39Å; Q443-E451 HydrophobicContact CG-CB 4.36Å; Q448-E451 WeakPolarHBondContact CA-OE2 3.45Å; Q448-E451 HydrophobicContact CB-CB 4.31Å; Q448-E451 HydrophobicContact CB-CG 4.39Å; Q448-E451 WeakPolarHBondContact CB-OE2 3.49Å; E451-K453 VanDerWaalsContact C-N 3.33Å; E451-K453 PolarHBondContact O-N 3.11Å; E451-E454 PolarHBondContact O-N 2.76Å; E451-L455 WeakPolarHBondContact O-CB 3.49Å; E451-L455 WeakPolarHBondContact O-CD1 3.49Å; E451-L455 WeakPolarHBondContact O-CG 3.38Å; E451-L455 PolarHBondContact O-N 3.09Å
452	A	94.6	Very high	91.9	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.6	-42.1	174	0	0	0	0	0	112.4	Q443 F444 Q448 E454 L455 F456	Q443-A452 HydrophobicContact CB-CB 4.03Å; F444-A452 HydrophobicContact CB-CB 4.04Å; Q448-A452 VanDerWaalsContact O-CB 3.25Å; Q448-A452 WeakPolarHBondContact O-CB 3.47Å; Q448-A452 PolarHBondContact O-N 2.81Å; A452-E454 PolarHBondContact O-N 3.46Å; A452-L455 PolarHBondContact O-N 2.99Å; A452-F456 HydrophobicContact CB-CD2 4.36Å; A452-F456 HydrophobicContact CB-CE2 3.91Å; A452-F456 HydrophobicContact CB-CZ 4.45Å; A452-F456 WeakPolarHBondContact O-CB 3.3Å; A452-F456 WeakPolarHBondContact O-CD2 3.25Å; A452-F456 WeakPolarHBondContact O-CG 3.09Å; A452-F456 PolarHBondContact O-N 2.76Å
453	K	93.1	Very high	91.7	Very high	29 Å²	29	50.7 Å²	50.7	13%	0.126	25%	0.251	C	S	.	.	H	α-helix	trans	-60.4	-45.6	179.1	-167.9	162.5	178	178.4	0	112.3	F449 L450 E451 R457 F510 S513 Y514 E517	F449-K453 VanDerWaalsContact O-CB 3.28Å; F449-K453 WeakPolarHBondContact O-CB 2.91Å; F449-K453 PolarHBondContact O-N 3.11Å; L450-K453 WeakPolarHBondContact O-CB 3.49Å; L450-K453 PolarHBondContact O-N 3.26Å; E451-K453 VanDerWaalsContact C-N 3.33Å; E451-K453 PolarHBondContact O-N 3.11Å; K453-R457 WeakPolarHBondContact O-CB 3.32Å; K453-R457 VanDerWaalsContact O-CG 3.31Å; K453-R457 WeakPolarHBondContact O-CG 3.16Å; K453-R457 PolarHBondContact O-N 3.35Å; K453-F510 HydrophobicContact CB-CE2 4.12Å; K453-S513 PolarHBondContact NZ-OG 3.08Å; K453-Y514 HydrophobicContact CG-CD2 4.04Å; K453-Y514 HydrophobicContact CG-CE2 4.49Å; K453-E517 WeakPolarHBondContact CE-OE1 3.35Å; K453-E517 WeakPolarHBondContact CE-OE2 3.26Å; K453-E517 VanDerWaalsContact NZ-CD 3.27Å; K453-E517 IonicContact NZ-OE1 3.95Å; K453-E517 PolarHBondContact NZ-OE1 2.74Å; K453-E517 IonicContact NZ-OE2 3.42Å; K453-E517 PolarHBondContact NZ-OE2 2.98Å
454	E	92.5	Very high	91.6	Very high	146 Å²	146	52.2 Å²	52.2	68%	0.682	26%	0.256	S	S	*	.	H	α-helix	trans	-67.3	-39.1	176.7	-67.5	-169.4	171.7	0	0	112.2	L450 E451 A452 R457 S458	L450-E454 PolarHBondContact O-N 3.07Å; L450-E454 VanDerWaalsContact O-N 3.12Å; E451-E454 PolarHBondContact O-N 2.76Å; A452-E454 PolarHBondContact O-N 3.46Å; E454-R457 PolarHBondContact O-N 2.99Å; E454-S458 VanDerWaalsContact O-CB 3.31Å; E454-S458 WeakPolarHBondContact O-CB 3.3Å; E454-S458 PolarHBondContact O-N 2.85Å; E454-S458 PolarHBondContact O-OG 3.28Å
455	L	93.4	Very high	91.5	Very high	21 Å²	21	52.5 Å²	52.5	11%	0.11	26%	0.257	C	S	.	.	H	α-helix	trans	-66.1	-41.5	176.6	-69.4	168.7	0	0	0	112.2	V409 L413 L436 A439 Q443 E451 A452 S458 G459	V409-L455 HydrophobicContact CG1-CD1 4.47Å; L413-L455 HydrophobicContact CD1-CD2 3.75Å; L436-L455 HydrophobicContact CD2-CD2 3.58Å; A439-L455 HydrophobicContact CB-CD1 4.05Å; A439-L455 HydrophobicContact CB-CD2 4.33Å; Q443-L455 HydrophobicContact CB-CD1 4.4Å; Q443-L455 HydrophobicContact CG-CD1 3.71Å; E451-L455 WeakPolarHBondContact O-CB 3.49Å; E451-L455 WeakPolarHBondContact O-CD1 3.49Å; E451-L455 WeakPolarHBondContact O-CG 3.38Å; E451-L455 PolarHBondContact O-N 3.09Å; A452-L455 PolarHBondContact O-N 2.99Å; L455-S458 PolarHBondContact O-OG 3.42Å; L455-G459 WeakPolarHBondContact O-CA 3.48Å; L455-G459 PolarHBondContact O-N 2.9Å
456	F	93.2	Very high	91.5	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.9	-41	175.2	-61.9	-40.8	0	0	0	112.7	G440 F441 F444 A452 Q460 L461 L466 F510 Y514	G440-F456 WeakPolarHBondContact O-CZ 3.29Å; F441-F456 HydrophobicContact CD1-CE1 4.02Å; F441-F456 AromaticContact CD1-CZ 3.91Å; F441-F456 HydrophobicContact CD1-CZ 3.91Å; F441-F456 HydrophobicContact CD2-CE1 4.01Å; F441-F456 HydrophobicContact CE1-CE1 4.18Å; F441-F456 HydrophobicContact CE1-CZ 4.16Å; F441-F456 HydrophobicContact CE2-CE1 4.16Å; F441-F456 AromaticContact CG-CE1 3.93Å; F441-F456 HydrophobicContact CG-CE1 3.93Å; F441-F456 HydrophobicContact CG-CZ 4.19Å; F441-F456 HydrophobicContact CZ-CE1 4.24Å; F444-F456 HydrophobicContact CB-CE2 4.25Å; F444-F456 HydrophobicContact CB-CZ 4.04Å; A452-F456 HydrophobicContact CB-CD2 4.36Å; A452-F456 HydrophobicContact CB-CE2 3.91Å; A452-F456 HydrophobicContact CB-CZ 4.45Å; A452-F456 WeakPolarHBondContact O-CB 3.3Å; A452-F456 WeakPolarHBondContact O-CD2 3.25Å; A452-F456 WeakPolarHBondContact O-CG 3.09Å; A452-F456 PolarHBondContact O-N 2.76Å; F456-Q460 PolarHBondContact O-N 3.29Å; F456-Q460 VanDerWaalsContact O-N 3.1Å; F456-L461 HydrophobicContact CB-CB 4.18Å; F456-L461 HydrophobicContact CB-CD2 4.23Å; F456-L461 HydrophobicContact CD1-CB 4.29Å; F456-L461 HydrophobicContact CD1-CD2 3.39Å; F456-L461 HydrophobicContact CD1-CG 4.38Å; F456-L461 HydrophobicContact CD2-CD2 4.46Å; F456-L461 HydrophobicContact CE1-CD2 3.7Å; F456-L461 HydrophobicContact CG-CD2 3.81Å; F456-L461 HydrophobicContact CZ-CD2 4.38Å; F456-L461 PolarHBondContact O-N 3.04Å; F456-L461 VanDerWaalsContact O-N 3.17Å; F456-L466 HydrophobicContact CD2-CD1 3.9Å; F456-L466 HydrophobicContact CE2-CD1 3.84Å; F456-L466 HydrophobicContact CE2-CD2 4.04Å; F456-L466 HydrophobicContact CE2-CG 4.46Å; F456-L466 HydrophobicContact CG-CD1 4.43Å; F456-L466 HydrophobicContact CZ-CD1 4.29Å; F456-L466 HydrophobicContact CZ-CD2 4.04Å; F456-F510 HydrophobicContact CD2-CZ 4.06Å; F456-F510 HydrophobicContact CE2-CE1 4.2Å; F456-F510 AromaticContact CE2-CZ 3.94Å; F456-F510 HydrophobicContact CE2-CZ 3.94Å; F456-Y514 HydrophobicContact CB-CE2 4.15Å; F456-Y514 WeakPolarHBondContact CB-OH 3.38Å
457	R	90.4	Very high	91.5	Very high	136 Å²	136	46.9 Å²	46.9	51%	0.513	22%	0.224	S	C	.	.	H	α-helix	trans	-64.5	-46.1	175.7	-73.7	177	66.3	152.6	-2.3	111.8	K453 E454 Q460 Y514 E517	K453-R457 WeakPolarHBondContact O-CB 3.32Å; K453-R457 VanDerWaalsContact O-CG 3.31Å; K453-R457 WeakPolarHBondContact O-CG 3.16Å; K453-R457 PolarHBondContact O-N 3.35Å; E454-R457 PolarHBondContact O-N 2.99Å; R457-Q460 PolarHBondContact O-N 3.33Å; R457-Y514 HydrophobicContact CG-CE2 4.14Å; R457-E517 IonicContact CZ-OE2 2.69Å; R457-E517 IonicContact NH1-OE2 3.02Å; R457-E517 PolarHBondContact NH1-OE2 2.87Å
458	S	90.8	Very high	91.4	Very high	67 Å²	67	45.3 Å²	45.3	47%	0.469	22%	0.218	S	C	.	.	H	α-helix	trans	-73.5	-30.3	179.1	58.8	0	0	0	0	113.5	E454 L455 Q460	E454-S458 VanDerWaalsContact O-CB 3.31Å; E454-S458 WeakPolarHBondContact O-CB 3.3Å; E454-S458 PolarHBondContact O-N 2.85Å; E454-S458 PolarHBondContact O-OG 3.28Å; L455-S458 PolarHBondContact O-OG 3.42Å; S458-Q460 VanDerWaalsContact C-N 3.32Å
459	G	88.5	Confident	91.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-77.8	-10.1	173.9	0	0	0	0	0	114.8	Q437 L455	Q437-G459 PolarHBondContact NE2-O 3.36Å; L455-G459 WeakPolarHBondContact O-CA 3.48Å; L455-G459 PolarHBondContact O-N 2.9Å
460	Q	89.5	Confident	90.9	Very high	99 Å²	99	40.3 Å²	40.3	46%	0.463	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	58	-172.2	-61.8	-173.4	-16.1	0	0	111.6	Q437 F456 R457 S458	Q437-Q460 PolarHBondContact NE2-O 2.9Å; F456-Q460 PolarHBondContact O-N 3.29Å; F456-Q460 VanDerWaalsContact O-N 3.1Å; R457-Q460 PolarHBondContact O-N 3.33Å; S458-Q460 VanDerWaalsContact C-N 3.32Å
461	L	90.8	Very high	90.4	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.01	19%	0.185	C	C	.	.			trans	-66	135.9	177.7	179.1	65.3	0	0	0	111.4	Q437 F441 F456 V463 E465 L466 L487	Q437-L461 HydrophobicContact CB-CD1 4.33Å; Q437-L461 HydrophobicContact CG-CB 4.23Å; Q437-L461 HydrophobicContact CG-CD1 4.04Å; F441-L461 HydrophobicContact CE1-CD2 4.4Å; F441-L461 HydrophobicContact CE2-CD1 3.71Å; F441-L461 HydrophobicContact CE2-CD2 4.01Å; F441-L461 HydrophobicContact CZ-CD1 3.91Å; F441-L461 HydrophobicContact CZ-CD2 3.64Å; F441-L461 HydrophobicContact CZ-CG 4.44Å; F456-L461 HydrophobicContact CB-CB 4.18Å; F456-L461 HydrophobicContact CB-CD2 4.23Å; F456-L461 HydrophobicContact CD1-CB 4.29Å; F456-L461 HydrophobicContact CD1-CD2 3.39Å; F456-L461 HydrophobicContact CD1-CG 4.38Å; F456-L461 HydrophobicContact CD2-CD2 4.46Å; F456-L461 HydrophobicContact CE1-CD2 3.7Å; F456-L461 HydrophobicContact CG-CD2 3.81Å; F456-L461 HydrophobicContact CZ-CD2 4.38Å; F456-L461 PolarHBondContact O-N 3.04Å; F456-L461 VanDerWaalsContact O-N 3.17Å; L461-V463 PolarHBondContact O-N 2.96Å; L461-E465 HydrophobicContact CD1-CB 4.17Å; L461-E465 HydrophobicContact CD1-CG 4.11Å; L461-L466 HydrophobicContact CD2-CD1 3.62Å; L461-L466 HydrophobicContact CD2-CG 3.87Å; L461-L487 HydrophobicContact CD1-CD1 4.04Å
462	D	89.2	Confident	89.9	Confident	44 Å²	44	41.5 Å²	41.5	24%	0.235	20%	0.201	C	C	.	.			trans	-66.5	112.3	162.7	-173.4	-33.4	0	0	0	108.5	R464 E465	D462-R464 PolarHBondContact O-N 3.12Å; D462-R464 VanDerWaalsContact OD1-CB 3.31Å; D462-R464 WeakPolarHBondContact OD1-CB 3.4Å; D462-R464 WeakPolarHBondContact OD1-CG 3.18Å; D462-R464 IonicContact OD1-CZ 3.78Å; D462-R464 PolarHBondContact OD1-N 2.84Å; D462-R464 IonicContact OD1-NE 2.75Å; D462-R464 PolarHBondContact OD1-NE 3.44Å; D462-R464 IonicContact OD1-NH2 3.96Å; D462-R464 IonicContact OD2-CZ 3.61Å; D462-R464 IonicContact OD2-NE 2.66Å; D462-R464 PolarHBondContact OD2-NE 3.1Å; D462-R464 IonicContact OD2-NH2 2.72Å; D462-R464 PolarHBondContact OD2-NH2 3.12Å; D462-E465 WeakPolarHBondContact O-CB 3.15Å; D462-E465 PolarHBondContact O-N 2.87Å
463	V	89.6	Confident	89.5	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-56.5	-25.8	-172.8	-178.7	0	0	0	0	112.3	L461 E465 L466 I467 Y514 L515 V518 Y527 I531	L461-V463 PolarHBondContact O-N 2.96Å; V463-E465 VanDerWaalsContact C-N 3.26Å; V463-E465 PolarHBondContact O-N 2.94Å; V463-L466 WeakPolarHBondContact O-CB 3.39Å; V463-L466 PolarHBondContact O-N 3.05Å; V463-L466 VanDerWaalsContact O-N 3.07Å; V463-I467 HydrophobicContact CG1-CD1 4.05Å; V463-I467 HydrophobicContact CG1-CG1 4.26Å; V463-I467 PolarHBondContact O-N 3.31Å; V463-I467 VanDerWaalsContact O-N 3.09Å; V463-Y514 HydrophobicContact CG1-CE1 4.41Å; V463-Y514 HydrophobicContact CG2-CE1 4.3Å; V463-L515 HydrophobicContact CG1-CD2 3.16Å; V463-V518 HydrophobicContact CG2-CB 4.48Å; V463-V518 HydrophobicContact CG2-CG1 3.72Å; V463-Y527 HydrophobicContact CB-CD2 4.49Å; V463-Y527 HydrophobicContact CB-CE2 3.8Å; V463-Y527 HydrophobicContact CG2-CE2 3.73Å; V463-I531 HydrophobicContact CG1-CG1 4.21Å
464	R	89.9	Confident	89.1	Confident	48 Å²	48	42.4 Å²	42.4	18%	0.181	21%	0.207	C	C	.	.	H	α-helix	trans	-70	-21.7	-178.4	-60.8	171.4	-64.2	-175.2	3	113	D462 L466 I467 S468 L474 F480 D530	D462-R464 PolarHBondContact O-N 3.12Å; D462-R464 VanDerWaalsContact OD1-CB 3.31Å; D462-R464 WeakPolarHBondContact OD1-CB 3.4Å; D462-R464 WeakPolarHBondContact OD1-CG 3.18Å; D462-R464 IonicContact OD1-CZ 3.78Å; D462-R464 PolarHBondContact OD1-N 2.84Å; D462-R464 IonicContact OD1-NE 2.75Å; D462-R464 PolarHBondContact OD1-NE 3.44Å; D462-R464 IonicContact OD1-NH2 3.96Å; D462-R464 IonicContact OD2-CZ 3.61Å; D462-R464 IonicContact OD2-NE 2.66Å; D462-R464 PolarHBondContact OD2-NE 3.1Å; D462-R464 IonicContact OD2-NH2 2.72Å; D462-R464 PolarHBondContact OD2-NH2 3.12Å; R464-L466 VanDerWaalsContact C-N 3.33Å; R464-L466 PolarHBondContact O-N 3.11Å; R464-I467 PolarHBondContact O-N 2.78Å; R464-S468 WeakPolarHBondContact O-CB 3.29Å; R464-S468 PolarHBondContact O-N 3.24Å; R464-S468 PolarHBondContact O-OG 3.04Å; R464-L474 HydrophobicContact CB-CD2 4.29Å; R464-L474 HydrophobicContact CG-CD2 4.34Å; R464-F480 HydrophobicContact CB-CB 4.44Å; R464-F480 HydrophobicContact CB-CD1 3.92Å; R464-F480 HydrophobicContact CB-CD2 3.56Å; R464-F480 HydrophobicContact CB-CE1 4.04Å; R464-F480 HydrophobicContact CB-CE2 3.7Å; R464-F480 HydrophobicContact CB-CG 3.68Å; R464-F480 HydrophobicContact CB-CZ 3.94Å; R464-F480 HydrophobicContact CG-CD2 4.46Å; R464-F480 WeakPolarHBondContact O-CE1 3.45Å; R464-D530 VanDerWaalsContact CD-CG 3.46Å; R464-D530 WeakPolarHBondContact CD-OD2 3.39Å; R464-D530 HydrophobicContact CG-CB 3.93Å; R464-D530 IonicContact NH1-OD2 2.64Å; R464-D530 PolarHBondContact NH1-OD2 3.26Å
465	E	90.4	Very high	88.6	Confident	7 Å²	7	35.8 Å²	35.8	3%	0.033	18%	0.176	C	C	.	.	H	α-helix	trans	-56.2	-50.1	166.9	-67.2	-77.5	-151.5	0	0	109.9	F441 L461 D462 V463 S468 F480 R482 S483 L487	F441-E465 HydrophobicContact CZ-CB 3.82Å; L461-E465 HydrophobicContact CD1-CB 4.17Å; L461-E465 HydrophobicContact CD1-CG 4.11Å; D462-E465 WeakPolarHBondContact O-CB 3.15Å; D462-E465 PolarHBondContact O-N 2.87Å; V463-E465 VanDerWaalsContact C-N 3.26Å; V463-E465 PolarHBondContact O-N 2.94Å; E465-S468 PolarHBondContact O-N 3.37Å; E465-S468 PolarHBondContact O-OG 3.44Å; E465-F480 HydrophobicContact CB-CZ 4.36Å; E465-F480 HydrophobicContact CG-CZ 3.82Å; E465-R482 WeakPolarHBondContact OE2-CA 3.4Å; E465-R482 WeakPolarHBondContact OE2-CB 3.29Å; E465-R482 VanDerWaalsContact OE2-CG 3.26Å; E465-R482 WeakPolarHBondContact OE2-CG 3.32Å; E465-S483 WeakPolarHBondContact OE1-CB 3.46Å; E465-S483 PolarHBondContact OE1-N 2.97Å; E465-S483 PolarHBondContact OE1-OG 3.29Å; E465-L487 HydrophobicContact CG-CD1 4.45Å
466	L	90.8	Very high	87.9	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-66.1	-44.3	177.2	-79.2	163.4	0	0	0	112.5	F441 F456 L461 V463 R464 S468 L469 Y470 L511 Y514	F441-L466 HydrophobicContact CD1-CD2 4.35Å; F441-L466 HydrophobicContact CE1-CD2 3.7Å; F441-L466 HydrophobicContact CE1-CG 3.95Å; F441-L466 HydrophobicContact CZ-CG 4.33Å; F456-L466 HydrophobicContact CD2-CD1 3.9Å; F456-L466 HydrophobicContact CE2-CD1 3.84Å; F456-L466 HydrophobicContact CE2-CD2 4.04Å; F456-L466 HydrophobicContact CE2-CG 4.46Å; F456-L466 HydrophobicContact CG-CD1 4.43Å; F456-L466 HydrophobicContact CZ-CD1 4.29Å; F456-L466 HydrophobicContact CZ-CD2 4.04Å; L461-L466 HydrophobicContact CD2-CD1 3.62Å; L461-L466 HydrophobicContact CD2-CG 3.87Å; V463-L466 WeakPolarHBondContact O-CB 3.39Å; V463-L466 PolarHBondContact O-N 3.05Å; V463-L466 VanDerWaalsContact O-N 3.07Å; R464-L466 VanDerWaalsContact C-N 3.33Å; R464-L466 PolarHBondContact O-N 3.11Å; L466-S468 VanDerWaalsContact C-N 3.26Å; L466-S468 PolarHBondContact O-N 3.15Å; L466-L469 HydrophobicContact CD2-CD1 4.13Å; L466-L469 WeakPolarHBondContact O-CB 3.47Å; L466-L469 PolarHBondContact O-N 3.1Å; L466-Y470 VanDerWaalsContact O-CD2 3.22Å; L466-Y470 WeakPolarHBondContact O-CD2 3.48Å; L466-Y470 WeakPolarHBondContact O-CE2 3.26Å; L466-L511 HydrophobicContact CB-CD1 4.23Å; L466-Y514 HydrophobicContact CD1-CD1 3.84Å; L466-Y514 HydrophobicContact CD1-CE1 3.62Å
467	I	90.1	Very high	87.2	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-37.7	178.6	-56.1	169.5	0	0	0	110.2	V463 R464 L469 Y470 L473 L474 L515 A534	V463-I467 HydrophobicContact CG1-CD1 4.05Å; V463-I467 HydrophobicContact CG1-CG1 4.26Å; V463-I467 PolarHBondContact O-N 3.31Å; V463-I467 VanDerWaalsContact O-N 3.09Å; R464-I467 PolarHBondContact O-N 2.78Å; I467-L469 PolarHBondContact O-N 3.29Å; I467-L469 VanDerWaalsContact O-N 3.07Å; I467-Y470 PolarHBondContact O-N 3.27Å; I467-L473 HydrophobicContact CG2-CB 3.69Å; I467-L474 HydrophobicContact CB-CD2 3.98Å; I467-L474 HydrophobicContact CB-CG 4.39Å; I467-L474 HydrophobicContact CG2-CD2 3.72Å; I467-L474 HydrophobicContact CG2-CG 3.87Å; I467-L515 HydrophobicContact CD1-CD2 4.02Å; I467-L515 HydrophobicContact CG1-CD2 4.09Å; I467-A534 HydrophobicContact CD1-CB 3.97Å; I467-A534 HydrophobicContact CG1-CB 4.31Å; I467-A534 HydrophobicContact CG2-CB 3.75Å
468	S	90.2	Very high	86.8	Confident	24 Å²	24	38.2 Å²	38.2	17%	0.168	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-11.2	179.5	82.2	0	0	0	0	114.8	R464 E465 L466 Y470 R482	R464-S468 WeakPolarHBondContact O-CB 3.29Å; R464-S468 PolarHBondContact O-N 3.24Å; R464-S468 PolarHBondContact O-OG 3.04Å; E465-S468 PolarHBondContact O-N 3.37Å; E465-S468 PolarHBondContact O-OG 3.44Å; L466-S468 VanDerWaalsContact C-N 3.26Å; L466-S468 PolarHBondContact O-N 3.15Å; S468-Y470 VanDerWaalsContact C-N 3.26Å; S468-R482 PolarHBondContact O-NH2 3.45Å; S468-R482 PolarHBondContact OG-NE 3.08Å; S468-R482 PolarHBondContact OG-NH2 2.84Å
469	L	88.1	Confident	86.3	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-17.5	172.3	-59.8	174.7	0	0	0	112.7	F441 F444 L466 I467 Y490 L493	F441-L469 HydrophobicContact CE1-CD1 4.44Å; F444-L469 HydrophobicContact CE1-CD1 3.96Å; L466-L469 HydrophobicContact CD2-CD1 4.13Å; L466-L469 WeakPolarHBondContact O-CB 3.47Å; L466-L469 PolarHBondContact O-N 3.1Å; I467-L469 PolarHBondContact O-N 3.29Å; I467-L469 VanDerWaalsContact O-N 3.07Å; L469-Y490 HydrophobicContact CD1-CE2 3.87Å; L469-Y490 HydrophobicContact CD2-CD2 3.82Å; L469-Y490 HydrophobicContact CD2-CE2 3.76Å; L469-Y490 HydrophobicContact CG-CE2 4.49Å; L469-L493 WeakPolarHBondContact O-CB 3.2Å; L469-L493 PolarHBondContact O-N 2.92Å
470	Y	87.1	Confident	86.2	Confident	11 Å²	11	42.2 Å²	42.2	4%	0.043	24%	0.235	C	C	.	.	S	Bend	trans	-109.3	110.4	-173.5	-61.7	-111.6	0	0	0	108.6	L466 I467 S468 F472 L473 L493 C507 K508 L511	L466-Y470 VanDerWaalsContact O-CD2 3.22Å; L466-Y470 WeakPolarHBondContact O-CD2 3.48Å; L466-Y470 WeakPolarHBondContact O-CE2 3.26Å; I467-Y470 PolarHBondContact O-N 3.27Å; S468-Y470 VanDerWaalsContact C-N 3.26Å; Y470-F472 PolarHBondContact O-N 3.23Å; Y470-L473 VanDerWaalsContact CB-CD1 3.4Å; Y470-L473 HydrophobicContact CD1-CD1 4.05Å; Y470-L473 HydrophobicContact CG-CD1 3.79Å; Y470-L473 PolarHBondContact O-N 3.46Å; Y470-L493 HydrophobicContact CD1-CD2 3.77Å; Y470-L493 HydrophobicContact CE1-CD2 3.4Å; Y470-L493 VanDerWaalsContact CE1-CD2 3.4Å; Y470-L493 HydrophobicContact CE2-CD2 4.48Å; Y470-L493 HydrophobicContact CG-CD2 4.46Å; Y470-C507 VanDerWaalsContact OH-C 3.23Å; Y470-C507 WeakPolarHBondContact OH-CB 3.38Å; Y470-C507 PolarHBondContact OH-O 3.08Å; Y470-K508 HydrophobicContact CD1-CG 4.17Å; Y470-K508 HydrophobicContact CE1-CG 3.77Å; Y470-L511 HydrophobicContact CD1-CD2 4.2Å; Y470-L511 HydrophobicContact CD2-CD2 3.69Å; Y470-L511 HydrophobicContact CE1-CD2 4.01Å; Y470-L511 HydrophobicContact CE2-CB 4.47Å; Y470-L511 HydrophobicContact CE2-CD2 3.54Å; Y470-L511 HydrophobicContact CE2-CG 4.46Å; Y470-L511 HydrophobicContact CG-CD2 4.05Å
471	P	82.5	Confident	86	Confident	68 Å²	68	43.1 Å²	43.1	44%	0.442	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	139.2	178.7	-28.7	36.3	0	0	0	112.6	L473	P471-L473 PolarHBondContact O-N 2.9Å; P471-L473 VanDerWaalsContact O-N 3.16Å
472	F	82.6	Confident	85.7	Confident	167 Å²	167	47.6 Å²	47.6	73%	0.732	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	-0.9	176.2	-42.2	-74.9	0	0	0	117.5	Y470 K537 W565	Y470-F472 PolarHBondContact O-N 3.23Å; F472-K537 WeakPolarHBondContact O-CD 3.47Å; F472-K537 PolarHBondContact O-NZ 2.95Å; F472-W565 HydrophobicContact CB-CZ3 4.38Å
473	L	86.3	Confident	85.5	Confident	6 Å²	6	47.5 Å²	47.5	3%	0.031	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-45.2	176.9	-68.3	-165.5	0	0	0	113.4	I467 Y470 P471 L511 A534 K537 L538	I467-L473 HydrophobicContact CG2-CB 3.69Å; Y470-L473 VanDerWaalsContact CB-CD1 3.4Å; Y470-L473 HydrophobicContact CD1-CD1 4.05Å; Y470-L473 HydrophobicContact CG-CD1 3.79Å; Y470-L473 PolarHBondContact O-N 3.46Å; P471-L473 PolarHBondContact O-N 2.9Å; P471-L473 VanDerWaalsContact O-N 3.16Å; L473-L511 HydrophobicContact CD1-CD2 3.97Å; L473-A534 HydrophobicContact CB-CB 4.29Å; L473-K537 HydrophobicContact CD2-CB 3.73Å; L473-K537 HydrophobicContact CD2-CD 4.39Å; L473-K537 WeakPolarHBondContact O-CD 3.19Å; L473-K537 PolarHBondContact O-NZ 3.11Å; L473-L538 HydrophobicContact CD1-CD1 3.89Å; L473-L538 HydrophobicContact CD1-CD2 3.84Å; L473-L538 HydrophobicContact CD1-CG 3.75Å; L473-L538 HydrophobicContact CD2-CD2 4.45Å; L473-L538 HydrophobicContact CD2-CG 4.2Å
474	L	85.6	Confident	85.2	Confident	42 Å²	42	55.5 Å²	55.5	22%	0.22	30%	0.304	C	S	.	.	S	Bend	trans	-55.9	142	176.2	-75.5	174.6	0	0	0	111	R464 I467 F480 K537	R464-L474 HydrophobicContact CB-CD2 4.29Å; R464-L474 HydrophobicContact CG-CD2 4.34Å; I467-L474 HydrophobicContact CB-CD2 3.98Å; I467-L474 HydrophobicContact CB-CG 4.39Å; I467-L474 HydrophobicContact CG2-CD2 3.72Å; I467-L474 HydrophobicContact CG2-CG 3.87Å; L474-F480 HydrophobicContact CD1-CD1 4.17Å; L474-K537 PolarHBondContact O-NZ 3.01Å; L474-K537 VanDerWaalsContact O-NZ 3.15Å
475	P	81.3	Confident	84.9	Confident	7 Å²	7	56.6 Å²	56.6	5%	0.045	32%	0.317	C	S	.	.			trans	-58.5	150.1	171.3	-24.4	33.1	0	0	0	113.4	S477 S478 E529 D530 T533 L558 D561	P475-S477 WeakPolarHBondContact CB-OG 3.27Å; P475-S477 PolarHBondContact O-N 3.06Å; P475-S478 VanDerWaalsContact O-CB 3.26Å; P475-S478 WeakPolarHBondContact O-CB 3.45Å; P475-S478 PolarHBondContact O-N 3.16Å; P475-E529 HydrophobicContact CG-CG 4.5Å; P475-D530 WeakPolarHBondContact CD-OD1 3.43Å; P475-T533 HydrophobicContact CG-CG2 4.09Å; P475-L558 HydrophobicContact CB-CD2 3.87Å; P475-D561 WeakPolarHBondContact CA-OD2 3.22Å
476	T	78.6	Confident	84.7	Confident	117 Å²	117	60.3 Å²	60.3	72%	0.718	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-19.4	168.3	53.5	0	0	0	0	114.1	S478 D561	T476-S478 VanDerWaalsContact C-N 3.34Å; T476-D561 WeakPolarHBondContact CB-OD1 3.28Å; T476-D561 WeakPolarHBondContact CG2-OD1 3.49Å; T476-D561 PolarHBondContact N-OD2 2.91Å; T476-D561 PolarHBondContact OG1-OD1 2.85Å
477	S	78.1	Confident	84.6	Confident	60 Å²	60	60.9 Å²	60.9	42%	0.42	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-15.7	171.4	53.9	0	0	0	0	114.1	P475 S479 E529	P475-S477 WeakPolarHBondContact CB-OG 3.27Å; P475-S477 PolarHBondContact O-N 3.06Å; S477-S479 PolarHBondContact O-N 3.37Å; S477-E529 WeakPolarHBondContact CB-OE1 3.2Å; S477-E529 PolarHBondContact OG-OE1 3.12Å
478	S	82.4	Confident	84.5	Confident	32 Å²	32	62 Å²	62	22%	0.224	35%	0.35	C	S	.	.			trans	-75	115.3	-166.9	-161.4	0	0	0	0	112.5	P475 T476 F480 D530	P475-S478 VanDerWaalsContact O-CB 3.26Å; P475-S478 WeakPolarHBondContact O-CB 3.45Å; P475-S478 PolarHBondContact O-N 3.16Å; T476-S478 VanDerWaalsContact C-N 3.34Å; S478-F480 PolarHBondContact O-N 3.23Å; S478-D530 WeakPolarHBondContact CB-OD1 3.04Å; S478-D530 PolarHBondContact OG-OD1 2.96Å
479	S	81.9	Confident	84.2	Confident	114 Å²	114	69.7 Å²	69.7	80%	0.797	38%	0.383	S	S	*	.			trans	-84	17.4	175.9	56.9	0	0	0	0	113.7	S477 T481	S477-S479 PolarHBondContact O-N 3.37Å; S479-T481 PolarHBondContact O-N 3.26Å
480	F	85.4	Confident	84	Confident	37 Å²	37	70.9 Å²	70.9	16%	0.162	39%	0.388	C	S	.	.			trans	-67.1	126.5	-171.3	176.9	-104.3	0	0	0	113.6	R464 E465 L474 S478 R482	R464-F480 HydrophobicContact CB-CB 4.44Å; R464-F480 HydrophobicContact CB-CD1 3.92Å; R464-F480 HydrophobicContact CB-CD2 3.56Å; R464-F480 HydrophobicContact CB-CE1 4.04Å; R464-F480 HydrophobicContact CB-CE2 3.7Å; R464-F480 HydrophobicContact CB-CG 3.68Å; R464-F480 HydrophobicContact CB-CZ 3.94Å; R464-F480 HydrophobicContact CG-CD2 4.46Å; R464-F480 WeakPolarHBondContact O-CE1 3.45Å; E465-F480 HydrophobicContact CB-CZ 4.36Å; E465-F480 HydrophobicContact CG-CZ 3.82Å; L474-F480 HydrophobicContact CD1-CD1 4.17Å; S478-F480 PolarHBondContact O-N 3.23Å; F480-R482 HydrophobicContact CE1-CG 4Å; F480-R482 HydrophobicContact CZ-CG 4.5Å
481	T	84.5	Confident	83.7	Confident	117 Å²	117	73 Å²	73	72%	0.718	41%	0.408	S	S	*	.			trans	-116.6	130.1	170.2	58.7	0	0	0	0	110.3	S479	S479-T481 PolarHBondContact O-N 3.26Å
482	R	86	Confident	83.7	Confident	96 Å²	96	71.9 Å²	71.9	36%	0.362	40%	0.398	S	S	.	.			trans	-56.7	149.4	176.3	-61.3	-165	-178.6	155	1.6	112.2	E465 S468 F480 A491	E465-R482 WeakPolarHBondContact OE2-CA 3.4Å; E465-R482 WeakPolarHBondContact OE2-CB 3.29Å; E465-R482 VanDerWaalsContact OE2-CG 3.26Å; E465-R482 WeakPolarHBondContact OE2-CG 3.32Å; S468-R482 PolarHBondContact O-NH2 3.45Å; S468-R482 PolarHBondContact OG-NE 3.08Å; S468-R482 PolarHBondContact OG-NH2 2.84Å; F480-R482 HydrophobicContact CE1-CG 4Å; F480-R482 HydrophobicContact CZ-CG 4.5Å; R482-A491 VanDerWaalsContact CZ-O 3.28Å; R482-A491 PolarHBondContact NH1-O 3.01Å; R482-A491 PolarHBondContact NH2-O 3.37Å
483	S	85.1	Confident	83.8	Confident	42 Å²	42	64.2 Å²	64.2	29%	0.294	37%	0.365	S	S	.	.			trans	-63.2	149.8	-177.5	55.5	0	0	0	0	113.8	E465 P485 P486 L487	E465-S483 WeakPolarHBondContact OE1-CB 3.46Å; E465-S483 PolarHBondContact OE1-N 2.97Å; E465-S483 PolarHBondContact OE1-OG 3.29Å; S483-P485 CarbonylContact C-O 3.54Å; S483-P485 CarbonylContact O-C 3.58Å; S483-P486 WeakPolarHBondContact O-CA 3.26Å; S483-L487 WeakPolarHBondContact OG-CD1 3.42Å; S483-L487 WeakPolarHBondContact OG-CG 3.45Å
484	H	81.7	Confident	83.6	Confident	169 Å²	169	67.2 Å²	67.2	78%	0.782	38%	0.381	S	S	*	.	S	Bend	trans	-124.1	131.9	178.3	-176.4	-89.7	0	0	0	111.8
485	P	84.4	Confident	83.5	Confident	71 Å²	71	70.6 Å²	70.6	46%	0.461	40%	0.396	S	S	.	.	S	Bend	cis	-56.1	163.8	-14.8	-21.3	33.6	0	0	0	111.5	R434 S483	R434-P485 PolarHBondContact NH1-O 3.33Å; R434-P485 VanDerWaalsContact NH2-C 3.33Å; R434-P485 PolarHBondContact NH2-O 2.91Å; S483-P485 CarbonylContact C-O 3.54Å; S483-P485 CarbonylContact O-C 3.58Å
486	P	87	Confident	83.7	Confident	85 Å²	85	72 Å²	72	55%	0.552	40%	0.402	S	S	*	.			trans	-64	159.7	-176.5	26.8	-35.6	0	0	0	113.3	R434 S483	R434-P486 PolarHBondContact NH2-O 3.1Å; R434-P486 VanDerWaalsContact NH2-O 3.12Å; S483-P486 WeakPolarHBondContact O-CA 3.26Å
487	L	88.4	Confident	83.9	Confident	12 Å²	12	66.5 Å²	66.5	6%	0.063	37%	0.369	C	S	.	.	S	Bend	trans	-94.3	-18.2	174.7	-69.2	168.8	0	0	0	113.4	R434 Q437 Q438 F441 L461 E465 S483	R434-L487 HydrophobicContact CG-CD2 3.94Å; Q437-L487 HydrophobicContact CB-CD1 4.13Å; Q437-L487 HydrophobicContact CB-CD2 3.92Å; Q438-L487 HydrophobicContact CG-CD2 3.83Å; F441-L487 HydrophobicContact CD2-CB 3.79Å; F441-L487 HydrophobicContact CE2-CB 3.77Å; F441-L487 HydrophobicContact CE2-CD1 4Å; L461-L487 HydrophobicContact CD1-CD1 4.04Å; E465-L487 HydrophobicContact CG-CD1 4.45Å; S483-L487 WeakPolarHBondContact OG-CD1 3.42Å; S483-L487 WeakPolarHBondContact OG-CG 3.45Å
488	H	88.1	Confident	84.2	Confident	24 Å²	24	72 Å²	72	11%	0.111	39%	0.388	C	S	.	.			trans	-149.5	160	179	56.8	80	0	0	0	111.1	F441 Y490	F441-H488 HydrophobicContact CB-CB 3.92Å; F441-H488 HydrophobicContact CD1-CB 4.44Å; F441-H488 AromaticContact CD1-CD2 3.68Å; F441-H488 AromaticContact CD2-CD2 3.9Å; F441-H488 AromaticContact CE1-CD2 3.68Å; F441-H488 AromaticContact CE2-CD2 3.92Å; F441-H488 HydrophobicContact CG-CB 4.07Å; F441-H488 AromaticContact CG-CD2 3.8Å; F441-H488 AromaticContact CZ-CD2 3.81Å; H488-Y490 HydrophobicContact CB-CD1 4.33Å; H488-Y490 HydrophobicContact CB-CE1 3.87Å; H488-Y490 HydrophobicContact CB-CE2 4.23Å; H488-Y490 PolarHBondContact CE1-O 3.13Å; H488-Y490 VanDerWaalsContact CE1-O 3.23Å; H488-Y490 AromaticContact CG-CE2 3.91Å; H488-Y490 AromaticContact ND1-CD2 3.67Å; H488-Y490 AromaticContact ND1-CE2 3.73Å; H488-Y490 PolarHBondContact ND1-O 3.24Å
489	E	83.3	Confident	84	Confident	186 Å²	186	72.5 Å²	72.5	87%	0.869	40%	0.398	S	S	*	.	S	Bend	trans	-90.2	-25.5	-174.3	-60.4	-179.7	151.6	0	0	114
490	Y	84.6	Confident	84.3	Confident	25 Å²	25	69.5 Å²	69.5	10%	0.098	37%	0.373	C	S	.	.			trans	-78.6	138.5	-177.9	44.4	-92.2	0	0	0	112.1	F441 A445 L469 H488 L496	F441-Y490 WeakPolarHBondContact CD1-OH 3.41Å; F441-Y490 PolarHBondContact O-OH 3.24Å; A445-Y490 HydrophobicContact CB-CE1 3.95Å; L469-Y490 HydrophobicContact CD1-CE2 3.87Å; L469-Y490 HydrophobicContact CD2-CD2 3.82Å; L469-Y490 HydrophobicContact CD2-CE2 3.76Å; L469-Y490 HydrophobicContact CG-CE2 4.49Å; H488-Y490 HydrophobicContact CB-CD1 4.33Å; H488-Y490 HydrophobicContact CB-CE1 3.87Å; H488-Y490 HydrophobicContact CB-CE2 4.23Å; H488-Y490 PolarHBondContact CE1-O 3.13Å; H488-Y490 VanDerWaalsContact CE1-O 3.23Å; H488-Y490 AromaticContact CG-CE2 3.91Å; H488-Y490 AromaticContact ND1-CD2 3.67Å; H488-Y490 AromaticContact ND1-CE2 3.73Å; H488-Y490 PolarHBondContact ND1-O 3.24Å; Y490-L496 HydrophobicContact CD1-CD1 4.06Å; Y490-L496 HydrophobicContact CD2-CB 4.37Å; Y490-L496 HydrophobicContact CD2-CD2 4.46Å; Y490-L496 HydrophobicContact CE1-CD1 4.1Å; Y490-L496 HydrophobicContact CE1-CD2 4.48Å; Y490-L496 HydrophobicContact CE2-CD2 4.09Å; Y490-L496 HydrophobicContact CG-CB 4.34Å; Y490-L496 HydrophobicContact CG-CD1 4.46Å
491	A	79.8	Confident	84.4	Confident	57 Å²	57	74.3 Å²	74.3	47%	0.471	40%	0.396	S	S	.	.	S	Bend	trans	-78.8	-38.5	-178.3	0	0	0	0	0	112.5	R482	R482-A491 VanDerWaalsContact CZ-O 3.28Å; R482-A491 PolarHBondContact NH1-O 3.01Å; R482-A491 PolarHBondContact NH2-O 3.37Å
492	D	83.6	Confident	84.6	Confident	44 Å²	44	74.3 Å²	74.3	24%	0.235	39%	0.388	C	S	.	.	S	Bend	trans	-147.7	177.9	-180	80.2	-15.3	0	0	0	112.1	N494 Q495 L496	D492-N494 VanDerWaalsContact C-N 3.32Å; D492-N494 PolarHBondContact O-N 3.35Å; D492-N494 PolarHBondContact OD1-N 3.43Å; D492-N494 VanDerWaalsContact OD1-N 3.11Å; D492-N494 WeakPolarHBondContact OD2-CB 3.45Å; D492-N494 PolarHBondContact OD2-ND2 2.75Å; D492-Q495 WeakPolarHBondContact OD1-CB 3.48Å; D492-Q495 PolarHBondContact OD1-N 3.36Å; D492-L496 PolarHBondContact O-N 2.88Å
493	L	83.9	Confident	84.7	Confident	5 Å²	5	73.2 Å²	73.2	3%	0.026	39%	0.386	C	S	.	.	H	α-helix	trans	-69.2	-27.3	177.8	-170.2	64.4	0	0	0	113.2	F444 L469 Y470 L496 T497 M504 C507	F444-L493 HydrophobicContact CE1-CD1 4.44Å; F444-L493 HydrophobicContact CZ-CD1 4.29Å; L469-L493 WeakPolarHBondContact O-CB 3.2Å; L469-L493 PolarHBondContact O-N 2.92Å; Y470-L493 HydrophobicContact CD1-CD2 3.77Å; Y470-L493 HydrophobicContact CE1-CD2 3.4Å; Y470-L493 VanDerWaalsContact CE1-CD2 3.4Å; Y470-L493 HydrophobicContact CE2-CD2 4.48Å; Y470-L493 HydrophobicContact CG-CD2 4.46Å; L493-L496 HydrophobicContact CD1-CD2 4.14Å; L493-L496 PolarHBondContact O-N 3.48Å; L493-T497 HydrophobicContact CD1-CG2 4.05Å; L493-T497 HydrophobicContact CG-CG2 4.07Å; L493-T497 WeakPolarHBondContact O-CG2 3.41Å; L493-T497 PolarHBondContact O-N 2.85Å; L493-T497 PolarHBondContact O-OG1 2.93Å; L493-M504 HydrophobicContact CD2-CG 3.79Å; L493-C507 HydrophobicContact CD1-CB 3.83Å; L493-C507 HydrophobicContact CD2-CB 4.06Å
494	N	81.9	Confident	84.8	Confident	70 Å²	70	72.2 Å²	72.2	37%	0.374	38%	0.377	S	S	.	.	H	α-helix	trans	-67.5	-41.8	179.7	-61.1	-64.2	0	0	0	111.5	D492 L496 Q498 G499 M504	D492-N494 VanDerWaalsContact C-N 3.32Å; D492-N494 PolarHBondContact O-N 3.35Å; D492-N494 PolarHBondContact OD1-N 3.43Å; D492-N494 VanDerWaalsContact OD1-N 3.11Å; D492-N494 WeakPolarHBondContact OD2-CB 3.45Å; D492-N494 PolarHBondContact OD2-ND2 2.75Å; N494-L496 VanDerWaalsContact C-N 3.28Å; N494-L496 PolarHBondContact O-N 2.98Å; N494-Q498 WeakPolarHBondContact O-CA 3.17Å; N494-Q498 PolarHBondContact O-N 3.16Å; N494-G499 PolarHBondContact O-N 3.36Å; N494-M504 WeakPolarHBondContact OD1-CE 3.27Å
495	Q	84.3	Confident	85.1	Confident	112 Å²	112	65.8 Å²	65.8	52%	0.523	35%	0.353	S	S	.	.	H	α-helix	trans	-61.3	-38.3	172.3	-172.4	-177.1	2.9	0	0	111.3	D492	D492-Q495 WeakPolarHBondContact OD1-CB 3.48Å; D492-Q495 PolarHBondContact OD1-N 3.36Å
496	L	84.4	Confident	85.4	Confident	36 Å²	36	65.9 Å²	65.9	19%	0.188	35%	0.346	C	S	.	.	H	α-helix	trans	-71.6	-45	179.7	-179.3	61.4	0	0	0	113	F444 A445 Y490 D492 L493 N494 Q498	F444-L496 HydrophobicContact CD1-CD2 3.88Å; F444-L496 HydrophobicContact CE1-CD2 3.56Å; F444-L496 HydrophobicContact CZ-CD2 4.5Å; A445-L496 HydrophobicContact CB-CD1 3.56Å; Y490-L496 HydrophobicContact CD1-CD1 4.06Å; Y490-L496 HydrophobicContact CD2-CB 4.37Å; Y490-L496 HydrophobicContact CD2-CD2 4.46Å; Y490-L496 HydrophobicContact CE1-CD1 4.1Å; Y490-L496 HydrophobicContact CE1-CD2 4.48Å; Y490-L496 HydrophobicContact CE2-CD2 4.09Å; Y490-L496 HydrophobicContact CG-CB 4.34Å; Y490-L496 HydrophobicContact CG-CD1 4.46Å; D492-L496 PolarHBondContact O-N 2.88Å; L493-L496 HydrophobicContact CD1-CD2 4.14Å; L493-L496 PolarHBondContact O-N 3.48Å; N494-L496 VanDerWaalsContact C-N 3.28Å; N494-L496 PolarHBondContact O-N 2.98Å; L496-Q498 VanDerWaalsContact C-N 3.32Å
497	T	84.1	Confident	85.5	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.012	32%	0.32	C	S	.	.	H	α-helix	trans	-82.6	-10	-179.1	66.5	0	0	0	0	113.5	L493 G499 D500 K503 M504	L493-T497 HydrophobicContact CD1-CG2 4.05Å; L493-T497 HydrophobicContact CG-CG2 4.07Å; L493-T497 WeakPolarHBondContact O-CG2 3.41Å; L493-T497 PolarHBondContact O-N 2.85Å; L493-T497 PolarHBondContact O-OG1 2.93Å; T497-G499 PolarHBondContact O-N 2.9Å; T497-G499 PolarHBondContact OG1-N 2.91Å; T497-D500 WeakPolarHBondContact O-CB 3.46Å; T497-D500 PolarHBondContact O-N 3.3Å; T497-D500 VanDerWaalsContact O-N 3.13Å; T497-K503 HydrophobicContact CG2-CB 3.8Å; T497-M504 HydrophobicContact CG2-CB 4.27Å
498	Q	82.8	Confident	85.6	Confident	176 Å²	176	63.5 Å²	63.5	82%	0.822	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	32.4	-171.6	-55	175.7	-12.6	0	0	112.3	N494 L496 D500	N494-Q498 WeakPolarHBondContact O-CA 3.17Å; N494-Q498 PolarHBondContact O-N 3.16Å; L496-Q498 VanDerWaalsContact C-N 3.32Å; Q498-D500 VanDerWaalsContact C-N 3.31Å; Q498-D500 PolarHBondContact O-N 3.45Å
499	G	79.1	Confident	85.8	Confident	42 Å²	42	69.6 Å²	69.6	43%	0.433	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	81	0.3	-175.9	0	0	0	0	0	115.5	N494 T497 Q501	N494-G499 PolarHBondContact O-N 3.36Å; T497-G499 PolarHBondContact O-N 2.9Å; T497-G499 PolarHBondContact OG1-N 2.91Å; G499-Q501 PolarHBondContact O-N 3.18Å
500	D	88.9	Confident	86.3	Confident	52 Å²	52	61.3 Å²	61.3	28%	0.278	31%	0.31	S	S	.	.			trans	-67	116.6	179.4	-175.4	-38	0	0	0	111.8	T497 Q498 E502 K503 M504	T497-D500 WeakPolarHBondContact O-CB 3.46Å; T497-D500 PolarHBondContact O-N 3.3Å; T497-D500 VanDerWaalsContact O-N 3.13Å; Q498-D500 VanDerWaalsContact C-N 3.31Å; Q498-D500 PolarHBondContact O-N 3.45Å; D500-E502 WeakPolarHBondContact OD1-CA 3.14Å; D500-E502 WeakPolarHBondContact OD1-CB 3.41Å; D500-E502 PolarHBondContact OD1-N 3.47Å; D500-K503 HydrophobicContact CB-CB 4.05Å; D500-K503 HydrophobicContact CB-CD 4.01Å; D500-K503 HydrophobicContact CB-CG 4.02Å; D500-K503 PolarHBondContact OD1-N 2.92Å; D500-K503 WeakPolarHBondContact OD2-CE 3.26Å; D500-K503 WeakPolarHBondContact OD2-CG 3.49Å; D500-K503 IonicContact OD2-NZ 3.65Å; D500-K503 PolarHBondContact OD2-NZ 3.14Å; D500-M504 WeakPolarHBondContact O-CB 3.27Å; D500-M504 PolarHBondContact O-N 2.86Å
501	Q	86.1	Confident	86.7	Confident	137 Å²	137	60.1 Å²	60.1	64%	0.64	31%	0.305	S	S	*	.	H	α-helix	trans	-70.4	-32.2	-179	-65.8	-64.2	-36.5	0	0	113.3	G499 M504 A505	G499-Q501 PolarHBondContact O-N 3.18Å; Q501-M504 PolarHBondContact O-N 3.48Å; Q501-A505 WeakPolarHBondContact O-CB 3.49Å; Q501-A505 PolarHBondContact O-N 2.69Å
502	E	88.5	Confident	87.3	Confident	118 Å²	118	58 Å²	58	55%	0.551	29%	0.286	S	S	*	.	H	α-helix	trans	-73.4	-41.5	179.1	-157.5	-152.5	145.5	0	0	110.5	D500 A505 K506	D500-E502 WeakPolarHBondContact OD1-CA 3.14Å; D500-E502 WeakPolarHBondContact OD1-CB 3.41Å; D500-E502 PolarHBondContact OD1-N 3.47Å; E502-A505 PolarHBondContact O-N 2.87Å; E502-K506 VanDerWaalsContact O-CG 3.32Å; E502-K506 WeakPolarHBondContact O-CG 2.96Å; E502-K506 PolarHBondContact O-N 3.5Å; E502-K506 WeakPolarHBondContact OE1-CE 3.5Å; E502-K506 IonicContact OE1-NZ 3.4Å; E502-K506 PolarHBondContact OE1-NZ 3.3Å; E502-K506 IonicContact OE2-NZ 2.84Å
503	K	87.9	Confident	87.7	Confident	72 Å²	72	58.5 Å²	58.5	31%	0.313	29%	0.292	S	S	.	.	H	α-helix	trans	-62.8	-42.3	170.5	-65.1	-174.7	-170	94.3	0	111.1	L447 T497 D500 A505 K506 C507	L447-K503 HydrophobicContact CD1-CD 4.24Å; L447-K503 HydrophobicContact CD1-CG 4.04Å; T497-K503 HydrophobicContact CG2-CB 3.8Å; D500-K503 HydrophobicContact CB-CB 4.05Å; D500-K503 HydrophobicContact CB-CD 4.01Å; D500-K503 HydrophobicContact CB-CG 4.02Å; D500-K503 PolarHBondContact OD1-N 2.92Å; D500-K503 WeakPolarHBondContact OD2-CE 3.26Å; D500-K503 WeakPolarHBondContact OD2-CG 3.49Å; D500-K503 IonicContact OD2-NZ 3.65Å; D500-K503 PolarHBondContact OD2-NZ 3.14Å; K503-A505 PolarHBondContact O-N 2.94Å; K503-K506 PolarHBondContact O-N 3.19Å; K503-C507 PolarHBondContact O-N 3.19Å; K503-C507 PolarHBondContact O-SG 2.64Å
504	M	87.9	Confident	88	Confident	22 Å²	22	58.4 Å²	58.4	11%	0.108	29%	0.292	C	S	.	.	H	α-helix	trans	-61.2	-44.8	176.8	-169.6	-177.2	-66.3	0	0	111.7	L493 N494 T497 D500 Q501 K506 C507 K508	L493-M504 HydrophobicContact CD2-CG 3.79Å; N494-M504 WeakPolarHBondContact OD1-CE 3.27Å; T497-M504 HydrophobicContact CG2-CB 4.27Å; D500-M504 WeakPolarHBondContact O-CB 3.27Å; D500-M504 PolarHBondContact O-N 2.86Å; Q501-M504 PolarHBondContact O-N 3.48Å; M504-K506 PolarHBondContact O-N 3.46Å; M504-C507 PolarHBondContact O-N 3.41Å; M504-K508 PolarHBondContact O-N 2.79Å
505	A	88.2	Confident	88.5	Confident	34 Å²	34	55.1 Å²	55.1	28%	0.281	27%	0.274	S	S	.	.	H	α-helix	trans	-63.3	-39.3	175.7	0	0	0	0	0	112.5	Q501 E502 K503 K508 R509	Q501-A505 WeakPolarHBondContact O-CB 3.49Å; Q501-A505 PolarHBondContact O-N 2.69Å; E502-A505 PolarHBondContact O-N 2.87Å; K503-A505 PolarHBondContact O-N 2.94Å; A505-K508 PolarHBondContact O-N 2.94Å; A505-R509 WeakPolarHBondContact O-CG 3.24Å; A505-R509 PolarHBondContact O-N 3.01Å
506	K	90.1	Very high	88.7	Confident	72 Å²	72	53.7 Å²	53.7	31%	0.313	27%	0.27	S	S	.	.	H	α-helix	trans	-60.7	-44.4	172.7	-72.9	167.1	-174.8	167.5	0	111.7	F449 E502 K503 M504 R509 F510	F449-K506 HydrophobicContact CE2-CB 3.95Å; F449-K506 HydrophobicContact CZ-CB 4.1Å; E502-K506 VanDerWaalsContact O-CG 3.32Å; E502-K506 WeakPolarHBondContact O-CG 2.96Å; E502-K506 PolarHBondContact O-N 3.5Å; E502-K506 WeakPolarHBondContact OE1-CE 3.5Å; E502-K506 IonicContact OE1-NZ 3.4Å; E502-K506 PolarHBondContact OE1-NZ 3.3Å; E502-K506 IonicContact OE2-NZ 2.84Å; K503-K506 PolarHBondContact O-N 3.19Å; M504-K506 PolarHBondContact O-N 3.46Å; K506-R509 PolarHBondContact O-N 3.2Å; K506-F510 PolarHBondContact O-N 3.3Å
507	C	90.6	Very high	88.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.8	-43.3	177.2	-63.7	0	0	0	0	112.3	F444 Y470 L493 K503 M504 R509 F510 L511	F444-C507 HydrophobicContact CE2-CB 4.31Å; F444-C507 HydrophobicContact CZ-CB 4.05Å; Y470-C507 VanDerWaalsContact OH-C 3.23Å; Y470-C507 WeakPolarHBondContact OH-CB 3.38Å; Y470-C507 PolarHBondContact OH-O 3.08Å; L493-C507 HydrophobicContact CD1-CB 3.83Å; L493-C507 HydrophobicContact CD2-CB 4.06Å; K503-C507 PolarHBondContact O-N 3.19Å; K503-C507 PolarHBondContact O-SG 2.64Å; M504-C507 PolarHBondContact O-N 3.41Å; C507-R509 PolarHBondContact O-N 2.83Å; C507-F510 WeakPolarHBondContact O-CB 3.49Å; C507-F510 PolarHBondContact O-N 2.91Å; C507-L511 PolarHBondContact O-N 3.32Å
508	K	90.2	Very high	89	Confident	47 Å²	47	55.4 Å²	55.4	20%	0.204	28%	0.277	C	S	.	.	H	α-helix	trans	-57.3	-48.3	173.5	-73.5	-175.5	-177.5	-171.4	0	111.9	Y470 M504 A505 F510 L511 M512 L538 E541	Y470-K508 HydrophobicContact CD1-CG 4.17Å; Y470-K508 HydrophobicContact CE1-CG 3.77Å; M504-K508 PolarHBondContact O-N 2.79Å; A505-K508 PolarHBondContact O-N 2.94Å; K508-F510 VanDerWaalsContact C-N 3.33Å; K508-F510 PolarHBondContact O-N 3.06Å; K508-L511 PolarHBondContact O-N 2.89Å; K508-L511 VanDerWaalsContact O-N 3.15Å; K508-M512 VanDerWaalsContact O-CG 3.23Å; K508-M512 WeakPolarHBondContact O-CG 3.48Å; K508-M512 PolarHBondContact O-N 3.26Å; K508-M512 VanDerWaalsContact O-SD 3.4Å; K508-L538 HydrophobicContact CB-CD2 4.29Å; K508-L538 HydrophobicContact CD-CD2 4.39Å; K508-L538 HydrophobicContact CG-CD2 4.14Å; K508-E541 IonicContact NZ-OE1 2.75Å; K508-E541 PolarHBondContact NZ-OE1 3.36Å; K508-E541 IonicContact NZ-OE2 2.81Å; K508-E541 PolarHBondContact NZ-OE2 2.99Å
509	R	91.6	Very high	89.2	Confident	152 Å²	152	48.9 Å²	48.9	57%	0.574	25%	0.245	S	C	*	.	H	α-helix	trans	-60.1	-40	176	-68.4	-179	-146.8	118.2	1.9	112.8	A505 K506 C507 M512 S513	A505-R509 WeakPolarHBondContact O-CG 3.24Å; A505-R509 PolarHBondContact O-N 3.01Å; K506-R509 PolarHBondContact O-N 3.2Å; C507-R509 PolarHBondContact O-N 2.83Å; R509-M512 PolarHBondContact O-N 3Å; R509-S513 PolarHBondContact O-N 3.08Å
