A0A5K4F8T2_SCHMA Loading...

Transient-receptor-potential-like protein

AlphaFold DB , UniProt , Accession A0A5K4F8T2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,201 aa.

						>A0A5K4F8T2_SCHMA|A0A5K4F8T2
MDPFNIDSYKLKRSLSTNNLEQFHGHSVFTEKRKYSKNSRSLHKRPFNTSLIQLGKNKSMNGCELRPIHDLLNEIKNNNMNNTTHNTTTISNNTTNNNDSNNNHLFKPNTNVDLNNIELPIIEDELTDIERLFLYAAEQGDLGTIKQLTDQVNELKLNLNCTDTLGRDVLRIAIENEHMELLQFLVALPQLDLKDCILHAINEDNVIAVEIILHAQTERGSKKNLRGLLGRFQSSSFTPDINGIILAAHRDNYVILKLLLDRGDRIYKPHDLRCACNICTKARRENGLQHSTLRINTYRALTSPSFIILTSNDPILTAFELSWELKKLGELENEFRTEYEELEAKCQKFATEMLAQTRSSSELSIVLNHYTGADVSGCHVSGINQSLSEDISERMQLSRLKLAIRYGQKQFVAHPHCQQLLAAIWYEGLPGFRQKPFVAHAHCQRLLAAIWYEGLPGFRQKPVFAQLTTIGTLCSLFPLLATFYMLAPHSKLGSMMRKPFIKFLCHSSSYLSFLALLTLAATRVEFLLTNSLDQRMHDRGPTPSLTESALVIYVIGFVWQQMKKLYIWGLRAYLTDMWNLVDFVMNALYIATISLRTVAWARIVFYNEPRYINRGQWDSFDPVLVSECLFAAANIVSTLKLVYVFTVSPQLGPLQISLGRMLHDIFRFFCVYFLVLVAFAFGFNQLYWFYAKNRARNCKNVHFTLEEGQKDVYDYCITRGTYFTNLFEIVQSLYWSAYGLIDLTSLNLEYPHAFTEFVGKLTFGTYSYIAFIVLLNMLIAMMNNSYEQIVGQVDIEWKFARSKLWISYFGEGCTVPVPFNIIPTPKAFMYMLNTIKNLFLNCSNKKQLHRNDWETIRLRIKQVKECEARYQNVMRELTKRYLMQKLRSSENDIVTADDLSEIKGDISAFRHELLDILKSNGMKIPAYHKTVSKLRRGREAYQLSEIQEMVRGKKSRESIKRTNISINENKSTQSKPLFSDIKQPVHRKITTSTGINKSDFNKTLLPSSTSIGGIIGPVDNPAFENEEVIVNKTSISSSVDLDGKKQGKSTTVLDQKTSVSDVTSQQLNPNFIPCTSAVVCEETITNNTDQNTVEKQLQQSKLKQPPSQLSIETKTPSMNIIKNDKMPNLKNSTFTNETRSQTVKQDHADKIESVENEATSQLFSDRKSTDHKTIEHCKLNKISHHPMDECSQMKNQRSDLV
					

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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	32.3	Very low	30.8	Very low	238 Å²	238	161.6 Å²	161.6	100%	1.172	81%	0.81	S	S	*	*				0	159.7	0	-79.1	177.6	166.1	0	0	108
2	D	36.3	Very low	30.5	Very low	157 Å²	157	165.3 Å²	165.3	84%	0.84	82%	0.817	S	S	*	*			trans	57.8	101.1	-170.4	-62.1	-1.1	0	0	0	114.7
3	P	35.1	Very low	30.2	Very low	113 Å²	113	171.5 Å²	171.5	73%	0.734	83%	0.826	S	S	*	*			trans	-91.6	138.8	177.4	35	-30.8	0	0	0	111.5
4	F	36.6	Very low	30	Very low	222 Å²	222	167.8 Å²	167.8	97%	0.974	83%	0.827	S	S	*	*			trans	-122.7	130.4	150.6	-95.1	-85.5	0	0	0	108.9
5	N	28.4	Very low	29.8	Very low	132 Å²	132	167.6 Å²	167.6	71%	0.706	83%	0.829	S	S	*	*			trans	-131.3	167	-164.3	-166.4	16.3	0	0	0	109
6	I	30.6	Very low	29.6	Very low	125 Å²	125	164.7 Å²	164.7	64%	0.641	83%	0.83	S	S	*	*			trans	76.4	93.4	161.5	-72.5	156.9	0	0	0	116.8
7	D	27.9	Very low	29.7	Very low	136 Å²	136	161.5 Å²	161.5	73%	0.727	82%	0.821	S	S	*	*				82.2	129.6	116.5	-56.7	-10.1	0	0	0	124.4
8	S	27.7	Very low	29.8	Very low	79 Å²	79	160.3 Å²	160.3	55%	0.552	82%	0.817	S	S	*	*			trans	69.5	128.6	135.4	-177.1	0	0	0	0	120.1
9	Y	30.1	Very low	29.8	Very low	213 Å²	213	160 Å²	160	84%	0.835	82%	0.818	S	S	*	*				174.9	103.2	108.1	-89.8	-67.7	0	0	0	107.7
10	K	27.6	Very low	29.7	Very low	191 Å²	191	158.5 Å²	158.5	83%	0.83	81%	0.811	S	S	*	*				63.8	112.7	77.7	-141.4	173.9	-165.9	174.3	0	113.8
11	L	26.4	Very low	29.6	Very low	172 Å²	172	157.9 Å²	157.9	90%	0.901	80%	0.804	S	S	*	*			trans	-47.6	130.9	-178.3	-160	89.3	0	0	0	115
12	K	26.7	Very low	29.4	Very low	206 Å²	206	152.8 Å²	152.8	90%	0.896	78%	0.778	S	S	*	*			trans	-166.7	142.5	144.3	-115.6	171.3	-174.5	-178.4	0	114.7
13	R	26.6	Very low	29.1	Very low	245 Å²	245	155.3 Å²	155.3	93%	0.925	78%	0.782	S	S	*	*			trans	-79.2	140.2	169	-67	169.9	169	159.8	-5.3	111.1
14	S	27.1	Very low	28.8	Very low	120 Å²	120	157.3 Å²	157.3	84%	0.839	78%	0.781	S	S	*	*			trans	-176	147.7	130	52	0	0	0	0	111.5
15	L	28.2	Very low	28.6	Very low	165 Å²	165	150.3 Å²	150.3	86%	0.864	77%	0.772	S	S	*	*			trans	-84.9	150.8	173.1	-68.9	75.9	0	0	0	111
16	S	26.5	Very low	28.7	Very low	121 Å²	121	151.4 Å²	151.4	85%	0.846	77%	0.772	S	S	*	*			trans	-145.7	118.3	137.1	56.6	0	0	0	0	112.8
17	T	31.1	Very low	28.6	Very low	110 Å²	110	149.5 Å²	149.5	68%	0.675	77%	0.77	S	S	*	*			trans	-63.5	160.2	153.5	48.1	0	0	0	0	110.2
18	N	31.2	Very low	28.7	Very low	140 Å²	140	148.9 Å²	148.9	75%	0.749	77%	0.771	S	S	*	*			cis	-158.8	159.1	-3.9	-110.1	-6.5	0	0	0	107
19	N	30.1	Very low	28.8	Very low	155 Å²	155	154.8 Å²	154.8	83%	0.829	79%	0.787	S	S	*	*			trans	-146.1	142.2	142	-111.5	-34	0	0	0	111.1
20	L	27.6	Very low	28.7	Very low	130 Å²	130	150.3 Å²	150.3	68%	0.681	78%	0.782	S	S	*	*			trans	-34.8	133.8	-173.6	-88.9	62.3	0	0	0	115.5
21	E	28.1	Very low	28.7	Very low	145 Å²	145	148.6 Å²	148.6	68%	0.678	78%	0.777	S	S	*	*				61.5	136.8	86.6	-62.3	-166.3	126.7	0	0	113.5
22	Q	27.7	Very low	28.7	Very low	132 Å²	132	149.4 Å²	149.4	62%	0.617	77%	0.773	S	S	*	*			cis	-159.6	153.7	-4.2	-112	177.3	39.4	0	0	106.3
23	F	29.6	Very low	28.9	Very low	210 Å²	210	149.6 Å²	149.6	92%	0.921	77%	0.768	S	S	*	*			trans	-174.4	143.1	132.7	-105.9	-66.9	0	0	0	111.8
24	H	29.2	Very low	28.8	Very low	154 Å²	154	147.5 Å²	147.5	71%	0.713	77%	0.766	S	S	*	*			trans	-76.3	155.8	-171.1	-82.1	-127.6	0	0	0	114.6
25	G	31.9	Very low	29	Very low	76 Å²	76	152.6 Å²	152.6	78%	0.784	77%	0.768	S	S	*	*			trans	-150.5	-4.9	-178.6	0	0	0	0	0	119.2
26	H	30.7	Very low	29.1	Very low	154 Å²	154	149.7 Å²	149.7	71%	0.713	76%	0.761	S	S	*	*			trans	55.7	124.7	161.6	-92.5	-88.3	0	0	0	123
27	S	28.9	Very low	29.1	Very low	86 Å²	86	153.4 Å²	153.4	60%	0.601	76%	0.763	S	S	*	*			trans	38.3	119.8	138.2	55.9	0	0	0	0	119.8
28	V	30.2	Very low	28.9	Very low	122 Å²	122	155.2 Å²	155.2	74%	0.739	77%	0.768	S	S	*	*			cis	54.6	116.8	43.2	-171.5	0	0	0	0	114.2	T30	V28-T30 HydrophobicContact CG1-CG2 4.34Å
29	F	29.2	Very low	28.7	Very low	204 Å²	204	152.6 Å²	152.6	90%	0.895	76%	0.76	S	S	*	*			trans	-137.8	118	160.3	-125.2	-88.6	0	0	0	110.5
30	T	27.4	Very low	28.5	Very low	118 Å²	118	155.8 Å²	155.8	72%	0.724	76%	0.761	S	S	*	*			trans	-102.9	102	179.7	42.7	0	0	0	0	110.6	V28 K32	V28-T30 HydrophobicContact CG1-CG2 4.34Å; T30-K32 PolarHBondContact O-N 2.64Å
31	E	29.1	Very low	28.4	Very low	155 Å²	155	154 Å²	154	72%	0.724	76%	0.76	S	S	*	*			trans	-89.7	92.5	-176.6	-158	-176.5	155.1	0	0	113.8	R33	E31-R33 IonicContact OE1-NH2 2.71Å
32	K	26	Very low	28.3	Very low	189 Å²	189	154 Å²	154	82%	0.822	76%	0.764	S	S	*	*			trans	-18.1	119.7	150.7	-61.6	160.7	177.4	169.7	0	116.5	T30	T30-K32 PolarHBondContact O-N 2.64Å
33	R	30.3	Very low	28.3	Very low	211 Å²	211	156.3 Å²	156.3	80%	0.796	77%	0.774	S	S	*	*			trans	-157.7	114.7	144.4	-95.6	159.2	-142.4	-146.9	7.2	105.6	E31	E31-R33 IonicContact OE1-NH2 2.71Å
34	K	25.2	Very low	28.1	Very low	200 Å²	200	154.4 Å²	154.4	87%	0.87	77%	0.765	S	S	*	*			cis	73.8	53.6	36.4	-122.1	-164.1	-168.2	-169.2	0	115
35	Y	31	Very low	28.1	Very low	228 Å²	228	158.1 Å²	158.1	89%	0.894	77%	0.773	S	S	*	*			trans	-144.5	154	140.5	-84.2	-86	0	0	0	107.1
36	S	29.2	Very low	28.1	Very low	103 Å²	103	159.5 Å²	159.5	72%	0.72	77%	0.768	S	S	*	*			cis	-161.4	155.3	-36.4	-175.7	0	0	0	0	106.9	N38	S36-N38 PolarHBondContact O-N 3.02Å
37	K	26.5	Very low	27.9	Very low	200 Å²	200	161.3 Å²	161.3	87%	0.87	77%	0.774	S	S	*	*			trans	-71.7	117.1	175.9	-71.8	178.3	177.1	178.6	0	110.4
38	N	27.5	Very low	27.8	Very low	147 Å²	147	163 Å²	163	79%	0.786	78%	0.776	S	S	*	*			trans	-136	111.3	153.3	-100.5	-19.4	0	0	0	105.8	S36	S36-N38 PolarHBondContact O-N 3.02Å
39	S	26.2	Very low	27.6	Very low	85 Å²	85	163.8 Å²	163.8	59%	0.594	78%	0.782	S	S	*	*				77.5	125.8	88.1	78.9	0	0	0	0	111.1
40	R	27.8	Very low	27.6	Very low	222 Å²	222	159 Å²	159	84%	0.838	77%	0.773	S	S	*	*			cis	-153.5	134.6	10.1	-101.1	145.2	-176.7	178.5	1.4	107.4
41	S	24.3	Very low	27.5	Very low	94 Å²	94	160.6 Å²	160.6	66%	0.657	78%	0.777	S	S	*	*				41.6	121.2	96.8	77.2	0	0	0	0	116.8
42	L	25.7	Very low	27.5	Very low	145 Å²	145	159.8 Å²	159.8	76%	0.759	78%	0.776	S	S	*	*			trans	15.5	109.4	152.9	-74.2	70.8	0	0	0	118.6
43	H	27.6	Very low	27.5	Very low	180 Å²	180	158.5 Å²	158.5	83%	0.833	77%	0.773	S	S	*	*			trans	-151.4	118.4	135.9	-99.1	-85.6	0	0	0	105.5
44	K	25.2	Very low	27.3	Very low	169 Å²	169	156.6 Å²	156.6	74%	0.735	78%	0.778	S	S	*	*			cis	69.7	77	24.8	-129.6	-173.1	-167.3	-176	0	114.1
45	R	29.2	Very low	27.6	Very low	233 Å²	233	150.4 Å²	150.4	88%	0.879	77%	0.77	S	S	*	*			trans	64.2	175.4	154.8	-66.1	-175	176.2	-173.6	-1.8	116.2
46	P	33.2	Very low	27.4	Very low	104 Å²	104	149 Å²	149	68%	0.675	77%	0.769	S	S	*	*			cis	-117.6	169.1	-19.6	36.4	-24.2	0	0	0	112.6
47	F	27.2	Very low	27.6	Very low	192 Å²	192	151.3 Å²	151.3	84%	0.842	77%	0.773	S	S	*	*			trans	-149.7	126.4	132.2	-109.3	-69.6	0	0	0	111.9
48	N	26.8	Very low	27.6	Very low	121 Å²	121	151 Å²	151	65%	0.647	77%	0.772	S	S	*	*			trans	37.9	94.7	164.9	-62.6	-0.1	0	0	0	119.8	S50	N48-S50 PolarHBondContact O-N 3.08Å
49	T	24.5	Very low	27.6	Very low	140 Å²	140	149.4 Å²	149.4	86%	0.859	77%	0.772	S	S	*	*				-55.2	108.5	127.2	-43.4	0	0	0	0	108.8	L51	T49-L51 HydrophobicContact CG2-CB 4.34Å
50	S	29.8	Very low	27.7	Very low	102 Å²	102	153.1 Å²	153.1	71%	0.713	78%	0.782	S	S	*	*			trans	-117.2	61.4	168.3	63	0	0	0	0	110.7	N48 I52	N48-S50 PolarHBondContact O-N 3.08Å; S50-I52 PolarHBondContact O-N 3.32Å; S50-I52 VanDerWaalsContact O-N 3.14Å
51	L	25.6	Very low	27.7	Very low	152 Å²	152	149.3 Å²	149.3	80%	0.796	78%	0.778	S	S	*	*			trans	-71.4	95.9	166.2	-170.4	-179.1	0	0	0	107.5	T49	T49-L51 HydrophobicContact CG2-CB 4.34Å
52	I	27.8	Very low	27.8	Very low	138 Å²	138	148.2 Å²	148.2	71%	0.708	78%	0.782	S	S	*	*			trans	-169.5	127	163.8	-106.1	151.1	0	0	0	111	S50	S50-I52 PolarHBondContact O-N 3.32Å; S50-I52 VanDerWaalsContact O-N 3.14Å
53	Q	27.8	Very low	27.9	Very low	162 Å²	162	146.4 Å²	146.4	76%	0.757	78%	0.78	S	S	*	*			trans	54.8	113.3	148.3	-59.8	-177.3	-18.4	0	0	119.2
54	L	25.4	Very low	27.9	Very low	172 Å²	172	145.6 Å²	145.6	90%	0.901	78%	0.777	S	S	*	*				70.2	117.7	82.4	-72.7	170.3	0	0	0	114.7
55	G	31.6	Very low	28	Very low	69 Å²	69	144.2 Å²	144.2	71%	0.711	78%	0.777	S	S	*	*			trans	140.7	76.2	174.6	0	0	0	0	0	112.1
56	K	27.4	Very low	28.1	Very low	198 Å²	198	142 Å²	142	86%	0.861	77%	0.769	S	S	*	*				43	95.2	90.6	-68	-174.6	178.1	177.5	0	114.2
57	N	31.8	Very low	28.3	Very low	152 Å²	152	142.7 Å²	142.7	81%	0.813	77%	0.773	S	S	*	*				-167.9	123.8	105.7	-82.6	-28.4	0	0	0	107.9
58	K	27.3	Very low	28.6	Very low	194 Å²	194	137.5 Å²	137.5	84%	0.843	75%	0.753	S	S	*	*				67.2	135.2	60.1	-106.1	-165.5	177.7	-169.5	0	114.4
59	S	27.9	Very low	28.8	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	75%	0.753	S	S	*	*			trans	71	143.9	-176.6	81.6	0	0	0	0	114.3
60	M	28.8	Very low	29.3	Very low	162 Å²	162	137.9 Å²	137.9	80%	0.798	75%	0.745	S	S	*	*			cis	-148.7	158.7	-0.5	-149.1	155.3	171.3	0	0	113.2
61	N	26.7	Very low	29.6	Very low	142 Å²	142	139 Å²	139	76%	0.759	74%	0.742	S	S	*	*			trans	-28.6	147.8	159.5	-35	-14.6	0	0	0	113
62	G	26.3	Very low	30.1	Very low	71 Å²	71	136.7 Å²	136.7	73%	0.732	73%	0.73	S	S	*	*			cis	119.2	110.3	17	0	0	0	0	0	110.2
63	C	27.8	Very low	30.4	Very low	107 Å²	107	134.1 Å²	134.1	72%	0.723	72%	0.718	S	S	*	*			trans	-154.8	119.8	170.5	-95.3	0	0	0	0	106.2
64	E	28	Very low	30.7	Very low	163 Å²	163	132.9 Å²	132.9	76%	0.762	71%	0.712	S	S	*	*				76.2	106.5	100.5	-69.4	172.2	153	0	0	113.4
65	L	27.8	Very low	31.3	Very low	141 Å²	141	131 Å²	131	74%	0.738	70%	0.701	S	S	*	*				67.8	89.2	84.3	-81.8	153.1	0	0	0	113.8
66	R	30.7	Very low	31.4	Very low	187 Å²	187	135.9 Å²	135.9	71%	0.706	70%	0.703	S	S	*	*				46	142.3	129.3	-79.2	160.5	143.9	-163	-1.6	119.5	I68	R66-I68 HydrophobicContact CB-CG1 3.88Å; R66-I68 HydrophobicContact CG-CG1 4.08Å
67	P	37.8	Very low	31.9	Very low	118 Å²	118	132.3 Å²	132.3	77%	0.766	69%	0.693	S	S	*	*				-92.7	128.7	117	-24.9	36.9	0	0	0	112.5
68	I	32.2	Very low	32.3	Very low	82 Å²	82	131 Å²	131	42%	0.421	69%	0.687	S	S	.	*			trans	-82.8	-7	174.2	-64.4	168.9	0	0	0	111.1	R66 D70 L72	R66-I68 HydrophobicContact CB-CG1 3.88Å; R66-I68 HydrophobicContact CG-CG1 4.08Å; I68-D70 PolarHBondContact O-N 3.27Å; I68-L72 HydrophobicContact CG2-CD1 3.6Å; I68-L72 HydrophobicContact CG2-CG 3.96Å
69	H	31.8	Very low	32.5	Very low	141 Å²	141	126.8 Å²	126.8	65%	0.653	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-28.6	-150.5	-151.8	-82.2	0	0	0	115.4	N73	H69-N73 PolarHBondContact O-ND2 3.16Å
70	D	35.4	Very low	32.6	Very low	128 Å²	128	130 Å²	130	68%	0.684	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-42	-176.6	-57.5	-38.1	0	0	0	112	I68 L72 N73	I68-D70 PolarHBondContact O-N 3.27Å; D70-L72 PolarHBondContact O-N 3.16Å; D70-N73 PolarHBondContact O-N 2.75Å
71	L	36	Very low	32.9	Very low	126 Å²	126	127.9 Å²	127.9	66%	0.66	67%	0.67	S	S	*	*	H	α-helix	trans	-68.5	-14.1	-179.2	-83.3	165	0	0	0	114.7	I75	L71-I75 WeakPolarHBondContact O-CD1 3.38Å; L71-I75 WeakPolarHBondContact O-CG1 3.15Å
72	L	35.3	Very low	33.1	Very low	103 Å²	103	127.3 Å²	127.3	54%	0.539	67%	0.667	S	S	.	*	H	α-helix	trans	-86.6	-20.3	173.3	-82.2	-177.5	0	0	0	114.3	I68 D70 K76	I68-L72 HydrophobicContact CG2-CD1 3.6Å; I68-L72 HydrophobicContact CG2-CG 3.96Å; D70-L72 PolarHBondContact O-N 3.16Å; L72-K76 WeakPolarHBondContact O-CB 3.12Å; L72-K76 PolarHBondContact O-N 3.5Å
73	N	34.1	Very low	33.3	Very low	84 Å²	84	129.1 Å²	129.1	45%	0.449	66%	0.664	S	S	.	*	H	α-helix	trans	-80.7	-34.4	176.6	-73.4	-35.8	0	0	0	111.7	H69 D70 I75 K76 N77	H69-N73 PolarHBondContact O-ND2 3.16Å; D70-N73 PolarHBondContact O-N 2.75Å; N73-I75 VanDerWaalsContact C-N 3.35Å; N73-I75 PolarHBondContact O-N 3.11Å; N73-K76 PolarHBondContact O-N 3.44Å; N73-N77 PolarHBondContact O-N 2.77Å
74	E	35.6	Very low	33.5	Very low	136 Å²	136	129.5 Å²	129.5	64%	0.636	66%	0.663	S	S	*	*	H	α-helix	trans	-70.1	-30.4	178.9	-160.4	166.9	-143.3	0	0	112.8	N78	E74-N78 PolarHBondContact O-ND2 3.36Å
75	I	38	Very low	33.9	Very low	132 Å²	132	129 Å²	129	68%	0.677	66%	0.66	S	S	*	*	H	α-helix	trans	-75.6	-27.8	172.5	-64.5	174.4	0	0	0	111.6	L71 N73	L71-I75 WeakPolarHBondContact O-CD1 3.38Å; L71-I75 WeakPolarHBondContact O-CG1 3.15Å; N73-I75 VanDerWaalsContact C-N 3.35Å; N73-I75 PolarHBondContact O-N 3.11Å
76	K	33.8	Very low	34.2	Very low	172 Å²	172	128.3 Å²	128.3	75%	0.748	66%	0.657	S	S	*	*	H	α-helix	trans	-89.9	-23.5	-175.5	-154.4	173.6	-173.6	-177.9	0	114.1	L72 N73	L72-K76 WeakPolarHBondContact O-CB 3.12Å; L72-K76 PolarHBondContact O-N 3.5Å; N73-K76 PolarHBondContact O-N 3.44Å
77	N	36.3	Very low	34.4	Very low	123 Å²	123	125.3 Å²	125.3	66%	0.658	66%	0.66	S	S	*	*	S	Bend	trans	-89.6	2.5	177.9	-72.3	-8.8	0	0	0	114.2	N73 N79	N73-N77 PolarHBondContact O-N 2.77Å; N77-N79 VanDerWaalsContact C-N 3.29Å; N77-N79 PolarHBondContact O-N 2.87Å
78	N	39.9	Very low	34.2	Very low	126 Å²	126	125.8 Å²	125.8	67%	0.674	66%	0.661	S	S	*	*	S	Bend	trans	-90	63.7	170	-82.8	-73.8	0	0	0	111.6	E74	E74-N78 PolarHBondContact O-ND2 3.36Å
79	N	33.4	Very low	34.2	Very low	105 Å²	105	127.8 Å²	127.8	56%	0.561	68%	0.677	S	S	*	*			trans	37	123	148	-54.9	-45.2	0	0	0	118.3	N77 N81	N77-N79 VanDerWaalsContact C-N 3.29Å; N77-N79 PolarHBondContact O-N 2.87Å; N79-N81 VanDerWaalsContact C-N 3.35Å; N79-N81 HydrophobicContact CB-CB 4.49Å
80	M	28.5	Very low	34.3	Very low	182 Å²	182	129 Å²	129	90%	0.897	69%	0.687	S	S	*	*			cis	48.6	41.9	18.6	-77.8	-146.1	164.6	0	0	115.9
81	N	34.9	Very low	34.1	Very low	116 Å²	116	127.2 Å²	127.2	62%	0.62	68%	0.684	S	S	*	*			trans	-115.6	113.8	142.1	-72.1	-51.6	0	0	0	105.6	N79	N79-N81 VanDerWaalsContact C-N 3.35Å; N79-N81 HydrophobicContact CB-CB 4.49Å
82	N	31	Very low	34.1	Very low	131 Å²	131	127.4 Å²	127.4	70%	0.701	69%	0.686	S	S	*	*				64.3	120.7	73.3	-65.3	-22.7	0	0	0	112.6
83	T	31.9	Very low	34	Very low	109 Å²	109	129.1 Å²	129.1	67%	0.669	70%	0.695	S	S	*	*			cis	-170	154.6	-13.9	-3	0	0	0	0	109.3
84	T	31.3	Very low	34	Very low	114 Å²	114	130.5 Å²	130.5	70%	0.699	71%	0.707	S	S	*	*			trans	61.6	141.5	161.8	53.9	0	0	0	0	117.8
85	H	35.8	Very low	33.7	Very low	154 Å²	154	129.4 Å²	129.4	71%	0.713	71%	0.71	S	S	*	*			cis	-154.4	150.9	42.4	-101.2	-77.3	0	0	0	115
86	N	35.3	Very low	33.4	Very low	126 Å²	126	129.2 Å²	129.2	67%	0.674	71%	0.71	S	S	*	*			trans	73.2	107.8	143.2	-61	1.3	0	0	0	123.8
87	T	34.2	Very low	33.3	Very low	124 Å²	124	127.1 Å²	127.1	76%	0.761	71%	0.707	S	S	*	*				58.5	140.2	127.8	59.1	0	0	0	0	121.7
88	T	34	Very low	33.3	Very low	127 Å²	127	127.7 Å²	127.7	78%	0.779	71%	0.71	S	S	*	*			cis	-156.5	173	8.5	-3.5	0	0	0	0	113.3
89	T	31.2	Very low	33	Very low	125 Å²	125	127.8 Å²	127.8	77%	0.767	71%	0.711	S	S	*	*			trans	-60.4	166	173.5	41.9	0	0	0	0	114.1
90	I	34.6	Very low	33	Very low	167 Å²	167	126.8 Å²	126.8	86%	0.856	71%	0.712	S	S	*	*				-154.6	159.8	62.1	-76.7	168.2	0	0	0	111.8
91	S	31.6	Very low	33.2	Very low	89 Å²	89	124.5 Å²	124.5	62%	0.622	70%	0.703	S	S	*	*			trans	-121.7	161.9	-176.4	59.3	0	0	0	0	114.2
92	N	35	Very low	33.1	Very low	131 Å²	131	125.1 Å²	125.1	70%	0.701	71%	0.706	S	S	*	*			trans	150.3	132.3	130.2	-75.3	-7.7	0	0	0	114.6
93	N	33	Very low	33.2	Very low	139 Å²	139	125.4 Å²	125.4	74%	0.743	71%	0.708	S	S	*	*			trans	64.7	150.5	141.6	-60.2	-3.9	0	0	0	119.5
94	T	33.9	Very low	33.4	Very low	113 Å²	113	129.8 Å²	129.8	69%	0.693	72%	0.72	S	S	*	*			cis	-157.4	139.5	-1.1	2.1	0	0	0	0	111.9
95	T	29.7	Very low	33.2	Very low	112 Å²	112	130.8 Å²	130.8	69%	0.687	72%	0.721	S	S	*	*			trans	29.6	142.9	139.6	58.9	0	0	0	0	124.3
96	N	32.1	Very low	33.2	Very low	129 Å²	129	133 Å²	133	69%	0.69	73%	0.729	S	S	*	*			trans	104.5	106.1	139.8	-70.9	-4.9	0	0	0	121.8
97	N	31.3	Very low	32.9	Very low	128 Å²	128	135.6 Å²	135.6	68%	0.684	73%	0.734	S	S	*	*				97.8	149.3	114.7	-70.8	7	0	0	0	122.8
98	N	36.1	Very low	32.8	Very low	134 Å²	134	134.7 Å²	134.7	72%	0.717	73%	0.73	S	S	*	*			trans	74.9	137.9	163.3	-62.7	10.3	0	0	0	118
99	D	34.3	Very low	32.5	Very low	129 Å²	129	135.3 Å²	135.3	69%	0.69	73%	0.729	S	S	*	*			cis	-163	146.8	-15.6	-123.4	-36.5	0	0	0	115.6
100	S	32.8	Very low	32.6	Very low	83 Å²	83	135 Å²	135	58%	0.58	73%	0.727	S	S	*	*			trans	68.1	149.6	142.9	80.6	0	0	0	0	123.9
101	N	34.2	Very low	32.2	Very low	134 Å²	134	134.4 Å²	134.4	72%	0.717	73%	0.725	S	S	*	*			trans	73.8	139.2	149.7	-61.2	-41.9	0	0	0	120.9
102	N	31.6	Very low	32.4	Very low	129 Å²	129	136 Å²	136	69%	0.69	73%	0.731	S	S	*	*			cis	-166.1	167.3	-26	-128.1	-24.1	0	0	0	112.3
103	N	32.9	Very low	32.3	Very low	137 Å²	137	136.6 Å²	136.6	73%	0.733	73%	0.734	S	S	*	*			trans	63.2	99.9	159	-58.2	-22.3	0	0	0	120.8
104	H	35.8	Very low	32.5	Very low	201 Å²	201	136.3 Å²	136.3	93%	0.931	73%	0.732	S	S	*	*				-155	121.9	123.7	-123.4	-81.4	0	0	0	111.5
105	L	28.7	Very low	32.6	Very low	136 Å²	136	137.6 Å²	137.6	71%	0.712	74%	0.735	S	S	*	*			trans	-146.8	123.9	179.2	176.4	74.4	0	0	0	108.5
106	F	34.5	Very low	33.2	Very low	200 Å²	200	139.9 Å²	139.9	88%	0.877	74%	0.743	S	S	*	*			trans	-171.7	153.6	130.1	-103.2	-68.5	0	0	0	110.8
107	K	30.1	Very low	33.5	Very low	181 Å²	181	140 Å²	140	79%	0.787	74%	0.742	S	S	*	*			trans	-103.6	179	-172.5	-98.3	179.7	179.7	-179.1	0	109.9
108	P	32.3	Very low	33.7	Very low	104 Å²	104	143.2 Å²	143.2	68%	0.675	75%	0.753	S	S	*	*			cis	-143.3	170.7	23.1	43.6	-25	0	0	0	118.7	T110	P108-T110 HydrophobicContact CG-CG2 4.47Å
109	N	26.7	Very low	33.5	Very low	141 Å²	141	142.7 Å²	142.7	75%	0.754	75%	0.749	S	S	*	*			trans	-69.6	146.9	156.1	-56.4	19.8	0	0	0	109.7
110	T	32.8	Very low	33.3	Very low	117 Å²	117	142.6 Å²	142.6	72%	0.718	76%	0.756	S	S	*	*			trans	-132	104	165.6	53.7	0	0	0	0	110.8	P108	P108-T110 HydrophobicContact CG-CG2 4.47Å
111	N	27.5	Very low	33.4	Very low	156 Å²	156	144.9 Å²	144.9	83%	0.834	76%	0.76	S	S	*	*			trans	-70.9	136.8	166.5	-60.2	6.4	0	0	0	108.4
112	V	35.2	Very low	33.5	Very low	123 Å²	123	145 Å²	145	75%	0.745	76%	0.759	S	S	*	*			trans	-113.3	107.4	170.8	179.4	0	0	0	0	108.1	L114	V112-L114 HydrophobicContact CG1-CD1 4.31Å
113	D	33.6	Very low	34.2	Very low	143 Å²	143	146.4 Å²	146.4	77%	0.765	76%	0.762	S	S	*	*			trans	-84.1	119.6	-174.1	-169.4	-1.8	0	0	0	111.3
114	L	35.5	Very low	35.2	Very low	132 Å²	132	146.5 Å²	146.5	69%	0.691	76%	0.762	S	S	*	*			trans	-139.7	76.2	-177.3	-86	169.8	0	0	0	111.6	V112	V112-L114 HydrophobicContact CG1-CD1 4.31Å
115	N	36.6	Very low	36.4	Very low	140 Å²	140	145.8 Å²	145.8	75%	0.749	76%	0.759	S	S	*	*	S	Bend	trans	63.2	54.9	162.5	-63.5	-51	0	0	0	116.9	I117	N115-I117 PolarHBondContact O-N 2.8Å
116	N	42.3	Very low	38.5	Very low	160 Å²	160	141 Å²	141	86%	0.856	73%	0.734	S	S	*	*	S	Bend	trans	57.6	35.2	160.5	-60.8	6.8	0	0	0	116.4
117	I	39.8	Very low	40.7	Very low	131 Å²	131	134.6 Å²	134.6	67%	0.672	71%	0.712	S	S	*	*			trans	-118.5	102	168	-50.5	-178.8	0	0	0	109	N115 L119	N115-I117 PolarHBondContact O-N 2.8Å; I117-L119 VanDerWaalsContact C-N 3.31Å; I117-L119 HydrophobicContact CG2-CD2 4.46Å; I117-L119 HydrophobicContact CG2-CG 3.96Å; I117-L119 PolarHBondContact O-N 3.08Å
118	E	33.8	Very low	43.1	Very low	197 Å²	197	130 Å²	130	92%	0.921	70%	0.696	S	S	*	*			trans	-72.1	88.1	166.7	-68.7	-179.6	166.8	0	0	108.9	P120	E118-P120 WeakPolarHBondContact O-CD 3.3Å
119	L	32.4	Very low	45.5	Very low	123 Å²	123	127.7 Å²	127.7	64%	0.644	68%	0.677	S	S	*	*			trans	-80.1	120.7	165.3	-78.5	169.2	0	0	0	108.6	I117 I121	I117-L119 VanDerWaalsContact C-N 3.31Å; I117-L119 HydrophobicContact CG2-CD2 4.46Å; I117-L119 HydrophobicContact CG2-CG 3.96Å; I117-L119 PolarHBondContact O-N 3.08Å; L119-I121 HydrophobicContact CB-CD1 4.08Å; L119-I121 HydrophobicContact CB-CG1 4.14Å; L119-I121 HydrophobicContact CD1-CD1 4.11Å; L119-I121 PolarHBondContact O-N 2.82Å
120	P	29.5	Very low	48.3	Very low	127 Å²	127	122.1 Å²	122.1	83%	0.825	65%	0.647	S	S	*	*			trans	-76.4	66.7	173	33	-35.2	0	0	0	110.2	E118 I122	E118-P120 WeakPolarHBondContact O-CD 3.3Å; P120-I122 VanDerWaalsContact C-N 3.35Å; P120-I122 PolarHBondContact O-N 2.82Å