510	F	93.5	Very high	89.4	Confident	13 Å²	13	51.9 Å²	51.9	6%	0.057	26%	0.26	C	S	.	.	H	α-helix	trans	-60.3	-48.8	172.9	166.3	-98	0	0	0	111.5	F444 F449 K453 F456 K506 C507 K508 M512 S513 Y514	F444-F510 AromaticContact CD2-CD1 3.71Å; F444-F510 HydrophobicContact CD2-CD1 3.71Å; F444-F510 AromaticContact CD2-CE1 3.62Å; F444-F510 HydrophobicContact CD2-CE1 3.62Å; F444-F510 HydrophobicContact CD2-CZ 4.36Å; F444-F510 AromaticContact CE2-CD1 3.46Å; F444-F510 HydrophobicContact CE2-CD1 3.46Å; F444-F510 VanDerWaalsContact CE2-CD1 3.46Å; F444-F510 AromaticContact CE2-CE1 3.77Å; F444-F510 HydrophobicContact CE2-CE1 3.77Å; F444-F510 HydrophobicContact CE2-CG 4.34Å; F449-F510 HydrophobicContact CB-CD2 3.66Å; F449-F510 HydrophobicContact CB-CE2 4.17Å; F449-F510 HydrophobicContact CB-CG 4.36Å; F449-F510 HydrophobicContact CD1-CB 3.55Å; F449-F510 HydrophobicContact CD1-CD1 4.04Å; F449-F510 AromaticContact CD1-CD2 3.56Å; F449-F510 HydrophobicContact CD1-CD2 3.56Å; F449-F510 HydrophobicContact CD1-CE2 4.23Å; F449-F510 AromaticContact CD1-CG 3.41Å; F449-F510 HydrophobicContact CD1-CG 3.41Å; F449-F510 VanDerWaalsContact CD1-CG 3.41Å; F449-F510 HydrophobicContact CE1-CB 3.76Å; F449-F510 HydrophobicContact CE1-CD1 4.35Å; F449-F510 AromaticContact CE1-CG 3.95Å; F449-F510 HydrophobicContact CE1-CG 3.95Å; F449-F510 HydrophobicContact CG-CB 4.05Å; F449-F510 AromaticContact CG-CD2 3.9Å; F449-F510 HydrophobicContact CG-CD2 3.9Å; F449-F510 HydrophobicContact CG-CG 4.09Å; F449-F510 HydrophobicContact CZ-CB 4.4Å; F449-F510 VanDerWaalsContact O-CE2 3.3Å; F449-F510 WeakPolarHBondContact O-CE2 3.34Å; K453-F510 HydrophobicContact CB-CE2 4.12Å; F456-F510 HydrophobicContact CD2-CZ 4.06Å; F456-F510 HydrophobicContact CE2-CE1 4.2Å; F456-F510 AromaticContact CE2-CZ 3.94Å; F456-F510 HydrophobicContact CE2-CZ 3.94Å; K506-F510 PolarHBondContact O-N 3.3Å; C507-F510 WeakPolarHBondContact O-CB 3.49Å; C507-F510 PolarHBondContact O-N 2.91Å; K508-F510 VanDerWaalsContact C-N 3.33Å; K508-F510 PolarHBondContact O-N 3.06Å; F510-M512 VanDerWaalsContact C-N 3.35Å; F510-M512 PolarHBondContact O-N 3.32Å; F510-S513 PolarHBondContact O-N 3.19Å; F510-Y514 HydrophobicContact CZ-CG 4.42Å; F510-Y514 WeakPolarHBondContact O-CB 3.36Å; F510-Y514 PolarHBondContact O-N 2.97Å
511	L	92.4	Very high	89.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.4	-45.4	179.5	-176.5	62.7	0	0	0	110.8	L466 Y470 L473 C507 K508 S513 Y514 L515 L538	L466-L511 HydrophobicContact CB-CD1 4.23Å; Y470-L511 HydrophobicContact CD1-CD2 4.2Å; Y470-L511 HydrophobicContact CD2-CD2 3.69Å; Y470-L511 HydrophobicContact CE1-CD2 4.01Å; Y470-L511 HydrophobicContact CE2-CB 4.47Å; Y470-L511 HydrophobicContact CE2-CD2 3.54Å; Y470-L511 HydrophobicContact CE2-CG 4.46Å; Y470-L511 HydrophobicContact CG-CD2 4.05Å; L473-L511 HydrophobicContact CD1-CD2 3.97Å; C507-L511 PolarHBondContact O-N 3.32Å; K508-L511 PolarHBondContact O-N 2.89Å; K508-L511 VanDerWaalsContact O-N 3.15Å; L511-S513 PolarHBondContact O-N 2.76Å; L511-Y514 PolarHBondContact O-N 2.64Å; L511-Y514 VanDerWaalsContact O-N 3.16Å; L511-L515 HydrophobicContact CD1-CD1 4.01Å; L511-L515 HydrophobicContact CD1-CD2 3.93Å; L511-L515 HydrophobicContact CD1-CG 3.71Å; L511-L515 HydrophobicContact CD2-CD1 4.34Å; L511-L515 HydrophobicContact CG-CD1 3.81Å; L511-L515 HydrophobicContact CG-CG 3.93Å; L511-L515 WeakPolarHBondContact O-CB 3.27Å; L511-L515 VanDerWaalsContact O-CG 3.26Å; L511-L515 WeakPolarHBondContact O-CG 3.48Å; L511-L515 PolarHBondContact O-N 3.23Å; L511-L538 HydrophobicContact CB-CD1 4.49Å; L511-L538 HydrophobicContact CD2-CD1 3.76Å; L511-L538 HydrophobicContact CG-CD1 3.98Å
512	M	92.7	Very high	88.5	Confident	13 Å²	13	53.2 Å²	53.2	6%	0.064	27%	0.267	C	S	.	.	H	α-helix	trans	-56.2	-46.3	175.5	-65.1	153.6	72	0	0	112.3	K508 R509 F510 N516 L538 Y539 A542 H544	K508-M512 VanDerWaalsContact O-CG 3.23Å; K508-M512 WeakPolarHBondContact O-CG 3.48Å; K508-M512 PolarHBondContact O-N 3.26Å; K508-M512 VanDerWaalsContact O-SD 3.4Å; R509-M512 PolarHBondContact O-N 3Å; F510-M512 VanDerWaalsContact C-N 3.35Å; F510-M512 PolarHBondContact O-N 3.32Å; M512-N516 WeakPolarHBondContact O-CB 3.41Å; M512-N516 PolarHBondContact O-N 3.35Å; M512-L538 HydrophobicContact CG-CB 3.88Å; M512-L538 HydrophobicContact CG-CD1 4.03Å; M512-L538 HydrophobicContact CG-CD2 4.46Å; M512-L538 HydrophobicContact CG-CG 4.36Å; M512-Y539 HydrophobicContact CB-CE1 4.28Å; M512-Y539 HydrophobicContact CE-CD1 3.74Å; M512-Y539 HydrophobicContact CE-CE1 3.97Å; M512-Y539 HydrophobicContact CG-CE1 4.44Å; M512-A542 HydrophobicContact CE-CB 3.89Å; M512-A542 HydrophobicContact SD-CB 4.38Å; M512-H544 HydrophobicContact CE-CB 4.1Å; M512-H544 VanDerWaalsContact CE-CD2 3.48Å; M512-H544 WeakPolarHBondContact CE-CD2 3.3Å
513	S	91.9	Very high	87.7	Confident	54 Å²	54	50 Å²	50	38%	0.378	26%	0.256	S	S	.	.	H	α-helix	trans	-64.7	-40.2	175.8	175.1	0	0	0	0	112.7	K453 R509 F510 L511 E517	K453-S513 PolarHBondContact NZ-OG 3.08Å; R509-S513 PolarHBondContact O-N 3.08Å; F510-S513 PolarHBondContact O-N 3.19Å; L511-S513 PolarHBondContact O-N 2.76Å; S513-E517 PolarHBondContact O-N 3.34Å
514	Y	91.5	Very high	86.8	Confident	3 Å²	3	46.6 Å²	46.6	1%	0.012	24%	0.241	C	C	.	.	H	α-helix	trans	-71.2	-47.8	-177.9	-176.8	-113.8	0	0	0	112.1	K453 F456 R457 V463 L466 F510 L511 N516 E517 V518	K453-Y514 HydrophobicContact CG-CD2 4.04Å; K453-Y514 HydrophobicContact CG-CE2 4.49Å; F456-Y514 HydrophobicContact CB-CE2 4.15Å; F456-Y514 WeakPolarHBondContact CB-OH 3.38Å; R457-Y514 HydrophobicContact CG-CE2 4.14Å; V463-Y514 HydrophobicContact CG1-CE1 4.41Å; V463-Y514 HydrophobicContact CG2-CE1 4.3Å; L466-Y514 HydrophobicContact CD1-CD1 3.84Å; L466-Y514 HydrophobicContact CD1-CE1 3.62Å; F510-Y514 HydrophobicContact CZ-CG 4.42Å; F510-Y514 WeakPolarHBondContact O-CB 3.36Å; F510-Y514 PolarHBondContact O-N 2.97Å; L511-Y514 PolarHBondContact O-N 2.64Å; L511-Y514 VanDerWaalsContact O-N 3.16Å; Y514-N516 PolarHBondContact O-N 3.28Å; Y514-E517 PolarHBondContact O-N 3.43Å; Y514-V518 HydrophobicContact CD1-CG2 4.47Å; Y514-V518 HydrophobicContact CD2-CG2 4.16Å; Y514-V518 HydrophobicContact CE1-CG2 4.09Å; Y514-V518 HydrophobicContact CE2-CG2 3.77Å; Y514-V518 HydrophobicContact CG-CG2 4.5Å; Y514-V518 VanDerWaalsContact O-CG2 3.32Å; Y514-V518 WeakPolarHBondContact O-CG2 3.48Å; Y514-V518 PolarHBondContact O-N 2.95Å
515	L	90.9	Very high	85.7	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.8	-45	178.1	-69.4	-175.1	0	0	0	111.7	V463 I467 L511 E517 V518 R519 I531 A534 L535 L538	V463-L515 HydrophobicContact CG1-CD2 3.16Å; I467-L515 HydrophobicContact CD1-CD2 4.02Å; I467-L515 HydrophobicContact CG1-CD2 4.09Å; L511-L515 HydrophobicContact CD1-CD1 4.01Å; L511-L515 HydrophobicContact CD1-CD2 3.93Å; L511-L515 HydrophobicContact CD1-CG 3.71Å; L511-L515 HydrophobicContact CD2-CD1 4.34Å; L511-L515 HydrophobicContact CG-CD1 3.81Å; L511-L515 HydrophobicContact CG-CG 3.93Å; L511-L515 WeakPolarHBondContact O-CB 3.27Å; L511-L515 VanDerWaalsContact O-CG 3.26Å; L511-L515 WeakPolarHBondContact O-CG 3.48Å; L511-L515 PolarHBondContact O-N 3.23Å; L515-E517 PolarHBondContact O-N 3.03Å; L515-V518 PolarHBondContact O-N 3.29Å; L515-R519 PolarHBondContact O-N 2.55Å; L515-I531 HydrophobicContact CB-CG2 4.33Å; L515-I531 HydrophobicContact CD2-CG1 4.4Å; L515-I531 HydrophobicContact CD2-CG2 4.4Å; L515-A534 HydrophobicContact CD1-CB 4.1Å; L515-L535 HydrophobicContact CB-CD1 4.07Å; L515-L535 HydrophobicContact CB-CD2 3.47Å; L515-L535 VanDerWaalsContact CB-CD2 3.47Å; L515-L535 HydrophobicContact CB-CG 3.69Å; L515-L535 HydrophobicContact CD1-CD2 3.99Å; L515-L535 HydrophobicContact CD1-CG 3.95Å; L515-L535 HydrophobicContact CG-CD2 4.35Å; L515-L535 HydrophobicContact CG-CG 4.46Å; L515-L538 HydrophobicContact CD1-CD1 4.02Å
516	N	89.4	Confident	85	Confident	82 Å²	82	52.5 Å²	52.5	44%	0.439	29%	0.286	S	S	.	.	H	α-helix	trans	-63.2	-41.3	-179.5	-169	28.5	0	0	0	112.2	M512 Y514	M512-N516 WeakPolarHBondContact O-CB 3.41Å; M512-N516 PolarHBondContact O-N 3.35Å; Y514-N516 PolarHBondContact O-N 3.28Å
517	E	88	Confident	84.7	Confident	68 Å²	68	50.4 Å²	50.4	32%	0.318	28%	0.276	S	S	.	.	H	α-helix	trans	-64	-46.5	171.7	-84.8	179.5	-147.1	0	0	112	K453 R457 S513 Y514 L515 R519 S520	K453-E517 WeakPolarHBondContact CE-OE1 3.35Å; K453-E517 WeakPolarHBondContact CE-OE2 3.26Å; K453-E517 VanDerWaalsContact NZ-CD 3.27Å; K453-E517 IonicContact NZ-OE1 3.95Å; K453-E517 PolarHBondContact NZ-OE1 2.74Å; K453-E517 IonicContact NZ-OE2 3.42Å; K453-E517 PolarHBondContact NZ-OE2 2.98Å; R457-E517 IonicContact CZ-OE2 2.69Å; R457-E517 IonicContact NH1-OE2 3.02Å; R457-E517 PolarHBondContact NH1-OE2 2.87Å; S513-E517 PolarHBondContact O-N 3.34Å; Y514-E517 PolarHBondContact O-N 3.43Å; L515-E517 PolarHBondContact O-N 3.03Å; E517-R519 VanDerWaalsContact C-N 3.34Å; E517-R519 PolarHBondContact O-N 3Å; E517-S520 PolarHBondContact O-N 2.87Å; E517-S520 PolarHBondContact O-OG 3.15Å
518	V	87.4	Confident	84.4	Confident	6 Å²	6	53.7 Å²	53.7	4%	0.036	29%	0.29	C	S	.	.	H	α-helix	trans	-68.5	-30.8	-174.8	177	0	0	0	0	112.5	V463 Y514 L515 S520 T521 V523 A524 I531	V463-V518 HydrophobicContact CG2-CB 4.48Å; V463-V518 HydrophobicContact CG2-CG1 3.72Å; Y514-V518 HydrophobicContact CD1-CG2 4.47Å; Y514-V518 HydrophobicContact CD2-CG2 4.16Å; Y514-V518 HydrophobicContact CE1-CG2 4.09Å; Y514-V518 HydrophobicContact CE2-CG2 3.77Å; Y514-V518 HydrophobicContact CG-CG2 4.5Å; Y514-V518 VanDerWaalsContact O-CG2 3.32Å; Y514-V518 WeakPolarHBondContact O-CG2 3.48Å; Y514-V518 PolarHBondContact O-N 2.95Å; L515-V518 PolarHBondContact O-N 3.29Å; V518-S520 PolarHBondContact O-N 3.44Å; V518-S520 VanDerWaalsContact O-N 3.12Å; V518-T521 PolarHBondContact O-N 2.94Å; V518-T521 PolarHBondContact O-OG1 3.25Å; V518-V523 HydrophobicContact CG1-CB 4.3Å; V518-V523 HydrophobicContact CG1-CG1 4.28Å; V518-A524 HydrophobicContact CG1-CB 4.47Å; V518-A524 WeakPolarHBondContact O-CB 3.42Å; V518-I531 HydrophobicContact CG1-CD1 4.46Å
519	R	86.2	Confident	84.4	Confident	40 Å²	40	55.1 Å²	55.1	15%	0.151	30%	0.298	C	S	.	.	H	α-helix	trans	-51.8	-32.7	172.4	179.2	175.4	169	146.3	-21.8	112.7	L515 E517 T521 I531 D532 L550 T553 E554	L515-R519 PolarHBondContact O-N 2.55Å; E517-R519 VanDerWaalsContact C-N 3.34Å; E517-R519 PolarHBondContact O-N 3Å; R519-T521 VanDerWaalsContact C-N 3.33Å; R519-I531 HydrophobicContact CB-CG2 4.33Å; R519-D532 WeakPolarHBondContact CD-OD1 3.5Å; R519-D532 IonicContact CZ-OD1 3.76Å; R519-D532 IonicContact CZ-OD2 3.56Å; R519-D532 IonicContact NE-OD1 3.21Å; R519-D532 IonicContact NH1-OD1 2.78Å; R519-D532 PolarHBondContact NH1-OD1 3.13Å; R519-D532 IonicContact NH1-OD2 2.87Å; R519-D532 PolarHBondContact NH1-OD2 2.98Å; R519-D532 VanDerWaalsContact NH1-OD2 3.12Å; R519-L550 PolarHBondContact NH2-O 3.07Å; R519-T553 PolarHBondContact NH2-OG1 3.14Å; R519-E554 PolarHBondContact NH2-O 3.36Å
520	S	82.8	Confident	84.2	Confident	105 Å²	105	48.5 Å²	48.5	73%	0.734	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-8.7	177.9	75	0	0	0	0	115.1	E517 V518	E517-S520 PolarHBondContact O-N 2.87Å; E517-S520 PolarHBondContact O-OG 3.15Å; V518-S520 PolarHBondContact O-N 3.44Å; V518-S520 VanDerWaalsContact O-N 3.12Å
521	T	83.3	Confident	84.1	Confident	44 Å²	44	47.9 Å²	47.9	27%	0.27	27%	0.271	S	S	.	.	S	Bend	trans	-107.6	156.1	-170.3	70.3	0	0	0	0	112.8	V518 R519 V523 A524	V518-T521 PolarHBondContact O-N 2.94Å; V518-T521 PolarHBondContact O-OG1 3.25Å; R519-T521 VanDerWaalsContact C-N 3.33Å; T521-V523 PolarHBondContact O-N 3Å; T521-A524 PolarHBondContact O-N 3.4Å; T521-A524 VanDerWaalsContact O-N 3.09Å
522	E	74	Confident	84	Confident	172 Å²	172	47.9 Å²	47.9	80%	0.804	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-55.7	-23.1	174.8	-62.4	-180	172.7	0	0	113.7	A524 N525	E522-A524 PolarHBondContact O-N 3.24Å; E522-N525 VanDerWaalsContact O-CB 3.3Å; E522-N525 WeakPolarHBondContact O-CB 3.26Å; E522-N525 PolarHBondContact O-N 3.47Å; E522-N525 VanDerWaalsContact O-N 3.14Å; E522-N525 PolarHBondContact O-ND2 3.22Å
523	V	70.7	Confident	83.9	Confident	52 Å²	52	47.3 Å²	47.3	32%	0.315	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-62.5	-30.6	178.7	178.9	0	0	0	0	111.8	V518 T521 N525 Y527	V518-V523 HydrophobicContact CG1-CB 4.3Å; V518-V523 HydrophobicContact CG1-CG1 4.28Å; T521-V523 PolarHBondContact O-N 3Å; V523-N525 PolarHBondContact O-N 3.01Å; V523-Y527 WeakPolarHBondContact CG1-OH 3.22Å; V523-Y527 PolarHBondContact O-OH 3.46Å
524	A	69.5	Low	83.9	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-73.3	-9.6	177.6	0	0	0	0	0	114.1	V518 T521 E522 G526 Y527 K528 I531	V518-A524 HydrophobicContact CG1-CB 4.47Å; V518-A524 WeakPolarHBondContact O-CB 3.42Å; T521-A524 PolarHBondContact O-N 3.4Å; T521-A524 VanDerWaalsContact O-N 3.09Å; E522-A524 PolarHBondContact O-N 3.24Å; A524-G526 PolarHBondContact O-N 3.28Å; A524-Y527 PolarHBondContact O-N 3.02Å; A524-K528 HydrophobicContact CB-CG 4.33Å; A524-K528 VanDerWaalsContact O-CG 3.27Å; A524-K528 WeakPolarHBondContact O-CG 3.47Å; A524-K528 PolarHBondContact O-N 2.96Å; A524-I531 HydrophobicContact CB-CD1 3.66Å
525	N	65.6	Low	83.9	Confident	104 Å²	104	44.6 Å²	44.6	56%	0.556	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	107.6	-177.6	-69.7	-31.2	0	0	0	111.1	E522 V523 K528	E522-N525 VanDerWaalsContact O-CB 3.3Å; E522-N525 WeakPolarHBondContact O-CB 3.26Å; E522-N525 PolarHBondContact O-N 3.47Å; E522-N525 VanDerWaalsContact O-N 3.14Å; E522-N525 PolarHBondContact O-ND2 3.22Å; V523-N525 PolarHBondContact O-N 3.01Å; N525-K528 WeakPolarHBondContact OD1-CE 3.31Å
526	G	73.1	Confident	83.9	Confident	75 Å²	75	44.6 Å²	44.6	77%	0.773	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	119.9	-11.6	-178.6	0	0	0	0	0	114.5	A524	A524-G526 PolarHBondContact O-N 3.28Å
527	Y	83.2	Confident	84	Confident	29 Å²	29	40.9 Å²	40.9	11%	0.114	23%	0.23	C	C	.	.			trans	-147.4	36.8	177.7	48.5	-96.9	0	0	0	113.2	V463 V523 A524 E529 D530 I531	V463-Y527 HydrophobicContact CB-CD2 4.49Å; V463-Y527 HydrophobicContact CB-CE2 3.8Å; V463-Y527 HydrophobicContact CG2-CE2 3.73Å; V523-Y527 WeakPolarHBondContact CG1-OH 3.22Å; V523-Y527 PolarHBondContact O-OH 3.46Å; A524-Y527 PolarHBondContact O-N 3.02Å; Y527-E529 VanDerWaalsContact C-N 3.32Å; Y527-E529 PolarHBondContact O-N 3.28Å; Y527-D530 WeakPolarHBondContact CB-OD2 3.35Å; Y527-D530 PolarHBondContact O-N 2.95Å; Y527-I531 HydrophobicContact CD2-CD1 3.67Å; Y527-I531 HydrophobicContact CD2-CG1 4.07Å; Y527-I531 HydrophobicContact CE2-CD1 3.85Å; Y527-I531 WeakPolarHBondContact O-CG1 3.04Å; Y527-I531 PolarHBondContact O-N 2.97Å
528	K	85.3	Confident	84.1	Confident	68 Å²	68	37.7 Å²	37.7	30%	0.296	22%	0.215	S	C	.	.	H	α-helix	trans	-61.9	-37.8	173.7	-62.8	-168.1	177.2	-177.2	0	112.3	A524 N525 D530 I531 D532 F556	A524-K528 HydrophobicContact CB-CG 4.33Å; A524-K528 VanDerWaalsContact O-CG 3.27Å; A524-K528 WeakPolarHBondContact O-CG 3.47Å; A524-K528 PolarHBondContact O-N 2.96Å; N525-K528 WeakPolarHBondContact OD1-CE 3.31Å; K528-D530 PolarHBondContact O-N 3.41Å; K528-I531 PolarHBondContact O-N 3.11Å; K528-D532 VanDerWaalsContact O-CB 3.24Å; K528-D532 WeakPolarHBondContact O-CB 3.28Å; K528-D532 PolarHBondContact O-N 3.41Å; K528-F556 HydrophobicContact CB-CB 4.11Å; K528-F556 HydrophobicContact CB-CD2 3.68Å; K528-F556 HydrophobicContact CB-CE2 4.37Å; K528-F556 HydrophobicContact CB-CG 3.93Å; K528-F556 HydrophobicContact CD-CD2 3.86Å; K528-F556 HydrophobicContact CD-CE2 3.68Å; K528-F556 HydrophobicContact CD-CZ 4.34Å; K528-F556 HydrophobicContact CG-CD2 4.4Å
529	E	88.5	Confident	84.3	Confident	77 Å²	77	37.7 Å²	37.7	36%	0.36	21%	0.214	S	C	.	.	H	α-helix	trans	-59.6	-43.6	175.8	179.3	178.7	136.2	0	0	112.5	P475 S477 Y527 T533 F556 L558	P475-E529 HydrophobicContact CG-CG 4.5Å; S477-E529 WeakPolarHBondContact CB-OE1 3.2Å; S477-E529 PolarHBondContact OG-OE1 3.12Å; Y527-E529 VanDerWaalsContact C-N 3.32Å; Y527-E529 PolarHBondContact O-N 3.28Å; E529-T533 WeakPolarHBondContact O-CB 3.34Å; E529-T533 PolarHBondContact O-N 3.11Å; E529-T533 PolarHBondContact O-OG1 3.24Å; E529-F556 VanDerWaalsContact CA-O 3.28Å; E529-F556 WeakPolarHBondContact CA-O 3.28Å; E529-F556 HydrophobicContact CB-CB 4.43Å; E529-F556 WeakPolarHBondContact CG-O 3.42Å; E529-L558 HydrophobicContact CG-CB 4.39Å
530	D	89.1	Confident	84.4	Confident	13 Å²	13	35.8 Å²	35.8	7%	0.07	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-44.5	175.8	-65.8	-70	0	0	0	111.8	R464 P475 S478 Y527 K528 A534	R464-D530 VanDerWaalsContact CD-CG 3.46Å; R464-D530 WeakPolarHBondContact CD-OD2 3.39Å; R464-D530 HydrophobicContact CG-CB 3.93Å; R464-D530 IonicContact NH1-OD2 2.64Å; R464-D530 PolarHBondContact NH1-OD2 3.26Å; P475-D530 WeakPolarHBondContact CD-OD1 3.43Å; S478-D530 WeakPolarHBondContact CB-OD1 3.04Å; S478-D530 PolarHBondContact OG-OD1 2.96Å; Y527-D530 WeakPolarHBondContact CB-OD2 3.35Å; Y527-D530 PolarHBondContact O-N 2.95Å; K528-D530 PolarHBondContact O-N 3.41Å; D530-A534 WeakPolarHBondContact O-CB 3.42Å; D530-A534 PolarHBondContact O-N 3.43Å
531	I	90.1	Very high	84.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.4	-50	179.4	-70	168.1	0	0	0	111.1	V463 L515 V518 R519 A524 Y527 K528 A534 L535	V463-I531 HydrophobicContact CG1-CG1 4.21Å; L515-I531 HydrophobicContact CB-CG2 4.33Å; L515-I531 HydrophobicContact CD2-CG1 4.4Å; L515-I531 HydrophobicContact CD2-CG2 4.4Å; V518-I531 HydrophobicContact CG1-CD1 4.46Å; R519-I531 HydrophobicContact CB-CG2 4.33Å; A524-I531 HydrophobicContact CB-CD1 3.66Å; Y527-I531 HydrophobicContact CD2-CD1 3.67Å; Y527-I531 HydrophobicContact CD2-CG1 4.07Å; Y527-I531 HydrophobicContact CE2-CD1 3.85Å; Y527-I531 WeakPolarHBondContact O-CG1 3.04Å; Y527-I531 PolarHBondContact O-N 2.97Å; K528-I531 PolarHBondContact O-N 3.11Å; I531-A534 PolarHBondContact O-N 3.17Å; I531-L535 HydrophobicContact CG2-CD1 3.92Å; I531-L535 HydrophobicContact CG2-CG 4.42Å; I531-L535 WeakPolarHBondContact O-CB 3.26Å; I531-L535 WeakPolarHBondContact O-CG 3.43Å; I531-L535 PolarHBondContact O-N 2.84Å
532	D	90.6	Very high	84.9	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-70.7	-42	-171.2	-70.8	-5.2	0	0	0	111.3	R519 K528 A534 L535 L536 N555 F556	R519-D532 WeakPolarHBondContact CD-OD1 3.5Å; R519-D532 IonicContact CZ-OD1 3.76Å; R519-D532 IonicContact CZ-OD2 3.56Å; R519-D532 IonicContact NE-OD1 3.21Å; R519-D532 IonicContact NH1-OD1 2.78Å; R519-D532 PolarHBondContact NH1-OD1 3.13Å; R519-D532 IonicContact NH1-OD2 2.87Å; R519-D532 PolarHBondContact NH1-OD2 2.98Å; R519-D532 VanDerWaalsContact NH1-OD2 3.12Å; K528-D532 VanDerWaalsContact O-CB 3.24Å; K528-D532 WeakPolarHBondContact O-CB 3.28Å; K528-D532 PolarHBondContact O-N 3.41Å; D532-A534 VanDerWaalsContact C-N 3.34Å; D532-A534 PolarHBondContact O-N 3.06Å; D532-L535 PolarHBondContact O-N 3.24Å; D532-L536 WeakPolarHBondContact O-CB 3.24Å; D532-L536 PolarHBondContact O-N 2.99Å; D532-N555 WeakPolarHBondContact OD2-CA 3.38Å; D532-F556 WeakPolarHBondContact OD2-CD2 3.4Å; D532-F556 PolarHBondContact OD2-N 3.1Å
533	T	91.2	Very high	85.3	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.1	-39.2	174	-53.5	0	0	0	0	111.3	P475 E529 K537 L558 D561	P475-T533 HydrophobicContact CG-CG2 4.09Å; E529-T533 WeakPolarHBondContact O-CB 3.34Å; E529-T533 PolarHBondContact O-N 3.11Å; E529-T533 PolarHBondContact O-OG1 3.24Å; T533-K537 HydrophobicContact CG2-CD 4.23Å; T533-K537 WeakPolarHBondContact O-CB 3.41Å; T533-K537 VanDerWaalsContact O-CG 3.26Å; T533-K537 WeakPolarHBondContact O-CG 3.44Å; T533-K537 PolarHBondContact O-N 3.26Å; T533-L558 HydrophobicContact CG2-CB 4.38Å; T533-L558 PolarHBondContact OG1-N 3.27Å; T533-D561 HydrophobicContact CG2-CB 4.21Å
534	A	91.3	Very high	86	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-68.8	-40.2	175.7	0	0	0	0	0	112.5	I467 L473 L515 D530 I531 D532 K537 L538	I467-A534 HydrophobicContact CD1-CB 3.97Å; I467-A534 HydrophobicContact CG1-CB 4.31Å; I467-A534 HydrophobicContact CG2-CB 3.75Å; L473-A534 HydrophobicContact CB-CB 4.29Å; L515-A534 HydrophobicContact CD1-CB 4.1Å; D530-A534 WeakPolarHBondContact O-CB 3.42Å; D530-A534 PolarHBondContact O-N 3.43Å; I531-A534 PolarHBondContact O-N 3.17Å; D532-A534 VanDerWaalsContact C-N 3.34Å; D532-A534 PolarHBondContact O-N 3.06Å; A534-K537 PolarHBondContact O-N 2.93Å; A534-L538 WeakPolarHBondContact O-CB 3.45Å; A534-L538 WeakPolarHBondContact O-CD1 3.44Å; A534-L538 VanDerWaalsContact O-CG 3.28Å; A534-L538 WeakPolarHBondContact O-CG 3.45Å; A534-L538 PolarHBondContact O-N 2.92Å
535	L	91.6	Very high	86.6	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.3	-48.9	173.2	-83.5	174.8	0	0	0	111.5	L515 I531 D532 K537 L538 Y539 L550	L515-L535 HydrophobicContact CB-CD1 4.07Å; L515-L535 HydrophobicContact CB-CD2 3.47Å; L515-L535 VanDerWaalsContact CB-CD2 3.47Å; L515-L535 HydrophobicContact CB-CG 3.69Å; L515-L535 HydrophobicContact CD1-CD2 3.99Å; L515-L535 HydrophobicContact CD1-CG 3.95Å; L515-L535 HydrophobicContact CG-CD2 4.35Å; L515-L535 HydrophobicContact CG-CG 4.46Å; I531-L535 HydrophobicContact CG2-CD1 3.92Å; I531-L535 HydrophobicContact CG2-CG 4.42Å; I531-L535 WeakPolarHBondContact O-CB 3.26Å; I531-L535 WeakPolarHBondContact O-CG 3.43Å; I531-L535 PolarHBondContact O-N 2.84Å; D532-L535 PolarHBondContact O-N 3.24Å; L535-K537 PolarHBondContact O-N 3.3Å; L535-L538 PolarHBondContact O-N 2.96Å; L535-Y539 HydrophobicContact CB-CD2 4.32Å; L535-Y539 HydrophobicContact CB-CE2 4.04Å; L535-Y539 HydrophobicContact CD2-CE2 3.83Å; L535-Y539 HydrophobicContact CG-CE2 4.41Å; L535-Y539 WeakPolarHBondContact O-CB 3.33Å; L535-Y539 VanDerWaalsContact O-CD2 3.24Å; L535-Y539 WeakPolarHBondContact O-CD2 3.44Å; L535-Y539 PolarHBondContact O-N 3.35Å; L535-L550 HydrophobicContact CB-CD1 4.32Å; L535-L550 HydrophobicContact CB-CD2 3.81Å; L535-L550 HydrophobicContact CD1-CD1 3.98Å
536	L	91.8	Very high	87.6	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-58.1	-48.8	177.4	-176.7	158.3	0	0	0	111.1	D532 L538 Y539 A540 L547 L550 L551 C557 L566	D532-L536 WeakPolarHBondContact O-CB 3.24Å; D532-L536 PolarHBondContact O-N 2.99Å; L536-L538 VanDerWaalsContact C-N 3.32Å; L536-L538 PolarHBondContact O-N 3.17Å; L536-Y539 PolarHBondContact O-N 3.23Å; L536-A540 VanDerWaalsContact O-CB 3.26Å; L536-A540 WeakPolarHBondContact O-CB 3.4Å; L536-A540 PolarHBondContact O-N 3.42Å; L536-L547 HydrophobicContact CG-CD1 4.31Å; L536-L550 HydrophobicContact CB-CD2 4Å; L536-L551 HydrophobicContact CD1-CD2 3.91Å; L536-C557 HydrophobicContact CD1-CB 3.9Å; L536-L566 HydrophobicContact CD1-CD1 4.44Å; L536-L566 HydrophobicContact CD2-CD1 4.17Å; L536-L566 HydrophobicContact CD2-CD2 4.12Å; L536-L566 HydrophobicContact CD2-CG 3.97Å
537	K	90.8	Very high	88.3	Confident	5 Å²	5	33.4 Å²	33.4	2%	0.022	18%	0.175	C	C	.	.	H	α-helix	trans	-59.3	-41	177.2	-73.7	171.3	-179.5	176.4	0	112.1	F472 L473 L474 T533 A534 L535 E541 D561 W565	F472-K537 WeakPolarHBondContact O-CD 3.47Å; F472-K537 PolarHBondContact O-NZ 2.95Å; L473-K537 HydrophobicContact CD2-CB 3.73Å; L473-K537 HydrophobicContact CD2-CD 4.39Å; L473-K537 WeakPolarHBondContact O-CD 3.19Å; L473-K537 PolarHBondContact O-NZ 3.11Å; L474-K537 PolarHBondContact O-NZ 3.01Å; L474-K537 VanDerWaalsContact O-NZ 3.15Å; T533-K537 HydrophobicContact CG2-CD 4.23Å; T533-K537 WeakPolarHBondContact O-CB 3.41Å; T533-K537 VanDerWaalsContact O-CG 3.26Å; T533-K537 WeakPolarHBondContact O-CG 3.44Å; T533-K537 PolarHBondContact O-N 3.26Å; A534-K537 PolarHBondContact O-N 2.93Å; L535-K537 PolarHBondContact O-N 3.3Å; K537-E541 WeakPolarHBondContact O-CB 3.26Å; K537-E541 PolarHBondContact O-N 2.87Å; K537-E541 VanDerWaalsContact O-N 3.17Å; K537-D561 IonicContact NZ-OD2 2.71Å; K537-D561 PolarHBondContact NZ-OD2 3.15Å; K537-W565 HydrophobicContact CB-CD2 4.48Å; K537-W565 HydrophobicContact CB-CG 4.41Å; K537-W565 HydrophobicContact CG-CB 4.34Å; K537-W565 HydrophobicContact CG-CD2 4.13Å; K537-W565 HydrophobicContact CG-CG 3.89Å; K537-W565 PolarHBondContact O-NE1 3.41Å
538	L	90.9	Very high	88.4	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-69.2	-47.4	177.2	-76.8	163.2	0	0	0	113	L473 K508 L511 M512 L515 A534 L535 L536 A540 E541 A542	L473-L538 HydrophobicContact CD1-CD1 3.89Å; L473-L538 HydrophobicContact CD1-CD2 3.84Å; L473-L538 HydrophobicContact CD1-CG 3.75Å; L473-L538 HydrophobicContact CD2-CD2 4.45Å; L473-L538 HydrophobicContact CD2-CG 4.2Å; K508-L538 HydrophobicContact CB-CD2 4.29Å; K508-L538 HydrophobicContact CD-CD2 4.39Å; K508-L538 HydrophobicContact CG-CD2 4.14Å; L511-L538 HydrophobicContact CB-CD1 4.49Å; L511-L538 HydrophobicContact CD2-CD1 3.76Å; L511-L538 HydrophobicContact CG-CD1 3.98Å; M512-L538 HydrophobicContact CG-CB 3.88Å; M512-L538 HydrophobicContact CG-CD1 4.03Å; M512-L538 HydrophobicContact CG-CD2 4.46Å; M512-L538 HydrophobicContact CG-CG 4.36Å; L515-L538 HydrophobicContact CD1-CD1 4.02Å; A534-L538 WeakPolarHBondContact O-CB 3.45Å; A534-L538 WeakPolarHBondContact O-CD1 3.44Å; A534-L538 VanDerWaalsContact O-CG 3.28Å; A534-L538 WeakPolarHBondContact O-CG 3.45Å; A534-L538 PolarHBondContact O-N 2.92Å; L535-L538 PolarHBondContact O-N 2.96Å; L536-L538 VanDerWaalsContact C-N 3.32Å; L536-L538 PolarHBondContact O-N 3.17Å; L538-A540 VanDerWaalsContact C-N 3.34Å; L538-A540 PolarHBondContact O-N 3.22Å; L538-E541 PolarHBondContact O-N 3.29Å; L538-A542 VanDerWaalsContact O-CB 3.26Å; L538-A542 WeakPolarHBondContact O-CB 3.28Å; L538-A542 PolarHBondContact O-N 3.44Å
539	Y	91.1	Very high	88.4	Confident	5 Å²	5	36 Å²	36	2%	0.02	19%	0.194	C	C	.	.	H	α-helix	trans	-66.6	-35.5	-179.6	-66.3	-43.5	0	0	0	112.2	M512 L535 L536 A542 D543 H544 L550	M512-Y539 HydrophobicContact CB-CE1 4.28Å; M512-Y539 HydrophobicContact CE-CD1 3.74Å; M512-Y539 HydrophobicContact CE-CE1 3.97Å; M512-Y539 HydrophobicContact CG-CE1 4.44Å; L535-Y539 HydrophobicContact CB-CD2 4.32Å; L535-Y539 HydrophobicContact CB-CE2 4.04Å; L535-Y539 HydrophobicContact CD2-CE2 3.83Å; L535-Y539 HydrophobicContact CG-CE2 4.41Å; L535-Y539 WeakPolarHBondContact O-CB 3.33Å; L535-Y539 VanDerWaalsContact O-CD2 3.24Å; L535-Y539 WeakPolarHBondContact O-CD2 3.44Å; L535-Y539 PolarHBondContact O-N 3.35Å; L536-Y539 PolarHBondContact O-N 3.23Å; Y539-A542 PolarHBondContact O-N 3.45Å; Y539-D543 PolarHBondContact O-N 2.78Å; Y539-D543 VanDerWaalsContact O-N 3.14Å; Y539-H544 HydrophobicContact CD1-CB 3.63Å; Y539-H544 AromaticContact CD1-CG 3.59Å; Y539-H544 AromaticContact CD1-ND1 3.7Å; Y539-H544 HydrophobicContact CE1-CB 4.42Å; Y539-H544 AromaticContact CE1-CE1 3.94Å; Y539-H544 AromaticContact CE1-CG 3.89Å; Y539-H544 AromaticContact CE1-ND1 3.7Å; Y539-H544 HydrophobicContact CG-CB 4.32Å; Y539-H544 PolarHBondContact O-N 2.59Å; Y539-L550 HydrophobicContact CD2-CD2 4.02Å; Y539-L550 HydrophobicContact CE2-CD1 4.12Å; Y539-L550 HydrophobicContact CE2-CD2 4.2Å
540	A	89	Confident	88.3	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-71.6	-27.1	174.2	0	0	0	0	0	113.6	L536 L538 L547 L566 H569	L536-A540 VanDerWaalsContact O-CB 3.26Å; L536-A540 WeakPolarHBondContact O-CB 3.4Å; L536-A540 PolarHBondContact O-N 3.42Å; L538-A540 VanDerWaalsContact C-N 3.34Å; L538-A540 PolarHBondContact O-N 3.22Å; A540-L547 HydrophobicContact CB-CD1 4.46Å; A540-L547 HydrophobicContact CB-CD2 4.3Å; A540-L566 HydrophobicContact CB-CD2 3.84Å; A540-H569 PolarHBondContact O-ND1 2.63Å
541	E	88.9	Confident	88.2	Confident	76 Å²	76	32.3 Å²	32.3	36%	0.355	18%	0.177	S	C	.	.	H	α-helix	trans	-78.6	-33	171.7	-171.1	-173	-163.7	0	0	112.3	K508 K537 L538	K508-E541 IonicContact NZ-OE1 2.75Å; K508-E541 PolarHBondContact NZ-OE1 3.36Å; K508-E541 IonicContact NZ-OE2 2.81Å; K508-E541 PolarHBondContact NZ-OE2 2.99Å; K537-E541 WeakPolarHBondContact O-CB 3.26Å; K537-E541 PolarHBondContact O-N 2.87Å; K537-E541 VanDerWaalsContact O-N 3.17Å; L538-E541 PolarHBondContact O-N 3.29Å
542	A	86	Confident	87.8	Confident	54 Å²	54	37.5 Å²	37.5	45%	0.446	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	5.2	-172	0	0	0	0	0	115.2	M512 L538 Y539 H544	M512-A542 HydrophobicContact CE-CB 3.89Å; M512-A542 HydrophobicContact SD-CB 4.38Å; L538-A542 VanDerWaalsContact O-CB 3.26Å; L538-A542 WeakPolarHBondContact O-CB 3.28Å; L538-A542 PolarHBondContact O-N 3.44Å; Y539-A542 PolarHBondContact O-N 3.45Å; A542-H544 PolarHBondContact O-N 2.83Å
543	D	82.9	Confident	87.5	Confident	112 Å²	112	40.8 Å²	40.8	60%	0.599	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.7	41.9	-175.8	-73.5	-35.9	0	0	0	113.6	Y539 K571	Y539-D543 PolarHBondContact O-N 2.78Å; Y539-D543 VanDerWaalsContact O-N 3.14Å; D543-K571 WeakPolarHBondContact OD1-CE 3.47Å; D543-K571 IonicContact OD1-NZ 3.64Å; D543-K571 PolarHBondContact OD1-NZ 2.94Å
544	H	85.3	Confident	86.9	Confident	74 Å²	74	48 Å²	48	34%	0.343	26%	0.262	S	S	.	.			trans	-91.6	129.1	-171.3	-170.9	-69.8	0	0	0	112.2	M512 Y539 A542 S546 L547	M512-H544 HydrophobicContact CE-CB 4.1Å; M512-H544 VanDerWaalsContact CE-CD2 3.48Å; M512-H544 WeakPolarHBondContact CE-CD2 3.3Å; Y539-H544 HydrophobicContact CD1-CB 3.63Å; Y539-H544 AromaticContact CD1-CG 3.59Å; Y539-H544 AromaticContact CD1-ND1 3.7Å; Y539-H544 HydrophobicContact CE1-CB 4.42Å; Y539-H544 AromaticContact CE1-CE1 3.94Å; Y539-H544 AromaticContact CE1-CG 3.89Å; Y539-H544 AromaticContact CE1-ND1 3.7Å; Y539-H544 HydrophobicContact CG-CB 4.32Å; Y539-H544 PolarHBondContact O-N 2.59Å; A542-H544 PolarHBondContact O-N 2.83Å; H544-S546 VanDerWaalsContact C-N 3.3Å; H544-S546 PolarHBondContact ND1-N 3.46Å; H544-S546 PolarHBondContact O-N 3.49Å; H544-S546 VanDerWaalsContact O-N 3.13Å; H544-L547 WeakPolarHBondContact O-CB 3.15Å; H544-L547 PolarHBondContact O-N 3.4Å
545	D	83.1	Confident	86.6	Confident	143 Å²	143	48.2 Å²	48.2	77%	0.765	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.3	-47.7	-173.5	-54.4	-47.6	0	0	0	113.6	L547 L548	D545-L547 PolarHBondContact O-N 2.72Å; D545-L548 PolarHBondContact O-N 3.05Å
546	S	86.4	Confident	86.2	Confident	32 Å²	32	52.8 Å²	52.8	22%	0.224	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	3.4	179.5	-52.9	0	0	0	0	116.7	H544 L548 D549 L550	H544-S546 VanDerWaalsContact C-N 3.3Å; H544-S546 PolarHBondContact ND1-N 3.46Å; H544-S546 PolarHBondContact O-N 3.49Å; H544-S546 VanDerWaalsContact O-N 3.13Å; S546-L548 PolarHBondContact O-N 3.47Å; S546-D549 VanDerWaalsContact CA-OD2 3.28Å; S546-D549 WeakPolarHBondContact CA-OD2 3.35Å; S546-D549 WeakPolarHBondContact CB-OD2 3.34Å; S546-D549 PolarHBondContact O-N 3.35Å; S546-D549 PolarHBondContact OG-OD2 3.36Å; S546-D549 VanDerWaalsContact OG-OD2 3.09Å; S546-L550 WeakPolarHBondContact O-CB 3.44Å; S546-L550 PolarHBondContact O-N 3.21Å
547	L	87.1	Confident	86	Confident	11 Å²	11	53.1 Å²	53.1	6%	0.058	29%	0.286	C	S	.	.	H	α-helix	trans	-54.8	-40	164.5	179.2	60.2	0	0	0	111.3	L536 A540 H544 D545 L551 L566 K571 A574	L536-L547 HydrophobicContact CG-CD1 4.31Å; A540-L547 HydrophobicContact CB-CD1 4.46Å; A540-L547 HydrophobicContact CB-CD2 4.3Å; H544-L547 WeakPolarHBondContact O-CB 3.15Å; H544-L547 PolarHBondContact O-N 3.4Å; D545-L547 PolarHBondContact O-N 2.72Å; L547-L551 HydrophobicContact CD1-CD1 4.35Å; L547-L551 HydrophobicContact CG-CD1 4.47Å; L547-L551 WeakPolarHBondContact O-CD1 3.26Å; L547-L566 HydrophobicContact CD1-CD2 4.45Å; L547-L566 HydrophobicContact CD2-CD2 4.38Å; L547-K571 HydrophobicContact CD2-CG 4.33Å; L547-A574 HydrophobicContact CD2-CB 4.11Å; L547-A574 HydrophobicContact CG-CB 4.36Å
548	L	85.5	Confident	85.7	Confident	53 Å²	53	54.6 Å²	54.6	28%	0.277	29%	0.294	S	S	.	.	H	α-helix	trans	-75.5	-42.3	-178.7	-57.7	-178.4	0	0	0	111.2	D545 S546 L550 L551 V552 F573 A574 L577	D545-L548 PolarHBondContact O-N 3.05Å; S546-L548 PolarHBondContact O-N 3.47Å; L548-L550 PolarHBondContact O-N 3.22Å; L548-L551 PolarHBondContact O-N 2.82Å; L548-L551 VanDerWaalsContact O-N 3.1Å; L548-V552 WeakPolarHBondContact O-CG2 3.43Å; L548-V552 PolarHBondContact O-N 3.41Å; L548-F573 HydrophobicContact CD1-CE1 4.27Å; L548-F573 HydrophobicContact CD2-CD1 3.92Å; L548-F573 HydrophobicContact CD2-CE1 4Å; L548-A574 HydrophobicContact CD2-CB 4.22Å; L548-L577 HydrophobicContact CD2-CD1 3.93Å
549	D	85.5	Confident	85.5	Confident	99 Å²	99	56.3 Å²	56.3	53%	0.529	30%	0.303	S	S	.	.	H	α-helix	trans	-55	-39.9	174	-56.2	-31.2	0	0	0	111.7	S546 L551 T553	S546-D549 VanDerWaalsContact CA-OD2 3.28Å; S546-D549 WeakPolarHBondContact CA-OD2 3.35Å; S546-D549 WeakPolarHBondContact CB-OD2 3.34Å; S546-D549 PolarHBondContact O-N 3.35Å; S546-D549 PolarHBondContact OG-OD2 3.36Å; S546-D549 VanDerWaalsContact OG-OD2 3.09Å; D549-L551 VanDerWaalsContact C-N 3.28Å; D549-L551 PolarHBondContact O-N 3.12Å; D549-T553 WeakPolarHBondContact O-CB 3.32Å; D549-T553 WeakPolarHBondContact O-CG2 3.37Å; D549-T553 PolarHBondContact O-N 3.42Å; D549-T553 PolarHBondContact O-OG1 2.76Å
550	L	86.8	Confident	85.3	Confident	7 Å²	7	60.7 Å²	60.7	4%	0.037	33%	0.33	C	S	.	.	H	α-helix	trans	-63.7	-32.5	-180	-160.9	77.7	0	0	0	113.2	R519 L535 L536 Y539 S546 L548 T553 N555	R519-L550 PolarHBondContact NH2-O 3.07Å; L535-L550 HydrophobicContact CB-CD1 4.32Å; L535-L550 HydrophobicContact CB-CD2 3.81Å; L535-L550 HydrophobicContact CD1-CD1 3.98Å; L536-L550 HydrophobicContact CB-CD2 4Å; Y539-L550 HydrophobicContact CD2-CD2 4.02Å; Y539-L550 HydrophobicContact CE2-CD1 4.12Å; Y539-L550 HydrophobicContact CE2-CD2 4.2Å; S546-L550 WeakPolarHBondContact O-CB 3.44Å; S546-L550 PolarHBondContact O-N 3.21Å; L548-L550 PolarHBondContact O-N 3.22Å; L550-T553 PolarHBondContact O-OG1 3.41Å; L550-N555 WeakPolarHBondContact O-CB 3.36Å
551	L	85.6	Confident	85.1	Confident	5 Å²	5	61.9 Å²	61.9	3%	0.026	34%	0.336	C	S	.	.	H	α-helix	trans	-94.1	-27	-174.7	-71.5	166.9	0	0	0	113.1	L536 L547 L548 D549 T553 A574 L577 L578	L536-L551 HydrophobicContact CD1-CD2 3.91Å; L547-L551 HydrophobicContact CD1-CD1 4.35Å; L547-L551 HydrophobicContact CG-CD1 4.47Å; L547-L551 WeakPolarHBondContact O-CD1 3.26Å; L548-L551 PolarHBondContact O-N 2.82Å; L548-L551 VanDerWaalsContact O-N 3.1Å; D549-L551 VanDerWaalsContact C-N 3.28Å; D549-L551 PolarHBondContact O-N 3.12Å; L551-T553 VanDerWaalsContact C-N 3.34Å; L551-A574 HydrophobicContact CD1-CB 3.71Å; L551-A574 WeakPolarHBondContact CD1-O 3.07Å; L551-L577 HydrophobicContact CB-CB 4.1Å; L551-L577 HydrophobicContact CB-CD1 4.38Å; L551-L577 HydrophobicContact CD1-CB 4.45Å; L551-L578 HydrophobicContact CD2-CB 4.02Å; L551-L578 HydrophobicContact CD2-CD1 3.98Å
552	V	83.1	Confident	85.1	Confident	109 Å²	109	58.2 Å²	58.2	66%	0.661	32%	0.319	S	S	*	.	H	α-helix	trans	-77.4	-22.6	172.8	173.3	0	0	0	0	111.7	L548 L577	L548-V552 WeakPolarHBondContact O-CG2 3.43Å; L548-V552 PolarHBondContact O-N 3.41Å; V552-L577 HydrophobicContact CG2-CD1 4.43Å
553	T	84	Confident	85.2	Confident	71 Å²	71	56.1 Å²	56.1	44%	0.436	30%	0.302	S	S	.	.	S	Bend	trans	-92.5	164.9	175.4	53.9	0	0	0	0	112.6	R519 D549 L550 L551 N555	R519-T553 PolarHBondContact NH2-OG1 3.14Å; D549-T553 WeakPolarHBondContact O-CB 3.32Å; D549-T553 WeakPolarHBondContact O-CG2 3.37Å; D549-T553 PolarHBondContact O-N 3.42Å; D549-T553 PolarHBondContact O-OG1 2.76Å; L550-T553 PolarHBondContact O-OG1 3.41Å; L551-T553 VanDerWaalsContact C-N 3.34Å; T553-N555 PolarHBondContact O-N 3.25Å; T553-N555 VanDerWaalsContact O-N 3.11Å; T553-N555 PolarHBondContact O-ND2 2.99Å
554	E	78.7	Confident	85.5	Confident	150 Å²	150	53.6 Å²	53.6	70%	0.701	30%	0.297	S	S	*	.			trans	-52.1	118.6	171.6	-72.4	-176	-176.7	0	0	110.6	R519 Y581	R519-E554 PolarHBondContact NH2-O 3.36Å; E554-Y581 WeakPolarHBondContact CA-OH 3.13Å
555	N	84.2	Confident	85.7	Confident	5 Å²	5	52 Å²	52	3%	0.027	29%	0.288	C	S	.	.			trans	-140.6	150.8	-174.3	72.2	92.5	0	0	0	110.9	D532 L550 T553 C557 Y581	D532-N555 WeakPolarHBondContact OD2-CA 3.38Å; L550-N555 WeakPolarHBondContact O-CB 3.36Å; T553-N555 PolarHBondContact O-N 3.25Å; T553-N555 VanDerWaalsContact O-N 3.11Å; T553-N555 PolarHBondContact O-ND2 2.99Å; N555-C557 PolarHBondContact OD1-SG 3.38Å; N555-Y581 PolarHBondContact N-OH 3.33Å; N555-Y581 WeakPolarHBondContact ND2-CD2 3.45Å; N555-Y581 WeakPolarHBondContact O-CE1 3.37Å; N555-Y581 PolarHBondContact O-OH 2.73Å
556	F	84.3	Confident	86	Confident	96 Å²	96	45.1 Å²	45.1	42%	0.421	25%	0.251	S	S	.	.			trans	-114.9	32.8	-175.6	-61.7	-90.5	0	0	0	111.1	K528 E529 D532 L558	K528-F556 HydrophobicContact CB-CB 4.11Å; K528-F556 HydrophobicContact CB-CD2 3.68Å; K528-F556 HydrophobicContact CB-CE2 4.37Å; K528-F556 HydrophobicContact CB-CG 3.93Å; K528-F556 HydrophobicContact CD-CD2 3.86Å; K528-F556 HydrophobicContact CD-CE2 3.68Å; K528-F556 HydrophobicContact CD-CZ 4.34Å; K528-F556 HydrophobicContact CG-CD2 4.4Å; E529-F556 VanDerWaalsContact CA-O 3.28Å; E529-F556 WeakPolarHBondContact CA-O 3.28Å; E529-F556 HydrophobicContact CB-CB 4.43Å; E529-F556 WeakPolarHBondContact CG-O 3.42Å; D532-F556 WeakPolarHBondContact OD2-CD2 3.4Å; D532-F556 PolarHBondContact OD2-N 3.1Å; F556-L558 PolarHBondContact O-N 2.68Å
557	C	86.2	Confident	86	Confident	8 Å²	8	48.1 Å²	48.1	5%	0.054	26%	0.261	C	S	.	.			trans	-69.2	128.7	-172.2	-55	0	0	0	0	112.2	L536 N555 L559 L578	L536-C557 HydrophobicContact CD1-CB 3.9Å; N555-C557 PolarHBondContact OD1-SG 3.38Å; C557-L559 PolarHBondContact O-N 3.32Å; C557-L559 VanDerWaalsContact O-N 3.15Å; C557-L578 HydrophobicContact CB-CD1 3.91Å
558	L	86.1	Confident	86.1	Confident	35 Å²	35	53.7 Å²	53.7	18%	0.183	29%	0.285	C	S	.	.			trans	-66.6	114.5	175.2	177.7	62.7	0	0	0	110.2	P475 E529 T533 F556 T560 D561 S562	P475-L558 HydrophobicContact CB-CD2 3.87Å; E529-L558 HydrophobicContact CG-CB 4.39Å; T533-L558 HydrophobicContact CG2-CB 4.38Å; T533-L558 PolarHBondContact OG1-N 3.27Å; F556-L558 PolarHBondContact O-N 2.68Å; L558-T560 PolarHBondContact O-N 3.22Å; L558-D561 HydrophobicContact CB-CB 4.48Å; L558-D561 HydrophobicContact CD2-CB 4.07Å; L558-D561 HydrophobicContact CG-CB 4.3Å; L558-S562 WeakPolarHBondContact O-CB 3.45Å; L558-S562 PolarHBondContact O-N 2.93Å; L558-S562 PolarHBondContact O-OG 2.93Å
559	L	86.3	Confident	86.2	Confident	38 Å²	38	53.6 Å²	53.6	20%	0.199	28%	0.283	C	S	.	.	H	α-helix	trans	-57.2	-45.4	-172.9	-178.2	57.1	0	0	0	113.3	C557 S562 A563 L578 Y579	C557-L559 PolarHBondContact O-N 3.32Å; C557-L559 VanDerWaalsContact O-N 3.15Å; L559-S562 PolarHBondContact O-N 3.14Å; L559-A563 HydrophobicContact CD1-CB 4.49Å; L559-A563 WeakPolarHBondContact O-CB 3.23Å; L559-A563 PolarHBondContact O-N 2.75Å; L559-L578 HydrophobicContact CD1-CD2 3.84Å; L559-L578 HydrophobicContact CD1-CG 3.88Å; L559-Y579 HydrophobicContact CD1-CD1 4.04Å; L559-Y579 HydrophobicContact CD1-CE1 3.96Å
560	T	86.3	Confident	86.2	Confident	96 Å²	96	55.6 Å²	55.6	59%	0.589	29%	0.287	S	S	*	.	H	α-helix	trans	-64.2	-47	-174.4	50	0	0	0	0	112.7	L558	L558-T560 PolarHBondContact O-N 3.22Å
561	D	85.9	Confident	86.2	Confident	25 Å²	25	57 Å²	57	13%	0.134	29%	0.293	C	S	.	.	H	α-helix	trans	-68.3	-43.7	177.1	-89.2	48.7	0	0	0	111.5	P475 T476 T533 K537 L558 W565	P475-D561 WeakPolarHBondContact CA-OD2 3.22Å; T476-D561 WeakPolarHBondContact CB-OD1 3.28Å; T476-D561 WeakPolarHBondContact CG2-OD1 3.49Å; T476-D561 PolarHBondContact N-OD2 2.91Å; T476-D561 PolarHBondContact OG1-OD1 2.85Å; T533-D561 HydrophobicContact CG2-CB 4.21Å; K537-D561 IonicContact NZ-OD2 2.71Å; K537-D561 PolarHBondContact NZ-OD2 3.15Å; L558-D561 HydrophobicContact CB-CB 4.48Å; L558-D561 HydrophobicContact CD2-CB 4.07Å; L558-D561 HydrophobicContact CG-CB 4.3Å; D561-W565 WeakPolarHBondContact O-CB 3.4Å; D561-W565 PolarHBondContact O-N 2.89Å
562	S	88.3	Confident	86.2	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-72.7	-39.9	-173.3	-58.3	0	0	0	0	111.9	L558 L559 W565 L566	L558-S562 WeakPolarHBondContact O-CB 3.45Å; L558-S562 PolarHBondContact O-N 2.93Å; L558-S562 PolarHBondContact O-OG 2.93Å; L559-S562 PolarHBondContact O-N 3.14Å; S562-W565 PolarHBondContact O-N 3.02Å; S562-L566 WeakPolarHBondContact O-CB 3.37Å; S562-L566 VanDerWaalsContact O-CG 3.27Å; S562-L566 WeakPolarHBondContact O-CG 3.16Å; S562-L566 PolarHBondContact O-N 2.94Å
563	A	88	Confident	86.3	Confident	10 Å²	10	54.4 Å²	54.4	8%	0.083	27%	0.272	C	S	.	.	H	α-helix	trans	-61.9	-54.3	177.9	0	0	0	0	0	111.8	L559 W565 L566 E567 L575	L559-A563 HydrophobicContact CD1-CB 4.49Å; L559-A563 WeakPolarHBondContact O-CB 3.23Å; L559-A563 PolarHBondContact O-N 2.75Å; A563-W565 PolarHBondContact O-N 3.16Å; A563-W565 VanDerWaalsContact O-N 3.17Å; A563-L566 PolarHBondContact O-N 3.31Å; A563-L566 VanDerWaalsContact O-N 3.11Å; A563-E567 WeakPolarHBondContact O-CG 3.48Å; A563-E567 PolarHBondContact O-N 3.48Å; A563-L575 HydrophobicContact CB-CD1 3.68Å
564	A	88.8	Confident	86.4	Confident	59 Å²	59	51.1 Å²	51.1	49%	0.488	25%	0.251	S	S	.	.	H	α-helix	trans	-59.6	-29.9	178.6	0	0	0	0	0	112.9	K568	A564-K568 VanDerWaalsContact O-CB 3.27Å; A564-K568 WeakPolarHBondContact O-CB 3.49Å; A564-K568 PolarHBondContact O-N 3.43Å
565	W	89.1	Confident	86.9	Confident	39 Å²	39	44 Å²	44	15%	0.148	22%	0.218	C	C	.	.	H	α-helix	trans	-76.1	-41.5	174.9	-162.6	-94.6	0	0	0	112.9	F472 K537 D561 S562 A563 K568 H569	F472-W565 HydrophobicContact CB-CZ3 4.38Å; K537-W565 HydrophobicContact CB-CD2 4.48Å; K537-W565 HydrophobicContact CB-CG 4.41Å; K537-W565 HydrophobicContact CG-CB 4.34Å; K537-W565 HydrophobicContact CG-CD2 4.13Å; K537-W565 HydrophobicContact CG-CG 3.89Å; K537-W565 PolarHBondContact O-NE1 3.41Å; D561-W565 WeakPolarHBondContact O-CB 3.4Å; D561-W565 PolarHBondContact O-N 2.89Å; S562-W565 PolarHBondContact O-N 3.02Å; A563-W565 PolarHBondContact O-N 3.16Å; A563-W565 VanDerWaalsContact O-N 3.17Å; W565-K568 HydrophobicContact CE3-CD 4.23Å; W565-K568 HydrophobicContact CZ3-CD 4.45Å; W565-K568 VanDerWaalsContact CZ3-NZ 3.31Å; W565-K568 PolarHBondContact O-N 2.98Å; W565-H569 AromaticContact CD1-CD2 3.93Å; W565-H569 AromaticContact CE2-CD2 3.93Å; W565-H569 AromaticContact CE2-NE2 3.72Å; W565-H569 AromaticContact CZ2-NE2 3.84Å; W565-H569 AromaticContact NE1-CD2 3.7Å; W565-H569 AromaticContact NE1-NE2 3.8Å; W565-H569 PolarHBondContact O-CD2 3.47Å; W565-H569 VanDerWaalsContact O-CD2 3.31Å; W565-H569 PolarHBondContact O-N 2.87Å
566	L	88.9	Confident	87	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65.9	-39.8	176.6	-70	167.9	0	0	0	111.8	L536 A540 L547 S562 A563 H569 K570 K571 A574 L575 L578	L536-L566 HydrophobicContact CD1-CD1 4.44Å; L536-L566 HydrophobicContact CD2-CD1 4.17Å; L536-L566 HydrophobicContact CD2-CD2 4.12Å; L536-L566 HydrophobicContact CD2-CG 3.97Å; A540-L566 HydrophobicContact CB-CD2 3.84Å; L547-L566 HydrophobicContact CD1-CD2 4.45Å; L547-L566 HydrophobicContact CD2-CD2 4.38Å; S562-L566 WeakPolarHBondContact O-CB 3.37Å; S562-L566 VanDerWaalsContact O-CG 3.27Å; S562-L566 WeakPolarHBondContact O-CG 3.16Å; S562-L566 PolarHBondContact O-N 2.94Å; A563-L566 PolarHBondContact O-N 3.31Å; A563-L566 VanDerWaalsContact O-N 3.11Å; L566-H569 CarbonylContact O-C 3.55Å; L566-H569 PolarHBondContact O-N 3.05Å; L566-K570 PolarHBondContact O-N 3.38Å; L566-K571 HydrophobicContact CB-CB 4.4Å; L566-K571 HydrophobicContact CD2-CB 3.75Å; L566-K571 HydrophobicContact CD2-CG 4.42Å; L566-K571 PolarHBondContact O-N 3.02Å; L566-A574 HydrophobicContact CD2-CB 4.19Å; L566-L575 HydrophobicContact CB-CB 4.21Å; L566-L575 HydrophobicContact CD1-CB 4.24Å; L566-L575 HydrophobicContact CD1-CD1 4.35Å; L566-L578 HydrophobicContact CD1-CD2 4.06Å
567	E	87.9	Confident	87.1	Confident	94 Å²	94	39.6 Å²	39.6	44%	0.439	20%	0.199	S	C	.	.	H	α-helix	trans	-60.7	-49.6	173	-69.7	178.2	170.8	0	0	111.6	A563 H569 K570 Y572 L575	A563-E567 WeakPolarHBondContact O-CG 3.48Å; A563-E567 PolarHBondContact O-N 3.48Å; E567-H569 PolarHBondContact O-N 3.48Å; E567-K570 PolarHBondContact O-N 3.4Å; E567-Y572 HydrophobicContact CG-CE1 4.43Å; E567-L575 HydrophobicContact CG-CD2 3.57Å
568	K	89.1	Confident	87.1	Confident	128 Å²	128	39.2 Å²	39.2	56%	0.557	20%	0.196	S	C	*	.	H	α-helix	trans	-55	-36.5	175.6	172.9	-173.2	167.4	-115.9	0	112.6	A564 W565	A564-K568 VanDerWaalsContact O-CB 3.27Å; A564-K568 WeakPolarHBondContact O-CB 3.49Å; A564-K568 PolarHBondContact O-N 3.43Å; W565-K568 HydrophobicContact CE3-CD 4.23Å; W565-K568 HydrophobicContact CZ3-CD 4.45Å; W565-K568 VanDerWaalsContact CZ3-NZ 3.31Å; W565-K568 PolarHBondContact O-N 2.98Å
569	H	86.9	Confident	87.3	Confident	51 Å²	51	39.6 Å²	39.6	24%	0.236	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	7.5	178.1	-74.7	-97.2	0	0	0	114	A540 W565 L566 E567 K571	A540-H569 PolarHBondContact O-ND1 2.63Å; W565-H569 AromaticContact CD1-CD2 3.93Å; W565-H569 AromaticContact CE2-CD2 3.93Å; W565-H569 AromaticContact CE2-NE2 3.72Å; W565-H569 AromaticContact CZ2-NE2 3.84Å; W565-H569 AromaticContact NE1-CD2 3.7Å; W565-H569 AromaticContact NE1-NE2 3.8Å; W565-H569 PolarHBondContact O-CD2 3.47Å; W565-H569 VanDerWaalsContact O-CD2 3.31Å; W565-H569 PolarHBondContact O-N 2.87Å; L566-H569 CarbonylContact O-C 3.55Å; L566-H569 PolarHBondContact O-N 3.05Å; E567-H569 PolarHBondContact O-N 3.48Å; H569-K571 VanDerWaalsContact C-N 3.33Å; H569-K571 HydrophobicContact CB-CG 4.3Å; H569-K571 PolarHBondContact O-N 2.74Å
570	K	86.4	Confident	87.3	Confident	141 Å²	141	41.3 Å²	41.3	61%	0.613	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	37.3	179	-55.3	-176.9	-179	-177.4	0	114.7	L566 E567 Y572	L566-K570 PolarHBondContact O-N 3.38Å; E567-K570 PolarHBondContact O-N 3.4Å; K570-Y572 HydrophobicContact CB-CD2 4.38Å; K570-Y572 HydrophobicContact CB-CE2 3.76Å; K570-Y572 HydrophobicContact CG-CE2 4.21Å
571	K	86.1	Confident	87.2	Confident	37 Å²	37	40.7 Å²	40.7	16%	0.161	19%	0.19	C	C	.	.			trans	-101.8	64.5	179.1	-57.8	-55.5	-179.7	179.1	0	110.8	D543 L547 L566 H569 A574 L575 T604	D543-K571 WeakPolarHBondContact OD1-CE 3.47Å; D543-K571 IonicContact OD1-NZ 3.64Å; D543-K571 PolarHBondContact OD1-NZ 2.94Å; L547-K571 HydrophobicContact CD2-CG 4.33Å; L566-K571 HydrophobicContact CB-CB 4.4Å; L566-K571 HydrophobicContact CD2-CB 3.75Å; L566-K571 HydrophobicContact CD2-CG 4.42Å; L566-K571 PolarHBondContact O-N 3.02Å; H569-K571 VanDerWaalsContact C-N 3.33Å; H569-K571 HydrophobicContact CB-CG 4.3Å; H569-K571 PolarHBondContact O-N 2.74Å; K571-A574 HydrophobicContact CB-CB 4.21Å; K571-A574 PolarHBondContact O-N 3.35Å; K571-L575 WeakPolarHBondContact O-CB 3.18Å; K571-L575 PolarHBondContact O-N 3.18Å; K571-T604 HydrophobicContact CD-CG2 4.33Å
572	Y	85.7	Confident	87.2	Confident	56 Å²	56	41.9 Å²	41.9	22%	0.22	20%	0.196	C	C	.	.	H	α-helix	trans	-73.1	-31.9	-172.7	-58.3	-76.8	0	0	0	113.4	E567 K570 L575 G576 L591 V600 D602	E567-Y572 HydrophobicContact CG-CE1 4.43Å; K570-Y572 HydrophobicContact CB-CD2 4.38Å; K570-Y572 HydrophobicContact CB-CE2 3.76Å; K570-Y572 HydrophobicContact CG-CE2 4.21Å; Y572-L575 WeakPolarHBondContact O-CB 3.49Å; Y572-L575 PolarHBondContact O-N 3.2Å; Y572-G576 PolarHBondContact O-N 3.32Å; Y572-L591 HydrophobicContact CD1-CD1 4.28Å; Y572-L591 VanDerWaalsContact O-CD2 3.26Å; Y572-L591 WeakPolarHBondContact O-CD2 3.33Å; Y572-V600 HydrophobicContact CD1-CG1 3.99Å; Y572-V600 HydrophobicContact CD2-CG1 3.28Å; Y572-V600 HydrophobicContact CE1-CG1 4.24Å; Y572-V600 HydrophobicContact CE2-CG1 3.57Å; Y572-V600 HydrophobicContact CG-CG1 3.49Å; Y572-V600 VanDerWaalsContact CG-CG1 3.49Å; Y572-D602 WeakPolarHBondContact CA-OD2 3.3Å; Y572-D602 HydrophobicContact CD2-CB 4.37Å; Y572-D602 PolarHBondContact N-OD2 3Å
573	F	85.7	Confident	87	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.018	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-47.4	172.6	176.5	-114.9	0	0	0	111.4	L548 L575 G576 L577 W592 D602 T604 L608 Y611	L548-F573 HydrophobicContact CD1-CE1 4.27Å; L548-F573 HydrophobicContact CD2-CD1 3.92Å; L548-F573 HydrophobicContact CD2-CE1 4Å; F573-L575 VanDerWaalsContact C-N 3.31Å; F573-L575 PolarHBondContact O-N 3.35Å; F573-G576 PolarHBondContact O-N 2.88Å; F573-G576 VanDerWaalsContact O-N 3.13Å; F573-L577 HydrophobicContact CD1-CD1 4.4Å; F573-L577 HydrophobicContact CE1-CD1 3.86Å; F573-L577 HydrophobicContact CE1-CG 4.43Å; F573-L577 HydrophobicContact CZ-CD1 4.13Å; F573-L577 HydrophobicContact CZ-CD2 4.32Å; F573-L577 HydrophobicContact CZ-CG 4.29Å; F573-L577 PolarHBondContact O-N 2.82Å; F573-L577 VanDerWaalsContact O-N 3.11Å; F573-W592 AromaticContact CD2-CD1 3.72Å; F573-W592 AromaticContact CD2-NE1 3.43Å; F573-W592 AromaticContact CE2-NE1 3.79Å; F573-W592 PolarHBondContact O-NE1 3.4Å; F573-D602 PolarHBondContact N-OD2 3.26Å; F573-T604 VanDerWaalsContact CB-OG1 3.26Å; F573-T604 WeakPolarHBondContact CB-OG1 3.42Å; F573-L608 HydrophobicContact CD2-CD1 3.5Å; F573-L608 VanDerWaalsContact CD2-CD1 3.5Å; F573-L608 HydrophobicContact CE2-CD1 3.55Å; F573-Y611 AromaticContact CE2-CD1 3.77Å; F573-Y611 HydrophobicContact CE2-CD1 3.77Å; F573-Y611 AromaticContact CE2-CE1 3.77Å; F573-Y611 HydrophobicContact CE2-CE1 3.77Å; F573-Y611 HydrophobicContact CZ-CD1 4.21Å; F573-Y611 HydrophobicContact CZ-CE1 4.08Å
574	A	86.1	Confident	86.9	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.008	25%	0.249	C	C	.	.	H	α-helix	trans	-62.6	-36.5	175.3	0	0	0	0	0	112.2	L547 L548 L551 L566 K571 G576 L577 L578	L547-A574 HydrophobicContact CD2-CB 4.11Å; L547-A574 HydrophobicContact CG-CB 4.36Å; L548-A574 HydrophobicContact CD2-CB 4.22Å; L551-A574 HydrophobicContact CD1-CB 3.71Å; L551-A574 WeakPolarHBondContact CD1-O 3.07Å; L566-A574 HydrophobicContact CD2-CB 4.19Å; K571-A574 HydrophobicContact CB-CB 4.21Å; K571-A574 PolarHBondContact O-N 3.35Å; A574-G576 VanDerWaalsContact C-N 3.34Å; A574-L577 WeakPolarHBondContact O-CB 3.37Å; A574-L577 PolarHBondContact O-N 2.83Å; A574-L578 PolarHBondContact O-N 3.06Å
575	L	87.8	Confident	86.7	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-62	-40.1	172	179	56.2	0	0	0	112.4	A563 L566 E567 K571 Y572 F573 L578 Y579 L591	A563-L575 HydrophobicContact CB-CD1 3.68Å; L566-L575 HydrophobicContact CB-CB 4.21Å; L566-L575 HydrophobicContact CD1-CB 4.24Å; L566-L575 HydrophobicContact CD1-CD1 4.35Å; E567-L575 HydrophobicContact CG-CD2 3.57Å; K571-L575 WeakPolarHBondContact O-CB 3.18Å; K571-L575 PolarHBondContact O-N 3.18Å; Y572-L575 WeakPolarHBondContact O-CB 3.49Å; Y572-L575 PolarHBondContact O-N 3.2Å; F573-L575 VanDerWaalsContact C-N 3.31Å; F573-L575 PolarHBondContact O-N 3.35Å; L575-L578 HydrophobicContact CD1-CD2 4.5Å; L575-L578 PolarHBondContact O-N 2.84Å; L575-Y579 HydrophobicContact CD1-CD2 4.09Å; L575-Y579 HydrophobicContact CD1-CE2 3.59Å; L575-Y579 HydrophobicContact CD2-CE2 4.04Å; L575-Y579 HydrophobicContact CG-CD2 3.96Å; L575-Y579 HydrophobicContact CG-CE2 3.5Å; L575-Y579 VanDerWaalsContact O-CD2 3.29Å; L575-Y579 WeakPolarHBondContact O-CD2 3.39Å; L575-Y579 PolarHBondContact O-N 3.49Å; L575-L591 HydrophobicContact CB-CD2 3.95Å; L575-L591 HydrophobicContact CD2-CD2 3.84Å; L575-L591 HydrophobicContact CG-CD2 3.75Å
576	G	86.2	Confident	86.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62.6	-39.7	172.7	0	0	0	0	0	113	Y572 F573 A574 L578 Y579 H580 A588 W592	Y572-G576 PolarHBondContact O-N 3.32Å; F573-G576 PolarHBondContact O-N 2.88Å; F573-G576 VanDerWaalsContact O-N 3.13Å; A574-G576 VanDerWaalsContact C-N 3.34Å; G576-L578 VanDerWaalsContact C-N 3.34Å; G576-L578 PolarHBondContact O-N 3.46Å; G576-Y579 PolarHBondContact O-N 3.39Å; G576-H580 PolarHBondContact O-N 3.27Å; G576-A588 WeakPolarHBondContact O-CB 3.41Å; G576-W592 VanDerWaalsContact C-CZ2 3.48Å
577	L	86.9	Confident	86.4	Confident	7 Å²	7	54.6 Å²	54.6	4%	0.037	27%	0.269	C	S	.	.	H	α-helix	trans	-61.8	-40.6	173.3	-66.1	173.3	0	0	0	112	L548 L551 V552 F573 A574 H580 Y581 W592 Y611	L548-L577 HydrophobicContact CD2-CD1 3.93Å; L551-L577 HydrophobicContact CB-CB 4.1Å; L551-L577 HydrophobicContact CB-CD1 4.38Å; L551-L577 HydrophobicContact CD1-CB 4.45Å; V552-L577 HydrophobicContact CG2-CD1 4.43Å; F573-L577 HydrophobicContact CD1-CD1 4.4Å; F573-L577 HydrophobicContact CE1-CD1 3.86Å; F573-L577 HydrophobicContact CE1-CG 4.43Å; F573-L577 HydrophobicContact CZ-CD1 4.13Å; F573-L577 HydrophobicContact CZ-CD2 4.32Å; F573-L577 HydrophobicContact CZ-CG 4.29Å; F573-L577 PolarHBondContact O-N 2.82Å; F573-L577 VanDerWaalsContact O-N 3.11Å; A574-L577 WeakPolarHBondContact O-CB 3.37Å; A574-L577 PolarHBondContact O-N 2.83Å; L577-H580 PolarHBondContact O-N 2.91Å; L577-Y581 PolarHBondContact O-N 3.01Å; L577-W592 HydrophobicContact CD2-CZ2 4.04Å; L577-W592 HydrophobicContact CG-CZ2 4.4Å; L577-Y611 HydrophobicContact CD2-CE1 4.5Å; L577-Y611 VanDerWaalsContact CD2-OH 3.29Å; L577-Y611 WeakPolarHBondContact CD2-OH 3.45Å
578	L	87.4	Confident	86.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.5	-38.7	175.6	-177.9	67	0	0	0	112.3	L551 C557 L559 L566 A574 L575 G576 N582	L551-L578 HydrophobicContact CD2-CB 4.02Å; L551-L578 HydrophobicContact CD2-CD1 3.98Å; C557-L578 HydrophobicContact CB-CD1 3.91Å; L559-L578 HydrophobicContact CD1-CD2 3.84Å; L559-L578 HydrophobicContact CD1-CG 3.88Å; L566-L578 HydrophobicContact CD1-CD2 4.06Å; A574-L578 PolarHBondContact O-N 3.06Å; L575-L578 HydrophobicContact CD1-CD2 4.5Å; L575-L578 PolarHBondContact O-N 2.84Å; G576-L578 VanDerWaalsContact C-N 3.34Å; G576-L578 PolarHBondContact O-N 3.46Å; L578-N582 PolarHBondContact O-N 3.09Å
579	Y	88.6	Confident	86.3	Confident	43 Å²	43	44 Å²	44	17%	0.169	22%	0.221	C	C	.	.	H	α-helix	trans	-64.9	-43.5	173	-75.6	-50.6	0	0	0	111.8	L559 L575 G576 N582 N583 Q584 A587 L591	L559-Y579 HydrophobicContact CD1-CD1 4.04Å; L559-Y579 HydrophobicContact CD1-CE1 3.96Å; L575-Y579 HydrophobicContact CD1-CD2 4.09Å; L575-Y579 HydrophobicContact CD1-CE2 3.59Å; L575-Y579 HydrophobicContact CD2-CE2 4.04Å; L575-Y579 HydrophobicContact CG-CD2 3.96Å; L575-Y579 HydrophobicContact CG-CE2 3.5Å; L575-Y579 VanDerWaalsContact O-CD2 3.29Å; L575-Y579 WeakPolarHBondContact O-CD2 3.39Å; L575-Y579 PolarHBondContact O-N 3.49Å; G576-Y579 PolarHBondContact O-N 3.39Å; Y579-N582 CarbonylContact O-C 3.58Å; Y579-N582 PolarHBondContact O-N 3.03Å; Y579-N583 PolarHBondContact O-N 3.41Å; Y579-Q584 HydrophobicContact CD1-CB 4.29Å; Y579-Q584 WeakPolarHBondContact O-CA 3.31Å; Y579-Q584 WeakPolarHBondContact O-CB 3.43Å; Y579-Q584 PolarHBondContact O-N 3.12Å; Y579-A587 HydrophobicContact CD2-CB 4.44Å; Y579-A587 HydrophobicContact CG-CB 4.33Å; Y579-L591 HydrophobicContact CD2-CD2 4.43Å; Y579-L591 HydrophobicContact CE2-CD2 4.36Å
580	H	86.3	Confident	86.3	Confident	75 Å²	75	45.6 Å²	45.6	35%	0.347	23%	0.229	S	C	.	.	H	α-helix	trans	-59.2	-50.5	175.6	169.4	46.3	0	0	0	112.1	G576 L577 N582 N583 D585 A588 W592 F615	G576-H580 PolarHBondContact O-N 3.27Å; L577-H580 PolarHBondContact O-N 2.91Å; H580-N582 PolarHBondContact O-N 3.32Å; H580-N582 VanDerWaalsContact O-N 3.13Å; H580-N583 WeakPolarHBondContact O-CA 3.47Å; H580-N583 PolarHBondContact O-N 2.77Å; H580-D585 WeakPolarHBondContact CA-OD1 3.29Å; H580-D585 IonicContact CE1-OD1 2.72Å; H580-D585 IonicContact CG-OD1 2.75Å; H580-D585 IonicContact ND1-OD1 3.18Å; H580-D585 PolarHBondContact ND1-OD1 2.85Å; H580-D585 IonicContact ND1-OD2 2.76Å; H580-A588 HydrophobicContact CB-CB 4.21Å; H580-W592 HydrophobicContact CB-CH2 4.34Å; H580-F615 HydrophobicContact CB-CE2 4.4Å; H580-F615 AromaticContact CD2-CE2 3.85Å; H580-F615 AromaticContact CE1-CE2 3.64Å; H580-F615 AromaticContact CG-CE2 3.66Å; H580-F615 AromaticContact ND1-CE2 3.53Å; H580-F615 AromaticContact ND1-CZ 3.65Å; H580-F615 AromaticContact NE2-CE2 3.83Å
581	Y	85	Confident	86.3	Confident	82 Å²	82	40.1 Å²	40.1	32%	0.322	21%	0.206	S	C	.	.	H	α-helix	trans	-57.3	-32.2	178.7	-170	-90.8	0	0	0	112.6	E554 N555 L577 N583	E554-Y581 WeakPolarHBondContact CA-OH 3.13Å; N555-Y581 PolarHBondContact N-OH 3.33Å; N555-Y581 WeakPolarHBondContact ND2-CD2 3.45Å; N555-Y581 WeakPolarHBondContact O-CE1 3.37Å; N555-Y581 PolarHBondContact O-OH 2.73Å; L577-Y581 PolarHBondContact O-N 3.01Å; Y581-N583 VanDerWaalsContact C-N 3.29Å; Y581-N583 PolarHBondContact O-N 2.89Å
582	N	85.2	Confident	86.4	Confident	51 Å²	51	38.4 Å²	38.4	27%	0.273	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	17.5	176.6	-69.7	-16.6	0	0	0	114.2	L578 Y579 H580 Q584	L578-N582 PolarHBondContact O-N 3.09Å; Y579-N582 CarbonylContact O-C 3.58Å; Y579-N582 PolarHBondContact O-N 3.03Å; H580-N582 PolarHBondContact O-N 3.32Å; H580-N582 VanDerWaalsContact O-N 3.13Å; N582-Q584 VanDerWaalsContact C-N 3.33Å; N582-Q584 PolarHBondContact O-N 3.21Å
583	N	84.1	Confident	86.4	Confident	147 Å²	147	36 Å²	36	79%	0.786	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.8	32.9	178.2	-49.7	-97.3	0	0	0	114	Y579 H580 Y581	Y579-N583 PolarHBondContact O-N 3.41Å; H580-N583 WeakPolarHBondContact O-CA 3.47Å; H580-N583 PolarHBondContact O-N 2.77Å; Y581-N583 VanDerWaalsContact C-N 3.29Å; Y581-N583 PolarHBondContact O-N 2.89Å
584	Q	86.9	Confident	86.4	Confident	87 Å²	87	37.9 Å²	37.9	41%	0.407	20%	0.2	S	C	.	.			trans	-110.4	46.1	177.1	-59.7	-173.4	5.5	0	0	111.3	Y579 N582 A586 A587 A588	Y579-Q584 HydrophobicContact CD1-CB 4.29Å; Y579-Q584 WeakPolarHBondContact O-CA 3.31Å; Y579-Q584 WeakPolarHBondContact O-CB 3.43Å; Y579-Q584 PolarHBondContact O-N 3.12Å; N582-Q584 VanDerWaalsContact C-N 3.33Å; N582-Q584 PolarHBondContact O-N 3.21Å; Q584-A586 VanDerWaalsContact C-N 3.25Å; Q584-A586 PolarHBondContact O-N 2.81Å; Q584-A586 VanDerWaalsContact O-N 3.16Å; Q584-A587 HydrophobicContact CB-CB 4.39Å; Q584-A587 WeakPolarHBondContact O-CA 3.44Å; Q584-A587 WeakPolarHBondContact O-CB 3.39Å; Q584-A587 PolarHBondContact O-N 3.33Å; Q584-A588 PolarHBondContact O-N 3.27Å; Q584-A588 VanDerWaalsContact O-N 3.08Å
585	D	85.2	Confident	86.3	Confident	40 Å²	40	38.9 Å²	38.9	21%	0.214	21%	0.205	C	C	.	.	H	α-helix	trans	-54.1	-37.3	-173.1	-67.4	-8.8	0	0	0	113.5	H580 A587 A588 V589 F615 L624	H580-D585 WeakPolarHBondContact CA-OD1 3.29Å; H580-D585 IonicContact CE1-OD1 2.72Å; H580-D585 IonicContact CG-OD1 2.75Å; H580-D585 IonicContact ND1-OD1 3.18Å; H580-D585 PolarHBondContact ND1-OD1 2.85Å; H580-D585 IonicContact ND1-OD2 2.76Å; D585-A587 VanDerWaalsContact C-N 3.3Å; D585-A587 PolarHBondContact O-N 3.44Å; D585-A588 PolarHBondContact O-N 2.86Å; D585-V589 WeakPolarHBondContact O-CG2 3Å; D585-V589 PolarHBondContact O-N 2.73Å; D585-F615 HydrophobicContact CB-CZ 4.26Å; D585-L624 HydrophobicContact CB-CD2 3.73Å
586	A	85.4	Confident	86	Confident	59 Å²	59	40.7 Å²	40.7	49%	0.488	22%	0.216	S	C	.	.	H	α-helix	trans	-60.9	-36.6	175.8	0	0	0	0	0	113.1	Q584 Q590 L624	Q584-A586 VanDerWaalsContact C-N 3.25Å; Q584-A586 PolarHBondContact O-N 2.81Å; Q584-A586 VanDerWaalsContact O-N 3.16Å; A586-Q590 VanDerWaalsContact O-CB 3.29Å; A586-Q590 WeakPolarHBondContact O-CB 3.22Å; A586-Q590 PolarHBondContact O-N 2.79Å; A586-Q590 VanDerWaalsContact O-N 3.14Å; A586-L624 HydrophobicContact CB-CD1 4.02Å
587	A	86	Confident	85.8	Confident	41 Å²	41	44 Å²	44	34%	0.339	23%	0.234	S	C	.	.	H	α-helix	trans	-76	-38	175.3	0	0	0	0	0	111.6	Y579 Q584 D585 L591	Y579-A587 HydrophobicContact CD2-CB 4.44Å; Y579-A587 HydrophobicContact CG-CB 4.33Å; Q584-A587 HydrophobicContact CB-CB 4.39Å; Q584-A587 WeakPolarHBondContact O-CA 3.44Å; Q584-A587 WeakPolarHBondContact O-CB 3.39Å; Q584-A587 PolarHBondContact O-N 3.33Å; D585-A587 VanDerWaalsContact C-N 3.3Å; D585-A587 PolarHBondContact O-N 3.44Å; A587-L591 WeakPolarHBondContact O-CB 3.47Å; A587-L591 PolarHBondContact O-N 2.71Å
588	A	88.1	Confident	85.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.5	-52.3	174.8	0	0	0	0	0	111.8	G576 H580 Q584 D585 L591 W592	G576-A588 WeakPolarHBondContact O-CB 3.41Å; H580-A588 HydrophobicContact CB-CB 4.21Å; Q584-A588 PolarHBondContact O-N 3.27Å; Q584-A588 VanDerWaalsContact O-N 3.08Å; D585-A588 PolarHBondContact O-N 2.86Å; A588-L591 PolarHBondContact O-N 3.21Å; A588-W592 HydrophobicContact CB-CH2 4.02Å; A588-W592 HydrophobicContact CB-CZ2 4.23Å; A588-W592 HydrophobicContact CB-CZ3 4.17Å; A588-W592 VanDerWaalsContact O-CG 3.31Å; A588-W592 PolarHBondContact O-N 3.07Å
589	V	86.4	Confident	84.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-42.9	179.5	177.9	0	0	0	0	111.1	D585 L591 W592 V593 F615 L616 L624 Y628	D585-V589 WeakPolarHBondContact O-CG2 3Å; D585-V589 PolarHBondContact O-N 2.73Å; V589-L591 VanDerWaalsContact C-N 3.3Å; V589-L591 PolarHBondContact O-N 3.38Å; V589-W592 HydrophobicContact CG2-CE3 4.22Å; V589-W592 HydrophobicContact CG2-CZ3 4.23Å; V589-W592 PolarHBondContact O-N 3.43Å; V589-V593 HydrophobicContact CG1-CG2 4.14Å; V589-V593 WeakPolarHBondContact O-CB 3.2Å; V589-V593 VanDerWaalsContact O-CG2 3.25Å; V589-V593 WeakPolarHBondContact O-CG2 3.46Å; V589-V593 PolarHBondContact O-N 2.95Å; V589-F615 HydrophobicContact CG2-CD1 3.82Å; V589-F615 HydrophobicContact CG2-CE1 3.54Å; V589-L616 HydrophobicContact CG2-CD2 4.46Å; V589-L624 HydrophobicContact CG2-CD2 4.28Å; V589-Y628 HydrophobicContact CB-CD2 4.46Å; V589-Y628 HydrophobicContact CB-CE2 4.13Å; V589-Y628 HydrophobicContact CG1-CD1 4.04Å; V589-Y628 HydrophobicContact CG1-CD2 3.59Å; V589-Y628 HydrophobicContact CG1-CE1 4.04Å; V589-Y628 HydrophobicContact CG1-CE2 3.59Å; V589-Y628 HydrophobicContact CG1-CG 3.81Å
590	Q	87.8	Confident	84.2	Confident	85 Å²	85	51.2 Å²	51.2	40%	0.397	29%	0.289	S	S	.	.	H	α-helix	trans	-59.2	-41.8	175.6	-175.5	64.3	78.4	0	0	111.6	A586 V593 N594 Y628	A586-Q590 VanDerWaalsContact O-CB 3.29Å; A586-Q590 WeakPolarHBondContact O-CB 3.22Å; A586-Q590 PolarHBondContact O-N 2.79Å; A586-Q590 VanDerWaalsContact O-N 3.14Å; Q590-V593 PolarHBondContact O-N 3.25Å; Q590-N594 PolarHBondContact NE2-OD1 2.98Å; Q590-N594 PolarHBondContact O-N 3.4Å; Q590-N594 PolarHBondContact O-OD1 3.23Å; Q590-N594 VanDerWaalsContact O-OD1 3.06Å; Q590-Y628 WeakPolarHBondContact CA-OH 2.96Å; Q590-Y628 WeakPolarHBondContact CB-OH 3.32Å; Q590-Y628 PolarHBondContact OE1-OH 2.84Å
591	L	86.5	Confident	83.6	Confident	26 Å²	26	56 Å²	56	14%	0.136	31%	0.312	C	S	.	.	H	α-helix	trans	-66.6	-43.6	178.3	-175.7	59.8	0	0	0	111.9	Y572 L575 Y579 A587 A588 V589 N594 I595	Y572-L591 HydrophobicContact CD1-CD1 4.28Å; Y572-L591 VanDerWaalsContact O-CD2 3.26Å; Y572-L591 WeakPolarHBondContact O-CD2 3.33Å; L575-L591 HydrophobicContact CB-CD2 3.95Å; L575-L591 HydrophobicContact CD2-CD2 3.84Å; L575-L591 HydrophobicContact CG-CD2 3.75Å; Y579-L591 HydrophobicContact CD2-CD2 4.43Å; Y579-L591 HydrophobicContact CE2-CD2 4.36Å; A587-L591 WeakPolarHBondContact O-CB 3.47Å; A587-L591 PolarHBondContact O-N 2.71Å; A588-L591 PolarHBondContact O-N 3.21Å; V589-L591 VanDerWaalsContact C-N 3.3Å; V589-L591 PolarHBondContact O-N 3.38Å; L591-N594 PolarHBondContact O-N 3.48Å; L591-I595 WeakPolarHBondContact O-CG1 3.36Å; L591-I595 PolarHBondContact O-N 3.48Å; L591-I595 VanDerWaalsContact O-N 3.14Å
592	W	87.8	Confident	83.1	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65.5	-37.6	175.3	-61.1	-33.9	0	0	0	112.7	F573 G576 L577 H580 A588 V589 I595 V596 L608 Y611 I612 F615	F573-W592 AromaticContact CD2-CD1 3.72Å; F573-W592 AromaticContact CD2-NE1 3.43Å; F573-W592 AromaticContact CE2-NE1 3.79Å; F573-W592 PolarHBondContact O-NE1 3.4Å; G576-W592 VanDerWaalsContact C-CZ2 3.48Å; L577-W592 HydrophobicContact CD2-CZ2 4.04Å; L577-W592 HydrophobicContact CG-CZ2 4.4Å; H580-W592 HydrophobicContact CB-CH2 4.34Å; A588-W592 HydrophobicContact CB-CH2 4.02Å; A588-W592 HydrophobicContact CB-CZ2 4.23Å; A588-W592 HydrophobicContact CB-CZ3 4.17Å; A588-W592 VanDerWaalsContact O-CG 3.31Å; A588-W592 PolarHBondContact O-N 3.07Å; V589-W592 HydrophobicContact CG2-CE3 4.22Å; V589-W592 HydrophobicContact CG2-CZ3 4.23Å; V589-W592 PolarHBondContact O-N 3.43Å; W592-I595 PolarHBondContact O-N 3.17Å; W592-V596 WeakPolarHBondContact O-CG2 3.45Å; W592-V596 PolarHBondContact O-N 3.43Å; W592-L608 HydrophobicContact CB-CD1 4.25Å; W592-L608 HydrophobicContact CG-CD1 4.18Å; W592-Y611 HydrophobicContact CE3-CE1 4.42Å; W592-Y611 AromaticContact CH2-CE1 3.83Å; W592-Y611 HydrophobicContact CH2-CE1 3.83Å; W592-Y611 AromaticContact CZ2-CE1 3.91Å; W592-Y611 HydrophobicContact CZ2-CE1 3.91Å; W592-Y611 HydrophobicContact CZ3-CE1 4.1Å; W592-I612 HydrophobicContact CB-CD1 3.73Å; W592-I612 HydrophobicContact CB-CG1 3.83Å; W592-I612 HydrophobicContact CE3-CG1 4.39Å; W592-F615 AromaticContact CH2-CD2 3.99Å; W592-F615 HydrophobicContact CH2-CD2 3.99Å; W592-F615 AromaticContact CH2-CE2 3.95Å; W592-F615 HydrophobicContact CH2-CE2 3.95Å; W592-F615 HydrophobicContact CH2-CG 4.44Å; W592-F615 HydrophobicContact CH2-CZ 4.37Å; W592-F615 AromaticContact CZ3-CD1 3.94Å; W592-F615 HydrophobicContact CZ3-CD1 3.94Å; W592-F615 AromaticContact CZ3-CD2 3.82Å; W592-F615 HydrophobicContact CZ3-CD2 3.82Å; W592-F615 HydrophobicContact CZ3-CE1 4.08Å; W592-F615 AromaticContact CZ3-CE2 3.96Å; W592-F615 HydrophobicContact CZ3-CE2 3.96Å; W592-F615 AromaticContact CZ3-CG 3.82Å; W592-F615 HydrophobicContact CZ3-CG 3.82Å; W592-F615 HydrophobicContact CZ3-CZ 4.09Å
593	V	85.2	Confident	82.2	Confident	5 Å²	5	56.9 Å²	56.9	3%	0.03	33%	0.331	C	S	.	.	H	α-helix	trans	-63	-41.9	173.8	165.5	0	0	0	0	111.3	V589 Q590 I595 V596 N597 Y628 W631	V589-V593 HydrophobicContact CG1-CG2 4.14Å; V589-V593 WeakPolarHBondContact O-CB 3.2Å; V589-V593 VanDerWaalsContact O-CG2 3.25Å; V589-V593 WeakPolarHBondContact O-CG2 3.46Å; V589-V593 PolarHBondContact O-N 2.95Å; Q590-V593 PolarHBondContact O-N 3.25Å; V593-I595 VanDerWaalsContact C-N 3.29Å; V593-I595 PolarHBondContact O-N 3.14Å; V593-V596 PolarHBondContact O-N 3.19Å; V593-N597 WeakPolarHBondContact CG1-ND2 3.4Å; V593-N597 WeakPolarHBondContact O-CB 3.37Å; V593-N597 VanDerWaalsContact O-CG 3.28Å; V593-N597 PolarHBondContact O-N 2.63Å; V593-N597 PolarHBondContact O-ND2 3.07Å; V593-Y628 HydrophobicContact CB-CE1 4.4Å; V593-Y628 HydrophobicContact CG1-CE1 4.47Å; V593-Y628 HydrophobicContact CG2-CD1 3.92Å; V593-Y628 HydrophobicContact CG2-CE1 3.83Å; V593-W631 HydrophobicContact CB-CZ2 4.3Å; V593-W631 HydrophobicContact CG1-CD2 4.35Å; V593-W631 HydrophobicContact CG1-CZ2 3.99Å; V593-W631 HydrophobicContact CG2-CD2 4.24Å; V593-W631 HydrophobicContact CG2-CE3 4.08Å; V593-W631 HydrophobicContact CG2-CH2 3.86Å; V593-W631 HydrophobicContact CG2-CZ2 3.99Å; V593-W631 HydrophobicContact CG2-CZ3 3.9Å
594	N	85.1	Confident	81.6	Confident	45 Å²	45	52.5 Å²	52.5	24%	0.241	31%	0.31	C	S	.	.	H	α-helix	trans	-62.2	-35.7	175	-66.4	-2.9	0	0	0	112	Q590 L591 G598 D599 V600	Q590-N594 PolarHBondContact NE2-OD1 2.98Å; Q590-N594 PolarHBondContact O-N 3.4Å; Q590-N594 PolarHBondContact O-OD1 3.23Å; Q590-N594 VanDerWaalsContact O-OD1 3.06Å; L591-N594 PolarHBondContact O-N 3.48Å; N594-G598 PolarHBondContact O-N 3.34Å; N594-D599 HydrophobicContact CB-CB 4.24Å; N594-D599 WeakPolarHBondContact O-CB 3.41Å; N594-D599 PolarHBondContact O-N 3.02Å; N594-V600 HydrophobicContact CB-CG2 4.07Å; N594-V600 PolarHBondContact O-N 3.09Å
595	I	84.5	Confident	80.8	Confident	22 Å²	22	52.9 Å²	52.9	11%	0.113	31%	0.308	C	S	.	.	H	α-helix	trans	-67	-47.4	173.4	-60.8	162.3	0	0	0	110.5	L591 W592 V593 N597 G598 V600 D602 L608	L591-I595 WeakPolarHBondContact O-CG1 3.36Å; L591-I595 PolarHBondContact O-N 3.48Å; L591-I595 VanDerWaalsContact O-N 3.14Å; W592-I595 PolarHBondContact O-N 3.17Å; V593-I595 VanDerWaalsContact C-N 3.29Å; V593-I595 PolarHBondContact O-N 3.14Å; I595-N597 VanDerWaalsContact C-N 3.29Å; I595-N597 PolarHBondContact O-N 2.58Å; I595-G598 PolarHBondContact O-N 3.05Å; I595-V600 WeakPolarHBondContact CA-O 3.32Å; I595-V600 HydrophobicContact CG1-CB 4Å; I595-V600 HydrophobicContact CG1-CG1 4.05Å; I595-D602 HydrophobicContact CD1-CB 4.14Å; I595-D602 HydrophobicContact CG1-CB 4.38Å; I595-D602 HydrophobicContact CG2-CB 4.16Å; I595-L608 HydrophobicContact CB-CD2 3.77Å; I595-L608 HydrophobicContact CD1-CD2 4.2Å; I595-L608 HydrophobicContact CG2-CD2 3.54Å
596	V	81.6	Confident	80.1	Confident	40 Å²	40	57 Å²	57	24%	0.242	34%	0.34	C	S	.	.	H	α-helix	trans	-69.9	-22.9	-178.8	174.4	0	0	0	0	113.5	W592 V593 L608 Y609 I612 W631	W592-V596 WeakPolarHBondContact O-CG2 3.45Å; W592-V596 PolarHBondContact O-N 3.43Å; V593-V596 PolarHBondContact O-N 3.19Å; V596-L608 HydrophobicContact CG2-CB 4.1Å; V596-L608 HydrophobicContact CG2-CD2 3.8Å; V596-L608 HydrophobicContact CG2-CG 3.73Å; V596-Y609 HydrophobicContact CG1-CD2 4.15Å; V596-I612 HydrophobicContact CG2-CD1 3.75Å; V596-W631 HydrophobicContact CB-CH2 4.12Å; V596-W631 HydrophobicContact CB-CZ2 4.04Å; V596-W631 HydrophobicContact CG1-CH2 3.84Å; V596-W631 HydrophobicContact CG1-CZ2 3.75Å
597	N	81.1	Confident	79.8	Confident	69 Å²	69	57.1 Å²	57.1	37%	0.369	33%	0.332	S	S	.	.	H	α-helix	trans	-81.4	-17.6	170.6	-71	-22.7	0	0	0	113	V593 I595 D599 W631 K635	V593-N597 WeakPolarHBondContact CG1-ND2 3.4Å; V593-N597 WeakPolarHBondContact O-CB 3.37Å; V593-N597 VanDerWaalsContact O-CG 3.28Å; V593-N597 PolarHBondContact O-N 2.63Å; V593-N597 PolarHBondContact O-ND2 3.07Å; I595-N597 VanDerWaalsContact C-N 3.29Å; I595-N597 PolarHBondContact O-N 2.58Å; N597-D599 WeakPolarHBondContact CB-OD2 3.36Å; N597-W631 PolarHBondContact OD1-NE1 3.06Å; N597-W631 VanDerWaalsContact OD1-NE1 3.1Å; N597-K635 WeakPolarHBondContact OD1-CE 3.37Å; N597-K635 PolarHBondContact OD1-NZ 3.1Å
598	G	76.1	Confident	79.6	Confident	54 Å²	54	55.5 Å²	55.5	56%	0.557	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.4	5.4	-179.2	0	0	0	0	0	114.7	N594 I595 V600	N594-G598 PolarHBondContact O-N 3.34Å; I595-G598 PolarHBondContact O-N 3.05Å; G598-V600 PolarHBondContact O-N 3.13Å
599	D	76.1	Confident	79.3	Confident	118 Å²	118	57.6 Å²	57.6	63%	0.631	33%	0.326	S	S	*	.	S	Bend	trans	-66.8	-28.2	175.6	-54.9	-65	0	0	0	111.7	N594 N597	N594-D599 HydrophobicContact CB-CB 4.24Å; N594-D599 WeakPolarHBondContact O-CB 3.41Å; N594-D599 PolarHBondContact O-N 3.02Å; N597-D599 WeakPolarHBondContact CB-OD2 3.36Å
600	V	79.1	Confident	79.2	Confident	30 Å²	30	63.1 Å²	63.1	18%	0.182	35%	0.352	C	S	.	.	S	Bend	trans	-128.5	126.6	178.5	179	0	0	0	0	109.6	Y572 N594 I595 G598	Y572-V600 HydrophobicContact CD1-CG1 3.99Å; Y572-V600 HydrophobicContact CD2-CG1 3.28Å; Y572-V600 HydrophobicContact CE1-CG1 4.24Å; Y572-V600 HydrophobicContact CE2-CG1 3.57Å; Y572-V600 HydrophobicContact CG-CG1 3.49Å; Y572-V600 VanDerWaalsContact CG-CG1 3.49Å; N594-V600 HydrophobicContact CB-CG2 4.07Å; N594-V600 PolarHBondContact O-N 3.09Å; I595-V600 WeakPolarHBondContact CA-O 3.32Å; I595-V600 HydrophobicContact CG1-CB 4Å; I595-V600 HydrophobicContact CG1-CG1 4.05Å; G598-V600 PolarHBondContact O-N 3.13Å
601	Q	71.9	Confident	79	Confident	176 Å²	176	61.4 Å²	61.4	82%	0.822	34%	0.342	S	S	*	.			trans	-88.4	111.4	175.7	-69.1	-174.9	-7.8	0	0	111.1
602	D	74.5	Confident	78.9	Confident	27 Å²	27	60.2 Å²	60.2	14%	0.144	34%	0.336	C	S	.	.			trans	-130.4	136.9	164.8	-165.6	-35.9	0	0	0	108.1	Y572 F573 I595 T604	Y572-D602 WeakPolarHBondContact CA-OD2 3.3Å; Y572-D602 HydrophobicContact CD2-CB 4.37Å; Y572-D602 PolarHBondContact N-OD2 3Å; F573-D602 PolarHBondContact N-OD2 3.26Å; I595-D602 HydrophobicContact CD1-CB 4.14Å; I595-D602 HydrophobicContact CG1-CB 4.38Å; I595-D602 HydrophobicContact CG2-CB 4.16Å; D602-T604 VanDerWaalsContact CG-OG1 3.3Å; D602-T604 VanDerWaalsContact OD1-CB 3.28Å; D602-T604 WeakPolarHBondContact OD1-CB 3.43Å; D602-T604 VanDerWaalsContact OD1-CG2 3.22Å; D602-T604 WeakPolarHBondContact OD1-CG2 3.47Å; D602-T604 PolarHBondContact OD1-N 3.22Å; D602-T604 PolarHBondContact OD1-OG1 2.96Å
603	S	68	Low	78.7	Confident	123 Å²	123	60.2 Å²	60.2	86%	0.86	34%	0.336	S	S	*	.			trans	-114.4	12.6	-178.2	71	0	0	0	0	113.3	R605	S603-R605 VanDerWaalsContact C-N 3.32Å; S603-R605 PolarHBondContact O-N 3.17Å
604	T	70	Confident	78.7	Confident	55 Å²	55	63 Å²	63	34%	0.337	35%	0.35	S	S	.	.	S	Bend	trans	-66.9	-27.5	179.9	46.1	0	0	0	0	113.9	K571 F573 D602	K571-T604 HydrophobicContact CD-CG2 4.33Å; F573-T604 VanDerWaalsContact CB-OG1 3.26Å; F573-T604 WeakPolarHBondContact CB-OG1 3.42Å; D602-T604 VanDerWaalsContact CG-OG1 3.3Å; D602-T604 VanDerWaalsContact OD1-CB 3.28Å; D602-T604 WeakPolarHBondContact OD1-CB 3.43Å; D602-T604 VanDerWaalsContact OD1-CG2 3.22Å; D602-T604 WeakPolarHBondContact OD1-CG2 3.47Å; D602-T604 PolarHBondContact OD1-N 3.22Å; D602-T604 PolarHBondContact OD1-OG1 2.96Å
605	R	70.6	Confident	78.7	Confident	95 Å²	95	61.8 Å²	61.8	36%	0.358	34%	0.343	S	S	.	.			trans	-150.7	128.7	-174.7	-165.4	165.2	-171.8	163.9	-0.3	112.8	S603 D607	S603-R605 VanDerWaalsContact C-N 3.32Å; S603-R605 PolarHBondContact O-N 3.17Å; R605-D607 WeakPolarHBondContact CG-OD1 3.32Å; R605-D607 IonicContact CZ-OD1 3.84Å; R605-D607 IonicContact CZ-OD2 3.93Å; R605-D607 IonicContact NE-OD1 3.46Å; R605-D607 PolarHBondContact NE-OD1 3.19Å; R605-D607 IonicContact NE-OD2 3.85Å; R605-D607 PolarHBondContact NE-OD2 2.97Å; R605-D607 IonicContact NH2-OD1 2.72Å; R605-D607 IonicContact NH2-OD2 2.8Å; R605-D607 PolarHBondContact NH2-OD2 3.38Å
606	S	70.9	Confident	78.6	Confident	127 Å²	127	60.8 Å²	60.8	89%	0.888	34%	0.338	S	S	*	.	S	Bend	trans	-89.9	-29.6	179.9	48.6	0	0	0	0	113.7	L608	S606-L608 PolarHBondContact O-N 3.47Å
607	D	79.3	Confident	78.7	Confident	61 Å²	61	58.9 Å²	58.9	33%	0.326	33%	0.327	S	S	.	.			trans	-86.6	20.3	178	61.5	-51.6	0	0	0	113.2	R605 Y609 E610 Y611	R605-D607 WeakPolarHBondContact CG-OD1 3.32Å; R605-D607 IonicContact CZ-OD1 3.84Å; R605-D607 IonicContact CZ-OD2 3.93Å; R605-D607 IonicContact NE-OD1 3.46Å; R605-D607 PolarHBondContact NE-OD1 3.19Å; R605-D607 IonicContact NE-OD2 3.85Å; R605-D607 PolarHBondContact NE-OD2 2.97Å; R605-D607 IonicContact NH2-OD1 2.72Å; R605-D607 IonicContact NH2-OD2 2.8Å; R605-D607 PolarHBondContact NH2-OD2 3.38Å; D607-Y609 PolarHBondContact O-N 3.21Å; D607-Y609 VanDerWaalsContact O-N 3.12Å; D607-E610 PolarHBondContact O-N 2.82Å; D607-Y611 PolarHBondContact O-N 3.09Å
608	L	81.6	Confident	78.8	Confident	8 Å²	8	62.5 Å²	62.5	4%	0.042	34%	0.336	C	S	.	.	H	α-helix	trans	-56.4	-32.8	-175.6	-178	58.3	0	0	0	113.4	F573 W592 I595 V596 S606 Y611 I612	F573-L608 HydrophobicContact CD2-CD1 3.5Å; F573-L608 VanDerWaalsContact CD2-CD1 3.5Å; F573-L608 HydrophobicContact CE2-CD1 3.55Å; W592-L608 HydrophobicContact CB-CD1 4.25Å; W592-L608 HydrophobicContact CG-CD1 4.18Å; I595-L608 HydrophobicContact CB-CD2 3.77Å; I595-L608 HydrophobicContact CD1-CD2 4.2Å; I595-L608 HydrophobicContact CG2-CD2 3.54Å; V596-L608 HydrophobicContact CG2-CB 4.1Å; V596-L608 HydrophobicContact CG2-CD2 3.8Å; V596-L608 HydrophobicContact CG2-CG 3.73Å; S606-L608 PolarHBondContact O-N 3.47Å; L608-Y611 HydrophobicContact CD1-CD1 4.13Å; L608-Y611 PolarHBondContact O-N 3.21Å; L608-I612 HydrophobicContact CD1-CG1 4.44Å; L608-I612 HydrophobicContact CG-CD1 4.27Å; L608-I612 VanDerWaalsContact O-CG1 3.27Å; L608-I612 WeakPolarHBondContact O-CG1 3.25Å; L608-I612 PolarHBondContact O-N 3.47Å
609	Y	81.1	Confident	79	Confident	43 Å²	43	60.4 Å²	60.4	17%	0.169	31%	0.313	C	S	.	.	H	α-helix	trans	-64.6	-42.6	175	177.7	-101.9	0	0	0	112.6	V596 D607 I612 V613 W631 V632 K635 S636 V639	V596-Y609 HydrophobicContact CG1-CD2 4.15Å; D607-Y609 PolarHBondContact O-N 3.21Å; D607-Y609 VanDerWaalsContact O-N 3.12Å; Y609-I612 PolarHBondContact O-N 3.33Å; Y609-V613 HydrophobicContact CE1-CG2 4.23Å; Y609-V613 VanDerWaalsContact O-CG2 3.3Å; Y609-V613 WeakPolarHBondContact O-CG2 3.37Å; Y609-V613 PolarHBondContact O-N 3.23Å; Y609-V613 VanDerWaalsContact O-N 3.14Å; Y609-W631 AromaticContact CD2-CH2 3.96Å; Y609-W631 HydrophobicContact CD2-CH2 3.96Å; Y609-W631 HydrophobicContact CD2-CZ3 4.26Å; Y609-W631 HydrophobicContact CE2-CH2 4.21Å; Y609-W631 HydrophobicContact CE2-CZ3 4.15Å; Y609-V632 HydrophobicContact CE2-CG1 4.34Å; Y609-V632 WeakPolarHBondContact OH-CG1 3.22Å; Y609-V632 PolarHBondContact OH-O 3.21Å; Y609-K635 HydrophobicContact CE2-CB 3.6Å; Y609-K635 HydrophobicContact CE2-CG 4.18Å; Y609-S636 PolarHBondContact OH-N 2.91Å; Y609-V639 HydrophobicContact CE1-CB 4.03Å; Y609-V639 HydrophobicContact CE1-CG1 3.87Å
610	E	83.8	Confident	79	Confident	117 Å²	117	60.2 Å²	60.2	55%	0.547	31%	0.311	S	S	.	.	H	α-helix	trans	-69.8	-36.4	176.7	-62	-175.3	-178.4	0	0	110.6	D607 V613 D614	D607-E610 PolarHBondContact O-N 2.82Å; E610-V613 WeakPolarHBondContact O-CB 3.3Å; E610-V613 PolarHBondContact O-N 3.26Å; E610-D614 PolarHBondContact O-N 2.73Å
611	Y	84.7	Confident	79.1	Confident	49 Å²	49	62.4 Å²	62.4	19%	0.192	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-42.3	172.3	-179.2	-98	0	0	0	113.1	F573 L577 W592 D607 L608 V613 D614 F615	F573-Y611 AromaticContact CE2-CD1 3.77Å; F573-Y611 HydrophobicContact CE2-CD1 3.77Å; F573-Y611 AromaticContact CE2-CE1 3.77Å; F573-Y611 HydrophobicContact CE2-CE1 3.77Å; F573-Y611 HydrophobicContact CZ-CD1 4.21Å; F573-Y611 HydrophobicContact CZ-CE1 4.08Å; L577-Y611 HydrophobicContact CD2-CE1 4.5Å; L577-Y611 VanDerWaalsContact CD2-OH 3.29Å; L577-Y611 WeakPolarHBondContact CD2-OH 3.45Å; W592-Y611 HydrophobicContact CE3-CE1 4.42Å; W592-Y611 AromaticContact CH2-CE1 3.83Å; W592-Y611 HydrophobicContact CH2-CE1 3.83Å; W592-Y611 AromaticContact CZ2-CE1 3.91Å; W592-Y611 HydrophobicContact CZ2-CE1 3.91Å; W592-Y611 HydrophobicContact CZ3-CE1 4.1Å; D607-Y611 PolarHBondContact O-N 3.09Å; L608-Y611 HydrophobicContact CD1-CD1 4.13Å; L608-Y611 PolarHBondContact O-N 3.21Å; Y611-V613 VanDerWaalsContact C-N 3.3Å; Y611-V613 PolarHBondContact O-N 3.43Å; Y611-D614 PolarHBondContact O-N 3.23Å; Y611-F615 VanDerWaalsContact O-CB 3.24Å; Y611-F615 WeakPolarHBondContact O-CB 3.31Å; Y611-F615 PolarHBondContact O-N 2.84Å
612	I	84.3	Confident	79.4	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.4	-38.1	174.2	-65	161.3	0	0	0	110.8	W592 V596 L608 Y609 F615 L616 W631	W592-I612 HydrophobicContact CB-CD1 3.73Å; W592-I612 HydrophobicContact CB-CG1 3.83Å; W592-I612 HydrophobicContact CE3-CG1 4.39Å; V596-I612 HydrophobicContact CG2-CD1 3.75Å; L608-I612 HydrophobicContact CD1-CG1 4.44Å; L608-I612 HydrophobicContact CG-CD1 4.27Å; L608-I612 VanDerWaalsContact O-CG1 3.27Å; L608-I612 WeakPolarHBondContact O-CG1 3.25Å; L608-I612 PolarHBondContact O-N 3.47Å; Y609-I612 PolarHBondContact O-N 3.33Å; I612-F615 PolarHBondContact O-N 2.91Å; I612-L616 HydrophobicContact CG2-CD1 3.88Å; I612-L616 HydrophobicContact CG2-CG 4.31Å; I612-L616 WeakPolarHBondContact O-CB 3.33Å; I612-L616 WeakPolarHBondContact O-CG 3.4Å; I612-L616 PolarHBondContact O-N 2.73Å; I612-W631 HydrophobicContact CD1-CH2 3.97Å; I612-W631 HydrophobicContact CD1-CZ3 4.36Å; I612-W631 HydrophobicContact CG2-CZ3 4.09Å
613	V	84.2	Confident	79.7	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.006	33%	0.328	C	S	.	.	H	α-helix	trans	-64.8	-48.8	177.8	167.5	0	0	0	0	111.3	Y609 E610 Y611 L616 T617 V632 V639 Q642 V643	Y609-V613 HydrophobicContact CE1-CG2 4.23Å; Y609-V613 VanDerWaalsContact O-CG2 3.3Å; Y609-V613 WeakPolarHBondContact O-CG2 3.37Å; Y609-V613 PolarHBondContact O-N 3.23Å; Y609-V613 VanDerWaalsContact O-N 3.14Å; E610-V613 WeakPolarHBondContact O-CB 3.3Å; E610-V613 PolarHBondContact O-N 3.26Å; Y611-V613 VanDerWaalsContact C-N 3.3Å; Y611-V613 PolarHBondContact O-N 3.43Å; V613-L616 PolarHBondContact O-N 3.31Å; V613-T617 WeakPolarHBondContact O-CB 3.28Å; V613-T617 PolarHBondContact O-N 2.66Å; V613-T617 PolarHBondContact O-OG1 3.03Å; V613-V632 HydrophobicContact CG2-CG1 3.62Å; V613-V639 HydrophobicContact CB-CG1 4.3Å; V613-V639 HydrophobicContact CG1-CG1 3.99Å; V613-V639 HydrophobicContact CG2-CG1 3.89Å; V613-Q642 HydrophobicContact CG1-CB 4.11Å; V613-V643 HydrophobicContact CG1-CG2 3.98Å
614	D	84.6	Confident	80.5	Confident	62 Å²	62	58.5 Å²	58.5	33%	0.332	29%	0.289	S	S	.	.	H	α-helix	trans	-66	-39.8	176.6	-78.4	-18.8	0	0	0	110.7	E610 Y611 L616 T617 Y618 K646	E610-D614 PolarHBondContact O-N 2.73Å; Y611-D614 PolarHBondContact O-N 3.23Å; D614-L616 PolarHBondContact O-N 3Å; D614-T617 VanDerWaalsContact O-CB 3.26Å; D614-T617 WeakPolarHBondContact O-CB 3.21Å; D614-T617 PolarHBondContact O-N 2.92Å; D614-T617 VanDerWaalsContact O-N 3.1Å; D614-Y618 WeakPolarHBondContact O-CD2 3.17Å; D614-Y618 PolarHBondContact O-N 3.45Å; D614-Y618 VanDerWaalsContact O-N 3.11Å; D614-K646 IonicContact OD1-NZ 2.81Å; D614-K646 PolarHBondContact OD1-NZ 2.9Å