121	I	34.9	Very low	50.8	Low	130 Å²	130	121.4 Å²	121.4	67%	0.667	63%	0.631	S	S	*	*			trans	-97.1	73.8	168.4	-56.6	167.4	0	0	0	106.9	L119	L119-I121 HydrophobicContact CB-CD1 4.08Å; L119-I121 HydrophobicContact CB-CG1 4.14Å; L119-I121 HydrophobicContact CD1-CD1 4.11Å; L119-I121 PolarHBondContact O-N 2.82Å
122	I	37.2	Very low	53.6	Low	137 Å²	137	116.3 Å²	116.3	70%	0.703	60%	0.603	S	S	*	*			trans	-122.3	73.5	157.9	-51.7	179.6	0	0	0	105.3	P120 D124	P120-I122 VanDerWaalsContact C-N 3.35Å; P120-I122 PolarHBondContact O-N 2.82Å; I122-D124 VanDerWaalsContact C-N 3.31Å; I122-D124 WeakPolarHBondContact CG2-OD1 2.99Å; I122-D124 PolarHBondContact O-N 3.19Å
123	E	46	Very low	56.2	Low	158 Å²	158	110.5 Å²	110.5	74%	0.738	57%	0.568	S	S	*	*			trans	-67.7	102.2	148.3	-71.1	176.9	-170.8	0	0	104.7	E125	E123-E125 PolarHBondContact O-N 3.44Å
124	D	53.7	Low	58.8	Low	139 Å²	139	104.1 Å²	104.1	74%	0.743	53%	0.534	S	S	*	.			trans	-53.3	130.4	175.3	-77.8	-50.4	0	0	0	108.7	I122 L126	I122-D124 VanDerWaalsContact C-N 3.31Å; I122-D124 WeakPolarHBondContact CG2-OD1 2.99Å; I122-D124 PolarHBondContact O-N 3.19Å; D124-L126 PolarHBondContact O-N 3.25Å
125	E	62.4	Low	61.3	Low	187 Å²	187	100.4 Å²	100.4	87%	0.874	51%	0.511	S	S	*	.			trans	-62.2	97.7	-178	-77.6	-163.7	144.4	0	0	109.8	E123 T127	E123-E125 PolarHBondContact O-N 3.44Å; E125-T127 PolarHBondContact O-N 3.26Å
126	L	71.8	Confident	63.7	Low	34 Å²	34	93.9 Å²	93.9	18%	0.178	48%	0.477	C	S	.	.			trans	-42.1	115.7	-176.6	-169.4	77.6	0	0	0	109.7	D124 E130 R131 L134 C161	D124-L126 PolarHBondContact O-N 3.25Å; L126-E130 HydrophobicContact CD1-CB 3.55Å; L126-E130 HydrophobicContact CD1-CG 4.4Å; L126-E130 HydrophobicContact CG-CB 3.74Å; L126-R131 HydrophobicContact CD2-CB 4.03Å; L126-R131 HydrophobicContact CG-CB 4.48Å; L126-R131 PolarHBondContact O-NH1 3.11Å; L126-R131 PolarHBondContact O-NH2 3.4Å; L126-L134 HydrophobicContact CD1-CD1 4.45Å; L126-L134 HydrophobicContact CD2-CD1 3.97Å; L126-C161 HydrophobicContact CD1-CB 3.94Å
127	T	80	Confident	65.9	Low	66 Å²	66	86.3 Å²	86.3	41%	0.405	44%	0.436	S	S	.	.			trans	-63.3	157.3	-170.4	61.3	0	0	0	0	110.2	E125 I129 E130 R131	E125-T127 PolarHBondContact O-N 3.26Å; T127-I129 PolarHBondContact O-N 2.91Å; T127-E130 VanDerWaalsContact CB-OE2 3.28Å; T127-E130 WeakPolarHBondContact CB-OE2 3.48Å; T127-E130 WeakPolarHBondContact CG2-OE2 3.25Å; T127-E130 PolarHBondContact N-OE2 2.75Å; T127-E130 PolarHBondContact O-N 3.13Å; T127-E130 VanDerWaalsContact OG1-CD 3.23Å; T127-E130 WeakPolarHBondContact OG1-CG 3.44Å; T127-E130 PolarHBondContact OG1-N 3.22Å; T127-E130 PolarHBondContact OG1-OE2 3.21Å; T127-R131 WeakPolarHBondContact O-CB 3.44Å; T127-R131 PolarHBondContact O-N 2.83Å
128	D	80.7	Confident	68.2	Low	85 Å²	85	83 Å²	83	46%	0.455	42%	0.418	S	S	.	.	H	α-helix	trans	-62.1	-14.8	178.1	-96.2	-3.7	0	0	0	113.7	R131 L132 R936	D128-R131 IonicContact OD1-CZ 2.73Å; D128-R131 IonicContact OD1-NH1 3.93Å; D128-R131 PolarHBondContact OD1-NH1 3.3Å; D128-L132 VanDerWaalsContact O-CB 3.26Å; D128-L132 WeakPolarHBondContact O-CB 3.44Å; D128-L132 PolarHBondContact O-N 2.99Å; D128-R936 IonicContact OD2-CZ 3.27Å; D128-R936 IonicContact OD2-NE 2.62Å; D128-R936 IonicContact OD2-NH2 3.66Å; D128-R936 PolarHBondContact OD2-NH2 3.5Å
129	I	83.1	Confident	70.6	Confident	55 Å²	55	74.7 Å²	74.7	28%	0.282	38%	0.379	S	S	.	.	H	α-helix	trans	-83.6	-44.8	173.1	-54	168.9	0	0	0	110.3	T127 L132 F133 L148 L155 L157	T127-I129 PolarHBondContact O-N 2.91Å; I129-L132 WeakPolarHBondContact O-CB 3.49Å; I129-L132 PolarHBondContact O-N 3.26Å; I129-F133 WeakPolarHBondContact O-CB 3.38Å; I129-F133 PolarHBondContact O-N 2.91Å; I129-L148 HydrophobicContact CG2-CD2 4.1Å; I129-L155 HydrophobicContact CD1-CB 4.26Å; I129-L155 HydrophobicContact CD1-CD2 4.15Å; I129-L155 HydrophobicContact CG2-CB 4.3Å; I129-L155 HydrophobicContact CG2-CD1 4.1Å; I129-L157 HydrophobicContact CG2-CD1 4.36Å
130	E	85.3	Confident	73.1	Confident	25 Å²	25	69.2 Å²	69.2	12%	0.117	35%	0.352	C	S	.	.	H	α-helix	trans	-66.9	-42.1	175	-70.2	157.7	144.3	0	0	111.8	L126 T127 L132 F133 L134 L157 N158 C161	L126-E130 HydrophobicContact CD1-CB 3.55Å; L126-E130 HydrophobicContact CD1-CG 4.4Å; L126-E130 HydrophobicContact CG-CB 3.74Å; T127-E130 VanDerWaalsContact CB-OE2 3.28Å; T127-E130 WeakPolarHBondContact CB-OE2 3.48Å; T127-E130 WeakPolarHBondContact CG2-OE2 3.25Å; T127-E130 PolarHBondContact N-OE2 2.75Å; T127-E130 PolarHBondContact O-N 3.13Å; T127-E130 VanDerWaalsContact OG1-CD 3.23Å; T127-E130 WeakPolarHBondContact OG1-CG 3.44Å; T127-E130 PolarHBondContact OG1-N 3.22Å; T127-E130 PolarHBondContact OG1-OE2 3.21Å; E130-L132 PolarHBondContact O-N 2.98Å; E130-F133 WeakPolarHBondContact O-CB 3.22Å; E130-F133 PolarHBondContact O-N 2.8Å; E130-F133 VanDerWaalsContact O-N 3.13Å; E130-L134 WeakPolarHBondContact O-CG 3.26Å; E130-L134 PolarHBondContact O-N 3.46Å; E130-L157 HydrophobicContact CB-CD1 4.29Å; E130-L157 HydrophobicContact CG-CD1 3.51Å; E130-N158 VanDerWaalsContact OE1-CB 3.32Å; E130-N158 WeakPolarHBondContact OE1-CB 3.36Å; E130-C161 HydrophobicContact CB-CB 4.41Å; E130-C161 HydrophobicContact CG-CB 4.21Å
131	R	85.9	Confident	75.9	Confident	101 Å²	101	64.1 Å²	64.1	38%	0.381	32%	0.318	S	S	.	.	H	α-helix	trans	-58.7	-36.3	171.3	-176.2	179.8	-69.5	92.1	17.5	111.4	L126 T127 D128 Y135	L126-R131 HydrophobicContact CD2-CB 4.03Å; L126-R131 HydrophobicContact CG-CB 4.48Å; L126-R131 PolarHBondContact O-NH1 3.11Å; L126-R131 PolarHBondContact O-NH2 3.4Å; T127-R131 WeakPolarHBondContact O-CB 3.44Å; T127-R131 PolarHBondContact O-N 2.83Å; D128-R131 IonicContact OD1-CZ 2.73Å; D128-R131 IonicContact OD1-NH1 3.93Å; D128-R131 PolarHBondContact OD1-NH1 3.3Å; R131-Y135 WeakPolarHBondContact O-CB 3.49Å; R131-Y135 PolarHBondContact O-N 2.75Å; R131-Y135 VanDerWaalsContact O-N 3.08Å
132	L	86.6	Confident	78.4	Confident	50 Å²	50	59.3 Å²	59.3	26%	0.262	29%	0.293	S	S	.	.	H	α-helix	trans	-71.5	-41.7	173.7	176.7	61.9	0	0	0	112.1	D128 I129 E130 Y135 A136 L148 H928	D128-L132 VanDerWaalsContact O-CB 3.26Å; D128-L132 WeakPolarHBondContact O-CB 3.44Å; D128-L132 PolarHBondContact O-N 2.99Å; I129-L132 WeakPolarHBondContact O-CB 3.49Å; I129-L132 PolarHBondContact O-N 3.26Å; E130-L132 PolarHBondContact O-N 2.98Å; L132-Y135 PolarHBondContact O-N 3.42Å; L132-A136 WeakPolarHBondContact O-CB 2.91Å; L132-A136 PolarHBondContact O-N 3.24Å; L132-L148 HydrophobicContact CG-CD1 4.3Å; L132-H928 WeakPolarHBondContact CD1-NE2 3.3Å
133	F	88.8	Confident	80.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.3	-49.4	177.4	175.7	-110.2	0	0	0	111.8	I129 E130 A136 A137 I145 L148 L157 L159 V169 L185	I129-F133 WeakPolarHBondContact O-CB 3.38Å; I129-F133 PolarHBondContact O-N 2.91Å; E130-F133 WeakPolarHBondContact O-CB 3.22Å; E130-F133 PolarHBondContact O-N 2.8Å; E130-F133 VanDerWaalsContact O-N 3.13Å; F133-A136 PolarHBondContact O-N 2.76Å; F133-A137 PolarHBondContact O-N 3.47Å; F133-I145 HydrophobicContact CE2-CG2 4.1Å; F133-L148 HydrophobicContact CB-CD1 4.03Å; F133-L148 HydrophobicContact CD2-CB 4.35Å; F133-L148 HydrophobicContact CD2-CD1 4.24Å; F133-L157 HydrophobicContact CB-CD1 4.11Å; F133-L157 HydrophobicContact CB-CD2 4.32Å; F133-L157 HydrophobicContact CD1-CD1 4.36Å; F133-L157 HydrophobicContact CD2-CD2 3.91Å; F133-L157 HydrophobicContact CE2-CD2 4.37Å; F133-L157 HydrophobicContact CG-CD1 4.23Å; F133-L157 HydrophobicContact CG-CD2 4.1Å; F133-L159 HydrophobicContact CE1-CD2 4.23Å; F133-L159 HydrophobicContact CE2-CD2 3.79Å; F133-L159 HydrophobicContact CZ-CD2 3.53Å; F133-V169 HydrophobicContact CD1-CG2 4.33Å; F133-V169 HydrophobicContact CE1-CB 3.76Å; F133-V169 HydrophobicContact CE1-CG1 3.87Å; F133-V169 HydrophobicContact CE1-CG2 3.68Å; F133-V169 HydrophobicContact CZ-CB 4.22Å; F133-V169 HydrophobicContact CZ-CG1 4.03Å; F133-V169 HydrophobicContact CZ-CG2 3.86Å; F133-L185 HydrophobicContact CZ-CD2 4.35Å
134	L	88.7	Confident	82.6	Confident	10 Å²	10	46.8 Å²	46.8	5%	0.052	24%	0.237	C	C	.	.	H	α-helix	trans	-66.9	-35.8	175.9	-60.4	-173.9	0	0	0	112.3	L126 E130 A137 E138 D163 V169 I172	L126-L134 HydrophobicContact CD1-CD1 4.45Å; L126-L134 HydrophobicContact CD2-CD1 3.97Å; E130-L134 WeakPolarHBondContact O-CG 3.26Å; E130-L134 PolarHBondContact O-N 3.46Å; L134-A137 PolarHBondContact O-N 2.82Å; L134-E138 PolarHBondContact O-N 2.73Å; L134-D163 HydrophobicContact CD1-CB 4.09Å; L134-V169 HydrophobicContact CD2-CB 3.85Å; L134-V169 HydrophobicContact CD2-CG2 4.19Å; L134-I172 HydrophobicContact CB-CD1 4.32Å; L134-I172 HydrophobicContact CD2-CD1 4.19Å
135	Y	87.4	Confident	84.3	Confident	53 Å²	53	40.1 Å²	40.1	21%	0.208	20%	0.201	C	C	.	.	H	α-helix	trans	-67.7	-40	174.5	179.8	-115.4	0	0	0	112.6	R131 L132 A137 E138 Q139 V931	R131-Y135 WeakPolarHBondContact O-CB 3.49Å; R131-Y135 PolarHBondContact O-N 2.75Å; R131-Y135 VanDerWaalsContact O-N 3.08Å; L132-Y135 PolarHBondContact O-N 3.42Å; Y135-A137 PolarHBondContact O-N 3.42Å; Y135-E138 VanDerWaalsContact CD2-OE2 3.3Å; Y135-E138 WeakPolarHBondContact CD2-OE2 3.17Å; Y135-E138 PolarHBondContact O-N 2.84Å; Y135-Q139 HydrophobicContact CD1-CG 4.46Å; Y135-Q139 HydrophobicContact CD2-CG 4.08Å; Y135-Q139 HydrophobicContact CE1-CG 3.97Å; Y135-Q139 HydrophobicContact CE2-CG 3.52Å; Y135-Q139 VanDerWaalsContact CZ-CG 3.44Å; Y135-Q139 WeakPolarHBondContact O-CB 3.31Å; Y135-Q139 VanDerWaalsContact O-CG 3.24Å; Y135-Q139 WeakPolarHBondContact O-CG 3.22Å; Y135-Q139 PolarHBondContact O-N 2.88Å; Y135-Q139 VanDerWaalsContact O-N 3.08Å; Y135-Q139 PolarHBondContact OH-OE1 2.75Å; Y135-V931 HydrophobicContact CE1-CG1 3.96Å; Y135-V931 WeakPolarHBondContact OH-CG1 3.49Å
136	A	87.5	Confident	85.5	Confident	4 Å²	4	35.3 Å²	35.3	3%	0.033	18%	0.177	C	C	.	.	H	α-helix	trans	-60.9	-38	173.4	0	0	0	0	0	110.6	L132 F133 Q139 G140 D141 T144 I145	L132-A136 WeakPolarHBondContact O-CB 2.91Å; L132-A136 PolarHBondContact O-N 3.24Å; F133-A136 PolarHBondContact O-N 2.76Å; A136-Q139 CarbonylContact O-C 3.59Å; A136-Q139 PolarHBondContact O-N 2.62Å; A136-G140 PolarHBondContact O-N 3.03Å; A136-D141 HydrophobicContact CB-CB 4.19Å; A136-D141 PolarHBondContact O-N 2.94Å; A136-T144 HydrophobicContact CB-CG2 4.15Å; A136-I145 HydrophobicContact CB-CD1 4.04Å; A136-I145 HydrophobicContact CB-CG1 3.67Å
137	A	89.2	Confident	86.1	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-69.1	-40.8	176.5	0	0	0	0	0	112.9	F133 L134 Y135 Q139 G140 I145 V169 I172 H178 L181	F133-A137 PolarHBondContact O-N 3.47Å; L134-A137 PolarHBondContact O-N 2.82Å; Y135-A137 PolarHBondContact O-N 3.42Å; A137-Q139 PolarHBondContact O-N 2.79Å; A137-G140 PolarHBondContact O-N 2.73Å; A137-I145 HydrophobicContact CB-CD1 4.07Å; A137-V169 HydrophobicContact CB-CG2 3.59Å; A137-I172 HydrophobicContact CB-CG2 4.25Å; A137-H178 PolarHBondContact O-CD2 2.78Å; A137-H178 PolarHBondContact O-NE2 3.36Å; A137-L181 HydrophobicContact CB-CD2 4Å
138	E	86.7	Confident	86.4	Confident	61 Å²	61	35.9 Å²	35.9	29%	0.285	18%	0.175	S	C	.	.	H	α-helix	trans	-56.3	-34.9	170.4	-174.6	-171.2	-171.6	0	0	111.5	L134 Y135 I172 H178 R935	L134-E138 PolarHBondContact O-N 2.73Å; Y135-E138 VanDerWaalsContact CD2-OE2 3.3Å; Y135-E138 WeakPolarHBondContact CD2-OE2 3.17Å; Y135-E138 PolarHBondContact O-N 2.84Å; E138-I172 HydrophobicContact CB-CG2 4.32Å; E138-H178 PolarHBondContact O-NE2 3.36Å; E138-R935 IonicContact OE2-NH1 2.83Å; E138-R935 PolarHBondContact OE2-NH1 3.31Å
139	Q	85.1	Confident	86.7	Confident	24 Å²	24	32.6 Å²	32.6	11%	0.112	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-5.5	-175.2	-66.4	-60.6	-87.6	0	0	115.5	Y135 A136 A137 D141 S907 H911	Y135-Q139 HydrophobicContact CD1-CG 4.46Å; Y135-Q139 HydrophobicContact CD2-CG 4.08Å; Y135-Q139 HydrophobicContact CE1-CG 3.97Å; Y135-Q139 HydrophobicContact CE2-CG 3.52Å; Y135-Q139 VanDerWaalsContact CZ-CG 3.44Å; Y135-Q139 WeakPolarHBondContact O-CB 3.31Å; Y135-Q139 VanDerWaalsContact O-CG 3.24Å; Y135-Q139 WeakPolarHBondContact O-CG 3.22Å; Y135-Q139 PolarHBondContact O-N 2.88Å; Y135-Q139 VanDerWaalsContact O-N 3.08Å; Y135-Q139 PolarHBondContact OH-OE1 2.75Å; A136-Q139 CarbonylContact O-C 3.59Å; A136-Q139 PolarHBondContact O-N 2.62Å; A137-Q139 PolarHBondContact O-N 2.79Å; Q139-D141 VanDerWaalsContact C-N 3.32Å; Q139-S907 CarbonylContact O-C 3.54Å; Q139-S907 WeakPolarHBondContact O-CB 3.1Å; Q139-H911 PolarHBondContact O-CE1 3.11Å; Q139-H911 VanDerWaalsContact O-CE1 3.26Å; Q139-H911 PolarHBondContact O-ND1 2.73Å
140	G	85.2	Confident	86.8	Confident	7 Å²	7	36.3 Å²	36.3	7%	0.072	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	23.6	-174.7	0	0	0	0	0	114.4	A136 A137 L142 H178	A136-G140 PolarHBondContact O-N 3.03Å; A137-G140 PolarHBondContact O-N 2.73Å; G140-L142 VanDerWaalsContact C-N 3.31Å; G140-L142 PolarHBondContact O-N 2.9Å; G140-H178 VanDerWaalsContact CA-CE1 3.45Å; G140-H178 WeakPolarHBondContact CA-CE1 3.48Å; G140-H178 PolarHBondContact N-CE1 3.33Å; G140-H178 PolarHBondContact N-NE2 2.73Å
141	D	88.5	Confident	86.7	Confident	21 Å²	21	39 Å²	39	11%	0.112	19%	0.191	C	C	.	.			trans	-80.8	76.7	-178.9	-172.8	-10.8	0	0	0	111.4	A136 Q139 G143 T144 I145 H911	A136-D141 HydrophobicContact CB-CB 4.19Å; A136-D141 PolarHBondContact O-N 2.94Å; Q139-D141 VanDerWaalsContact C-N 3.32Å; D141-G143 PolarHBondContact O-N 3.14Å; D141-G143 PolarHBondContact OD1-N 3.42Å; D141-T144 VanDerWaalsContact CG-CB 3.41Å; D141-T144 PolarHBondContact O-N 2.87Å; D141-T144 WeakPolarHBondContact OD1-CB 3.42Å; D141-T144 PolarHBondContact OD1-N 2.96Å; D141-T144 PolarHBondContact OD1-OG1 3.28Å; D141-T144 VanDerWaalsContact OD2-CB 3.26Å; D141-T144 WeakPolarHBondContact OD2-CB 3.15Å; D141-T144 PolarHBondContact OD2-OG1 2.79Å; D141-I145 WeakPolarHBondContact O-CD1 3.31Å; D141-I145 VanDerWaalsContact O-CG1 3.27Å; D141-I145 WeakPolarHBondContact O-CG1 3.27Å; D141-I145 PolarHBondContact O-N 3.49Å; D141-H911 HydrophobicContact CB-CB 4.35Å
142	L	87.7	Confident	86.4	Confident	28 Å²	28	34.9 Å²	34.9	15%	0.147	18%	0.177	C	C	.	.	H	α-helix	trans	-58.5	-29.9	177.9	-176.6	59.7	0	0	0	113.1	G140 K146 E180 L181 F184	G140-L142 VanDerWaalsContact C-N 3.31Å; G140-L142 PolarHBondContact O-N 2.9Å; L142-K146 HydrophobicContact CD1-CD 4.36Å; L142-K146 HydrophobicContact CD1-CG 4.48Å; L142-K146 HydrophobicContact CG-CD 4.17Å; L142-K146 WeakPolarHBondContact O-CB 3.25Å; L142-K146 WeakPolarHBondContact O-CD 3.27Å; L142-K146 VanDerWaalsContact O-CG 3.29Å; L142-K146 WeakPolarHBondContact O-CG 3.49Å; L142-K146 PolarHBondContact O-N 3.38Å; L142-E180 HydrophobicContact CD2-CB 4.13Å; L142-L181 HydrophobicContact CD1-CD1 4.16Å; L142-F184 HydrophobicContact CD1-CB 3.81Å; L142-F184 HydrophobicContact CD1-CD1 4.12Å; L142-F184 HydrophobicContact CD1-CG 4.01Å
143	G	84.9	Confident	86	Confident	13 Å²	13	39.3 Å²	39.3	13%	0.134	20%	0.201	C	C	.	.	H	α-helix	trans	-70.8	-48.4	179.7	0	0	0	0	0	112.6	D141 I145 Q147 D915	D141-G143 PolarHBondContact O-N 3.14Å; D141-G143 PolarHBondContact OD1-N 3.42Å; G143-I145 VanDerWaalsContact C-N 3.35Å; G143-Q147 VanDerWaalsContact C-NE2 3.32Å; G143-Q147 PolarHBondContact O-N 2.82Å; G143-Q147 PolarHBondContact O-NE2 3.02Å; G143-D915 VanDerWaalsContact CA-OD2 3.32Å; G143-D915 WeakPolarHBondContact CA-OD2 3.22Å
144	T	85.6	Confident	85.6	Confident	19 Å²	19	46.1 Å²	46.1	12%	0.117	23%	0.233	C	C	.	.	H	α-helix	trans	-64.8	-39.2	174.1	-63.9	0	0	0	0	111	A136 D141 Q147 L148	A136-T144 HydrophobicContact CB-CG2 4.15Å; D141-T144 VanDerWaalsContact CG-CB 3.41Å; D141-T144 PolarHBondContact O-N 2.87Å; D141-T144 WeakPolarHBondContact OD1-CB 3.42Å; D141-T144 PolarHBondContact OD1-N 2.96Å; D141-T144 PolarHBondContact OD1-OG1 3.28Å; D141-T144 VanDerWaalsContact OD2-CB 3.26Å; D141-T144 WeakPolarHBondContact OD2-CB 3.15Å; D141-T144 PolarHBondContact OD2-OG1 2.79Å; T144-Q147 PolarHBondContact O-N 3.39Å; T144-L148 HydrophobicContact CG2-CD1 3.95Å; T144-L148 HydrophobicContact CG2-CG 4.35Å; T144-L148 WeakPolarHBondContact O-CG 3.48Å; T144-L148 PolarHBondContact O-N 2.94Å
145	I	89	Confident	84.9	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65.7	-42.3	179.1	-68.6	164.3	0	0	0	111.8	F133 A136 A137 D141 G143 Q147 L148 T149 L181 F184 L185	F133-I145 HydrophobicContact CE2-CG2 4.1Å; A136-I145 HydrophobicContact CB-CD1 4.04Å; A136-I145 HydrophobicContact CB-CG1 3.67Å; A137-I145 HydrophobicContact CB-CD1 4.07Å; D141-I145 WeakPolarHBondContact O-CD1 3.31Å; D141-I145 VanDerWaalsContact O-CG1 3.27Å; D141-I145 WeakPolarHBondContact O-CG1 3.27Å; D141-I145 PolarHBondContact O-N 3.49Å; G143-I145 VanDerWaalsContact C-N 3.35Å; I145-Q147 PolarHBondContact O-N 3.08Å; I145-L148 PolarHBondContact O-N 2.83Å; I145-T149 WeakPolarHBondContact O-CB 3.41Å; I145-T149 PolarHBondContact O-N 3.01Å; I145-T149 PolarHBondContact O-OG1 2.98Å; I145-T149 VanDerWaalsContact O-OG1 3.12Å; I145-L181 HydrophobicContact CB-CD1 4.31Å; I145-L181 HydrophobicContact CD1-CD1 3.41Å; I145-L181 VanDerWaalsContact CD1-CD1 3.41Å; I145-L181 HydrophobicContact CD1-CD2 3.63Å; I145-L181 HydrophobicContact CD1-CG 4.17Å; I145-L181 HydrophobicContact CG1-CD1 4.44Å; I145-L181 HydrophobicContact CG2-CD1 3.9Å; I145-F184 HydrophobicContact CG2-CD1 4.2Å; I145-F184 HydrophobicContact CG2-CE1 4.06Å; I145-L185 HydrophobicContact CG2-CD2 4.24Å
146	K	87.9	Confident	84.4	Confident	85 Å²	85	54.8 Å²	54.8	37%	0.37	27%	0.273	S	S	.	.	H	α-helix	trans	-56.2	-49.1	173	-78.8	165.3	179.2	167.2	0	111.7	L142 L148 T149 D150 F184	L142-K146 HydrophobicContact CD1-CD 4.36Å; L142-K146 HydrophobicContact CD1-CG 4.48Å; L142-K146 HydrophobicContact CG-CD 4.17Å; L142-K146 WeakPolarHBondContact O-CB 3.25Å; L142-K146 WeakPolarHBondContact O-CD 3.27Å; L142-K146 VanDerWaalsContact O-CG 3.29Å; L142-K146 WeakPolarHBondContact O-CG 3.49Å; L142-K146 PolarHBondContact O-N 3.38Å; K146-L148 PolarHBondContact O-N 2.87Å; K146-T149 PolarHBondContact O-N 3.3Å; K146-D150 VanDerWaalsContact O-CG 3.26Å; K146-D150 PolarHBondContact O-N 3.07Å; K146-F184 HydrophobicContact CB-CZ 4.34Å; K146-F184 HydrophobicContact CG-CD1 4.35Å; K146-F184 HydrophobicContact CG-CD2 4.25Å; K146-F184 HydrophobicContact CG-CE1 3.88Å; K146-F184 HydrophobicContact CG-CE2 3.78Å; K146-F184 HydrophobicContact CG-CZ 3.57Å
147	Q	85.4	Confident	84.1	Confident	98 Å²	98	55 Å²	55	46%	0.458	27%	0.274	S	S	.	.	H	α-helix	trans	-58.1	-44.6	176.3	-72.7	161	81.5	0	0	112.4	G143 T144 I145 Q151	G143-Q147 VanDerWaalsContact C-NE2 3.32Å; G143-Q147 PolarHBondContact O-N 2.82Å; G143-Q147 PolarHBondContact O-NE2 3.02Å; T144-Q147 PolarHBondContact O-N 3.39Å; I145-Q147 PolarHBondContact O-N 3.08Å; Q147-Q151 WeakPolarHBondContact O-CB 3.27Å; Q147-Q151 WeakPolarHBondContact O-CG 3.36Å; Q147-Q151 PolarHBondContact O-N 2.8Å
148	L	85.8	Confident	83.8	Confident	14 Å²	14	58.8 Å²	58.8	7%	0.073	29%	0.294	C	S	.	.	H	α-helix	trans	-66.7	-38.1	177.8	-69.9	172.9	0	0	0	112.5	I129 L132 F133 T144 I145 K146 Q151 V152 L155 L157	I129-L148 HydrophobicContact CG2-CD2 4.1Å; L132-L148 HydrophobicContact CG-CD1 4.3Å; F133-L148 HydrophobicContact CB-CD1 4.03Å; F133-L148 HydrophobicContact CD2-CB 4.35Å; F133-L148 HydrophobicContact CD2-CD1 4.24Å; T144-L148 HydrophobicContact CG2-CD1 3.95Å; T144-L148 HydrophobicContact CG2-CG 4.35Å; T144-L148 WeakPolarHBondContact O-CG 3.48Å; T144-L148 PolarHBondContact O-N 2.94Å; I145-L148 PolarHBondContact O-N 2.83Å; K146-L148 PolarHBondContact O-N 2.87Å; L148-Q151 CarbonylContact O-C 3.58Å; L148-Q151 PolarHBondContact O-N 2.82Å; L148-V152 PolarHBondContact O-N 2.74Å; L148-L155 HydrophobicContact CD2-CD1 3.72Å; L148-L157 HydrophobicContact CB-CD2 4.02Å
149	T	85.8	Confident	83.7	Confident	17 Å²	17	56.2 Å²	56.2	10%	0.104	28%	0.282	C	S	.	.	H	α-helix	trans	-66.5	-46.4	176	-67.7	0	0	0	0	112	I145 K146 Q151 V152 F184 L188	I145-T149 WeakPolarHBondContact O-CB 3.41Å; I145-T149 PolarHBondContact O-N 3.01Å; I145-T149 PolarHBondContact O-OG1 2.98Å; I145-T149 VanDerWaalsContact O-OG1 3.12Å; K146-T149 PolarHBondContact O-N 3.3Å; T149-Q151 PolarHBondContact O-N 3.32Å; T149-V152 WeakPolarHBondContact O-CB 3.46Å; T149-V152 VanDerWaalsContact O-CG2 3.24Å; T149-V152 WeakPolarHBondContact O-CG2 3.37Å; T149-V152 PolarHBondContact O-N 3.33Å; T149-F184 HydrophobicContact CG2-CE1 4.27Å; T149-F184 HydrophobicContact CG2-CZ 4.01Å; T149-L188 HydrophobicContact CG2-CD1 3.59Å; T149-L188 HydrophobicContact CG2-CD2 3.7Å; T149-L188 HydrophobicContact CG2-CG 4.3Å
150	D	85.3	Confident	83.6	Confident	132 Å²	132	57 Å²	57	71%	0.706	29%	0.287	S	S	*	.	H	α-helix	trans	-60.8	-31.2	177.4	-67.6	-25.7	0	0	0	111.5	K146	K146-D150 VanDerWaalsContact O-CG 3.26Å; K146-D150 PolarHBondContact O-N 3.07Å
151	Q	83.5	Confident	83.6	Confident	81 Å²	81	57 Å²	57	38%	0.379	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	11.3	179.5	-62.1	-167.1	-70.7	0	0	115.1	Q147 L148 T149 N153 E154 L155	Q147-Q151 WeakPolarHBondContact O-CB 3.27Å; Q147-Q151 WeakPolarHBondContact O-CG 3.36Å; Q147-Q151 PolarHBondContact O-N 2.8Å; L148-Q151 CarbonylContact O-C 3.58Å; L148-Q151 PolarHBondContact O-N 2.82Å; T149-Q151 PolarHBondContact O-N 3.32Å; Q151-N153 VanDerWaalsContact C-N 3.26Å; Q151-N153 PolarHBondContact O-N 3.23Å; Q151-N153 VanDerWaalsContact O-N 3.13Å; Q151-E154 PolarHBondContact NE2-OE2 2.8Å; Q151-E154 PolarHBondContact O-N 3.44Å; Q151-L155 HydrophobicContact CB-CD1 3.65Å; Q151-L155 HydrophobicContact CB-CG 3.88Å; Q151-L155 WeakPolarHBondContact O-CB 3.38Å; Q151-L155 WeakPolarHBondContact O-CG 3.3Å; Q151-L155 PolarHBondContact O-N 3.34Å