615	F	84.2	Confident	81.1	Confident	21 Å²	21	55.9 Å²	55.9	9%	0.092	27%	0.273	C	S	.	.	H	α-helix	trans	-56.3	-52.2	173.4	-178	-90.4	0	0	0	112	H580 D585 V589 W592 Y611 I612 T617 Y618 C619	H580-F615 HydrophobicContact CB-CE2 4.4Å; H580-F615 AromaticContact CD2-CE2 3.85Å; H580-F615 AromaticContact CE1-CE2 3.64Å; H580-F615 AromaticContact CG-CE2 3.66Å; H580-F615 AromaticContact ND1-CE2 3.53Å; H580-F615 AromaticContact ND1-CZ 3.65Å; H580-F615 AromaticContact NE2-CE2 3.83Å; D585-F615 HydrophobicContact CB-CZ 4.26Å; V589-F615 HydrophobicContact CG2-CD1 3.82Å; V589-F615 HydrophobicContact CG2-CE1 3.54Å; W592-F615 AromaticContact CH2-CD2 3.99Å; W592-F615 HydrophobicContact CH2-CD2 3.99Å; W592-F615 AromaticContact CH2-CE2 3.95Å; W592-F615 HydrophobicContact CH2-CE2 3.95Å; W592-F615 HydrophobicContact CH2-CG 4.44Å; W592-F615 HydrophobicContact CH2-CZ 4.37Å; W592-F615 AromaticContact CZ3-CD1 3.94Å; W592-F615 HydrophobicContact CZ3-CD1 3.94Å; W592-F615 AromaticContact CZ3-CD2 3.82Å; W592-F615 HydrophobicContact CZ3-CD2 3.82Å; W592-F615 HydrophobicContact CZ3-CE1 4.08Å; W592-F615 AromaticContact CZ3-CE2 3.96Å; W592-F615 HydrophobicContact CZ3-CE2 3.96Å; W592-F615 AromaticContact CZ3-CG 3.82Å; W592-F615 HydrophobicContact CZ3-CG 3.82Å; W592-F615 HydrophobicContact CZ3-CZ 4.09Å; Y611-F615 VanDerWaalsContact O-CB 3.24Å; Y611-F615 WeakPolarHBondContact O-CB 3.31Å; Y611-F615 PolarHBondContact O-N 2.84Å; I612-F615 PolarHBondContact O-N 2.91Å; F615-T617 PolarHBondContact O-N 3Å; F615-Y618 PolarHBondContact O-N 2.72Å; F615-C619 WeakPolarHBondContact O-CB 3.26Å; F615-C619 PolarHBondContact O-N 3.12Å
616	L	83.9	Confident	81.7	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-27.7	177.1	-70.4	173.2	0	0	0	112.2	V589 I612 V613 D614 V625 V632 V643 R647	V589-L616 HydrophobicContact CG2-CD2 4.46Å; I612-L616 HydrophobicContact CG2-CD1 3.88Å; I612-L616 HydrophobicContact CG2-CG 4.31Å; I612-L616 WeakPolarHBondContact O-CB 3.33Å; I612-L616 WeakPolarHBondContact O-CG 3.4Å; I612-L616 PolarHBondContact O-N 2.73Å; V613-L616 PolarHBondContact O-N 3.31Å; D614-L616 PolarHBondContact O-N 3Å; L616-V625 HydrophobicContact CD2-CG2 4.44Å; L616-V632 HydrophobicContact CD1-CG2 3.92Å; L616-V643 HydrophobicContact CB-CG1 4.01Å; L616-V643 HydrophobicContact CB-CG2 4.34Å; L616-R647 PolarHBondContact O-NH2 3.26Å
617	T	83.6	Confident	82.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.2	-39.1	174.3	-57.5	0	0	0	0	112.1	V613 D614 F615 V643 K646 R647	V613-T617 WeakPolarHBondContact O-CB 3.28Å; V613-T617 PolarHBondContact O-N 2.66Å; V613-T617 PolarHBondContact O-OG1 3.03Å; D614-T617 VanDerWaalsContact O-CB 3.26Å; D614-T617 WeakPolarHBondContact O-CB 3.21Å; D614-T617 PolarHBondContact O-N 2.92Å; D614-T617 VanDerWaalsContact O-N 3.1Å; F615-T617 PolarHBondContact O-N 3Å; T617-V643 WeakPolarHBondContact OG1-CA 3.42Å; T617-K646 HydrophobicContact CG2-CB 3.67Å; T617-R647 HydrophobicContact CG2-CG 4.28Å
618	Y	81.7	Confident	82.7	Confident	144 Å²	144	51.7 Å²	51.7	57%	0.565	25%	0.249	S	C	*	.	H	α-helix	trans	-92.9	-10	179.2	-64.8	-68.7	0	0	0	114	D614 F615 P648	D614-Y618 WeakPolarHBondContact O-CD2 3.17Å; D614-Y618 PolarHBondContact O-N 3.45Å; D614-Y618 VanDerWaalsContact O-N 3.11Å; F615-Y618 PolarHBondContact O-N 2.72Å; Y618-P648 HydrophobicContact CD1-CG 4.13Å; Y618-P648 HydrophobicContact CE1-CG 4.32Å
619	C	80.5	Confident	82.8	Confident	11 Å²	11	51.4 Å²	51.4	7%	0.074	25%	0.249	C	C	.	.			trans	-64.8	135.1	177.9	-171.3	0	0	0	0	112.4	F615 V625 R647	F615-C619 WeakPolarHBondContact O-CB 3.26Å; F615-C619 PolarHBondContact O-N 3.12Å; C619-V625 HydrophobicContact CB-CG2 4.24Å; C619-R647 PolarHBondContact O-NH1 3.44Å
620	L	76.6	Confident	82.9	Confident	114 Å²	114	51.4 Å²	51.4	60%	0.597	25%	0.251	S	S	*	.			trans	-87.8	-17.9	-178.7	-60.4	176.8	0	0	0	113.7	E622 N655	L620-E622 PolarHBondContact O-N 3.15Å; L620-N655 PolarHBondContact O-ND2 3.48Å
621	D	80.8	Confident	83	Confident	75 Å²	75	47.7 Å²	47.7	40%	0.401	23%	0.232	S	C	.	.			trans	-80.1	109.8	179.6	-176.9	-15.5	0	0	0	110.3	E623 L624 V625	D621-E623 WeakPolarHBondContact OD1-CA 3.06Å; D621-E623 WeakPolarHBondContact OD1-CB 3.13Å; D621-E623 PolarHBondContact OD1-N 3.5Å; D621-L624 HydrophobicContact CB-CB 3.88Å; D621-L624 PolarHBondContact OD1-N 3.05Å; D621-V625 VanDerWaalsContact O-CG2 3.24Å; D621-V625 WeakPolarHBondContact O-CG2 3.41Å; D621-V625 PolarHBondContact O-N 3.22Å
622	E	77.7	Confident	83.1	Confident	67 Å²	67	45.4 Å²	45.4	31%	0.313	22%	0.223	S	C	.	.	H	α-helix	trans	-69.1	-34.5	179	-59.2	-169.4	-176.2	0	0	112.4	L620 V625 W626 N655 F657	L620-E622 PolarHBondContact O-N 3.15Å; E622-V625 PolarHBondContact O-N 3.29Å; E622-W626 WeakPolarHBondContact O-CB 3.48Å; E622-W626 PolarHBondContact O-N 3.45Å; E622-N655 VanDerWaalsContact OE1-CA 3.29Å; E622-N655 WeakPolarHBondContact OE1-CA 3.2Å; E622-N655 WeakPolarHBondContact OE1-CB 3.5Å; E622-F657 HydrophobicContact CB-CE1 4.46Å; E622-F657 HydrophobicContact CB-CZ 4.01Å; E622-F657 HydrophobicContact CG-CE2 3.86Å; E622-F657 HydrophobicContact CG-CZ 3.85Å
623	E	81.8	Confident	83	Confident	166 Å²	166	45.5 Å²	45.5	78%	0.776	22%	0.224	S	C	*	.	H	α-helix	trans	-68.8	-42.8	-179.5	-63.7	-169.8	-174.6	0	0	110.7	D621 W626 A627	D621-E623 WeakPolarHBondContact OD1-CA 3.06Å; D621-E623 WeakPolarHBondContact OD1-CB 3.13Å; D621-E623 PolarHBondContact OD1-N 3.5Å; E623-W626 PolarHBondContact O-N 2.91Å; E623-A627 WeakPolarHBondContact O-CB 3.28Å; E623-A627 PolarHBondContact O-N 3.4Å
624	L	83.8	Confident	83.1	Confident	11 Å²	11	51.7 Å²	51.7	6%	0.058	25%	0.253	C	S	.	.	H	α-helix	trans	-61.6	-43.8	174.7	-173.6	66.6	0	0	0	111.7	D585 A586 V589 D621 A627 Y628	D585-L624 HydrophobicContact CB-CD2 3.73Å; A586-L624 HydrophobicContact CB-CD1 4.02Å; V589-L624 HydrophobicContact CG2-CD2 4.28Å; D621-L624 HydrophobicContact CB-CB 3.88Å; D621-L624 PolarHBondContact OD1-N 3.05Å; L624-A627 PolarHBondContact O-N 3.47Å; L624-Y628 HydrophobicContact CD1-CD2 3.8Å; L624-Y628 HydrophobicContact CD1-CE2 3.56Å; L624-Y628 HydrophobicContact CG-CD2 4.36Å; L624-Y628 WeakPolarHBondContact O-CD2 3.46Å; L624-Y628 PolarHBondContact O-N 3.4Å
625	V	83.9	Confident	83	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-47.3	176.5	168.9	0	0	0	0	111	L616 C619 D621 E622 A627 Y628 A629 V643 F644 R647 F657	L616-V625 HydrophobicContact CD2-CG2 4.44Å; C619-V625 HydrophobicContact CB-CG2 4.24Å; D621-V625 VanDerWaalsContact O-CG2 3.24Å; D621-V625 WeakPolarHBondContact O-CG2 3.41Å; D621-V625 PolarHBondContact O-N 3.22Å; E622-V625 PolarHBondContact O-N 3.29Å; V625-A627 VanDerWaalsContact C-N 3.35Å; V625-A627 PolarHBondContact O-N 2.94Å; V625-Y628 PolarHBondContact O-N 2.99Å; V625-A629 VanDerWaalsContact O-CB 3.23Å; V625-A629 WeakPolarHBondContact O-CB 3.43Å; V625-A629 PolarHBondContact O-N 3.2Å; V625-V643 HydrophobicContact CG1-CG1 4.06Å; V625-F644 HydrophobicContact CG1-CE1 4.29Å; V625-R647 VanDerWaalsContact CG2-NH2 3.3Å; V625-F657 HydrophobicContact CB-CE1 4.31Å; V625-F657 HydrophobicContact CB-CZ 3.9Å; V625-F657 HydrophobicContact CG1-CE1 3.76Å; V625-F657 HydrophobicContact CG1-CZ 3.64Å; V625-F657 HydrophobicContact CG2-CZ 4.36Å
626	W	83.6	Confident	82.9	Confident	92 Å²	92	54.2 Å²	54.2	35%	0.348	27%	0.266	S	S	.	.	H	α-helix	trans	-64.8	-36.3	178.7	-77.8	120.2	0	0	0	113	E622 E623 Y628 F644 F657 I662 C665	E622-W626 WeakPolarHBondContact O-CB 3.48Å; E622-W626 PolarHBondContact O-N 3.45Å; E623-W626 PolarHBondContact O-N 2.91Å; W626-Y628 PolarHBondContact O-N 3.16Å; W626-F644 HydrophobicContact CZ3-CZ 4.42Å; W626-F657 HydrophobicContact CD2-CE1 4.42Å; W626-F657 AromaticContact CE2-CD1 3.84Å; W626-F657 AromaticContact CE2-CE1 3.81Å; W626-F657 AromaticContact CZ2-CD1 3.77Å; W626-F657 HydrophobicContact CZ2-CD1 3.77Å; W626-F657 HydrophobicContact CZ2-CE1 4.2Å; W626-F657 AromaticContact NE1-CD1 3.82Å; W626-F657 AromaticContact NE1-CE1 3.55Å; W626-I662 HydrophobicContact CH2-CG1 4.1Å; W626-C665 HydrophobicContact CZ3-CB 3.98Å
627	A	85.3	Confident	82.8	Confident	73 Å²	73	56.5 Å²	56.5	60%	0.603	28%	0.276	S	S	*	.	H	α-helix	trans	-62.7	-40.5	177.8	0	0	0	0	0	112.8	E623 L624 V625	E623-A627 WeakPolarHBondContact O-CB 3.28Å; E623-A627 PolarHBondContact O-N 3.4Å; L624-A627 PolarHBondContact O-N 3.47Å; V625-A627 VanDerWaalsContact C-N 3.35Å; V625-A627 PolarHBondContact O-N 2.94Å
628	Y	84.8	Confident	82.6	Confident	30 Å²	30	60.6 Å²	60.6	12%	0.118	30%	0.296	C	S	.	.	H	α-helix	trans	-96.2	-14.4	-178.4	-70.6	-75.8	0	0	0	114.7	V589 Q590 V593 L624 V625 W626 D630 W631 V632	V589-Y628 HydrophobicContact CB-CD2 4.46Å; V589-Y628 HydrophobicContact CB-CE2 4.13Å; V589-Y628 HydrophobicContact CG1-CD1 4.04Å; V589-Y628 HydrophobicContact CG1-CD2 3.59Å; V589-Y628 HydrophobicContact CG1-CE1 4.04Å; V589-Y628 HydrophobicContact CG1-CE2 3.59Å; V589-Y628 HydrophobicContact CG1-CG 3.81Å; Q590-Y628 WeakPolarHBondContact CA-OH 2.96Å; Q590-Y628 WeakPolarHBondContact CB-OH 3.32Å; Q590-Y628 PolarHBondContact OE1-OH 2.84Å; V593-Y628 HydrophobicContact CB-CE1 4.4Å; V593-Y628 HydrophobicContact CG1-CE1 4.47Å; V593-Y628 HydrophobicContact CG2-CD1 3.92Å; V593-Y628 HydrophobicContact CG2-CE1 3.83Å; L624-Y628 HydrophobicContact CD1-CD2 3.8Å; L624-Y628 HydrophobicContact CD1-CE2 3.56Å; L624-Y628 HydrophobicContact CG-CD2 4.36Å; L624-Y628 WeakPolarHBondContact O-CD2 3.46Å; L624-Y628 PolarHBondContact O-N 3.4Å; V625-Y628 PolarHBondContact O-N 2.99Å; W626-Y628 PolarHBondContact O-N 3.16Å; Y628-D630 VanDerWaalsContact C-N 3.33Å; Y628-D630 PolarHBondContact O-N 3.33Å; Y628-W631 WeakPolarHBondContact O-CB 3.3Å; Y628-W631 PolarHBondContact O-N 2.87Å; Y628-V632 WeakPolarHBondContact O-CG2 3.36Å; Y628-V632 PolarHBondContact O-N 2.99Å
629	A	83.1	Confident	82.5	Confident	3 Å²	3	55.1 Å²	55.1	3%	0.025	28%	0.277	C	S	.	.	H	α-helix	trans	-53.9	-42.6	-178.5	0	0	0	0	0	113.9	V625 V632 L633 F644	V625-A629 VanDerWaalsContact O-CB 3.23Å; V625-A629 WeakPolarHBondContact O-CB 3.43Å; V625-A629 PolarHBondContact O-N 3.2Å; A629-V632 PolarHBondContact O-N 3.44Å; A629-L633 WeakPolarHBondContact O-CB 3.49Å; A629-L633 WeakPolarHBondContact O-CD1 3.38Å; A629-L633 VanDerWaalsContact O-CG 3.29Å; A629-L633 WeakPolarHBondContact O-CG 3.43Å; A629-L633 PolarHBondContact O-N 3.45Å; A629-F644 HydrophobicContact CB-CE2 4.33Å; A629-F644 HydrophobicContact CB-CZ 3.91Å
630	D	84.8	Confident	82.5	Confident	43 Å²	43	54.6 Å²	54.6	23%	0.23	27%	0.274	C	S	.	.	H	α-helix	trans	-69.4	-34.9	178.9	-157.9	69.2	0	0	0	111.6	Y628 L633 Q634 K668 Y669	Y628-D630 VanDerWaalsContact C-N 3.33Å; Y628-D630 PolarHBondContact O-N 3.33Å; D630-L633 PolarHBondContact O-N 3.5Å; D630-Q634 WeakPolarHBondContact O-CB 3.3Å; D630-Q634 WeakPolarHBondContact O-CG 3.48Å; D630-Q634 PolarHBondContact O-N 3.4Å; D630-Q634 PolarHBondContact OD2-NE2 3.24Å; D630-K668 IonicContact OD1-NZ 3.03Å; D630-K668 PolarHBondContact OD1-NZ 3.45Å; D630-K668 IonicContact OD2-NZ 2.64Å; D630-Y669 PolarHBondContact OD1-OH 3.06Å
631	W	86.2	Confident	82.8	Confident	38 Å²	38	49.4 Å²	49.4	14%	0.144	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-43.4	173.9	173	88.2	0	0	0	111.9	V593 V596 N597 Y609 I612 Y628 K635	V593-W631 HydrophobicContact CB-CZ2 4.3Å; V593-W631 HydrophobicContact CG1-CD2 4.35Å; V593-W631 HydrophobicContact CG1-CZ2 3.99Å; V593-W631 HydrophobicContact CG2-CD2 4.24Å; V593-W631 HydrophobicContact CG2-CE3 4.08Å; V593-W631 HydrophobicContact CG2-CH2 3.86Å; V593-W631 HydrophobicContact CG2-CZ2 3.99Å; V593-W631 HydrophobicContact CG2-CZ3 3.9Å; V596-W631 HydrophobicContact CB-CH2 4.12Å; V596-W631 HydrophobicContact CB-CZ2 4.04Å; V596-W631 HydrophobicContact CG1-CH2 3.84Å; V596-W631 HydrophobicContact CG1-CZ2 3.75Å; N597-W631 PolarHBondContact OD1-NE1 3.06Å; N597-W631 VanDerWaalsContact OD1-NE1 3.1Å; Y609-W631 AromaticContact CD2-CH2 3.96Å; Y609-W631 HydrophobicContact CD2-CH2 3.96Å; Y609-W631 HydrophobicContact CD2-CZ3 4.26Å; Y609-W631 HydrophobicContact CE2-CH2 4.21Å; Y609-W631 HydrophobicContact CE2-CZ3 4.15Å; I612-W631 HydrophobicContact CD1-CH2 3.97Å; I612-W631 HydrophobicContact CD1-CZ3 4.36Å; I612-W631 HydrophobicContact CG2-CZ3 4.09Å; Y628-W631 WeakPolarHBondContact O-CB 3.3Å; Y628-W631 PolarHBondContact O-N 2.87Å; W631-K635 HydrophobicContact CD2-CG 4.48Å; W631-K635 HydrophobicContact CZ2-CG 4.42Å; W631-K635 VanDerWaalsContact O-CG 3.31Å; W631-K635 WeakPolarHBondContact O-CG 3.18Å; W631-K635 PolarHBondContact O-N 2.89Å; W631-K635 VanDerWaalsContact O-N 3.14Å
632	V	85.4	Confident	82.8	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-46.7	176.5	-173	0	0	0	0	110.5	Y609 V613 L616 Y628 A629 Q634 K635 S636 G640	Y609-V632 HydrophobicContact CE2-CG1 4.34Å; Y609-V632 WeakPolarHBondContact OH-CG1 3.22Å; Y609-V632 PolarHBondContact OH-O 3.21Å; V613-V632 HydrophobicContact CG2-CG1 3.62Å; L616-V632 HydrophobicContact CD1-CG2 3.92Å; Y628-V632 WeakPolarHBondContact O-CG2 3.36Å; Y628-V632 PolarHBondContact O-N 2.99Å; A629-V632 PolarHBondContact O-N 3.44Å; V632-Q634 PolarHBondContact O-N 3.43Å; V632-K635 PolarHBondContact O-N 3.47Å; V632-K635 VanDerWaalsContact O-N 3.16Å; V632-S636 PolarHBondContact O-N 2.82Å; V632-G640 VanDerWaalsContact CG1-CA 3.4Å
633	L	83.2	Confident	83	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-65.7	-35.4	-179.7	-70.5	165.6	0	0	0	112.8	A629 D630 E637 V641 L666 Y669 A672	A629-L633 WeakPolarHBondContact O-CB 3.49Å; A629-L633 WeakPolarHBondContact O-CD1 3.38Å; A629-L633 VanDerWaalsContact O-CG 3.29Å; A629-L633 WeakPolarHBondContact O-CG 3.43Å; A629-L633 PolarHBondContact O-N 3.45Å; D630-L633 PolarHBondContact O-N 3.5Å; L633-E637 PolarHBondContact O-N 2.98Å; L633-V641 HydrophobicContact CD2-CG2 4.46Å; L633-L666 HydrophobicContact CD1-CD2 3.73Å; L633-L666 HydrophobicContact CD2-CD2 3.82Å; L633-L666 HydrophobicContact CG-CD2 4.46Å; L633-Y669 HydrophobicContact CB-CD1 4.41Å; L633-Y669 HydrophobicContact CB-CD2 3.77Å; L633-Y669 HydrophobicContact CB-CE1 4.26Å; L633-Y669 HydrophobicContact CB-CE2 3.58Å; L633-Y669 HydrophobicContact CB-CG 4.2Å; L633-Y669 HydrophobicContact CD1-CD2 3.85Å; L633-Y669 HydrophobicContact CD1-CE2 3.91Å; L633-Y669 HydrophobicContact CG-CD2 4.26Å; L633-Y669 HydrophobicContact CG-CE2 4.35Å; L633-A672 HydrophobicContact CD2-CB 4.1Å
634	Q	85	Confident	82.9	Confident	130 Å²	130	37.6 Å²	37.6	61%	0.607	19%	0.189	S	C	*	.	H	α-helix	trans	-64.5	-35.2	171.9	-75.8	179.3	34	0	0	113	D630 V632 Y669	D630-Q634 WeakPolarHBondContact O-CB 3.3Å; D630-Q634 WeakPolarHBondContact O-CG 3.48Å; D630-Q634 PolarHBondContact O-N 3.4Å; D630-Q634 PolarHBondContact OD2-NE2 3.24Å; V632-Q634 PolarHBondContact O-N 3.43Å; Q634-Y669 HydrophobicContact CG-CE1 4.47Å; Q634-Y669 WeakPolarHBondContact CG-OH 3.47Å
635	K	82.4	Confident	82.7	Confident	98 Å²	98	38.2 Å²	38.2	43%	0.426	19%	0.193	S	C	.	.	H	α-helix	trans	-77.2	-42.3	179.4	-71.4	-85.3	-173.6	163.6	0	112.3	N597 Y609 W631 V632	N597-K635 WeakPolarHBondContact OD1-CE 3.37Å; N597-K635 PolarHBondContact OD1-NZ 3.1Å; Y609-K635 HydrophobicContact CE2-CB 3.6Å; Y609-K635 HydrophobicContact CE2-CG 4.18Å; W631-K635 HydrophobicContact CD2-CG 4.48Å; W631-K635 HydrophobicContact CZ2-CG 4.42Å; W631-K635 VanDerWaalsContact O-CG 3.31Å; W631-K635 WeakPolarHBondContact O-CG 3.18Å; W631-K635 PolarHBondContact O-N 2.89Å; W631-K635 VanDerWaalsContact O-N 3.14Å; V632-K635 PolarHBondContact O-N 3.47Å; V632-K635 VanDerWaalsContact O-N 3.16Å
636	S	82.4	Confident	82.4	Confident	39 Å²	39	43 Å²	43	27%	0.273	21%	0.214	S	C	.	.			trans	-159.4	107.9	174	179.1	0	0	0	0	112.4	Y609 V632 E638 V639 G640	Y609-S636 PolarHBondContact OH-N 2.91Å; V632-S636 PolarHBondContact O-N 2.82Å; S636-E638 PolarHBondContact O-N 2.84Å; S636-V639 PolarHBondContact O-N 2.9Å; S636-V639 PolarHBondContact OG-N 3.5Å; S636-G640 PolarHBondContact O-N 3.47Å
637	E	83.1	Confident	81.9	Confident	48 Å²	48	40.6 Å²	40.6	22%	0.224	21%	0.205	C	C	.	.	H	α-helix	trans	-49.6	-40.5	173.8	-71.1	-169.9	-106.2	0	0	112.9	L633 V641 Y669 K671 A672	L633-E637 PolarHBondContact O-N 2.98Å; E637-V641 WeakPolarHBondContact O-CG2 3.21Å; E637-Y669 HydrophobicContact CG-CD1 4.16Å; E637-Y669 HydrophobicContact CG-CG 4.5Å; E637-Y669 WeakPolarHBondContact OE2-CA 3.41Å; E637-K671 HydrophobicContact CB-CB 4.44Å; E637-K671 WeakPolarHBondContact OE2-CB 3.45Å; E637-K671 PolarHBondContact OE2-N 3.21Å; E637-A672 HydrophobicContact CB-CB 4.08Å; E637-A672 HydrophobicContact CG-CB 4.49Å; E637-A672 PolarHBondContact OE2-N 3.41Å
638	E	78.3	Confident	81	Confident	87 Å²	87	40.6 Å²	40.6	41%	0.407	20%	0.199	S	C	.	.	H	α-helix	trans	-82.3	-23.3	-170.4	-64.9	-165.6	-148.1	0	0	113.8	S636 K675	S636-E638 PolarHBondContact O-N 2.84Å; E638-K675 WeakPolarHBondContact OE2-CE 3.32Å; E638-K675 IonicContact OE2-NZ 3.94Å; E638-K675 PolarHBondContact OE2-NZ 3.37Å
639	V	79.6	Confident	79.7	Confident	28 Å²	28	45.8 Å²	45.8	17%	0.17	23%	0.228	C	C	.	.	H	α-helix	trans	-94.4	-37.6	175.4	-177.1	0	0	0	0	110.4	Y609 V613 S636 V641 Q642	Y609-V639 HydrophobicContact CE1-CB 4.03Å; Y609-V639 HydrophobicContact CE1-CG1 3.87Å; V613-V639 HydrophobicContact CB-CG1 4.3Å; V613-V639 HydrophobicContact CG1-CG1 3.99Å; V613-V639 HydrophobicContact CG2-CG1 3.89Å; S636-V639 PolarHBondContact O-N 2.9Å; S636-V639 PolarHBondContact OG-N 3.5Å; V639-V641 VanDerWaalsContact C-N 3.3Å; V639-V641 PolarHBondContact O-N 2.99Å; V639-Q642 VanDerWaalsContact O-CB 3.22Å; V639-Q642 WeakPolarHBondContact O-CB 3.45Å; V639-Q642 VanDerWaalsContact O-CG 3.26Å; V639-Q642 WeakPolarHBondContact O-CG 3.44Å; V639-Q642 PolarHBondContact O-N 3.03Å
640	G	80.9	Confident	78	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-63.9	-27.8	-178.4	0	0	0	0	0	115.5	V632 S636 Q642 V643	V632-G640 VanDerWaalsContact CG1-CA 3.4Å; S636-G640 PolarHBondContact O-N 3.47Å; G640-Q642 PolarHBondContact O-N 2.73Å; G640-V643 WeakPolarHBondContact O-CB 3.46Å; G640-V643 WeakPolarHBondContact O-CG2 3.38Å; G640-V643 PolarHBondContact O-N 2.65Å
641	V	82.1	Confident	76.3	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.024	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.1	172.2	168.8	0	0	0	0	113.1	L633 E637 V639 V643 F644 T645 A672 K675	L633-V641 HydrophobicContact CD2-CG2 4.46Å; E637-V641 WeakPolarHBondContact O-CG2 3.21Å; V639-V641 VanDerWaalsContact C-N 3.3Å; V639-V641 PolarHBondContact O-N 2.99Å; V641-V643 PolarHBondContact O-N 3.46Å; V641-F644 PolarHBondContact O-N 3.43Å; V641-T645 HydrophobicContact CG1-CG2 3.5Å; V641-T645 PolarHBondContact O-N 3.11Å; V641-T645 PolarHBondContact O-OG1 2.84Å; V641-A672 VanDerWaalsContact CG2-CA 3.42Å; V641-A672 HydrophobicContact CG2-CB 3.36Å; V641-A672 WeakPolarHBondContact CG2-O 3.41Å; V641-K675 HydrophobicContact CG1-CB 4.24Å
642	Q	81.7	Confident	74.4	Confident	52 Å²	52	63.9 Å²	63.9	24%	0.243	32%	0.315	C	S	.	.	H	α-helix	trans	-63.1	-30.1	-177.5	-57.7	-179.7	37.3	0	0	111.5	V613 V639 G640 F644 T645 K646	V613-Q642 HydrophobicContact CG1-CB 4.11Å; V639-Q642 VanDerWaalsContact O-CB 3.22Å; V639-Q642 WeakPolarHBondContact O-CB 3.45Å; V639-Q642 VanDerWaalsContact O-CG 3.26Å; V639-Q642 WeakPolarHBondContact O-CG 3.44Å; V639-Q642 PolarHBondContact O-N 3.03Å; G640-Q642 PolarHBondContact O-N 2.73Å; Q642-F644 PolarHBondContact O-N 3.5Å; Q642-F644 VanDerWaalsContact O-N 3.07Å; Q642-T645 PolarHBondContact O-N 3.28Å; Q642-K646 HydrophobicContact CB-CD 4.13Å; Q642-K646 HydrophobicContact CB-CG 4.25Å; Q642-K646 WeakPolarHBondContact O-CB 3.4Å; Q642-K646 PolarHBondContact O-N 2.97Å
643	V	82.2	Confident	72.8	Confident	2 Å²	2	68.2 Å²	68.2	1%	0.012	34%	0.335	C	S	.	.	H	α-helix	trans	-56.1	-22.7	171.3	-175.1	0	0	0	0	113.2	V613 L616 T617 V625 G640 V641 R647	V613-V643 HydrophobicContact CG1-CG2 3.98Å; L616-V643 HydrophobicContact CB-CG1 4.01Å; L616-V643 HydrophobicContact CB-CG2 4.34Å; T617-V643 WeakPolarHBondContact OG1-CA 3.42Å; V625-V643 HydrophobicContact CG1-CG1 4.06Å; G640-V643 WeakPolarHBondContact O-CB 3.46Å; G640-V643 WeakPolarHBondContact O-CG2 3.38Å; G640-V643 PolarHBondContact O-N 2.65Å; V641-V643 PolarHBondContact O-N 3.46Å; V643-R647 VanDerWaalsContact O-CG 3.32Å; V643-R647 WeakPolarHBondContact O-CG 3.42Å; V643-R647 PolarHBondContact O-NE 2.89Å; V643-R647 PolarHBondContact O-NH2 2.97Å
644	F	80.2	Confident	71.1	Confident	6 Å²	6	77.5 Å²	77.5	3%	0.026	38%	0.376	C	S	.	.	H	α-helix	trans	-112.6	-24.3	179.6	-60.2	-65.5	0	0	0	114.2	V625 W626 A629 V641 Q642 F657 I662 Y676	V625-F644 HydrophobicContact CG1-CE1 4.29Å; W626-F644 HydrophobicContact CZ3-CZ 4.42Å; A629-F644 HydrophobicContact CB-CE2 4.33Å; A629-F644 HydrophobicContact CB-CZ 3.91Å; V641-F644 PolarHBondContact O-N 3.43Å; Q642-F644 PolarHBondContact O-N 3.5Å; Q642-F644 VanDerWaalsContact O-N 3.07Å; F644-F657 HydrophobicContact CE1-CD1 4.12Å; F644-F657 HydrophobicContact CE1-CE1 4.22Å; F644-I662 HydrophobicContact CB-CD1 4.19Å; F644-I662 HydrophobicContact CB-CG2 4.22Å; F644-I662 HydrophobicContact CD1-CD1 3.53Å; F644-I662 HydrophobicContact CD1-CG1 3.79Å; F644-I662 HydrophobicContact CD1-CG2 4.26Å; F644-I662 HydrophobicContact CD2-CG2 4.12Å; F644-I662 HydrophobicContact CE1-CD1 4.19Å; F644-I662 HydrophobicContact CE1-CG1 4Å; F644-I662 HydrophobicContact CG-CD1 4.07Å; F644-I662 HydrophobicContact CG-CG1 4.33Å; F644-I662 HydrophobicContact CG-CG2 3.94Å; F644-Y676 HydrophobicContact CB-CD2 4.07Å; F644-Y676 HydrophobicContact CB-CE2 3.75Å
645	T	78	Confident	69.4	Low	24 Å²	24	75.5 Å²	75.5	15%	0.147	37%	0.369	C	S	.	.	H	α-helix	trans	-94.1	-39.2	-179.4	58.6	0	0	0	0	114	V641 Q642 R647 Y676 H679	V641-T645 HydrophobicContact CG1-CG2 3.5Å; V641-T645 PolarHBondContact O-N 3.11Å; V641-T645 PolarHBondContact O-OG1 2.84Å; Q642-T645 PolarHBondContact O-N 3.28Å; T645-R647 VanDerWaalsContact C-N 3.31Å; T645-R647 PolarHBondContact O-N 2.88Å; T645-Y676 HydrophobicContact CG2-CD2 3.72Å; T645-Y676 HydrophobicContact CG2-CE2 4.36Å; T645-H679 HydrophobicContact CG2-CB 3.68Å; T645-H679 PolarHBondContact O-CE1 3.23Å; T645-H679 VanDerWaalsContact O-CE1 3.27Å; T645-H679 PolarHBondContact O-NE2 3.11Å
646	K	78.6	Confident	68.4	Low	100 Å²	100	75.7 Å²	75.7	44%	0.435	38%	0.382	S	S	.	.	S	Bend	trans	-80.5	-4.3	-176.9	-74.5	-171.8	-175.5	168.6	0	114.5	D614 T617 Q642	D614-K646 IonicContact OD1-NZ 2.81Å; D614-K646 PolarHBondContact OD1-NZ 2.9Å; T617-K646 HydrophobicContact CG2-CB 3.67Å; Q642-K646 HydrophobicContact CB-CD 4.13Å; Q642-K646 HydrophobicContact CB-CG 4.25Å; Q642-K646 WeakPolarHBondContact O-CB 3.4Å; Q642-K646 PolarHBondContact O-N 2.97Å
647	R	73.6	Confident	67.7	Low	42 Å²	42	74.8 Å²	74.8	16%	0.158	37%	0.374	C	S	.	.			trans	-53.8	134.3	-177.8	-66.9	-160.6	169.7	-101.2	-18.8	111.8	L616 T617 C619 V625 V643 T645 L649	L616-R647 PolarHBondContact O-NH2 3.26Å; T617-R647 HydrophobicContact CG2-CG 4.28Å; C619-R647 PolarHBondContact O-NH1 3.44Å; V625-R647 VanDerWaalsContact CG2-NH2 3.3Å; V643-R647 VanDerWaalsContact O-CG 3.32Å; V643-R647 WeakPolarHBondContact O-CG 3.42Å; V643-R647 PolarHBondContact O-NE 2.89Å; V643-R647 PolarHBondContact O-NH2 2.97Å; T645-R647 VanDerWaalsContact C-N 3.31Å; T645-R647 PolarHBondContact O-N 2.88Å; R647-L649 PolarHBondContact O-N 3.25Å
648	P	65.3	Low	67.3	Low	73 Å²	73	75.8 Å²	75.8	47%	0.474	38%	0.38	S	S	.	.			trans	-61.3	136.2	179.4	25.4	-33.7	0	0	0	111.5	Y618 D650	Y618-P648 HydrophobicContact CD1-CG 4.13Å; Y618-P648 HydrophobicContact CE1-CG 4.32Å; P648-D650 PolarHBondContact O-N 2.9Å
649	L	57.6	Low	67.1	Low	139 Å²	139	73.1 Å²	73.1	73%	0.728	37%	0.371	S	S	*	.			trans	-90	72.3	177.2	-75.1	171.7	0	0	0	110.2	R647	R647-L649 PolarHBondContact O-N 3.25Å
650	D	48.7	Very low	66.9	Low	85 Å²	85	74.3 Å²	74.3	46%	0.455	38%	0.376	S	S	.	.			trans	-92.4	112.2	-178.9	-162	7.2	0	0	0	110.6	P648 Q652 Q653	P648-D650 PolarHBondContact O-N 2.9Å; D650-Q652 PolarHBondContact O-N 3.44Å; D650-Q653 HydrophobicContact CB-CG 4.17Å; D650-Q653 PolarHBondContact O-N 3.19Å; D650-Q653 VanDerWaalsContact O-N 3.12Å; D650-Q653 PolarHBondContact OD2-NE2 3.24Å
651	E	48.1	Very low	66.8	Low	200 Å²	200	78 Å²	78	94%	0.935	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-9.6	-169.2	-65.9	-169	144.4	0	0	114.6
652	Q	45.3	Very low	66.7	Low	180 Å²	180	78 Å²	78	84%	0.841	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-11.1	-178.6	-56.9	-169.1	11.2	0	0	113.9	D650	D650-Q652 PolarHBondContact O-N 3.44Å
653	Q	51.8	Low	66.6	Low	92 Å²	92	76.1 Å²	76.1	43%	0.43	39%	0.387	S	S	.	.			trans	-93.9	123.5	-174.8	-60.2	-171.9	22.1	0	0	111.8	D650 N655	D650-Q653 HydrophobicContact CB-CG 4.17Å; D650-Q653 PolarHBondContact O-N 3.19Å; D650-Q653 VanDerWaalsContact O-N 3.12Å; D650-Q653 PolarHBondContact OD2-NE2 3.24Å; Q653-N655 VanDerWaalsContact C-N 3.28Å; Q653-N655 PolarHBondContact O-N 2.95Å
654	K	47.7	Very low	66.6	Low	198 Å²	198	80 Å²	80	86%	0.861	41%	0.408	S	S	*	.			trans	-76.4	-11.6	178.4	-76.8	-176.1	174.6	178.9	0	114.4	S656	K654-S656 PolarHBondContact O-N 3.27Å
655	N	51.2	Low	66.6	Low	88 Å²	88	80.9 Å²	80.9	47%	0.471	41%	0.414	S	S	.	.			trans	-81.4	52.6	-172.5	-66.8	32.6	0	0	0	111.3	L620 E622 Q653 F657	L620-N655 PolarHBondContact O-ND2 3.48Å; E622-N655 VanDerWaalsContact OE1-CA 3.29Å; E622-N655 WeakPolarHBondContact OE1-CA 3.2Å; E622-N655 WeakPolarHBondContact OE1-CB 3.5Å; Q653-N655 VanDerWaalsContact C-N 3.28Å; Q653-N655 PolarHBondContact O-N 2.95Å; N655-F657 PolarHBondContact O-N 3.5Å
656	S	59.7	Low	66.7	Low	101 Å²	101	79.8 Å²	79.8	71%	0.706	41%	0.407	S	S	*	.			trans	-85.2	98	174	66.7	0	0	0	0	109.6	K654 N658	K654-S656 PolarHBondContact O-N 3.27Å; S656-N658 PolarHBondContact O-N 2.99Å
657	F	68.8	Low	66.7	Low	21 Å²	21	81.1 Å²	81.1	9%	0.092	41%	0.413	C	S	.	.			trans	-45.1	123.9	170.3	-74	-111.4	0	0	0	110.1	E622 V625 W626 F644 N655 P659 I662	E622-F657 HydrophobicContact CB-CE1 4.46Å; E622-F657 HydrophobicContact CB-CZ 4.01Å; E622-F657 HydrophobicContact CG-CE2 3.86Å; E622-F657 HydrophobicContact CG-CZ 3.85Å; V625-F657 HydrophobicContact CB-CE1 4.31Å; V625-F657 HydrophobicContact CB-CZ 3.9Å; V625-F657 HydrophobicContact CG1-CE1 3.76Å; V625-F657 HydrophobicContact CG1-CZ 3.64Å; V625-F657 HydrophobicContact CG2-CZ 4.36Å; W626-F657 HydrophobicContact CD2-CE1 4.42Å; W626-F657 AromaticContact CE2-CD1 3.84Å; W626-F657 AromaticContact CE2-CE1 3.81Å; W626-F657 AromaticContact CZ2-CD1 3.77Å; W626-F657 HydrophobicContact CZ2-CD1 3.77Å; W626-F657 HydrophobicContact CZ2-CE1 4.2Å; W626-F657 AromaticContact NE1-CD1 3.82Å; W626-F657 AromaticContact NE1-CE1 3.55Å; F644-F657 HydrophobicContact CE1-CD1 4.12Å; F644-F657 HydrophobicContact CE1-CE1 4.22Å; N655-F657 PolarHBondContact O-N 3.5Å; F657-P659 WeakPolarHBondContact O-CD 3.35Å; F657-I662 HydrophobicContact CB-CD1 3.58Å; F657-I662 HydrophobicContact CB-CG1 4.29Å; F657-I662 HydrophobicContact CG-CD1 4.38Å
658	N	74.4	Confident	67	Low	68 Å²	68	85.4 Å²	85.4	36%	0.364	43%	0.433	S	S	.	.			trans	-61.9	120.3	-180	-180	16.2	0	0	0	110	S656 D660 D661 I662	S656-N658 PolarHBondContact O-N 2.99Å; N658-D660 PolarHBondContact O-N 3.07Å; N658-D660 VanDerWaalsContact O-N 3.16Å; N658-D660 PolarHBondContact OD1-N 3.45Å; N658-D660 PolarHBondContact OD1-OD2 3.03Å; N658-D661 HydrophobicContact CB-CB 4.3Å; N658-D661 WeakPolarHBondContact CB-OD2 3.5Å; N658-D661 PolarHBondContact ND2-OD2 2.84Å; N658-D661 PolarHBondContact O-N 3.25Å; N658-I662 PolarHBondContact O-N 3.32Å; N658-I662 VanDerWaalsContact O-N 3.16Å
659	P	73.3	Confident	67.8	Low	32 Å²	32	83.3 Å²	83.3	21%	0.208	42%	0.416	C	S	.	.	H	α-helix	trans	-61	-28.3	-178.8	-22.5	32.8	0	0	0	112.9	F657 D661 I662 I663 Y676 L680 Y691	F657-P659 WeakPolarHBondContact O-CD 3.35Å; P659-D661 VanDerWaalsContact C-N 3.32Å; P659-D661 PolarHBondContact O-N 3.05Å; P659-I662 PolarHBondContact O-N 3.46Å; P659-I663 WeakPolarHBondContact O-CB 3.15Å; P659-I663 WeakPolarHBondContact O-CD1 3.47Å; P659-I663 WeakPolarHBondContact O-CG1 3.36Å; P659-I663 PolarHBondContact O-N 3.44Å; P659-Y676 HydrophobicContact CB-CE1 4.47Å; P659-L680 HydrophobicContact CB-CD1 4.06Å; P659-L680 HydrophobicContact CB-CD2 4.5Å; P659-Y691 HydrophobicContact CB-CE2 4.49Å
660	D	75.8	Confident	68.7	Low	53 Å²	53	80.9 Å²	80.9	28%	0.283	41%	0.408	S	S	.	.	H	α-helix	trans	-67.2	-33.3	178.2	-58.2	-45.5	0	0	0	111.7	N658 N664 K688 Y691	N658-D660 PolarHBondContact O-N 3.07Å; N658-D660 VanDerWaalsContact O-N 3.16Å; N658-D660 PolarHBondContact OD1-N 3.45Å; N658-D660 PolarHBondContact OD1-OD2 3.03Å; D660-N664 VanDerWaalsContact O-CG 3.24Å; D660-N664 PolarHBondContact O-N 3.22Å; D660-N664 PolarHBondContact O-ND2 2.99Å; D660-N664 VanDerWaalsContact O-ND2 3.16Å; D660-K688 IonicContact OD1-NZ 2.61Å; D660-K688 PolarHBondContact OD1-NZ 3.19Å; D660-K688 IonicContact OD2-NZ 2.87Å; D660-K688 PolarHBondContact OD2-NZ 3.04Å; D660-Y691 WeakPolarHBondContact OD1-CE1 3.21Å; D660-Y691 PolarHBondContact OD1-OH 3Å
661	D	79.5	Confident	70	Confident	78 Å²	78	82.6 Å²	82.6	42%	0.417	41%	0.412	S	S	.	.	H	α-helix	trans	-80.3	-33.8	177.2	-66	-49	0	0	0	112.5	N658 P659 N664 C665	N658-D661 HydrophobicContact CB-CB 4.3Å; N658-D661 WeakPolarHBondContact CB-OD2 3.5Å; N658-D661 PolarHBondContact ND2-OD2 2.84Å; N658-D661 PolarHBondContact O-N 3.25Å; P659-D661 VanDerWaalsContact C-N 3.32Å; P659-D661 PolarHBondContact O-N 3.05Å; D661-N664 WeakPolarHBondContact O-CB 3.48Å; D661-N664 PolarHBondContact O-N 3.44Å; D661-C665 PolarHBondContact O-N 3.06Å
662	I	80.3	Confident	71.6	Confident	3 Å²	3	73.1 Å²	73.1	2%	0.015	37%	0.368	C	S	.	.	H	α-helix	trans	-62.1	-45.4	167.6	-65.4	166	0	0	0	110	W626 F644 F657 N658 P659 N664 C665 L666 Y676	W626-I662 HydrophobicContact CH2-CG1 4.1Å; F644-I662 HydrophobicContact CB-CD1 4.19Å; F644-I662 HydrophobicContact CB-CG2 4.22Å; F644-I662 HydrophobicContact CD1-CD1 3.53Å; F644-I662 HydrophobicContact CD1-CG1 3.79Å; F644-I662 HydrophobicContact CD1-CG2 4.26Å; F644-I662 HydrophobicContact CD2-CG2 4.12Å; F644-I662 HydrophobicContact CE1-CD1 4.19Å; F644-I662 HydrophobicContact CE1-CG1 4Å; F644-I662 HydrophobicContact CG-CD1 4.07Å; F644-I662 HydrophobicContact CG-CG1 4.33Å; F644-I662 HydrophobicContact CG-CG2 3.94Å; F657-I662 HydrophobicContact CB-CD1 3.58Å; F657-I662 HydrophobicContact CB-CG1 4.29Å; F657-I662 HydrophobicContact CG-CD1 4.38Å; N658-I662 PolarHBondContact O-N 3.32Å; N658-I662 VanDerWaalsContact O-N 3.16Å; P659-I662 PolarHBondContact O-N 3.46Å; I662-N664 VanDerWaalsContact C-N 3.27Å; I662-N664 PolarHBondContact O-N 2.99Å; I662-C665 WeakPolarHBondContact O-CB 3.45Å; I662-C665 PolarHBondContact O-N 2.95Å; I662-C665 VanDerWaalsContact O-N 3.11Å; I662-L666 HydrophobicContact CG2-CD1 3.74Å; I662-L666 HydrophobicContact CG2-CG 4.02Å; I662-L666 WeakPolarHBondContact O-CB 3.43Å; I662-L666 WeakPolarHBondContact O-CG 3.41Å; I662-L666 PolarHBondContact O-N 3.44Å; I662-Y676 HydrophobicContact CB-CE1 3.96Å; I662-Y676 HydrophobicContact CD1-CE2 4.35Å; I662-Y676 VanDerWaalsContact CD1-OH 3.26Å; I662-Y676 WeakPolarHBondContact CD1-OH 3.49Å; I662-Y676 HydrophobicContact CG2-CD1 3.98Å; I662-Y676 HydrophobicContact CG2-CD2 4.23Å; I662-Y676 HydrophobicContact CG2-CE1 3.57Å; I662-Y676 HydrophobicContact CG2-CE2 3.89Å; I662-Y676 HydrophobicContact CG2-CG 4.3Å
663	I	79.1	Confident	73.4	Confident	13 Å²	13	65.1 Å²	65.1	7%	0.067	33%	0.331	C	S	.	.	H	α-helix	trans	-59.1	-39.3	174.1	-70.3	165.1	0	0	0	110.4	P659 C665 L666 K667 L673 Y676 L677 L680 Y691	P659-I663 WeakPolarHBondContact O-CB 3.15Å; P659-I663 WeakPolarHBondContact O-CD1 3.47Å; P659-I663 WeakPolarHBondContact O-CG1 3.36Å; P659-I663 PolarHBondContact O-N 3.44Å; I663-C665 VanDerWaalsContact C-N 3.34Å; I663-C665 PolarHBondContact O-N 2.88Å; I663-L666 PolarHBondContact O-N 3.5Å; I663-K667 WeakPolarHBondContact O-CG 3.5Å; I663-K667 PolarHBondContact O-N 3.35Å; I663-L673 HydrophobicContact CB-CD1 4.46Å; I663-L673 HydrophobicContact CG1-CD1 4.31Å; I663-L673 HydrophobicContact CG2-CD1 4.1Å; I663-Y676 HydrophobicContact CG1-CD1 4.09Å; I663-Y676 HydrophobicContact CG1-CE1 4.03Å; I663-L677 HydrophobicContact CD1-CD2 4.04Å; I663-L680 HydrophobicContact CD1-CD1 4.39Å; I663-Y691 HydrophobicContact CD1-CD1 4.03Å; I663-Y691 HydrophobicContact CD1-CE1 3.76Å
664	N	82.1	Confident	74.8	Confident	84 Å²	84	62.5 Å²	62.5	45%	0.449	32%	0.321	S	S	.	.	H	α-helix	trans	-61	-39.2	174.8	-73.7	-34.5	0	0	0	113.2	D660 D661 I662 K667	D660-N664 VanDerWaalsContact O-CG 3.24Å; D660-N664 PolarHBondContact O-N 3.22Å; D660-N664 PolarHBondContact O-ND2 2.99Å; D660-N664 VanDerWaalsContact O-ND2 3.16Å; D661-N664 WeakPolarHBondContact O-CB 3.48Å; D661-N664 PolarHBondContact O-N 3.44Å; I662-N664 VanDerWaalsContact C-N 3.27Å; I662-N664 PolarHBondContact O-N 2.99Å; N664-K667 PolarHBondContact OD1-NZ 3.29Å
665	C	79.6	Confident	76.4	Confident	25 Å²	25	56.8 Å²	56.8	17%	0.169	30%	0.296	C	S	.	.	H	α-helix	trans	-68	-48.1	173	-171.6	0	0	0	0	112	W626 D661 I662 I663 K667 K668	W626-C665 HydrophobicContact CZ3-CB 3.98Å; D661-C665 PolarHBondContact O-N 3.06Å; I662-C665 WeakPolarHBondContact O-CB 3.45Å; I662-C665 PolarHBondContact O-N 2.95Å; I662-C665 VanDerWaalsContact O-N 3.11Å; I663-C665 VanDerWaalsContact C-N 3.34Å; I663-C665 PolarHBondContact O-N 2.88Å; C665-K667 PolarHBondContact O-N 2.97Å; C665-K668 PolarHBondContact O-N 3.2Å
666	L	79.8	Confident	77.9	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-69.4	-12.9	-176	-65.8	-176.1	0	0	0	114.3	L633 I662 I663 K668 Y669 A672 L673 Y676	L633-L666 HydrophobicContact CD1-CD2 3.73Å; L633-L666 HydrophobicContact CD2-CD2 3.82Å; L633-L666 HydrophobicContact CG-CD2 4.46Å; I662-L666 HydrophobicContact CG2-CD1 3.74Å; I662-L666 HydrophobicContact CG2-CG 4.02Å; I662-L666 WeakPolarHBondContact O-CB 3.43Å; I662-L666 WeakPolarHBondContact O-CG 3.41Å; I662-L666 PolarHBondContact O-N 3.44Å; I663-L666 PolarHBondContact O-N 3.5Å; L666-K668 PolarHBondContact O-N 2.87Å; L666-Y669 CarbonylContact O-C 3.52Å; L666-Y669 PolarHBondContact O-N 3.48Å; L666-Y669 VanDerWaalsContact O-O 3.05Å; L666-A672 HydrophobicContact CD2-CB 3.94Å; L666-L673 HydrophobicContact CB-CB 4.14Å; L666-L673 HydrophobicContact CB-CD1 4.01Å; L666-Y676 VanDerWaalsContact CD1-CB 3.41Å; L666-Y676 HydrophobicContact CD1-CD1 3.8Å; L666-Y676 HydrophobicContact CD1-CD2 4.28Å; L666-Y676 HydrophobicContact CD1-CG 3.57Å
667	K	79.3	Confident	78.8	Confident	128 Å²	128	48.1 Å²	48.1	56%	0.557	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-21.3	170.9	-81.8	165.6	-168.4	168.4	0	114.2	I663 N664 C665	I663-K667 WeakPolarHBondContact O-CG 3.5Å; I663-K667 PolarHBondContact O-N 3.35Å; N664-K667 PolarHBondContact OD1-NZ 3.29Å; C665-K667 PolarHBondContact O-N 2.97Å
668	K	79.1	Confident	79.5	Confident	132 Å²	132	49 Å²	49	57%	0.574	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-23.5	171.9	-65.1	177.5	-177.1	-179.5	0	113.8	D630 C665 L666	D630-K668 IonicContact OD1-NZ 3.03Å; D630-K668 PolarHBondContact OD1-NZ 3.45Å; D630-K668 IonicContact OD2-NZ 2.64Å; C665-K668 PolarHBondContact O-N 3.2Å; L666-K668 PolarHBondContact O-N 2.87Å
669	Y	82.4	Confident	79.9	Confident	29 Å²	29	46.9 Å²	46.9	11%	0.114	23%	0.234	C	C	.	.			trans	-129.2	88.5	-162.5	-58.3	-67.3	0	0	0	109.5	D630 L633 Q634 E637 L666 K671 A672 L673	D630-Y669 PolarHBondContact OD1-OH 3.06Å; L633-Y669 HydrophobicContact CB-CD1 4.41Å; L633-Y669 HydrophobicContact CB-CD2 3.77Å; L633-Y669 HydrophobicContact CB-CE1 4.26Å; L633-Y669 HydrophobicContact CB-CE2 3.58Å; L633-Y669 HydrophobicContact CB-CG 4.2Å; L633-Y669 HydrophobicContact CD1-CD2 3.85Å; L633-Y669 HydrophobicContact CD1-CE2 3.91Å; L633-Y669 HydrophobicContact CG-CD2 4.26Å; L633-Y669 HydrophobicContact CG-CE2 4.35Å; Q634-Y669 HydrophobicContact CG-CE1 4.47Å; Q634-Y669 WeakPolarHBondContact CG-OH 3.47Å; E637-Y669 HydrophobicContact CG-CD1 4.16Å; E637-Y669 HydrophobicContact CG-CG 4.5Å; E637-Y669 WeakPolarHBondContact OE2-CA 3.41Å; L666-Y669 CarbonylContact O-C 3.52Å; L666-Y669 PolarHBondContact O-N 3.48Å; L666-Y669 VanDerWaalsContact O-O 3.05Å; Y669-K671 PolarHBondContact O-N 2.86Å; Y669-A672 WeakPolarHBondContact O-CB 3.31Å; Y669-A672 PolarHBondContact O-N 3.29Å; Y669-L673 PolarHBondContact O-N 3.5Å
670	P	76.7	Confident	80.2	Confident	88 Å²	88	45.5 Å²	45.5	57%	0.571	22%	0.224	S	C	*	.	H	α-helix	trans	-67.5	-34.2	-164	25.7	-34.2	0	0	0	113.9	V674	P670-V674 WeakPolarHBondContact O-CG2 3.11Å; P670-V674 PolarHBondContact O-N 3.43Å
671	K	77.1	Confident	80.4	Confident	122 Å²	122	43.6 Å²	43.6	53%	0.53	21%	0.214	S	C	.	.	H	α-helix	trans	-71.3	-38.7	176.7	-59	177.3	176.5	-177.9	0	110.4	E637 Y669 V674 K675	E637-K671 HydrophobicContact CB-CB 4.44Å; E637-K671 WeakPolarHBondContact OE2-CB 3.45Å; E637-K671 PolarHBondContact OE2-N 3.21Å; Y669-K671 PolarHBondContact O-N 2.86Å; K671-V674 PolarHBondContact O-N 2.9Å; K671-K675 PolarHBondContact O-N 3.02Å
672	A	80.7	Confident	80.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.4	-45.3	176.5	0	0	0	0	0	111.7	L633 E637 V641 L666 Y669 V674 K675 Y676	L633-A672 HydrophobicContact CD2-CB 4.1Å; E637-A672 HydrophobicContact CB-CB 4.08Å; E637-A672 HydrophobicContact CG-CB 4.49Å; E637-A672 PolarHBondContact OE2-N 3.41Å; V641-A672 VanDerWaalsContact CG2-CA 3.42Å; V641-A672 HydrophobicContact CG2-CB 3.36Å; V641-A672 WeakPolarHBondContact CG2-O 3.41Å; L666-A672 HydrophobicContact CD2-CB 3.94Å; Y669-A672 WeakPolarHBondContact O-CB 3.31Å; Y669-A672 PolarHBondContact O-N 3.29Å; A672-V674 PolarHBondContact O-N 3.3Å; A672-K675 PolarHBondContact O-N 2.72Å; A672-Y676 PolarHBondContact O-N 3.05Å
673	L	82.6	Confident	80.1	Confident	12 Å²	12	49.3 Å²	49.3	6%	0.063	24%	0.244	C	C	.	.	H	α-helix	trans	-58.9	-44.1	177.2	-178.9	61.3	0	0	0	112.6	I663 L666 Y669 Y676 L677 L698	I663-L673 HydrophobicContact CB-CD1 4.46Å; I663-L673 HydrophobicContact CG1-CD1 4.31Å; I663-L673 HydrophobicContact CG2-CD1 4.1Å; L666-L673 HydrophobicContact CB-CB 4.14Å; L666-L673 HydrophobicContact CB-CD1 4.01Å; Y669-L673 PolarHBondContact O-N 3.5Å; L673-Y676 PolarHBondContact O-N 3.39Å; L673-L677 HydrophobicContact CD1-CD1 3.98Å; L673-L677 HydrophobicContact CD1-CG 4.25Å; L673-L677 HydrophobicContact CG-CD1 3.96Å; L673-L677 WeakPolarHBondContact O-CB 3.5Å; L673-L677 WeakPolarHBondContact O-CG 3.44Å; L673-L677 PolarHBondContact O-N 3.12Å; L673-L698 HydrophobicContact CD2-CD1 4.14Å; L673-L698 HydrophobicContact CG-CD1 4.25Å
674	V	82.1	Confident	79.8	Confident	37 Å²	37	51.7 Å²	51.7	22%	0.224	25%	0.254	C	S	.	.	H	α-helix	trans	-62.2	-48.5	177.9	173.9	0	0	0	0	111.1	P670 K671 A672 Y676 L677 E678 L695 L698 Y699	P670-V674 WeakPolarHBondContact O-CG2 3.11Å; P670-V674 PolarHBondContact O-N 3.43Å; K671-V674 PolarHBondContact O-N 2.9Å; A672-V674 PolarHBondContact O-N 3.3Å; V674-Y676 VanDerWaalsContact C-N 3.31Å; V674-Y676 PolarHBondContact O-N 3.43Å; V674-L677 PolarHBondContact O-N 3.13Å; V674-E678 HydrophobicContact CG1-CG 4.38Å; V674-E678 WeakPolarHBondContact O-CB 3.36Å; V674-E678 WeakPolarHBondContact O-CG 3.39Å; V674-E678 PolarHBondContact O-N 2.81Å; V674-L695 HydrophobicContact CG1-CD1 4.38Å; V674-L698 HydrophobicContact CG2-CB 4.27Å; V674-L698 HydrophobicContact CG2-CD1 4.15Å; V674-Y699 HydrophobicContact CG1-CE1 4.19Å
675	K	81.3	Confident	79.4	Confident	78 Å²	78	56.6 Å²	56.6	34%	0.339	27%	0.266	S	S	.	.	H	α-helix	trans	-62.9	-35.5	178.6	-69	-165.8	-176.6	-168.5	0	113	E638 V641 K671 A672 H679	E638-K675 WeakPolarHBondContact OE2-CE 3.32Å; E638-K675 IonicContact OE2-NZ 3.94Å; E638-K675 PolarHBondContact OE2-NZ 3.37Å; V641-K675 HydrophobicContact CG1-CB 4.24Å; K671-K675 PolarHBondContact O-N 3.02Å; A672-K675 PolarHBondContact O-N 2.72Å; K675-H679 PolarHBondContact O-N 2.73Å; K675-H679 VanDerWaalsContact O-N 3.14Å
676	Y	82	Confident	79.3	Confident	8 Å²	8	58.2 Å²	58.2	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-67.9	-43.5	175.6	-173.8	-110.2	0	0	0	111.7	F644 T645 P659 I662 I663 L666 A672 L673 V674 H679 L680	F644-Y676 HydrophobicContact CB-CD2 4.07Å; F644-Y676 HydrophobicContact CB-CE2 3.75Å; T645-Y676 HydrophobicContact CG2-CD2 3.72Å; T645-Y676 HydrophobicContact CG2-CE2 4.36Å; P659-Y676 HydrophobicContact CB-CE1 4.47Å; I662-Y676 HydrophobicContact CB-CE1 3.96Å; I662-Y676 HydrophobicContact CD1-CE2 4.35Å; I662-Y676 VanDerWaalsContact CD1-OH 3.26Å; I662-Y676 WeakPolarHBondContact CD1-OH 3.49Å; I662-Y676 HydrophobicContact CG2-CD1 3.98Å; I662-Y676 HydrophobicContact CG2-CD2 4.23Å; I662-Y676 HydrophobicContact CG2-CE1 3.57Å; I662-Y676 HydrophobicContact CG2-CE2 3.89Å; I662-Y676 HydrophobicContact CG2-CG 4.3Å; I663-Y676 HydrophobicContact CG1-CD1 4.09Å; I663-Y676 HydrophobicContact CG1-CE1 4.03Å; L666-Y676 VanDerWaalsContact CD1-CB 3.41Å; L666-Y676 HydrophobicContact CD1-CD1 3.8Å; L666-Y676 HydrophobicContact CD1-CD2 4.28Å; L666-Y676 HydrophobicContact CD1-CG 3.57Å; A672-Y676 PolarHBondContact O-N 3.05Å; L673-Y676 PolarHBondContact O-N 3.39Å; V674-Y676 VanDerWaalsContact C-N 3.31Å; V674-Y676 PolarHBondContact O-N 3.43Å; Y676-H679 PolarHBondContact O-N 3.4Å; Y676-L680 HydrophobicContact CD1-CD1 4.01Å; Y676-L680 HydrophobicContact CD1-CG 4.35Å; Y676-L680 HydrophobicContact CE1-CD1 3.55Å; Y676-L680 HydrophobicContact CE1-CD2 4.33Å; Y676-L680 HydrophobicContact CE1-CG 4.02Å; Y676-L680 HydrophobicContact CE2-CD2 4.44Å; Y676-L680 WeakPolarHBondContact O-CG 3.33Å; Y676-L680 PolarHBondContact O-N 3.49Å