152	V	80.6	Confident	83.4	Confident	16 Å²	16	59 Å²	59	10%	0.097	30%	0.3	C	S	.	.	H	α-helix	trans	-50	-43.6	-177.5	158.9	0	0	0	0	113.3	L148 T149 E154 K156 L157 L159	L148-V152 PolarHBondContact O-N 2.74Å; T149-V152 WeakPolarHBondContact O-CB 3.46Å; T149-V152 VanDerWaalsContact O-CG2 3.24Å; T149-V152 WeakPolarHBondContact O-CG2 3.37Å; T149-V152 PolarHBondContact O-N 3.33Å; V152-E154 VanDerWaalsContact C-N 3.34Å; V152-E154 PolarHBondContact O-N 3.32Å; V152-K156 WeakPolarHBondContact O-CA 3.48Å; V152-K156 PolarHBondContact O-N 2.65Å; V152-L157 HydrophobicContact CG2-CB 4.32Å; V152-L157 HydrophobicContact CG2-CD2 4.23Å; V152-L157 HydrophobicContact CG2-CG 4.47Å; V152-L157 PolarHBondContact O-N 2.95Å; V152-L159 HydrophobicContact CG2-CD1 4.05Å; V152-L159 HydrophobicContact CG2-CD2 3.7Å; V152-L159 HydrophobicContact CG2-CG 3.87Å
153	N	77.7	Confident	83.2	Confident	143 Å²	143	59.4 Å²	59.4	77%	0.765	30%	0.301	S	S	*	.	H	α-helix	trans	-69.8	-29.1	-179.6	-65.8	-32.7	0	0	0	113.1	Q151	Q151-N153 VanDerWaalsContact C-N 3.26Å; Q151-N153 PolarHBondContact O-N 3.23Å; Q151-N153 VanDerWaalsContact O-N 3.13Å
154	E	79.3	Confident	83.1	Confident	143 Å²	143	64.2 Å²	64.2	67%	0.668	33%	0.329	S	S	*	.	H	α-helix	trans	-81.9	-43	179.3	-54.9	-172.9	146	0	0	111	Q151 V152	Q151-E154 PolarHBondContact NE2-OE2 2.8Å; Q151-E154 PolarHBondContact O-N 3.44Å; V152-E154 VanDerWaalsContact C-N 3.34Å; V152-E154 PolarHBondContact O-N 3.32Å
155	L	74.8	Confident	82.9	Confident	54 Å²	54	69.4 Å²	69.4	28%	0.283	36%	0.355	S	S	.	.	H	α-helix	trans	-84	-14.3	-175.6	-62.6	174.8	0	0	0	113.6	I129 L148 Q151 L157	I129-L155 HydrophobicContact CD1-CB 4.26Å; I129-L155 HydrophobicContact CD1-CD2 4.15Å; I129-L155 HydrophobicContact CG2-CB 4.3Å; I129-L155 HydrophobicContact CG2-CD1 4.1Å; L148-L155 HydrophobicContact CD2-CD1 3.72Å; Q151-L155 HydrophobicContact CB-CD1 3.65Å; Q151-L155 HydrophobicContact CB-CG 3.88Å; Q151-L155 WeakPolarHBondContact O-CB 3.38Å; Q151-L155 WeakPolarHBondContact O-CG 3.3Å; Q151-L155 PolarHBondContact O-N 3.34Å; L155-L157 HydrophobicContact CB-CB 4.37Å; L155-L157 PolarHBondContact O-N 3.33Å
156	K	77.2	Confident	82.5	Confident	190 Å²	190	71.5 Å²	71.5	83%	0.826	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	35.1	-170.3	-57.1	-177.5	-179.8	179.3	0	113.2	V152 N158	V152-K156 WeakPolarHBondContact O-CA 3.48Å; V152-K156 PolarHBondContact O-N 2.65Å; K156-N158 PolarHBondContact O-N 3.25Å
157	L	80.8	Confident	82.4	Confident	10 Å²	10	69.5 Å²	69.5	5%	0.052	37%	0.367	C	S	.	.			trans	-69.9	120.4	-178	171.4	58.2	0	0	0	111.1	I129 E130 F133 L148 V152 L155 L159	I129-L157 HydrophobicContact CG2-CD1 4.36Å; E130-L157 HydrophobicContact CB-CD1 4.29Å; E130-L157 HydrophobicContact CG-CD1 3.51Å; F133-L157 HydrophobicContact CB-CD1 4.11Å; F133-L157 HydrophobicContact CB-CD2 4.32Å; F133-L157 HydrophobicContact CD1-CD1 4.36Å; F133-L157 HydrophobicContact CD2-CD2 3.91Å; F133-L157 HydrophobicContact CE2-CD2 4.37Å; F133-L157 HydrophobicContact CG-CD1 4.23Å; F133-L157 HydrophobicContact CG-CD2 4.1Å; L148-L157 HydrophobicContact CB-CD2 4.02Å; V152-L157 HydrophobicContact CG2-CB 4.32Å; V152-L157 HydrophobicContact CG2-CD2 4.23Å; V152-L157 HydrophobicContact CG2-CG 4.47Å; V152-L157 PolarHBondContact O-N 2.95Å; L155-L157 HydrophobicContact CB-CB 4.37Å; L155-L157 PolarHBondContact O-N 3.33Å; L157-L159 HydrophobicContact CD2-CD2 4.09Å; L157-L159 HydrophobicContact CG-CD2 4.27Å; L157-L159 PolarHBondContact O-N 3.31Å
158	N	83.3	Confident	82.4	Confident	79 Å²	79	65.7 Å²	65.7	42%	0.422	35%	0.35	S	S	.	.			trans	-76.3	105.2	167.3	-178.6	10.3	0	0	0	109.9	E130 K156 N160 C161	E130-N158 VanDerWaalsContact OE1-CB 3.32Å; E130-N158 WeakPolarHBondContact OE1-CB 3.36Å; K156-N158 PolarHBondContact O-N 3.25Å; N158-N160 PolarHBondContact O-N 3.26Å; N158-N160 PolarHBondContact OD1-N 3.31Å; N158-C161 HydrophobicContact CB-CB 4.41Å; N158-C161 WeakPolarHBondContact O-CB 3.22Å; N158-C161 PolarHBondContact O-N 2.8Å; N158-C161 PolarHBondContact O-SG 3.33Å
159	L	83.8	Confident	82.7	Confident	6 Å²	6	65.1 Å²	65.1	3%	0.031	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-27.5	176.5	-66.3	176.9	0	0	0	112.9	F133 V152 L157 C161 Q190 L191	F133-L159 HydrophobicContact CE1-CD2 4.23Å; F133-L159 HydrophobicContact CE2-CD2 3.79Å; F133-L159 HydrophobicContact CZ-CD2 3.53Å; V152-L159 HydrophobicContact CG2-CD1 4.05Å; V152-L159 HydrophobicContact CG2-CD2 3.7Å; V152-L159 HydrophobicContact CG2-CG 3.87Å; L157-L159 HydrophobicContact CD2-CD2 4.09Å; L157-L159 HydrophobicContact CG-CD2 4.27Å; L157-L159 PolarHBondContact O-N 3.31Å; L159-C161 VanDerWaalsContact C-N 3.26Å; L159-C161 PolarHBondContact O-N 2.7Å; L159-Q190 HydrophobicContact CD1-CB 3.93Å; L159-Q190 VanDerWaalsContact CD1-OE1 3.3Å; L159-L191 HydrophobicContact CB-CD2 3.74Å; L159-L191 HydrophobicContact CB-CG 4.12Å; L159-L191 WeakPolarHBondContact O-CD2 3.46Å
160	N	83	Confident	82.8	Confident	41 Å²	41	64.4 Å²	64.4	22%	0.219	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	25	177.9	-64.1	-50.7	0	0	0	112.3	N158 Q190 L191 D192	N158-N160 PolarHBondContact O-N 3.26Å; N158-N160 PolarHBondContact OD1-N 3.31Å; N160-Q190 PolarHBondContact ND2-O 2.88Å; N160-L191 WeakPolarHBondContact OD1-CA 3.29Å; N160-L191 WeakPolarHBondContact OD1-CD2 3.11Å; N160-D192 PolarHBondContact OD1-N 3.4Å
161	C	86	Confident	83	Confident	6 Å²	6	60.7 Å²	60.7	4%	0.041	32%	0.318	C	S	.	.			trans	-69.4	147.8	174.3	61.2	0	0	0	0	112	L126 E130 N158 L159	L126-C161 HydrophobicContact CD1-CB 3.94Å; E130-C161 HydrophobicContact CB-CB 4.41Å; E130-C161 HydrophobicContact CG-CB 4.21Å; N158-C161 HydrophobicContact CB-CB 4.41Å; N158-C161 WeakPolarHBondContact O-CB 3.22Å; N158-C161 PolarHBondContact O-N 2.8Å; N158-C161 PolarHBondContact O-SG 3.33Å; L159-C161 VanDerWaalsContact C-N 3.26Å; L159-C161 PolarHBondContact O-N 2.7Å
162	T	84	Confident	83.3	Confident	65 Å²	65	57 Å²	57	40%	0.399	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	-108.1	143.1	176.7	49.8	0	0	0	0	111.7	R167 D168	T162-R167 WeakPolarHBondContact CA-O 3.1Å; T162-D168 VanDerWaalsContact CG2-OD1 3.28Å; T162-D168 WeakPolarHBondContact CG2-OD1 3.43Å
163	D	84	Confident	83.7	Confident	35 Å²	35	56.2 Å²	56.2	19%	0.187	30%	0.297	C	S	.	.			trans	-61.2	162.2	161.2	-177.3	15.8	0	0	0	110.8	L134 L165 G166 R167 I172	L134-D163 HydrophobicContact CD1-CB 4.09Å; D163-L165 PolarHBondContact O-N 3.23Å; D163-G166 PolarHBondContact O-N 3.21Å; D163-R167 HydrophobicContact CB-CB 4.29Å; D163-R167 PolarHBondContact N-O 2.83Å; D163-R167 IonicContact OD2-CZ 2.7Å; D163-R167 IonicContact OD2-NE 3.08Å; D163-R167 PolarHBondContact OD2-NE 2.92Å; D163-R167 IonicContact OD2-NH2 3.68Å; D163-R167 PolarHBondContact OD2-NH2 2.92Å; D163-I172 HydrophobicContact CB-CD1 4.46Å
164	T	81.8	Confident	84.3	Confident	115 Å²	115	49.5 Å²	49.5	71%	0.706	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-14	169.3	55.6	0	0	0	0	115
165	L	81.3	Confident	84.7	Confident	127 Å²	127	45.1 Å²	45.1	67%	0.665	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	7.8	173.6	-61.6	177.5	0	0	0	113.6	D163 R167	D163-L165 PolarHBondContact O-N 3.23Å; L165-R167 VanDerWaalsContact C-N 3.34Å; L165-R167 HydrophobicContact CB-CG 4.04Å
166	G	81.4	Confident	85.2	Confident	45 Å²	45	43.4 Å²	43.4	46%	0.464	23%	0.231	S	C	.	.	S	Bend	trans	70.8	25.8	-176.7	0	0	0	0	0	114.1	D163	D163-G166 PolarHBondContact O-N 3.21Å
167	R	85.4	Confident	85.6	Confident	42 Å²	42	36.9 Å²	36.9	16%	0.158	20%	0.204	C	C	.	.			trans	-99.8	121.8	-176.7	-57.7	-174.8	-65.8	163.7	0.8	111.7	T162 D163 L165 I172 E175	T162-R167 WeakPolarHBondContact CA-O 3.1Å; D163-R167 HydrophobicContact CB-CB 4.29Å; D163-R167 PolarHBondContact N-O 2.83Å; D163-R167 IonicContact OD2-CZ 2.7Å; D163-R167 IonicContact OD2-NE 3.08Å; D163-R167 PolarHBondContact OD2-NE 2.92Å; D163-R167 IonicContact OD2-NH2 3.68Å; D163-R167 PolarHBondContact OD2-NH2 2.92Å; L165-R167 VanDerWaalsContact C-N 3.34Å; L165-R167 HydrophobicContact CB-CG 4.04Å; R167-I172 HydrophobicContact CB-CD1 4.37Å; R167-I172 HydrophobicContact CB-CG1 4.01Å; R167-E175 WeakPolarHBondContact CD-OE2 3.46Å; R167-E175 IonicContact CZ-OE2 3.49Å; R167-E175 IonicContact NE-OE2 2.74Å; R167-E175 IonicContact NH1-OE2 3.32Å; R167-E175 PolarHBondContact NH1-OE2 3.13Å
168	D	86.5	Confident	86	Confident	19 Å²	19	36.9 Å²	36.9	10%	0.102	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-69.3	156.9	168.6	-70.1	-23.2	0	0	0	111.8	T162 L170 R171 I172 K194	T162-D168 VanDerWaalsContact CG2-OD1 3.28Å; T162-D168 WeakPolarHBondContact CG2-OD1 3.43Å; D168-L170 PolarHBondContact O-N 3.47Å; D168-R171 WeakPolarHBondContact O-CA 3.45Å; D168-R171 WeakPolarHBondContact O-CB 3.35Å; D168-R171 PolarHBondContact O-N 3.04Å; D168-I172 PolarHBondContact O-N 3.37Å; D168-K194 IonicContact OD1-NZ 3.46Å; D168-K194 PolarHBondContact OD1-NZ 3.24Å; D168-K194 VanDerWaalsContact OD2-CD 3.23Å; D168-K194 WeakPolarHBondContact OD2-CD 3.16Å; D168-K194 WeakPolarHBondContact OD2-CE 3.37Å; D168-K194 IonicContact OD2-NZ 3.44Å; D168-K194 PolarHBondContact OD2-NZ 3.2Å
169	V	90.3	Very high	86.2	Confident	1 Å²	1	35 Å²	35	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-55.2	-36.6	175.5	71.5	0	0	0	0	113.5	F133 L134 A137 R171 I172 A173 L185 L191	F133-V169 HydrophobicContact CD1-CG2 4.33Å; F133-V169 HydrophobicContact CE1-CB 3.76Å; F133-V169 HydrophobicContact CE1-CG1 3.87Å; F133-V169 HydrophobicContact CE1-CG2 3.68Å; F133-V169 HydrophobicContact CZ-CB 4.22Å; F133-V169 HydrophobicContact CZ-CG1 4.03Å; F133-V169 HydrophobicContact CZ-CG2 3.86Å; L134-V169 HydrophobicContact CD2-CB 3.85Å; L134-V169 HydrophobicContact CD2-CG2 4.19Å; A137-V169 HydrophobicContact CB-CG2 3.59Å; V169-R171 VanDerWaalsContact C-N 3.34Å; V169-R171 PolarHBondContact O-N 2.84Å; V169-I172 PolarHBondContact O-N 3.38Å; V169-A173 PolarHBondContact O-N 3.31Å; V169-L185 HydrophobicContact CG1-CD1 4.36Å; V169-L185 HydrophobicContact CG1-CD2 4.31Å; V169-L185 HydrophobicContact CG2-CD1 3.96Å; V169-L185 HydrophobicContact CG2-CD2 4.33Å; V169-L191 HydrophobicContact CG1-CD1 4.26Å; V169-L191 HydrophobicContact CG1-CD2 3.76Å
170	L	89.6	Confident	86.4	Confident	3 Å²	3	40.5 Å²	40.5	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-64.3	-39	175.4	-72.2	172.5	0	0	0	112	D168 A173 I174 L182 L185 V186 L193 C196	D168-L170 PolarHBondContact O-N 3.47Å; L170-A173 PolarHBondContact O-N 2.95Å; L170-I174 WeakPolarHBondContact O-CD1 3.45Å; L170-I174 VanDerWaalsContact O-CG1 3.28Å; L170-I174 WeakPolarHBondContact O-CG1 3.38Å; L170-I174 PolarHBondContact O-N 2.86Å; L170-I174 VanDerWaalsContact O-N 3.14Å; L170-L182 HydrophobicContact CD2-CD1 4.09Å; L170-L185 HydrophobicContact CD2-CB 3.64Å; L170-L185 HydrophobicContact CD2-CD1 4.34Å; L170-V186 HydrophobicContact CD2-CG2 3.71Å; L170-L193 HydrophobicContact CD1-CD2 3.87Å; L170-C196 HydrophobicContact CB-CB 4.18Å
171	R	89.1	Confident	86.7	Confident	53 Å²	53	38.8 Å²	38.8	20%	0.2	21%	0.209	C	C	.	.	H	α-helix	trans	-68.9	-39.9	177.3	179.2	175.5	165.5	155.3	9.8	111	D168 V169 A173 I174 E175 H199 S236	D168-R171 WeakPolarHBondContact O-CA 3.45Å; D168-R171 WeakPolarHBondContact O-CB 3.35Å; D168-R171 PolarHBondContact O-N 3.04Å; V169-R171 VanDerWaalsContact C-N 3.34Å; V169-R171 PolarHBondContact O-N 2.84Å; R171-A173 VanDerWaalsContact C-N 3.33Å; R171-A173 PolarHBondContact O-N 2.77Å; R171-I174 PolarHBondContact O-N 3.42Å; R171-E175 HydrophobicContact CG-CG 4.22Å; R171-E175 IonicContact CZ-OE1 3.65Å; R171-E175 VanDerWaalsContact CZ-OE1 3.27Å; R171-E175 IonicContact NE-OE1 3.85Å; R171-E175 PolarHBondContact NE-OE1 3.13Å; R171-E175 IonicContact NH2-OE1 2.66Å; R171-E175 PolarHBondContact NH2-OE1 3.08Å; R171-E175 WeakPolarHBondContact O-CB 3.26Å; R171-E175 WeakPolarHBondContact O-CG 3.49Å; R171-E175 PolarHBondContact O-N 2.63Å; R171-H199 PolarHBondContact NH1-CE1 3.25Å; R171-S236 PolarHBondContact NH1-OG 3.01Å
172	I	88.5	Confident	87	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.015	21%	0.207	C	C	.	.	H	α-helix	trans	-63	-39.3	174.7	-63.9	172.9	0	0	0	111.3	L134 A137 E138 D163 R167 D168 V169 I174 N176	L134-I172 HydrophobicContact CB-CD1 4.32Å; L134-I172 HydrophobicContact CD2-CD1 4.19Å; A137-I172 HydrophobicContact CB-CG2 4.25Å; E138-I172 HydrophobicContact CB-CG2 4.32Å; D163-I172 HydrophobicContact CB-CD1 4.46Å; R167-I172 HydrophobicContact CB-CD1 4.37Å; R167-I172 HydrophobicContact CB-CG1 4.01Å; D168-I172 PolarHBondContact O-N 3.37Å; V169-I172 PolarHBondContact O-N 3.38Å; I172-I174 VanDerWaalsContact C-N 3.33Å; I172-I174 PolarHBondContact O-N 2.96Å; I172-N176 PolarHBondContact O-N 2.89Å; I172-N176 PolarHBondContact O-ND2 2.83Å
173	A	90.6	Very high	87.3	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-65.8	-33.5	175.9	0	0	0	0	0	112.9	V169 L170 R171 E177 H178 L181 L182 L185	V169-A173 PolarHBondContact O-N 3.31Å; L170-A173 PolarHBondContact O-N 2.95Å; R171-A173 VanDerWaalsContact C-N 3.33Å; R171-A173 PolarHBondContact O-N 2.77Å; A173-E177 PolarHBondContact O-N 2.9Å; A173-H178 PolarHBondContact O-N 3.48Å; A173-L181 HydrophobicContact CB-CD2 4.27Å; A173-L181 HydrophobicContact CB-CG 4.29Å; A173-L182 HydrophobicContact CB-CB 4.43Å; A173-L182 HydrophobicContact CB-CD1 4.44Å; A173-L185 HydrophobicContact CB-CD1 4.03Å
174	I	90.3	Very high	87.6	Confident	2 Å²	2	42 Å²	42	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-73.9	-50.7	174.9	-66	159.4	0	0	0	111.1	L170 R171 I172 N176 E177 L182 C196 A200 E203 I212	L170-I174 WeakPolarHBondContact O-CD1 3.45Å; L170-I174 VanDerWaalsContact O-CG1 3.28Å; L170-I174 WeakPolarHBondContact O-CG1 3.38Å; L170-I174 PolarHBondContact O-N 2.86Å; L170-I174 VanDerWaalsContact O-N 3.14Å; R171-I174 PolarHBondContact O-N 3.42Å; I172-I174 VanDerWaalsContact C-N 3.33Å; I172-I174 PolarHBondContact O-N 2.96Å; I174-N176 PolarHBondContact O-N 3.13Å; I174-E177 PolarHBondContact O-N 2.93Å; I174-L182 HydrophobicContact CD1-CD1 4.4Å; I174-L182 HydrophobicContact CG1-CD1 3.98Å; I174-L182 HydrophobicContact CG1-CD2 4.18Å; I174-C196 HydrophobicContact CD1-CB 3.93Å; I174-C196 WeakPolarHBondContact CD1-O 3.28Å; I174-A200 HydrophobicContact CD1-CB 4.13Å; I174-A200 HydrophobicContact CG1-CB 4.49Å; I174-A200 HydrophobicContact CG2-CB 4.25Å; I174-E203 HydrophobicContact CG2-CB 4.48Å; I174-E203 HydrophobicContact CG2-CG 4.07Å; I174-I212 HydrophobicContact CD1-CD1 4Å
175	E	87.2	Confident	88	Confident	50 Å²	50	36.5 Å²	36.5	23%	0.234	18%	0.184	C	C	.	.	H	α-helix	trans	-60.8	-10.8	-179.5	-75.2	179.2	176	0	0	114.3	R167 R171	R167-E175 WeakPolarHBondContact CD-OE2 3.46Å; R167-E175 IonicContact CZ-OE2 3.49Å; R167-E175 IonicContact NE-OE2 2.74Å; R167-E175 IonicContact NH1-OE2 3.32Å; R167-E175 PolarHBondContact NH1-OE2 3.13Å; R171-E175 HydrophobicContact CG-CG 4.22Å; R171-E175 IonicContact CZ-OE1 3.65Å; R171-E175 VanDerWaalsContact CZ-OE1 3.27Å; R171-E175 IonicContact NE-OE1 3.85Å; R171-E175 PolarHBondContact NE-OE1 3.13Å; R171-E175 IonicContact NH2-OE1 2.66Å; R171-E175 PolarHBondContact NH2-OE1 3.08Å; R171-E175 WeakPolarHBondContact O-CB 3.26Å; R171-E175 WeakPolarHBondContact O-CG 3.49Å; R171-E175 PolarHBondContact O-N 2.63Å
176	N	85.9	Confident	88.3	Confident	18 Å²	18	30.6 Å²	30.6	10%	0.096	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.3	15.4	177.6	-61.8	-98	0	0	0	112.6	I172 I174 H178	I172-N176 PolarHBondContact O-N 2.89Å; I172-N176 PolarHBondContact O-ND2 2.83Å; I174-N176 PolarHBondContact O-N 3.13Å; N176-H178 VanDerWaalsContact CB-CD2 3.46Å; N176-H178 WeakPolarHBondContact CB-CD2 3.45Å; N176-H178 WeakPolarHBondContact CB-NE2 3.36Å; N176-H178 PolarHBondContact O-N 3.25Å; N176-H178 VanDerWaalsContact O-N 3.08Å
177	E	85.5	Confident	88.5	Confident	54 Å²	54	31.9 Å²	31.9	25%	0.252	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	22.3	175.4	-61.3	-95.8	124.8	0	0	115	A173 I174 M179 N205 E901	A173-E177 PolarHBondContact O-N 2.9Å; I174-E177 PolarHBondContact O-N 2.93Å; E177-M179 VanDerWaalsContact C-N 3.29Å; E177-M179 WeakPolarHBondContact O-CG 3.34Å; E177-M179 PolarHBondContact O-N 3.2Å; E177-N205 WeakPolarHBondContact OE1-CB 3.46Å; E177-N205 PolarHBondContact OE1-ND2 3.22Å; E177-N205 PolarHBondContact OE2-ND2 3.25Å; E177-E901 HydrophobicContact CB-CG 4.32Å; E177-E901 HydrophobicContact CG-CB 4.18Å; E177-E901 HydrophobicContact CG-CG 3.98Å
178	H	89.3	Confident	88.5	Confident	9 Å²	9	31.2 Å²	31.2	4%	0.042	16%	0.158	C	C	.	.			trans	-75.6	74	-174.4	-69.2	-57.6	0	0	0	112.1	A137 E138 G140 A173 N176 E180 L181 L182	A137-H178 PolarHBondContact O-CD2 2.78Å; A137-H178 PolarHBondContact O-NE2 3.36Å; E138-H178 PolarHBondContact O-NE2 3.36Å; G140-H178 VanDerWaalsContact CA-CE1 3.45Å; G140-H178 WeakPolarHBondContact CA-CE1 3.48Å; G140-H178 PolarHBondContact N-CE1 3.33Å; G140-H178 PolarHBondContact N-NE2 2.73Å; A173-H178 PolarHBondContact O-N 3.48Å; N176-H178 VanDerWaalsContact CB-CD2 3.46Å; N176-H178 WeakPolarHBondContact CB-CD2 3.45Å; N176-H178 WeakPolarHBondContact CB-NE2 3.36Å; N176-H178 PolarHBondContact O-N 3.25Å; N176-H178 VanDerWaalsContact O-N 3.08Å; H178-E180 PolarHBondContact O-N 3.44Å; H178-L181 HydrophobicContact CB-CB 3.94Å; H178-L181 HydrophobicContact CB-CD2 4.25Å; H178-L181 WeakPolarHBondContact O-CB 3.3Å; H178-L181 PolarHBondContact O-N 3.19Å; H178-L181 VanDerWaalsContact O-N 3.12Å; H178-L182 PolarHBondContact O-N 3.37Å
179	M	87.4	Confident	88.1	Confident	41 Å²	41	35.9 Å²	35.9	20%	0.202	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-42.1	-165.7	-59.8	-43	-51.1	0	0	115.1	E177 L181 L182 Q183 N205 I207 A208 I211	E177-M179 VanDerWaalsContact C-N 3.29Å; E177-M179 WeakPolarHBondContact O-CG 3.34Å; E177-M179 PolarHBondContact O-N 3.2Å; M179-L181 VanDerWaalsContact C-N 3.31Å; M179-L181 PolarHBondContact O-N 3.22Å; M179-L182 HydrophobicContact CE-CD2 3.93Å; M179-L182 PolarHBondContact O-N 3.08Å; M179-Q183 PolarHBondContact O-N 3.4Å; M179-N205 PolarHBondContact SD-ND2 2.75Å; M179-N205 VanDerWaalsContact SD-ND2 3.36Å; M179-I207 HydrophobicContact CE-CB 3.88Å; M179-I207 HydrophobicContact CE-CG2 3.83Å; M179-A208 HydrophobicContact CE-CB 3.89Å; M179-A208 VanDerWaalsContact CE-N 3.31Å; M179-I211 HydrophobicContact CE-CD1 3.74Å
180	E	87	Confident	87.4	Confident	121 Å²	121	41 Å²	41	57%	0.565	21%	0.214	S	C	*	.	H	α-helix	trans	-67.3	-35	177.8	-58	-165.4	162.9	0	0	112.1	L142 H178 Q183 F184	L142-E180 HydrophobicContact CD2-CB 4.13Å; H178-E180 PolarHBondContact O-N 3.44Å; E180-Q183 PolarHBondContact O-N 3.3Å; E180-F184 PolarHBondContact O-N 3.24Å
181	L	90.2	Very high	87.1	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-68.8	-43.9	174.7	174.2	58.5	0	0	0	110.8	A137 L142 I145 A173 H178 M179 Q183 F184 L185	A137-L181 HydrophobicContact CB-CD2 4Å; L142-L181 HydrophobicContact CD1-CD1 4.16Å; I145-L181 HydrophobicContact CB-CD1 4.31Å; I145-L181 HydrophobicContact CD1-CD1 3.41Å; I145-L181 VanDerWaalsContact CD1-CD1 3.41Å; I145-L181 HydrophobicContact CD1-CD2 3.63Å; I145-L181 HydrophobicContact CD1-CG 4.17Å; I145-L181 HydrophobicContact CG1-CD1 4.44Å; I145-L181 HydrophobicContact CG2-CD1 3.9Å; A173-L181 HydrophobicContact CB-CD2 4.27Å; A173-L181 HydrophobicContact CB-CG 4.29Å; H178-L181 HydrophobicContact CB-CB 3.94Å; H178-L181 HydrophobicContact CB-CD2 4.25Å; H178-L181 WeakPolarHBondContact O-CB 3.3Å; H178-L181 PolarHBondContact O-N 3.19Å; H178-L181 VanDerWaalsContact O-N 3.12Å; M179-L181 VanDerWaalsContact C-N 3.31Å; M179-L181 PolarHBondContact O-N 3.22Å; L181-Q183 VanDerWaalsContact C-N 3.31Å; L181-Q183 PolarHBondContact O-N 2.85Å; L181-F184 PolarHBondContact O-N 3.33Å; L181-L185 HydrophobicContact CD1-CD1 3.77Å; L181-L185 HydrophobicContact CD1-CD2 4.27Å; L181-L185 HydrophobicContact CD1-CG 3.73Å; L181-L185 HydrophobicContact CD2-CD1 4.38Å; L181-L185 HydrophobicContact CG-CD1 3.74Å; L181-L185 HydrophobicContact CG-CG 4.19Å; L181-L185 WeakPolarHBondContact O-CB 3.32Å; L181-L185 VanDerWaalsContact O-CG 3.29Å; L181-L185 WeakPolarHBondContact O-CG 3.31Å; L181-L185 PolarHBondContact O-N 2.92Å
182	L	91.2	Very high	86.7	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-57.9	-46	174	-175.6	66.4	0	0	0	110.5	L170 A173 I174 H178 M179 F184 L185 V186 A208 I211 I212	L170-L182 HydrophobicContact CD2-CD1 4.09Å; A173-L182 HydrophobicContact CB-CB 4.43Å; A173-L182 HydrophobicContact CB-CD1 4.44Å; I174-L182 HydrophobicContact CD1-CD1 4.4Å; I174-L182 HydrophobicContact CG1-CD1 3.98Å; I174-L182 HydrophobicContact CG1-CD2 4.18Å; H178-L182 PolarHBondContact O-N 3.37Å; M179-L182 HydrophobicContact CE-CD2 3.93Å; M179-L182 PolarHBondContact O-N 3.08Å; L182-F184 VanDerWaalsContact C-N 3.33Å; L182-F184 PolarHBondContact O-N 3.41Å; L182-L185 PolarHBondContact O-N 3.12Å; L182-V186 HydrophobicContact CD1-CG2 3.69Å; L182-V186 HydrophobicContact CG-CG2 4.04Å; L182-V186 WeakPolarHBondContact O-CB 3.33Å; L182-V186 WeakPolarHBondContact O-CG2 3.26Å; L182-V186 PolarHBondContact O-N 2.88Å; L182-A208 HydrophobicContact CD2-CB 3.62Å; L182-I211 HydrophobicContact CG-CG2 4.44Å; L182-I212 HydrophobicContact CD2-CD1 4.29Å; L182-I212 HydrophobicContact CD2-CG1 4.45Å
183	Q	90.5	Very high	86.4	Confident	126 Å²	126	44.1 Å²	44.1	59%	0.589	23%	0.234	S	C	*	.	H	α-helix	trans	-59	-41.6	176.8	-166.3	180	18.9	0	0	112.5	M179 E180 L181 A187 I211	M179-Q183 PolarHBondContact O-N 3.4Å; E180-Q183 PolarHBondContact O-N 3.3Å; L181-Q183 VanDerWaalsContact C-N 3.31Å; L181-Q183 PolarHBondContact O-N 2.85Å; Q183-A187 PolarHBondContact O-N 3.06Å; Q183-I211 HydrophobicContact CB-CD1 4.33Å; Q183-I211 HydrophobicContact CB-CG2 4.41Å