677	L	79.6	Confident	79.1	Confident	0 Å²	0	65 Å²	65	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-67.2	-39.3	175.9	-71.8	168.5	0	0	0	112.5	I663 L673 V674 H679 L680 V681 L695 L698	I663-L677 HydrophobicContact CD1-CD2 4.04Å; L673-L677 HydrophobicContact CD1-CD1 3.98Å; L673-L677 HydrophobicContact CD1-CG 4.25Å; L673-L677 HydrophobicContact CG-CD1 3.96Å; L673-L677 WeakPolarHBondContact O-CB 3.5Å; L673-L677 WeakPolarHBondContact O-CG 3.44Å; L673-L677 PolarHBondContact O-N 3.12Å; V674-L677 PolarHBondContact O-N 3.13Å; L677-H679 VanDerWaalsContact C-N 3.31Å; L677-H679 PolarHBondContact O-N 3.42Å; L677-L680 PolarHBondContact O-N 3.26Å; L677-V681 WeakPolarHBondContact O-CB 3.33Å; L677-V681 WeakPolarHBondContact O-CG2 3.36Å; L677-V681 PolarHBondContact O-N 2.92Å; L677-L695 HydrophobicContact CB-CB 4.26Å; L677-L695 HydrophobicContact CB-CD1 3.97Å; L677-L698 HydrophobicContact CD1-CD1 3.58Å
678	E	83.6	Confident	79.1	Confident	39 Å²	39	63 Å²	63	18%	0.182	30%	0.296	C	S	.	.	H	α-helix	trans	-51.7	-50.8	169.7	-80.9	-179.3	157.4	0	0	110.3	V674 V681 I682 L695 Y699 K723	V674-E678 HydrophobicContact CG1-CG 4.38Å; V674-E678 WeakPolarHBondContact O-CB 3.36Å; V674-E678 WeakPolarHBondContact O-CG 3.39Å; V674-E678 PolarHBondContact O-N 2.81Å; E678-V681 PolarHBondContact O-N 2.98Å; E678-I682 HydrophobicContact CB-CD1 4.38Å; E678-I682 VanDerWaalsContact O-CB 3.24Å; E678-I682 WeakPolarHBondContact O-CB 3.46Å; E678-I682 WeakPolarHBondContact O-CG1 3.35Å; E678-I682 PolarHBondContact O-N 3.1Å; E678-L695 HydrophobicContact CG-CD1 4.27Å; E678-Y699 WeakPolarHBondContact CG-OH 3.33Å; E678-Y699 PolarHBondContact OE1-OH 2.95Å; E678-Y699 VanDerWaalsContact OE1-OH 3.06Å; E678-K723 IonicContact OE1-NZ 3.57Å
679	H	81.9	Confident	79.1	Confident	24 Å²	24	60.6 Å²	60.6	11%	0.111	29%	0.287	C	S	.	.	I	π-helix	trans	-63.3	-44.8	179.1	174.9	73.4	0	0	0	113.7	T645 K675 Y676 L677 V681 D683 K684	T645-H679 HydrophobicContact CG2-CB 3.68Å; T645-H679 PolarHBondContact O-CE1 3.23Å; T645-H679 VanDerWaalsContact O-CE1 3.27Å; T645-H679 PolarHBondContact O-NE2 3.11Å; K675-H679 PolarHBondContact O-N 2.73Å; K675-H679 VanDerWaalsContact O-N 3.14Å; Y676-H679 PolarHBondContact O-N 3.4Å; L677-H679 VanDerWaalsContact C-N 3.31Å; L677-H679 PolarHBondContact O-N 3.42Å; H679-V681 VanDerWaalsContact C-N 3.28Å; H679-V681 PolarHBondContact O-N 3.34Å; H679-D683 IonicContact CE1-OD2 3.38Å; H679-D683 IonicContact CG-OD2 2.66Å; H679-D683 IonicContact ND1-OD2 3.14Å; H679-D683 PolarHBondContact ND1-OD2 2.87Å; H679-D683 WeakPolarHBondContact O-CB 3.37Å; H679-D683 PolarHBondContact O-N 3.09Å; H679-D683 VanDerWaalsContact O-N 3.12Å; H679-K684 WeakPolarHBondContact NE2-CD 3.46Å; H679-K684 WeakPolarHBondContact NE2-CE 3.49Å; H679-K684 PolarHBondContact NE2-NZ 3.07Å; H679-K684 PolarHBondContact O-N 2.85Å
680	L	80.1	Confident	79	Confident	3 Å²	3	64.8 Å²	64.8	2%	0.016	31%	0.307	C	S	.	.	I	π-helix	trans	-61.7	-36.5	177.7	-68.5	-176.2	0	0	0	112.7	P659 I663 Y676 L677 R685 L686 Y691	P659-L680 HydrophobicContact CB-CD1 4.06Å; P659-L680 HydrophobicContact CB-CD2 4.5Å; I663-L680 HydrophobicContact CD1-CD1 4.39Å; Y676-L680 HydrophobicContact CD1-CD1 4.01Å; Y676-L680 HydrophobicContact CD1-CG 4.35Å; Y676-L680 HydrophobicContact CE1-CD1 3.55Å; Y676-L680 HydrophobicContact CE1-CD2 4.33Å; Y676-L680 HydrophobicContact CE1-CG 4.02Å; Y676-L680 HydrophobicContact CE2-CD2 4.44Å; Y676-L680 WeakPolarHBondContact O-CG 3.33Å; Y676-L680 PolarHBondContact O-N 3.49Å; L677-L680 PolarHBondContact O-N 3.26Å; L680-R685 PolarHBondContact O-N 2.79Å; L680-L686 HydrophobicContact CB-CD1 4.3Å; L680-L686 HydrophobicContact CD2-CD1 3.84Å; L680-L686 HydrophobicContact CG-CD1 4.49Å; L680-L686 PolarHBondContact O-N 3.49Å; L680-Y691 HydrophobicContact CD1-CD2 4.04Å; L680-Y691 HydrophobicContact CD1-CE2 4.01Å
681	V	79.3	Confident	79.2	Confident	12 Å²	12	61.1 Å²	61.1	7%	0.073	28%	0.282	C	S	.	.	I	π-helix	trans	-86.9	-42.8	-174.7	166.1	0	0	0	0	112.6	L677 E678 H679 R685 L695 L727	L677-V681 WeakPolarHBondContact O-CB 3.33Å; L677-V681 WeakPolarHBondContact O-CG2 3.36Å; L677-V681 PolarHBondContact O-N 2.92Å; E678-V681 PolarHBondContact O-N 2.98Å; H679-V681 VanDerWaalsContact C-N 3.28Å; H679-V681 PolarHBondContact O-N 3.34Å; V681-R685 WeakPolarHBondContact O-CA 3.49Å; V681-L695 HydrophobicContact CB-CD2 3.96Å; V681-L695 HydrophobicContact CG1-CD2 4.06Å; V681-L695 HydrophobicContact CG2-CD2 4.03Å; V681-L727 HydrophobicContact CG1-CD1 3.65Å
682	I	77.6	Confident	79.4	Confident	95 Å²	95	55.6 Å²	55.6	49%	0.487	26%	0.258	S	S	.	.	I	π-helix	trans	-91.7	-49.4	-171.7	-59.2	171.8	0	0	0	111.1	E678 R685	E678-I682 HydrophobicContact CB-CD1 4.38Å; E678-I682 VanDerWaalsContact O-CB 3.24Å; E678-I682 WeakPolarHBondContact O-CB 3.46Å; E678-I682 WeakPolarHBondContact O-CG1 3.35Å; E678-I682 PolarHBondContact O-N 3.1Å; I682-R685 WeakPolarHBondContact O-CG 3.44Å
683	D	76.1	Confident	79.6	Confident	107 Å²	107	56.3 Å²	56.3	57%	0.572	26%	0.262	S	S	*	.	I	π-helix	trans	-85.2	-55.6	-173.9	-54.6	-29.9	0	0	0	111	H679 R685	H679-D683 IonicContact CE1-OD2 3.38Å; H679-D683 IonicContact CG-OD2 2.66Å; H679-D683 IonicContact ND1-OD2 3.14Å; H679-D683 PolarHBondContact ND1-OD2 2.87Å; H679-D683 WeakPolarHBondContact O-CB 3.37Å; H679-D683 PolarHBondContact O-N 3.09Å; H679-D683 VanDerWaalsContact O-N 3.12Å; D683-R685 VanDerWaalsContact C-N 3.32Å; D683-R685 PolarHBondContact O-N 3.25Å
684	K	73.4	Confident	79.5	Confident	62 Å²	62	58.9 Å²	58.9	27%	0.27	27%	0.274	S	S	.	.	S	Bend	trans	-81.2	-8.6	-180	-69.4	-174.4	173.8	169	0	113.8	H679 L686	H679-K684 WeakPolarHBondContact NE2-CD 3.46Å; H679-K684 WeakPolarHBondContact NE2-CE 3.49Å; H679-K684 PolarHBondContact NE2-NZ 3.07Å; H679-K684 PolarHBondContact O-N 2.85Å; K684-L686 HydrophobicContact CB-CD2 4.48Å; K684-L686 HydrophobicContact CB-CG 4.18Å; K684-L686 PolarHBondContact O-N 3.38Å
685	R	74.2	Confident	79.6	Confident	188 Å²	188	57.1 Å²	57.1	71%	0.709	26%	0.264	S	S	*	.			trans	48.5	34.8	174.3	-57.7	-175.1	-177.4	-173.1	3.2	114.5	L680 V681 I682 D683 Q687	L680-R685 PolarHBondContact O-N 2.79Å; V681-R685 WeakPolarHBondContact O-CA 3.49Å; I682-R685 WeakPolarHBondContact O-CG 3.44Å; D683-R685 VanDerWaalsContact C-N 3.32Å; D683-R685 PolarHBondContact O-N 3.25Å; R685-Q687 PolarHBondContact O-N 3.43Å; R685-Q687 PolarHBondContact O-NE2 3.2Å
686	L	76.8	Confident	79.6	Confident	59 Å²	59	53.4 Å²	53.4	31%	0.309	25%	0.247	S	C	.	.			trans	-62.2	136.8	-174.4	-65.9	-175.7	0	0	0	111.3	L680 K684 K688 Y691 H692	L680-L686 HydrophobicContact CB-CD1 4.3Å; L680-L686 HydrophobicContact CD2-CD1 3.84Å; L680-L686 HydrophobicContact CG-CD1 4.49Å; L680-L686 PolarHBondContact O-N 3.49Å; K684-L686 HydrophobicContact CB-CD2 4.48Å; K684-L686 HydrophobicContact CB-CG 4.18Å; K684-L686 PolarHBondContact O-N 3.38Å; L686-K688 VanDerWaalsContact C-N 3.31Å; L686-K688 PolarHBondContact O-N 2.86Å; L686-Y691 HydrophobicContact CB-CD2 4.42Å; L686-Y691 HydrophobicContact CD1-CD2 4.33Å; L686-Y691 HydrophobicContact CD1-CE2 3.92Å; L686-H692 PolarHBondContact O-NE2 2.96Å
687	Q	74.8	Confident	79.7	Confident	141 Å²	141	53.7 Å²	53.7	66%	0.659	25%	0.25	S	C	*	.			trans	-87.6	7.4	-172.2	-54.9	-70	-78.6	0	0	113.7	R685 E689 L733	R685-Q687 PolarHBondContact O-N 3.43Å; R685-Q687 PolarHBondContact O-NE2 3.2Å; Q687-E689 PolarHBondContact O-N 3.07Å; Q687-L733 HydrophobicContact CB-CD1 4.09Å; Q687-L733 HydrophobicContact CG-CD1 4.44Å
688	K	79.1	Confident	79.9	Confident	86 Å²	86	55.3 Å²	55.3	37%	0.374	26%	0.258	S	S	.	.			trans	-70.9	110.2	177.1	-95.7	-173.7	168.2	-160.5	0	110.5	D660 L686 E690 Y691 H692	D660-K688 IonicContact OD1-NZ 2.61Å; D660-K688 PolarHBondContact OD1-NZ 3.19Å; D660-K688 IonicContact OD2-NZ 2.87Å; D660-K688 PolarHBondContact OD2-NZ 3.04Å; L686-K688 VanDerWaalsContact C-N 3.31Å; L686-K688 PolarHBondContact O-N 2.86Å; K688-E690 PolarHBondContact O-N 3.1Å; K688-E690 VanDerWaalsContact O-N 3.09Å; K688-Y691 HydrophobicContact CB-CD2 3.85Å; K688-Y691 HydrophobicContact CB-CE2 3.94Å; K688-Y691 HydrophobicContact CB-CG 4.22Å; K688-Y691 HydrophobicContact CD-CD2 4.27Å; K688-Y691 HydrophobicContact CD-CE1 3.87Å; K688-Y691 HydrophobicContact CD-CE2 3.54Å; K688-Y691 VanDerWaalsContact CD-OH 3.26Å; K688-Y691 WeakPolarHBondContact CD-OH 3.48Å; K688-Y691 HydrophobicContact CG-CE2 4.35Å; K688-Y691 PolarHBondContact NZ-OH 3Å; K688-Y691 PolarHBondContact O-N 2.93Å; K688-Y691 VanDerWaalsContact O-N 3.15Å; K688-H692 PolarHBondContact O-CD2 3.47Å
689	E	80	Confident	79.9	Confident	82 Å²	82	53.9 Å²	53.9	38%	0.383	25%	0.251	S	S	.	.	H	α-helix	trans	-51.1	-33.6	-179	-172.9	-164.2	121.6	0	0	114.4	Q687 Y691 T693 L733 R735	Q687-E689 PolarHBondContact O-N 3.07Å; E689-Y691 PolarHBondContact O-N 3.16Å; E689-T693 WeakPolarHBondContact O-CB 3.34Å; E689-T693 PolarHBondContact O-N 3.25Å; E689-T693 PolarHBondContact O-OG1 3.35Å; E689-L733 VanDerWaalsContact CA-O 3.26Å; E689-L733 WeakPolarHBondContact CA-O 3.49Å; E689-R735 WeakPolarHBondContact OE1-CG 3.42Å; E689-R735 IonicContact OE1-CZ 3.21Å; E689-R735 IonicContact OE1-NE 2.73Å; E689-R735 PolarHBondContact OE1-NE 3.4Å; E689-R735 IonicContact OE1-NH2 2.9Å; E689-R735 PolarHBondContact OE1-NH2 3.1Å
690	E	80.1	Confident	79.8	Confident	117 Å²	117	52.9 Å²	52.9	55%	0.547	25%	0.247	S	C	.	.	H	α-helix	trans	-65.4	-37.7	-177.2	-60.1	-176.8	150.2	0	0	112.3	K688 T693 H694	K688-E690 PolarHBondContact O-N 3.1Å; K688-E690 VanDerWaalsContact O-N 3.09Å; E690-T693 PolarHBondContact O-N 3.26Å; E690-H694 VanDerWaalsContact O-CB 3.26Å; E690-H694 WeakPolarHBondContact O-CB 3.38Å; E690-H694 PolarHBondContact O-N 2.89Å
691	Y	81.7	Confident	79.9	Confident	11 Å²	11	55.8 Å²	55.8	4%	0.043	26%	0.26	C	S	.	.	H	α-helix	trans	-71.5	-42.8	-177.9	-57.9	-19.1	0	0	0	112.1	P659 D660 I663 L680 L686 K688 E689 T693 H694 L695	P659-Y691 HydrophobicContact CB-CE2 4.49Å; D660-Y691 WeakPolarHBondContact OD1-CE1 3.21Å; D660-Y691 PolarHBondContact OD1-OH 3Å; I663-Y691 HydrophobicContact CD1-CD1 4.03Å; I663-Y691 HydrophobicContact CD1-CE1 3.76Å; L680-Y691 HydrophobicContact CD1-CD2 4.04Å; L680-Y691 HydrophobicContact CD1-CE2 4.01Å; L686-Y691 HydrophobicContact CB-CD2 4.42Å; L686-Y691 HydrophobicContact CD1-CD2 4.33Å; L686-Y691 HydrophobicContact CD1-CE2 3.92Å; K688-Y691 HydrophobicContact CB-CD2 3.85Å; K688-Y691 HydrophobicContact CB-CE2 3.94Å; K688-Y691 HydrophobicContact CB-CG 4.22Å; K688-Y691 HydrophobicContact CD-CD2 4.27Å; K688-Y691 HydrophobicContact CD-CE1 3.87Å; K688-Y691 HydrophobicContact CD-CE2 3.54Å; K688-Y691 VanDerWaalsContact CD-OH 3.26Å; K688-Y691 WeakPolarHBondContact CD-OH 3.48Å; K688-Y691 HydrophobicContact CG-CE2 4.35Å; K688-Y691 PolarHBondContact NZ-OH 3Å; K688-Y691 PolarHBondContact O-N 2.93Å; K688-Y691 VanDerWaalsContact O-N 3.15Å; E689-Y691 PolarHBondContact O-N 3.16Å; Y691-T693 VanDerWaalsContact C-N 3.35Å; Y691-H694 PolarHBondContact O-N 2.99Å; Y691-L695 WeakPolarHBondContact O-CB 3.09Å; Y691-L695 PolarHBondContact O-N 3.25Å
692	H	81.4	Confident	80	Confident	7 Å²	7	59.2 Å²	59.2	3%	0.032	28%	0.275	C	S	.	.	H	α-helix	trans	-64.5	-42.3	175.2	-65.7	-107.8	0	0	0	110.7	L686 K688 A696 S731 L733	L686-H692 PolarHBondContact O-NE2 2.96Å; K688-H692 PolarHBondContact O-CD2 3.47Å; H692-A696 VanDerWaalsContact O-CB 3.28Å; H692-A696 WeakPolarHBondContact O-CB 3.31Å; H692-A696 PolarHBondContact O-N 2.93Å; H692-S731 PolarHBondContact CE1-OG 2.91Å; H692-S731 VanDerWaalsContact CE1-OG 3.32Å; H692-S731 PolarHBondContact ND1-OG 2.72Å; H692-L733 VanDerWaalsContact CB-O 3.28Å; H692-L733 WeakPolarHBondContact CB-O 3.47Å
693	T	83.8	Confident	80.2	Confident	14 Å²	14	54.8 Å²	54.8	9%	0.086	25%	0.253	C	S	.	.	H	α-helix	trans	-63.9	-42.4	176.2	-55.4	0	0	0	0	111.2	E689 E690 Y691 V697 Y734 R735 F738	E689-T693 WeakPolarHBondContact O-CB 3.34Å; E689-T693 PolarHBondContact O-N 3.25Å; E689-T693 PolarHBondContact O-OG1 3.35Å; E690-T693 PolarHBondContact O-N 3.26Å; Y691-T693 VanDerWaalsContact C-N 3.35Å; T693-V697 WeakPolarHBondContact O-CB 3.08Å; T693-V697 VanDerWaalsContact O-CG2 3.26Å; T693-V697 WeakPolarHBondContact O-CG2 3.24Å; T693-V697 PolarHBondContact O-N 2.96Å; T693-Y734 WeakPolarHBondContact OG1-CA 3.17Å; T693-R735 HydrophobicContact CG2-CB 4.09Å; T693-R735 HydrophobicContact CG2-CG 4.33Å; T693-R735 PolarHBondContact OG1-N 3.1Å; T693-R735 VanDerWaalsContact OG1-N 3.13Å; T693-F738 HydrophobicContact CG2-CD1 4.19Å
694	H	80.9	Confident	80.3	Confident	67 Å²	67	52.6 Å²	52.6	31%	0.31	24%	0.241	S	C	.	.	H	α-helix	trans	-67.1	-43.1	178.4	-168.8	17.1	0	0	0	112.3	E690 Y691 V697 L698	E690-H694 VanDerWaalsContact O-CB 3.26Å; E690-H694 WeakPolarHBondContact O-CB 3.38Å; E690-H694 PolarHBondContact O-N 2.89Å; Y691-H694 PolarHBondContact O-N 2.99Å; H694-V697 WeakPolarHBondContact O-CB 3.27Å; H694-V697 PolarHBondContact O-N 3.5Å; H694-L698 WeakPolarHBondContact O-CG 3.33Å; H694-L698 PolarHBondContact O-N 2.94Å
695	L	83.4	Confident	80.5	Confident	0 Å²	0	56 Å²	56	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.4	-44	175.4	-178.4	60.7	0	0	0	111.9	V674 L677 E678 V681 Y691 V697 L698 Y699 L727	V674-L695 HydrophobicContact CG1-CD1 4.38Å; L677-L695 HydrophobicContact CB-CB 4.26Å; L677-L695 HydrophobicContact CB-CD1 3.97Å; E678-L695 HydrophobicContact CG-CD1 4.27Å; V681-L695 HydrophobicContact CB-CD2 3.96Å; V681-L695 HydrophobicContact CG1-CD2 4.06Å; V681-L695 HydrophobicContact CG2-CD2 4.03Å; Y691-L695 WeakPolarHBondContact O-CB 3.09Å; Y691-L695 PolarHBondContact O-N 3.25Å; L695-V697 VanDerWaalsContact C-N 3.28Å; L695-V697 PolarHBondContact O-N 2.93Å; L695-L698 PolarHBondContact O-N 2.94Å; L695-Y699 HydrophobicContact CD1-CD1 4.47Å; L695-Y699 HydrophobicContact CD1-CD2 4.39Å; L695-Y699 HydrophobicContact CD1-CE1 4.08Å; L695-Y699 HydrophobicContact CD1-CE2 4Å; L695-Y699 HydrophobicContact CD2-CE2 4.19Å; L695-Y699 HydrophobicContact CG-CD2 4.16Å; L695-Y699 HydrophobicContact CG-CE2 3.81Å; L695-Y699 PolarHBondContact O-N 3.41Å; L695-L727 HydrophobicContact CB-CD2 4.33Å; L695-L727 HydrophobicContact CD2-CD2 4Å; L695-L727 HydrophobicContact CG-CD2 3.94Å
696	A	82.3	Confident	80.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.4	-35.7	175.7	0	0	0	0	0	112.3	H692 L700 L724 L727 L728 L739	H692-A696 VanDerWaalsContact O-CB 3.28Å; H692-A696 WeakPolarHBondContact O-CB 3.31Å; H692-A696 PolarHBondContact O-N 2.93Å; A696-L700 VanDerWaalsContact O-CB 3.27Å; A696-L700 WeakPolarHBondContact O-CB 3.48Å; A696-L700 PolarHBondContact O-N 3.37Å; A696-L724 HydrophobicContact CB-CD1 4.45Å; A696-L727 HydrophobicContact CB-CD2 4.02Å; A696-L728 HydrophobicContact CB-CD2 4.46Å; A696-L739 HydrophobicContact CB-CD1 3.86Å; A696-L739 HydrophobicContact CB-CD2 4.11Å
697	V	84.4	Confident	80.3	Confident	13 Å²	13	50.8 Å²	50.8	8%	0.079	24%	0.236	C	C	.	.	H	α-helix	trans	-66.8	-47.1	173.1	164.6	0	0	0	0	112	T693 H694 L695 L700 E701 F738 L739	T693-V697 WeakPolarHBondContact O-CB 3.08Å; T693-V697 VanDerWaalsContact O-CG2 3.26Å; T693-V697 WeakPolarHBondContact O-CG2 3.24Å; T693-V697 PolarHBondContact O-N 2.96Å; H694-V697 WeakPolarHBondContact O-CB 3.27Å; H694-V697 PolarHBondContact O-N 3.5Å; L695-V697 VanDerWaalsContact C-N 3.28Å; L695-V697 PolarHBondContact O-N 2.93Å; V697-L700 PolarHBondContact O-N 3.14Å; V697-L700 VanDerWaalsContact O-N 3.14Å; V697-E701 HydrophobicContact CG1-CG 4.35Å; V697-E701 VanDerWaalsContact CG1-OE1 3.23Å; V697-E701 WeakPolarHBondContact CG1-OE1 3.5Å; V697-E701 WeakPolarHBondContact O-CG 3.41Å; V697-E701 PolarHBondContact O-N 3.49Å; V697-F738 HydrophobicContact CG2-CD1 4.43Å; V697-F738 HydrophobicContact CG2-CE1 3.83Å; V697-L739 HydrophobicContact CG2-CD2 4.06Å
698	L	83	Confident	79.9	Confident	35 Å²	35	48 Å²	48	18%	0.183	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-43.2	179.8	-70.7	169.9	0	0	0	111.6	L673 V674 L677 H694 L695 L700 E701 E702	L673-L698 HydrophobicContact CD2-CD1 4.14Å; L673-L698 HydrophobicContact CG-CD1 4.25Å; V674-L698 HydrophobicContact CG2-CB 4.27Å; V674-L698 HydrophobicContact CG2-CD1 4.15Å; L677-L698 HydrophobicContact CD1-CD1 3.58Å; H694-L698 WeakPolarHBondContact O-CG 3.33Å; H694-L698 PolarHBondContact O-N 2.94Å; L695-L698 PolarHBondContact O-N 2.94Å; L698-L700 VanDerWaalsContact C-N 3.33Å; L698-L700 PolarHBondContact O-N 3.4Å; L698-E701 PolarHBondContact O-N 3.2Å; L698-E702 WeakPolarHBondContact O-CB 3.4Å; L698-E702 PolarHBondContact O-N 3.24Å
699	Y	83.1	Confident	79.2	Confident	9 Å²	9	48.3 Å²	48.3	4%	0.035	25%	0.25	C	S	.	.	H	α-helix	trans	-60.5	-39.7	171.6	-74.1	-29	0	0	0	112.8	V674 E678 L695 V703 K723 L724 L727	V674-Y699 HydrophobicContact CG1-CE1 4.19Å; E678-Y699 WeakPolarHBondContact CG-OH 3.33Å; E678-Y699 PolarHBondContact OE1-OH 2.95Å; E678-Y699 VanDerWaalsContact OE1-OH 3.06Å; L695-Y699 HydrophobicContact CD1-CD1 4.47Å; L695-Y699 HydrophobicContact CD1-CD2 4.39Å; L695-Y699 HydrophobicContact CD1-CE1 4.08Å; L695-Y699 HydrophobicContact CD1-CE2 4Å; L695-Y699 HydrophobicContact CD2-CE2 4.19Å; L695-Y699 HydrophobicContact CG-CD2 4.16Å; L695-Y699 HydrophobicContact CG-CE2 3.81Å; L695-Y699 PolarHBondContact O-N 3.41Å; Y699-V703 WeakPolarHBondContact O-CB 3.42Å; Y699-V703 VanDerWaalsContact O-CG2 3.24Å; Y699-V703 WeakPolarHBondContact O-CG2 3.46Å; Y699-V703 PolarHBondContact O-N 2.96Å; Y699-K723 HydrophobicContact CE1-CB 4.15Å; Y699-K723 HydrophobicContact CE1-CD 4.27Å; Y699-K723 HydrophobicContact CE2-CB 4.11Å; Y699-L724 HydrophobicContact CD2-CB 4.32Å; Y699-L724 HydrophobicContact CD2-CD1 4.28Å; Y699-L727 HydrophobicContact CD2-CD2 3.91Å; Y699-L727 HydrophobicContact CE2-CB 4.36Å; Y699-L727 HydrophobicContact CE2-CD2 3.86Å
700	L	81.4	Confident	78.2	Confident	3 Å²	3	49 Å²	49	2%	0.016	26%	0.26	C	S	.	.	H	α-helix	trans	-68	-42.3	178.3	177.8	58.7	0	0	0	111.6	A696 V697 L698 V703 L704 R742 L743 L748	A696-L700 VanDerWaalsContact O-CB 3.27Å; A696-L700 WeakPolarHBondContact O-CB 3.48Å; A696-L700 PolarHBondContact O-N 3.37Å; V697-L700 PolarHBondContact O-N 3.14Å; V697-L700 VanDerWaalsContact O-N 3.14Å; L698-L700 VanDerWaalsContact C-N 3.33Å; L698-L700 PolarHBondContact O-N 3.4Å; L700-V703 PolarHBondContact O-N 3.29Å; L700-L704 HydrophobicContact CD1-CD1 4.01Å; L700-L704 HydrophobicContact CD1-CG 4.18Å; L700-L704 HydrophobicContact CG-CD1 3.98Å; L700-L704 WeakPolarHBondContact O-CB 3.19Å; L700-L704 WeakPolarHBondContact O-CD1 3.3Å; L700-L704 WeakPolarHBondContact O-CG 3.5Å; L700-L704 PolarHBondContact O-N 2.96Å; L700-R742 HydrophobicContact CD2-CB 4.14Å; L700-R742 HydrophobicContact CD2-CG 3.98Å; L700-L743 HydrophobicContact CD1-CD2 3.61Å; L700-L743 HydrophobicContact CD1-CG 4.45Å; L700-L743 HydrophobicContact CD2-CD2 4.23Å; L700-L743 HydrophobicContact CD2-CG 4.2Å; L700-L748 HydrophobicContact CD1-CD1 3.7Å
701	E	82	Confident	76.8	Confident	64 Å²	64	49.3 Å²	49.3	30%	0.299	28%	0.275	S	S	.	.	H	α-helix	trans	-62.5	-44.9	175.7	-72.9	173.5	-172.1	0	0	111.5	V697 L698 L704 Q705 R742	V697-E701 HydrophobicContact CG1-CG 4.35Å; V697-E701 VanDerWaalsContact CG1-OE1 3.23Å; V697-E701 WeakPolarHBondContact CG1-OE1 3.5Å; V697-E701 WeakPolarHBondContact O-CG 3.41Å; V697-E701 PolarHBondContact O-N 3.49Å; L698-E701 PolarHBondContact O-N 3.2Å; E701-L704 PolarHBondContact O-N 3.06Å; E701-Q705 WeakPolarHBondContact O-CG 3.35Å; E701-Q705 PolarHBondContact O-N 3.27Å; E701-R742 IonicContact OE1-CZ 2.66Å; E701-R742 IonicContact OE1-NH1 3.43Å; E701-R742 PolarHBondContact OE1-NH1 3.22Å; E701-R742 IonicContact OE1-NH2 2.81Å; E701-R742 PolarHBondContact OE1-NH2 3.09Å
702	E	80.6	Confident	75.2	Confident	83 Å²	83	51.7 Å²	51.7	39%	0.388	30%	0.303	S	S	.	.	H	α-helix	trans	-61.3	-48.5	175.4	-178.1	61.9	-146.5	0	0	111.7	L698 L704 Q705 Q706 T720	L698-E702 WeakPolarHBondContact O-CB 3.4Å; L698-E702 PolarHBondContact O-N 3.24Å; E702-L704 VanDerWaalsContact C-N 3.28Å; E702-L704 PolarHBondContact O-N 3.37Å; E702-Q705 PolarHBondContact O-N 2.66Å; E702-Q706 WeakPolarHBondContact O-CB 3.16Å; E702-Q706 VanDerWaalsContact O-CG 3.3Å; E702-Q706 WeakPolarHBondContact O-CG 3.48Å; E702-Q706 PolarHBondContact O-N 2.96Å; E702-Q706 PolarHBondContact OE1-NE2 2.98Å; E702-T720 HydrophobicContact CG-CG2 4Å
703	V	81.1	Confident	73.3	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.012	35%	0.346	C	S	.	.	H	α-helix	trans	-62.7	-34.5	177.1	168.7	0	0	0	0	111.8	Y699 L700 R707 T720 Q721 L748	Y699-V703 WeakPolarHBondContact O-CB 3.42Å; Y699-V703 VanDerWaalsContact O-CG2 3.24Å; Y699-V703 WeakPolarHBondContact O-CG2 3.46Å; Y699-V703 PolarHBondContact O-N 2.96Å; L700-V703 PolarHBondContact O-N 3.29Å; V703-R707 WeakPolarHBondContact O-CB 3.34Å; V703-R707 VanDerWaalsContact O-CG 3.28Å; V703-R707 WeakPolarHBondContact O-CG 3.16Å; V703-R707 PolarHBondContact O-N 3.42Å; V703-R707 VanDerWaalsContact O-N 3.08Å; V703-T720 WeakPolarHBondContact CG2-OG1 3.43Å; V703-Q721 HydrophobicContact CG1-CB 4.36Å; V703-Q721 HydrophobicContact CG2-CB 3.95Å; V703-L748 HydrophobicContact CG1-CD2 4.45Å
704	L	78.9	Confident	71.5	Confident	61 Å²	61	64.5 Å²	64.5	32%	0.319	38%	0.379	S	S	.	.	H	α-helix	trans	-70.4	-40.9	174.8	-74.7	168.6	0	0	0	112.3	L700 E701 E702 R707 A708 A746	L700-L704 HydrophobicContact CD1-CD1 4.01Å; L700-L704 HydrophobicContact CD1-CG 4.18Å; L700-L704 HydrophobicContact CG-CD1 3.98Å; L700-L704 WeakPolarHBondContact O-CB 3.19Å; L700-L704 WeakPolarHBondContact O-CD1 3.3Å; L700-L704 WeakPolarHBondContact O-CG 3.5Å; L700-L704 PolarHBondContact O-N 2.96Å; E701-L704 PolarHBondContact O-N 3.06Å; E702-L704 VanDerWaalsContact C-N 3.28Å; E702-L704 PolarHBondContact O-N 3.37Å; L704-R707 PolarHBondContact O-N 3.26Å; L704-A708 WeakPolarHBondContact O-CB 3.05Å; L704-A708 PolarHBondContact O-N 3.19Å; L704-A746 HydrophobicContact CD2-CB 4.06Å
705	Q	77.8	Confident	69.8	Low	135 Å²	135	65.7 Å²	65.7	63%	0.631	40%	0.4	S	S	*	.	H	α-helix	trans	-64.8	-45.1	174.3	-72.6	-171.3	18.6	0	0	111.9	E701 E702 R707 A708 S709	E701-Q705 WeakPolarHBondContact O-CG 3.35Å; E701-Q705 PolarHBondContact O-N 3.27Å; E702-Q705 PolarHBondContact O-N 2.66Å; Q705-R707 VanDerWaalsContact C-N 3.26Å; Q705-R707 PolarHBondContact O-N 3.04Å; Q705-A708 PolarHBondContact O-N 3.23Å; Q705-A708 VanDerWaalsContact O-N 3.15Å; Q705-S709 PolarHBondContact O-N 2.62Å; Q705-S709 VanDerWaalsContact O-N 3.11Å; Q705-S709 PolarHBondContact O-OG 3.04Å
706	Q	74.8	Confident	68.3	Low	53 Å²	53	74.5 Å²	74.5	25%	0.248	44%	0.441	C	S	.	.	H	α-helix	trans	-61.1	-33.7	176.2	-69.9	179.5	7.2	0	0	112.4	E702 S709 T710 S718 T720	E702-Q706 WeakPolarHBondContact O-CB 3.16Å; E702-Q706 VanDerWaalsContact O-CG 3.3Å; E702-Q706 WeakPolarHBondContact O-CG 3.48Å; E702-Q706 PolarHBondContact O-N 2.96Å; E702-Q706 PolarHBondContact OE1-NE2 2.98Å; Q706-S709 PolarHBondContact O-OG 3.21Å; Q706-S709 VanDerWaalsContact O-OG 3.07Å; Q706-T710 WeakPolarHBondContact O-CB 3.23Å; Q706-T710 WeakPolarHBondContact O-CG2 3.46Å; Q706-T710 PolarHBondContact O-N 2.92Å; Q706-T710 PolarHBondContact O-OG1 2.96Å; Q706-S718 VanDerWaalsContact OE1-CB 3.28Å; Q706-S718 PolarHBondContact OE1-OG 3.02Å; Q706-T720 PolarHBondContact OE1-OG1 2.85Å
707	R	71	Confident	67.1	Low	84 Å²	84	77.2 Å²	77.2	32%	0.317	46%	0.464	S	S	.	.	H	α-helix	trans	-75.3	-35.6	173.3	-76.2	174.1	170.6	-136	-6.5	113.1	V703 L704 Q705 S709 T710 G747 L748	V703-R707 WeakPolarHBondContact O-CB 3.34Å; V703-R707 VanDerWaalsContact O-CG 3.28Å; V703-R707 WeakPolarHBondContact O-CG 3.16Å; V703-R707 PolarHBondContact O-N 3.42Å; V703-R707 VanDerWaalsContact O-N 3.08Å; L704-R707 PolarHBondContact O-N 3.26Å; Q705-R707 VanDerWaalsContact C-N 3.26Å; Q705-R707 PolarHBondContact O-N 3.04Å; R707-S709 VanDerWaalsContact C-N 3.27Å; R707-S709 PolarHBondContact O-N 2.8Å; R707-T710 WeakPolarHBondContact CA-OG1 3.48Å; R707-T710 PolarHBondContact O-N 3.25Å; R707-G747 PolarHBondContact NH1-O 3.16Å; R707-L748 VanDerWaalsContact CZ-CD2 3.43Å
708	A	68	Low	66.3	Low	83 Å²	83	78.6 Å²	78.6	69%	0.686	47%	0.474	S	S	*	.	H	α-helix	trans	-65.4	-29.8	176.4	0	0	0	0	0	112.8	L704 Q705	L704-A708 WeakPolarHBondContact O-CB 3.05Å; L704-A708 PolarHBondContact O-N 3.19Å; Q705-A708 PolarHBondContact O-N 3.23Å; Q705-A708 VanDerWaalsContact O-N 3.15Å
709	S	64.1	Low	66	Low	91 Å²	91	82.8 Å²	82.8	64%	0.636	49%	0.492	S	S	*	.	H	α-helix	trans	-85.5	-13.5	175.9	59.5	0	0	0	0	114.8	Q705 Q706 R707	Q705-S709 PolarHBondContact O-N 2.62Å; Q705-S709 VanDerWaalsContact O-N 3.11Å; Q705-S709 PolarHBondContact O-OG 3.04Å; Q706-S709 PolarHBondContact O-OG 3.21Å; Q706-S709 VanDerWaalsContact O-OG 3.07Å; R707-S709 VanDerWaalsContact C-N 3.27Å; R707-S709 PolarHBondContact O-N 2.8Å
710	T	58.7	Low	65.6	Low	97 Å²	97	83.6 Å²	83.6	60%	0.595	50%	0.498	S	S	*	.			trans	-111.2	51.1	-173.8	51.3	0	0	0	0	113.2	Q706 R707 G712	Q706-T710 WeakPolarHBondContact O-CB 3.23Å; Q706-T710 WeakPolarHBondContact O-CG2 3.46Å; Q706-T710 PolarHBondContact O-N 2.92Å; Q706-T710 PolarHBondContact O-OG1 2.96Å; R707-T710 WeakPolarHBondContact CA-OG1 3.48Å; R707-T710 PolarHBondContact O-N 3.25Å; T710-G712 PolarHBondContact O-N 3.08Å
711	S	51.3	Low	65.4	Low	123 Å²	123	83.8 Å²	83.8	86%	0.86	50%	0.499	S	S	*	.			trans	-72.6	33.2	-173	75.3	0	0	0	0	116
712	G	47.6	Very low	65.4	Low	61 Å²	61	82.4 Å²	82.4	63%	0.629	50%	0.499	S	S	*	.	S	Bend	trans	-161.9	79.1	-167.4	0	0	0	0	0	117.7	T710	T710-G712 PolarHBondContact O-N 3.08Å
713	K	41.9	Very low	65.5	Low	217 Å²	217	81.1 Å²	81.1	94%	0.943	49%	0.492	S	S	*	.	S	Bend	trans	67.3	138.6	168.4	-58.7	179.5	177	179.2	0	116.7
714	G	44.7	Very low	65.7	Low	74 Å²	74	81.3 Å²	81.3	76%	0.763	49%	0.493	S	S	*	.			trans	74.9	62.6	165.4	0	0	0	0	0	114.6	E716	G714-E716 VanDerWaalsContact C-N 3.32Å; G714-E716 PolarHBondContact O-N 2.97Å
715	A	45.2	Very low	66	Low	91 Å²	91	82 Å²	82	75%	0.752	49%	0.491	S	S	*	.			trans	-74.4	82.3	174.4	0	0	0	0	0	111.3
716	E	52.1	Low	66.2	Low	185 Å²	185	81.5 Å²	81.5	86%	0.864	48%	0.483	S	S	*	.			trans	-57.4	143	159	-67.8	-170.5	143.8	0	0	109.5	G714 S718	G714-E716 VanDerWaalsContact C-N 3.32Å; G714-E716 PolarHBondContact O-N 2.97Å; E716-S718 PolarHBondContact O-N 3.12Å
717	A	57.7	Low	66.6	Low	58 Å²	58	79.7 Å²	79.7	48%	0.479	48%	0.475	S	S	.	.			trans	-72.8	105	-176.5	0	0	0	0	0	110.1
718	S	68.2	Low	67.2	Low	42 Å²	42	75.8 Å²	75.8	29%	0.294	46%	0.461	S	S	.	.			trans	-50.2	147.7	175.6	-178.1	0	0	0	0	111.9	Q706 E716 T720 Q721 A722	Q706-S718 VanDerWaalsContact OE1-CB 3.28Å; Q706-S718 PolarHBondContact OE1-OG 3.02Å; E716-S718 PolarHBondContact O-N 3.12Å; S718-T720 PolarHBondContact O-N 3.12Å; S718-T720 VanDerWaalsContact O-N 3.11Å; S718-T720 PolarHBondContact OG-OG1 2.79Å; S718-T720 VanDerWaalsContact OG-OG1 3.13Å; S718-Q721 WeakPolarHBondContact O-CA 3.27Å; S718-Q721 WeakPolarHBondContact O-CB 3.14Å; S718-Q721 PolarHBondContact O-N 2.85Å; S718-A722 PolarHBondContact O-N 2.88Å
719	E	75.6	Confident	67.8	Low	123 Å²	123	74.9 Å²	74.9	58%	0.575	44%	0.442	S	S	*	.	H	α-helix	trans	-55.1	-34.4	-179.5	-163.6	-161.1	130	0	0	111.7	A722 K723	E719-A722 CarbonylContact O-C 3.56Å; E719-A722 PolarHBondContact O-N 3.29Å; E719-K723 WeakPolarHBondContact O-CG 3.29Å; E719-K723 PolarHBondContact O-N 3.07Å; E719-K723 WeakPolarHBondContact OE1-CE 3.41Å; E719-K723 IonicContact OE1-NZ 3.65Å; E719-K723 PolarHBondContact OE1-NZ 3.38Å
720	T	74.4	Confident	68.5	Low	25 Å²	25	79 Å²	79	15%	0.153	45%	0.448	C	S	.	.	H	α-helix	trans	-66.8	-38.4	174.5	52.1	0	0	0	0	112.4	E702 V703 Q706 S718 K723 L724	E702-T720 HydrophobicContact CG-CG2 4Å; V703-T720 WeakPolarHBondContact CG2-OG1 3.43Å; Q706-T720 PolarHBondContact OE1-OG1 2.85Å; S718-T720 PolarHBondContact O-N 3.12Å; S718-T720 VanDerWaalsContact O-N 3.11Å; S718-T720 PolarHBondContact OG-OG1 2.79Å; S718-T720 VanDerWaalsContact OG-OG1 3.13Å; T720-K723 PolarHBondContact O-N 3.5Å; T720-L724 WeakPolarHBondContact O-CB 3.39Å; T720-L724 PolarHBondContact O-N 2.76Å
721	Q	78.8	Confident	69.6	Low	8 Å²	8	74.9 Å²	74.9	4%	0.037	42%	0.424	C	S	.	.	H	α-helix	trans	-66.1	-38.4	172	-172.9	166.7	4.2	0	0	111	V703 S718 L724 R725 E751	V703-Q721 HydrophobicContact CG1-CB 4.36Å; V703-Q721 HydrophobicContact CG2-CB 3.95Å; S718-Q721 WeakPolarHBondContact O-CA 3.27Å; S718-Q721 WeakPolarHBondContact O-CB 3.14Å; S718-Q721 PolarHBondContact O-N 2.85Å; Q721-L724 PolarHBondContact O-N 2.84Å; Q721-R725 VanDerWaalsContact NE2-NH2 3.18Å; Q721-R725 WeakPolarHBondContact O-CG 3.34Å; Q721-R725 PolarHBondContact O-N 2.89Å; Q721-E751 WeakPolarHBondContact CG-OE1 3.43Å; Q721-E751 PolarHBondContact NE2-OE1 2.86Å
722	A	81.3	Confident	70.8	Confident	35 Å²	35	74.6 Å²	74.6	29%	0.289	41%	0.413	S	S	.	.	H	α-helix	trans	-69.8	-28.7	173.5	0	0	0	0	0	113.4	S718 E719 R726	S718-A722 PolarHBondContact O-N 2.88Å; E719-A722 CarbonylContact O-C 3.56Å; E719-A722 PolarHBondContact O-N 3.29Å; A722-R726 WeakPolarHBondContact O-CG 3.45Å; A722-R726 PolarHBondContact O-N 3.12Å; A722-R726 PolarHBondContact O-NE 3.27Å
723	K	82.9	Confident	72.2	Confident	55 Å²	55	74.2 Å²	74.2	24%	0.239	40%	0.396	C	S	.	.	H	α-helix	trans	-70.9	-45.5	169.5	-75.6	174.1	-178.3	171.6	0	111.6	E678 Y699 E719 T720 R725 R726 L727	E678-K723 IonicContact OE1-NZ 3.57Å; Y699-K723 HydrophobicContact CE1-CB 4.15Å; Y699-K723 HydrophobicContact CE1-CD 4.27Å; Y699-K723 HydrophobicContact CE2-CB 4.11Å; E719-K723 WeakPolarHBondContact O-CG 3.29Å; E719-K723 PolarHBondContact O-N 3.07Å; E719-K723 WeakPolarHBondContact OE1-CE 3.41Å; E719-K723 IonicContact OE1-NZ 3.65Å; E719-K723 PolarHBondContact OE1-NZ 3.38Å; T720-K723 PolarHBondContact O-N 3.5Å; K723-R725 PolarHBondContact O-N 3.47Å; K723-R726 PolarHBondContact O-N 3.02Å; K723-L727 PolarHBondContact O-N 3.36Å
724	L	84.5	Confident	74	Confident	6 Å²	6	64.4 Å²	64.4	3%	0.031	35%	0.353	C	S	.	.	H	α-helix	trans	-57	-50.7	176.4	-179.7	57.7	0	0	0	111.7	A696 Y699 T720 Q721 R726 L727 L728	A696-L724 HydrophobicContact CB-CD1 4.45Å; Y699-L724 HydrophobicContact CD2-CB 4.32Å; Y699-L724 HydrophobicContact CD2-CD1 4.28Å; T720-L724 WeakPolarHBondContact O-CB 3.39Å; T720-L724 PolarHBondContact O-N 2.76Å; Q721-L724 PolarHBondContact O-N 2.84Å; L724-R726 VanDerWaalsContact C-N 3.33Å; L724-R726 PolarHBondContact O-N 2.96Å; L724-L727 PolarHBondContact O-N 2.88Å; L724-L727 VanDerWaalsContact O-N 3.14Å; L724-L728 HydrophobicContact CD1-CD1 4.04Å; L724-L728 HydrophobicContact CD1-CD2 4.39Å; L724-L728 HydrophobicContact CD1-CG 4.04Å; L724-L728 HydrophobicContact CG-CD1 4.18Å; L724-L728 HydrophobicContact CG-CG 4.49Å; L724-L728 WeakPolarHBondContact O-CG 3.48Å; L724-L728 PolarHBondContact O-N 2.93Å
725	R	84.8	Confident	75.7	Confident	76 Å²	76	66.9 Å²	66.9	29%	0.287	34%	0.34	S	S	.	.	H	α-helix	trans	-54	-47.6	175.8	-72.4	175	-174.2	-170.7	-0.3	112.3	Q721 K723 L727 L728 Q729 E751	Q721-R725 VanDerWaalsContact NE2-NH2 3.18Å; Q721-R725 WeakPolarHBondContact O-CG 3.34Å; Q721-R725 PolarHBondContact O-N 2.89Å; K723-R725 PolarHBondContact O-N 3.47Å; R725-L727 PolarHBondContact O-N 3.34Å; R725-L728 PolarHBondContact O-N 3.41Å; R725-Q729 WeakPolarHBondContact O-CB 3.36Å; R725-Q729 WeakPolarHBondContact O-CG 3.44Å; R725-Q729 PolarHBondContact O-N 3.11Å; R725-Q729 PolarHBondContact O-OE1 3.45Å; R725-E751 HydrophobicContact CG-CG 4.22Å; R725-E751 IonicContact CZ-OE1 2.66Å; R725-E751 IonicContact NE-OE1 2.62Å; R725-E751 PolarHBondContact NE-OE1 2.86Å; R725-E751 IonicContact NH2-OE1 3.89Å; R725-E751 PolarHBondContact NH2-OE1 2.87Å; R725-E751 VanDerWaalsContact NH2-OE1 3.14Å
726	R	82.3	Confident	77.3	Confident	124 Å²	124	63.7 Å²	63.7	47%	0.468	31%	0.311	S	S	.	.	H	α-helix	trans	-63.9	-36.9	178.5	-75.6	179.1	-71.7	169.9	-3.2	112.8	A722 K723 L724 K730	A722-R726 WeakPolarHBondContact O-CG 3.45Å; A722-R726 PolarHBondContact O-N 3.12Å; A722-R726 PolarHBondContact O-NE 3.27Å; K723-R726 PolarHBondContact O-N 3.02Å; L724-R726 VanDerWaalsContact C-N 3.33Å; L724-R726 PolarHBondContact O-N 2.96Å; R726-K730 VanDerWaalsContact O-CB 3.3Å; R726-K730 WeakPolarHBondContact O-CB 3.19Å; R726-K730 WeakPolarHBondContact O-CG 3.41Å; R726-K730 PolarHBondContact O-N 2.88Å
727	L	84.4	Confident	78.6	Confident	15 Å²	15	61.1 Å²	61.1	8%	0.079	30%	0.298	C	S	.	.	H	α-helix	trans	-65	-48.1	174.7	178	62.8	0	0	0	111.4	V681 L695 A696 Y699 K723 L724 R725 Q729 K730 S731	V681-L727 HydrophobicContact CG1-CD1 3.65Å; L695-L727 HydrophobicContact CB-CD2 4.33Å; L695-L727 HydrophobicContact CD2-CD2 4Å; L695-L727 HydrophobicContact CG-CD2 3.94Å; A696-L727 HydrophobicContact CB-CD2 4.02Å; Y699-L727 HydrophobicContact CD2-CD2 3.91Å; Y699-L727 HydrophobicContact CE2-CB 4.36Å; Y699-L727 HydrophobicContact CE2-CD2 3.86Å; K723-L727 PolarHBondContact O-N 3.36Å; L724-L727 PolarHBondContact O-N 2.88Å; L724-L727 VanDerWaalsContact O-N 3.14Å; R725-L727 PolarHBondContact O-N 3.34Å; L727-Q729 VanDerWaalsContact C-N 3.32Å; L727-Q729 PolarHBondContact O-N 2.88Å; L727-K730 PolarHBondContact O-N 2.84Å; L727-S731 WeakPolarHBondContact O-CB 3.27Å; L727-S731 PolarHBondContact O-N 3.28Å
728	L	83	Confident	79.8	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.016	30%	0.295	C	S	.	.	H	α-helix	trans	-68.5	-27.8	180	-60.6	-178	0	0	0	113.1	A696 L724 R725 Y734 L739 E751 I754 L755 K758	A696-L728 HydrophobicContact CB-CD2 4.46Å; L724-L728 HydrophobicContact CD1-CD1 4.04Å; L724-L728 HydrophobicContact CD1-CD2 4.39Å; L724-L728 HydrophobicContact CD1-CG 4.04Å; L724-L728 HydrophobicContact CG-CD1 4.18Å; L724-L728 HydrophobicContact CG-CG 4.49Å; L724-L728 WeakPolarHBondContact O-CG 3.48Å; L724-L728 PolarHBondContact O-N 2.93Å; R725-L728 PolarHBondContact O-N 3.41Å; L728-Y734 WeakPolarHBondContact CA-OH 3.47Å; L728-Y734 HydrophobicContact CD2-CD1 4.42Å; L728-Y734 HydrophobicContact CD2-CD2 4.4Å; L728-Y734 HydrophobicContact CD2-CE1 3.88Å; L728-Y734 HydrophobicContact CD2-CE2 3.9Å; L728-Y734 PolarHBondContact O-OH 3.22Å; L728-L739 HydrophobicContact CD2-CD1 3.89Å; L728-E751 HydrophobicContact CD1-CB 4.34Å; L728-I754 HydrophobicContact CB-CG2 3.9Å; L728-L755 HydrophobicContact CD1-CD1 4.41Å; L728-L755 HydrophobicContact CD1-CD2 4.31Å; L728-L755 HydrophobicContact CD1-CG 4.28Å; L728-L755 HydrophobicContact CD2-CD2 4.11Å; L728-K758 WeakPolarHBondContact O-CE 3.47Å
729	Q	81.5	Confident	80.3	Confident	63 Å²	63	61 Å²	61	29%	0.294	28%	0.282	S	S	.	.	H	α-helix	trans	-75.1	-45.3	172.5	-73.9	169.2	-35.4	0	0	111.8	R725 L727 I754 K758 W785	R725-Q729 WeakPolarHBondContact O-CB 3.36Å; R725-Q729 WeakPolarHBondContact O-CG 3.44Å; R725-Q729 PolarHBondContact O-N 3.11Å; R725-Q729 PolarHBondContact O-OE1 3.45Å; L727-Q729 VanDerWaalsContact C-N 3.32Å; L727-Q729 PolarHBondContact O-N 2.88Å; Q729-I754 HydrophobicContact CG-CD1 4.03Å; Q729-I754 HydrophobicContact CG-CG1 4.37Å; Q729-I754 HydrophobicContact CG-CG2 4.13Å; Q729-K758 PolarHBondContact O-NZ 2.85Å; Q729-W785 HydrophobicContact CB-CZ2 4.13Å; Q729-W785 HydrophobicContact CG-CZ2 4.21Å; Q729-W785 WeakPolarHBondContact O-CZ2 3.47Å
730	K	78.6	Confident	80.4	Confident	177 Å²	177	56.5 Å²	56.5	77%	0.77	26%	0.262	S	S	*	.	H	α-helix	trans	-88.6	-22.1	-169.2	-68.1	-172.9	174.5	-168.6	0	115.8	R726 L727	R726-K730 VanDerWaalsContact O-CB 3.3Å; R726-K730 WeakPolarHBondContact O-CB 3.19Å; R726-K730 WeakPolarHBondContact O-CG 3.41Å; R726-K730 PolarHBondContact O-N 2.88Å; L727-K730 PolarHBondContact O-N 2.84Å
731	S	81.4	Confident	80.6	Confident	12 Å²	12	61.1 Å²	61.1	8%	0.084	28%	0.281	C	S	.	.			trans	-101.3	153.6	174.6	-171.2	0	0	0	0	111	H692 L727 L733 Y734 K758	H692-S731 PolarHBondContact CE1-OG 2.91Å; H692-S731 VanDerWaalsContact CE1-OG 3.32Å; H692-S731 PolarHBondContact ND1-OG 2.72Å; L727-S731 WeakPolarHBondContact O-CB 3.27Å; L727-S731 PolarHBondContact O-N 3.28Å; S731-L733 PolarHBondContact OG-N 3.12Å; S731-L733 VanDerWaalsContact OG-N 3.13Å; S731-Y734 WeakPolarHBondContact O-CE1 3.27Å; S731-K758 VanDerWaalsContact O-CE 3.27Å; S731-K758 WeakPolarHBondContact O-CE 3.31Å; S731-K758 PolarHBondContact O-NZ 2.83Å; S731-K758 VanDerWaalsContact O-NZ 3.1Å
732	D	76.5	Confident	80.5	Confident	116 Å²	116	65.9 Å²	65.9	62%	0.62	30%	0.299	S	S	*	.			trans	-116.5	-1.4	167.9	-63	-58.8	0	0	0	111.5	Y734 K758	D732-Y734 PolarHBondContact O-N 2.97Å; D732-K758 VanDerWaalsContact OD1-CD 3.3Å; D732-K758 WeakPolarHBondContact OD1-CD 3.45Å; D732-K758 WeakPolarHBondContact OD1-CE 3.25Å; D732-K758 IonicContact OD1-NZ 2.91Å; D732-K758 PolarHBondContact OD1-NZ 2.94Å
733	L	75.6	Confident	80.1	Confident	54 Å²	54	64.9 Å²	64.9	28%	0.283	29%	0.289	S	S	.	.			trans	-100.6	44.8	-162.2	-56.9	177.8	0	0	0	112.6	Q687 E689 H692 S731	Q687-L733 HydrophobicContact CB-CD1 4.09Å; Q687-L733 HydrophobicContact CG-CD1 4.44Å; E689-L733 VanDerWaalsContact CA-O 3.26Å; E689-L733 WeakPolarHBondContact CA-O 3.49Å; H692-L733 VanDerWaalsContact CB-O 3.28Å; H692-L733 WeakPolarHBondContact CB-O 3.47Å; S731-L733 PolarHBondContact OG-N 3.12Å; S731-L733 VanDerWaalsContact OG-N 3.13Å
734	Y	79.9	Confident	79.5	Confident	10 Å²	10	71.4 Å²	71.4	4%	0.039	31%	0.312	C	S	.	.	S	Bend	trans	-140.9	159	-179.4	55.8	-105	0	0	0	112.3	T693 L728 S731 D732 V736 L739 L755	T693-Y734 WeakPolarHBondContact OG1-CA 3.17Å; L728-Y734 WeakPolarHBondContact CA-OH 3.47Å; L728-Y734 HydrophobicContact CD2-CD1 4.42Å; L728-Y734 HydrophobicContact CD2-CD2 4.4Å; L728-Y734 HydrophobicContact CD2-CE1 3.88Å; L728-Y734 HydrophobicContact CD2-CE2 3.9Å; L728-Y734 PolarHBondContact O-OH 3.22Å; S731-Y734 WeakPolarHBondContact O-CE1 3.27Å; D732-Y734 PolarHBondContact O-N 2.97Å; Y734-V736 VanDerWaalsContact C-N 3.34Å; Y734-V736 HydrophobicContact CD2-CG2 4.13Å; Y734-V736 HydrophobicContact CE2-CB 4.49Å; Y734-V736 HydrophobicContact CE2-CG2 3.87Å; Y734-V736 WeakPolarHBondContact O-CG2 3.41Å; Y734-V736 PolarHBondContact O-N 3.25Å; Y734-L739 HydrophobicContact CD2-CD1 3.55Å; Y734-L739 HydrophobicContact CE2-CD1 4.03Å; Y734-L739 HydrophobicContact CG-CD1 4.19Å; Y734-L755 HydrophobicContact CD2-CD2 4.46Å; Y734-L755 HydrophobicContact CE2-CD2 3.49Å; Y734-L755 VanDerWaalsContact CE2-CD2 3.49Å
735	R	80.5	Confident	78.6	Confident	127 Å²	127	75.1 Å²	75.1	48%	0.479	35%	0.352	S	S	.	.			trans	-73	82.6	-178.3	-66	-170.3	174.1	148.2	19.7	112.5	E689 T693 H737 F738 L739	E689-R735 WeakPolarHBondContact OE1-CG 3.42Å; E689-R735 IonicContact OE1-CZ 3.21Å; E689-R735 IonicContact OE1-NE 2.73Å; E689-R735 PolarHBondContact OE1-NE 3.4Å; E689-R735 IonicContact OE1-NH2 2.9Å; E689-R735 PolarHBondContact OE1-NH2 3.1Å; T693-R735 HydrophobicContact CG2-CB 4.09Å; T693-R735 HydrophobicContact CG2-CG 4.33Å; T693-R735 PolarHBondContact OG1-N 3.1Å; T693-R735 VanDerWaalsContact OG1-N 3.13Å; R735-H737 VanDerWaalsContact C-N 3.3Å; R735-H737 PolarHBondContact O-N 3.02Å; R735-F738 HydrophobicContact CB-CB 3.71Å; R735-F738 WeakPolarHBondContact O-CB 3.24Å; R735-F738 PolarHBondContact O-N 2.92Å; R735-L739 PolarHBondContact O-N 3.33Å
736	V	79.1	Confident	77.7	Confident	23 Å²	23	72.5 Å²	72.5	14%	0.139	35%	0.346	C	S	.	.	H	α-helix	trans	-49.6	-47.3	-178.3	-165.2	0	0	0	0	112.3	Y734 L739 L740 L755 L759	Y734-V736 VanDerWaalsContact C-N 3.34Å; Y734-V736 HydrophobicContact CD2-CG2 4.13Å; Y734-V736 HydrophobicContact CE2-CB 4.49Å; Y734-V736 HydrophobicContact CE2-CG2 3.87Å; Y734-V736 WeakPolarHBondContact O-CG2 3.41Å; Y734-V736 PolarHBondContact O-N 3.25Å; V736-L739 PolarHBondContact O-N 3.23Å; V736-L740 HydrophobicContact CG1-CD1 4.18Å; V736-L740 WeakPolarHBondContact O-CB 3.3Å; V736-L740 WeakPolarHBondContact O-CG 3.33Å; V736-L740 PolarHBondContact O-N 2.94Å; V736-L755 HydrophobicContact CG1-CB 4.07Å; V736-L755 HydrophobicContact CG1-CD2 3.88Å; V736-L755 WeakPolarHBondContact CG1-O 3.42Å; V736-L759 HydrophobicContact CB-CD2 3.94Å; V736-L759 HydrophobicContact CB-CG 4.49Å; V736-L759 HydrophobicContact CG1-CD1 4.39Å; V736-L759 HydrophobicContact CG1-CD2 3.75Å; V736-L759 HydrophobicContact CG1-CG 3.75Å
737	H	80.7	Confident	77	Confident	131 Å²	131	69.2 Å²	69.2	61%	0.606	35%	0.351	S	S	*	.	H	α-helix	trans	-62.7	-42.3	177.2	-70.6	-64	0	0	0	113.3	R735 L739 L740 E741	R735-H737 VanDerWaalsContact C-N 3.3Å; R735-H737 PolarHBondContact O-N 3.02Å; H737-L739 PolarHBondContact O-N 3.18Å; H737-L740 PolarHBondContact O-N 2.75Å; H737-E741 WeakPolarHBondContact O-CG 3.27Å; H737-E741 PolarHBondContact O-N 2.81Å
738	F	81.1	Confident	76.8	Confident	95 Å²	95	68.7 Å²	68.7	42%	0.417	35%	0.348	S	S	.	.	H	α-helix	trans	-65.5	-39.3	179.4	-179.9	-107.8	0	0	0	111.8	T693 V697 R735 R742	T693-F738 HydrophobicContact CG2-CD1 4.19Å; V697-F738 HydrophobicContact CG2-CD1 4.43Å; V697-F738 HydrophobicContact CG2-CE1 3.83Å; R735-F738 HydrophobicContact CB-CB 3.71Å; R735-F738 WeakPolarHBondContact O-CB 3.24Å; R735-F738 PolarHBondContact O-N 2.92Å; F738-R742 WeakPolarHBondContact O-CB 3.23Å; F738-R742 PolarHBondContact O-N 2.89Å; F738-R742 VanDerWaalsContact O-N 3.07Å
739	L	80.2	Confident	76.5	Confident	4 Å²	4	70.3 Å²	70.3	2%	0.021	36%	0.359	C	S	.	.	H	α-helix	trans	-67	-41.7	173.5	-63.1	179.8	0	0	0	111.6	A696 V697 L728 Y734 R735 V736 H737 E741 R742 L743 L755	A696-L739 HydrophobicContact CB-CD1 3.86Å; A696-L739 HydrophobicContact CB-CD2 4.11Å; V697-L739 HydrophobicContact CG2-CD2 4.06Å; L728-L739 HydrophobicContact CD2-CD1 3.89Å; Y734-L739 HydrophobicContact CD2-CD1 3.55Å; Y734-L739 HydrophobicContact CE2-CD1 4.03Å; Y734-L739 HydrophobicContact CG-CD1 4.19Å; R735-L739 PolarHBondContact O-N 3.33Å; V736-L739 PolarHBondContact O-N 3.23Å; H737-L739 PolarHBondContact O-N 3.18Å; L739-E741 PolarHBondContact O-N 2.71Å; L739-R742 CarbonylContact O-C 3.57Å; L739-R742 PolarHBondContact O-N 3.1Å; L739-L743 WeakPolarHBondContact O-CB 3.34Å; L739-L743 WeakPolarHBondContact O-CD1 3.07Å; L739-L743 VanDerWaalsContact O-CG 3.24Å; L739-L743 WeakPolarHBondContact O-CG 3.27Å; L739-L743 PolarHBondContact O-N 3.1Å; L739-L755 HydrophobicContact CB-CD1 4.13Å; L739-L755 HydrophobicContact CB-CD2 4.5Å; L739-L755 HydrophobicContact CD1-CD2 4.33Å
740	L	76.9	Confident	76.4	Confident	27 Å²	27	69.1 Å²	69.1	14%	0.141	35%	0.354	C	S	.	.	H	α-helix	trans	-64.2	-36.3	175.8	-77.8	170.2	0	0	0	113.2	V736 H737 R744 L755 L759	V736-L740 HydrophobicContact CG1-CD1 4.18Å; V736-L740 WeakPolarHBondContact O-CB 3.3Å; V736-L740 WeakPolarHBondContact O-CG 3.33Å; V736-L740 PolarHBondContact O-N 2.94Å; H737-L740 PolarHBondContact O-N 2.75Å; L740-R744 PolarHBondContact O-N 3.29Å; L740-L755 HydrophobicContact CD1-CB 4.27Å; L740-L755 HydrophobicContact CD2-CB 3.7Å; L740-L755 HydrophobicContact CD2-CD1 3.95Å; L740-L755 HydrophobicContact CD2-CG 4.49Å; L740-L755 HydrophobicContact CG-CB 3.9Å; L740-L755 HydrophobicContact CG-CD1 4.09Å; L740-L759 HydrophobicContact CD1-CD1 3.59Å; L740-L759 HydrophobicContact CD1-CG 4.46Å
741	E	77.9	Confident	76.7	Confident	122 Å²	122	60.8 Å²	60.8	57%	0.57	32%	0.317	S	S	*	.	H	α-helix	trans	-65.2	-42.3	171.6	-72.1	-168.5	143.4	0	0	111.5	H737 L739 L743 R744	H737-E741 WeakPolarHBondContact O-CG 3.27Å; H737-E741 PolarHBondContact O-N 2.81Å; L739-E741 PolarHBondContact O-N 2.71Å; E741-L743 VanDerWaalsContact C-N 3.31Å; E741-L743 PolarHBondContact O-N 2.64Å; E741-R744 VanDerWaalsContact O-CB 3.28Å; E741-R744 WeakPolarHBondContact O-CB 3.29Å; E741-R744 PolarHBondContact O-N 3.33Å
742	R	76.6	Confident	76.7	Confident	109 Å²	109	61.2 Å²	61.2	41%	0.411	32%	0.321	S	S	.	.	H	α-helix	trans	-73.4	-20	179.4	-158.8	164.7	-168.9	170.6	2.8	114.1	L700 E701 F738 L739	L700-R742 HydrophobicContact CD2-CB 4.14Å; L700-R742 HydrophobicContact CD2-CG 3.98Å; E701-R742 IonicContact OE1-CZ 2.66Å; E701-R742 IonicContact OE1-NH1 3.43Å; E701-R742 PolarHBondContact OE1-NH1 3.22Å; E701-R742 IonicContact OE1-NH2 2.81Å; E701-R742 PolarHBondContact OE1-NH2 3.09Å; F738-R742 WeakPolarHBondContact O-CB 3.23Å; F738-R742 PolarHBondContact O-N 2.89Å; F738-R742 VanDerWaalsContact O-N 3.07Å; L739-R742 CarbonylContact O-C 3.57Å; L739-R742 PolarHBondContact O-N 3.1Å
743	L	74.1	Confident	76.9	Confident	13 Å²	13	55.8 Å²	55.8	7%	0.068	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-9	172.9	-75.7	164.2	0	0	0	113.8	L700 L739 E741 G745 A746 L748 L755	L700-L743 HydrophobicContact CD1-CD2 3.61Å; L700-L743 HydrophobicContact CD1-CG 4.45Å; L700-L743 HydrophobicContact CD2-CD2 4.23Å; L700-L743 HydrophobicContact CD2-CG 4.2Å; L739-L743 WeakPolarHBondContact O-CB 3.34Å; L739-L743 WeakPolarHBondContact O-CD1 3.07Å; L739-L743 VanDerWaalsContact O-CG 3.24Å; L739-L743 WeakPolarHBondContact O-CG 3.27Å; L739-L743 PolarHBondContact O-N 3.1Å; E741-L743 VanDerWaalsContact C-N 3.31Å; E741-L743 PolarHBondContact O-N 2.64Å; L743-G745 PolarHBondContact O-N 3.17Å; L743-A746 HydrophobicContact CD2-CB 4.17Å; L743-A746 VanDerWaalsContact O-CB 3.28Å; L743-A746 WeakPolarHBondContact O-CB 3.44Å; L743-A746 PolarHBondContact O-N 3.15Å; L743-L748 HydrophobicContact CD2-CB 3.83Å; L743-L748 HydrophobicContact CD2-CD1 3.51Å; L743-L748 HydrophobicContact CD2-CG 4.3Å; L743-L755 HydrophobicContact CD1-CD1 3.21Å
744	R	70.6	Confident	77.2	Confident	193 Å²	193	53.4 Å²	53.4	73%	0.728	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	97.5	-175.3	-167.7	180	-62.8	162.5	6.2	111.2	L740 E741	L740-R744 PolarHBondContact O-N 3.29Å; E741-R744 VanDerWaalsContact O-CB 3.28Å; E741-R744 WeakPolarHBondContact O-CB 3.29Å; E741-R744 PolarHBondContact O-N 3.33Å
745	G	65	Low	77.4	Confident	84 Å²	84	52.9 Å²	52.9	87%	0.866	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	103	1.8	-175.2	0	0	0	0	0	115.2	L743 G747	L743-G745 PolarHBondContact O-N 3.17Å; G745-G747 PolarHBondContact O-N 3.04Å
746	A	65.3	Low	77.5	Confident	21 Å²	21	48.8 Å²	48.8	17%	0.174	26%	0.263	C	S	.	.	S	Bend	trans	-78.7	-7.6	-174.2	0	0	0	0	0	115.8	L704 L743 L748	L704-A746 HydrophobicContact CD2-CB 4.06Å; L743-A746 HydrophobicContact CD2-CB 4.17Å; L743-A746 VanDerWaalsContact O-CB 3.28Å; L743-A746 WeakPolarHBondContact O-CB 3.44Å; L743-A746 PolarHBondContact O-N 3.15Å; A746-L748 HydrophobicContact CB-CD1 4.08Å; A746-L748 HydrophobicContact CB-CG 4.38Å
747	G	68.9	Low	77.6	Confident	54 Å²	54	48 Å²	48	56%	0.557	26%	0.259	S	S	*	.	S	Bend	trans	66.1	38.3	-177	0	0	0	0	0	113.8	R707 G745 P749	R707-G747 PolarHBondContact NH1-O 3.16Å; G745-G747 PolarHBondContact O-N 3.04Å; G747-P749 VanDerWaalsContact C-CD 3.44Å; G747-P749 WeakPolarHBondContact O-CD 3.49Å
748	L	79.6	Confident	77.7	Confident	4 Å²	4	44.2 Å²	44.2	2%	0.021	24%	0.241	C	C	.	.			trans	-124.5	66.3	-176.1	-72.4	170.7	0	0	0	111.1	L700 V703 R707 L743 A746 E751 S752	L700-L748 HydrophobicContact CD1-CD1 3.7Å; V703-L748 HydrophobicContact CG1-CD2 4.45Å; R707-L748 VanDerWaalsContact CZ-CD2 3.43Å; L743-L748 HydrophobicContact CD2-CB 3.83Å; L743-L748 HydrophobicContact CD2-CD1 3.51Å; L743-L748 HydrophobicContact CD2-CG 4.3Å; A746-L748 HydrophobicContact CB-CD1 4.08Å; A746-L748 HydrophobicContact CB-CG 4.38Å; L748-E751 HydrophobicContact CB-CB 4.34Å; L748-E751 WeakPolarHBondContact CB-OE2 3.49Å; L748-E751 WeakPolarHBondContact CD2-OE2 3.45Å; L748-S752 WeakPolarHBondContact O-CB 3.39Å; L748-S752 PolarHBondContact O-N 2.86Å; L748-S752 VanDerWaalsContact O-N 3.09Å; L748-S752 PolarHBondContact O-OG 3.31Å
749	P	77.3	Confident	77.7	Confident	37 Å²	37	42.4 Å²	42.4	24%	0.24	24%	0.236	C	C	.	.	H	α-helix	trans	-68.4	-34.6	-174.2	27	-34.9	0	0	0	113.2	G747 S752 A753 I768 L773	G747-P749 VanDerWaalsContact C-CD 3.44Å; G747-P749 WeakPolarHBondContact O-CD 3.49Å; P749-S752 WeakPolarHBondContact O-CB 3.26Å; P749-S752 PolarHBondContact O-N 3.37Å; P749-A753 WeakPolarHBondContact O-CB 3.23Å; P749-A753 PolarHBondContact O-N 3.46Å; P749-I768 HydrophobicContact CB-CG2 3.78Å; P749-I768 WeakPolarHBondContact O-CG2 3.43Å; P749-L773 HydrophobicContact CB-CD1 4.06Å; P749-L773 HydrophobicContact CB-CG 4.1Å; P749-L773 HydrophobicContact CG-CD1 4.06Å; P749-L773 HydrophobicContact CG-CD2 3.86Å; P749-L773 HydrophobicContact CG-CG 3.84Å
750	M	79	Confident	77.5	Confident	39 Å²	39	44.2 Å²	44.2	19%	0.192	26%	0.255	C	S	.	.	H	α-helix	trans	-65.7	-45.6	-179.7	-173.7	64.3	-178.5	0	0	111.4	S752 A753 I754 L769 L773 A778	M750-S752 VanDerWaalsContact C-N 3.3Å; M750-S752 PolarHBondContact O-N 3.32Å; M750-A753 PolarHBondContact O-N 2.91Å; M750-I754 HydrophobicContact CG-CD1 4.48Å; M750-I754 WeakPolarHBondContact O-CG1 3.34Å; M750-I754 PolarHBondContact O-N 2.88Å; M750-I754 VanDerWaalsContact O-N 3.11Å; M750-L769 HydrophobicContact CE-CD2 4.4Å; M750-L769 HydrophobicContact SD-CD2 3.53Å; M750-L769 VanDerWaalsContact SD-CD2 3.53Å; M750-L773 HydrophobicContact CB-CD1 4.1Å; M750-L773 HydrophobicContact SD-CD1 4.22Å; M750-A778 HydrophobicContact CE-CB 4.18Å
751	E	83.7	Confident	77.9	Confident	1 Å²	1	46 Å²	46	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-64.5	-37.4	175.2	-63.1	73.2	-166.5	0	0	111	Q721 R725 L728 L748 I754 L755	Q721-E751 WeakPolarHBondContact CG-OE1 3.43Å; Q721-E751 PolarHBondContact NE2-OE1 2.86Å; R725-E751 HydrophobicContact CG-CG 4.22Å; R725-E751 IonicContact CZ-OE1 2.66Å; R725-E751 IonicContact NE-OE1 2.62Å; R725-E751 PolarHBondContact NE-OE1 2.86Å; R725-E751 IonicContact NH2-OE1 3.89Å; R725-E751 PolarHBondContact NH2-OE1 2.87Å; R725-E751 VanDerWaalsContact NH2-OE1 3.14Å; L728-E751 HydrophobicContact CD1-CB 4.34Å; L748-E751 HydrophobicContact CB-CB 4.34Å; L748-E751 WeakPolarHBondContact CB-OE2 3.49Å; L748-E751 WeakPolarHBondContact CD2-OE2 3.45Å; E751-I754 PolarHBondContact O-N 2.87Å; E751-L755 VanDerWaalsContact O-CG 3.3Å; E751-L755 WeakPolarHBondContact O-CG 3.28Å; E751-L755 PolarHBondContact O-N 3.49Å; E751-L755 VanDerWaalsContact O-N 3.13Å
752	S	81.4	Confident	78.2	Confident	22 Å²	22	42 Å²	42	15%	0.154	24%	0.244	C	C	.	.	H	α-helix	trans	-66	-41.7	175.3	-56.2	0	0	0	0	112.2	L748 P749 M750 L755 H756	L748-S752 WeakPolarHBondContact O-CB 3.39Å; L748-S752 PolarHBondContact O-N 2.86Å; L748-S752 VanDerWaalsContact O-N 3.09Å; L748-S752 PolarHBondContact O-OG 3.31Å; P749-S752 WeakPolarHBondContact O-CB 3.26Å; P749-S752 PolarHBondContact O-N 3.37Å; M750-S752 VanDerWaalsContact C-N 3.3Å; M750-S752 PolarHBondContact O-N 3.32Å; S752-L755 PolarHBondContact O-N 3.01Å; S752-H756 PolarHBondContact O-CD2 3.43Å; S752-H756 VanDerWaalsContact O-CD2 3.24Å; S752-H756 PolarHBondContact O-N 3.49Å
753	A	81.2	Confident	78.4	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-62.7	-42.4	175.9	0	0	0	0	0	112.2	P749 M750 L755 H756 G757 A765 I768 L769	P749-A753 WeakPolarHBondContact O-CB 3.23Å; P749-A753 PolarHBondContact O-N 3.46Å; M750-A753 PolarHBondContact O-N 2.91Å; A753-L755 VanDerWaalsContact C-N 3.33Å; A753-L755 PolarHBondContact O-N 2.92Å; A753-H756 PolarHBondContact O-N 2.89Å; A753-G757 PolarHBondContact O-N 2.66Å; A753-A765 HydrophobicContact CB-CB 4.42Å; A753-A765 VanDerWaalsContact O-CB 3.28Å; A753-A765 WeakPolarHBondContact O-CB 3.44Å; A753-I768 HydrophobicContact CB-CB 4.27Å; A753-I768 HydrophobicContact CB-CG2 4.1Å; A753-L769 HydrophobicContact CB-CD1 4.45Å; A753-L769 HydrophobicContact CB-CD2 4Å; A753-L769 HydrophobicContact CB-CG 3.94Å
754	I	83.1	Confident	78.8	Confident	4 Å²	4	47 Å²	47	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-58.6	-44.6	174	-66.9	160.9	0	0	0	110.6	L728 Q729 M750 E751 G757 K758 W785	L728-I754 HydrophobicContact CB-CG2 3.9Å; Q729-I754 HydrophobicContact CG-CD1 4.03Å; Q729-I754 HydrophobicContact CG-CG1 4.37Å; Q729-I754 HydrophobicContact CG-CG2 4.13Å; M750-I754 HydrophobicContact CG-CD1 4.48Å; M750-I754 WeakPolarHBondContact O-CG1 3.34Å; M750-I754 PolarHBondContact O-N 2.88Å; M750-I754 VanDerWaalsContact O-N 3.11Å; E751-I754 PolarHBondContact O-N 2.87Å; I754-G757 PolarHBondContact O-N 2.81Å; I754-K758 WeakPolarHBondContact O-CG 3.46Å; I754-K758 PolarHBondContact O-N 2.75Å; I754-W785 HydrophobicContact CG2-CH2 3.97Å; I754-W785 HydrophobicContact CG2-CZ3 4.47Å
755	L	83.6	Confident	79.4	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.2	-41.9	178.9	-68.6	168	0	0	0	113.1	L728 Y734 V736 L739 L740 L743 E751 S752 A753 G757 K758 L759	L728-L755 HydrophobicContact CD1-CD1 4.41Å; L728-L755 HydrophobicContact CD1-CD2 4.31Å; L728-L755 HydrophobicContact CD1-CG 4.28Å; L728-L755 HydrophobicContact CD2-CD2 4.11Å; Y734-L755 HydrophobicContact CD2-CD2 4.46Å; Y734-L755 HydrophobicContact CE2-CD2 3.49Å; Y734-L755 VanDerWaalsContact CE2-CD2 3.49Å; V736-L755 HydrophobicContact CG1-CB 4.07Å; V736-L755 HydrophobicContact CG1-CD2 3.88Å; V736-L755 WeakPolarHBondContact CG1-O 3.42Å; L739-L755 HydrophobicContact CB-CD1 4.13Å; L739-L755 HydrophobicContact CB-CD2 4.5Å; L739-L755 HydrophobicContact CD1-CD2 4.33Å; L740-L755 HydrophobicContact CD1-CB 4.27Å; L740-L755 HydrophobicContact CD2-CB 3.7Å; L740-L755 HydrophobicContact CD2-CD1 3.95Å; L740-L755 HydrophobicContact CD2-CG 4.49Å; L740-L755 HydrophobicContact CG-CB 3.9Å; L740-L755 HydrophobicContact CG-CD1 4.09Å; L743-L755 HydrophobicContact CD1-CD1 3.21Å; E751-L755 VanDerWaalsContact O-CG 3.3Å; E751-L755 WeakPolarHBondContact O-CG 3.28Å; E751-L755 PolarHBondContact O-N 3.49Å; E751-L755 VanDerWaalsContact O-N 3.13Å; S752-L755 PolarHBondContact O-N 3.01Å; A753-L755 VanDerWaalsContact C-N 3.33Å; A753-L755 PolarHBondContact O-N 2.92Å; L755-G757 VanDerWaalsContact C-N 3.29Å; L755-G757 PolarHBondContact O-N 3.27Å; L755-K758 PolarHBondContact O-N 2.89Å; L755-L759 PolarHBondContact O-N 3.4Å; L755-L759 VanDerWaalsContact O-N 3.12Å
756	H	82.8	Confident	80.3	Confident	40 Å²	40	33.8 Å²	33.8	19%	0.185	19%	0.194	C	C	.	.	H	α-helix	trans	-63.7	-34.7	172.6	-79.8	-72.1	0	0	0	112.1	S752 A753 L759 G760 E761 A765	S752-H756 PolarHBondContact O-CD2 3.43Å; S752-H756 VanDerWaalsContact O-CD2 3.24Å; S752-H756 PolarHBondContact O-N 3.49Å; A753-H756 PolarHBondContact O-N 2.89Å; H756-L759 PolarHBondContact O-N 2.83Å; H756-G760 PolarHBondContact O-N 3Å; H756-E761 HydrophobicContact CB-CB 4.35Å; H756-E761 IonicContact CE1-OE2 3.5Å; H756-E761 PolarHBondContact CE1-OE2 2.83Å; H756-E761 IonicContact ND1-OE2 2.65Å; H756-E761 PolarHBondContact ND1-OE2 3.29Å; H756-E761 PolarHBondContact O-N 2.87Å; H756-A765 HydrophobicContact CB-CB 4.1Å
757	G	81.6	Confident	81.2	Confident	6 Å²	6	37.3 Å²	37.3	6%	0.062	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-40.8	172.1	0	0	0	0	0	113.3	A753 I754 L755 L759 G760 H762 Y782	A753-G757 PolarHBondContact O-N 2.66Å; I754-G757 PolarHBondContact O-N 2.81Å; L755-G757 VanDerWaalsContact C-N 3.29Å; L755-G757 PolarHBondContact O-N 3.27Å; G757-L759 VanDerWaalsContact C-N 3.3Å; G757-L759 PolarHBondContact O-N 3.42Å; G757-G760 PolarHBondContact O-N 3.46Å; G757-H762 PolarHBondContact O-CE1 2.88Å; G757-Y782 VanDerWaalsContact CA-OH 3.23Å; G757-Y782 WeakPolarHBondContact CA-OH 3.34Å
758	K	80.8	Confident	81.8	Confident	53 Å²	53	35.6 Å²	35.6	23%	0.23	19%	0.185	C	C	.	.	H	α-helix	trans	-65.5	-28.9	173.3	-67.2	-72	-165.3	-179.8	0	113.2	L728 Q729 S731 D732 I754 L755 G760 W785	L728-K758 WeakPolarHBondContact O-CE 3.47Å; Q729-K758 PolarHBondContact O-NZ 2.85Å; S731-K758 VanDerWaalsContact O-CE 3.27Å; S731-K758 WeakPolarHBondContact O-CE 3.31Å; S731-K758 PolarHBondContact O-NZ 2.83Å; S731-K758 VanDerWaalsContact O-NZ 3.1Å; D732-K758 VanDerWaalsContact OD1-CD 3.3Å; D732-K758 WeakPolarHBondContact OD1-CD 3.45Å; D732-K758 WeakPolarHBondContact OD1-CE 3.25Å; D732-K758 IonicContact OD1-NZ 2.91Å; D732-K758 PolarHBondContact OD1-NZ 2.94Å; I754-K758 WeakPolarHBondContact O-CG 3.46Å; I754-K758 PolarHBondContact O-N 2.75Å; L755-K758 PolarHBondContact O-N 2.89Å; K758-G760 PolarHBondContact O-N 2.87Å; K758-W785 HydrophobicContact CD-CH2 4.25Å; K758-W785 HydrophobicContact CD-CZ2 4.47Å; K758-W785 HydrophobicContact CG-CH2 4.4Å
759	L	81.2	Confident	82	Confident	57 Å²	57	35.5 Å²	35.5	30%	0.298	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-5.5	170.1	-66.9	-178.6	0	0	0	113.8	V736 L740 L755 H756 G757 E761	V736-L759 HydrophobicContact CB-CD2 3.94Å; V736-L759 HydrophobicContact CB-CG 4.49Å; V736-L759 HydrophobicContact CG1-CD1 4.39Å; V736-L759 HydrophobicContact CG1-CD2 3.75Å; V736-L759 HydrophobicContact CG1-CG 3.75Å; L740-L759 HydrophobicContact CD1-CD1 3.59Å; L740-L759 HydrophobicContact CD1-CG 4.46Å; L755-L759 PolarHBondContact O-N 3.4Å; L755-L759 VanDerWaalsContact O-N 3.12Å; H756-L759 PolarHBondContact O-N 2.83Å; G757-L759 VanDerWaalsContact C-N 3.3Å; G757-L759 PolarHBondContact O-N 3.42Å; L759-E761 HydrophobicContact CB-CG 3.95Å; L759-E761 PolarHBondContact O-N 2.69Å
760	G	77.8	Confident	82.2	Confident	42 Å²	42	33.8 Å²	33.8	43%	0.433	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	7	-171.8	0	0	0	0	0	114.2	H756 G757 K758 H762	H756-G760 PolarHBondContact O-N 3Å; G757-G760 PolarHBondContact O-N 3.46Å; K758-G760 PolarHBondContact O-N 2.87Å; G760-H762 PolarHBondContact O-CD2 2.59Å; G760-H762 PolarHBondContact O-N 2.97Å
761	E	85.2	Confident	82.3	Confident	65 Å²	65	35.5 Å²	35.5	30%	0.304	18%	0.181	S	C	.	.			trans	-81	51.1	179.1	-57.5	-161.3	127.2	0	0	111.4	H756 L759 E763 K764 A765	H756-E761 HydrophobicContact CB-CB 4.35Å; H756-E761 IonicContact CE1-OE2 3.5Å; H756-E761 PolarHBondContact CE1-OE2 2.83Å; H756-E761 IonicContact ND1-OE2 2.65Å; H756-E761 PolarHBondContact ND1-OE2 3.29Å; H756-E761 PolarHBondContact O-N 2.87Å; L759-E761 HydrophobicContact CB-CG 3.95Å; L759-E761 PolarHBondContact O-N 2.69Å; E761-E763 VanDerWaalsContact C-N 3.28Å; E761-E763 PolarHBondContact O-N 3.02Å; E761-E763 VanDerWaalsContact O-N 3.17Å; E761-K764 HydrophobicContact CB-CB 4.41Å; E761-K764 HydrophobicContact CB-CD 4.13Å; E761-K764 HydrophobicContact CB-CG 4.42Å; E761-K764 WeakPolarHBondContact O-CB 3.43Å; E761-K764 PolarHBondContact O-N 2.97Å; E761-K764 IonicContact OE1-NZ 3.42Å; E761-K764 PolarHBondContact OE1-NZ 2.67Å; E761-K764 WeakPolarHBondContact OE2-CD 3.05Å; E761-K764 IonicContact OE2-NZ 2.73Å; E761-K764 PolarHBondContact OE2-NZ 2.93Å; E761-A765 PolarHBondContact O-N 3.44Å; E761-A765 VanDerWaalsContact O-N 3.17Å
762	H	83.9	Confident	82.1	Confident	36 Å²	36	41.7 Å²	41.7	17%	0.167	21%	0.21	C	C	.	.	H	α-helix	trans	-59.8	-33.2	-166.5	-55.6	-65.7	0	0	0	113.6	G757 G760 K764 A765 L766 Y782 L798	G757-H762 PolarHBondContact O-CE1 2.88Å; G760-H762 PolarHBondContact O-CD2 2.59Å; G760-H762 PolarHBondContact O-N 2.97Å; H762-K764 VanDerWaalsContact C-N 3.33Å; H762-K764 PolarHBondContact O-N 3.21Å; H762-A765 PolarHBondContact O-N 3.2Å; H762-L766 WeakPolarHBondContact O-CB 3.43Å; H762-L766 WeakPolarHBondContact O-CG 3.45Å; H762-L766 PolarHBondContact O-N 2.82Å; H762-Y782 WeakPolarHBondContact CA-OH 3.27Å; H762-Y782 AromaticContact ND1-CZ 3.98Å; H762-Y782 PolarHBondContact ND1-OH 2.81Å; H762-L798 HydrophobicContact CB-CD2 3.97Å
763	E	80.6	Confident	81.9	Confident	122 Å²	122	43.9 Å²	43.9	57%	0.57	22%	0.219	S	C	*	.	H	α-helix	trans	-59.9	-40.8	173.6	-66.6	-167.5	146.5	0	0	112.4	E761 H767 T801	E761-E763 VanDerWaalsContact C-N 3.28Å; E761-E763 PolarHBondContact O-N 3.02Å; E761-E763 VanDerWaalsContact O-N 3.17Å; E763-H767 VanDerWaalsContact O-CB 3.27Å; E763-H767 WeakPolarHBondContact O-CB 3.29Å; E763-H767 PolarHBondContact O-N 3.41Å; E763-T801 HydrophobicContact CG-CG2 4.08Å
764	K	81.5	Confident	81.7	Confident	105 Å²	105	51.2 Å²	51.2	46%	0.457	25%	0.246	S	C	.	.	H	α-helix	trans	-72.2	-42.2	179.3	-61.4	-178.5	-169.5	166.3	0	111.4	E761 H762 H767 I768	E761-K764 HydrophobicContact CB-CB 4.41Å; E761-K764 HydrophobicContact CB-CD 4.13Å; E761-K764 HydrophobicContact CB-CG 4.42Å; E761-K764 WeakPolarHBondContact O-CB 3.43Å; E761-K764 PolarHBondContact O-N 2.97Å; E761-K764 IonicContact OE1-NZ 3.42Å; E761-K764 PolarHBondContact OE1-NZ 2.67Å; E761-K764 WeakPolarHBondContact OE2-CD 3.05Å; E761-K764 IonicContact OE2-NZ 2.73Å; E761-K764 PolarHBondContact OE2-NZ 2.93Å; H762-K764 VanDerWaalsContact C-N 3.33Å; H762-K764 PolarHBondContact O-N 3.21Å; K764-H767 PolarHBondContact O-N 3.3Å; K764-I768 WeakPolarHBondContact O-CG1 3.32Å; K764-I768 PolarHBondContact O-N 2.97Å
765	A	84.8	Confident	81.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.2	-48.2	176.1	0	0	0	0	0	111.3	A753 H756 E761 H762 I768 L769 Y782	A753-A765 HydrophobicContact CB-CB 4.42Å; A753-A765 VanDerWaalsContact O-CB 3.28Å; A753-A765 WeakPolarHBondContact O-CB 3.44Å; H756-A765 HydrophobicContact CB-CB 4.1Å; E761-A765 PolarHBondContact O-N 3.44Å; E761-A765 VanDerWaalsContact O-N 3.17Å; H762-A765 PolarHBondContact O-N 3.2Å; A765-I768 PolarHBondContact O-N 2.77Å; A765-L769 WeakPolarHBondContact O-CG 3.34Å; A765-L769 PolarHBondContact O-N 2.7Å; A765-L769 VanDerWaalsContact O-N 3.11Å; A765-Y782 HydrophobicContact CB-CE1 4.38Å; A765-Y782 HydrophobicContact CB-CE2 3.85Å; A765-Y782 VanDerWaalsContact CB-OH 3.29Å; A765-Y782 WeakPolarHBondContact CB-OH 3.2Å
766	L	83.8	Confident	81.7	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64	-40.3	174.8	-71	177	0	0	0	112.1	H762 I768 L769 V770 A779 Y782 T801 L802 I805	H762-L766 WeakPolarHBondContact O-CB 3.43Å; H762-L766 WeakPolarHBondContact O-CG 3.45Å; H762-L766 PolarHBondContact O-N 2.82Å; L766-I768 VanDerWaalsContact C-N 3.31Å; L766-I768 PolarHBondContact O-N 2.81Å; L766-L769 HydrophobicContact CD2-CD1 4.43Å; L766-L769 PolarHBondContact O-N 2.99Å; L766-V770 WeakPolarHBondContact O-CB 3.37Å; L766-V770 VanDerWaalsContact O-CG2 3.28Å; L766-V770 WeakPolarHBondContact O-CG2 3.44Å; L766-V770 PolarHBondContact O-N 2.92Å; L766-A779 HydrophobicContact CD2-CB 4.44Å; L766-Y782 HydrophobicContact CD2-CD1 3.41Å; L766-Y782 VanDerWaalsContact CD2-CD1 3.41Å; L766-Y782 HydrophobicContact CD2-CE1 3.73Å; L766-Y782 HydrophobicContact CD2-CG 4.38Å; L766-Y782 HydrophobicContact CG-CD1 4.08Å; L766-Y782 HydrophobicContact CG-CE1 3.84Å; L766-T801 HydrophobicContact CD1-CG2 4.09Å; L766-L802 HydrophobicContact CD1-CB 4.14Å; L766-L802 HydrophobicContact CD2-CD1 4.22Å; L766-I805 HydrophobicContact CB-CD1 3.49Å; L766-I805 VanDerWaalsContact CB-CD1 3.49Å; L766-I805 HydrophobicContact CD1-CD1 4.06Å; L766-I805 HydrophobicContact CG-CD1 4.44Å
767	H	82.8	Confident	81.6	Confident	96 Å²	96	58 Å²	58	44%	0.444	29%	0.29	S	S	.	.	H	α-helix	trans	-59.6	-39.3	175.4	-174.1	-69.4	0	0	0	112.5	E763 K764 H771	E763-H767 VanDerWaalsContact O-CB 3.27Å; E763-H767 WeakPolarHBondContact O-CB 3.29Å; E763-H767 PolarHBondContact O-N 3.41Å; K764-H767 PolarHBondContact O-N 3.3Å; H767-H771 AromaticContact CD2-CD2 3.47Å; H767-H771 PolarHBondContact CD2-CD2 2.78Å; H767-H771 VanDerWaalsContact CD2-CD2 3.47Å; H767-H771 AromaticContact CE1-CD2 3.83Å; H767-H771 AromaticContact CG-CD2 3.7Å; H767-H771 AromaticContact ND1-CD2 3.91Å; H767-H771 AromaticContact NE2-CD2 3.58Å; H767-H771 WeakPolarHBondContact O-CB 3.45Å; H767-H771 PolarHBondContact O-N 2.76Å
768	I	83.1	Confident	81.6	Confident	17 Å²	17	58.1 Å²	58.1	9%	0.087	29%	0.291	C	S	.	.	I	π-helix	trans	-64.6	-48.6	175.1	-67.3	161.5	0	0	0	110.5	P749 A753 K764 A765 L766 V770 E772 L773	P749-I768 HydrophobicContact CB-CG2 3.78Å; P749-I768 WeakPolarHBondContact O-CG2 3.43Å; A753-I768 HydrophobicContact CB-CB 4.27Å; A753-I768 HydrophobicContact CB-CG2 4.1Å; K764-I768 WeakPolarHBondContact O-CG1 3.32Å; K764-I768 PolarHBondContact O-N 2.97Å; A765-I768 PolarHBondContact O-N 2.77Å; L766-I768 VanDerWaalsContact C-N 3.31Å; L766-I768 PolarHBondContact O-N 2.81Å; I768-V770 PolarHBondContact O-N 2.69Å; I768-E772 HydrophobicContact CG2-CB 4.4Å; I768-E772 WeakPolarHBondContact O-CA 3.09Å; I768-E772 WeakPolarHBondContact O-CB 3.37Å; I768-E772 PolarHBondContact O-N 3.06Å; I768-L773 PolarHBondContact O-N 2.95Å
769	L	82.9	Confident	81.8	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.01	28%	0.28	C	S	.	.	I	π-helix	trans	-60.5	-44.1	179.3	-65	170	0	0	0	112.1	M750 A753 A765 L766 L773 R774 D775 A778 A779 Y782	M750-L769 HydrophobicContact CE-CD2 4.4Å; M750-L769 HydrophobicContact SD-CD2 3.53Å; M750-L769 VanDerWaalsContact SD-CD2 3.53Å; A753-L769 HydrophobicContact CB-CD1 4.45Å; A753-L769 HydrophobicContact CB-CD2 4Å; A753-L769 HydrophobicContact CB-CG 3.94Å; A765-L769 WeakPolarHBondContact O-CG 3.34Å; A765-L769 PolarHBondContact O-N 2.7Å; A765-L769 VanDerWaalsContact O-N 3.11Å; L766-L769 HydrophobicContact CD2-CD1 4.43Å; L766-L769 PolarHBondContact O-N 2.99Å; L769-L773 HydrophobicContact CD2-CD1 3.97Å; L769-L773 WeakPolarHBondContact O-CB 3.34Å; L769-R774 PolarHBondContact O-N 3.36Å; L769-D775 PolarHBondContact O-N 2.74Å; L769-D775 VanDerWaalsContact O-N 3.11Å; L769-A778 HydrophobicContact CD2-CB 4.32Å; L769-A779 HydrophobicContact CB-CB 4.17Å; L769-Y782 HydrophobicContact CD1-CD1 4.3Å; L769-Y782 HydrophobicContact CD1-CD2 4.09Å; L769-Y782 HydrophobicContact CD1-CG 3.76Å
770	V	82.4	Confident	82	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.012	27%	0.273	C	S	.	.	I	π-helix	trans	-81	-42	-174.2	173.9	0	0	0	0	113.4	L766 I768 R774 F776 A779 L802 I805 Y806 L816	L766-V770 WeakPolarHBondContact O-CB 3.37Å; L766-V770 VanDerWaalsContact O-CG2 3.28Å; L766-V770 WeakPolarHBondContact O-CG2 3.44Å; L766-V770 PolarHBondContact O-N 2.92Å; I768-V770 PolarHBondContact O-N 2.69Å; V770-R774 WeakPolarHBondContact O-CA 3.49Å; V770-F776 HydrophobicContact CG1-CE1 4.42Å; V770-A779 HydrophobicContact CG2-CB 4.02Å; V770-L802 HydrophobicContact CG2-CD1 3.82Å; V770-I805 HydrophobicContact CB-CG2 4.3Å; V770-I805 HydrophobicContact CG1-CG2 4.12Å; V770-I805 HydrophobicContact CG2-CG2 4.42Å; V770-Y806 HydrophobicContact CB-CE1 4.25Å; V770-Y806 HydrophobicContact CG1-CD1 3.77Å; V770-Y806 HydrophobicContact CG1-CE1 3.65Å; V770-Y806 HydrophobicContact CG2-CD1 4.22Å; V770-Y806 HydrophobicContact CG2-CE1 3.53Å; V770-L816 HydrophobicContact CG1-CD2 3.75Å
771	H	80.4	Confident	82.3	Confident	75 Å²	75	57.4 Å²	57.4	35%	0.347	28%	0.279	S	S	.	.	I	π-helix	trans	-103.4	-31.9	-172.2	-62.5	-67.3	0	0	0	114.5	H767	H767-H771 AromaticContact CD2-CD2 3.47Å; H767-H771 PolarHBondContact CD2-CD2 2.78Å; H767-H771 VanDerWaalsContact CD2-CD2 3.47Å; H767-H771 AromaticContact CE1-CD2 3.83Å; H767-H771 AromaticContact CG-CD2 3.7Å; H767-H771 AromaticContact ND1-CD2 3.91Å; H767-H771 AromaticContact NE2-CD2 3.58Å; H767-H771 WeakPolarHBondContact O-CB 3.45Å; H767-H771 PolarHBondContact O-N 2.76Å
772	E	78.5	Confident	82.2	Confident	131 Å²	131	55 Å²	55	61%	0.612	27%	0.267	S	S	*	.	I	π-helix	trans	-90.9	-43	178.3	-58.5	-175.8	-173.3	0	0	112	I768	I768-E772 HydrophobicContact CG2-CB 4.4Å; I768-E772 WeakPolarHBondContact O-CA 3.09Å; I768-E772 WeakPolarHBondContact O-CB 3.37Å; I768-E772 PolarHBondContact O-N 3.06Å
773	L	78.1	Confident	82.2	Confident	67 Å²	67	53.2 Å²	53.2	35%	0.351	26%	0.259	S	S	.	.	I	π-helix	trans	-90.1	-30	178.9	-84.5	163.6	0	0	0	114	P749 M750 I768 L769 D775	P749-L773 HydrophobicContact CB-CD1 4.06Å; P749-L773 HydrophobicContact CB-CG 4.1Å; P749-L773 HydrophobicContact CG-CD1 4.06Å; P749-L773 HydrophobicContact CG-CD2 3.86Å; P749-L773 HydrophobicContact CG-CG 3.84Å; M750-L773 HydrophobicContact CB-CD1 4.1Å; M750-L773 HydrophobicContact SD-CD1 4.22Å; I768-L773 PolarHBondContact O-N 2.95Å; L769-L773 HydrophobicContact CD2-CD1 3.97Å; L769-L773 WeakPolarHBondContact O-CB 3.34Å; L773-D775 HydrophobicContact CB-CB 4.36Å; L773-D775 PolarHBondContact O-N 3.25Å
774	R	77.4	Confident	82.3	Confident	155 Å²	155	49.7 Å²	49.7	59%	0.585	24%	0.244	S	C	*	.			trans	54.6	29.7	-169.8	-55.6	-169	-176.1	-159.5	8	114.1	L769 V770 F776 E815	L769-R774 PolarHBondContact O-N 3.36Å; V770-R774 WeakPolarHBondContact O-CA 3.49Å; R774-F776 HydrophobicContact CB-CZ 4.44Å; R774-F776 PolarHBondContact O-N 2.98Å; R774-E815 IonicContact CZ-OE2 2.72Å; R774-E815 IonicContact NH1-OE1 3.29Å; R774-E815 IonicContact NH1-OE2 3.82Å; R774-E815 PolarHBondContact NH1-OE2 2.79Å
775	D	81.9	Confident	82.3	Confident	74 Å²	74	47.3 Å²	47.3	40%	0.396	23%	0.232	S	C	.	.			trans	-98.8	91.3	179.2	-168.2	-21.7	0	0	0	109.6	L769 L773 A777 A778 A779	L769-D775 PolarHBondContact O-N 2.74Å; L769-D775 VanDerWaalsContact O-N 3.11Å; L773-D775 HydrophobicContact CB-CB 4.36Å; L773-D775 PolarHBondContact O-N 3.25Å; D775-A777 VanDerWaalsContact C-N 3.31Å; D775-A777 PolarHBondContact OD1-N 3.46Å; D775-A778 HydrophobicContact CB-CB 3.85Å; D775-A778 PolarHBondContact O-N 2.91Å; D775-A778 WeakPolarHBondContact OD1-CB 3.34Å; D775-A778 PolarHBondContact OD1-N 2.88Å; D775-A779 PolarHBondContact O-N 2.83Å; D775-A779 VanDerWaalsContact O-N 3.09Å
776	F	83	Confident	81.9	Confident	52 Å²	52	48 Å²	48	23%	0.228	24%	0.236	C	C	.	.	H	α-helix	trans	-69	-30.3	-177.5	-50.1	-45.2	0	0	0	112.2	V770 R774 A779 E780 Y806 L816 A819	V770-F776 HydrophobicContact CG1-CE1 4.42Å; R774-F776 HydrophobicContact CB-CZ 4.44Å; R774-F776 PolarHBondContact O-N 2.98Å; F776-A779 PolarHBondContact O-N 2.88Å; F776-E780 PolarHBondContact O-N 3.18Å; F776-E780 VanDerWaalsContact O-N 3.12Å; F776-Y806 WeakPolarHBondContact CB-OH 3.06Å; F776-Y806 AromaticContact CD1-CE1 3.85Å; F776-Y806 HydrophobicContact CD1-CE1 3.85Å; F776-Y806 HydrophobicContact CE1-CE1 4.37Å; F776-L816 HydrophobicContact CD1-CD2 4.33Å; F776-L816 HydrophobicContact CE1-CD2 3.39Å; F776-L816 HydrophobicContact CZ-CD2 3.73Å; F776-A819 HydrophobicContact CB-CB 4.36Å; F776-A819 HydrophobicContact CD1-CB 4.3Å; F776-A819 HydrophobicContact CD2-CB 3.93Å; F776-A819 HydrophobicContact CE2-CB 4.33Å; F776-A819 HydrophobicContact CG-CB 3.92Å
777	A	82.4	Confident	81.7	Confident	60 Å²	60	48.2 Å²	48.2	50%	0.496	24%	0.238	S	C	.	.	H	α-helix	trans	-69.9	-44.8	174.8	0	0	0	0	0	110.8	D775 A779 E780 D781	D775-A777 VanDerWaalsContact C-N 3.31Å; D775-A777 PolarHBondContact OD1-N 3.46Å; A777-A779 PolarHBondContact O-N 3.29Å; A777-E780 PolarHBondContact O-N 3.49Å; A777-E780 VanDerWaalsContact O-N 3.13Å; A777-D781 PolarHBondContact O-N 2.61Å
778	A	81.8	Confident	81.3	Confident	10 Å²	10	50.7 Å²	50.7	8%	0.083	25%	0.25	C	C	.	.	H	α-helix	trans	-63	-28.3	173.9	0	0	0	0	0	113.1	M750 L769 D775 Y782	M750-A778 HydrophobicContact CE-CB 4.18Å; L769-A778 HydrophobicContact CD2-CB 4.32Å; D775-A778 HydrophobicContact CB-CB 3.85Å; D775-A778 PolarHBondContact O-N 2.91Å; D775-A778 WeakPolarHBondContact OD1-CB 3.34Å; D775-A778 PolarHBondContact OD1-N 2.88Å; A778-Y782 WeakPolarHBondContact O-CB 3.46Å; A778-Y782 PolarHBondContact O-N 3.13Å
779	A	83.9	Confident	80.3	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-70.1	-39.4	172.4	0	0	0	0	0	112.6	L766 L769 V770 D775 F776 A777 C783 L802	L766-A779 HydrophobicContact CD2-CB 4.44Å; L769-A779 HydrophobicContact CB-CB 4.17Å; V770-A779 HydrophobicContact CG2-CB 4.02Å; D775-A779 PolarHBondContact O-N 2.83Å; D775-A779 VanDerWaalsContact O-N 3.09Å; F776-A779 PolarHBondContact O-N 2.88Å; A777-A779 PolarHBondContact O-N 3.29Å; A779-C783 PolarHBondContact O-N 3.26Å; A779-L802 HydrophobicContact CB-CD1 3.98Å; A779-L802 HydrophobicContact CB-CD2 4.22Å
780	E	85	Confident	79.9	Confident	32 Å²	32	61.2 Å²	61.2	15%	0.15	32%	0.318	C	S	.	.	H	α-helix	trans	-65.6	-49.2	171.4	-72.5	-177.2	-162.2	0	0	111.7	F776 A777 Y782 C783 L784 L802 L823 H827	F776-E780 PolarHBondContact O-N 3.18Å; F776-E780 VanDerWaalsContact O-N 3.12Å; A777-E780 PolarHBondContact O-N 3.49Å; A777-E780 VanDerWaalsContact O-N 3.13Å; E780-Y782 VanDerWaalsContact C-N 3.26Å; E780-Y782 PolarHBondContact O-N 2.91Å; E780-C783 WeakPolarHBondContact O-CB 3.29Å; E780-C783 PolarHBondContact O-N 3.32Å; E780-L784 WeakPolarHBondContact O-CG 3.43Å; E780-L784 PolarHBondContact O-N 3.08Å; E780-L802 HydrophobicContact CG-CD2 4.36Å; E780-L823 HydrophobicContact CG-CD1 3.49Å; E780-L823 VanDerWaalsContact CG-CD1 3.49Å; E780-L823 WeakPolarHBondContact OE1-CD1 3.22Å; E780-H827 IonicContact OE2-CD2 3.12Å; E780-H827 PolarHBondContact OE2-CD2 3.26Å; E780-H827 IonicContact OE2-CE1 3.39Å; E780-H827 IonicContact OE2-NE2 3.86Å; E780-H827 PolarHBondContact OE2-NE2 2.81Å
781	D	83.7	Confident	79.6	Confident	105 Å²	105	66.9 Å²	66.9	56%	0.561	35%	0.348	S	S	*	.	H	α-helix	trans	-58.2	-36.8	176.9	-80.5	-21.6	0	0	0	112.3	A777 L784 W785	A777-D781 PolarHBondContact O-N 2.61Å; D781-L784 PolarHBondContact O-N 2.84Å; D781-W785 VanDerWaalsContact O-CB 3.27Å; D781-W785 WeakPolarHBondContact O-CB 3.09Å; D781-W785 PolarHBondContact O-N 2.96Å
782	Y	84.5	Confident	79.4	Confident	13 Å²	13	67.4 Å²	67.4	5%	0.051	36%	0.358	C	S	.	.	H	α-helix	trans	-65.3	-40.9	174.2	168.9	-85.3	0	0	0	112.5	G757 H762 A765 L766 L769 A778 E780 W785 C786	G757-Y782 VanDerWaalsContact CA-OH 3.23Å; G757-Y782 WeakPolarHBondContact CA-OH 3.34Å; H762-Y782 WeakPolarHBondContact CA-OH 3.27Å; H762-Y782 AromaticContact ND1-CZ 3.98Å; H762-Y782 PolarHBondContact ND1-OH 2.81Å; A765-Y782 HydrophobicContact CB-CE1 4.38Å; A765-Y782 HydrophobicContact CB-CE2 3.85Å; A765-Y782 VanDerWaalsContact CB-OH 3.29Å; A765-Y782 WeakPolarHBondContact CB-OH 3.2Å; L766-Y782 HydrophobicContact CD2-CD1 3.41Å; L766-Y782 VanDerWaalsContact CD2-CD1 3.41Å; L766-Y782 HydrophobicContact CD2-CE1 3.73Å; L766-Y782 HydrophobicContact CD2-CG 4.38Å; L766-Y782 HydrophobicContact CG-CD1 4.08Å; L766-Y782 HydrophobicContact CG-CE1 3.84Å; L769-Y782 HydrophobicContact CD1-CD1 4.3Å; L769-Y782 HydrophobicContact CD1-CD2 4.09Å; L769-Y782 HydrophobicContact CD1-CG 3.76Å; A778-Y782 WeakPolarHBondContact O-CB 3.46Å; A778-Y782 PolarHBondContact O-N 3.13Å; E780-Y782 VanDerWaalsContact C-N 3.26Å; E780-Y782 PolarHBondContact O-N 2.91Å; Y782-W785 AromaticContact CD2-CE3 3.99Å; Y782-W785 HydrophobicContact CD2-CE3 3.99Å; Y782-W785 HydrophobicContact CD2-CZ3 4.04Å; Y782-W785 HydrophobicContact CE2-CE3 4.35Å; Y782-W785 HydrophobicContact CE2-CZ3 4.02Å; Y782-W785 PolarHBondContact O-N 2.81Å; Y782-C786 VanDerWaalsContact CE2-SG 3.59Å; Y782-C786 VanDerWaalsContact CZ-SG 3.52Å; Y782-C786 WeakPolarHBondContact O-CB 3.07Å; Y782-C786 PolarHBondContact O-N 2.63Å; Y782-C786 PolarHBondContact O-SG 3.04Å; Y782-C786 VanDerWaalsContact O-SG 3.42Å
783	C	83.5	Confident	79.4	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-65.5	-39.9	174.4	-76.5	0	0	0	0	111.7	A779 E780 S787 L798 F799	A779-C783 PolarHBondContact O-N 3.26Å; E780-C783 WeakPolarHBondContact O-CB 3.29Å; E780-C783 PolarHBondContact O-N 3.32Å; C783-S787 WeakPolarHBondContact O-CB 3.17Å; C783-S787 PolarHBondContact O-N 3.17Å; C783-S787 PolarHBondContact O-OG 3.19Å; C783-L798 HydrophobicContact CB-CB 4.42Å; C783-F799 HydrophobicContact CB-CD1 4.46Å; C783-F799 HydrophobicContact CB-CD2 4.32Å; C783-F799 HydrophobicContact CB-CE1 4.18Å; C783-F799 HydrophobicContact CB-CE2 4.03Å; C783-F799 HydrophobicContact CB-CZ 3.95Å
784	L	83.3	Confident	79.6	Confident	47 Å²	47	64.5 Å²	64.5	25%	0.246	35%	0.35	C	S	.	.	H	α-helix	trans	-60.9	-54.1	172.4	-65.8	174.2	0	0	0	110.6	E780 D781 S787 E788 R795 F799	E780-L784 WeakPolarHBondContact O-CG 3.43Å; E780-L784 PolarHBondContact O-N 3.08Å; D781-L784 PolarHBondContact O-N 2.84Å; L784-S787 PolarHBondContact O-N 2.66Å; L784-S787 PolarHBondContact O-OG 3.43Å; L784-E788 PolarHBondContact O-N 2.89Å; L784-R795 VanDerWaalsContact CD2-NH1 3.32Å; L784-R795 VanDerWaalsContact CD2-NH2 3.34Å; L784-F799 HydrophobicContact CD2-CE2 4.16Å; L784-F799 HydrophobicContact CD2-CZ 3.83Å; L784-F799 HydrophobicContact CG-CZ 4.16Å
785	W	80.9	Confident	79.8	Confident	56 Å²	56	60 Å²	60	21%	0.212	33%	0.333	C	S	.	.	H	α-helix	trans	-59	-48.1	-179.2	170.2	61.5	0	0	0	113.4	Q729 I754 K758 D781 Y782 S787 E788	Q729-W785 HydrophobicContact CB-CZ2 4.13Å; Q729-W785 HydrophobicContact CG-CZ2 4.21Å; Q729-W785 WeakPolarHBondContact O-CZ2 3.47Å; I754-W785 HydrophobicContact CG2-CH2 3.97Å; I754-W785 HydrophobicContact CG2-CZ3 4.47Å; K758-W785 HydrophobicContact CD-CH2 4.25Å; K758-W785 HydrophobicContact CD-CZ2 4.47Å; K758-W785 HydrophobicContact CG-CH2 4.4Å; D781-W785 VanDerWaalsContact O-CB 3.27Å; D781-W785 WeakPolarHBondContact O-CB 3.09Å; D781-W785 PolarHBondContact O-N 2.96Å; Y782-W785 AromaticContact CD2-CE3 3.99Å; Y782-W785 HydrophobicContact CD2-CE3 3.99Å; Y782-W785 HydrophobicContact CD2-CZ3 4.04Å; Y782-W785 HydrophobicContact CE2-CE3 4.35Å; Y782-W785 HydrophobicContact CE2-CZ3 4.02Å; Y782-W785 PolarHBondContact O-N 2.81Å; W785-S787 PolarHBondContact O-N 3.32Å; W785-S787 VanDerWaalsContact O-N 3.13Å; W785-E788 PolarHBondContact O-N 2.93Å
786	C	77.3	Confident	79.9	Confident	13 Å²	13	59.7 Å²	59.7	9%	0.088	33%	0.329	C	S	.	.	H	α-helix	trans	-65.3	-15.7	177.4	-71.8	0	0	0	0	113.4	Y782 L798	Y782-C786 VanDerWaalsContact CE2-SG 3.59Å; Y782-C786 VanDerWaalsContact CZ-SG 3.52Å; Y782-C786 WeakPolarHBondContact O-CB 3.07Å; Y782-C786 PolarHBondContact O-N 2.63Å; Y782-C786 PolarHBondContact O-SG 3.04Å; Y782-C786 VanDerWaalsContact O-SG 3.42Å; C786-L798 HydrophobicContact CB-CD1 3.63Å
787	S	79.1	Confident	79.9	Confident	5 Å²	5	62.5 Å²	62.5	4%	0.035	34%	0.343	C	S	.	.	H	α-helix	trans	-95.2	-9.4	177.5	76.9	0	0	0	0	114.8	C783 L784 W785 G789 R790 R795	C783-S787 WeakPolarHBondContact O-CB 3.17Å; C783-S787 PolarHBondContact O-N 3.17Å; C783-S787 PolarHBondContact O-OG 3.19Å; L784-S787 PolarHBondContact O-N 2.66Å; L784-S787 PolarHBondContact O-OG 3.43Å; W785-S787 PolarHBondContact O-N 3.32Å; W785-S787 VanDerWaalsContact O-N 3.13Å; S787-G789 PolarHBondContact O-N 3.04Å; S787-R790 PolarHBondContact O-N 2.74Å; S787-R790 VanDerWaalsContact O-N 3.12Å; S787-R795 WeakPolarHBondContact OG-CD 3.4Å; S787-R795 PolarHBondContact OG-NH1 3.3Å
788	E	73.1	Confident	80	Confident	149 Å²	149	59.8 Å²	59.8	70%	0.696	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	125.4	-178	-69.3	-166.6	127.8	0	0	111.4	L784 W785 R790	L784-E788 PolarHBondContact O-N 2.89Å; W785-E788 PolarHBondContact O-N 2.93Å; E788-R790 PolarHBondContact O-N 3.39Å
789	G	63.4	Low	80.2	Confident	95 Å²	95	59.3 Å²	59.3	98%	0.979	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	7.9	-179.9	0	0	0	0	0	116	S787	S787-G789 PolarHBondContact O-N 3.04Å
790	R	75.2	Confident	80.3	Confident	144 Å²	144	59.9 Å²	59.9	54%	0.543	32%	0.318	S	S	.	.	S	Bend	trans	-105.3	164.1	176.8	-65.7	-173	173.8	-172.2	-1.3	112.4	S787 E788 H794	S787-R790 PolarHBondContact O-N 2.74Å; S787-R790 VanDerWaalsContact O-N 3.12Å; E788-R790 PolarHBondContact O-N 3.39Å; R790-H794 HydrophobicContact CB-CB 4.47Å; R790-H794 WeakPolarHBondContact CD-CD2 3.37Å; R790-H794 PolarHBondContact NH1-CE1 3.08Å; R790-H794 PolarHBondContact NH1-NE2 2.89Å
791	D	74.5	Confident	80.2	Confident	122 Å²	122	59.3 Å²	59.3	65%	0.652	32%	0.317	S	S	*	.			trans	-62.2	141.1	-179.7	-67.7	-54.7	0	0	0	112.3	P793 H794	D791-P793 VanDerWaalsContact C-CD 3.49Å; D791-P793 HydrophobicContact CB-CG 4.1Å; D791-H794 WeakPolarHBondContact O-CB 3.46Å; D791-H794 PolarHBondContact O-N 2.94Å
792	P	76.4	Confident	80.3	Confident	86 Å²	86	54.3 Å²	54.3	56%	0.558	29%	0.29	S	S	*	.	H	α-helix	trans	-45.4	-44.3	177	-30.3	35.6	0	0	0	116.6	H794 R795 Q796	P792-H794 PolarHBondContact O-N 2.95Å; P792-H794 VanDerWaalsContact O-N 3.17Å; P792-R795 VanDerWaalsContact O-CB 3.29Å; P792-R795 WeakPolarHBondContact O-CB 3.37Å; P792-R795 PolarHBondContact O-N 3.38Å; P792-Q796 WeakPolarHBondContact O-CG 3.44Å; P792-Q796 PolarHBondContact O-N 3.35Å
793	P	79.9	Confident	80.3	Confident	85 Å²	85	53.7 Å²	53.7	55%	0.552	29%	0.288	S	S	*	.	H	α-helix	trans	-58.9	-26.7	175.9	21	-35.2	0	0	0	114.7	D791 H797	D791-P793 VanDerWaalsContact C-CD 3.49Å; D791-P793 HydrophobicContact CB-CG 4.1Å; P793-H797 WeakPolarHBondContact O-CB 3.4Å; P793-H797 PolarHBondContact O-N 2.95Å
794	H	80.9	Confident	80.4	Confident	51 Å²	51	55.2 Å²	55.2	24%	0.236	30%	0.301	C	S	.	.	H	α-helix	trans	-71.7	-39.5	174.7	-174.7	69.7	0	0	0	111.6	R790 D791 P792 H797 L798	R790-H794 HydrophobicContact CB-CB 4.47Å; R790-H794 WeakPolarHBondContact CD-CD2 3.37Å; R790-H794 PolarHBondContact NH1-CE1 3.08Å; R790-H794 PolarHBondContact NH1-NE2 2.89Å; D791-H794 WeakPolarHBondContact O-CB 3.46Å; D791-H794 PolarHBondContact O-N 2.94Å; P792-H794 PolarHBondContact O-N 2.95Å; P792-H794 VanDerWaalsContact O-N 3.17Å; H794-H797 PolarHBondContact O-N 2.82Å; H794-L798 WeakPolarHBondContact O-CG 3.23Å; H794-L798 PolarHBondContact O-N 2.85Å; H794-L798 VanDerWaalsContact O-N 3.12Å