184	F	90	Very high	85.8	Confident	47 Å²	47	48.3 Å²	48.3	21%	0.206	25%	0.253	C	S	.	.	H	α-helix	trans	-66.4	-52.6	175.7	178.3	-107.3	0	0	0	112.4	L142 I145 K146 T149 E180 L181 L182 V186 A187 L188	L142-F184 HydrophobicContact CD1-CB 3.81Å; L142-F184 HydrophobicContact CD1-CD1 4.12Å; L142-F184 HydrophobicContact CD1-CG 4.01Å; I145-F184 HydrophobicContact CG2-CD1 4.2Å; I145-F184 HydrophobicContact CG2-CE1 4.06Å; K146-F184 HydrophobicContact CB-CZ 4.34Å; K146-F184 HydrophobicContact CG-CD1 4.35Å; K146-F184 HydrophobicContact CG-CD2 4.25Å; K146-F184 HydrophobicContact CG-CE1 3.88Å; K146-F184 HydrophobicContact CG-CE2 3.78Å; K146-F184 HydrophobicContact CG-CZ 3.57Å; T149-F184 HydrophobicContact CG2-CE1 4.27Å; T149-F184 HydrophobicContact CG2-CZ 4.01Å; E180-F184 PolarHBondContact O-N 3.24Å; L181-F184 PolarHBondContact O-N 3.33Å; L182-F184 VanDerWaalsContact C-N 3.33Å; L182-F184 PolarHBondContact O-N 3.41Å; F184-V186 VanDerWaalsContact C-N 3.34Å; F184-V186 PolarHBondContact O-N 3.27Å; F184-A187 WeakPolarHBondContact O-CB 3.45Å; F184-A187 PolarHBondContact O-N 3.02Å; F184-L188 HydrophobicContact CE1-CD1 4.13Å; F184-L188 HydrophobicContact CE2-CD2 4.44Å; F184-L188 HydrophobicContact CZ-CD2 4.17Å
185	L	90	Very high	85.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.1	-43.2	-179	-68.1	170.6	0	0	0	111.7	F133 I145 V169 L170 A173 L181 L182 A187 L188 L191	F133-L185 HydrophobicContact CZ-CD2 4.35Å; I145-L185 HydrophobicContact CG2-CD2 4.24Å; V169-L185 HydrophobicContact CG1-CD1 4.36Å; V169-L185 HydrophobicContact CG1-CD2 4.31Å; V169-L185 HydrophobicContact CG2-CD1 3.96Å; V169-L185 HydrophobicContact CG2-CD2 4.33Å; L170-L185 HydrophobicContact CD2-CB 3.64Å; L170-L185 HydrophobicContact CD2-CD1 4.34Å; A173-L185 HydrophobicContact CB-CD1 4.03Å; L181-L185 HydrophobicContact CD1-CD1 3.77Å; L181-L185 HydrophobicContact CD1-CD2 4.27Å; L181-L185 HydrophobicContact CD1-CG 3.73Å; L181-L185 HydrophobicContact CD2-CD1 4.38Å; L181-L185 HydrophobicContact CG-CD1 3.74Å; L181-L185 HydrophobicContact CG-CG 4.19Å; L181-L185 WeakPolarHBondContact O-CB 3.32Å; L181-L185 VanDerWaalsContact O-CG 3.29Å; L181-L185 WeakPolarHBondContact O-CG 3.31Å; L181-L185 PolarHBondContact O-N 2.92Å; L182-L185 PolarHBondContact O-N 3.12Å; L185-A187 PolarHBondContact O-N 3.45Å; L185-L188 HydrophobicContact CD2-CD1 4.37Å; L185-L188 WeakPolarHBondContact O-CB 3.42Å; L185-L188 PolarHBondContact O-N 3.03Å; L185-L191 HydrophobicContact CB-CD1 3.83Å; L185-L191 HydrophobicContact CD2-CD1 3.76Å; L185-L191 HydrophobicContact CG-CD1 4.37Å; L185-L191 WeakPolarHBondContact O-CD1 3.42Å
186	V	87.6	Confident	85.3	Confident	2 Å²	2	47 Å²	47	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-67.7	-22.5	-178.8	168.2	0	0	0	0	112.3	L170 L182 F184 L193 I211 I212 A215 R219	L170-V186 HydrophobicContact CD2-CG2 3.71Å; L182-V186 HydrophobicContact CD1-CG2 3.69Å; L182-V186 HydrophobicContact CG-CG2 4.04Å; L182-V186 WeakPolarHBondContact O-CB 3.33Å; L182-V186 WeakPolarHBondContact O-CG2 3.26Å; L182-V186 PolarHBondContact O-N 2.88Å; F184-V186 VanDerWaalsContact C-N 3.34Å; F184-V186 PolarHBondContact O-N 3.27Å; V186-L193 HydrophobicContact CG2-CD2 4.32Å; V186-I211 HydrophobicContact CB-CG2 4.38Å; V186-I211 HydrophobicContact CG1-CG2 4.28Å; V186-I212 HydrophobicContact CG2-CG1 4.27Å; V186-A215 HydrophobicContact CG1-CB 3.13Å; V186-R219 PolarHBondContact O-NE 3.35Å; V186-R219 PolarHBondContact O-NH2 2.91Å
187	A	86.2	Confident	85.5	Confident	73 Å²	73	46.2 Å²	46.2	60%	0.603	24%	0.243	S	C	*	.	H	α-helix	trans	-74.3	-20.7	170.6	0	0	0	0	0	113.8	Q183 F184 L185 P189	Q183-A187 PolarHBondContact O-N 3.06Å; F184-A187 WeakPolarHBondContact O-CB 3.45Å; F184-A187 PolarHBondContact O-N 3.02Å; L185-A187 PolarHBondContact O-N 3.45Å; A187-P189 WeakPolarHBondContact O-CD 3.34Å
188	L	84.9	Confident	85.6	Confident	27 Å²	27	43.7 Å²	43.7	14%	0.141	23%	0.231	C	C	.	.			trans	-76.4	115.4	-176.5	-56.7	176.9	0	0	0	111.5	T149 F184 L185 Q190 L191 R219	T149-L188 HydrophobicContact CG2-CD1 3.59Å; T149-L188 HydrophobicContact CG2-CD2 3.7Å; T149-L188 HydrophobicContact CG2-CG 4.3Å; F184-L188 HydrophobicContact CE1-CD1 4.13Å; F184-L188 HydrophobicContact CE2-CD2 4.44Å; F184-L188 HydrophobicContact CZ-CD2 4.17Å; L185-L188 HydrophobicContact CD2-CD1 4.37Å; L185-L188 WeakPolarHBondContact O-CB 3.42Å; L185-L188 PolarHBondContact O-N 3.03Å; L188-Q190 PolarHBondContact O-N 3.46Å; L188-Q190 VanDerWaalsContact O-N 3.07Å; L188-L191 HydrophobicContact CB-CD1 4.28Å; L188-L191 HydrophobicContact CD1-CD1 4.05Å; L188-L191 PolarHBondContact O-N 3.04Å; L188-R219 PolarHBondContact O-NH2 3.34Å
189	P	78.1	Confident	85.6	Confident	118 Å²	118	43.4 Å²	43.4	77%	0.766	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-7.6	-174.2	30	-36.7	0	0	0	114.3	A187	A187-P189 WeakPolarHBondContact O-CD 3.34Å
190	Q	76.8	Confident	85.8	Confident	107 Å²	107	41.4 Å²	41.4	50%	0.5	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-19.7	178.2	-66.4	175	-17.2	0	0	113.5	L159 N160 L188	L159-Q190 HydrophobicContact CD1-CB 3.93Å; L159-Q190 VanDerWaalsContact CD1-OE1 3.3Å; N160-Q190 PolarHBondContact ND2-O 2.88Å; L188-Q190 PolarHBondContact O-N 3.46Å; L188-Q190 VanDerWaalsContact O-N 3.07Å
191	L	82.4	Confident	86.1	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.01	19%	0.193	C	C	.	.	S	Bend	trans	-83.3	128.4	178	-82.8	169.8	0	0	0	111	L159 N160 V169 L185 L188 R219	L159-L191 HydrophobicContact CB-CD2 3.74Å; L159-L191 HydrophobicContact CB-CG 4.12Å; L159-L191 WeakPolarHBondContact O-CD2 3.46Å; N160-L191 WeakPolarHBondContact OD1-CA 3.29Å; N160-L191 WeakPolarHBondContact OD1-CD2 3.11Å; V169-L191 HydrophobicContact CG1-CD1 4.26Å; V169-L191 HydrophobicContact CG1-CD2 3.76Å; L185-L191 HydrophobicContact CB-CD1 3.83Å; L185-L191 HydrophobicContact CD2-CD1 3.76Å; L185-L191 HydrophobicContact CG-CD1 4.37Å; L185-L191 WeakPolarHBondContact O-CD1 3.42Å; L188-L191 HydrophobicContact CB-CD1 4.28Å; L188-L191 HydrophobicContact CD1-CD1 4.05Å; L188-L191 PolarHBondContact O-N 3.04Å; L191-R219 PolarHBondContact O-NH1 3.02Å
192	D	81	Confident	86.2	Confident	99 Å²	99	37.3 Å²	37.3	53%	0.529	20%	0.202	S	C	.	.			trans	-80.8	125.7	173	-81.2	-42.4	0	0	0	110.3	N160 K194	N160-D192 PolarHBondContact OD1-N 3.4Å; D192-K194 HydrophobicContact CB-CG 3.9Å; D192-K194 PolarHBondContact O-N 3.26Å
193	L	81.8	Confident	86	Confident	24 Å²	24	40.8 Å²	40.8	13%	0.126	22%	0.219	C	C	.	.			trans	-72.9	-15.3	-179.1	-62.1	179.4	0	0	0	113.3	L170 V186 D195 C196 Q216	L170-L193 HydrophobicContact CD1-CD2 3.87Å; V186-L193 HydrophobicContact CG2-CD2 4.32Å; L193-D195 PolarHBondContact O-N 3.5Å; L193-C196 VanDerWaalsContact O-CB 3.28Å; L193-C196 WeakPolarHBondContact O-CB 3.33Å; L193-C196 PolarHBondContact O-N 3.26Å; L193-C196 PolarHBondContact O-SG 2.87Å; L193-Q216 HydrophobicContact CD1-CG 3.68Å
194	K	77.5	Confident	85.9	Confident	90 Å²	90	37 Å²	37	39%	0.391	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	32.8	-118.3	179.9	-54.9	-173.1	-152.3	158.3	0	113	D168 D192 F232	D168-K194 IonicContact OD1-NZ 3.46Å; D168-K194 PolarHBondContact OD1-NZ 3.24Å; D168-K194 VanDerWaalsContact OD2-CD 3.23Å; D168-K194 WeakPolarHBondContact OD2-CD 3.16Å; D168-K194 WeakPolarHBondContact OD2-CE 3.37Å; D168-K194 IonicContact OD2-NZ 3.44Å; D168-K194 PolarHBondContact OD2-NZ 3.2Å; D192-K194 HydrophobicContact CB-CG 3.9Å; D192-K194 PolarHBondContact O-N 3.26Å; K194-F232 WeakPolarHBondContact O-CD1 3.2Å; K194-F232 VanDerWaalsContact O-CE1 3.26Å; K194-F232 WeakPolarHBondContact O-CE1 3.35Å
195	D	82.3	Confident	85.9	Confident	20 Å²	20	35.3 Å²	35.3	11%	0.107	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	14.1	177.8	64.9	-19.4	0	0	0	113.3	L193 I197 L198 H199 F232 S234	L193-D195 PolarHBondContact O-N 3.5Å; D195-I197 PolarHBondContact O-N 3.19Å; D195-L198 HydrophobicContact CB-CD1 4.32Å; D195-L198 WeakPolarHBondContact O-CA 3.32Å; D195-L198 WeakPolarHBondContact O-CB 3.34Å; D195-L198 PolarHBondContact O-N 2.83Å; D195-H199 PolarHBondContact O-CD2 3.39Å; D195-H199 VanDerWaalsContact O-CD2 3.28Å; D195-H199 PolarHBondContact O-N 2.9Å; D195-H199 IonicContact OD1-CD2 3.66Å; D195-H199 IonicContact OD1-NE2 3.91Å; D195-H199 PolarHBondContact OD1-NE2 3.19Å; D195-H199 IonicContact OD2-CD2 3.37Å; D195-H199 IonicContact OD2-CE1 2.63Å; D195-H199 IonicContact OD2-NE2 3.76Å; D195-H199 PolarHBondContact OD2-NE2 2.96Å; D195-F232 HydrophobicContact CB-CB 4.12Å; D195-S234 WeakPolarHBondContact OD2-CB 3.33Å
196	C	86.8	Confident	86	Confident	5 Å²	5	37.1 Å²	37.1	3%	0.034	21%	0.206	C	C	.	.	H	α-helix	trans	-56.7	-30.2	-175.4	77.3	0	0	0	0	113.3	L170 I174 L193 L198 H199 A200	L170-C196 HydrophobicContact CB-CB 4.18Å; I174-C196 HydrophobicContact CD1-CB 3.93Å; I174-C196 WeakPolarHBondContact CD1-O 3.28Å; L193-C196 VanDerWaalsContact O-CB 3.28Å; L193-C196 WeakPolarHBondContact O-CB 3.33Å; L193-C196 PolarHBondContact O-N 3.26Å; L193-C196 PolarHBondContact O-SG 2.87Å; C196-L198 VanDerWaalsContact C-N 3.34Å; C196-L198 PolarHBondContact O-N 2.92Å; C196-H199 PolarHBondContact O-N 3.48Å; C196-A200 PolarHBondContact O-N 2.81Å
197	I	88.1	Confident	86.2	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-68.9	-29.3	174.8	-170.2	157.4	0	0	0	113.1	D195 I201 I212 L213 L229 F232	D195-I197 PolarHBondContact O-N 3.19Å; I197-I201 HydrophobicContact CG1-CD1 4Å; I197-I201 WeakPolarHBondContact O-CB 3.48Å; I197-I201 WeakPolarHBondContact O-CD1 3.38Å; I197-I201 WeakPolarHBondContact O-CG1 3.24Å; I197-I201 PolarHBondContact O-N 3.19Å; I197-I201 VanDerWaalsContact O-N 3.08Å; I197-I212 HydrophobicContact CB-CG2 3.99Å; I197-I212 HydrophobicContact CD1-CG2 4.15Å; I197-I212 HydrophobicContact CG1-CG2 4.34Å; I197-L213 HydrophobicContact CD1-CD2 3.48Å; I197-L213 VanDerWaalsContact CD1-CD2 3.48Å; I197-L213 HydrophobicContact CD1-CG 3.98Å; I197-L229 HydrophobicContact CD1-CD2 3.94Å; I197-L229 HydrophobicContact CG1-CD2 4.5Å; I197-L229 HydrophobicContact CG2-CD2 4.02Å; I197-F232 HydrophobicContact CG2-CE2 3.84Å; I197-F232 HydrophobicContact CG2-CZ 4.08Å
198	L	89.4	Confident	86.5	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-71.5	-39.6	173.4	-59.5	-176.5	0	0	0	110.5	D195 C196 I201 N202 F232 F237 L246	D195-L198 HydrophobicContact CB-CD1 4.32Å; D195-L198 WeakPolarHBondContact O-CA 3.32Å; D195-L198 WeakPolarHBondContact O-CB 3.34Å; D195-L198 PolarHBondContact O-N 2.83Å; C196-L198 VanDerWaalsContact C-N 3.34Å; C196-L198 PolarHBondContact O-N 2.92Å; L198-I201 PolarHBondContact O-N 3.28Å; L198-N202 WeakPolarHBondContact O-CB 3.46Å; L198-N202 PolarHBondContact O-N 3.11Å; L198-F232 HydrophobicContact CD1-CB 4.38Å; L198-F232 HydrophobicContact CD1-CD2 4.14Å; L198-F232 HydrophobicContact CG-CD2 4.19Å; L198-F237 HydrophobicContact CB-CD2 3.66Å; L198-F237 HydrophobicContact CB-CE2 3.41Å; L198-F237 VanDerWaalsContact CB-CE2 3.41Å; L198-F237 HydrophobicContact CB-CZ 4.09Å; L198-F237 HydrophobicContact CD1-CB 4.34Å; L198-F237 HydrophobicContact CD1-CD2 3.72Å; L198-F237 HydrophobicContact CD1-CE2 4.37Å; L198-F237 HydrophobicContact CD1-CG 4.22Å; L198-F237 HydrophobicContact CG-CD2 4.35Å; L198-L246 HydrophobicContact CB-CD2 3.98Å; L198-L246 HydrophobicContact CD2-CD2 4.25Å; L198-L246 WeakPolarHBondContact O-CD2 3.14Å
199	H	89.2	Confident	86.8	Confident	3 Å²	3	36.9 Å²	36.9	1%	0.014	19%	0.194	C	C	.	.	H	α-helix	trans	-65.1	-44.4	173.2	-60.1	-67.6	0	0	0	111.7	R171 D195 C196 I201 N202 E203 F237	R171-H199 PolarHBondContact NH1-CE1 3.25Å; D195-H199 PolarHBondContact O-CD2 3.39Å; D195-H199 VanDerWaalsContact O-CD2 3.28Å; D195-H199 PolarHBondContact O-N 2.9Å; D195-H199 IonicContact OD1-CD2 3.66Å; D195-H199 IonicContact OD1-NE2 3.91Å; D195-H199 PolarHBondContact OD1-NE2 3.19Å; D195-H199 IonicContact OD2-CD2 3.37Å; D195-H199 IonicContact OD2-CE1 2.63Å; D195-H199 IonicContact OD2-NE2 3.76Å; D195-H199 PolarHBondContact OD2-NE2 2.96Å; C196-H199 PolarHBondContact O-N 3.48Å; H199-I201 VanDerWaalsContact C-N 3.27Å; H199-I201 PolarHBondContact O-N 3.24Å; H199-N202 CarbonylContact O-C 3.57Å; H199-N202 WeakPolarHBondContact O-CA 3.19Å; H199-N202 WeakPolarHBondContact O-CB 3.45Å; H199-N202 PolarHBondContact O-N 2.87Å; H199-E203 PolarHBondContact O-N 3.24Å; H199-F237 AromaticContact CE1-CE2 3.48Å; H199-F237 VanDerWaalsContact CE1-CE2 3.48Å; H199-F237 WeakPolarHBondContact CE1-CE2 3.44Å; H199-F237 AromaticContact ND1-CE2 3.68Å; H199-F237 AromaticContact ND1-CZ 3.95Å; H199-F237 AromaticContact NE2-CE2 3.94Å
200	A	91.7	Very high	87.4	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.5	-32.5	175.4	0	0	0	0	0	113.6	I174 C196 N205 A208 V209 I212	I174-A200 HydrophobicContact CD1-CB 4.13Å; I174-A200 HydrophobicContact CG1-CB 4.49Å; I174-A200 HydrophobicContact CG2-CB 4.25Å; C196-A200 PolarHBondContact O-N 2.81Å; A200-N205 PolarHBondContact O-N 3.12Å; A200-A208 HydrophobicContact CB-CB 3.94Å; A200-V209 HydrophobicContact CB-CG2 3.89Å; A200-I212 HydrophobicContact CB-CD1 3.71Å
201	I	92.5	Very high	88.1	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-76.9	-28.4	172.5	-67.3	169.4	0	0	0	111.4	I197 L198 H199 D204 V209 L246 A247 I255 L259	I197-I201 HydrophobicContact CG1-CD1 4Å; I197-I201 WeakPolarHBondContact O-CB 3.48Å; I197-I201 WeakPolarHBondContact O-CD1 3.38Å; I197-I201 WeakPolarHBondContact O-CG1 3.24Å; I197-I201 PolarHBondContact O-N 3.19Å; I197-I201 VanDerWaalsContact O-N 3.08Å; L198-I201 PolarHBondContact O-N 3.28Å; H199-I201 VanDerWaalsContact C-N 3.27Å; H199-I201 PolarHBondContact O-N 3.24Å; I201-D204 PolarHBondContact O-N 2.94Å; I201-V209 HydrophobicContact CG1-CG2 3.68Å; I201-L246 HydrophobicContact CB-CD2 4.32Å; I201-L246 HydrophobicContact CG2-CB 4Å; I201-L246 HydrophobicContact CG2-CD2 4.15Å; I201-L246 HydrophobicContact CG2-CG 3.89Å; I201-A247 HydrophobicContact CG2-CB 3.78Å; I201-I255 HydrophobicContact CD1-CG2 4.39Å; I201-I255 HydrophobicContact CG1-CG2 3.89Å; I201-I255 HydrophobicContact CG2-CG2 4.26Å; I201-L259 HydrophobicContact CD1-CD1 4.1Å
202	N	92	Very high	88.4	Confident	39 Å²	39	32.1 Å²	32.1	21%	0.209	16%	0.162	C	C	.	.	H	α-helix	trans	-75.5	-32.6	176.4	-170.8	74.5	0	0	0	112.6	L198 H199 D204 F237 L246 R250	L198-N202 WeakPolarHBondContact O-CB 3.46Å; L198-N202 PolarHBondContact O-N 3.11Å; H199-N202 CarbonylContact O-C 3.57Å; H199-N202 WeakPolarHBondContact O-CA 3.19Å; H199-N202 WeakPolarHBondContact O-CB 3.45Å; H199-N202 PolarHBondContact O-N 2.87Å; N202-D204 PolarHBondContact O-N 3.11Å; N202-F237 HydrophobicContact CB-CE1 4.33Å; N202-F237 HydrophobicContact CB-CZ 3.98Å; N202-L246 HydrophobicContact CB-CD2 4.4Å; N202-R250 PolarHBondContact ND2-NH2 3.43Å; N202-R250 PolarHBondContact O-NH1 2.9Å; N202-R250 PolarHBondContact O-NH2 3.3Å; N202-R250 PolarHBondContact OD1-NH2 2.84Å
203	E	87.7	Confident	88.6	Confident	74 Å²	74	27.8 Å²	27.8	35%	0.346	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	6.9	172.9	-48.8	-32.8	122.3	0	0	112.3	I174 H199 N205	I174-E203 HydrophobicContact CG2-CB 4.48Å; I174-E203 HydrophobicContact CG2-CG 4.07Å; H199-E203 PolarHBondContact O-N 3.24Å; E203-N205 PolarHBondContact O-N 3.22Å
204	D	88.6	Confident	88.9	Confident	45 Å²	45	32.2 Å²	32.2	24%	0.241	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	58	8.3	177.8	-84.2	-69.7	0	0	0	115.9	I201 N202 V206 R250 N252	I201-D204 PolarHBondContact O-N 2.94Å; N202-D204 PolarHBondContact O-N 3.11Å; D204-V206 PolarHBondContact O-N 2.73Å; D204-R250 WeakPolarHBondContact OD1-CB 3.24Å; D204-R250 WeakPolarHBondContact OD2-CD 3.5Å; D204-R250 WeakPolarHBondContact OD2-CG 3.46Å; D204-R250 IonicContact OD2-CZ 3.66Å; D204-R250 IonicContact OD2-NE 3.28Å; D204-R250 IonicContact OD2-NH1 2.73Å; D204-R250 PolarHBondContact OD2-NH1 3.27Å; D204-N252 PolarHBondContact O-ND2 3.28Å; D204-N252 WeakPolarHBondContact OD1-CB 3.44Å; D204-N252 PolarHBondContact OD1-ND2 2.8Å
205	N	90	Very high	89.1	Confident	12 Å²	12	28.3 Å²	28.3	6%	0.064	14%	0.143	C	C	.	.			trans	-72.5	105.1	-180	-174.4	-34.6	0	0	0	112.6	E177 M179 A200 E203 I207 A208 V209	E177-N205 WeakPolarHBondContact OE1-CB 3.46Å; E177-N205 PolarHBondContact OE1-ND2 3.22Å; E177-N205 PolarHBondContact OE2-ND2 3.25Å; M179-N205 PolarHBondContact SD-ND2 2.75Å; M179-N205 VanDerWaalsContact SD-ND2 3.36Å; A200-N205 PolarHBondContact O-N 3.12Å; E203-N205 PolarHBondContact O-N 3.22Å; N205-I207 PolarHBondContact O-N 3.4Å; N205-I207 WeakPolarHBondContact OD1-CA 3.27Å; N205-I207 PolarHBondContact OD1-N 3.28Å; N205-A208 HydrophobicContact CB-CB 4.02Å; N205-A208 PolarHBondContact OD1-N 2.97Å; N205-V209 WeakPolarHBondContact O-CG2 3.42Å; N205-V209 PolarHBondContact O-N 3.31Å
206	V	92	Very high	89	Confident	39 Å²	39	29.4 Å²	29.4	24%	0.236	15%	0.148	C	C	.	.	H	α-helix	trans	-60.2	-41.8	178.4	-177	0	0	0	0	112.6	D204 V209 E210 V254 I255 L258	D204-V206 PolarHBondContact O-N 2.73Å; V206-V209 PolarHBondContact O-N 2.98Å; V206-E210 HydrophobicContact CG1-CG 4.49Å; V206-E210 PolarHBondContact O-N 3.35Å; V206-V254 HydrophobicContact CG1-CB 4.28Å; V206-V254 HydrophobicContact CG1-CG1 3.57Å; V206-V254 HydrophobicContact CG2-CB 3.91Å; V206-V254 HydrophobicContact CG2-CG1 4.1Å; V206-I255 HydrophobicContact CG2-CG1 4.2Å; V206-L258 HydrophobicContact CG1-CD1 3.83Å
207	I	91.5	Very high	88.6	Confident	96 Å²	96	32.3 Å²	32.3	49%	0.492	17%	0.166	S	C	.	.	H	α-helix	trans	-70.7	-38.6	-173	-48.5	177.7	0	0	0	110.1	M179 N205 E210 I211	M179-I207 HydrophobicContact CE-CB 3.88Å; M179-I207 HydrophobicContact CE-CG2 3.83Å; N205-I207 PolarHBondContact O-N 3.4Å; N205-I207 WeakPolarHBondContact OD1-CA 3.27Å; N205-I207 PolarHBondContact OD1-N 3.28Å; I207-E210 PolarHBondContact O-N 2.86Å; I207-I211 HydrophobicContact CG2-CD1 4.05Å; I207-I211 WeakPolarHBondContact O-CG1 3.4Å; I207-I211 PolarHBondContact O-N 3.49Å
208	A	91.8	Very high	88	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.6	-46	172.7	0	0	0	0	0	111.2	M179 L182 A200 N205 I211 I212	M179-A208 HydrophobicContact CE-CB 3.89Å; M179-A208 VanDerWaalsContact CE-N 3.31Å; L182-A208 HydrophobicContact CD2-CB 3.62Å; A200-A208 HydrophobicContact CB-CB 3.94Å; N205-A208 HydrophobicContact CB-CB 4.02Å; N205-A208 PolarHBondContact OD1-N 2.97Å; A208-I211 PolarHBondContact O-N 2.87Å; A208-I212 WeakPolarHBondContact O-CB 3.45Å; A208-I212 WeakPolarHBondContact O-CD1 3.29Å; A208-I212 VanDerWaalsContact O-CG1 3.24Å; A208-I212 WeakPolarHBondContact O-CG1 3.47Å; A208-I212 PolarHBondContact O-N 2.65Å
209	V	91.3	Very high	87.3	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.6	-43.6	175.5	173	0	0	0	0	111.5	A200 I201 N205 V206 I212 L213 I255	A200-V209 HydrophobicContact CB-CG2 3.89Å; I201-V209 HydrophobicContact CG1-CG2 3.68Å; N205-V209 WeakPolarHBondContact O-CG2 3.42Å; N205-V209 PolarHBondContact O-N 3.31Å; V206-V209 PolarHBondContact O-N 2.98Å; V209-I212 PolarHBondContact O-N 2.84Å; V209-L213 HydrophobicContact CG1-CD1 3.54Å; V209-L213 HydrophobicContact CG1-CG 4.11Å; V209-L213 VanDerWaalsContact O-CB 3.24Å; V209-L213 WeakPolarHBondContact O-CB 3.5Å; V209-L213 WeakPolarHBondContact O-CG 3.45Å; V209-L213 PolarHBondContact O-N 3.47Å; V209-I255 HydrophobicContact CG1-CG2 4.39Å; V209-I255 HydrophobicContact CG2-CD1 4.15Å; V209-I255 HydrophobicContact CG2-CG1 4.45Å
210	E	91.3	Very high	86	Confident	96 Å²	96	42.6 Å²	42.6	45%	0.449	22%	0.219	S	C	.	.	H	α-helix	trans	-61.9	-47.2	176.7	-74.3	-173.1	-179.4	0	0	112.7	V206 I207 L213 H214 L258	V206-E210 HydrophobicContact CG1-CG 4.49Å; V206-E210 PolarHBondContact O-N 3.35Å; I207-E210 PolarHBondContact O-N 2.86Å; E210-L213 PolarHBondContact O-N 3.27Å; E210-H214 WeakPolarHBondContact O-CB 3.33Å; E210-H214 PolarHBondContact O-N 2.78Å; E210-L258 HydrophobicContact CG-CD1 3.54Å; E210-L258 HydrophobicContact CG-CD2 4.04Å; E210-L258 HydrophobicContact CG-CG 4.45Å
211	I	90.4	Very high	84.2	Confident	32 Å²	32	47.8 Å²	47.8	16%	0.164	26%	0.255	C	S	.	.	H	α-helix	trans	-60.7	-47.1	177.9	-70.9	166.5	0	0	0	111	M179 L182 Q183 V186 I207 A208 H214 A215	M179-I211 HydrophobicContact CE-CD1 3.74Å; L182-I211 HydrophobicContact CG-CG2 4.44Å; Q183-I211 HydrophobicContact CB-CD1 4.33Å; Q183-I211 HydrophobicContact CB-CG2 4.41Å; V186-I211 HydrophobicContact CB-CG2 4.38Å; V186-I211 HydrophobicContact CG1-CG2 4.28Å; I207-I211 HydrophobicContact CG2-CD1 4.05Å; I207-I211 WeakPolarHBondContact O-CG1 3.4Å; I207-I211 PolarHBondContact O-N 3.49Å; A208-I211 PolarHBondContact O-N 2.87Å; I211-H214 PolarHBondContact O-N 3.21Å; I211-A215 PolarHBondContact O-N 3.43Å; I211-A215 VanDerWaalsContact O-N 3.13Å
212	I	88.9	Confident	82.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.9	-43.1	179.9	-67	161	0	0	0	110.7	I174 L182 V186 I197 A200 A208 V209 H214 A215 Q216	I174-I212 HydrophobicContact CD1-CD1 4Å; L182-I212 HydrophobicContact CD2-CD1 4.29Å; L182-I212 HydrophobicContact CD2-CG1 4.45Å; V186-I212 HydrophobicContact CG2-CG1 4.27Å; I197-I212 HydrophobicContact CB-CG2 3.99Å; I197-I212 HydrophobicContact CD1-CG2 4.15Å; I197-I212 HydrophobicContact CG1-CG2 4.34Å; A200-I212 HydrophobicContact CB-CD1 3.71Å; A208-I212 WeakPolarHBondContact O-CB 3.45Å; A208-I212 WeakPolarHBondContact O-CD1 3.29Å; A208-I212 VanDerWaalsContact O-CG1 3.24Å; A208-I212 WeakPolarHBondContact O-CG1 3.47Å; A208-I212 PolarHBondContact O-N 2.65Å; V209-I212 PolarHBondContact O-N 2.84Å; I212-H214 PolarHBondContact O-N 3.29Å; I212-A215 PolarHBondContact O-N 3.12Å; I212-Q216 HydrophobicContact CG2-CG 4.25Å; I212-Q216 VanDerWaalsContact O-CB 3.31Å; I212-Q216 WeakPolarHBondContact O-CB 3.43Å; I212-Q216 VanDerWaalsContact O-CG 3.24Å; I212-Q216 WeakPolarHBondContact O-CG 3.29Å; I212-Q216 PolarHBondContact O-N 3.48Å
213	L	86.7	Confident	79.9	Confident	8 Å²	8	62.4 Å²	62.4	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-66.2	-35.1	177.5	-72.8	174.5	0	0	0	112.7	I197 V209 E210 T217 L258 L259 R262	I197-L213 HydrophobicContact CD1-CD2 3.48Å; I197-L213 VanDerWaalsContact CD1-CD2 3.48Å; I197-L213 HydrophobicContact CD1-CG 3.98Å; V209-L213 HydrophobicContact CG1-CD1 3.54Å; V209-L213 HydrophobicContact CG1-CG 4.11Å; V209-L213 VanDerWaalsContact O-CB 3.24Å; V209-L213 WeakPolarHBondContact O-CB 3.5Å; V209-L213 WeakPolarHBondContact O-CG 3.45Å; V209-L213 PolarHBondContact O-N 3.47Å; E210-L213 PolarHBondContact O-N 3.27Å; L213-T217 PolarHBondContact O-N 2.89Å; L213-T217 VanDerWaalsContact O-N 3.16Å; L213-T217 PolarHBondContact O-OG1 3.22Å; L213-L258 HydrophobicContact CD1-CB 4.43Å; L213-L259 HydrophobicContact CD1-CD2 4.03Å; L213-L259 HydrophobicContact CD2-CD2 4.18Å; L213-R262 PolarHBondContact O-NH1 3.08Å
214	H	86.5	Confident	77.4	Confident	117 Å²	117	67.5 Å²	67.5	54%	0.542	35%	0.346	S	S	.	.	H	α-helix	trans	-61.2	-56.4	173.8	-169.3	-83	0	0	0	110.4	E210 I211 I212 Q216 T217 E218	E210-H214 WeakPolarHBondContact O-CB 3.33Å; E210-H214 PolarHBondContact O-N 2.78Å; I211-H214 PolarHBondContact O-N 3.21Å; I212-H214 PolarHBondContact O-N 3.29Å; H214-Q216 PolarHBondContact O-N 3.35Å; H214-T217 WeakPolarHBondContact O-CA 3.32Å; H214-T217 WeakPolarHBondContact O-CB 3.41Å; H214-T217 PolarHBondContact O-N 3.17Å; H214-E218 IonicContact CE1-OE1 2.89Å; H214-E218 PolarHBondContact CE1-OE1 3.22Å; H214-E218 IonicContact CE1-OE2 3.65Å; H214-E218 PolarHBondContact CE1-OE2 3.18Å; H214-E218 IonicContact ND1-OE1 2.85Å; H214-E218 IonicContact ND1-OE2 2.76Å; H214-E218 PolarHBondContact ND1-OE2 3.01Å; H214-E218 PolarHBondContact O-N 2.99Å
215	A	82.5	Confident	75.3	Confident	8 Å²	8	72 Å²	72	7%	0.066	37%	0.37	C	S	.	.	H	α-helix	trans	-68.7	-30.4	-178.1	0	0	0	0	0	113.8	V186 I211 I212 T217 E218 R219	V186-A215 HydrophobicContact CG1-CB 3.13Å; I211-A215 PolarHBondContact O-N 3.43Å; I211-A215 VanDerWaalsContact O-N 3.13Å; I212-A215 PolarHBondContact O-N 3.12Å; A215-T217 PolarHBondContact O-N 3.22Å; A215-E218 WeakPolarHBondContact CA-OE2 3.36Å; A215-E218 PolarHBondContact O-N 2.83Å; A215-R219 VanDerWaalsContact O-CB 3.29Å; A215-R219 WeakPolarHBondContact O-CB 3.19Å; A215-R219 VanDerWaalsContact O-CG 3.23Å; A215-R219 WeakPolarHBondContact O-CG 3.33Å; A215-R219 PolarHBondContact O-N 2.97Å
216	Q	79.8	Confident	72.9	Confident	42 Å²	42	83.4 Å²	83.4	20%	0.196	41%	0.412	C	S	.	.	H	α-helix	trans	-60.1	-32.9	167.1	-80	-179	6.7	0	0	111.7	L193 I212 H214 G220	L193-Q216 HydrophobicContact CD1-CG 3.68Å; I212-Q216 HydrophobicContact CG2-CG 4.25Å; I212-Q216 VanDerWaalsContact O-CB 3.31Å; I212-Q216 WeakPolarHBondContact O-CB 3.43Å; I212-Q216 VanDerWaalsContact O-CG 3.24Å; I212-Q216 WeakPolarHBondContact O-CG 3.29Å; I212-Q216 PolarHBondContact O-N 3.48Å; H214-Q216 PolarHBondContact O-N 3.35Å; Q216-G220 VanDerWaalsContact O-CA 3.26Å; Q216-G220 WeakPolarHBondContact O-CA 3.49Å; Q216-G220 PolarHBondContact O-N 2.71Å
217	T	78.3	Confident	70.7	Confident	67 Å²	67	84.7 Å²	84.7	41%	0.411	43%	0.433	S	S	.	.	H	α-helix	trans	-74.1	-42	176.3	-47.2	0	0	0	0	111.1	L213 H214 A215 G220 S221 R262	L213-T217 PolarHBondContact O-N 2.89Å; L213-T217 VanDerWaalsContact O-N 3.16Å; L213-T217 PolarHBondContact O-OG1 3.22Å; H214-T217 WeakPolarHBondContact O-CA 3.32Å; H214-T217 WeakPolarHBondContact O-CB 3.41Å; H214-T217 PolarHBondContact O-N 3.17Å; A215-T217 PolarHBondContact O-N 3.22Å; T217-G220 PolarHBondContact O-N 3.36Å; T217-S221 PolarHBondContact O-N 3.23Å; T217-R262 PolarHBondContact OG1-NH1 3.14Å; T217-R262 PolarHBondContact OG1-NH2 3.36Å
218	E	77	Confident	68.4	Low	115 Å²	115	86.6 Å²	86.6	54%	0.537	44%	0.443	S	S	.	.	H	α-helix	trans	-66.3	-45	177.1	-65.6	174	114	0	0	112.5	H214 A215	H214-E218 IonicContact CE1-OE1 2.89Å; H214-E218 PolarHBondContact CE1-OE1 3.22Å; H214-E218 IonicContact CE1-OE2 3.65Å; H214-E218 PolarHBondContact CE1-OE2 3.18Å; H214-E218 IonicContact ND1-OE1 2.85Å; H214-E218 IonicContact ND1-OE2 2.76Å; H214-E218 PolarHBondContact ND1-OE2 3.01Å; H214-E218 PolarHBondContact O-N 2.99Å; A215-E218 WeakPolarHBondContact CA-OE2 3.36Å; A215-E218 PolarHBondContact O-N 2.83Å
219	R	73.4	Confident	66.5	Low	74 Å²	74	87.6 Å²	87.6	28%	0.279	45%	0.449	S	S	.	.	H	α-helix	trans	-65.7	-43	172.1	-66.9	172.5	-177.9	-129.4	7	111	V186 L188 L191 A215 S221 K222	V186-R219 PolarHBondContact O-NE 3.35Å; V186-R219 PolarHBondContact O-NH2 2.91Å; L188-R219 PolarHBondContact O-NH2 3.34Å; L191-R219 PolarHBondContact O-NH1 3.02Å; A215-R219 VanDerWaalsContact O-CB 3.29Å; A215-R219 WeakPolarHBondContact O-CB 3.19Å; A215-R219 VanDerWaalsContact O-CG 3.23Å; A215-R219 WeakPolarHBondContact O-CG 3.33Å; A215-R219 PolarHBondContact O-N 2.97Å; R219-S221 VanDerWaalsContact C-N 3.32Å; R219-S221 PolarHBondContact O-N 3.24Å; R219-K222 PolarHBondContact O-N 3.07Å
220	G	61.9	Low	64.5	Low	31 Å²	31	89.5 Å²	89.5	32%	0.32	47%	0.468	S	S	.	.	H	α-helix	trans	-66.7	-26.3	-178.3	0	0	0	0	0	114.3	Q216 T217 K222 K223	Q216-G220 VanDerWaalsContact O-CA 3.26Å; Q216-G220 WeakPolarHBondContact O-CA 3.49Å; Q216-G220 PolarHBondContact O-N 2.71Å; T217-G220 PolarHBondContact O-N 3.36Å; G220-K222 PolarHBondContact O-N 3.03Å; G220-K223 CarbonylContact O-C 3.57Å; G220-K223 PolarHBondContact O-N 3.47Å; G220-K223 VanDerWaalsContact O-N 3.09Å
221	S	54.7	Low	62.7	Low	109 Å²	109	92.6 Å²	92.6	76%	0.762	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-13.5	174.8	-158.4	0	0	0	0	113.8	T217 R219	T217-S221 PolarHBondContact O-N 3.23Å; R219-S221 VanDerWaalsContact C-N 3.32Å; R219-S221 PolarHBondContact O-N 3.24Å
222	K	49.2	Very low	61.3	Low	188 Å²	188	93.7 Å²	93.7	82%	0.817	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-2.7	179	-64.3	178	179.3	174.6	0	115.1	R219 G220	R219-K222 PolarHBondContact O-N 3.07Å; G220-K222 PolarHBondContact O-N 3.03Å
223	K	44.6	Very low	60	Low	158 Å²	158	103.1 Å²	103.1	69%	0.687	52%	0.523	S	S	*	.	S	Bend	trans	-147.4	133.7	176.4	-67.5	-174.8	179.4	179.2	0	109.9	G220 L225	G220-K223 CarbonylContact O-C 3.57Å; G220-K223 PolarHBondContact O-N 3.47Å; G220-K223 VanDerWaalsContact O-N 3.09Å; K223-L225 HydrophobicContact CB-CD1 4.32Å; K223-L225 PolarHBondContact O-N 2.86Å
224	N	35.9	Very low	59	Low	180 Å²	180	103.7 Å²	103.7	96%	0.963	53%	0.528	S	S	*	.			trans	-68.5	64.4	-172	-74.1	-30.2	0	0	0	115.2
225	L	43.5	Very low	58.1	Low	141 Å²	141	103.6 Å²	103.6	74%	0.738	54%	0.541	S	S	*	.			trans	-109.7	56.6	-179.4	-74.9	161.1	0	0	0	110.8	K223	K223-L225 HydrophobicContact CB-CD1 4.32Å; K223-L225 PolarHBondContact O-N 2.86Å
226	R	40.6	Very low	58	Low	250 Å²	250	106 Å²	106	94%	0.943	56%	0.557	S	S	*	*			trans	-83.3	128.7	168.5	-80.6	-175.6	169.5	-174	-2.6	110.2
227	G	45.5	Very low	58.2	Low	66 Å²	66	105.5 Å²	105.5	68%	0.68	55%	0.554	S	S	*	*	S	Bend	trans	100.7	1.3	155.3	0	0	0	0	0	118.3
228	L	41.6	Very low	58.4	Low	136 Å²	136	105.3 Å²	105.3	71%	0.712	55%	0.553	S	S	*	*			trans	-142.3	127.8	162	-85.1	101.9	0	0	0	110.7	G230	L228-G230 PolarHBondContact O-N 3.5Å; L228-G230 VanDerWaalsContact O-N 3.12Å
229	L	52.6	Low	58.4	Low	22 Å²	22	102.8 Å²	102.8	12%	0.115	55%	0.547	C	S	.	.			trans	-62.1	108.3	145	-71.1	102	0	0	0	107	I197 F232 D264	I197-L229 HydrophobicContact CD1-CD2 3.94Å; I197-L229 HydrophobicContact CG1-CD2 4.5Å; I197-L229 HydrophobicContact CG2-CD2 4.02Å; L229-F232 HydrophobicContact CB-CE2 4.04Å; L229-F232 HydrophobicContact CB-CZ 4.36Å; L229-F232 HydrophobicContact CD2-CE2 3.92Å; L229-F232 HydrophobicContact CD2-CZ 4.22Å; L229-D264 WeakPolarHBondContact CD1-OD1 3.46Å; L229-D264 VanDerWaalsContact CD1-OD2 3.23Å; L229-D264 WeakPolarHBondContact CD1-OD2 3.36Å
230	G	49.5	Very low	58.7	Low	39 Å²	39	99.6 Å²	99.6	40%	0.402	54%	0.535	S	S	.	.			trans	-63	165.2	-179.6	0	0	0	0	0	112.2	L228 F232	L228-G230 PolarHBondContact O-N 3.5Å; L228-G230 VanDerWaalsContact O-N 3.12Å; G230-F232 WeakPolarHBondContact O-CD2 3.34Å; G230-F232 PolarHBondContact O-N 3.42Å
231	R	53.5	Low	59.7	Low	162 Å²	162	99.3 Å²	99.3	61%	0.611	53%	0.526	S	S	*	.			trans	-61	97.4	171.8	-85.3	178.3	153.3	163.6	-4.9	110.4	Q233 P239	R231-Q233 PolarHBondContact O-N 3.01Å; R231-P239 PolarHBondContact NE-O 2.96Å; R231-P239 PolarHBondContact NH2-O 3.14Å
232	F	60.8	Low	61.2	Low	55 Å²	55	96.7 Å²	96.7	24%	0.241	50%	0.503	C	S	.	.			trans	-67.6	128	167.9	-55.3	-66.1	0	0	0	108.9	K194 D195 I197 L198 L229 G230 S234	K194-F232 WeakPolarHBondContact O-CD1 3.2Å; K194-F232 VanDerWaalsContact O-CE1 3.26Å; K194-F232 WeakPolarHBondContact O-CE1 3.35Å; D195-F232 HydrophobicContact CB-CB 4.12Å; I197-F232 HydrophobicContact CG2-CE2 3.84Å; I197-F232 HydrophobicContact CG2-CZ 4.08Å; L198-F232 HydrophobicContact CD1-CB 4.38Å; L198-F232 HydrophobicContact CD1-CD2 4.14Å; L198-F232 HydrophobicContact CG-CD2 4.19Å; L229-F232 HydrophobicContact CB-CE2 4.04Å; L229-F232 HydrophobicContact CB-CZ 4.36Å; L229-F232 HydrophobicContact CD2-CE2 3.92Å; L229-F232 HydrophobicContact CD2-CZ 4.22Å; G230-F232 WeakPolarHBondContact O-CD2 3.34Å; G230-F232 PolarHBondContact O-N 3.42Å; F232-S234 PolarHBondContact O-N 3.21Å
233	Q	61.8	Low	63	Low	198 Å²	198	87.7 Å²	87.7	93%	0.925	46%	0.464	S	S	*	.			trans	-83.3	71.3	171.3	-70	-173.6	-6.9	0	0	109.2	R231	R231-Q233 PolarHBondContact O-N 3.01Å
234	S	66.5	Low	65.2	Low	19 Å²	19	80.5 Å²	80.5	13%	0.133	43%	0.433	C	S	.	.			trans	-74.8	141.2	170.2	55.4	0	0	0	0	110.7	D195 F232 S236 F237	D195-S234 WeakPolarHBondContact OD2-CB 3.33Å; F232-S234 PolarHBondContact O-N 3.21Å; S234-S236 VanDerWaalsContact C-N 3.26Å; S234-F237 WeakPolarHBondContact OG-CA 3.21Å; S234-F237 WeakPolarHBondContact OG-CB 3.29Å; S234-F237 PolarHBondContact OG-N 2.78Å; S234-F237 PolarHBondContact OG-O 3.29Å
235	S	67.9	Low	67.8	Low	116 Å²	116	72.4 Å²	72.4	81%	0.811	39%	0.39	S	S	*	.	S	Bend	trans	-72.2	-22.1	163.8	57.3	0	0	0	0	112.7
236	S	80.2	Confident	70.2	Confident	59 Å²	59	66.1 Å²	66.1	41%	0.413	36%	0.357	S	S	.	.	S	Bend	trans	-93.2	-32.2	-171.4	-58.2	0	0	0	0	114.5	R171 S234	R171-S236 PolarHBondContact NH1-OG 3.01Å; S234-S236 VanDerWaalsContact C-N 3.26Å
237	F	83.5	Confident	72.7	Confident	30 Å²	30	54.2 Å²	54.2	13%	0.132	31%	0.312	C	S	.	.	S	Bend	trans	-114.5	154.2	178.8	-50.6	-81.3	0	0	0	111.4	L198 H199 N202 S234 I241 L246	L198-F237 HydrophobicContact CB-CD2 3.66Å; L198-F237 HydrophobicContact CB-CE2 3.41Å; L198-F237 VanDerWaalsContact CB-CE2 3.41Å; L198-F237 HydrophobicContact CB-CZ 4.09Å; L198-F237 HydrophobicContact CD1-CB 4.34Å; L198-F237 HydrophobicContact CD1-CD2 3.72Å; L198-F237 HydrophobicContact CD1-CE2 4.37Å; L198-F237 HydrophobicContact CD1-CG 4.22Å; L198-F237 HydrophobicContact CG-CD2 4.35Å; H199-F237 AromaticContact CE1-CE2 3.48Å; H199-F237 VanDerWaalsContact CE1-CE2 3.48Å; H199-F237 WeakPolarHBondContact CE1-CE2 3.44Å; H199-F237 AromaticContact ND1-CE2 3.68Å; H199-F237 AromaticContact ND1-CZ 3.95Å; H199-F237 AromaticContact NE2-CE2 3.94Å; N202-F237 HydrophobicContact CB-CE1 4.33Å; N202-F237 HydrophobicContact CB-CZ 3.98Å; S234-F237 WeakPolarHBondContact OG-CA 3.21Å; S234-F237 WeakPolarHBondContact OG-CB 3.29Å; S234-F237 PolarHBondContact OG-N 2.78Å; S234-F237 PolarHBondContact OG-O 3.29Å; F237-I241 HydrophobicContact CB-CD1 4.41Å; F237-L246 HydrophobicContact CD1-CD1 4.39Å; F237-L246 HydrophobicContact CD1-CD2 4.23Å; F237-L246 HydrophobicContact CE1-CD1 4.15Å; F237-L246 HydrophobicContact CE1-CD2 3.78Å; F237-L246 HydrophobicContact CZ-CD2 4Å
238	T	82.5	Confident	75	Confident	64 Å²	64	51.1 Å²	51.1	39%	0.393	28%	0.28	S	S	.	.			trans	-78.2	145.9	177.6	58.3	0	0	0	0	111.1	D240 I241	T238-D240 WeakPolarHBondContact CB-OD1 3.5Å; T238-D240 PolarHBondContact O-N 3.03Å; T238-D240 PolarHBondContact OG1-OD1 2.98Å; T238-I241 PolarHBondContact O-N 3.4Å; T238-I241 WeakPolarHBondContact OG1-CD1 3.46Å
239	P	77.5	Confident	77.5	Confident	62 Å²	62	46.7 Å²	46.7	40%	0.403	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	22.8	-170.9	30.7	-37.7	0	0	0	115.2	R231	R231-P239 PolarHBondContact NE-O 2.96Å; R231-P239 PolarHBondContact NH2-O 3.14Å
240	D	77.9	Confident	79.5	Confident	6 Å²	6	50.6 Å²	50.6	3%	0.032	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-8.5	169.5	61.8	-63	0	0	0	112.7	T238 L293 N296	T238-D240 WeakPolarHBondContact CB-OD1 3.5Å; T238-D240 PolarHBondContact O-N 3.03Å; T238-D240 PolarHBondContact OG1-OD1 2.98Å; D240-L293 HydrophobicContact CB-CB 3.81Å; D240-L293 HydrophobicContact CB-CD1 3.77Å; D240-L293 HydrophobicContact CB-CG 4.34Å; D240-L293 WeakPolarHBondContact OD2-CA 3.42Å; D240-L293 PolarHBondContact OD2-N 3.35Å; D240-N296 PolarHBondContact OD2-ND2 2.89Å
241	I	84.9	Confident	81.5	Confident	26 Å²	26	49.9 Å²	49.9	13%	0.133	26%	0.256	C	S	.	.			trans	-89	105.6	177.1	-61.3	175.2	0	0	0	109.8	F237 T238 L246	F237-I241 HydrophobicContact CB-CD1 4.41Å; T238-I241 PolarHBondContact O-N 3.4Å; T238-I241 WeakPolarHBondContact OG1-CD1 3.46Å; I241-L246 HydrophobicContact CG2-CB 3.79Å; I241-L246 HydrophobicContact CG2-CD1 4.23Å; I241-L246 HydrophobicContact CG2-CG 4.43Å
242	N	84.3	Confident	83.4	Confident	53 Å²	53	43.7 Å²	43.7	28%	0.283	23%	0.234	S	C	.	.			trans	-87.3	159.7	167.7	-63.5	1	0	0	0	110.2	I244 I245 L246	N242-I244 VanDerWaalsContact C-N 3.32Å; N242-I244 PolarHBondContact O-N 3.4Å; N242-I245 HydrophobicContact CB-CD1 4.22Å; N242-I245 HydrophobicContact CB-CG1 4.35Å; N242-I245 WeakPolarHBondContact O-CA 3.23Å; N242-I245 WeakPolarHBondContact O-CB 3.29Å; N242-I245 PolarHBondContact O-N 2.88Å; N242-L246 PolarHBondContact O-N 3.39Å
243	G	87.6	Confident	84.9	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-52.7	-43	-179.6	0	0	0	0	0	114.4	I245 L246 A247	G243-I245 VanDerWaalsContact C-N 3.32Å; G243-I245 PolarHBondContact O-N 3.18Å; G243-L246 PolarHBondContact O-N 3.48Å; G243-A247 WeakPolarHBondContact O-CB 3.36Å; G243-A247 PolarHBondContact O-N 2.93Å
244	I	90.3	Very high	86.4	Confident	6 Å²	6	38.4 Å²	38.4	3%	0.031	21%	0.212	C	C	.	.	H	α-helix	trans	-67.2	-28.2	175.6	-169.2	168.8	0	0	0	113.6	N242 A248 L256 L259 L260 D264 I266 F306	N242-I244 VanDerWaalsContact C-N 3.32Å; N242-I244 PolarHBondContact O-N 3.4Å; I244-A248 VanDerWaalsContact O-CB 3.31Å; I244-A248 WeakPolarHBondContact O-CB 3.38Å; I244-A248 PolarHBondContact O-N 3.39Å; I244-L256 HydrophobicContact CG1-CD2 4.39Å; I244-L259 HydrophobicContact CB-CD1 4.18Å; I244-L260 HydrophobicContact CD1-CD2 4.01Å; I244-L260 HydrophobicContact CD1-CG 4.36Å; I244-D264 HydrophobicContact CB-CB 4.39Å; I244-D264 HydrophobicContact CD1-CB 3.86Å; I244-D264 WeakPolarHBondContact CD1-O 3.49Å; I244-I266 HydrophobicContact CD1-CG1 4.15Å; I244-I266 HydrophobicContact CG1-CD1 4.22Å; I244-I266 HydrophobicContact CG1-CG1 4.03Å; I244-I266 HydrophobicContact CG2-CG1 3.96Å; I244-F306 HydrophobicContact CD1-CE2 4.4Å
245	I	91.8	Very high	87.6	Confident	10 Å²	10	37.5 Å²	37.5	5%	0.051	21%	0.206	C	C	.	.	H	α-helix	trans	-72.2	-43.9	174.1	-65.5	175.4	0	0	0	109.3	N242 G243 A248 H249 I266 A300	N242-I245 HydrophobicContact CB-CD1 4.22Å; N242-I245 HydrophobicContact CB-CG1 4.35Å; N242-I245 WeakPolarHBondContact O-CA 3.23Å; N242-I245 WeakPolarHBondContact O-CB 3.29Å; N242-I245 PolarHBondContact O-N 2.88Å; G243-I245 VanDerWaalsContact C-N 3.32Å; G243-I245 PolarHBondContact O-N 3.18Å; I245-A248 WeakPolarHBondContact O-CB 3.32Å; I245-A248 PolarHBondContact O-N 3.03Å; I245-H249 WeakPolarHBondContact CG2-NE2 3.28Å; I245-H249 PolarHBondContact O-CD2 3.03Å; I245-H249 PolarHBondContact O-N 3.35Å; I245-I266 HydrophobicContact CG1-CD1 4.24Å; I245-I266 HydrophobicContact CG1-CG1 4.5Å; I245-A300 HydrophobicContact CB-CB 4.45Å; I245-A300 HydrophobicContact CG2-CB 4.11Å
246	L	92.4	Very high	88.8	Confident	10 Å²	10	32 Å²	32	5%	0.052	17%	0.167	C	C	.	.	H	α-helix	trans	-64.9	-44.2	177.8	-169.7	59.4	0	0	0	112.1	L198 I201 N202 F237 I241 N242 G243 A248 H249 R250	L198-L246 HydrophobicContact CB-CD2 3.98Å; L198-L246 HydrophobicContact CD2-CD2 4.25Å; L198-L246 WeakPolarHBondContact O-CD2 3.14Å; I201-L246 HydrophobicContact CB-CD2 4.32Å; I201-L246 HydrophobicContact CG2-CB 4Å; I201-L246 HydrophobicContact CG2-CD2 4.15Å; I201-L246 HydrophobicContact CG2-CG 3.89Å; N202-L246 HydrophobicContact CB-CD2 4.4Å; F237-L246 HydrophobicContact CD1-CD1 4.39Å; F237-L246 HydrophobicContact CD1-CD2 4.23Å; F237-L246 HydrophobicContact CE1-CD1 4.15Å; F237-L246 HydrophobicContact CE1-CD2 3.78Å; F237-L246 HydrophobicContact CZ-CD2 4Å; I241-L246 HydrophobicContact CG2-CB 3.79Å; I241-L246 HydrophobicContact CG2-CD1 4.23Å; I241-L246 HydrophobicContact CG2-CG 4.43Å; N242-L246 PolarHBondContact O-N 3.39Å; G243-L246 PolarHBondContact O-N 3.48Å; L246-A248 PolarHBondContact O-N 2.94Å; L246-H249 WeakPolarHBondContact O-CB 3.47Å; L246-H249 PolarHBondContact O-N 2.55Å; L246-R250 PolarHBondContact O-N 3.28Å
247	A	93.6	Very high	89.4	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60.5	-33.8	174.8	0	0	0	0	0	112.4	I201 G243 D251 N252 I255 L256 L259	I201-A247 HydrophobicContact CG2-CB 3.78Å; G243-A247 WeakPolarHBondContact O-CB 3.36Å; G243-A247 PolarHBondContact O-N 2.93Å; A247-D251 PolarHBondContact O-N 2.78Å; A247-N252 PolarHBondContact O-N 2.72Å; A247-I255 HydrophobicContact CB-CB 4.45Å; A247-I255 HydrophobicContact CB-CG2 3.6Å; A247-L256 HydrophobicContact CB-CD2 3.84Å; A247-L256 HydrophobicContact CB-CG 4.08Å; A247-L259 HydrophobicContact CB-CD1 3.93Å
248	A	94.7	Very high	89.8	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-75.1	-31.2	173.7	0	0	0	0	0	112.8	I244 I245 L246 D251 L256 I266 A300 S303	I244-A248 VanDerWaalsContact O-CB 3.31Å; I244-A248 WeakPolarHBondContact O-CB 3.38Å; I244-A248 PolarHBondContact O-N 3.39Å; I245-A248 WeakPolarHBondContact O-CB 3.32Å; I245-A248 PolarHBondContact O-N 3.03Å; L246-A248 PolarHBondContact O-N 2.94Å; A248-D251 PolarHBondContact O-N 2.71Å; A248-L256 HydrophobicContact CB-CD2 4Å; A248-I266 HydrophobicContact CB-CD1 4.34Å; A248-A300 HydrophobicContact CB-CB 3.5Å; A248-A300 VanDerWaalsContact CB-CB 3.5Å; A248-S303 WeakPolarHBondContact O-CB 3.34Å; A248-S303 PolarHBondContact O-OG 2.62Å
249	H	94.7	Very high	90.2	Very high	43 Å²	43	30.7 Å²	30.7	20%	0.199	15%	0.15	C	C	.	.	H	α-helix	trans	-68.2	-40.2	173	-72.5	-162.2	0	0	0	111.3	I245 L246 D251 N296	I245-H249 WeakPolarHBondContact CG2-NE2 3.28Å; I245-H249 PolarHBondContact O-CD2 3.03Å; I245-H249 PolarHBondContact O-N 3.35Å; L246-H249 WeakPolarHBondContact O-CB 3.47Å; L246-H249 PolarHBondContact O-N 2.55Å; H249-D251 VanDerWaalsContact C-N 3.25Å; H249-D251 PolarHBondContact O-N 3.04Å; H249-N296 PolarHBondContact CE1-OD1 2.9Å; H249-N296 PolarHBondContact NE2-O 2.8Å
250	R	92.9	Very high	90.8	Very high	105 Å²	105	29.5 Å²	29.5	40%	0.396	14%	0.141	S	C	.	.	H	α-helix	trans	-70.7	-17.8	169.6	-66.1	-53	-169.8	114.7	-9.8	113.9	N202 D204 L246 N252	N202-R250 PolarHBondContact ND2-NH2 3.43Å; N202-R250 PolarHBondContact O-NH1 2.9Å; N202-R250 PolarHBondContact O-NH2 3.3Å; N202-R250 PolarHBondContact OD1-NH2 2.84Å; D204-R250 WeakPolarHBondContact OD1-CB 3.24Å; D204-R250 WeakPolarHBondContact OD2-CD 3.5Å; D204-R250 WeakPolarHBondContact OD2-CG 3.46Å; D204-R250 IonicContact OD2-CZ 3.66Å; D204-R250 IonicContact OD2-NE 3.28Å; D204-R250 IonicContact OD2-NH1 2.73Å; D204-R250 PolarHBondContact OD2-NH1 3.27Å; L246-R250 PolarHBondContact O-N 3.28Å; R250-N252 PolarHBondContact O-N 3.36Å
251	D	92.9	Very high	91.4	Very high	24 Å²	24	34.4 Å²	34.4	13%	0.128	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	27.2	177	-166.8	29.1	0	0	0	112.8	A247 A248 H249 S303 P304 S305 K885	A247-D251 PolarHBondContact O-N 2.78Å; A248-D251 PolarHBondContact O-N 2.71Å; H249-D251 VanDerWaalsContact C-N 3.25Å; H249-D251 PolarHBondContact O-N 3.04Å; D251-S303 WeakPolarHBondContact OD1-CB 3.42Å; D251-P304 WeakPolarHBondContact OD1-CD 3.34Å; D251-P304 WeakPolarHBondContact OD2-CD 3.37Å; D251-S305 WeakPolarHBondContact O-CB 3.12Å; D251-S305 PolarHBondContact O-OG 3.16Å; D251-S305 WeakPolarHBondContact OD1-CB 3.38Å; D251-S305 PolarHBondContact OD1-N 2.86Å; D251-S305 PolarHBondContact OD1-OG 3.44Å; D251-S305 VanDerWaalsContact OD1-OG 3.04Å; D251-K885 PolarHBondContact O-NZ 2.98Å; D251-K885 IonicContact OD1-NZ 2.91Å; D251-K885 PolarHBondContact OD1-NZ 2.94Å; D251-K885 IonicContact OD2-NZ 3.8Å; D251-K885 PolarHBondContact OD2-NZ 3.35Å
252	N	92.2	Very high	91.4	Very high	31 Å²	31	38.9 Å²	38.9	17%	0.166	18%	0.182	C	C	.	.			trans	-81.4	114.9	-178.9	-176.5	-31.5	0	0	0	111.4	D204 A247 R250 V254 I255 L256	D204-N252 PolarHBondContact O-ND2 3.28Å; D204-N252 WeakPolarHBondContact OD1-CB 3.44Å; D204-N252 PolarHBondContact OD1-ND2 2.8Å; A247-N252 PolarHBondContact O-N 2.72Å; R250-N252 PolarHBondContact O-N 3.36Å; N252-V254 VanDerWaalsContact C-N 3.35Å; N252-V254 PolarHBondContact O-N 3.32Å; N252-V254 PolarHBondContact OD1-N 3.49Å; N252-V254 VanDerWaalsContact OD1-N 3.11Å; N252-I255 HydrophobicContact CB-CB 4.39Å; N252-I255 HydrophobicContact CB-CD1 4.48Å; N252-I255 WeakPolarHBondContact ND2-CD1 3.28Å; N252-I255 PolarHBondContact OD1-N 2.88Å; N252-L256 VanDerWaalsContact O-CB 3.3Å; N252-L256 WeakPolarHBondContact O-CB 3.42Å; N252-L256 WeakPolarHBondContact O-CD1 3.42Å; N252-L256 VanDerWaalsContact O-CG 3.27Å; N252-L256 WeakPolarHBondContact O-CG 3.38Å; N252-L256 PolarHBondContact O-N 2.78Å; N252-L256 VanDerWaalsContact O-N 3.13Å