795	R	83	Confident	80.4	Confident	62 Å²	62	53.9 Å²	53.9	23%	0.234	29%	0.294	C	S	.	.	H	α-helix	trans	-61.3	-50.9	172.8	-172	167.1	162.2	100.9	-3.2	111	L784 S787 P792 H797 L798 F799 E830	L784-R795 VanDerWaalsContact CD2-NH1 3.32Å; L784-R795 VanDerWaalsContact CD2-NH2 3.34Å; S787-R795 WeakPolarHBondContact OG-CD 3.4Å; S787-R795 PolarHBondContact OG-NH1 3.3Å; P792-R795 VanDerWaalsContact O-CB 3.29Å; P792-R795 WeakPolarHBondContact O-CB 3.37Å; P792-R795 PolarHBondContact O-N 3.38Å; R795-H797 VanDerWaalsContact C-N 3.29Å; R795-H797 PolarHBondContact O-N 2.93Å; R795-L798 PolarHBondContact O-N 2.97Å; R795-L798 VanDerWaalsContact O-N 3.15Å; R795-F799 HydrophobicContact CG-CD2 4.11Å; R795-F799 HydrophobicContact CG-CE2 4.07Å; R795-F799 WeakPolarHBondContact O-CD2 3.43Å; R795-F799 PolarHBondContact O-N 2.82Å; R795-F799 VanDerWaalsContact O-N 3.09Å; R795-E830 WeakPolarHBondContact CD-OE2 3.39Å; R795-E830 IonicContact CZ-OE1 2.67Å; R795-E830 VanDerWaalsContact CZ-OE1 3.29Å; R795-E830 IonicContact CZ-OE2 2.93Å; R795-E830 IonicContact NE-OE1 2.75Å; R795-E830 PolarHBondContact NE-OE1 2.79Å; R795-E830 IonicContact NE-OE2 3.58Å; R795-E830 PolarHBondContact NE-OE2 2.9Å; R795-E830 IonicContact NH2-OE1 2.99Å; R795-E830 PolarHBondContact NH2-OE1 2.89Å; R795-E830 IonicContact NH2-OE2 2.82Å
796	Q	82.8	Confident	80.5	Confident	66 Å²	66	51.4 Å²	51.4	31%	0.308	28%	0.284	S	S	.	.	H	α-helix	trans	-55.9	-43.2	175.4	-64.7	-179.6	-43.4	0	0	111.5	P792 L798 F799 H800 E830	P792-Q796 WeakPolarHBondContact O-CG 3.44Å; P792-Q796 PolarHBondContact O-N 3.35Å; Q796-L798 PolarHBondContact O-N 2.84Å; Q796-F799 PolarHBondContact O-N 2.92Å; Q796-H800 WeakPolarHBondContact O-CB 3.43Å; Q796-H800 PolarHBondContact O-CD2 2.78Å; Q796-H800 PolarHBondContact O-N 3.35Å; Q796-E830 WeakPolarHBondContact CG-O 3.43Å
797	H	84.3	Confident	80.5	Confident	112 Å²	112	52.6 Å²	52.6	52%	0.519	29%	0.29	S	S	.	.	H	α-helix	trans	-61.1	-43.1	177.1	-179.9	52.7	0	0	0	113	P793 H794 R795 H800 T801	P793-H797 WeakPolarHBondContact O-CB 3.4Å; P793-H797 PolarHBondContact O-N 2.95Å; H794-H797 PolarHBondContact O-N 2.82Å; R795-H797 VanDerWaalsContact C-N 3.29Å; R795-H797 PolarHBondContact O-N 2.93Å; H797-H800 PolarHBondContact O-N 2.9Å; H797-T801 WeakPolarHBondContact O-CB 3.41Å; H797-T801 PolarHBondContact O-N 2.94Å; H797-T801 PolarHBondContact O-OG1 2.99Å
798	L	84.4	Confident	80.2	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-63.3	-45	176.7	-69.1	169.2	0	0	0	112	H762 C783 C786 H794 R795 Q796 T801 L802	H762-L798 HydrophobicContact CB-CD2 3.97Å; C783-L798 HydrophobicContact CB-CB 4.42Å; C786-L798 HydrophobicContact CB-CD1 3.63Å; H794-L798 WeakPolarHBondContact O-CG 3.23Å; H794-L798 PolarHBondContact O-N 2.85Å; H794-L798 VanDerWaalsContact O-N 3.12Å; R795-L798 PolarHBondContact O-N 2.97Å; R795-L798 VanDerWaalsContact O-N 3.15Å; Q796-L798 PolarHBondContact O-N 2.84Å; L798-T801 PolarHBondContact O-N 2.93Å; L798-L802 PolarHBondContact O-N 2.91Å
799	F	85.4	Confident	79.7	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-64.2	-40.6	175.6	-83.8	-77.3	0	0	0	112.6	C783 L784 R795 Q796 L802 L803 L823 H827 E830 F831	C783-F799 HydrophobicContact CB-CD1 4.46Å; C783-F799 HydrophobicContact CB-CD2 4.32Å; C783-F799 HydrophobicContact CB-CE1 4.18Å; C783-F799 HydrophobicContact CB-CE2 4.03Å; C783-F799 HydrophobicContact CB-CZ 3.95Å; L784-F799 HydrophobicContact CD2-CE2 4.16Å; L784-F799 HydrophobicContact CD2-CZ 3.83Å; L784-F799 HydrophobicContact CG-CZ 4.16Å; R795-F799 HydrophobicContact CG-CD2 4.11Å; R795-F799 HydrophobicContact CG-CE2 4.07Å; R795-F799 WeakPolarHBondContact O-CD2 3.43Å; R795-F799 PolarHBondContact O-N 2.82Å; R795-F799 VanDerWaalsContact O-N 3.09Å; Q796-F799 PolarHBondContact O-N 2.92Å; F799-L802 PolarHBondContact O-N 2.83Å; F799-L803 WeakPolarHBondContact O-CB 3.5Å; F799-L803 PolarHBondContact O-N 2.98Å; F799-L823 HydrophobicContact CD1-CD1 4.02Å; F799-L823 HydrophobicContact CE1-CD1 4.08Å; F799-H827 HydrophobicContact CE1-CB 4.22Å; F799-H827 AromaticContact CE1-CD2 3.99Å; F799-H827 AromaticContact CE1-CG 3.91Å; F799-E830 HydrophobicContact CD2-CB 3.98Å; F799-E830 HydrophobicContact CD2-CG 4.44Å; F799-E830 HydrophobicContact CE2-CB 4.33Å; F799-E830 HydrophobicContact CE2-CG 4.29Å; F799-E830 HydrophobicContact CG-CB 4.25Å; F799-F831 HydrophobicContact CB-CD1 4.5Å; F799-F831 HydrophobicContact CB-CE1 3.88Å; F799-F831 HydrophobicContact CB-CZ 3.9Å; F799-F831 HydrophobicContact CD1-CZ 4.22Å; F799-F831 HydrophobicContact CG-CZ 4.49Å; F799-F831 WeakPolarHBondContact O-CE1 3.23Å
800	H	84.7	Confident	79.5	Confident	12 Å²	12	54 Å²	54	6%	0.056	28%	0.28	C	S	.	.	H	α-helix	trans	-63.7	-37.5	172.4	-77.2	-62	0	0	0	112.5	Q796 H797 A804 F831 D832 M839	Q796-H800 WeakPolarHBondContact O-CB 3.43Å; Q796-H800 PolarHBondContact O-CD2 2.78Å; Q796-H800 PolarHBondContact O-N 3.35Å; H797-H800 PolarHBondContact O-N 2.9Å; H800-A804 VanDerWaalsContact O-CB 3.31Å; H800-A804 WeakPolarHBondContact O-CB 2.72Å; H800-A804 PolarHBondContact O-N 2.83Å; H800-F831 AromaticContact CE1-CD1 3.82Å; H800-F831 AromaticContact ND1-CD1 3.74Å; H800-D832 PolarHBondContact NE2-N 3.01Å; H800-M839 HydrophobicContact CB-CE 4.44Å; H800-M839 WeakPolarHBondContact ND1-CE 2.93Å
801	T	84.8	Confident	78.6	Confident	20 Å²	20	54.3 Å²	54.3	12%	0.123	30%	0.301	C	S	.	.	H	α-helix	trans	-68.3	-40.3	174.8	-68.6	0	0	0	0	112	E763 L766 H797 L798 A804 I805	E763-T801 HydrophobicContact CG-CG2 4.08Å; L766-T801 HydrophobicContact CD1-CG2 4.09Å; H797-T801 WeakPolarHBondContact O-CB 3.41Å; H797-T801 PolarHBondContact O-N 2.94Å; H797-T801 PolarHBondContact O-OG1 2.99Å; L798-T801 PolarHBondContact O-N 2.93Å; T801-A804 PolarHBondContact O-N 3.35Å; T801-I805 HydrophobicContact CG2-CD1 4.13Å; T801-I805 WeakPolarHBondContact O-CG1 3.26Å; T801-I805 PolarHBondContact O-N 3.02Å
802	L	85.3	Confident	77.7	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61.1	-47.4	173.2	177.6	53.8	0	0	0	111.5	L766 V770 A779 E780 L798 F799 A804 I805 Y806 L823	L766-L802 HydrophobicContact CD1-CB 4.14Å; L766-L802 HydrophobicContact CD2-CD1 4.22Å; V770-L802 HydrophobicContact CG2-CD1 3.82Å; A779-L802 HydrophobicContact CB-CD1 3.98Å; A779-L802 HydrophobicContact CB-CD2 4.22Å; E780-L802 HydrophobicContact CG-CD2 4.36Å; L798-L802 PolarHBondContact O-N 2.91Å; F799-L802 PolarHBondContact O-N 2.83Å; L802-A804 VanDerWaalsContact C-N 3.32Å; L802-A804 PolarHBondContact O-N 2.96Å; L802-I805 PolarHBondContact O-N 3.05Å; L802-I805 VanDerWaalsContact O-N 3.13Å; L802-Y806 HydrophobicContact CD1-CD1 4.34Å; L802-Y806 HydrophobicContact CD1-CD2 4.45Å; L802-Y806 HydrophobicContact CD1-CE1 3.82Å; L802-Y806 HydrophobicContact CD1-CE2 3.94Å; L802-Y806 HydrophobicContact CD2-CE2 4.43Å; L802-Y806 HydrophobicContact CG-CD2 4.41Å; L802-Y806 HydrophobicContact CG-CE2 3.93Å; L802-Y806 PolarHBondContact O-N 2.88Å; L802-L823 HydrophobicContact CD2-CD1 3.96Å; L802-L823 HydrophobicContact CD2-CD2 4.25Å; L802-L823 HydrophobicContact CG-CD2 4.07Å
803	L	85.1	Confident	77.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.4	-41.8	174.6	-178.8	63.6	0	0	0	111.7	F799 I805 Y806 L807 A820 L823 L824 F831 V836 M839	F799-L803 WeakPolarHBondContact O-CB 3.5Å; F799-L803 PolarHBondContact O-N 2.98Å; L803-I805 VanDerWaalsContact C-N 3.32Å; L803-I805 PolarHBondContact O-N 2.92Å; L803-Y806 PolarHBondContact O-N 2.85Å; L803-L807 HydrophobicContact CD1-CD1 3.87Å; L803-L807 HydrophobicContact CD1-CG 4.1Å; L803-L807 HydrophobicContact CG-CD1 3.86Å; L803-L807 HydrophobicContact CG-CG 4.4Å; L803-L807 WeakPolarHBondContact O-CB 3.41Å; L803-L807 VanDerWaalsContact O-CG 3.29Å; L803-L807 WeakPolarHBondContact O-CG 3.49Å; L803-L807 PolarHBondContact O-N 2.74Å; L803-A820 HydrophobicContact CD1-CB 4Å; L803-L823 HydrophobicContact CB-CD2 4.12Å; L803-L823 HydrophobicContact CD1-CD2 4.41Å; L803-L824 HydrophobicContact CD1-CD1 4.14Å; L803-L824 HydrophobicContact CD1-CG 4.16Å; L803-L824 HydrophobicContact CD2-CD2 3.89Å; L803-L824 HydrophobicContact CD2-CG 4.4Å; L803-F831 HydrophobicContact CB-CE1 4.05Å; L803-F831 HydrophobicContact CB-CZ 4.48Å; L803-F831 HydrophobicContact CD2-CD1 4.25Å; L803-F831 HydrophobicContact CD2-CE1 3.79Å; L803-F831 HydrophobicContact CD2-CZ 4.46Å; L803-V836 HydrophobicContact CD2-CG1 4.41Å; L803-V836 HydrophobicContact CD2-CG2 3.99Å; L803-M839 HydrophobicContact CD2-CE 4Å
804	A	83.6	Confident	76.6	Confident	33 Å²	33	53.9 Å²	53.9	27%	0.273	30%	0.303	S	S	.	.	H	α-helix	trans	-66.3	-30.3	176.2	0	0	0	0	0	113.1	H800 T801 L802 R808	H800-A804 VanDerWaalsContact O-CB 3.31Å; H800-A804 WeakPolarHBondContact O-CB 2.72Å; H800-A804 PolarHBondContact O-N 2.83Å; T801-A804 PolarHBondContact O-N 3.35Å; L802-A804 VanDerWaalsContact C-N 3.32Å; L802-A804 PolarHBondContact O-N 2.96Å; A804-R808 WeakPolarHBondContact O-CB 3.43Å; A804-R808 WeakPolarHBondContact O-CD 3.35Å; A804-R808 WeakPolarHBondContact O-CG 3.42Å; A804-R808 PolarHBondContact O-N 3.28Å
805	I	83.6	Confident	76.3	Confident	18 Å²	18	56.8 Å²	56.8	9%	0.092	32%	0.317	C	S	.	.	H	α-helix	trans	-69.7	-47.5	172.6	-71.6	165.8	0	0	0	110.3	L766 V770 T801 L802 L803 L807 R808	L766-I805 HydrophobicContact CB-CD1 3.49Å; L766-I805 VanDerWaalsContact CB-CD1 3.49Å; L766-I805 HydrophobicContact CD1-CD1 4.06Å; L766-I805 HydrophobicContact CG-CD1 4.44Å; V770-I805 HydrophobicContact CB-CG2 4.3Å; V770-I805 HydrophobicContact CG1-CG2 4.12Å; V770-I805 HydrophobicContact CG2-CG2 4.42Å; T801-I805 HydrophobicContact CG2-CD1 4.13Å; T801-I805 WeakPolarHBondContact O-CG1 3.26Å; T801-I805 PolarHBondContact O-N 3.02Å; L802-I805 PolarHBondContact O-N 3.05Å; L802-I805 VanDerWaalsContact O-N 3.13Å; L803-I805 VanDerWaalsContact C-N 3.32Å; L803-I805 PolarHBondContact O-N 2.92Å; I805-L807 PolarHBondContact O-N 3.01Å; I805-R808 PolarHBondContact O-N 2.81Å
806	Y	82.8	Confident	76	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-59.7	-43.6	175.8	-65.8	-27.6	0	0	0	112.6	V770 F776 L802 L803 L816 A819 A820 L823	V770-Y806 HydrophobicContact CB-CE1 4.25Å; V770-Y806 HydrophobicContact CG1-CD1 3.77Å; V770-Y806 HydrophobicContact CG1-CE1 3.65Å; V770-Y806 HydrophobicContact CG2-CD1 4.22Å; V770-Y806 HydrophobicContact CG2-CE1 3.53Å; F776-Y806 WeakPolarHBondContact CB-OH 3.06Å; F776-Y806 AromaticContact CD1-CE1 3.85Å; F776-Y806 HydrophobicContact CD1-CE1 3.85Å; F776-Y806 HydrophobicContact CE1-CE1 4.37Å; L802-Y806 HydrophobicContact CD1-CD1 4.34Å; L802-Y806 HydrophobicContact CD1-CD2 4.45Å; L802-Y806 HydrophobicContact CD1-CE1 3.82Å; L802-Y806 HydrophobicContact CD1-CE2 3.94Å; L802-Y806 HydrophobicContact CD2-CE2 4.43Å; L802-Y806 HydrophobicContact CG-CD2 4.41Å; L802-Y806 HydrophobicContact CG-CE2 3.93Å; L802-Y806 PolarHBondContact O-N 2.88Å; L803-Y806 PolarHBondContact O-N 2.85Å; Y806-L816 HydrophobicContact CD1-CD2 3.98Å; Y806-L816 HydrophobicContact CE1-CD2 4.27Å; Y806-A819 HydrophobicContact CD2-CB 4.48Å; Y806-A819 HydrophobicContact CE1-CB 4.49Å; Y806-A819 HydrophobicContact CE2-CB 4.13Å; Y806-A820 HydrophobicContact CD2-CB 4.08Å; Y806-A820 HydrophobicContact CG-CB 4.42Å; Y806-L823 HydrophobicContact CD2-CD2 4Å; Y806-L823 HydrophobicContact CE2-CB 4.35Å; Y806-L823 HydrophobicContact CE2-CD2 3.89Å
807	L	79	Confident	75.7	Confident	39 Å²	39	53.1 Å²	53.1	20%	0.204	31%	0.309	C	S	.	.	H	α-helix	trans	-78.5	-17	-178.4	-65.2	178.1	0	0	0	114.4	L803 I805 A809 A820 L840 P841 W844	L803-L807 HydrophobicContact CD1-CD1 3.87Å; L803-L807 HydrophobicContact CD1-CG 4.1Å; L803-L807 HydrophobicContact CG-CD1 3.86Å; L803-L807 HydrophobicContact CG-CG 4.4Å; L803-L807 WeakPolarHBondContact O-CB 3.41Å; L803-L807 VanDerWaalsContact O-CG 3.29Å; L803-L807 WeakPolarHBondContact O-CG 3.49Å; L803-L807 PolarHBondContact O-N 2.74Å; I805-L807 PolarHBondContact O-N 3.01Å; L807-A809 VanDerWaalsContact C-N 3.31Å; L807-A820 HydrophobicContact CD2-CB 4.18Å; L807-L840 HydrophobicContact CD1-CD2 4.32Å; L807-P841 HydrophobicContact CD2-CG 4.32Å; L807-W844 HydrophobicContact CD2-CH2 3.88Å; L807-W844 HydrophobicContact CD2-CZ2 3.61Å
808	R	72.3	Confident	75.6	Confident	197 Å²	197	50.9 Å²	50.9	74%	0.743	30%	0.303	S	S	*	.	H	α-helix	trans	-75.6	-17.1	174.2	-90.7	171.6	138.7	179.4	-4.6	113.6	A804 I805	A804-R808 WeakPolarHBondContact O-CB 3.43Å; A804-R808 WeakPolarHBondContact O-CD 3.35Å; A804-R808 WeakPolarHBondContact O-CG 3.42Å; A804-R808 PolarHBondContact O-N 3.28Å; I805-R808 PolarHBondContact O-N 2.81Å
809	A	62.4	Low	75.4	Confident	32 Å²	32	51.2 Å²	51.2	26%	0.264	31%	0.306	S	S	.	.	S	Bend	trans	-68.7	132.5	174.5	0	0	0	0	0	110.7	L807 A813 L816	L807-A809 VanDerWaalsContact C-N 3.31Å; A809-A813 HydrophobicContact CB-CB 3.86Å; A809-L816 HydrophobicContact CB-CD1 3.45Å; A809-L816 VanDerWaalsContact CB-CD1 3.45Å
810	G	58.5	Low	75.3	Confident	49 Å²	49	51.2 Å²	51.2	51%	0.505	31%	0.306	S	S	.	.			trans	-61.6	162.4	-178.4	0	0	0	0	0	113.4	A812 A813	G810-A812 PolarHBondContact O-N 3.08Å; G810-A813 PolarHBondContact O-N 2.64Å
811	P	56.5	Low	75.2	Confident	150 Å²	150	51.6 Å²	51.6	97%	0.974	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	8.4	-166.5	26	-36.4	0	0	0	116.8
812	A	55	Low	75.2	Confident	102 Å²	102	54 Å²	54	84%	0.843	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-16.2	169.5	0	0	0	0	0	113.5	G810 H814	G810-A812 PolarHBondContact O-N 3.08Å; A812-H814 PolarHBondContact O-N 3.05Å; A812-H814 VanDerWaalsContact O-N 3.1Å
813	A	64.7	Low	75.2	Confident	35 Å²	35	54 Å²	54	29%	0.289	32%	0.321	S	S	.	.			trans	-87.4	65.9	-174	0	0	0	0	0	113.1	A809 G810 E815 L816 A817	A809-A813 HydrophobicContact CB-CB 3.86Å; G810-A813 PolarHBondContact O-N 2.64Å; A813-E815 VanDerWaalsContact C-N 3.26Å; A813-E815 PolarHBondContact O-N 3.21Å; A813-L816 HydrophobicContact CB-CB 4.27Å; A813-L816 HydrophobicContact CB-CD1 4Å; A813-L816 HydrophobicContact CB-CG 4.26Å; A813-L816 PolarHBondContact O-N 3.46Å; A813-L816 VanDerWaalsContact O-N 3.08Å; A813-A817 PolarHBondContact O-N 2.8Å
814	H	68.7	Low	75.2	Confident	147 Å²	147	54 Å²	54	68%	0.681	32%	0.321	S	S	*	.	H	α-helix	trans	-57.2	-36.3	-177.2	-171.6	51.2	0	0	0	113.4	A812 L816 A817 V818	A812-H814 PolarHBondContact O-N 3.05Å; A812-H814 VanDerWaalsContact O-N 3.1Å; H814-L816 VanDerWaalsContact C-N 3.32Å; H814-L816 PolarHBondContact O-N 2.85Å; H814-A817 PolarHBondContact O-N 2.92Å; H814-V818 PolarHBondContact O-N 2.83Å
815	E	74.6	Confident	75.2	Confident	113 Å²	113	54.5 Å²	54.5	53%	0.528	32%	0.319	S	S	.	.	H	α-helix	trans	-55	-43.8	174.8	-64.7	172	-177.8	0	0	112.3	R774 A813 V818 A819	R774-E815 IonicContact CZ-OE2 2.72Å; R774-E815 IonicContact NH1-OE1 3.29Å; R774-E815 IonicContact NH1-OE2 3.82Å; R774-E815 PolarHBondContact NH1-OE2 2.79Å; A813-E815 VanDerWaalsContact C-N 3.26Å; A813-E815 PolarHBondContact O-N 3.21Å; E815-V818 PolarHBondContact O-N 2.85Å; E815-A819 PolarHBondContact O-N 3.28Å
816	L	77.3	Confident	75.3	Confident	16 Å²	16	59.9 Å²	59.9	8%	0.084	34%	0.344	C	S	.	.	H	α-helix	trans	-75.1	-30	-179.7	-61.9	179.1	0	0	0	112.4	V770 F776 Y806 A809 A813 H814 A820	V770-L816 HydrophobicContact CG1-CD2 3.75Å; F776-L816 HydrophobicContact CD1-CD2 4.33Å; F776-L816 HydrophobicContact CE1-CD2 3.39Å; F776-L816 HydrophobicContact CZ-CD2 3.73Å; Y806-L816 HydrophobicContact CD1-CD2 3.98Å; Y806-L816 HydrophobicContact CE1-CD2 4.27Å; A809-L816 HydrophobicContact CB-CD1 3.45Å; A809-L816 VanDerWaalsContact CB-CD1 3.45Å; A813-L816 HydrophobicContact CB-CB 4.27Å; A813-L816 HydrophobicContact CB-CD1 4Å; A813-L816 HydrophobicContact CB-CG 4.26Å; A813-L816 PolarHBondContact O-N 3.46Å; A813-L816 VanDerWaalsContact O-N 3.08Å; H814-L816 VanDerWaalsContact C-N 3.32Å; H814-L816 PolarHBondContact O-N 2.85Å; L816-A820 WeakPolarHBondContact O-CB 3.17Å; L816-A820 PolarHBondContact O-N 2.74Å
817	A	77.3	Confident	75.2	Confident	34 Å²	34	61.3 Å²	61.3	28%	0.281	35%	0.351	S	S	.	.	H	α-helix	trans	-67.7	-37.9	173	0	0	0	0	0	111.9	A813 H814 V821 W844	A813-A817 PolarHBondContact O-N 2.8Å; H814-A817 PolarHBondContact O-N 2.92Å; A817-V821 WeakPolarHBondContact O-CG2 3.33Å; A817-V821 PolarHBondContact O-N 2.83Å; A817-W844 HydrophobicContact CB-CZ2 4.48Å
818	V	81.8	Confident	75.2	Confident	65 Å²	65	60.1 Å²	60.1	39%	0.394	35%	0.346	S	S	.	.	H	α-helix	trans	-66.2	-50.3	172.6	175.3	0	0	0	0	110.3	H814 E815 A820 V821 D822	H814-V818 PolarHBondContact O-N 2.83Å; E815-V818 PolarHBondContact O-N 2.85Å; V818-A820 PolarHBondContact O-N 2.85Å; V818-V821 PolarHBondContact O-N 3.4Å; V818-D822 WeakPolarHBondContact CG1-OD2 3.35Å; V818-D822 PolarHBondContact O-N 2.83Å
819	A	80.8	Confident	75.4	Confident	9 Å²	9	54.9 Å²	54.9	7%	0.074	34%	0.336	C	S	.	.	H	α-helix	trans	-56.4	-35.8	177.1	0	0	0	0	0	113.1	F776 Y806 E815 L823	F776-A819 HydrophobicContact CB-CB 4.36Å; F776-A819 HydrophobicContact CD1-CB 4.3Å; F776-A819 HydrophobicContact CD2-CB 3.93Å; F776-A819 HydrophobicContact CE2-CB 4.33Å; F776-A819 HydrophobicContact CG-CB 3.92Å; Y806-A819 HydrophobicContact CD2-CB 4.48Å; Y806-A819 HydrophobicContact CE1-CB 4.49Å; Y806-A819 HydrophobicContact CE2-CB 4.13Å; E815-A819 PolarHBondContact O-N 3.28Å; A819-L823 WeakPolarHBondContact O-CB 3.32Å; A819-L823 PolarHBondContact O-N 3.3Å
820	A	82.4	Confident	76.3	Confident	0 Å²	0	55 Å²	55	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-69.9	-34.9	174.5	0	0	0	0	0	114	L803 Y806 L807 L816 V818 L824 W844	L803-A820 HydrophobicContact CD1-CB 4Å; Y806-A820 HydrophobicContact CD2-CB 4.08Å; Y806-A820 HydrophobicContact CG-CB 4.42Å; L807-A820 HydrophobicContact CD2-CB 4.18Å; L816-A820 WeakPolarHBondContact O-CB 3.17Å; L816-A820 PolarHBondContact O-N 2.74Å; V818-A820 PolarHBondContact O-N 2.85Å; A820-L824 WeakPolarHBondContact O-CG 3.3Å; A820-L824 PolarHBondContact O-N 2.95Å; A820-W844 HydrophobicContact CB-CH2 3.78Å; A820-W844 HydrophobicContact CB-CZ2 4.37Å
821	V	83.3	Confident	77.4	Confident	20 Å²	20	53.1 Å²	53.1	12%	0.121	31%	0.309	C	S	.	.	H	α-helix	trans	-68.7	-42.6	172.9	170.6	0	0	0	0	110.6	A817 V818 L824 N825 W844	A817-V821 WeakPolarHBondContact O-CG2 3.33Å; A817-V821 PolarHBondContact O-N 2.83Å; V818-V821 PolarHBondContact O-N 3.4Å; V821-L824 PolarHBondContact O-N 2.95Å; V821-N825 WeakPolarHBondContact CG1-ND2 3.42Å; V821-N825 WeakPolarHBondContact O-CB 3.5Å; V821-N825 PolarHBondContact O-N 2.81Å; V821-N825 PolarHBondContact O-ND2 2.84Å; V821-W844 HydrophobicContact CB-CZ3 4.49Å; V821-W844 HydrophobicContact CG2-CE3 3.94Å; V821-W844 HydrophobicContact CG2-CH2 3.56Å; V821-W844 HydrophobicContact CG2-CZ2 4.25Å; V821-W844 HydrophobicContact CG2-CZ3 3.38Å
822	D	84.2	Confident	78.6	Confident	70 Å²	70	49.7 Å²	49.7	37%	0.374	28%	0.283	S	S	.	.	H	α-helix	trans	-67.8	-45.4	-179.7	-67.5	-21.9	0	0	0	111.2	V818 L824 N825 H826	V818-D822 WeakPolarHBondContact CG1-OD2 3.35Å; V818-D822 PolarHBondContact O-N 2.83Å; D822-L824 VanDerWaalsContact C-N 3.31Å; D822-L824 PolarHBondContact O-N 3.06Å; D822-N825 PolarHBondContact O-N 2.99Å; D822-N825 VanDerWaalsContact O-N 3.08Å; D822-H826 WeakPolarHBondContact O-CB 3.37Å; D822-H826 VanDerWaalsContact O-CG 3.29Å; D822-H826 PolarHBondContact O-N 3.34Å; D822-H826 PolarHBondContact O-ND1 3.49Å
823	L	85.4	Confident	79.8	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-51.3	-47.7	173.9	-179	74.6	0	0	0	112.3	E780 F799 L802 L803 Y806 A819 H827 F831	E780-L823 HydrophobicContact CG-CD1 3.49Å; E780-L823 VanDerWaalsContact CG-CD1 3.49Å; E780-L823 WeakPolarHBondContact OE1-CD1 3.22Å; F799-L823 HydrophobicContact CD1-CD1 4.02Å; F799-L823 HydrophobicContact CE1-CD1 4.08Å; L802-L823 HydrophobicContact CD2-CD1 3.96Å; L802-L823 HydrophobicContact CD2-CD2 4.25Å; L802-L823 HydrophobicContact CG-CD2 4.07Å; L803-L823 HydrophobicContact CB-CD2 4.12Å; L803-L823 HydrophobicContact CD1-CD2 4.41Å; Y806-L823 HydrophobicContact CD2-CD2 4Å; Y806-L823 HydrophobicContact CE2-CB 4.35Å; Y806-L823 HydrophobicContact CE2-CD2 3.89Å; A819-L823 WeakPolarHBondContact O-CB 3.32Å; A819-L823 PolarHBondContact O-N 3.3Å; L823-H827 PolarHBondContact O-N 3.3Å; L823-F831 HydrophobicContact CD2-CZ 3.85Å; L823-F831 HydrophobicContact CG-CE2 4.26Å; L823-F831 HydrophobicContact CG-CZ 3.9Å
824	L	85.1	Confident	80.6	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66.5	-38.5	178.6	-76.6	171.6	0	0	0	112.6	L803 A820 V821 D822 A828 F831 V836 L840 W844 L849 F852	L803-L824 HydrophobicContact CD1-CD1 4.14Å; L803-L824 HydrophobicContact CD1-CG 4.16Å; L803-L824 HydrophobicContact CD2-CD2 3.89Å; L803-L824 HydrophobicContact CD2-CG 4.4Å; A820-L824 WeakPolarHBondContact O-CG 3.3Å; A820-L824 PolarHBondContact O-N 2.95Å; V821-L824 PolarHBondContact O-N 2.95Å; D822-L824 VanDerWaalsContact C-N 3.31Å; D822-L824 PolarHBondContact O-N 3.06Å; L824-A828 WeakPolarHBondContact O-CA 3.39Å; L824-A828 PolarHBondContact O-N 2.93Å; L824-F831 HydrophobicContact CD2-CD1 4.22Å; L824-F831 HydrophobicContact CD2-CD2 3.86Å; L824-F831 HydrophobicContact CD2-CE1 4.24Å; L824-F831 HydrophobicContact CD2-CE2 3.89Å; L824-F831 HydrophobicContact CD2-CG 4.03Å; L824-F831 HydrophobicContact CD2-CZ 4.08Å; L824-V836 HydrophobicContact CD1-CG1 4.1Å; L824-V836 HydrophobicContact CD2-CB 4.47Å; L824-V836 HydrophobicContact CD2-CG1 3.69Å; L824-V836 HydrophobicContact CD2-CG2 3.89Å; L824-L840 HydrophobicContact CD1-CD2 3.97Å; L824-W844 HydrophobicContact CD1-CZ3 4.29Å; L824-L849 HydrophobicContact CD1-CD2 4.12Å; L824-F852 HydrophobicContact CB-CB 4.39Å; L824-F852 HydrophobicContact CB-CD2 4.37Å; L824-F852 HydrophobicContact CB-CG 4.25Å; L824-F852 HydrophobicContact CD2-CD2 4.36Å; L824-F852 HydrophobicContact CD2-CE1 4.41Å; L824-F852 HydrophobicContact CD2-CE2 4.17Å; L824-F852 HydrophobicContact CD2-CZ 4.19Å; L824-F852 WeakPolarHBondContact O-CD2 3.12Å
825	N	84.3	Confident	81.2	Confident	44 Å²	44	44.1 Å²	44.1	24%	0.235	25%	0.247	C	C	.	.	H	α-helix	trans	-78.7	-28.3	-178.8	-74.2	-43.4	0	0	0	112.9	V821 D822 L848 P851 F852	V821-N825 WeakPolarHBondContact CG1-ND2 3.42Å; V821-N825 WeakPolarHBondContact O-CB 3.5Å; V821-N825 PolarHBondContact O-N 2.81Å; V821-N825 PolarHBondContact O-ND2 2.84Å; D822-N825 PolarHBondContact O-N 2.99Å; D822-N825 VanDerWaalsContact O-N 3.08Å; N825-L848 PolarHBondContact ND2-O 2.88Å; N825-P851 VanDerWaalsContact OD1-CB 3.3Å; N825-P851 WeakPolarHBondContact OD1-CB 3.27Å; N825-P851 WeakPolarHBondContact OD1-CD 3.41Å; N825-P851 WeakPolarHBondContact OD1-CG 3.28Å; N825-F852 WeakPolarHBondContact OD1-CB 3.25Å; N825-F852 PolarHBondContact OD1-N 3.38Å
826	H	84.4	Confident	81.6	Confident	132 Å²	132	38.7 Å²	38.7	61%	0.611	22%	0.222	S	C	*	.	H	α-helix	trans	-78.6	-49.1	175.1	-66	143.6	0	0	0	112.8	D822	D822-H826 WeakPolarHBondContact O-CB 3.37Å; D822-H826 VanDerWaalsContact O-CG 3.29Å; D822-H826 PolarHBondContact O-N 3.34Å; D822-H826 PolarHBondContact O-ND1 3.49Å
827	H	81.3	Confident	81.8	Confident	34 Å²	34	42.7 Å²	42.7	16%	0.157	24%	0.243	C	C	.	.	S	Bend	trans	-106.1	38.4	-171.9	-57.4	-80	0	0	0	112.9	E780 F799 L823 T829 E830 F831	E780-H827 IonicContact OE2-CD2 3.12Å; E780-H827 PolarHBondContact OE2-CD2 3.26Å; E780-H827 IonicContact OE2-CE1 3.39Å; E780-H827 IonicContact OE2-NE2 3.86Å; E780-H827 PolarHBondContact OE2-NE2 2.81Å; F799-H827 HydrophobicContact CE1-CB 4.22Å; F799-H827 AromaticContact CE1-CD2 3.99Å; F799-H827 AromaticContact CE1-CG 3.91Å; L823-H827 PolarHBondContact O-N 3.3Å; H827-T829 PolarHBondContact O-N 2.89Å; H827-E830 HydrophobicContact CB-CB 4.22Å; H827-E830 HydrophobicContact CB-CG 4Å; H827-E830 WeakPolarHBondContact O-CB 3.49Å; H827-E830 PolarHBondContact O-N 3.43Å; H827-F831 HydrophobicContact CB-CE2 4.32Å; H827-F831 WeakPolarHBondContact O-CD2 3.37Å
828	A	79.3	Confident	82.1	Confident	13 Å²	13	48.8 Å²	48.8	11%	0.107	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-55.2	-23.9	-172.3	0	0	0	0	0	115.3	L824 F852	L824-A828 WeakPolarHBondContact O-CA 3.39Å; L824-A828 PolarHBondContact O-N 2.93Å; A828-F852 HydrophobicContact CB-CD2 3.7Å; A828-F852 HydrophobicContact CB-CE2 4.31Å
829	T	77.1	Confident	82.1	Confident	88 Å²	88	48.7 Å²	48.7	54%	0.54	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-77.2	-20.5	175.5	46.8	0	0	0	0	114.4	H827 D859	H827-T829 PolarHBondContact O-N 2.89Å; T829-D859 HydrophobicContact CG2-CB 4.49Å; T829-D859 WeakPolarHBondContact CG2-OD2 3.4Å
830	E	79.6	Confident	82.1	Confident	34 Å²	34	49.4 Å²	49.4	16%	0.159	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-91.6	3.8	-172.7	-54.3	-64	172.3	0	0	113.2	R795 Q796 F799 H827	R795-E830 WeakPolarHBondContact CD-OE2 3.39Å; R795-E830 IonicContact CZ-OE1 2.67Å; R795-E830 VanDerWaalsContact CZ-OE1 3.29Å; R795-E830 IonicContact CZ-OE2 2.93Å; R795-E830 IonicContact NE-OE1 2.75Å; R795-E830 PolarHBondContact NE-OE1 2.79Å; R795-E830 IonicContact NE-OE2 3.58Å; R795-E830 PolarHBondContact NE-OE2 2.9Å; R795-E830 IonicContact NH2-OE1 2.99Å; R795-E830 PolarHBondContact NH2-OE1 2.89Å; R795-E830 IonicContact NH2-OE2 2.82Å; Q796-E830 WeakPolarHBondContact CG-O 3.43Å; F799-E830 HydrophobicContact CD2-CB 3.98Å; F799-E830 HydrophobicContact CD2-CG 4.44Å; F799-E830 HydrophobicContact CE2-CB 4.33Å; F799-E830 HydrophobicContact CE2-CG 4.29Å; F799-E830 HydrophobicContact CG-CB 4.25Å; H827-E830 HydrophobicContact CB-CB 4.22Å; H827-E830 HydrophobicContact CB-CG 4Å; H827-E830 WeakPolarHBondContact O-CB 3.49Å; H827-E830 PolarHBondContact O-N 3.43Å
831	F	82.3	Confident	82	Confident	9 Å²	9	51.8 Å²	51.8	4%	0.039	28%	0.279	C	S	.	.	S	Bend	trans	-120.4	139.1	-177.5	-71.4	-76.5	0	0	0	111.7	F799 H800 L803 L823 L824 H827 A833 V836 F852	F799-F831 HydrophobicContact CB-CD1 4.5Å; F799-F831 HydrophobicContact CB-CE1 3.88Å; F799-F831 HydrophobicContact CB-CZ 3.9Å; F799-F831 HydrophobicContact CD1-CZ 4.22Å; F799-F831 HydrophobicContact CG-CZ 4.49Å; F799-F831 WeakPolarHBondContact O-CE1 3.23Å; H800-F831 AromaticContact CE1-CD1 3.82Å; H800-F831 AromaticContact ND1-CD1 3.74Å; L803-F831 HydrophobicContact CB-CE1 4.05Å; L803-F831 HydrophobicContact CB-CZ 4.48Å; L803-F831 HydrophobicContact CD2-CD1 4.25Å; L803-F831 HydrophobicContact CD2-CE1 3.79Å; L803-F831 HydrophobicContact CD2-CZ 4.46Å; L823-F831 HydrophobicContact CD2-CZ 3.85Å; L823-F831 HydrophobicContact CG-CE2 4.26Å; L823-F831 HydrophobicContact CG-CZ 3.9Å; L824-F831 HydrophobicContact CD2-CD1 4.22Å; L824-F831 HydrophobicContact CD2-CD2 3.86Å; L824-F831 HydrophobicContact CD2-CE1 4.24Å; L824-F831 HydrophobicContact CD2-CE2 3.89Å; L824-F831 HydrophobicContact CD2-CG 4.03Å; L824-F831 HydrophobicContact CD2-CZ 4.08Å; H827-F831 HydrophobicContact CB-CE2 4.32Å; H827-F831 WeakPolarHBondContact O-CD2 3.37Å; F831-A833 PolarHBondContact O-N 3.02Å; F831-V836 HydrophobicContact CB-CG2 3.72Å; F831-V836 HydrophobicContact CD1-CG2 3.69Å; F831-V836 HydrophobicContact CG-CG2 3.91Å; F831-F852 HydrophobicContact CB-CE2 3.99Å; F831-F852 HydrophobicContact CB-CZ 4.17Å; F831-F852 HydrophobicContact CD2-CE2 4.43Å
832	D	81.9	Confident	81.7	Confident	78 Å²	78	59.2 Å²	59.2	42%	0.417	32%	0.319	S	S	.	.			trans	-73.8	110.2	159.2	-174.3	-15.5	0	0	0	108.9	H800 A834 Q835 V836	H800-D832 PolarHBondContact NE2-N 3.01Å; D832-A834 PolarHBondContact O-N 3.47Å; D832-A834 WeakPolarHBondContact OD1-CB 3.48Å; D832-A834 PolarHBondContact OD1-N 2.95Å; D832-Q835 HydrophobicContact CB-CB 4.02Å; D832-Q835 PolarHBondContact O-N 2.82Å; D832-V836 PolarHBondContact O-N 2.84Å
833	A	80.6	Confident	81.3	Confident	25 Å²	25	61.9 Å²	61.9	21%	0.207	34%	0.338	C	S	.	.	H	α-helix	trans	-58.2	-30.6	177.8	0	0	0	0	0	113.3	F831 L837 F852 A856	F831-A833 PolarHBondContact O-N 3.02Å; A833-L837 WeakPolarHBondContact O-CB 3.34Å; A833-L837 WeakPolarHBondContact O-CD1 3.39Å; A833-L837 VanDerWaalsContact O-CG 3.22Å; A833-L837 WeakPolarHBondContact O-CG 3.44Å; A833-L837 PolarHBondContact O-N 2.9Å; A833-L837 VanDerWaalsContact O-N 3.1Å; A833-F852 HydrophobicContact CB-CE1 4.37Å; A833-F852 HydrophobicContact CB-CZ 4.04Å; A833-A856 HydrophobicContact CB-CB 3.99Å
834	A	81.4	Confident	81.2	Confident	56 Å²	56	64 Å²	64	46%	0.463	35%	0.346	S	S	.	.	H	α-helix	trans	-71.8	-30.3	175.7	0	0	0	0	0	112.4	D832 Q838	D832-A834 PolarHBondContact O-N 3.47Å; D832-A834 WeakPolarHBondContact OD1-CB 3.48Å; D832-A834 PolarHBondContact OD1-N 2.95Å; A834-Q838 WeakPolarHBondContact O-CG 3.07Å; A834-Q838 PolarHBondContact O-NE2 2.83Å
835	Q	80.8	Confident	81.1	Confident	86 Å²	86	67.2 Å²	67.2	40%	0.402	37%	0.368	S	S	.	.	H	α-helix	trans	-81.1	-41	174.5	-171.6	176.3	-13.1	0	0	111.6	D832 L837 Q838 M839	D832-Q835 HydrophobicContact CB-CB 4.02Å; D832-Q835 PolarHBondContact O-N 2.82Å; Q835-L837 VanDerWaalsContact C-N 3.34Å; Q835-L837 PolarHBondContact O-N 2.84Å; Q835-Q838 PolarHBondContact O-N 3.36Å; Q835-Q838 VanDerWaalsContact O-N 3.11Å; Q835-M839 HydrophobicContact CG-CE 4.33Å; Q835-M839 PolarHBondContact O-N 3.07Å
836	V	83.9	Confident	80.8	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-57.1	-47	174.5	168.8	0	0	0	0	111.1	L803 L824 F831 D832 Q838 M839 L840 F852	L803-V836 HydrophobicContact CD2-CG1 4.41Å; L803-V836 HydrophobicContact CD2-CG2 3.99Å; L824-V836 HydrophobicContact CD1-CG1 4.1Å; L824-V836 HydrophobicContact CD2-CB 4.47Å; L824-V836 HydrophobicContact CD2-CG1 3.69Å; L824-V836 HydrophobicContact CD2-CG2 3.89Å; F831-V836 HydrophobicContact CB-CG2 3.72Å; F831-V836 HydrophobicContact CD1-CG2 3.69Å; F831-V836 HydrophobicContact CG-CG2 3.91Å; D832-V836 PolarHBondContact O-N 2.84Å; V836-Q838 PolarHBondContact O-N 3.33Å; V836-M839 PolarHBondContact O-N 3.04Å; V836-L840 HydrophobicContact CG1-CD1 3.63Å; V836-L840 HydrophobicContact CG1-CG 3.92Å; V836-L840 WeakPolarHBondContact O-CG 3.38Å; V836-L840 PolarHBondContact O-N 2.93Å; V836-L840 VanDerWaalsContact O-N 3.14Å; V836-F852 HydrophobicContact CB-CE1 4.13Å; V836-F852 HydrophobicContact CB-CZ 4.07Å; V836-F852 HydrophobicContact CG1-CE1 3.71Å; V836-F852 HydrophobicContact CG1-CZ 4.04Å; V836-F852 HydrophobicContact CG2-CZ 4.06Å
837	L	81.4	Confident	80.7	Confident	99 Å²	99	70.7 Å²	70.7	52%	0.518	39%	0.39	S	S	.	.	H	α-helix	trans	-61.6	-14.8	178.9	-75	169.6	0	0	0	114.4	A833 Q835 L840 L853	A833-L837 WeakPolarHBondContact O-CB 3.34Å; A833-L837 WeakPolarHBondContact O-CD1 3.39Å; A833-L837 VanDerWaalsContact O-CG 3.22Å; A833-L837 WeakPolarHBondContact O-CG 3.44Å; A833-L837 PolarHBondContact O-N 2.9Å; A833-L837 VanDerWaalsContact O-N 3.1Å; Q835-L837 VanDerWaalsContact C-N 3.34Å; Q835-L837 PolarHBondContact O-N 2.84Å; L837-L840 HydrophobicContact CD2-CD1 4.5Å; L837-L853 HydrophobicContact CD1-CD2 4.37Å; L837-L853 HydrophobicContact CD2-CD2 4.37Å
838	Q	83.2	Confident	80.6	Confident	163 Å²	163	73.2 Å²	73.2	76%	0.762	40%	0.404	S	S	*	.	H	α-helix	trans	-93.9	-14.8	174.2	-67.9	171.5	58.1	0	0	113.5	A834 Q835 V836	A834-Q838 WeakPolarHBondContact O-CG 3.07Å; A834-Q838 PolarHBondContact O-NE2 2.83Å; Q835-Q838 PolarHBondContact O-N 3.36Å; Q835-Q838 VanDerWaalsContact O-N 3.11Å; V836-Q838 PolarHBondContact O-N 3.33Å
839	M	80.6	Confident	80.7	Confident	62 Å²	62	73.2 Å²	73.2	31%	0.305	40%	0.402	S	S	.	.	H	α-helix	trans	-102.8	-16.8	-179.2	-62.2	-171	-58.2	0	0	113.2	H800 L803 Q835 V836	H800-M839 HydrophobicContact CB-CE 4.44Å; H800-M839 WeakPolarHBondContact ND1-CE 2.93Å; L803-M839 HydrophobicContact CD2-CE 4Å; Q835-M839 HydrophobicContact CG-CE 4.33Å; Q835-M839 PolarHBondContact O-N 3.07Å; V836-M839 PolarHBondContact O-N 3.04Å
840	L	81.8	Confident	80.9	Confident	24 Å²	24	70.7 Å²	70.7	13%	0.126	39%	0.388	C	S	.	.	S	Bend	trans	-72.5	140.8	-178.6	-76	171.6	0	0	0	112.5	L807 L824 V836 L837 W844 L849	L807-L840 HydrophobicContact CD1-CD2 4.32Å; L824-L840 HydrophobicContact CD1-CD2 3.97Å; V836-L840 HydrophobicContact CG1-CD1 3.63Å; V836-L840 HydrophobicContact CG1-CG 3.92Å; V836-L840 WeakPolarHBondContact O-CG 3.38Å; V836-L840 PolarHBondContact O-N 2.93Å; V836-L840 VanDerWaalsContact O-N 3.14Å; L837-L840 HydrophobicContact CD2-CD1 4.5Å; L840-W844 HydrophobicContact CD2-CD2 4.27Å; L840-W844 HydrophobicContact CD2-CE3 3.57Å; L840-W844 HydrophobicContact CD2-CH2 4.02Å; L840-W844 HydrophobicContact CD2-CZ3 3.41Å; L840-W844 VanDerWaalsContact CD2-CZ3 3.41Å; L840-L849 HydrophobicContact CD1-CD1 3.69Å; L840-L849 HydrophobicContact CD1-CD2 3.73Å; L840-L849 HydrophobicContact CD1-CG 4.37Å; L840-L849 HydrophobicContact CD2-CD2 4.37Å
841	P	80.6	Confident	81.2	Confident	50 Å²	50	72.3 Å²	72.3	33%	0.325	40%	0.401	S	S	.	.			trans	-68.8	139.5	175.5	-20	33.1	0	0	0	113.3	L807 T843 W844	L807-P841 HydrophobicContact CD2-CG 4.32Å; P841-T843 PolarHBondContact O-N 3.27Å; P841-W844 PolarHBondContact O-N 2.85Å; P841-W844 VanDerWaalsContact O-N 3.08Å
842	D	76.7	Confident	81.4	Confident	176 Å²	176	71.9 Å²	71.9	94%	0.941	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-14.8	174.5	-62.7	-44.7	0	0	0	114.4	W844	D842-W844 VanDerWaalsContact C-N 3.34Å
843	T	76.3	Confident	81.4	Confident	126 Å²	126	70.3 Å²	70.3	77%	0.773	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-10.3	179.7	56	0	0	0	0	113.8	P841	P841-T843 PolarHBondContact O-N 3.27Å
844	W	82.6	Confident	81.6	Confident	46 Å²	46	74.7 Å²	74.7	17%	0.174	41%	0.408	C	S	.	.	S	Bend	trans	-84.4	130.9	-176.8	-75.3	29.3	0	0	0	111.9	L807 A817 A820 V821 L824 L840 P841 D842 L849	L807-W844 HydrophobicContact CD2-CH2 3.88Å; L807-W844 HydrophobicContact CD2-CZ2 3.61Å; A817-W844 HydrophobicContact CB-CZ2 4.48Å; A820-W844 HydrophobicContact CB-CH2 3.78Å; A820-W844 HydrophobicContact CB-CZ2 4.37Å; V821-W844 HydrophobicContact CB-CZ3 4.49Å; V821-W844 HydrophobicContact CG2-CE3 3.94Å; V821-W844 HydrophobicContact CG2-CH2 3.56Å; V821-W844 HydrophobicContact CG2-CZ2 4.25Å; V821-W844 HydrophobicContact CG2-CZ3 3.38Å; L824-W844 HydrophobicContact CD1-CZ3 4.29Å; L840-W844 HydrophobicContact CD2-CD2 4.27Å; L840-W844 HydrophobicContact CD2-CE3 3.57Å; L840-W844 HydrophobicContact CD2-CH2 4.02Å; L840-W844 HydrophobicContact CD2-CZ3 3.41Å; L840-W844 VanDerWaalsContact CD2-CZ3 3.41Å; P841-W844 PolarHBondContact O-N 2.85Å; P841-W844 VanDerWaalsContact O-N 3.08Å; D842-W844 VanDerWaalsContact C-N 3.34Å; W844-L849 HydrophobicContact CE3-CD2 4.04Å; W844-L849 HydrophobicContact CE3-CG 4.44Å; W844-L849 HydrophobicContact CZ3-CD2 4.18Å
845	S	81.9	Confident	81.7	Confident	66 Å²	66	72.8 Å²	72.8	46%	0.462	39%	0.394	S	S	.	.			trans	-76.3	136.4	175.8	77.1	0	0	0	0	111.5	Q847 L848	S845-Q847 PolarHBondContact O-N 3.34Å; S845-L848 WeakPolarHBondContact O-CB 3.48Å; S845-L848 PolarHBondContact O-N 3.15Å
846	V	80.1	Confident	81.8	Confident	101 Å²	101	69.6 Å²	69.6	61%	0.612	38%	0.382	S	S	*	.	H	α-helix	trans	-53.6	-30.3	179.4	-177.7	0	0	0	0	112.2	L848 L849 C850 L853	V846-L848 PolarHBondContact O-N 3.42Å; V846-L849 CarbonylContact O-C 3.54Å; V846-L849 PolarHBondContact O-N 2.03Å; V846-C850 PolarHBondContact O-N 2.92Å; V846-C850 PolarHBondContact O-SG 2.94Å; V846-C850 VanDerWaalsContact O-SG 3.39Å; V846-L853 HydrophobicContact CG1-CD1 4.44Å
847	Q	80.3	Confident	81.7	Confident	148 Å²	148	75.6 Å²	75.6	69%	0.692	41%	0.412	S	S	*	.	H	α-helix	trans	-59.6	-30.1	178.9	-172.8	59.9	23.6	0	0	113.8	S845 L849	S845-Q847 PolarHBondContact O-N 3.34Å; Q847-L849 VanDerWaalsContact C-N 3.33Å
848	L	80.4	Confident	81.9	Confident	87 Å²	87	79.4 Å²	79.4	46%	0.455	42%	0.419	S	S	.	.	H	α-helix	trans	-73.9	-27.3	175.9	-64.1	168.2	0	0	0	112.4	N825 S845 V846	N825-L848 PolarHBondContact ND2-O 2.88Å; S845-L848 WeakPolarHBondContact O-CB 3.48Å; S845-L848 PolarHBondContact O-N 3.15Å; V846-L848 PolarHBondContact O-N 3.42Å
849	L	80.2	Confident	81.8	Confident	13 Å²	13	74.5 Å²	74.5	7%	0.068	40%	0.398	C	S	.	.	H	α-helix	trans	-94.9	-8	-177.8	-63.1	164.7	0	0	0	112.5	L824 L840 W844 V846 Q847 P851 F852 L853	L824-L849 HydrophobicContact CD1-CD2 4.12Å; L840-L849 HydrophobicContact CD1-CD1 3.69Å; L840-L849 HydrophobicContact CD1-CD2 3.73Å; L840-L849 HydrophobicContact CD1-CG 4.37Å; L840-L849 HydrophobicContact CD2-CD2 4.37Å; W844-L849 HydrophobicContact CE3-CD2 4.04Å; W844-L849 HydrophobicContact CE3-CG 4.44Å; W844-L849 HydrophobicContact CZ3-CD2 4.18Å; V846-L849 CarbonylContact O-C 3.54Å; V846-L849 PolarHBondContact O-N 2.03Å; Q847-L849 VanDerWaalsContact C-N 3.33Å; L849-P851 VanDerWaalsContact C-CD 3.43Å; L849-F852 PolarHBondContact O-N 2.73Å; L849-L853 HydrophobicContact CB-CD1 3.97Å; L849-L853 HydrophobicContact CB-CG 4.31Å; L849-L853 WeakPolarHBondContact O-CB 3.29Å; L849-L853 VanDerWaalsContact O-CG 3.31Å; L849-L853 WeakPolarHBondContact O-CG 3.27Å; L849-L853 PolarHBondContact O-N 3.43Å
850	C	83.3	Confident	81.9	Confident	36 Å²	36	75.3 Å²	75.3	24%	0.243	41%	0.41	C	S	.	.	H	α-helix	trans	-51.6	-42.5	179.3	-82.1	0	0	0	0	114.3	V846 M854	V846-C850 PolarHBondContact O-N 2.92Å; V846-C850 PolarHBondContact O-SG 2.94Å; V846-C850 VanDerWaalsContact O-SG 3.39Å; C850-M854 HydrophobicContact CB-CE 4.34Å; C850-M854 VanDerWaalsContact O-CB 3.29Å; C850-M854 WeakPolarHBondContact O-CB 3.46Å; C850-M854 VanDerWaalsContact O-CE 3.32Å; C850-M854 WeakPolarHBondContact O-CE 3.2Å; C850-M854 VanDerWaalsContact O-CG 3.25Å; C850-M854 WeakPolarHBondContact O-CG 3.49Å; C850-M854 PolarHBondContact O-N 2.92Å
851	P	84.9	Confident	82.2	Confident	67 Å²	67	76.2 Å²	76.2	44%	0.435	42%	0.417	S	S	.	.	H	α-helix	trans	-66.7	-50.7	178.9	-13.1	27.1	0	0	0	111.8	N825 L849 L853 M854 G855	N825-P851 VanDerWaalsContact OD1-CB 3.3Å; N825-P851 WeakPolarHBondContact OD1-CB 3.27Å; N825-P851 WeakPolarHBondContact OD1-CD 3.41Å; N825-P851 WeakPolarHBondContact OD1-CG 3.28Å; L849-P851 VanDerWaalsContact C-CD 3.43Å; P851-L853 PolarHBondContact O-N 3.18Å; P851-M854 PolarHBondContact O-N 2.59Å; P851-G855 PolarHBondContact O-N 2.95Å
852	F	85.4	Confident	82.5	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-50.5	-53.8	172.4	169	-116.3	0	0	0	112.7	L824 N825 A828 F831 A833 V836 L849 M854 G855 A856	L824-F852 HydrophobicContact CB-CB 4.39Å; L824-F852 HydrophobicContact CB-CD2 4.37Å; L824-F852 HydrophobicContact CB-CG 4.25Å; L824-F852 HydrophobicContact CD2-CD2 4.36Å; L824-F852 HydrophobicContact CD2-CE1 4.41Å; L824-F852 HydrophobicContact CD2-CE2 4.17Å; L824-F852 HydrophobicContact CD2-CZ 4.19Å; L824-F852 WeakPolarHBondContact O-CD2 3.12Å; N825-F852 WeakPolarHBondContact OD1-CB 3.25Å; N825-F852 PolarHBondContact OD1-N 3.38Å; A828-F852 HydrophobicContact CB-CD2 3.7Å; A828-F852 HydrophobicContact CB-CE2 4.31Å; F831-F852 HydrophobicContact CB-CE2 3.99Å; F831-F852 HydrophobicContact CB-CZ 4.17Å; F831-F852 HydrophobicContact CD2-CE2 4.43Å; A833-F852 HydrophobicContact CB-CE1 4.37Å; A833-F852 HydrophobicContact CB-CZ 4.04Å; V836-F852 HydrophobicContact CB-CE1 4.13Å; V836-F852 HydrophobicContact CB-CZ 4.07Å; V836-F852 HydrophobicContact CG1-CE1 3.71Å; V836-F852 HydrophobicContact CG1-CZ 4.04Å; V836-F852 HydrophobicContact CG2-CZ 4.06Å; L849-F852 PolarHBondContact O-N 2.73Å; F852-M854 VanDerWaalsContact C-N 3.34Å; F852-M854 PolarHBondContact O-N 3.37Å; F852-G855 WeakPolarHBondContact O-CA 3.28Å; F852-G855 PolarHBondContact O-N 3.41Å; F852-G855 VanDerWaalsContact O-N 3.1Å; F852-A856 HydrophobicContact CE2-CB 4.49Å; F852-A856 PolarHBondContact O-N 2.89Å
853	L	83.7	Confident	82.8	Confident	45 Å²	45	73.6 Å²	73.6	24%	0.236	40%	0.404	C	S	.	.	H	α-helix	trans	-64.7	-36.3	-178	-68.3	172.2	0	0	0	112.3	L837 V846 L849 P851 M857	L837-L853 HydrophobicContact CD1-CD2 4.37Å; L837-L853 HydrophobicContact CD2-CD2 4.37Å; V846-L853 HydrophobicContact CG1-CD1 4.44Å; L849-L853 HydrophobicContact CB-CD1 3.97Å; L849-L853 HydrophobicContact CB-CG 4.31Å; L849-L853 WeakPolarHBondContact O-CB 3.29Å; L849-L853 VanDerWaalsContact O-CG 3.31Å; L849-L853 WeakPolarHBondContact O-CG 3.27Å; L849-L853 PolarHBondContact O-N 3.43Å; P851-L853 PolarHBondContact O-N 3.18Å; L853-M857 VanDerWaalsContact O-CB 3.22Å; L853-M857 WeakPolarHBondContact O-CB 3.31Å; L853-M857 VanDerWaalsContact O-CG 3.22Å; L853-M857 WeakPolarHBondContact O-CG 3.47Å; L853-M857 PolarHBondContact O-N 2.81Å; L853-M857 VanDerWaalsContact O-N 3.16Å
854	M	84.3	Confident	83.3	Confident	117 Å²	117	75.3 Å²	75.3	58%	0.576	40%	0.397	S	S	*	.	H	α-helix	trans	-69.4	-33.2	172.9	-76.8	-171.1	-69.8	0	0	112.8	C850 P851 F852 R858	C850-M854 HydrophobicContact CB-CE 4.34Å; C850-M854 VanDerWaalsContact O-CB 3.29Å; C850-M854 WeakPolarHBondContact O-CB 3.46Å; C850-M854 VanDerWaalsContact O-CE 3.32Å; C850-M854 WeakPolarHBondContact O-CE 3.2Å; C850-M854 VanDerWaalsContact O-CG 3.25Å; C850-M854 WeakPolarHBondContact O-CG 3.49Å; C850-M854 PolarHBondContact O-N 2.92Å; P851-M854 PolarHBondContact O-N 2.59Å; F852-M854 VanDerWaalsContact C-N 3.34Å; F852-M854 PolarHBondContact O-N 3.37Å; M854-R858 WeakPolarHBondContact O-CB 3.48Å; M854-R858 PolarHBondContact O-N 2.93Å; M854-R858 VanDerWaalsContact O-N 3.08Å