253	Y	92	Very high	91.4	Very high	76 Å²	76	38.6 Å²	38.6	30%	0.298	19%	0.192	S	C	.	.	H	α-helix	trans	-64.3	-35.1	-173.2	177.1	-96.2	0	0	0	113.6	K257 I308 L309 L882	Y253-K257 WeakPolarHBondContact O-CB 3.49Å; Y253-K257 PolarHBondContact O-N 3.32Å; Y253-K257 VanDerWaalsContact O-N 3.12Å; Y253-I308 HydrophobicContact CD2-CG2 4.44Å; Y253-I308 HydrophobicContact CE2-CG2 3.92Å; Y253-L309 HydrophobicContact CD2-CD1 3.97Å; Y253-L309 HydrophobicContact CD2-CD2 4.25Å; Y253-L309 HydrophobicContact CD2-CG 4.05Å; Y253-L309 HydrophobicContact CE2-CD1 4.07Å; Y253-L309 HydrophobicContact CE2-CD2 3.5Å; Y253-L309 VanDerWaalsContact CE2-CD2 3.5Å; Y253-L309 HydrophobicContact CE2-CG 3.7Å; Y253-L882 HydrophobicContact CD2-CD1 3.94Å; Y253-L882 HydrophobicContact CD2-CD2 3.62Å; Y253-L882 HydrophobicContact CD2-CG 4.45Å; Y253-L882 HydrophobicContact CE1-CD1 4.32Å; Y253-L882 HydrophobicContact CE2-CD1 3.5Å; Y253-L882 VanDerWaalsContact CE2-CD1 3.5Å; Y253-L882 HydrophobicContact CE2-CD2 4.06Å; Y253-L882 HydrophobicContact CE2-CG 4.45Å; Y253-L882 HydrophobicContact CG-CD1 4.5Å; Y253-L882 HydrophobicContact CG-CD2 4.03Å
254	V	93.2	Very high	91.2	Very high	66 Å²	66	39.8 Å²	39.8	40%	0.4	20%	0.198	S	C	.	.	H	α-helix	trans	-79.2	-47.5	-173.1	-167.7	0	0	0	0	110.4	V206 N252 L256 K257 L258	V206-V254 HydrophobicContact CG1-CB 4.28Å; V206-V254 HydrophobicContact CG1-CG1 3.57Å; V206-V254 HydrophobicContact CG2-CB 3.91Å; V206-V254 HydrophobicContact CG2-CG1 4.1Å; N252-V254 VanDerWaalsContact C-N 3.35Å; N252-V254 PolarHBondContact O-N 3.32Å; N252-V254 PolarHBondContact OD1-N 3.49Å; N252-V254 VanDerWaalsContact OD1-N 3.11Å; V254-L256 VanDerWaalsContact C-N 3.34Å; V254-L256 PolarHBondContact O-N 2.77Å; V254-K257 PolarHBondContact O-N 2.92Å; V254-K257 VanDerWaalsContact O-N 3.17Å; V254-L258 HydrophobicContact CG1-CD1 4.46Å; V254-L258 WeakPolarHBondContact O-CG 3.35Å; V254-L258 PolarHBondContact O-N 3.04Å
255	I	93	Very high	91	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-59	-45.9	175	-63.3	-178	0	0	0	110.8	I201 V206 V209 A247 N252 K257 L258 L259	I201-I255 HydrophobicContact CD1-CG2 4.39Å; I201-I255 HydrophobicContact CG1-CG2 3.89Å; I201-I255 HydrophobicContact CG2-CG2 4.26Å; V206-I255 HydrophobicContact CG2-CG1 4.2Å; V209-I255 HydrophobicContact CG1-CG2 4.39Å; V209-I255 HydrophobicContact CG2-CD1 4.15Å; V209-I255 HydrophobicContact CG2-CG1 4.45Å; A247-I255 HydrophobicContact CB-CB 4.45Å; A247-I255 HydrophobicContact CB-CG2 3.6Å; N252-I255 HydrophobicContact CB-CB 4.39Å; N252-I255 HydrophobicContact CB-CD1 4.48Å; N252-I255 WeakPolarHBondContact ND2-CD1 3.28Å; N252-I255 PolarHBondContact OD1-N 2.88Å; I255-K257 VanDerWaalsContact C-N 3.31Å; I255-K257 PolarHBondContact O-N 2.76Å; I255-L258 PolarHBondContact O-N 3.48Å; I255-L259 HydrophobicContact CG2-CD1 4.21Å; I255-L259 WeakPolarHBondContact O-CG 3.43Å; I255-L259 PolarHBondContact O-N 3.34Å; I255-L259 VanDerWaalsContact O-N 3.14Å
256	L	92.6	Very high	90.9	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.7	-42.2	176.2	-80	170.4	0	0	0	112.5	I244 A247 A248 N252 V254 L259 L260 S305 F306 L309	I244-L256 HydrophobicContact CG1-CD2 4.39Å; A247-L256 HydrophobicContact CB-CD2 3.84Å; A247-L256 HydrophobicContact CB-CG 4.08Å; A248-L256 HydrophobicContact CB-CD2 4Å; N252-L256 VanDerWaalsContact O-CB 3.3Å; N252-L256 WeakPolarHBondContact O-CB 3.42Å; N252-L256 WeakPolarHBondContact O-CD1 3.42Å; N252-L256 VanDerWaalsContact O-CG 3.27Å; N252-L256 WeakPolarHBondContact O-CG 3.38Å; N252-L256 PolarHBondContact O-N 2.78Å; N252-L256 VanDerWaalsContact O-N 3.13Å; V254-L256 VanDerWaalsContact C-N 3.34Å; V254-L256 PolarHBondContact O-N 2.77Å; L256-L259 PolarHBondContact O-N 2.9Å; L256-L260 WeakPolarHBondContact O-CB 3.18Å; L256-L260 WeakPolarHBondContact O-CD1 3.42Å; L256-L260 VanDerWaalsContact O-CG 3.27Å; L256-L260 WeakPolarHBondContact O-CG 3.14Å; L256-L260 PolarHBondContact O-N 2.85Å; L256-S305 VanDerWaalsContact CD1-CB 3.49Å; L256-F306 HydrophobicContact CD1-CB 4.29Å; L256-F306 HydrophobicContact CD2-CD2 4.29Å; L256-L309 HydrophobicContact CB-CD1 3.7Å
257	K	93.5	Very high	90.6	Very high	86 Å²	86	57.9 Å²	57.9	37%	0.374	27%	0.267	S	S	.	.	H	α-helix	trans	-64.4	-43.5	177.5	-175.5	178.1	179.5	-70	0	111.6	Y253 V254 I255 L259 L260 D261 L309	Y253-K257 WeakPolarHBondContact O-CB 3.49Å; Y253-K257 PolarHBondContact O-N 3.32Å; Y253-K257 VanDerWaalsContact O-N 3.12Å; V254-K257 PolarHBondContact O-N 2.92Å; V254-K257 VanDerWaalsContact O-N 3.17Å; I255-K257 VanDerWaalsContact C-N 3.31Å; I255-K257 PolarHBondContact O-N 2.76Å; K257-L259 VanDerWaalsContact C-N 3.3Å; K257-L259 PolarHBondContact O-N 2.96Å; K257-L260 PolarHBondContact O-N 3.29Å; K257-D261 IonicContact NZ-OD2 2.64Å; K257-D261 PolarHBondContact NZ-OD2 2.96Å; K257-D261 VanDerWaalsContact O-CB 3.3Å; K257-D261 WeakPolarHBondContact O-CB 3.46Å; K257-D261 VanDerWaalsContact O-CG 3.29Å; K257-D261 PolarHBondContact O-N 3.49Å; K257-L309 HydrophobicContact CB-CD1 4.12Å; K257-L309 HydrophobicContact CB-CD2 4.18Å; K257-L309 HydrophobicContact CG-CD2 4.3Å
258	L	91	Very high	90.3	Very high	40 Å²	40	63.1 Å²	63.1	21%	0.209	29%	0.29	C	S	.	.	H	α-helix	trans	-59.9	-38.1	178.1	-71.5	166.9	0	0	0	112.8	V206 E210 L213 V254 I255 R262	V206-L258 HydrophobicContact CG1-CD1 3.83Å; E210-L258 HydrophobicContact CG-CD1 3.54Å; E210-L258 HydrophobicContact CG-CD2 4.04Å; E210-L258 HydrophobicContact CG-CG 4.45Å; L213-L258 HydrophobicContact CD1-CB 4.43Å; V254-L258 HydrophobicContact CG1-CD1 4.46Å; V254-L258 WeakPolarHBondContact O-CG 3.35Å; V254-L258 PolarHBondContact O-N 3.04Å; I255-L258 PolarHBondContact O-N 3.48Å; L258-R262 WeakPolarHBondContact O-CD 3.38Å; L258-R262 VanDerWaalsContact O-CG 3.28Å; L258-R262 WeakPolarHBondContact O-CG 3.46Å; L258-R262 PolarHBondContact O-N 3.39Å
259	L	90.2	Very high	90.1	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-74.6	-42.5	176.6	-63	173.4	0	0	0	112	I201 L213 I244 A247 I255 L256 K257 R262 G263 D264	I201-L259 HydrophobicContact CD1-CD1 4.1Å; L213-L259 HydrophobicContact CD1-CD2 4.03Å; L213-L259 HydrophobicContact CD2-CD2 4.18Å; I244-L259 HydrophobicContact CB-CD1 4.18Å; A247-L259 HydrophobicContact CB-CD1 3.93Å; I255-L259 HydrophobicContact CG2-CD1 4.21Å; I255-L259 WeakPolarHBondContact O-CG 3.43Å; I255-L259 PolarHBondContact O-N 3.34Å; I255-L259 VanDerWaalsContact O-N 3.14Å; L256-L259 PolarHBondContact O-N 2.9Å; K257-L259 VanDerWaalsContact C-N 3.3Å; K257-L259 PolarHBondContact O-N 2.96Å; L259-R262 PolarHBondContact O-N 3.13Å; L259-G263 PolarHBondContact O-N 2.8Å; L259-D264 HydrophobicContact CB-CB 4.37Å; L259-D264 PolarHBondContact O-N 2.92Å; L259-D264 VanDerWaalsContact O-N 3.15Å
260	L	90.8	Very high	89.8	Confident	38 Å²	38	67.1 Å²	67.1	20%	0.199	31%	0.311	C	S	.	.	H	α-helix	trans	-65.5	-40	177.2	-73.6	167.2	0	0	0	112.6	I244 L256 K257 R262 G263 F306 L309 T310	I244-L260 HydrophobicContact CD1-CD2 4.01Å; I244-L260 HydrophobicContact CD1-CG 4.36Å; L256-L260 WeakPolarHBondContact O-CB 3.18Å; L256-L260 WeakPolarHBondContact O-CD1 3.42Å; L256-L260 VanDerWaalsContact O-CG 3.27Å; L256-L260 WeakPolarHBondContact O-CG 3.14Å; L256-L260 PolarHBondContact O-N 2.85Å; K257-L260 PolarHBondContact O-N 3.29Å; L260-R262 PolarHBondContact O-N 3.4Å; L260-G263 WeakPolarHBondContact O-CA 3.4Å; L260-G263 PolarHBondContact O-N 3.27Å; L260-F306 HydrophobicContact CD2-CE2 4.39Å; L260-L309 HydrophobicContact CD1-CB 3.53Å; L260-L309 HydrophobicContact CD1-CD1 3.96Å; L260-L309 HydrophobicContact CD1-CG 4.33Å; L260-T310 HydrophobicContact CD1-CG2 3.95Å; L260-T310 HydrophobicContact CD2-CG2 3.89Å
261	D	90	Very high	89.4	Confident	109 Å²	109	64.2 Å²	64.2	58%	0.583	30%	0.304	S	S	*	.	H	α-helix	trans	-65.7	-24.5	176.4	-75.3	-14.5	0	0	0	111.9	K257	K257-D261 IonicContact NZ-OD2 2.64Å; K257-D261 PolarHBondContact NZ-OD2 2.96Å; K257-D261 VanDerWaalsContact O-CB 3.3Å; K257-D261 WeakPolarHBondContact O-CB 3.46Å; K257-D261 VanDerWaalsContact O-CG 3.29Å; K257-D261 PolarHBondContact O-N 3.49Å
262	R	85.2	Confident	89	Confident	119 Å²	119	64.7 Å²	64.7	45%	0.449	31%	0.306	S	S	.	.	H	α-helix	trans	-81.9	-13.6	171.2	-70.4	172.5	68.2	85.9	-6.5	113.7	L213 T217 L258 L259 L260	L213-R262 PolarHBondContact O-NH1 3.08Å; T217-R262 PolarHBondContact OG1-NH1 3.14Å; T217-R262 PolarHBondContact OG1-NH2 3.36Å; L258-R262 WeakPolarHBondContact O-CD 3.38Å; L258-R262 VanDerWaalsContact O-CG 3.28Å; L258-R262 WeakPolarHBondContact O-CG 3.46Å; L258-R262 PolarHBondContact O-N 3.39Å; L259-R262 PolarHBondContact O-N 3.13Å; L260-R262 PolarHBondContact O-N 3.4Å
263	G	84.4	Confident	88.6	Confident	48 Å²	48	72.6 Å²	72.6	50%	0.495	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.1	5.9	176.7	0	0	0	0	0	115.9	L259 L260	L259-G263 PolarHBondContact O-N 2.8Å; L260-G263 WeakPolarHBondContact O-CA 3.4Å; L260-G263 PolarHBondContact O-N 3.27Å
264	D	84	Confident	88.4	Confident	24 Å²	24	71.1 Å²	71.1	13%	0.128	33%	0.334	C	S	.	.			trans	-62.9	140.6	172.2	-72.4	-51.9	0	0	0	110.6	L229 I244 L259	L229-D264 WeakPolarHBondContact CD1-OD1 3.46Å; L229-D264 VanDerWaalsContact CD1-OD2 3.23Å; L229-D264 WeakPolarHBondContact CD1-OD2 3.36Å; I244-D264 HydrophobicContact CB-CB 4.39Å; I244-D264 HydrophobicContact CD1-CB 3.86Å; I244-D264 WeakPolarHBondContact CD1-O 3.49Å; L259-D264 HydrophobicContact CB-CB 4.37Å; L259-D264 PolarHBondContact O-N 2.92Å; L259-D264 VanDerWaalsContact O-N 3.15Å
265	R	86.9	Confident	88.1	Confident	191 Å²	191	72 Å²	72	72%	0.721	35%	0.348	S	S	*	.			trans	-141.7	146	-178.3	-66.2	-174	-178.8	-159	-2	112.5
266	I	88.7	Confident	88	Confident	23 Å²	23	74 Å²	74	12%	0.118	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-95.3	119.3	170.4	-53.4	-176.3	0	0	0	108.4	I244 I245 A248 T297 A300 L301 F306	I244-I266 HydrophobicContact CD1-CG1 4.15Å; I244-I266 HydrophobicContact CG1-CD1 4.22Å; I244-I266 HydrophobicContact CG1-CG1 4.03Å; I244-I266 HydrophobicContact CG2-CG1 3.96Å; I245-I266 HydrophobicContact CG1-CD1 4.24Å; I245-I266 HydrophobicContact CG1-CG1 4.5Å; A248-I266 HydrophobicContact CB-CD1 4.34Å; I266-T297 HydrophobicContact CG2-CG2 3.74Å; I266-A300 HydrophobicContact CD1-CB 3.61Å; I266-L301 HydrophobicContact CB-CD2 4.14Å; I266-L301 HydrophobicContact CG2-CD2 3.79Å; I266-L301 HydrophobicContact CG2-CG 4.08Å; I266-F306 HydrophobicContact CB-CE2 4.19Å; I266-F306 HydrophobicContact CB-CZ 3.87Å; I266-F306 HydrophobicContact CD1-CD2 4.12Å; I266-F306 HydrophobicContact CD1-CE2 3.68Å; I266-F306 HydrophobicContact CD1-CZ 4.04Å; I266-F306 HydrophobicContact CG1-CE2 3.8Å; I266-F306 HydrophobicContact CG1-CZ 4.02Å
267	Y	86.6	Confident	88	Confident	192 Å²	192	79 Å²	79	75%	0.753	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-81.2	138.4	173.4	-62.8	-83.9	0	0	0	110.2
268	K	86.9	Confident	87.7	Confident	111 Å²	111	81.1 Å²	81.1	48%	0.483	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-62.3	132.8	170.5	-76.1	-160.1	170.4	-157.8	0	109.4	L301 E324	K268-L301 HydrophobicContact CG-CD1 4.16Å; K268-E324 IonicContact NZ-OE2 2.92Å; K268-E324 PolarHBondContact NZ-OE2 2.98Å
269	P	89.6	Confident	87.6	Confident	30 Å²	30	80 Å²	80	20%	0.195	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-70.6	158	177.8	31.7	-34.7	0	0	0	110.5	R294 T297 Y298	P269-R294 HydrophobicContact CB-CG 3.97Å; P269-R294 HydrophobicContact CG-CG 3.97Å; P269-T297 HydrophobicContact CG-CG2 4.29Å; P269-Y298 HydrophobicContact CG-CD2 3.93Å; P269-Y298 HydrophobicContact CG-CE1 4.29Å; P269-Y298 HydrophobicContact CG-CE2 3.32Å
270	H	88.6	Confident	87.6	Confident	96 Å²	96	82.5 Å²	82.5	44%	0.444	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-70.8	150.4	178.9	-61.6	173.7	0	0	0	112.2	C274 C279	H270-C274 HydrophobicContact CB-CB 3.76Å; H270-C279 PolarHBondContact ND1-SG 3.44Å
271	D	86	Confident	87.6	Confident	44 Å²	44	86.7 Å²	86.7	24%	0.235	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-51.2	141.6	170.4	-163.2	-34.3	0	0	0	110.5	R273 C274 K327 R1166	D271-R273 PolarHBondContact O-N 3.48Å; D271-C274 WeakPolarHBondContact O-CB 3.22Å; D271-C274 PolarHBondContact O-N 3.42Å; D271-K327 IonicContact OD2-NZ 2.83Å; D271-R1166 IonicContact OD2-CZ 3.4Å; D271-R1166 IonicContact OD2-NH1 3.63Å; D271-R1166 PolarHBondContact OD2-NH1 2.9Å; D271-R1166 IonicContact OD2-NH2 2.78Å
272	L	84.2	Confident	87.4	Confident	34 Å²	34	83 Å²	83	18%	0.178	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.5	-172.7	-47.9	77.9	0	0	0	113.1	L328 L331 E332	L272-L328 HydrophobicContact CD1-CD2 3.39Å; L272-L328 HydrophobicContact CG-CD2 4.37Å; L272-L331 HydrophobicContact CD1-CD1 3.93Å; L272-L331 HydrophobicContact CD2-CB 4.01Å; L272-E332 HydrophobicContact CD2-CG 3.55Å; L272-E332 WeakPolarHBondContact CD2-OE2 3.41Å
273	R	84	Confident	87.5	Confident	198 Å²	198	85.9 Å²	85.9	75%	0.747	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	9.5	177.9	-58.8	-173.1	179.7	-156.7	-1.5	113.4	D271 A275	D271-R273 PolarHBondContact O-N 3.48Å; R273-A275 PolarHBondContact O-N 2.87Å
274	C	87.6	Confident	87.8	Confident	44 Å²	44	94 Å²	94	30%	0.297	44%	0.441	S	S	.	.			trans	-67	117.8	177.7	-173.1	0	0	0	0	111.3	H270 D271 C276	H270-C274 HydrophobicContact CB-CB 3.76Å; D271-C274 WeakPolarHBondContact O-CB 3.22Å; D271-C274 PolarHBondContact O-N 3.42Å; C274-C276 VanDerWaalsContact C-N 3.34Å; C274-C276 VanDerWaalsContact SG-SG 3.64Å
275	A	86.9	Confident	88	Confident	84 Å²	84	98.6 Å²	98.6	69%	0.694	46%	0.462	S	S	*	.			trans	-90.1	12.7	-178.3	0	0	0	0	0	114.1	R273	R273-A275 PolarHBondContact O-N 2.87Å
276	C	91.3	Very high	87.9	Confident	42 Å²	42	94 Å²	94	28%	0.284	45%	0.451	S	S	.	.			trans	-67.3	155.3	-176.7	79.2	0	0	0	0	112.4	C274 I278 C279 T280	C274-C276 VanDerWaalsContact C-N 3.34Å; C274-C276 VanDerWaalsContact SG-SG 3.64Å; C276-I278 PolarHBondContact O-N 3.43Å; C276-I278 VanDerWaalsContact O-N 3.15Å; C276-C279 PolarHBondContact O-N 3.24Å; C276-C279 VanDerWaalsContact SG-SG 3.68Å; C276-T280 WeakPolarHBondContact O-CG2 3.18Å; C276-T280 PolarHBondContact O-N 2.97Å; C276-T280 PolarHBondContact O-OG1 3.28Å
277	N	91.2	Very high	87.8	Confident	106 Å²	106	94.6 Å²	94.6	57%	0.567	46%	0.463	S	S	*	.	H	α-helix	trans	-57.3	-32.9	-176.5	-66.2	-9	0	0	0	112.9	T280 K281	N277-T280 WeakPolarHBondContact CA-OG1 3.23Å; N277-T280 PolarHBondContact O-OG1 3.32Å; N277-K281 WeakPolarHBondContact O-CB 3.48Å; N277-K281 PolarHBondContact O-N 3.19Å
278	I	87.7	Confident	87.8	Confident	130 Å²	130	91.3 Å²	91.3	67%	0.667	46%	0.458	S	S	*	.	H	α-helix	trans	-68.5	-52	179.3	-55.1	173.5	0	0	0	110.8	C276 K281 A282	C276-I278 PolarHBondContact O-N 3.43Å; C276-I278 VanDerWaalsContact O-N 3.15Å; I278-K281 PolarHBondContact O-N 2.99Å; I278-A282 VanDerWaalsContact O-CB 3.32Å; I278-A282 WeakPolarHBondContact O-CB 3.35Å; I278-A282 PolarHBondContact O-N 3.13Å
279	C	89.2	Confident	87.8	Confident	18 Å²	18	88.9 Å²	88.9	12%	0.122	45%	0.448	C	S	.	.	H	α-helix	trans	-66.8	-40.7	179.8	-69.8	0	0	0	0	112.2	H270 C276 R283	H270-C279 PolarHBondContact ND1-SG 3.44Å; C276-C279 PolarHBondContact O-N 3.24Å; C276-C279 VanDerWaalsContact SG-SG 3.68Å; C279-R283 VanDerWaalsContact O-CB 3.23Å; C279-R283 WeakPolarHBondContact O-CB 3.28Å; C279-R283 PolarHBondContact O-N 3.08Å
280	T	89.8	Confident	87.7	Confident	51 Å²	51	89.1 Å²	89.1	31%	0.313	45%	0.447	S	S	.	.	H	α-helix	trans	-69.8	-36	178.7	54.2	0	0	0	0	112.5	C276 N277 R284	C276-T280 WeakPolarHBondContact O-CG2 3.18Å; C276-T280 PolarHBondContact O-N 2.97Å; C276-T280 PolarHBondContact O-OG1 3.28Å; N277-T280 WeakPolarHBondContact CA-OG1 3.23Å; N277-T280 PolarHBondContact O-OG1 3.32Å; T280-R284 WeakPolarHBondContact O-CB 3.43Å; T280-R284 VanDerWaalsContact O-CG 3.27Å; T280-R284 WeakPolarHBondContact O-CG 3.43Å; T280-R284 PolarHBondContact O-N 3.43Å
281	K	91	Very high	87.8	Confident	126 Å²	126	85.3 Å²	85.3	55%	0.548	43%	0.431	S	S	.	.	H	α-helix	trans	-65.1	-54.7	170.5	-178.2	175.4	176.2	179.8	0	111.3	N277 I278 R283 R284 E285	N277-K281 WeakPolarHBondContact O-CB 3.48Å; N277-K281 PolarHBondContact O-N 3.19Å; I278-K281 PolarHBondContact O-N 2.99Å; K281-R283 VanDerWaalsContact C-N 3.27Å; K281-R283 PolarHBondContact O-N 2.96Å; K281-R284 PolarHBondContact O-N 3.17Å; K281-E285 WeakPolarHBondContact CE-OE1 3.36Å; K281-E285 WeakPolarHBondContact CE-OE2 3.47Å; K281-E285 HydrophobicContact CG-CG 4.29Å; K281-E285 WeakPolarHBondContact CG-OE2 3.24Å; K281-E285 IonicContact NZ-OE1 3.84Å; K281-E285 PolarHBondContact O-N 2.91Å
282	A	86.5	Confident	88	Confident	31 Å²	31	85 Å²	85	26%	0.256	43%	0.431	S	S	.	.	H	α-helix	trans	-57.1	-38.6	-179.4	0	0	0	0	0	113	I278 N286 H290	I278-A282 VanDerWaalsContact O-CB 3.32Å; I278-A282 WeakPolarHBondContact O-CB 3.35Å; I278-A282 PolarHBondContact O-N 3.13Å; A282-N286 CarbonylContact O-C 3.48Å; A282-N286 PolarHBondContact O-N 3.06Å; A282-H290 HydrophobicContact CB-CB 4.49Å
283	R	87	Confident	88.3	Confident	180 Å²	180	86.3 Å²	86.3	68%	0.679	44%	0.438	S	S	*	.	H	α-helix	trans	-69.8	-31.2	175.9	-175	176.3	179.2	176.9	2.1	113.5	C279 K281	C279-R283 VanDerWaalsContact O-CB 3.23Å; C279-R283 WeakPolarHBondContact O-CB 3.28Å; C279-R283 PolarHBondContact O-N 3.08Å; K281-R283 VanDerWaalsContact C-N 3.27Å; K281-R283 PolarHBondContact O-N 2.96Å
284	R	89.3	Confident	88.6	Confident	219 Å²	219	77.7 Å²	77.7	83%	0.826	41%	0.405	S	S	*	.	H	α-helix	trans	-76.9	-36.1	175.3	-77.8	174.4	178.9	179.1	1.3	112.5	T280 K281	T280-R284 WeakPolarHBondContact O-CB 3.43Å; T280-R284 VanDerWaalsContact O-CG 3.27Å; T280-R284 WeakPolarHBondContact O-CG 3.43Å; T280-R284 PolarHBondContact O-N 3.43Å; K281-R284 PolarHBondContact O-N 3.17Å
285	E	88.7	Confident	88.9	Confident	121 Å²	121	75.9 Å²	75.9	57%	0.565	39%	0.392	S	S	*	.	H	α-helix	trans	-76.4	-62.3	179.8	-68.8	175.9	151.6	0	0	110.9	K281	K281-E285 WeakPolarHBondContact CE-OE1 3.36Å; K281-E285 WeakPolarHBondContact CE-OE2 3.47Å; K281-E285 HydrophobicContact CG-CG 4.29Å; K281-E285 WeakPolarHBondContact CG-OE2 3.24Å; K281-E285 IonicContact NZ-OE1 3.84Å; K281-E285 PolarHBondContact O-N 2.91Å
286	N	84.5	Confident	89.2	Confident	93 Å²	93	72.5 Å²	72.5	50%	0.497	36%	0.362	S	S	.	.	H	α-helix	trans	-138.4	79.6	-178.4	-77	-29.8	0	0	0	111	A282 L288 Q289 H290	A282-N286 CarbonylContact O-C 3.48Å; A282-N286 PolarHBondContact O-N 3.06Å; N286-L288 VanDerWaalsContact C-N 3.29Å; N286-L288 PolarHBondContact O-N 3.06Å; N286-Q289 HydrophobicContact CB-CB 3.63Å; N286-Q289 PolarHBondContact ND2-OE1 2.8Å; N286-Q289 PolarHBondContact O-N 3.38Å; N286-Q289 VanDerWaalsContact O-N 3.14Å; N286-H290 PolarHBondContact O-N 3.08Å
287	G	86.6	Confident	89.3	Confident	36 Å²	36	71 Å²	71	37%	0.371	35%	0.352	S	S	.	.	H	α-helix	trans	-52.1	-42.8	179.5	0	0	0	0	0	114.3	H290 S291	G287-H290 PolarHBondContact O-N 3.24Å; G287-S291 PolarHBondContact O-N 3.32Å; G287-S291 VanDerWaalsContact O-N 3.17Å; G287-S291 PolarHBondContact O-OG 2.83Å
288	L	87.8	Confident	89.5	Confident	124 Å²	124	66.1 Å²	66.1	65%	0.649	33%	0.326	S	S	*	.	H	α-helix	trans	-65.7	-46.8	176.8	178.3	61.1	0	0	0	112.2	N286 H290 S291 T292 F335	N286-L288 VanDerWaalsContact C-N 3.29Å; N286-L288 PolarHBondContact O-N 3.06Å; L288-H290 PolarHBondContact O-N 3.41Å; L288-S291 PolarHBondContact O-N 3.31Å; L288-S291 VanDerWaalsContact O-N 3.14Å; L288-S291 PolarHBondContact O-OG 2.85Å; L288-T292 PolarHBondContact O-N 2.86Å; L288-T292 PolarHBondContact O-OG1 2.89Å; L288-T292 VanDerWaalsContact O-OG1 3.06Å; L288-F335 HydrophobicContact CD1-CZ 4.5Å
289	Q	86.7	Confident	89.9	Confident	60 Å²	60	64 Å²	64	28%	0.28	31%	0.309	S	S	.	.	H	α-helix	trans	-60.9	-33.5	177.4	-168	-175.2	12.7	0	0	111.4	N286 L293	N286-Q289 HydrophobicContact CB-CB 3.63Å; N286-Q289 PolarHBondContact ND2-OE1 2.8Å; N286-Q289 PolarHBondContact O-N 3.38Å; N286-Q289 VanDerWaalsContact O-N 3.14Å; Q289-L293 VanDerWaalsContact O-CB 3.24Å; Q289-L293 WeakPolarHBondContact O-CB 3.45Å; Q289-L293 PolarHBondContact O-N 3.49Å
290	H	88.2	Confident	90.2	Very high	35 Å²	35	63.2 Å²	63.2	16%	0.162	30%	0.304	C	S	.	.	H	α-helix	trans	-69.5	-36.6	176.4	-176.9	62.8	0	0	0	113	A282 N286 G287 L288 R294	A282-H290 HydrophobicContact CB-CB 4.49Å; N286-H290 PolarHBondContact O-N 3.08Å; G287-H290 PolarHBondContact O-N 3.24Å; L288-H290 PolarHBondContact O-N 3.41Å; H290-R294 PolarHBondContact CD2-NH2 3.39Å; H290-R294 VanDerWaalsContact CD2-NH2 3.31Å; H290-R294 PolarHBondContact NE2-NH2 3.33Å; H290-R294 WeakPolarHBondContact O-CB 3.48Å; H290-R294 PolarHBondContact O-N 2.86Å
291	S	90	Very high	90.4	Very high	15 Å²	15	61.3 Å²	61.3	11%	0.105	29%	0.292	C	S	.	.	H	α-helix	trans	-73.2	-41.2	171.5	48.1	0	0	0	0	112.3	G287 L288 L293 R294 I295	G287-S291 PolarHBondContact O-N 3.32Å; G287-S291 VanDerWaalsContact O-N 3.17Å; G287-S291 PolarHBondContact O-OG 2.83Å; L288-S291 PolarHBondContact O-N 3.31Å; L288-S291 VanDerWaalsContact O-N 3.14Å; L288-S291 PolarHBondContact O-OG 2.85Å; S291-L293 PolarHBondContact O-N 3.48Å; S291-R294 WeakPolarHBondContact O-CB 3.44Å; S291-R294 PolarHBondContact O-N 2.66Å; S291-R294 VanDerWaalsContact O-N 3.1Å; S291-I295 PolarHBondContact O-N 3.49Å
292	T	90.4	Very high	90.7	Very high	39 Å²	39	55.4 Å²	55.4	24%	0.239	27%	0.266	C	S	.	.	H	α-helix	trans	-58.4	-48.8	175.1	-56.7	0	0	0	0	111.7	L288 R294 I295 N296	L288-T292 PolarHBondContact O-N 2.86Å; L288-T292 PolarHBondContact O-OG1 2.89Å; L288-T292 VanDerWaalsContact O-OG1 3.06Å; T292-R294 VanDerWaalsContact C-N 3.29Å; T292-R294 PolarHBondContact O-N 3.16Å; T292-I295 WeakPolarHBondContact O-CG2 3.35Å; T292-I295 PolarHBondContact O-N 3.39Å; T292-N296 WeakPolarHBondContact O-CB 3.39Å; T292-N296 PolarHBondContact O-N 2.88Å
293	L	89.3	Confident	91.1	Very high	61 Å²	61	53.9 Å²	53.9	32%	0.319	25%	0.254	S	S	.	.	H	α-helix	trans	-54.5	-44.8	172.3	169.1	63.6	0	0	0	111.7	D240 Q289 S291 T297	D240-L293 HydrophobicContact CB-CB 3.81Å; D240-L293 HydrophobicContact CB-CD1 3.77Å; D240-L293 HydrophobicContact CB-CG 4.34Å; D240-L293 WeakPolarHBondContact OD2-CA 3.42Å; D240-L293 PolarHBondContact OD2-N 3.35Å; Q289-L293 VanDerWaalsContact O-CB 3.24Å; Q289-L293 WeakPolarHBondContact O-CB 3.45Å; Q289-L293 PolarHBondContact O-N 3.49Å; S291-L293 PolarHBondContact O-N 3.48Å; L293-T297 VanDerWaalsContact O-CB 3.31Å; L293-T297 WeakPolarHBondContact O-CB 3.03Å; L293-T297 PolarHBondContact O-N 2.89Å; L293-T297 PolarHBondContact O-OG1 3.22Å
294	R	92	Very high	91.5	Very high	17 Å²	17	45.7 Å²	45.7	6%	0.064	22%	0.224	C	C	.	.	H	α-helix	trans	-63.9	-47.6	-178.9	-167.3	-171.1	-55.9	139.1	6.1	111.6	P269 H290 S291 T292 T297 Y298 E332	P269-R294 HydrophobicContact CB-CG 3.97Å; P269-R294 HydrophobicContact CG-CG 3.97Å; H290-R294 PolarHBondContact CD2-NH2 3.39Å; H290-R294 VanDerWaalsContact CD2-NH2 3.31Å; H290-R294 PolarHBondContact NE2-NH2 3.33Å; H290-R294 WeakPolarHBondContact O-CB 3.48Å; H290-R294 PolarHBondContact O-N 2.86Å; S291-R294 WeakPolarHBondContact O-CB 3.44Å; S291-R294 PolarHBondContact O-N 2.66Å; S291-R294 VanDerWaalsContact O-N 3.1Å; T292-R294 VanDerWaalsContact C-N 3.29Å; T292-R294 PolarHBondContact O-N 3.16Å; R294-T297 WeakPolarHBondContact O-CB 3.26Å; R294-T297 PolarHBondContact O-N 3.39Å; R294-Y298 HydrophobicContact CG-CD2 3.94Å; R294-Y298 HydrophobicContact CG-CE2 3.77Å; R294-Y298 VanDerWaalsContact O-CD2 3.27Å; R294-Y298 WeakPolarHBondContact O-CD2 3.49Å; R294-Y298 PolarHBondContact O-N 3.38Å; R294-E332 IonicContact CZ-OE1 3.26Å; R294-E332 IonicContact CZ-OE2 2.69Å; R294-E332 IonicContact NH1-OE1 3.94Å; R294-E332 PolarHBondContact NH1-OE1 2.87Å; R294-E332 IonicContact NH1-OE2 3.01Å; R294-E332 PolarHBondContact NH1-OE2 3.21Å
295	I	92.7	Very high	91.7	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-72.2	-36.6	-178	-162.6	157.9	0	0	0	112.1	S291 T292 T297 Y298 R299 F335 E338 Y339	S291-I295 PolarHBondContact O-N 3.49Å; T292-I295 WeakPolarHBondContact O-CG2 3.35Å; T292-I295 PolarHBondContact O-N 3.39Å; I295-T297 VanDerWaalsContact C-N 3.31Å; I295-T297 PolarHBondContact O-N 3.01Å; I295-Y298 PolarHBondContact O-N 3.37Å; I295-R299 VanDerWaalsContact O-CB 3.3Å; I295-R299 WeakPolarHBondContact O-CB 3.48Å; I295-R299 PolarHBondContact O-N 2.88Å; I295-F335 HydrophobicContact CD1-CB 3.73Å; I295-F335 HydrophobicContact CD1-CD1 4.08Å; I295-F335 HydrophobicContact CD1-CG 4.1Å; I295-E338 HydrophobicContact CD1-CB 3.6Å; I295-E338 HydrophobicContact CD1-CG 4.32Å; I295-E338 WeakPolarHBondContact CD1-OE2 3.49Å; I295-Y339 HydrophobicContact CD1-CE1 4.3Å; I295-Y339 HydrophobicContact CD1-CE2 4.22Å; I295-Y339 HydrophobicContact CG1-CE1 4.27Å
296	N	93.5	Very high	92	Very high	13 Å²	13	30.1 Å²	30.1	7%	0.07	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-37	170.5	-78	-24.5	0	0	0	112.2	D240 H249 T292 R299 A300	D240-N296 PolarHBondContact OD2-ND2 2.89Å; H249-N296 PolarHBondContact CE1-OD1 2.9Å; H249-N296 PolarHBondContact NE2-O 2.8Å; T292-N296 WeakPolarHBondContact O-CB 3.39Å; T292-N296 PolarHBondContact O-N 2.88Å; N296-R299 PolarHBondContact O-N 2.81Å; N296-A300 PolarHBondContact O-N 2.71Å; N296-A300 VanDerWaalsContact O-N 3.1Å
297	T	93.8	Very high	92.5	Very high	10 Å²	10	25.8 Å²	25.8	6%	0.061	14%	0.137	C	C	.	.	H	α-helix	trans	-64.4	-46.8	173.1	-57	0	0	0	0	111.2	I266 P269 L293 R294 I295 A300 L301	I266-T297 HydrophobicContact CG2-CG2 3.74Å; P269-T297 HydrophobicContact CG-CG2 4.29Å; L293-T297 VanDerWaalsContact O-CB 3.31Å; L293-T297 WeakPolarHBondContact O-CB 3.03Å; L293-T297 PolarHBondContact O-N 2.89Å; L293-T297 PolarHBondContact O-OG1 3.22Å; R294-T297 WeakPolarHBondContact O-CB 3.26Å; R294-T297 PolarHBondContact O-N 3.39Å; I295-T297 VanDerWaalsContact C-N 3.31Å; I295-T297 PolarHBondContact O-N 3.01Å; T297-A300 WeakPolarHBondContact O-CB 3.24Å; T297-A300 PolarHBondContact O-N 2.92Å; T297-L301 HydrophobicContact CG2-CD1 4.13Å; T297-L301 HydrophobicContact CG2-CG 4.45Å; T297-L301 WeakPolarHBondContact O-CG 3.2Å; T297-L301 PolarHBondContact O-N 3.11Å
298	Y	95.4	Very high	92.9	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.016	12%	0.123	C	C	.	.	H	α-helix	trans	-65.4	-38.9	175.9	-81.3	-66.3	0	0	0	112.8	P269 R294 I295 A300 L301 T302 E324 L325 L328 Y339	P269-Y298 HydrophobicContact CG-CD2 3.93Å; P269-Y298 HydrophobicContact CG-CE1 4.29Å; P269-Y298 HydrophobicContact CG-CE2 3.32Å; R294-Y298 HydrophobicContact CG-CD2 3.94Å; R294-Y298 HydrophobicContact CG-CE2 3.77Å; R294-Y298 VanDerWaalsContact O-CD2 3.27Å; R294-Y298 WeakPolarHBondContact O-CD2 3.49Å; R294-Y298 PolarHBondContact O-N 3.38Å; I295-Y298 PolarHBondContact O-N 3.37Å; Y298-A300 PolarHBondContact O-N 3.17Å; Y298-L301 HydrophobicContact CD1-CD1 4.24Å; Y298-L301 PolarHBondContact O-N 3.27Å; Y298-T302 WeakPolarHBondContact O-CB 3.02Å; Y298-T302 WeakPolarHBondContact O-CG2 3.4Å; Y298-T302 PolarHBondContact O-N 3Å; Y298-T302 PolarHBondContact O-OG1 3.15Å; Y298-E324 HydrophobicContact CE1-CG 4.32Å; Y298-E324 PolarHBondContact OH-OE1 3.15Å; Y298-L325 HydrophobicContact CD1-CD2 3.98Å; Y298-L325 HydrophobicContact CG-CD2 4.05Å; Y298-L328 HydrophobicContact CD1-CD1 4.36Å; Y298-L328 HydrophobicContact CD2-CD1 3.68Å; Y298-L328 HydrophobicContact CE1-CD1 4.03Å; Y298-L328 HydrophobicContact CE2-CD1 3.28Å; Y298-L328 HydrophobicContact CG-CD1 4.21Å; Y298-L328 VanDerWaalsContact CZ-CD1 3.48Å; Y298-Y339 HydrophobicContact CD2-CE1 4.21Å
299	R	95.6	Very high	93.1	Very high	87 Å²	87	21.3 Å²	21.3	33%	0.328	11%	0.105	S	C	.	.	H	α-helix	trans	-59.4	-32.2	174.3	-173.7	-177.7	-67.2	-179	-0.8	112.4	I295 N296 T302 E338 L342	I295-R299 VanDerWaalsContact O-CB 3.3Å; I295-R299 WeakPolarHBondContact O-CB 3.48Å; I295-R299 PolarHBondContact O-N 2.88Å; N296-R299 PolarHBondContact O-N 2.81Å; R299-T302 WeakPolarHBondContact CA-OG1 3.48Å; R299-T302 PolarHBondContact O-OG1 2.91Å; R299-E338 IonicContact CZ-OE2 3.67Å; R299-E338 IonicContact NH2-OE2 3.89Å; R299-E338 PolarHBondContact NH2-OE2 3.25Å; R299-L342 HydrophobicContact CB-CD1 4.16Å; R299-L342 HydrophobicContact CB-CD2 4.36Å; R299-L342 HydrophobicContact CG-CD2 4.2Å
300	A	95.2	Very high	93.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-75.7	-49.8	172	0	0	0	0	0	112.9	I245 A248 I266 N296 T297 Y298 T302 S303	I245-A300 HydrophobicContact CB-CB 4.45Å; I245-A300 HydrophobicContact CG2-CB 4.11Å; A248-A300 HydrophobicContact CB-CB 3.5Å; A248-A300 VanDerWaalsContact CB-CB 3.5Å; I266-A300 HydrophobicContact CD1-CB 3.61Å; N296-A300 PolarHBondContact O-N 2.71Å; N296-A300 VanDerWaalsContact O-N 3.1Å; T297-A300 WeakPolarHBondContact O-CB 3.24Å; T297-A300 PolarHBondContact O-N 2.92Å; Y298-A300 PolarHBondContact O-N 3.17Å; A300-T302 PolarHBondContact O-N 3.06Å; A300-T302 VanDerWaalsContact O-N 3.1Å; A300-S303 WeakPolarHBondContact O-CB 3.15Å; A300-S303 PolarHBondContact O-N 3.23Å; A300-S303 VanDerWaalsContact O-N 3.09Å; A300-S303 PolarHBondContact O-OG 2.83Å
301	L	95.3	Very high	93.5	Very high	12 Å²	12	21 Å²	21	6%	0.063	11%	0.11	C	C	.	.	H	α-helix	trans	-58.8	-24.6	179.2	-69.6	172.9	0	0	0	113.6	I266 K268 T297 Y298 F306 I307 L321	I266-L301 HydrophobicContact CB-CD2 4.14Å; I266-L301 HydrophobicContact CG2-CD2 3.79Å; I266-L301 HydrophobicContact CG2-CG 4.08Å; K268-L301 HydrophobicContact CG-CD1 4.16Å; T297-L301 HydrophobicContact CG2-CD1 4.13Å; T297-L301 HydrophobicContact CG2-CG 4.45Å; T297-L301 WeakPolarHBondContact O-CG 3.2Å; T297-L301 PolarHBondContact O-N 3.11Å; Y298-L301 HydrophobicContact CD1-CD1 4.24Å; Y298-L301 PolarHBondContact O-N 3.27Å; L301-F306 HydrophobicContact CD2-CD1 4.47Å; L301-F306 HydrophobicContact CD2-CE1 3.64Å; L301-F306 HydrophobicContact CD2-CZ 4.13Å; L301-I307 WeakPolarHBondContact O-CG1 3.23Å; L301-L321 HydrophobicContact CB-CD2 4.48Å; L301-L321 VanDerWaalsContact O-CD1 3.3Å; L301-L321 WeakPolarHBondContact O-CD1 3.29Å
302	T	95.7	Very high	93.4	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.006	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	4.9	-178.5	52.7	0	0	0	0	114.1	Y298 R299 A300 L325 L342	Y298-T302 WeakPolarHBondContact O-CB 3.02Å; Y298-T302 WeakPolarHBondContact O-CG2 3.4Å; Y298-T302 PolarHBondContact O-N 3Å; Y298-T302 PolarHBondContact O-OG1 3.15Å; R299-T302 WeakPolarHBondContact CA-OG1 3.48Å; R299-T302 PolarHBondContact O-OG1 2.91Å; A300-T302 PolarHBondContact O-N 3.06Å; A300-T302 VanDerWaalsContact O-N 3.1Å; T302-L325 HydrophobicContact CG2-CD1 3.44Å; T302-L325 VanDerWaalsContact CG2-CD1 3.44Å; T302-L325 HydrophobicContact CG2-CD2 4.22Å; T302-L325 HydrophobicContact CG2-CG 4.36Å; T302-L342 HydrophobicContact CG2-CB 4.45Å
303	S	94.8	Very high	93.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.			trans	-77	126.9	177.8	63.4	0	0	0	0	111.9	A248 D251 A300 S305 F306 I307	A248-S303 WeakPolarHBondContact O-CB 3.34Å; A248-S303 PolarHBondContact O-OG 2.62Å; D251-S303 WeakPolarHBondContact OD1-CB 3.42Å; A300-S303 WeakPolarHBondContact O-CB 3.15Å; A300-S303 PolarHBondContact O-N 3.23Å; A300-S303 VanDerWaalsContact O-N 3.09Å; A300-S303 PolarHBondContact O-OG 2.83Å; S303-S305 VanDerWaalsContact C-N 3.29Å; S303-S305 PolarHBondContact O-N 3.09Å; S303-F306 PolarHBondContact O-N 3Å; S303-F306 VanDerWaalsContact O-N 3.12Å; S303-F306 WeakPolarHBondContact OG-CB 3.39Å; S303-I307 WeakPolarHBondContact O-CG1 3.24Å; S303-I307 PolarHBondContact O-N 3.47Å
304	P	95.4	Very high	93.6	Very high	8 Å²	8	23 Å²	23	5%	0.052	12%	0.119	C	C	.	.	H	α-helix	trans	-44.4	-47.3	177.1	-35.7	36.4	0	0	0	115.1	D251 I308 F349 Y881	D251-P304 WeakPolarHBondContact OD1-CD 3.34Å; D251-P304 WeakPolarHBondContact OD2-CD 3.37Å; P304-I308 WeakPolarHBondContact O-CB 3.4Å; P304-I308 WeakPolarHBondContact O-CD1 3.18Å; P304-I308 WeakPolarHBondContact O-CG1 3.31Å; P304-I308 PolarHBondContact O-N 2.95Å; P304-F349 HydrophobicContact CB-CD2 3.57Å; P304-F349 HydrophobicContact CB-CE2 3.7Å; P304-F349 HydrophobicContact CB-CG 4.44Å; P304-F349 HydrophobicContact CG-CB 4.42Å; P304-F349 HydrophobicContact CG-CD2 3.82Å; P304-F349 HydrophobicContact CG-CE2 4.44Å; P304-F349 HydrophobicContact CG-CG 4.33Å; P304-Y881 HydrophobicContact CB-CE1 4.12Å
305	S	93.9	Very high	93.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-66.4	-39.4	-178.6	-61.1	0	0	0	0	112.5	D251 L256 S303 L309 K885	D251-S305 WeakPolarHBondContact O-CB 3.12Å; D251-S305 PolarHBondContact O-OG 3.16Å; D251-S305 WeakPolarHBondContact OD1-CB 3.38Å; D251-S305 PolarHBondContact OD1-N 2.86Å; D251-S305 PolarHBondContact OD1-OG 3.44Å; D251-S305 VanDerWaalsContact OD1-OG 3.04Å; L256-S305 VanDerWaalsContact CD1-CB 3.49Å; S303-S305 VanDerWaalsContact C-N 3.29Å; S303-S305 PolarHBondContact O-N 3.09Å; S305-L309 WeakPolarHBondContact O-CB 3.41Å; S305-L309 WeakPolarHBondContact O-CD1 3.44Å; S305-L309 WeakPolarHBondContact O-CG 3.2Å; S305-L309 PolarHBondContact O-N 2.88Å; S305-L309 VanDerWaalsContact O-N 3.09Å; S305-K885 PolarHBondContact OG-NZ 2.99Å
306	F	94.8	Very high	93.7	Very high	13 Å²	13	23.2 Å²	23.2	6%	0.057	12%	0.121	C	C	.	.	H	α-helix	trans	-68	-47.5	176.7	-177	-91.9	0	0	0	111.1	I244 L256 L260 I266 L301 S303 I308 L309 T310	I244-F306 HydrophobicContact CD1-CE2 4.4Å; L256-F306 HydrophobicContact CD1-CB 4.29Å; L256-F306 HydrophobicContact CD2-CD2 4.29Å; L260-F306 HydrophobicContact CD2-CE2 4.39Å; I266-F306 HydrophobicContact CB-CE2 4.19Å; I266-F306 HydrophobicContact CB-CZ 3.87Å; I266-F306 HydrophobicContact CD1-CD2 4.12Å; I266-F306 HydrophobicContact CD1-CE2 3.68Å; I266-F306 HydrophobicContact CD1-CZ 4.04Å; I266-F306 HydrophobicContact CG1-CE2 3.8Å; I266-F306 HydrophobicContact CG1-CZ 4.02Å; L301-F306 HydrophobicContact CD2-CD1 4.47Å; L301-F306 HydrophobicContact CD2-CE1 3.64Å; L301-F306 HydrophobicContact CD2-CZ 4.13Å; S303-F306 PolarHBondContact O-N 3Å; S303-F306 VanDerWaalsContact O-N 3.12Å; S303-F306 WeakPolarHBondContact OG-CB 3.39Å; F306-I308 VanDerWaalsContact C-N 3.26Å; F306-I308 PolarHBondContact O-N 2.82Å; F306-L309 PolarHBondContact O-N 3.39Å; F306-L309 VanDerWaalsContact O-N 3.08Å; F306-T310 HydrophobicContact CD1-CG2 4.23Å; F306-T310 HydrophobicContact CD2-CG2 4.09Å; F306-T310 HydrophobicContact CE1-CG2 3.91Å; F306-T310 HydrophobicContact CE2-CG2 3.77Å; F306-T310 HydrophobicContact CG-CG2 4.31Å; F306-T310 HydrophobicContact CZ-CG2 3.67Å; F306-T310 PolarHBondContact O-N 3.2Å; F306-T310 PolarHBondContact O-OG1 3.3Å
307	I	95.3	Very high	93.7	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-57.4	-43.3	177.6	-61.9	170.3	0	0	0	110.2	L301 S303 L309 S311 P314 T317 L321 F349	L301-I307 WeakPolarHBondContact O-CG1 3.23Å; S303-I307 WeakPolarHBondContact O-CG1 3.24Å; S303-I307 PolarHBondContact O-N 3.47Å; I307-L309 PolarHBondContact O-N 2.91Å; I307-S311 WeakPolarHBondContact O-CB 3.43Å; I307-S311 PolarHBondContact O-N 2.93Å; I307-S311 VanDerWaalsContact O-N 3.1Å; I307-S311 PolarHBondContact O-OG 2.95Å; I307-P314 HydrophobicContact CG2-CB 3.77Å; I307-T317 HydrophobicContact CG2-CG2 4.08Å; I307-L321 HydrophobicContact CD1-CD1 4.02Å; I307-L321 HydrophobicContact CG1-CD1 4.27Å; I307-F349 HydrophobicContact CB-CE1 4.25Å; I307-F349 HydrophobicContact CB-CZ 4.35Å; I307-F349 HydrophobicContact CD1-CD1 4.38Å; I307-F349 HydrophobicContact CD1-CE1 4.26Å; I307-F349 HydrophobicContact CG2-CE1 3.84Å; I307-F349 HydrophobicContact CG2-CZ 4.2Å
308	I	94.4	Very high	93.8	Very high	17 Å²	17	23.9 Å²	23.9	9%	0.087	13%	0.126	C	C	.	.	H	α-helix	trans	-58.5	-44	175.3	-79.1	168.1	0	0	0	112.8	Y253 P304 F306 F349 M353 T878 Y881 L882	Y253-I308 HydrophobicContact CD2-CG2 4.44Å; Y253-I308 HydrophobicContact CE2-CG2 3.92Å; P304-I308 WeakPolarHBondContact O-CB 3.4Å; P304-I308 WeakPolarHBondContact O-CD1 3.18Å; P304-I308 WeakPolarHBondContact O-CG1 3.31Å; P304-I308 PolarHBondContact O-N 2.95Å; F306-I308 VanDerWaalsContact C-N 3.26Å; F306-I308 PolarHBondContact O-N 2.82Å; I308-F349 HydrophobicContact CD1-CE2 4.09Å; I308-F349 HydrophobicContact CD1-CZ 4.45Å; I308-F349 HydrophobicContact CG1-CE2 4.18Å; I308-F349 HydrophobicContact CG1-CZ 4.04Å; I308-M353 HydrophobicContact CD1-CE 3.57Å; I308-M353 HydrophobicContact CG1-CE 3.71Å; I308-T878 HydrophobicContact CB-CG2 4.33Å; I308-T878 HydrophobicContact CD1-CG2 4.32Å; I308-T878 HydrophobicContact CG1-CG2 4.08Å; I308-T878 HydrophobicContact CG2-CG2 3.44Å; I308-T878 VanDerWaalsContact CG2-CG2 3.44Å; I308-Y881 HydrophobicContact CD1-CD1 3.64Å; I308-Y881 HydrophobicContact CD1-CE1 3.98Å; I308-L882 HydrophobicContact CD1-CD2 3.83Å; I308-L882 HydrophobicContact CD1-CG 4.18Å; I308-L882 HydrophobicContact CG2-CD1 4.27Å
309	L	93.1	Very high	93.8	Very high	50 Å²	50	23.7 Å²	23.7	26%	0.262	13%	0.125	S	C	.	.	H	α-helix	trans	-80.3	-27.5	-174.3	-73.5	165.2	0	0	0	113.2	Y253 L256 K257 L260 S305 F306 I307	Y253-L309 HydrophobicContact CD2-CD1 3.97Å; Y253-L309 HydrophobicContact CD2-CD2 4.25Å; Y253-L309 HydrophobicContact CD2-CG 4.05Å; Y253-L309 HydrophobicContact CE2-CD1 4.07Å; Y253-L309 HydrophobicContact CE2-CD2 3.5Å; Y253-L309 VanDerWaalsContact CE2-CD2 3.5Å; Y253-L309 HydrophobicContact CE2-CG 3.7Å; L256-L309 HydrophobicContact CB-CD1 3.7Å; K257-L309 HydrophobicContact CB-CD1 4.12Å; K257-L309 HydrophobicContact CB-CD2 4.18Å; K257-L309 HydrophobicContact CG-CD2 4.3Å; L260-L309 HydrophobicContact CD1-CB 3.53Å; L260-L309 HydrophobicContact CD1-CD1 3.96Å; L260-L309 HydrophobicContact CD1-CG 4.33Å; S305-L309 WeakPolarHBondContact O-CB 3.41Å; S305-L309 WeakPolarHBondContact O-CD1 3.44Å; S305-L309 WeakPolarHBondContact O-CG 3.2Å; S305-L309 PolarHBondContact O-N 2.88Å; S305-L309 VanDerWaalsContact O-N 3.09Å; F306-L309 PolarHBondContact O-N 3.39Å; F306-L309 VanDerWaalsContact O-N 3.08Å; I307-L309 PolarHBondContact O-N 2.91Å
310	T	92.4	Very high	93.7	Very high	68 Å²	68	22.8 Å²	22.8	42%	0.417	13%	0.125	S	C	.	.	H	α-helix	trans	-105	-14	-173.7	65.7	0	0	0	0	115.5	L260 F306	L260-T310 HydrophobicContact CD1-CG2 3.95Å; L260-T310 HydrophobicContact CD2-CG2 3.89Å; F306-T310 HydrophobicContact CD1-CG2 4.23Å; F306-T310 HydrophobicContact CD2-CG2 4.09Å; F306-T310 HydrophobicContact CE1-CG2 3.91Å; F306-T310 HydrophobicContact CE2-CG2 3.77Å; F306-T310 HydrophobicContact CG-CG2 4.31Å; F306-T310 HydrophobicContact CZ-CG2 3.67Å; F306-T310 PolarHBondContact O-N 3.2Å; F306-T310 PolarHBondContact O-OG1 3.3Å
311	S	90.4	Very high	93.7	Very high	20 Å²	20	23 Å²	23	14%	0.14	13%	0.126	C	C	.	.			trans	-114.8	136.4	-173.9	74	0	0	0	0	113.7	I307 D313 P314 T317	I307-S311 WeakPolarHBondContact O-CB 3.43Å; I307-S311 PolarHBondContact O-N 2.93Å; I307-S311 VanDerWaalsContact O-N 3.1Å; I307-S311 PolarHBondContact O-OG 2.95Å; S311-D313 PolarHBondContact O-N 3.29Å; S311-P314 VanDerWaalsContact OG-CA 3.23Å; S311-P314 WeakPolarHBondContact OG-CA 3.41Å; S311-T317 WeakPolarHBondContact CB-OG1 3.23Å
312	N	87.4	Confident	93.7	Very high	135 Å²	135	22.5 Å²	22.5	72%	0.722	12%	0.123	S	C	*	.	S	Bend	trans	-72.1	-13.7	170.7	-65.5	-24.9	0	0	0	112.5	Q871	N312-Q871 PolarHBondContact O-NE2 2.96Å; N312-Q871 PolarHBondContact O-OE1 3.03Å
313	D	90.2	Very high	93.7	Very high	17 Å²	17	29 Å²	29	9%	0.091	15%	0.147	C	C	.	.			trans	-146.7	81.4	-177.9	-176.4	-13	0	0	0	109.7	S311 I315 L316 T317 R399 Y870	S311-D313 PolarHBondContact O-N 3.29Å; D313-I315 PolarHBondContact O-N 3.48Å; D313-I315 VanDerWaalsContact O-N 3.14Å; D313-I315 PolarHBondContact OD1-N 3.22Å; D313-L316 HydrophobicContact CB-CB 4.03Å; D313-L316 PolarHBondContact O-N 3.41Å; D313-L316 PolarHBondContact OD1-N 2.98Å; D313-L316 VanDerWaalsContact OD2-CB 3.29Å; D313-L316 WeakPolarHBondContact OD2-CB 3.44Å; D313-T317 PolarHBondContact O-N 3.2Å; D313-T317 PolarHBondContact O-OG1 3.41Å; D313-R399 IonicContact OD1-CZ 2.71Å; D313-R399 IonicContact OD1-NH1 2.66Å; D313-R399 IonicContact OD1-NH2 3.75Å; D313-R399 IonicContact OD2-CZ 3.67Å; D313-R399 IonicContact OD2-NH1 3.79Å; D313-R399 PolarHBondContact OD2-NH1 3.22Å; D313-R399 IonicContact OD2-NH2 3.71Å; D313-R399 PolarHBondContact OD2-NH2 2.88Å; D313-Y870 VanDerWaalsContact CG-OH 3.31Å; D313-Y870 PolarHBondContact OD1-OH 2.97Å
314	P	94.2	Very high	93.6	Very high	4 Å²	4	31.1 Å²	31.1	3%	0.026	16%	0.158	C	C	.	.	H	α-helix	trans	-63.2	-20.8	-177.2	22.9	-34.4	0	0	0	113.5	I307 S311 A318 F349 M874	I307-P314 HydrophobicContact CG2-CB 3.77Å; S311-P314 VanDerWaalsContact OG-CA 3.23Å; S311-P314 WeakPolarHBondContact OG-CA 3.41Å; P314-A318 VanDerWaalsContact O-CB 3.24Å; P314-A318 WeakPolarHBondContact O-CB 3.48Å; P314-A318 PolarHBondContact O-N 3.38Å; P314-A318 VanDerWaalsContact O-N 3.12Å; P314-F349 HydrophobicContact CB-CE1 4.06Å; P314-F349 HydrophobicContact CB-CZ 3.98Å; P314-M874 HydrophobicContact CG-CE 3.62Å
315	I	93.9	Very high	93.6	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-76.6	-42.7	177.6	-63.5	173.8	0	0	0	110.1	D313 F319 M353 V366 F411 M874	D313-I315 PolarHBondContact O-N 3.48Å; D313-I315 VanDerWaalsContact O-N 3.14Å; D313-I315 PolarHBondContact OD1-N 3.22Å; I315-F319 HydrophobicContact CG2-CD2 4.36Å; I315-F319 HydrophobicContact CG2-CE1 4Å; I315-F319 HydrophobicContact CG2-CE2 3.75Å; I315-F319 HydrophobicContact CG2-CZ 3.55Å; I315-F319 WeakPolarHBondContact O-CD1 3.45Å; I315-F319 WeakPolarHBondContact O-CG 3.31Å; I315-F319 PolarHBondContact O-N 3.14Å; I315-F319 VanDerWaalsContact O-N 3.11Å; I315-M353 HydrophobicContact CG1-CB 4.37Å; I315-V366 HydrophobicContact CD1-CG1 3.73Å; I315-F411 HydrophobicContact CG2-CE2 4.04Å; I315-F411 HydrophobicContact CG2-CZ 4.33Å; I315-M874 HydrophobicContact CD1-CE 3.75Å; I315-M874 HydrophobicContact CD1-SD 4.15Å; I315-M874 HydrophobicContact CG1-CE 3.91Å
316	L	92.6	Very high	93.6	Very high	27 Å²	27	35.2 Å²	35.2	14%	0.141	18%	0.175	C	C	.	.	H	α-helix	trans	-63.5	-50.4	173.1	-177.2	62.7	0	0	0	111.6	D313 A318 F319 E320 T371 L402	D313-L316 HydrophobicContact CB-CB 4.03Å; D313-L316 PolarHBondContact O-N 3.41Å; D313-L316 PolarHBondContact OD1-N 2.98Å; D313-L316 VanDerWaalsContact OD2-CB 3.29Å; D313-L316 WeakPolarHBondContact OD2-CB 3.44Å; L316-A318 PolarHBondContact O-N 3.25Å; L316-F319 WeakPolarHBondContact O-CA 3.45Å; L316-F319 WeakPolarHBondContact O-CB 3.07Å; L316-F319 PolarHBondContact O-N 3.37Å; L316-E320 HydrophobicContact CD1-CG 4.19Å; L316-E320 HydrophobicContact CG-CG 4.29Å; L316-E320 WeakPolarHBondContact CG-OE1 3.43Å; L316-E320 PolarHBondContact O-N 3.44Å; L316-T371 HydrophobicContact CD2-CG2 3.94Å; L316-L402 HydrophobicContact CD1-CD2 3.72Å
317	T	94	Very high	93.6	Very high	36 Å²	36	38.5 Å²	38.5	22%	0.221	19%	0.189	C	C	.	.	H	α-helix	trans	-59.9	-37.1	-178.5	-59.3	0	0	0	0	111.4	I307 S311 D313 L321	I307-T317 HydrophobicContact CG2-CG2 4.08Å; S311-T317 WeakPolarHBondContact CB-OG1 3.23Å; D313-T317 PolarHBondContact O-N 3.2Å; D313-T317 PolarHBondContact O-OG1 3.41Å; T317-L321 HydrophobicContact CG2-CD1 3.88Å; T317-L321 HydrophobicContact CG2-CG 4.32Å; T317-L321 VanDerWaalsContact O-CB 3.28Å; T317-L321 WeakPolarHBondContact O-CB 3.36Å; T317-L321 VanDerWaalsContact O-CG 3.23Å; T317-L321 WeakPolarHBondContact O-CG 3.26Å; T317-L321 PolarHBondContact O-N 3.45Å