855	G	83.3	Confident	83.7	Confident	16 Å²	16	80.6 Å²	80.6	17%	0.165	42%	0.417	C	S	.	.	H	α-helix	trans	-62.7	-68.8	172	0	0	0	0	0	111	P851 F852 M857 R858 D859	P851-G855 PolarHBondContact O-N 2.95Å; F852-G855 WeakPolarHBondContact O-CA 3.28Å; F852-G855 PolarHBondContact O-N 3.41Å; F852-G855 VanDerWaalsContact O-N 3.1Å; G855-M857 PolarHBondContact O-N 3.02Å; G855-M857 VanDerWaalsContact O-N 3.09Å; G855-R858 CarbonylContact O-C 3.43Å; G855-R858 WeakPolarHBondContact O-CA 3.32Å; G855-R858 WeakPolarHBondContact O-CB 3.48Å; G855-R858 PolarHBondContact O-N 3.14Å; G855-D859 PolarHBondContact O-N 3.46Å; G855-D859 VanDerWaalsContact O-OD2 3.04Å
856	A	83	Confident	84.1	Confident	19 Å²	19	80.8 Å²	80.8	16%	0.157	42%	0.415	C	S	.	.	H	α-helix	trans	-53	-38.6	-177.2	0	0	0	0	0	113.5	A833 F852 S860	A833-A856 HydrophobicContact CB-CB 3.99Å; F852-A856 HydrophobicContact CE2-CB 4.49Å; F852-A856 PolarHBondContact O-N 2.89Å; A856-S860 VanDerWaalsContact O-CB 3.29Å; A856-S860 WeakPolarHBondContact O-CB 3.44Å; A856-S860 PolarHBondContact O-N 3.12Å
857	M	82.6	Confident	84.6	Confident	127 Å²	127	82.3 Å²	82.3	63%	0.626	42%	0.417	S	S	*	.	H	α-helix	trans	-69.5	-39.2	173.9	-74	-66.8	-67.5	0	0	113.3	L853 G855 D859 V861	L853-M857 VanDerWaalsContact O-CB 3.22Å; L853-M857 WeakPolarHBondContact O-CB 3.31Å; L853-M857 VanDerWaalsContact O-CG 3.22Å; L853-M857 WeakPolarHBondContact O-CG 3.47Å; L853-M857 PolarHBondContact O-N 2.81Å; L853-M857 VanDerWaalsContact O-N 3.16Å; G855-M857 PolarHBondContact O-N 3.02Å; G855-M857 VanDerWaalsContact O-N 3.09Å; M857-D859 VanDerWaalsContact C-N 3.34Å; M857-V861 WeakPolarHBondContact O-CB 3.42Å; M857-V861 VanDerWaalsContact O-CG2 3.26Å; M857-V861 WeakPolarHBondContact O-CG2 3.48Å; M857-V861 PolarHBondContact O-N 3.34Å; M857-V861 VanDerWaalsContact O-N 3.07Å
858	R	85.2	Confident	85.1	Confident	178 Å²	178	81 Å²	81	67%	0.672	41%	0.411	S	S	*	.	H	α-helix	trans	-63.4	-42.1	174.5	176.6	-176.8	-62.1	178.1	2.1	110.8	M854 G855 V861 H862	M854-R858 WeakPolarHBondContact O-CB 3.48Å; M854-R858 PolarHBondContact O-N 2.93Å; M854-R858 VanDerWaalsContact O-N 3.08Å; G855-R858 CarbonylContact O-C 3.43Å; G855-R858 WeakPolarHBondContact O-CA 3.32Å; G855-R858 WeakPolarHBondContact O-CB 3.48Å; G855-R858 PolarHBondContact O-N 3.14Å; R858-V861 CarbonylContact O-C 3.55Å; R858-V861 PolarHBondContact O-N 2.91Å; R858-H862 VanDerWaalsContact O-CB 3.3Å; R858-H862 WeakPolarHBondContact O-CB 3.49Å; R858-H862 PolarHBondContact O-N 2.57Å
859	D	81.3	Confident	85.7	Confident	60 Å²	60	81.2 Å²	81.2	32%	0.321	42%	0.416	S	S	.	.	H	α-helix	trans	-74.1	-39.9	-175.3	-60.1	-38.2	0	0	0	111.4	T829 G855 M857 V861 H862 A863	T829-D859 HydrophobicContact CG2-CB 4.49Å; T829-D859 WeakPolarHBondContact CG2-OD2 3.4Å; G855-D859 PolarHBondContact O-N 3.46Å; G855-D859 VanDerWaalsContact O-OD2 3.04Å; M857-D859 VanDerWaalsContact C-N 3.34Å; D859-V861 PolarHBondContact O-N 2.87Å; D859-H862 PolarHBondContact O-N 3.32Å; D859-A863 WeakPolarHBondContact O-CB 3.3Å; D859-A863 PolarHBondContact O-N 2.81Å
860	S	82.8	Confident	86.2	Confident	80 Å²	80	83 Å²	83	56%	0.559	43%	0.432	S	S	*	.	H	α-helix	trans	-57.5	-45	168.1	179.7	0	0	0	0	112.3	A856 R864	A856-S860 VanDerWaalsContact O-CB 3.29Å; A856-S860 WeakPolarHBondContact O-CB 3.44Å; A856-S860 PolarHBondContact O-N 3.12Å; S860-R864 WeakPolarHBondContact O-CB 3.3Å; S860-R864 PolarHBondContact O-N 2.88Å; S860-R864 VanDerWaalsContact O-N 3.11Å
861	V	87.1	Confident	86.7	Confident	43 Å²	43	85.6 Å²	85.6	26%	0.261	44%	0.443	S	S	.	.	H	α-helix	trans	-68.4	-35.7	175.8	169.3	0	0	0	0	112.2	M857 R858 D859 R865	M857-V861 WeakPolarHBondContact O-CB 3.42Å; M857-V861 VanDerWaalsContact O-CG2 3.26Å; M857-V861 WeakPolarHBondContact O-CG2 3.48Å; M857-V861 PolarHBondContact O-N 3.34Å; M857-V861 VanDerWaalsContact O-N 3.07Å; R858-V861 CarbonylContact O-C 3.55Å; R858-V861 PolarHBondContact O-N 2.91Å; D859-V861 PolarHBondContact O-N 2.87Å; V861-R865 VanDerWaalsContact O-CG 3.3Å; V861-R865 WeakPolarHBondContact O-CG 2.96Å; V861-R865 PolarHBondContact O-N 2.9Å; V861-R865 VanDerWaalsContact O-N 3.11Å
862	H	86.8	Confident	87	Confident	111 Å²	111	84.2 Å²	84.2	51%	0.514	44%	0.441	S	S	.	.	H	α-helix	trans	-67.5	-52.8	176.7	-179.8	82.9	0	0	0	110.7	R858 D859 R864 R865 T866	R858-H862 VanDerWaalsContact O-CB 3.3Å; R858-H862 WeakPolarHBondContact O-CB 3.49Å; R858-H862 PolarHBondContact O-N 2.57Å; D859-H862 PolarHBondContact O-N 3.32Å; H862-R864 VanDerWaalsContact C-N 3.26Å; H862-R864 PolarHBondContact O-N 2.89Å; H862-R865 CarbonylContact O-C 3.58Å; H862-R865 PolarHBondContact O-N 2.9Å; H862-T866 PolarHBondContact CE1-OG1 2.93Å; H862-T866 VanDerWaalsContact CE1-OG1 3.32Å; H862-T866 PolarHBondContact NE2-OG1 3.02Å; H862-T866 WeakPolarHBondContact O-CB 3.46Å; H862-T866 PolarHBondContact O-N 2.89Å; H862-T866 PolarHBondContact O-OG1 3.1Å
863	A	83.8	Confident	87.3	Confident	59 Å²	59	89.2 Å²	89.2	49%	0.488	47%	0.467	S	S	.	.	H	α-helix	trans	-53.1	-44.3	176.3	0	0	0	0	0	111.5	D859 R865 T866 M867	D859-A863 WeakPolarHBondContact O-CB 3.3Å; D859-A863 PolarHBondContact O-N 2.81Å; A863-R865 PolarHBondContact O-N 3.34Å; A863-T866 PolarHBondContact O-N 2.64Å; A863-M867 VanDerWaalsContact O-CB 3.27Å; A863-M867 WeakPolarHBondContact O-CB 3.36Å; A863-M867 PolarHBondContact O-N 2.89Å
864	R	87.2	Confident	87.5	Confident	163 Å²	163	89.5 Å²	89.5	62%	0.615	48%	0.476	S	S	*	.	H	α-helix	trans	-60.7	-43.1	175.1	-166.3	-178.6	75.2	171.1	2.1	112.8	S860 H862 Q868	S860-R864 WeakPolarHBondContact O-CB 3.3Å; S860-R864 PolarHBondContact O-N 2.88Å; S860-R864 VanDerWaalsContact O-N 3.11Å; H862-R864 VanDerWaalsContact C-N 3.26Å; H862-R864 PolarHBondContact O-N 2.89Å; R864-Q868 VanDerWaalsContact O-CG 3.31Å; R864-Q868 WeakPolarHBondContact O-CG 3.24Å; R864-Q868 PolarHBondContact O-N 2.78Å; R864-Q868 VanDerWaalsContact O-N 3.14Å
865	R	90.7	Very high	87.9	Confident	157 Å²	157	92.1 Å²	92.1	59%	0.592	48%	0.48	S	S	*	.	H	α-helix	trans	-69.2	-44.9	178.3	-75.2	170.2	174	169.2	-0.1	111.9	V861 H862 A863 M867 Q868 V869	V861-R865 VanDerWaalsContact O-CG 3.3Å; V861-R865 WeakPolarHBondContact O-CG 2.96Å; V861-R865 PolarHBondContact O-N 2.9Å; V861-R865 VanDerWaalsContact O-N 3.11Å; H862-R865 CarbonylContact O-C 3.58Å; H862-R865 PolarHBondContact O-N 2.9Å; A863-R865 PolarHBondContact O-N 3.34Å; R865-M867 VanDerWaalsContact C-N 3.33Å; R865-M867 PolarHBondContact O-N 2.99Å; R865-Q868 WeakPolarHBondContact O-CB 3.4Å; R865-Q868 PolarHBondContact O-N 2.85Å; R865-Q868 VanDerWaalsContact O-N 3.12Å; R865-V869 PolarHBondContact O-N 2.83Å
866	T	90.5	Very high	88.3	Confident	69 Å²	69	94.3 Å²	94.3	42%	0.423	49%	0.492	S	S	.	.	H	α-helix	trans	-64	-38.8	178.9	-61.4	0	0	0	0	111.1	H862 A863 V869 A870	H862-T866 PolarHBondContact CE1-OG1 2.93Å; H862-T866 VanDerWaalsContact CE1-OG1 3.32Å; H862-T866 PolarHBondContact NE2-OG1 3.02Å; H862-T866 WeakPolarHBondContact O-CB 3.46Å; H862-T866 PolarHBondContact O-N 2.89Å; H862-T866 PolarHBondContact O-OG1 3.1Å; A863-T866 PolarHBondContact O-N 2.64Å; T866-V869 PolarHBondContact O-N 2.83Å; T866-A870 WeakPolarHBondContact O-CB 3.33Å; T866-A870 PolarHBondContact O-N 2.88Å
867	M	88.9	Confident	88.6	Confident	134 Å²	134	98.3 Å²	98.3	66%	0.66	51%	0.508	S	S	*	.	H	α-helix	trans	-64.5	-37.4	171.7	-169	59.2	63.7	0	0	112.7	A863 R865 A870 L871	A863-M867 VanDerWaalsContact O-CB 3.27Å; A863-M867 WeakPolarHBondContact O-CB 3.36Å; A863-M867 PolarHBondContact O-N 2.89Å; R865-M867 VanDerWaalsContact C-N 3.33Å; R865-M867 PolarHBondContact O-N 2.99Å; M867-A870 PolarHBondContact O-N 3.36Å; M867-L871 WeakPolarHBondContact O-CB 3.15Å; M867-L871 PolarHBondContact O-N 3.02Å
868	Q	92.5	Very high	89	Confident	119 Å²	119	97.1 Å²	97.1	56%	0.556	50%	0.504	S	S	*	.	H	α-helix	trans	-65.2	-37.6	173	-74.9	172.9	-27	0	0	112.5	R864 R865 G872	R864-Q868 VanDerWaalsContact O-CG 3.31Å; R864-Q868 WeakPolarHBondContact O-CG 3.24Å; R864-Q868 PolarHBondContact O-N 2.78Å; R864-Q868 VanDerWaalsContact O-N 3.14Å; R865-Q868 WeakPolarHBondContact O-CB 3.4Å; R865-Q868 PolarHBondContact O-N 2.85Å; R865-Q868 VanDerWaalsContact O-N 3.12Å; Q868-G872 PolarHBondContact O-N 2.67Å
869	V	92.6	Very high	89.3	Confident	93 Å²	93	94.5 Å²	94.5	56%	0.564	50%	0.503	S	S	*	.	H	α-helix	trans	-67.6	-45.9	174	174	0	0	0	0	111.1	R865 T866 L871 G872 L873	R865-V869 PolarHBondContact O-N 2.83Å; T866-V869 PolarHBondContact O-N 2.83Å; V869-L871 VanDerWaalsContact C-N 3.33Å; V869-L871 PolarHBondContact O-N 3.03Å; V869-G872 CarbonylContact O-C 3.58Å; V869-G872 WeakPolarHBondContact O-CA 3.5Å; V869-G872 PolarHBondContact O-N 2.83Å; V869-L873 HydrophobicContact CG1-CD1 4.17Å; V869-L873 HydrophobicContact CG1-CG 4.44Å; V869-L873 WeakPolarHBondContact O-CG 3.23Å; V869-L873 PolarHBondContact O-N 2.8Å
870	A	90.7	Very high	89.7	Confident	49 Å²	49	96 Å²	96	41%	0.405	51%	0.509	S	S	.	.	H	α-helix	trans	-58.8	-42.8	176.4	0	0	0	0	0	112.1	T866 M867 G872 L873 A874	T866-A870 WeakPolarHBondContact O-CB 3.33Å; T866-A870 PolarHBondContact O-N 2.88Å; M867-A870 PolarHBondContact O-N 3.36Å; A870-G872 VanDerWaalsContact C-N 3.31Å; A870-G872 PolarHBondContact O-N 3.46Å; A870-L873 PolarHBondContact O-N 3.07Å; A870-A874 WeakPolarHBondContact O-CB 3.14Å; A870-A874 PolarHBondContact O-N 3.3Å
871	L	93.8	Very high	89.9	Confident	91 Å²	91	96.5 Å²	96.5	48%	0.476	50%	0.5	S	S	.	.	H	α-helix	trans	-62.5	-36	172.7	179.9	62.4	0	0	0	112.5	M867 V869 R875	M867-L871 WeakPolarHBondContact O-CB 3.15Å; M867-L871 PolarHBondContact O-N 3.02Å; V869-L871 VanDerWaalsContact C-N 3.33Å; V869-L871 PolarHBondContact O-N 3.03Å; L871-R875 WeakPolarHBondContact O-CB 3.37Å; L871-R875 WeakPolarHBondContact O-CD 3.46Å; L871-R875 WeakPolarHBondContact O-CG 3.49Å; L871-R875 PolarHBondContact O-N 2.99Å; L871-R875 VanDerWaalsContact O-N 3.15Å
872	G	91.8	Very high	89.9	Confident	38 Å²	38	97.4 Å²	97.4	39%	0.392	51%	0.506	S	S	.	.	H	α-helix	trans	-65.8	-44.7	173.7	0	0	0	0	0	112.9	Q868 V869 A870 R875 S876	Q868-G872 PolarHBondContact O-N 2.67Å; V869-G872 CarbonylContact O-C 3.58Å; V869-G872 WeakPolarHBondContact O-CA 3.5Å; V869-G872 PolarHBondContact O-N 2.83Å; A870-G872 VanDerWaalsContact C-N 3.31Å; A870-G872 PolarHBondContact O-N 3.46Å; G872-R875 PolarHBondContact O-N 3.43Å; G872-S876 PolarHBondContact O-N 3.31Å
873	L	91.8	Very high	89.9	Confident	106 Å²	106	99.3 Å²	99.3	56%	0.555	51%	0.509	S	S	*	.	H	α-helix	trans	-64.1	-48.5	176.7	-68.5	172.3	0	0	0	111.4	V869 A870 R875 S876 E877	V869-L873 HydrophobicContact CG1-CD1 4.17Å; V869-L873 HydrophobicContact CG1-CG 4.44Å; V869-L873 WeakPolarHBondContact O-CG 3.23Å; V869-L873 PolarHBondContact O-N 2.8Å; A870-L873 PolarHBondContact O-N 3.07Å; L873-R875 PolarHBondContact O-N 2.96Å; L873-S876 CarbonylContact O-C 3.53Å; L873-S876 WeakPolarHBondContact O-CA 3.47Å; L873-S876 VanDerWaalsContact O-CB 3.29Å; L873-S876 WeakPolarHBondContact O-CB 3.47Å; L873-S876 PolarHBondContact O-N 3.34Å; L873-E877 PolarHBondContact O-N 3.48Å
874	A	86.9	Confident	89.9	Confident	51 Å²	51	99.3 Å²	99.3	42%	0.421	50%	0.501	S	S	.	.	H	α-helix	trans	-60.4	-32.5	177.2	0	0	0	0	0	113	A870 N878	A870-A874 WeakPolarHBondContact O-CB 3.14Å; A870-A874 PolarHBondContact O-N 3.3Å; A874-N878 VanDerWaalsContact O-CB 3.27Å; A874-N878 WeakPolarHBondContact O-CB 3.32Å; A874-N878 PolarHBondContact O-N 3.37Å; A874-N878 VanDerWaalsContact O-N 3.12Å
875	R	93.2	Very high	89.6	Confident	172 Å²	172	98 Å²	98	65%	0.649	50%	0.5	S	S	*	.	H	α-helix	trans	-68.5	-38.8	171.1	-75.5	168.4	177.2	-169.2	-0.9	112.3	L871 G872 L873 L879	L871-R875 WeakPolarHBondContact O-CB 3.37Å; L871-R875 WeakPolarHBondContact O-CD 3.46Å; L871-R875 WeakPolarHBondContact O-CG 3.49Å; L871-R875 PolarHBondContact O-N 2.99Å; L871-R875 VanDerWaalsContact O-N 3.15Å; G872-R875 PolarHBondContact O-N 3.43Å; L873-R875 PolarHBondContact O-N 2.96Å; R875-L879 PolarHBondContact O-N 3.28Å; R875-L879 VanDerWaalsContact O-N 3.11Å
876	S	90.8	Very high	89.2	Confident	61 Å²	61	96.2 Å²	96.2	43%	0.427	50%	0.5	S	S	.	.	H	α-helix	trans	-65.8	-48.3	176.3	-167.9	0	0	0	0	111.7	G872 L873 N878 L879 I880	G872-S876 PolarHBondContact O-N 3.31Å; L873-S876 CarbonylContact O-C 3.53Å; L873-S876 WeakPolarHBondContact O-CA 3.47Å; L873-S876 VanDerWaalsContact O-CB 3.29Å; L873-S876 WeakPolarHBondContact O-CB 3.47Å; L873-S876 PolarHBondContact O-N 3.34Å; S876-N878 PolarHBondContact O-N 2.87Å; S876-L879 WeakPolarHBondContact O-CB 3.4Å; S876-L879 PolarHBondContact O-N 3.34Å; S876-L879 VanDerWaalsContact O-N 3.12Å; S876-I880 WeakPolarHBondContact O-CG1 3.32Å; S876-I880 PolarHBondContact O-N 2.82Å
877	E	89.3	Confident	88.8	Confident	104 Å²	104	99 Å²	99	49%	0.486	51%	0.506	S	S	.	.	H	α-helix	trans	-58.9	-45.9	176.2	-69.9	-178.6	157.5	0	0	111.7	L873 L879 I880 Y881	L873-E877 PolarHBondContact O-N 3.48Å; E877-L879 VanDerWaalsContact C-N 3.27Å; E877-L879 PolarHBondContact O-N 3.09Å; E877-I880 PolarHBondContact O-N 3.29Å; E877-I880 VanDerWaalsContact O-N 3.1Å; E877-Y881 HydrophobicContact CB-CD2 4.33Å; E877-Y881 HydrophobicContact CB-CE2 3.94Å; E877-Y881 WeakPolarHBondContact O-CD2 3.32Å; E877-Y881 PolarHBondContact O-N 3.43Å
878	N	90.7	Very high	88.1	Confident	102 Å²	102	97.8 Å²	97.8	55%	0.545	50%	0.501	S	S	.	.	H	α-helix	trans	-59.8	-36.6	175.9	-168	-21.9	0	0	0	112.3	A874 S876 T882	A874-N878 VanDerWaalsContact O-CB 3.27Å; A874-N878 WeakPolarHBondContact O-CB 3.32Å; A874-N878 PolarHBondContact O-N 3.37Å; A874-N878 VanDerWaalsContact O-N 3.12Å; S876-N878 PolarHBondContact O-N 2.87Å; N878-T882 VanDerWaalsContact O-CB 3.25Å; N878-T882 WeakPolarHBondContact O-CB 3.32Å; N878-T882 PolarHBondContact O-N 2.59Å; N878-T882 PolarHBondContact O-OG1 3.23Å
879	L	92.7	Very high	87.2	Confident	123 Å²	123	99.6 Å²	99.6	64%	0.644	51%	0.507	S	S	*	.	H	α-helix	trans	-67.2	-41.2	173.7	-175.4	62.8	0	0	0	112.2	R875 S876 E877 T882 Y883	R875-L879 PolarHBondContact O-N 3.28Å; R875-L879 VanDerWaalsContact O-N 3.11Å; S876-L879 WeakPolarHBondContact O-CB 3.4Å; S876-L879 PolarHBondContact O-N 3.34Å; S876-L879 VanDerWaalsContact O-N 3.12Å; E877-L879 VanDerWaalsContact C-N 3.27Å; E877-L879 PolarHBondContact O-N 3.09Å; L879-T882 PolarHBondContact O-N 3.45Å; L879-Y883 PolarHBondContact O-N 3.19Å
880	I	89.4	Confident	86.3	Confident	90 Å²	90	98.3 Å²	98.3	46%	0.462	51%	0.513	S	S	.	.	H	α-helix	trans	-62.7	-50.4	175.1	-65.9	164.3	0	0	0	110.4	S876 E877 T882 Y883 D884	S876-I880 WeakPolarHBondContact O-CG1 3.32Å; S876-I880 PolarHBondContact O-N 2.82Å; E877-I880 PolarHBondContact O-N 3.29Å; E877-I880 VanDerWaalsContact O-N 3.1Å; I880-T882 VanDerWaalsContact C-N 3.25Å; I880-T882 PolarHBondContact O-N 3.28Å; I880-Y883 WeakPolarHBondContact O-CA 3.31Å; I880-Y883 WeakPolarHBondContact O-CB 3.48Å; I880-Y883 PolarHBondContact O-N 2.8Å; I880-D884 PolarHBondContact O-N 3.34Å
881	Y	86.5	Confident	85.4	Confident	92 Å²	92	98.5 Å²	98.5	36%	0.361	51%	0.511	S	S	.	.	H	α-helix	trans	-60.8	-34.6	176	-65.2	-47	0	0	0	112.6	E877 K885 T943	E877-Y881 HydrophobicContact CB-CD2 4.33Å; E877-Y881 HydrophobicContact CB-CE2 3.94Å; E877-Y881 WeakPolarHBondContact O-CD2 3.32Å; E877-Y881 PolarHBondContact O-N 3.43Å; Y881-K885 WeakPolarHBondContact O-CB 3.23Å; Y881-K885 PolarHBondContact O-N 3.28Å; Y881-T943 WeakPolarHBondContact OH-CA 3.48Å; Y881-T943 PolarHBondContact OH-OXT 2.62Å
882	T	87.1	Confident	84.6	Confident	62 Å²	62	100 Å²	100	38%	0.38	53%	0.53	S	S	.	.	H	α-helix	trans	-66.9	-40.9	173.4	-64.3	0	0	0	0	111.5	N878 L879 I880 M886	N878-T882 VanDerWaalsContact O-CB 3.25Å; N878-T882 WeakPolarHBondContact O-CB 3.32Å; N878-T882 PolarHBondContact O-N 2.59Å; N878-T882 PolarHBondContact O-OG1 3.23Å; L879-T882 PolarHBondContact O-N 3.45Å; I880-T882 VanDerWaalsContact C-N 3.25Å; I880-T882 PolarHBondContact O-N 3.28Å; T882-M886 WeakPolarHBondContact O-CG 3.42Å; T882-M886 PolarHBondContact O-N 3.31Å; T882-M886 VanDerWaalsContact O-N 3.16Å
883	Y	87.5	Confident	83.8	Confident	151 Å²	151	100.7 Å²	100.7	59%	0.592	52%	0.524	S	S	*	.	H	α-helix	trans	-63.6	-51.5	174.7	172	-93.7	0	0	0	112.2	L879 I880 K885 M886 K887	L879-Y883 PolarHBondContact O-N 3.19Å; I880-Y883 WeakPolarHBondContact O-CA 3.31Å; I880-Y883 WeakPolarHBondContact O-CB 3.48Å; I880-Y883 PolarHBondContact O-N 2.8Å; Y883-K885 VanDerWaalsContact C-N 3.29Å; Y883-K885 PolarHBondContact O-N 3.03Å; Y883-M886 WeakPolarHBondContact O-CB 3.13Å; Y883-M886 PolarHBondContact O-N 3.47Å; Y883-K887 HydrophobicContact CE1-CD 3.9Å; Y883-K887 PolarHBondContact O-N 3.18Å
884	D	82.8	Confident	83	Confident	59 Å²	59	106.4 Å²	106.4	32%	0.316	54%	0.538	S	S	.	.	H	α-helix	trans	-65.9	-33.2	-179.1	-80.8	-44.9	0	0	0	112.1	I880 M886 K887 L888	I880-D884 PolarHBondContact O-N 3.34Å; D884-M886 VanDerWaalsContact C-N 3.32Å; D884-M886 PolarHBondContact O-N 3.36Å; D884-K887 PolarHBondContact O-N 3.46Å; D884-K887 IonicContact OD1-NZ 3.65Å; D884-L888 WeakPolarHBondContact O-CB 3.42Å; D884-L888 VanDerWaalsContact O-CG 3.3Å; D884-L888 WeakPolarHBondContact O-CG 3.4Å; D884-L888 PolarHBondContact O-N 3.45Å
885	K	81	Confident	82.4	Confident	135 Å²	135	106.5 Å²	106.5	59%	0.587	53%	0.531	S	S	*	.	H	α-helix	trans	-60.8	-36.3	169.9	-178	176.8	-175.8	175.2	0	112.8	Y881 Y883 K889	Y881-K885 WeakPolarHBondContact O-CB 3.23Å; Y881-K885 PolarHBondContact O-N 3.28Å; Y883-K885 VanDerWaalsContact C-N 3.29Å; Y883-K885 PolarHBondContact O-N 3.03Å; K885-K889 WeakPolarHBondContact O-CG 3.32Å; K885-K889 PolarHBondContact O-N 3.44Å
886	M	83.3	Confident	81.4	Confident	120 Å²	120	101.3 Å²	101.3	59%	0.591	52%	0.521	S	S	*	.	H	α-helix	trans	-73.6	-42.1	173.2	-66.5	-58.8	-165.6	0	0	112	T882 Y883 D884 L888 K889 G890	T882-M886 WeakPolarHBondContact O-CG 3.42Å; T882-M886 PolarHBondContact O-N 3.31Å; T882-M886 VanDerWaalsContact O-N 3.16Å; Y883-M886 WeakPolarHBondContact O-CB 3.13Å; Y883-M886 PolarHBondContact O-N 3.47Å; D884-M886 VanDerWaalsContact C-N 3.32Å; D884-M886 PolarHBondContact O-N 3.36Å; M886-L888 PolarHBondContact O-N 3.39Å; M886-K889 WeakPolarHBondContact O-CB 3.24Å; M886-K889 PolarHBondContact O-N 3.33Å; M886-K889 HydrophobicContact SD-CD 4.33Å; M886-G890 PolarHBondContact O-N 3.17Å; M886-G890 VanDerWaalsContact O-N 3.08Å
887	K	81	Confident	80.4	Confident	128 Å²	128	105.6 Å²	105.6	56%	0.557	54%	0.539	S	S	*	.	H	α-helix	trans	-59.7	-43.4	176.6	-177.2	179.2	171.3	-171.2	0	112.2	Y883 D884 G890	Y883-K887 HydrophobicContact CE1-CD 3.9Å; Y883-K887 PolarHBondContact O-N 3.18Å; D884-K887 PolarHBondContact O-N 3.46Å; D884-K887 IonicContact OD1-NZ 3.65Å; K887-G890 PolarHBondContact O-N 3.21Å
888	L	74.6	Confident	79.6	Confident	107 Å²	107	110 Å²	110	56%	0.56	56%	0.557	S	S	*	*	H	α-helix	trans	-65.2	-41.8	174.8	-72.6	169.7	0	0	0	112.2	D884 M886 G890 S891	D884-L888 WeakPolarHBondContact O-CB 3.42Å; D884-L888 VanDerWaalsContact O-CG 3.3Å; D884-L888 WeakPolarHBondContact O-CG 3.4Å; D884-L888 PolarHBondContact O-N 3.45Å; M886-L888 PolarHBondContact O-N 3.39Å; L888-G890 PolarHBondContact O-N 3.41Å; L888-S891 PolarHBondContact O-N 3.42Å; L888-S891 VanDerWaalsContact O-N 3.1Å; L888-S891 PolarHBondContact O-OG 2.83Å
889	K	74.1	Confident	78.9	Confident	158 Å²	158	108.9 Å²	108.9	69%	0.687	55%	0.547	S	S	*	.	H	α-helix	trans	-59.3	-29.6	173.4	-83.5	-179.3	170.6	-166.7	0	113.6	K885 M886 S891	K885-K889 WeakPolarHBondContact O-CG 3.32Å; K885-K889 PolarHBondContact O-N 3.44Å; M886-K889 WeakPolarHBondContact O-CB 3.24Å; M886-K889 PolarHBondContact O-N 3.33Å; M886-K889 HydrophobicContact SD-CD 4.33Å; K889-S891 VanDerWaalsContact C-N 3.27Å; K889-S891 PolarHBondContact O-N 2.79Å
890	G	73.2	Confident	78.3	Confident	66 Å²	66	106.6 Å²	106.6	68%	0.68	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-11.2	176.2	0	0	0	0	0	114.9	M886 K887 L888 S892	M886-G890 PolarHBondContact O-N 3.17Å; M886-G890 VanDerWaalsContact O-N 3.08Å; K887-G890 PolarHBondContact O-N 3.21Å; L888-G890 PolarHBondContact O-N 3.41Å; G890-S892 PolarHBondContact O-N 3Å
891	S	72.9	Confident	78	Confident	53 Å²	53	102.3 Å²	102.3	37%	0.371	51%	0.513	S	S	.	.			trans	-84	111.2	-176.7	67.3	0	0	0	0	112.6	L888 K889 R915	L888-S891 PolarHBondContact O-N 3.42Å; L888-S891 VanDerWaalsContact O-N 3.1Å; L888-S891 PolarHBondContact O-OG 2.83Å; K889-S891 VanDerWaalsContact C-N 3.27Å; K889-S891 PolarHBondContact O-N 2.79Å; S891-R915 PolarHBondContact OG-NH1 2.67Å; S891-R915 VanDerWaalsContact OG-NH1 3.09Å
892	S	76.8	Confident	77.7	Confident	123 Å²	123	101.8 Å²	101.8	86%	0.86	51%	0.514	S	S	*	.			trans	-79.2	147.9	172.7	63.8	0	0	0	0	111.5	G890	G890-S892 PolarHBondContact O-N 3Å
893	I	73.5	Confident	77.3	Confident	52 Å²	52	101.5 Å²	101.5	27%	0.267	51%	0.51	S	S	.	.			trans	-131.3	123.8	-175.5	-56.6	178.2	0	0	0	108.8	F913 L921	I893-F913 HydrophobicContact CB-CZ 4.2Å; I893-F913 HydrophobicContact CD1-CE2 4.12Å; I893-F913 HydrophobicContact CD1-CZ 4.36Å; I893-L921 HydrophobicContact CD1-CD2 4.26Å; I893-L921 HydrophobicContact CG2-CD1 4.47Å
894	R	75.1	Confident	76.8	Confident	226 Å²	226	96.4 Å²	96.4	85%	0.853	50%	0.496	S	S	*	.			trans	-78.8	121.1	168.5	-64.1	-173.9	-177.7	-170.6	0.5	109.5	K899	R894-K899 PolarHBondContact O-NZ 2.94Å
895	L	74.6	Confident	76.7	Confident	52 Å²	52	99 Å²	99	27%	0.272	51%	0.506	S	S	.	.			trans	-75.9	158.4	162.8	-63.1	175.7	0	0	0	109.7	F908 F913 L921	L895-F908 HydrophobicContact CD1-CB 4.11Å; L895-F908 HydrophobicContact CD2-CB 4.47Å; L895-F908 HydrophobicContact CD2-CD2 4.26Å; L895-F908 HydrophobicContact CD2-CG 4.3Å; L895-F913 HydrophobicContact CD1-CD1 3.89Å; L895-F913 HydrophobicContact CD1-CE1 4.07Å; L895-F913 HydrophobicContact CD2-CD1 4.05Å; L895-F913 HydrophobicContact CD2-CE1 4.1Å; L895-F913 HydrophobicContact CG-CD1 4.3Å; L895-F913 HydrophobicContact CG-CE1 4.14Å; L895-L921 HydrophobicContact CD2-CD1 4.08Å
896	S	73	Confident	76.6	Confident	64 Å²	64	97.3 Å²	97.3	45%	0.448	50%	0.503	S	S	.	.			trans	-161.2	156.6	170.2	57.5	0	0	0	0	108.5	K898 K899	S896-K898 PolarHBondContact O-N 2.85Å; S896-K899 WeakPolarHBondContact O-CB 3.35Å; S896-K899 PolarHBondContact O-N 2.92Å
897	D	69.6	Low	76.5	Confident	151 Å²	151	94.4 Å²	94.4	81%	0.807	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-18.2	-169	-34.7	-31.3	0	0	0	113.8	K899	D897-K899 VanDerWaalsContact C-N 3.32Å
898	K	72.1	Confident	76.5	Confident	197 Å²	197	89.6 Å²	89.6	86%	0.857	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-7.2	173.7	-58.2	-170	-177.4	-171.9	0	114	S896	S896-K898 PolarHBondContact O-N 2.85Å
899	K	75.6	Confident	76.5	Confident	78 Å²	78	90.4 Å²	90.4	34%	0.339	49%	0.486	S	S	.	.			trans	-95.1	114.7	177	-68.7	-175.6	176.1	-178.8	0	109.4	R894 S896 D897 F908 L921	R894-K899 PolarHBondContact O-NZ 2.94Å; S896-K899 WeakPolarHBondContact O-CB 3.35Å; S896-K899 PolarHBondContact O-N 2.92Å; D897-K899 VanDerWaalsContact C-N 3.32Å; K899-F908 WeakPolarHBondContact O-CD2 3.44Å; K899-L921 HydrophobicContact CD-CD1 4.22Å
900	L	81.6	Confident	76.5	Confident	75 Å²	75	89.3 Å²	89.3	39%	0.393	48%	0.483	S	S	.	.	B	Isolated β-bridge	trans	-103.6	152.1	-179.3	-52.5	177.1	0	0	0	110.1	Q902 Q905 N906 P907	L900-Q902 PolarHBondContact O-N 3.29Å; L900-Q905 WeakPolarHBondContact CD1-O 3.35Å; L900-N906 WeakPolarHBondContact CA-O 3.49Å; L900-P907 HydrophobicContact CD2-CB 3.94Å
901	C	81.2	Confident	76.5	Confident	0 Å²	0	91.4 Å²	91.4	0%	0	48%	0.484	C	S	.	.			trans	-67.3	127.4	172.1	166.7	0	0	0	0	110.3	I903 C904 Q905 N906 F908 V922 H923	C901-I903 PolarHBondContact O-N 2.92Å; C901-C904 PolarHBondContact O-N 2.84Å; C901-Q905 VanDerWaalsContact O-CA 3.22Å; C901-Q905 WeakPolarHBondContact O-CA 3.33Å; C901-Q905 PolarHBondContact O-N 2.92Å; C901-N906 PolarHBondContact N-O 2.85Å; C901-F908 HydrophobicContact CB-CE1 4.48Å; C901-F908 HydrophobicContact CB-CE2 4.37Å; C901-F908 HydrophobicContact CB-CZ 3.94Å; C901-V922 VanDerWaalsContact SG-CA 3.54Å; C901-H923 WeakPolarHBondContact CB-ND1 3.28Å
902	Q	80.4	Confident	76.8	Confident	81 Å²	81	92.8 Å²	92.8	38%	0.379	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-22.9	-176.7	-74.4	-170.9	-27	0	0	115.2	L900 Q905 G920 L921 V922	L900-Q902 PolarHBondContact O-N 3.29Å; Q902-Q905 PolarHBondContact O-NE2 2.96Å; Q902-Q905 VanDerWaalsContact O-NE2 3.15Å; Q902-G920 VanDerWaalsContact CD-CA 3.45Å; Q902-G920 VanDerWaalsContact OE1-CA 3.3Å; Q902-L921 PolarHBondContact N-O 2.97Å; Q902-V922 HydrophobicContact CB-CG1 4.14Å
903	I	78.4	Confident	77	Confident	56 Å²	56	89.7 Å²	89.7	29%	0.287	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-48.7	-177.2	-66.8	172.2	0	0	0	111.7	C901 V922 C926	C901-I903 PolarHBondContact O-N 2.92Å; I903-V922 HydrophobicContact CD1-CB 4.43Å; I903-V922 HydrophobicContact CD1-CG1 3.88Å; I903-V922 HydrophobicContact CG1-CG1 3.93Å; I903-C926 HydrophobicContact CB-CB 4.05Å; I903-C926 HydrophobicContact CD1-CB 4.04Å; I903-C926 WeakPolarHBondContact CD1-O 3.23Å; I903-C926 HydrophobicContact CG2-CB 4.17Å
904	C	78.3	Confident	77.4	Confident	44 Å²	44	89.8 Å²	89.8	30%	0.297	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-2.2	-175.9	66	0	0	0	0	115.1	C901 N906 H923 C926	C901-C904 PolarHBondContact O-N 2.84Å; C904-N906 PolarHBondContact O-N 2.88Å; C904-H923 PolarHBondContact SG-ND1 2.92Å; C904-C926 VanDerWaalsContact SG-SG 3.65Å
905	Q	80.5	Confident	77.5	Confident	113 Å²	113	84.3 Å²	84.3	53%	0.528	44%	0.444	S	S	.	.			trans	55.1	12.2	-179.1	-57.2	-62	-26.7	0	0	116	L900 C901 Q902	L900-Q905 WeakPolarHBondContact CD1-O 3.35Å; C901-Q905 VanDerWaalsContact O-CA 3.22Å; C901-Q905 WeakPolarHBondContact O-CA 3.33Å; C901-Q905 PolarHBondContact O-N 2.92Å; Q902-Q905 PolarHBondContact O-NE2 2.96Å; Q902-Q905 VanDerWaalsContact O-NE2 3.15Å
906	N	79.5	Confident	77.7	Confident	100 Å²	100	84.1 Å²	84.1	54%	0.535	44%	0.44	S	S	.	.			trans	-83.9	149.6	172	-69.5	-25.1	0	0	0	111.6	L900 C901 C904	L900-N906 WeakPolarHBondContact CA-O 3.49Å; C901-N906 PolarHBondContact N-O 2.85Å; C904-N906 PolarHBondContact O-N 2.88Å
907	P	79.9	Confident	77.4	Confident	59 Å²	59	87.6 Å²	87.6	38%	0.383	46%	0.461	S	S	.	.	B	Isolated β-bridge	trans	-70.6	158.2	174.7	30.8	-35.9	0	0	0	112.4	L900 C909 H923	L900-P907 HydrophobicContact CD2-CB 3.94Å; P907-C909 PolarHBondContact O-N 2.7Å; P907-H923 PolarHBondContact O-NE2 2.78Å
908	F	81.1	Confident	77.5	Confident	27 Å²	27	85.4 Å²	85.4	12%	0.118	45%	0.449	C	S	.	.			trans	-82.1	98.9	178.6	-67	-88	0	0	0	111.8	L895 K899 C901 E910 F913 L921 H923	L895-F908 HydrophobicContact CD1-CB 4.11Å; L895-F908 HydrophobicContact CD2-CB 4.47Å; L895-F908 HydrophobicContact CD2-CD2 4.26Å; L895-F908 HydrophobicContact CD2-CG 4.3Å; K899-F908 WeakPolarHBondContact O-CD2 3.44Å; C901-F908 HydrophobicContact CB-CE1 4.48Å; C901-F908 HydrophobicContact CB-CE2 4.37Å; C901-F908 HydrophobicContact CB-CZ 3.94Å; F908-E910 VanDerWaalsContact C-N 3.31Å; F908-F913 HydrophobicContact CD1-CB 3.88Å; F908-F913 HydrophobicContact CE1-CB 3.59Å; F908-F913 HydrophobicContact CZ-CB 4.45Å; F908-L921 HydrophobicContact CE2-CB 3.91Å; F908-L921 HydrophobicContact CZ-CB 3.64Å; F908-H923 AromaticContact CD1-CD2 3.44Å; F908-H923 VanDerWaalsContact CD1-CD2 3.44Å; F908-H923 WeakPolarHBondContact CD1-CD2 3.47Å; F908-H923 AromaticContact CD1-NE2 3.4Å; F908-H923 WeakPolarHBondContact CD1-NE2 3.44Å; F908-H923 AromaticContact CE1-CD2 3.64Å; F908-H923 AromaticContact CE1-NE2 3.82Å; F908-H923 AromaticContact CG-NE2 3.87Å
909	C	74.6	Confident	77.6	Confident	124 Å²	124	77.6 Å²	77.6	84%	0.838	43%	0.425	S	S	*	.	S	Bend	trans	-73.3	-21.6	175.1	-59.5	0	0	0	0	113.6	P907	P907-C909 PolarHBondContact O-N 2.7Å
910	E	75.3	Confident	77.8	Confident	135 Å²	135	74 Å²	74	63%	0.631	41%	0.41	S	S	*	.	S	Bend	trans	-118.9	151.5	179.2	-70.2	-176	-174.2	0	0	111.2	F908 V912	F908-E910 VanDerWaalsContact C-N 3.31Å; E910-V912 PolarHBondContact O-N 3.36Å
911	P	72.5	Confident	77.9	Confident	109 Å²	109	71.4 Å²	71.4	71%	0.708	40%	0.396	S	S	*	.	S	Bend	trans	-72.1	5.3	176.6	31.6	-36.6	0	0	0	114.1	F913	P911-F913 WeakPolarHBondContact O-CD1 3.44Å
912	V	79.4	Confident	78	Confident	82 Å²	82	71.4 Å²	71.4	50%	0.497	40%	0.396	S	S	.	.			trans	-101.5	113.2	-176.2	-168	0	0	0	0	110.4	E910 T924	E910-V912 PolarHBondContact O-N 3.36Å; V912-T924 HydrophobicContact CG1-CG2 3.79Å
913	F	80.7	Confident	78.1	Confident	59 Å²	59	68.7 Å²	68.7	26%	0.259	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	162.4	-177.3	60.7	-88.6	0	0	0	111.4	I893 L895 F908 P911 L921	I893-F913 HydrophobicContact CB-CZ 4.2Å; I893-F913 HydrophobicContact CD1-CE2 4.12Å; I893-F913 HydrophobicContact CD1-CZ 4.36Å; L895-F913 HydrophobicContact CD1-CD1 3.89Å; L895-F913 HydrophobicContact CD1-CE1 4.07Å; L895-F913 HydrophobicContact CD2-CD1 4.05Å; L895-F913 HydrophobicContact CD2-CE1 4.1Å; L895-F913 HydrophobicContact CG-CD1 4.3Å; L895-F913 HydrophobicContact CG-CE1 4.14Å; F908-F913 HydrophobicContact CD1-CB 3.88Å; F908-F913 HydrophobicContact CE1-CB 3.59Å; F908-F913 HydrophobicContact CZ-CB 4.45Å; P911-F913 WeakPolarHBondContact O-CD1 3.44Å; F913-L921 HydrophobicContact CD2-CD2 3.82Å; F913-L921 HydrophobicContact CE2-CD2 3.84Å
914	V	81.7	Confident	78.2	Confident	53 Å²	53	69.4 Å²	69.4	32%	0.321	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	137.3	170.7	178.3	0	0	0	0	108.7	V922 T924 A927	V914-V922 HydrophobicContact CB-CG2 3.99Å; V914-V922 HydrophobicContact CG1-CG2 4.46Å; V914-V922 PolarHBondContact N-O 3.44Å; V914-V922 PolarHBondContact O-N 3.18Å; V914-T924 HydrophobicContact CG2-CG2 4.21Å; V914-A927 HydrophobicContact CB-CB 4Å; V914-A927 HydrophobicContact CG1-CB 4.08Å; V914-A927 HydrophobicContact CG2-CB 3.87Å
915	R	78.1	Confident	78.3	Confident	111 Å²	111	73.1 Å²	73.1	42%	0.419	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.9	172.6	176	172.2	173.1	-160	0.5	109.9	S891 G920 L921	S891-R915 PolarHBondContact OG-NH1 2.67Å; S891-R915 VanDerWaalsContact OG-NH1 3.09Å; R915-G920 CarbonylContact C-O 3.57Å; R915-G920 WeakPolarHBondContact CA-O 3.48Å; R915-L921 HydrophobicContact CB-CD2 3.96Å; R915-L921 HydrophobicContact CG-CD2 4.13Å
916	Y	77.6	Confident	78.1	Confident	49 Å²	49	68 Å²	68	19%	0.192	38%	0.38	C	S	.	.			trans	-77.7	159.3	171.3	-76.9	-70.3	0	0	0	111.5	N918 G919 G920 V922	Y916-N918 WeakPolarHBondContact CB-OD1 3.38Å; Y916-N918 PolarHBondContact O-N 2.77Å; Y916-G919 PolarHBondContact O-N 3.08Å; Y916-G920 PolarHBondContact N-O 2.6Å; Y916-V922 HydrophobicContact CD2-CG1 4.13Å; Y916-V922 HydrophobicContact CD2-CG2 4.07Å; Y916-V922 HydrophobicContact CE2-CB 4.32Å; Y916-V922 HydrophobicContact CE2-CG1 3.81Å; Y916-V922 HydrophobicContact CE2-CG2 3.51Å
917	P	67.6	Low	77.9	Confident	137 Å²	137	64.7 Å²	64.7	89%	0.89	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-31.9	179.5	-27.2	36	0	0	0	114.2	G919	P917-G919 PolarHBondContact O-N 3.48Å
918	N	71.4	Confident	77.5	Confident	104 Å²	104	65.4 Å²	65.4	56%	0.556	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	2	174.4	70.3	-8.2	0	0	0	114.4	Y916 G920	Y916-N918 WeakPolarHBondContact CB-OD1 3.38Å; Y916-N918 PolarHBondContact O-N 2.77Å; N918-G920 VanDerWaalsContact C-N 3.28Å; N918-G920 PolarHBondContact O-N 2.9Å; N918-G920 WeakPolarHBondContact OD1-CA 3.15Å; N918-G920 PolarHBondContact OD1-N 3.01Å
919	G	73.3	Confident	76.9	Confident	34 Å²	34	67.1 Å²	67.1	35%	0.351	39%	0.392	S	S	.	.	S	Bend	trans	84.7	-6.6	-176.1	0	0	0	0	0	114.9	Y916 P917	Y916-G919 PolarHBondContact O-N 3.08Å; P917-G919 PolarHBondContact O-N 3.48Å
920	G	80.7	Confident	75.8	Confident	2 Å²	2	72.5 Å²	72.5	2%	0.021	40%	0.395	C	S	.	.			trans	-64	137.9	179.4	0	0	0	0	0	113.1	Q902 R915 Y916 N918	Q902-G920 VanDerWaalsContact CD-CA 3.45Å; Q902-G920 VanDerWaalsContact OE1-CA 3.3Å; R915-G920 CarbonylContact C-O 3.57Å; R915-G920 WeakPolarHBondContact CA-O 3.48Å; Y916-G920 PolarHBondContact N-O 2.6Å; N918-G920 VanDerWaalsContact C-N 3.28Å; N918-G920 PolarHBondContact O-N 2.9Å; N918-G920 WeakPolarHBondContact OD1-CA 3.15Å; N918-G920 PolarHBondContact OD1-N 3.01Å
921	L	82.8	Confident	74.8	Confident	20 Å²	20	75 Å²	75	11%	0.105	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	134.9	176	-55	-179.3	0	0	0	109.9	I893 L895 K899 Q902 F908 F913 R915	I893-L921 HydrophobicContact CD1-CD2 4.26Å; I893-L921 HydrophobicContact CG2-CD1 4.47Å; L895-L921 HydrophobicContact CD2-CD1 4.08Å; K899-L921 HydrophobicContact CD-CD1 4.22Å; Q902-L921 PolarHBondContact N-O 2.97Å; F908-L921 HydrophobicContact CE2-CB 3.91Å; F908-L921 HydrophobicContact CZ-CB 3.64Å; F913-L921 HydrophobicContact CD2-CD2 3.82Å; F913-L921 HydrophobicContact CE2-CD2 3.84Å; R915-L921 HydrophobicContact CB-CD2 3.96Å; R915-L921 HydrophobicContact CG-CD2 4.13Å
922	V	83.4	Confident	73.7	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	155.3	172.7	-59.2	0	0	0	0	112.2	C901 Q902 I903 V914 Y916 C926 A927	C901-V922 VanDerWaalsContact SG-CA 3.54Å; Q902-V922 HydrophobicContact CB-CG1 4.14Å; I903-V922 HydrophobicContact CD1-CB 4.43Å; I903-V922 HydrophobicContact CD1-CG1 3.88Å; I903-V922 HydrophobicContact CG1-CG1 3.93Å; V914-V922 HydrophobicContact CB-CG2 3.99Å; V914-V922 HydrophobicContact CG1-CG2 4.46Å; V914-V922 PolarHBondContact N-O 3.44Å; V914-V922 PolarHBondContact O-N 3.18Å; Y916-V922 HydrophobicContact CD2-CG1 4.13Å; Y916-V922 HydrophobicContact CD2-CG2 4.07Å; Y916-V922 HydrophobicContact CE2-CB 4.32Å; Y916-V922 HydrophobicContact CE2-CG1 3.81Å; Y916-V922 HydrophobicContact CE2-CG2 3.51Å; V922-C926 HydrophobicContact CB-CB 4.24Å; V922-A927 HydrophobicContact CG2-CB 3.91Å
923	H	83	Confident	72	Confident	25 Å²	25	76.2 Å²	76.2	12%	0.116	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	150.5	169.6	-64.6	116.9	0	0	0	111	C901 C904 P907 F908 H925 C926 A927	C901-H923 WeakPolarHBondContact CB-ND1 3.28Å; C904-H923 PolarHBondContact SG-ND1 2.92Å; P907-H923 PolarHBondContact O-NE2 2.78Å; F908-H923 AromaticContact CD1-CD2 3.44Å; F908-H923 VanDerWaalsContact CD1-CD2 3.44Å; F908-H923 WeakPolarHBondContact CD1-CD2 3.47Å; F908-H923 AromaticContact CD1-NE2 3.4Å; F908-H923 WeakPolarHBondContact CD1-NE2 3.44Å; F908-H923 AromaticContact CE1-CD2 3.64Å; F908-H923 AromaticContact CE1-NE2 3.82Å; F908-H923 AromaticContact CG-NE2 3.87Å; H923-H925 VanDerWaalsContact C-N 3.26Å; H923-H925 WeakPolarHBondContact CB-NE2 3.49Å; H923-H925 AromaticContact CG-NE2 3.68Å; H923-H925 AromaticContact ND1-NE2 3.88Å; H923-H925 PolarHBondContact O-N 2.72Å; H923-C926 HydrophobicContact CB-CB 4.37Å; H923-C926 WeakPolarHBondContact O-CB 3.43Å; H923-C926 PolarHBondContact O-N 3.25Å; H923-A927 PolarHBondContact O-N 3.34Å
924	T	81.8	Confident	70.4	Confident	71 Å²	71	75.4 Å²	75.4	44%	0.436	41%	0.408	S	S	.	.	H	α-helix	trans	-53.8	-41.9	176.9	48.3	0	0	0	0	112.4	V912 V914 A927 A928	V912-T924 HydrophobicContact CG1-CG2 3.79Å; V914-T924 HydrophobicContact CG2-CG2 4.21Å; T924-A927 PolarHBondContact O-N 3.48Å; T924-A928 PolarHBondContact O-N 2.87Å
925	H	79.6	Confident	68.4	Low	122 Å²	122	78.6 Å²	78.6	57%	0.565	43%	0.432	S	S	*	.	H	α-helix	trans	-66.9	-36.4	176.3	68.8	84.4	0	0	0	113	H923 A927 A928 S929	H923-H925 VanDerWaalsContact C-N 3.26Å; H923-H925 WeakPolarHBondContact CB-NE2 3.49Å; H923-H925 AromaticContact CG-NE2 3.68Å; H923-H925 AromaticContact ND1-NE2 3.88Å; H923-H925 PolarHBondContact O-N 2.72Å; H925-A927 VanDerWaalsContact C-N 3.33Å; H925-A927 PolarHBondContact O-N 2.82Å; H925-A928 WeakPolarHBondContact O-CB 3.46Å; H925-A928 PolarHBondContact O-N 2.65Å; H925-S929 PolarHBondContact O-N 2.67Å
926	C	76.4	Confident	66.3	Low	6 Å²	6	78.2 Å²	78.2	4%	0.041	45%	0.447	C	S	.	.	H	α-helix	trans	-69.8	-28.7	175.7	-66.4	0	0	0	0	112.8	I903 C904 V922 H923 A928 S929	I903-C926 HydrophobicContact CB-CB 4.05Å; I903-C926 HydrophobicContact CD1-CB 4.04Å; I903-C926 WeakPolarHBondContact CD1-O 3.23Å; I903-C926 HydrophobicContact CG2-CB 4.17Å; C904-C926 VanDerWaalsContact SG-SG 3.65Å; V922-C926 HydrophobicContact CB-CB 4.24Å; H923-C926 HydrophobicContact CB-CB 4.37Å; H923-C926 WeakPolarHBondContact O-CB 3.43Å; H923-C926 PolarHBondContact O-N 3.25Å; C926-A928 VanDerWaalsContact C-N 3.33Å; C926-S929 PolarHBondContact O-OG 3.06Å
927	A	75.9	Confident	64.2	Low	29 Å²	29	81.9 Å²	81.9	24%	0.24	48%	0.479	C	S	.	.	H	α-helix	trans	-74	-24	172.6	0	0	0	0	0	112.8	V914 V922 H923 T924 H925	V914-A927 HydrophobicContact CB-CB 4Å; V914-A927 HydrophobicContact CG1-CB 4.08Å; V914-A927 HydrophobicContact CG2-CB 3.87Å; V922-A927 HydrophobicContact CG2-CB 3.91Å; H923-A927 PolarHBondContact O-N 3.34Å; T924-A927 PolarHBondContact O-N 3.48Å; H925-A927 VanDerWaalsContact C-N 3.33Å; H925-A927 PolarHBondContact O-N 2.82Å
928	A	71.8	Confident	62.3	Low	74 Å²	74	79.1 Å²	79.1	61%	0.612	46%	0.463	S	S	*	.	H	α-helix	trans	-76	-29	179.1	0	0	0	0	0	113	T924 H925 C926 R930	T924-A928 PolarHBondContact O-N 2.87Å; H925-A928 WeakPolarHBondContact O-CB 3.46Å; H925-A928 PolarHBondContact O-N 2.65Å; C926-A928 VanDerWaalsContact C-N 3.33Å; A928-R930 PolarHBondContact O-N 2.89Å
929	S	67.3	Low	60.4	Low	63 Å²	63	81.2 Å²	81.2	44%	0.441	48%	0.482	S	S	.	.			trans	-72.9	84	173.2	43.5	0	0	0	0	111.6	H925 C926 H931	H925-S929 PolarHBondContact O-N 2.67Å; C926-S929 PolarHBondContact O-OG 3.06Å; S929-H931 PolarHBondContact O-N 3.13Å
930	R	51.5	Low	58.3	Low	237 Å²	237	82 Å²	82	89%	0.894	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	0.8	-171.4	-69.6	-174.4	175.1	-173.2	-1.2	117.7	A928	A928-R930 PolarHBondContact O-N 2.89Å
931	H	53.5	Low	55.8	Low	189 Å²	189	87.6 Å²	87.6	88%	0.875	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-3	-171.3	-87.5	-74.8	0	0	0	116.2	S929	S929-H931 PolarHBondContact O-N 3.13Å
932	T	49.5	Very low	53.2	Low	76 Å²	76	98.7 Å²	98.7	47%	0.466	57%	0.565	S	S	.	*			trans	-131.7	87.4	177.4	55.7	0	0	0	0	112.2
933	N	45.3	Very low	50.8	Low	140 Å²	140	105.4 Å²	105.4	75%	0.749	61%	0.606	S	S	*	*			trans	-66.1	125	153.8	-94.5	-19.2	0	0	0	107.6	S935	N933-S935 PolarHBondContact O-N 2.63Å
934	P	45.6	Very low	49.2	Very low	42 Å²	42	109.4 Å²	109.4	27%	0.273	63%	0.631	S	S	.	*			trans	-61.9	127.2	171.7	25.6	-32.3	0	0	0	109.2	S936	P934-S936 PolarHBondContact O-N 3.23Å; P934-S936 VanDerWaalsContact O-N 3.15Å
935	S	39.7	Very low	47.4	Very low	119 Å²	119	111.4 Å²	111.4	83%	0.832	64%	0.641	S	S	*	*			trans	-58.5	112.5	-165.7	52.6	0	0	0	0	113.4	N933 S937	N933-S935 PolarHBondContact O-N 2.63Å; S935-S937 PolarHBondContact O-N 2.8Å
936	S	35.1	Very low	45.7	Very low	104 Å²	104	110.8 Å²	110.8	73%	0.727	65%	0.646	S	S	*	*			trans	-80.8	104.6	173.8	54.8	0	0	0	0	111	P934 S938	P934-S936 PolarHBondContact O-N 3.23Å; P934-S936 VanDerWaalsContact O-N 3.15Å; S936-S938 PolarHBondContact O-N 3.36Å
937	S	33.2	Very low	43.9	Very low	125 Å²	125	117 Å²	117	87%	0.874	68%	0.681	S	S	*	*	S	Bend	trans	-77.3	50.1	176.1	62.6	0	0	0	0	113.3	S935	S935-S937 PolarHBondContact O-N 2.8Å
938	S	28.5	Very low	41.9	Very low	80 Å²	80	122.5 Å²	122.5	56%	0.559	71%	0.709	S	S	*	*			trans	-168.5	132	164.7	52.8	0	0	0	0	111.7	S936 G940	S936-S938 PolarHBondContact O-N 3.36Å; S938-G940 PolarHBondContact O-N 3.27Å
939	P	31.5	Very low	39.9	Very low	147 Å²	147	125.7 Å²	125.7	96%	0.955	72%	0.715	S	S	*	*			trans	-80.1	58	164.9	34.1	-33.8	0	0	0	110.1
940	G	28.9	Very low	37.9	Very low	52 Å²	52	130.2 Å²	130.2	54%	0.536	74%	0.735	S	S	.	*			trans	-95.2	102.4	-177.9	0	0	0	0	0	112.2	S938	S938-G940 PolarHBondContact O-N 3.27Å
941	T	26.8	Very low	36.9	Very low	119 Å²	119	122 Å²	122	73%	0.73	72%	0.722	S	S	*	*			trans	51.8	103.6	164.3	-31.6	0	0	0	0	116.4	T943	T941-T943 HydrophobicContact CG2-CG2 3.69Å; T941-T943 PolarHBondContact O-N 3.39Å
942	R	28.9	Very low	35.5	Very low	252 Å²	252	116.4 Å²	116.4	95%	0.951	71%	0.71	S	S	*	*			trans	-64.5	125.5	154.1	-81.2	-176.3	176.3	170.4	-0.6	108.6
943	T	32.8	Very low	34.2	Very low	141 Å²	141	120.1 Å²	120.1	87%	0.865	73%	0.732	S	S	*	*			trans	-129.5	0	162.3	67.9	0	0	0	0	107.4	Y881 T941	Y881-T943 WeakPolarHBondContact OH-CA 3.48Å; Y881-T943 PolarHBondContact OH-OXT 2.62Å; T941-T943 HydrophobicContact CG2-CG2 3.69Å; T941-T943 PolarHBondContact O-N 3.39Å

Retrieved 943 of 943 residues in 273.1 ms (Link to these results)

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