318	A	95.7	Very high	93.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66.5	-38.3	172.5	0	0	0	0	0	113.6	P314 L316 S322 F349 A350	P314-A318 VanDerWaalsContact O-CB 3.24Å; P314-A318 WeakPolarHBondContact O-CB 3.48Å; P314-A318 PolarHBondContact O-N 3.38Å; P314-A318 VanDerWaalsContact O-N 3.12Å; L316-A318 PolarHBondContact O-N 3.25Å; A318-S322 WeakPolarHBondContact O-CB 3.47Å; A318-S322 PolarHBondContact O-N 3.4Å; A318-S322 PolarHBondContact O-OG 3.01Å; A318-F349 HydrophobicContact CB-CD1 3.78Å; A318-F349 HydrophobicContact CB-CE1 4.15Å; A318-A350 HydrophobicContact CB-CB 4.14Å
319	F	94.7	Very high	93.3	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-67.8	-41.5	175.7	-66.7	-10.6	0	0	0	112.5	I315 L316 S322 W323 A350 R399 A403 Y406 Q408 F411	I315-F319 HydrophobicContact CG2-CD2 4.36Å; I315-F319 HydrophobicContact CG2-CE1 4Å; I315-F319 HydrophobicContact CG2-CE2 3.75Å; I315-F319 HydrophobicContact CG2-CZ 3.55Å; I315-F319 WeakPolarHBondContact O-CD1 3.45Å; I315-F319 WeakPolarHBondContact O-CG 3.31Å; I315-F319 PolarHBondContact O-N 3.14Å; I315-F319 VanDerWaalsContact O-N 3.11Å; L316-F319 WeakPolarHBondContact O-CA 3.45Å; L316-F319 WeakPolarHBondContact O-CB 3.07Å; L316-F319 PolarHBondContact O-N 3.37Å; F319-S322 PolarHBondContact O-OG 2.65Å; F319-W323 WeakPolarHBondContact O-CB 3.16Å; F319-W323 PolarHBondContact O-N 3.38Å; F319-W323 VanDerWaalsContact O-N 3.15Å; F319-A350 HydrophobicContact CD1-CB 4.16Å; F319-A350 HydrophobicContact CE1-CB 3.73Å; F319-R399 HydrophobicContact CE2-CG 4.44Å; F319-A403 HydrophobicContact CD2-CB 4.45Å; F319-A403 HydrophobicContact CE2-CB 3.64Å; F319-A403 HydrophobicContact CZ-CB 3.74Å; F319-Y406 HydrophobicContact CB-CD2 3.7Å; F319-Y406 HydrophobicContact CB-CE2 4.18Å; F319-Y406 HydrophobicContact CB-CG 4.22Å; F319-Y406 HydrophobicContact CD2-CD2 4.35Å; F319-Y406 HydrophobicContact CG-CD2 4.42Å; F319-Q408 HydrophobicContact CD1-CG 3.52Å; F319-Q408 HydrophobicContact CE1-CB 4.21Å; F319-Q408 HydrophobicContact CE1-CG 3.65Å; F319-Q408 HydrophobicContact CG-CG 3.98Å; F319-Q408 HydrophobicContact CZ-CG 4.24Å; F319-F411 HydrophobicContact CE1-CB 4.5Å; F319-F411 AromaticContact CE1-CD2 3.96Å; F319-F411 HydrophobicContact CE1-CD2 3.96Å; F319-F411 HydrophobicContact CE1-CE2 4.29Å; F319-F411 HydrophobicContact CE1-CG 4.12Å; F319-F411 AromaticContact CZ-CD1 3.92Å; F319-F411 HydrophobicContact CZ-CD1 3.92Å; F319-F411 AromaticContact CZ-CD2 3.81Å; F319-F411 HydrophobicContact CZ-CD2 3.81Å; F319-F411 AromaticContact CZ-CE1 3.92Å; F319-F411 HydrophobicContact CZ-CE1 3.92Å; F319-F411 AromaticContact CZ-CE2 3.79Å; F319-F411 HydrophobicContact CZ-CE2 3.79Å; F319-F411 AromaticContact CZ-CG 3.88Å; F319-F411 HydrophobicContact CZ-CG 3.88Å; F319-F411 AromaticContact CZ-CZ 3.85Å; F319-F411 HydrophobicContact CZ-CZ 3.85Å
320	E	94.3	Very high	93.3	Very high	69 Å²	69	41.2 Å²	41.2	32%	0.322	20%	0.2	S	C	.	.	H	α-helix	trans	-66.6	-48.6	176.9	-72.3	177.2	175.7	0	0	111.4	L316 W323 E324	L316-E320 HydrophobicContact CD1-CG 4.19Å; L316-E320 HydrophobicContact CG-CG 4.29Å; L316-E320 WeakPolarHBondContact CG-OE1 3.43Å; L316-E320 PolarHBondContact O-N 3.44Å; E320-W323 PolarHBondContact O-N 3.44Å; E320-E324 WeakPolarHBondContact O-CB 3.46Å; E320-E324 PolarHBondContact O-N 3.17Å
321	L	94.7	Very high	93.2	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-61.5	-45.9	177.6	-74	171.9	0	0	0	111.7	L301 I307 T317 W323 E324 L325	L301-L321 HydrophobicContact CB-CD2 4.48Å; L301-L321 VanDerWaalsContact O-CD1 3.3Å; L301-L321 WeakPolarHBondContact O-CD1 3.29Å; I307-L321 HydrophobicContact CD1-CD1 4.02Å; I307-L321 HydrophobicContact CG1-CD1 4.27Å; T317-L321 HydrophobicContact CG2-CD1 3.88Å; T317-L321 HydrophobicContact CG2-CG 4.32Å; T317-L321 VanDerWaalsContact O-CB 3.28Å; T317-L321 WeakPolarHBondContact O-CB 3.36Å; T317-L321 VanDerWaalsContact O-CG 3.23Å; T317-L321 WeakPolarHBondContact O-CG 3.26Å; T317-L321 PolarHBondContact O-N 3.45Å; L321-W323 VanDerWaalsContact C-N 3.31Å; L321-W323 PolarHBondContact O-N 2.78Å; L321-E324 WeakPolarHBondContact O-CB 3.42Å; L321-E324 PolarHBondContact O-N 2.68Å; L321-L325 HydrophobicContact CB-CD1 4.45Å; L321-L325 WeakPolarHBondContact O-CB 3.28Å; L321-L325 VanDerWaalsContact O-CD1 3.23Å; L321-L325 WeakPolarHBondContact O-CD1 3.45Å; L321-L325 WeakPolarHBondContact O-CG 3.45Å; L321-L325 PolarHBondContact O-N 3.12Å
322	S	96	Very high	93.1	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.007	20%	0.198	C	C	.	.	H	α-helix	trans	-62.7	-35.9	177.8	48.3	0	0	0	0	113	A318 F319 K326 Q408	A318-S322 WeakPolarHBondContact O-CB 3.47Å; A318-S322 PolarHBondContact O-N 3.4Å; A318-S322 PolarHBondContact O-OG 3.01Å; F319-S322 PolarHBondContact O-OG 2.65Å; S322-K326 WeakPolarHBondContact O-CB 3.41Å; S322-K326 PolarHBondContact O-N 2.91Å; S322-K326 VanDerWaalsContact O-N 3.1Å; S322-Q408 PolarHBondContact OG-NE2 3.13Å
323	W	94.9	Very high	93.3	Very high	137 Å²	137	40.5 Å²	40.5	52%	0.519	19%	0.191	S	C	.	.	H	α-helix	trans	-70.8	-37.1	172.6	-177.3	80.9	0	0	0	113.1	F319 E320 L321 K327 Y406	F319-W323 WeakPolarHBondContact O-CB 3.16Å; F319-W323 PolarHBondContact O-N 3.38Å; F319-W323 VanDerWaalsContact O-N 3.15Å; E320-W323 PolarHBondContact O-N 3.44Å; L321-W323 VanDerWaalsContact C-N 3.31Å; L321-W323 PolarHBondContact O-N 2.78Å; W323-K327 PolarHBondContact O-N 2.79Å; W323-Y406 HydrophobicContact CB-CD1 3.54Å; W323-Y406 HydrophobicContact CB-CE1 4.02Å; W323-Y406 HydrophobicContact CB-CG 4.48Å; W323-Y406 AromaticContact CD1-CD1 3.93Å; W323-Y406 HydrophobicContact CD2-CD1 4.28Å; W323-Y406 HydrophobicContact CD2-CE1 4.22Å; W323-Y406 AromaticContact CG-CD1 3.62Å; W323-Y406 HydrophobicContact CG-CD1 3.62Å; W323-Y406 AromaticContact CG-CE1 4Å; W323-Y406 HydrophobicContact CG-CE1 4Å
324	E	94.2	Very high	93.3	Very high	46 Å²	46	46.8 Å²	46.8	22%	0.215	22%	0.22	C	C	.	.	H	α-helix	trans	-61.6	-55.8	174	-169.4	174	175.4	0	0	110.2	K268 Y298 E320 L321 K326 K327 L328	K268-E324 IonicContact NZ-OE2 2.92Å; K268-E324 PolarHBondContact NZ-OE2 2.98Å; Y298-E324 HydrophobicContact CE1-CG 4.32Å; Y298-E324 PolarHBondContact OH-OE1 3.15Å; E320-E324 WeakPolarHBondContact O-CB 3.46Å; E320-E324 PolarHBondContact O-N 3.17Å; L321-E324 WeakPolarHBondContact O-CB 3.42Å; L321-E324 PolarHBondContact O-N 2.68Å; E324-K326 VanDerWaalsContact C-N 3.35Å; E324-K326 PolarHBondContact O-N 3.13Å; E324-K327 WeakPolarHBondContact O-CA 3.43Å; E324-K327 WeakPolarHBondContact O-CB 3.3Å; E324-K327 PolarHBondContact O-N 3.33Å; E324-L328 WeakPolarHBondContact O-CG 3.19Å; E324-L328 PolarHBondContact O-N 3.2Å
325	L	95.3	Very high	93.2	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-55.8	-44.5	179.1	-65.5	156.3	0	0	0	112.6	Y298 T302 L321 K327 L328 G329 Y339 L342 E343	Y298-L325 HydrophobicContact CD1-CD2 3.98Å; Y298-L325 HydrophobicContact CG-CD2 4.05Å; T302-L325 HydrophobicContact CG2-CD1 3.44Å; T302-L325 VanDerWaalsContact CG2-CD1 3.44Å; T302-L325 HydrophobicContact CG2-CD2 4.22Å; T302-L325 HydrophobicContact CG2-CG 4.36Å; L321-L325 HydrophobicContact CB-CD1 4.45Å; L321-L325 WeakPolarHBondContact O-CB 3.28Å; L321-L325 VanDerWaalsContact O-CD1 3.23Å; L321-L325 WeakPolarHBondContact O-CD1 3.45Å; L321-L325 WeakPolarHBondContact O-CG 3.45Å; L321-L325 PolarHBondContact O-N 3.12Å; L325-K327 VanDerWaalsContact C-N 3.31Å; L325-K327 PolarHBondContact O-N 3.25Å; L325-L328 HydrophobicContact CD2-CD1 4.49Å; L325-L328 WeakPolarHBondContact O-CA 3.42Å; L325-L328 WeakPolarHBondContact O-CB 3.37Å; L325-L328 PolarHBondContact O-N 2.86Å; L325-G329 PolarHBondContact O-N 3.2Å; L325-Y339 HydrophobicContact CD2-CD1 3.85Å; L325-Y339 HydrophobicContact CD2-CE1 4.24Å; L325-L342 HydrophobicContact CD1-CB 3.97Å; L325-L342 HydrophobicContact CD2-CB 4.01Å; L325-L342 HydrophobicContact CD2-CD1 4.2Å; L325-E343 HydrophobicContact CB-CB 4.49Å
326	K	94.1	Very high	93.2	Very high	94 Å²	94	53.4 Å²	53.4	41%	0.409	25%	0.245	S	C	.	.	H	α-helix	trans	-57.3	-45.9	175.8	-177	174	177.5	175.1	0	112	S322 E324 L328 G329 E330 E343	S322-K326 WeakPolarHBondContact O-CB 3.41Å; S322-K326 PolarHBondContact O-N 2.91Å; S322-K326 VanDerWaalsContact O-N 3.1Å; E324-K326 VanDerWaalsContact C-N 3.35Å; E324-K326 PolarHBondContact O-N 3.13Å; K326-L328 VanDerWaalsContact C-N 3.26Å; K326-L328 PolarHBondContact O-N 2.9Å; K326-G329 PolarHBondContact O-N 3.46Å; K326-E330 VanDerWaalsContact CE-OE1 3.23Å; K326-E330 WeakPolarHBondContact CE-OE1 3.36Å; K326-E330 PolarHBondContact O-N 3.2Å; K326-E343 WeakPolarHBondContact CB-OE2 3.02Å; K326-E343 WeakPolarHBondContact CG-OE2 3.4Å
327	K	92.9	Very high	93.3	Very high	81 Å²	81	57.1 Å²	57.1	35%	0.352	27%	0.269	S	S	.	.	H	α-helix	trans	-64.5	-30.6	176	-177.9	-164.4	164.9	-138.2	0	111.6	D271 W323 E324 L325 L331	D271-K327 IonicContact OD2-NZ 2.83Å; W323-K327 PolarHBondContact O-N 2.79Å; E324-K327 WeakPolarHBondContact O-CA 3.43Å; E324-K327 WeakPolarHBondContact O-CB 3.3Å; E324-K327 PolarHBondContact O-N 3.33Å; L325-K327 VanDerWaalsContact C-N 3.31Å; L325-K327 PolarHBondContact O-N 3.25Å; K327-L331 HydrophobicContact CG-CD1 4.29Å; K327-L331 WeakPolarHBondContact O-CD1 3.42Å; K327-L331 VanDerWaalsContact O-CG 3.25Å; K327-L331 WeakPolarHBondContact O-CG 3.47Å; K327-L331 PolarHBondContact O-N 3.48Å
328	L	92.7	Very high	93.4	Very high	6 Å²	6	57.9 Å²	57.9	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-68.6	-46	172.3	-56.2	175.8	0	0	0	111.5	L272 Y298 E324 L325 K326 E330 L331 E332 Y339	L272-L328 HydrophobicContact CD1-CD2 3.39Å; L272-L328 HydrophobicContact CG-CD2 4.37Å; Y298-L328 HydrophobicContact CD1-CD1 4.36Å; Y298-L328 HydrophobicContact CD2-CD1 3.68Å; Y298-L328 HydrophobicContact CE1-CD1 4.03Å; Y298-L328 HydrophobicContact CE2-CD1 3.28Å; Y298-L328 HydrophobicContact CG-CD1 4.21Å; Y298-L328 VanDerWaalsContact CZ-CD1 3.48Å; E324-L328 WeakPolarHBondContact O-CG 3.19Å; E324-L328 PolarHBondContact O-N 3.2Å; L325-L328 HydrophobicContact CD2-CD1 4.49Å; L325-L328 WeakPolarHBondContact O-CA 3.42Å; L325-L328 WeakPolarHBondContact O-CB 3.37Å; L325-L328 PolarHBondContact O-N 2.86Å; K326-L328 VanDerWaalsContact C-N 3.26Å; K326-L328 PolarHBondContact O-N 2.9Å; L328-E330 PolarHBondContact O-N 3.45Å; L328-L331 CarbonylContact O-C 3.56Å; L328-L331 WeakPolarHBondContact O-CA 3.44Å; L328-L331 PolarHBondContact O-N 3.06Å; L328-E332 PolarHBondContact O-N 2.92Å; L328-Y339 HydrophobicContact CB-CD1 3.92Å; L328-Y339 HydrophobicContact CB-CD2 4.1Å; L328-Y339 HydrophobicContact CB-CE1 3.87Å; L328-Y339 HydrophobicContact CB-CE2 4.02Å; L328-Y339 HydrophobicContact CB-CG 4.06Å; L328-Y339 HydrophobicContact CD1-CD1 4.04Å; L328-Y339 HydrophobicContact CD1-CE1 3.49Å; L328-Y339 VanDerWaalsContact CD1-CE1 3.49Å; L328-Y339 HydrophobicContact CG-CE1 4.33Å
329	G	92.7	Very high	93.4	Very high	1 Å²	1	58 Å²	58	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-66.5	-19.3	176.6	0	0	0	0	0	114.8	L325 K326 R336	L325-G329 PolarHBondContact O-N 3.2Å; K326-G329 PolarHBondContact O-N 3.46Å; G329-R336 WeakPolarHBondContact O-CG 3.47Å
330	E	91.4	Very high	93.5	Very high	119 Å²	119	61.8 Å²	61.8	56%	0.556	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-9	167.7	-71.8	177.2	-169.5	0	0	113.5	K326 L328	K326-E330 VanDerWaalsContact CE-OE1 3.23Å; K326-E330 WeakPolarHBondContact CE-OE1 3.36Å; K326-E330 PolarHBondContact O-N 3.2Å; L328-E330 PolarHBondContact O-N 3.45Å
331	L	91.1	Very high	93.6	Very high	67 Å²	67	65.1 Å²	65.1	35%	0.351	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-36.2	-178.2	-72.3	171.4	0	0	0	114.1	L272 K327 L328	L272-L331 HydrophobicContact CD1-CD1 3.93Å; L272-L331 HydrophobicContact CD2-CB 4.01Å; K327-L331 HydrophobicContact CG-CD1 4.29Å; K327-L331 WeakPolarHBondContact O-CD1 3.42Å; K327-L331 VanDerWaalsContact O-CG 3.25Å; K327-L331 WeakPolarHBondContact O-CG 3.47Å; K327-L331 PolarHBondContact O-N 3.48Å; L328-L331 CarbonylContact O-C 3.56Å; L328-L331 WeakPolarHBondContact O-CA 3.44Å; L328-L331 PolarHBondContact O-N 3.06Å
332	E	89	Confident	93.6	Very high	33 Å²	33	65.5 Å²	65.5	15%	0.154	31%	0.306	C	S	.	.			trans	-112.8	93.2	174	-79.9	175.4	151.9	0	0	108.7	L272 R294 L328 E334 R336 Y339	L272-E332 HydrophobicContact CD2-CG 3.55Å; L272-E332 WeakPolarHBondContact CD2-OE2 3.41Å; R294-E332 IonicContact CZ-OE1 3.26Å; R294-E332 IonicContact CZ-OE2 2.69Å; R294-E332 IonicContact NH1-OE1 3.94Å; R294-E332 PolarHBondContact NH1-OE1 2.87Å; R294-E332 IonicContact NH1-OE2 3.01Å; R294-E332 PolarHBondContact NH1-OE2 3.21Å; L328-E332 PolarHBondContact O-N 2.92Å; E332-E334 PolarHBondContact O-N 3.36Å; E332-R336 PolarHBondContact O-N 2.77Å; E332-Y339 HydrophobicContact CB-CE2 4.4Å
333	N	90.6	Very high	93.7	Very high	107 Å²	107	67 Å²	67	57%	0.572	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-66.2	-25.3	-178	-71.8	-61.3	0	0	0	112.2	R336	N333-R336 WeakPolarHBondContact O-CB 3.5Å; N333-R336 PolarHBondContact O-N 3.12Å
334	E	90.9	Very high	93.7	Very high	149 Å²	149	62.7 Å²	62.7	70%	0.696	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-65.6	-37.9	-176.1	-61.4	75.9	-170.2	0	0	112.3	E332	E332-E334 PolarHBondContact O-N 3.36Å
335	F	91.7	Very high	93.7	Very high	47 Å²	47	63.7 Å²	63.7	21%	0.206	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-110	14.6	178.9	-65.2	-77.8	0	0	0	112.7	L288 I295 T337 E338 Y339	L288-F335 HydrophobicContact CD1-CZ 4.5Å; I295-F335 HydrophobicContact CD1-CB 3.73Å; I295-F335 HydrophobicContact CD1-CD1 4.08Å; I295-F335 HydrophobicContact CD1-CG 4.1Å; F335-T337 VanDerWaalsContact C-N 3.29Å; F335-T337 PolarHBondContact O-N 2.91Å; F335-E338 PolarHBondContact O-N 2.8Å; F335-E338 VanDerWaalsContact O-N 3.09Å; F335-Y339 HydrophobicContact CB-CD2 4.11Å; F335-Y339 HydrophobicContact CB-CE2 3.99Å; F335-Y339 WeakPolarHBondContact O-CD2 3.33Å; F335-Y339 PolarHBondContact O-N 3.49Å; F335-Y339 VanDerWaalsContact O-N 3.09Å
336	R	93.9	Very high	93.8	Very high	98 Å²	98	63.7 Å²	63.7	37%	0.37	31%	0.31	S	S	.	.	H	α-helix	trans	-51.7	-44.2	-173.5	174.4	178.2	177.5	124.8	15.4	113.5	G329 E332 N333 E338 Y339 E340	G329-R336 WeakPolarHBondContact O-CG 3.47Å; E332-R336 PolarHBondContact O-N 2.77Å; N333-R336 WeakPolarHBondContact O-CB 3.5Å; N333-R336 PolarHBondContact O-N 3.12Å; R336-E338 VanDerWaalsContact C-N 3.33Å; R336-E338 PolarHBondContact O-N 3.31Å; R336-Y339 PolarHBondContact O-N 2.69Å; R336-E340 HydrophobicContact CG-CG 4.33Å; R336-E340 IonicContact CZ-OE1 3.75Å; R336-E340 IonicContact NE-OE1 3.84Å; R336-E340 PolarHBondContact NE-OE1 2.66Å; R336-E340 IonicContact NE-OE2 3.18Å; R336-E340 IonicContact NH2-OE1 3.69Å; R336-E340 PolarHBondContact NH2-OE1 3.5Å; R336-E340 WeakPolarHBondContact O-CG 3.41Å; R336-E340 PolarHBondContact O-N 3.48Å
337	T	95.4	Very high	93.8	Very high	104 Å²	104	60.1 Å²	60.1	64%	0.638	30%	0.295	S	S	*	.	H	α-helix	trans	-64.4	-37	-177.7	47.9	0	0	0	0	112.5	F335 E341	F335-T337 VanDerWaalsContact C-N 3.29Å; F335-T337 PolarHBondContact O-N 2.91Å; T337-E341 WeakPolarHBondContact O-CB 3.48Å; T337-E341 PolarHBondContact O-N 3.33Å
338	E	95	Very high	94	Very high	53 Å²	53	61.8 Å²	61.8	25%	0.248	30%	0.302	C	S	.	.	H	α-helix	trans	-70.1	-40	174.1	-69.1	-169.9	-126.9	0	0	111.3	I295 R299 F335 R336 E340 E341 L342	I295-E338 HydrophobicContact CD1-CB 3.6Å; I295-E338 HydrophobicContact CD1-CG 4.32Å; I295-E338 WeakPolarHBondContact CD1-OE2 3.49Å; R299-E338 IonicContact CZ-OE2 3.67Å; R299-E338 IonicContact NH2-OE2 3.89Å; R299-E338 PolarHBondContact NH2-OE2 3.25Å; F335-E338 PolarHBondContact O-N 2.8Å; F335-E338 VanDerWaalsContact O-N 3.09Å; R336-E338 VanDerWaalsContact C-N 3.33Å; R336-E338 PolarHBondContact O-N 3.31Å; E338-E340 VanDerWaalsContact C-N 3.35Å; E338-E340 PolarHBondContact O-N 3.05Å; E338-E341 PolarHBondContact O-N 3.1Å; E338-L342 WeakPolarHBondContact O-CG 3.45Å; E338-L342 PolarHBondContact O-N 3.28Å
339	Y	96.6	Very high	94.1	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.008	30%	0.301	C	S	.	.	H	α-helix	trans	-63.8	-37.9	174.6	-77	-55.6	0	0	0	112.8	I295 Y298 L325 L328 E332 F335 R336 E343	I295-Y339 HydrophobicContact CD1-CE1 4.3Å; I295-Y339 HydrophobicContact CD1-CE2 4.22Å; I295-Y339 HydrophobicContact CG1-CE1 4.27Å; Y298-Y339 HydrophobicContact CD2-CE1 4.21Å; L325-Y339 HydrophobicContact CD2-CD1 3.85Å; L325-Y339 HydrophobicContact CD2-CE1 4.24Å; L328-Y339 HydrophobicContact CB-CD1 3.92Å; L328-Y339 HydrophobicContact CB-CD2 4.1Å; L328-Y339 HydrophobicContact CB-CE1 3.87Å; L328-Y339 HydrophobicContact CB-CE2 4.02Å; L328-Y339 HydrophobicContact CB-CG 4.06Å; L328-Y339 HydrophobicContact CD1-CD1 4.04Å; L328-Y339 HydrophobicContact CD1-CE1 3.49Å; L328-Y339 VanDerWaalsContact CD1-CE1 3.49Å; L328-Y339 HydrophobicContact CG-CE1 4.33Å; E332-Y339 HydrophobicContact CB-CE2 4.4Å; F335-Y339 HydrophobicContact CB-CD2 4.11Å; F335-Y339 HydrophobicContact CB-CE2 3.99Å; F335-Y339 WeakPolarHBondContact O-CD2 3.33Å; F335-Y339 PolarHBondContact O-N 3.49Å; F335-Y339 VanDerWaalsContact O-N 3.09Å; R336-Y339 PolarHBondContact O-N 2.69Å; Y339-E343 WeakPolarHBondContact O-CB 3.31Å; Y339-E343 PolarHBondContact O-N 2.86Å
340	E	95.3	Very high	94.3	Very high	80 Å²	80	61.6 Å²	61.6	37%	0.374	30%	0.301	S	S	.	.	H	α-helix	trans	-68.8	-33.6	173.4	-72.3	176.9	164.5	0	0	112.2	R336 E338 A344	R336-E340 HydrophobicContact CG-CG 4.33Å; R336-E340 IonicContact CZ-OE1 3.75Å; R336-E340 IonicContact NE-OE1 3.84Å; R336-E340 PolarHBondContact NE-OE1 2.66Å; R336-E340 IonicContact NE-OE2 3.18Å; R336-E340 IonicContact NH2-OE1 3.69Å; R336-E340 PolarHBondContact NH2-OE1 3.5Å; R336-E340 WeakPolarHBondContact O-CG 3.41Å; R336-E340 PolarHBondContact O-N 3.48Å; E338-E340 VanDerWaalsContact C-N 3.35Å; E338-E340 PolarHBondContact O-N 3.05Å; E340-A344 WeakPolarHBondContact O-CB 3.23Å; E340-A344 PolarHBondContact O-N 3.25Å
341	E	96.5	Very high	94.4	Very high	139 Å²	139	56.8 Å²	56.8	65%	0.65	28%	0.28	S	S	*	.	H	α-helix	trans	-68.1	-44.3	172.3	-173.5	179.4	175.7	0	0	112.1	T337 E338 A344 K345	T337-E341 WeakPolarHBondContact O-CB 3.48Å; T337-E341 PolarHBondContact O-N 3.33Å; E338-E341 PolarHBondContact O-N 3.1Å; E341-A344 WeakPolarHBondContact O-CB 3.45Å; E341-A344 PolarHBondContact O-N 3.17Å; E341-K345 PolarHBondContact O-N 2.91Å
342	L	96.4	Very high	94.6	Very high	12 Å²	12	56.3 Å²	56.3	6%	0.063	28%	0.276	C	S	.	.	H	α-helix	trans	-67.2	-35.9	176	-64	-177.4	0	0	0	111.9	R299 T302 L325 E338 A344 K345 C346	R299-L342 HydrophobicContact CB-CD1 4.16Å; R299-L342 HydrophobicContact CB-CD2 4.36Å; R299-L342 HydrophobicContact CG-CD2 4.2Å; T302-L342 HydrophobicContact CG2-CB 4.45Å; L325-L342 HydrophobicContact CD1-CB 3.97Å; L325-L342 HydrophobicContact CD2-CB 4.01Å; L325-L342 HydrophobicContact CD2-CD1 4.2Å; E338-L342 WeakPolarHBondContact O-CG 3.45Å; E338-L342 PolarHBondContact O-N 3.28Å; L342-A344 VanDerWaalsContact C-N 3.34Å; L342-K345 PolarHBondContact O-N 3.17Å; L342-C346 PolarHBondContact O-N 2.83Å; L342-C346 VanDerWaalsContact O-N 3.12Å
343	E	96.3	Very high	94.8	Very high	33 Å²	33	54.8 Å²	54.8	15%	0.154	27%	0.268	C	S	.	.	H	α-helix	trans	-55.6	-50.5	168.1	-178.9	-172.5	167.4	0	0	110	L325 K326 Y339 K345 C346 Q347	L325-E343 HydrophobicContact CB-CB 4.49Å; K326-E343 WeakPolarHBondContact CB-OE2 3.02Å; K326-E343 WeakPolarHBondContact CG-OE2 3.4Å; Y339-E343 WeakPolarHBondContact O-CB 3.31Å; Y339-E343 PolarHBondContact O-N 2.86Å; E343-K345 PolarHBondContact O-N 3.26Å; E343-C346 PolarHBondContact O-N 3.37Å; E343-Q347 HydrophobicContact CG-CG 4.5Å; E343-Q347 WeakPolarHBondContact O-CG 3.06Å; E343-Q347 PolarHBondContact O-N 3.31Å; E343-Q347 PolarHBondContact OE1-NE2 2.73Å
344	A	95.3	Very high	95	Very high	46 Å²	46	49.7 Å²	49.7	38%	0.38	24%	0.241	S	C	.	.	H	α-helix	trans	-63.2	-37.9	179.8	0	0	0	0	0	112.9	E340 E341 L342 Q347 K348	E340-A344 WeakPolarHBondContact O-CB 3.23Å; E340-A344 PolarHBondContact O-N 3.25Å; E341-A344 WeakPolarHBondContact O-CB 3.45Å; E341-A344 PolarHBondContact O-N 3.17Å; L342-A344 VanDerWaalsContact C-N 3.34Å; A344-Q347 PolarHBondContact O-N 2.79Å; A344-K348 VanDerWaalsContact O-CB 3.28Å; A344-K348 WeakPolarHBondContact O-CB 3.46Å; A344-K348 PolarHBondContact O-N 2.97Å
345	K	95.7	Very high	95.1	Very high	67 Å²	67	44.6 Å²	44.6	29%	0.291	23%	0.225	S	C	.	.	H	α-helix	trans	-59.2	-47.4	174.4	-171.9	175.9	-180	178	0	111.3	E341 L342 E343 F349	E341-K345 PolarHBondContact O-N 2.91Å; L342-K345 PolarHBondContact O-N 3.17Å; E343-K345 PolarHBondContact O-N 3.26Å; K345-F349 WeakPolarHBondContact O-CB 3.27Å; K345-F349 PolarHBondContact O-N 2.98Å
346	C	96.1	Very high	95.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67.3	-40.5	176.3	-77	0	0	0	0	113.3	L342 E343 F349 A350	L342-C346 PolarHBondContact O-N 2.83Å; L342-C346 VanDerWaalsContact O-N 3.12Å; E343-C346 PolarHBondContact O-N 3.37Å; C346-F349 PolarHBondContact O-N 3.25Å; C346-A350 PolarHBondContact O-N 3.33Å; C346-A350 VanDerWaalsContact O-N 3.1Å
347	Q	95.4	Very high	95.1	Very high	19 Å²	19	39.5 Å²	39.5	9%	0.089	21%	0.206	C	C	.	.	H	α-helix	trans	-61.5	-46.4	175.3	-71.1	-172.8	19.7	0	0	111.5	E343 A344 A350 T351	E343-Q347 HydrophobicContact CG-CG 4.5Å; E343-Q347 WeakPolarHBondContact O-CG 3.06Å; E343-Q347 PolarHBondContact O-N 3.31Å; E343-Q347 PolarHBondContact OE1-NE2 2.73Å; A344-Q347 PolarHBondContact O-N 2.79Å; Q347-A350 PolarHBondContact O-N 3.22Å; Q347-T351 VanDerWaalsContact O-CG2 3.28Å; Q347-T351 WeakPolarHBondContact O-CG2 3.41Å; Q347-T351 PolarHBondContact O-N 2.67Å; Q347-T351 VanDerWaalsContact O-N 3.13Å
348	K	95.5	Very high	94.8	Very high	116 Å²	116	43.8 Å²	43.8	50%	0.504	21%	0.21	S	C	.	.	H	α-helix	trans	-58.1	-52.7	176.7	178	177.5	166.7	-177.2	0	110.9	A344 A350 T351 E352	A344-K348 VanDerWaalsContact O-CB 3.28Å; A344-K348 WeakPolarHBondContact O-CB 3.46Å; A344-K348 PolarHBondContact O-N 2.97Å; K348-A350 VanDerWaalsContact C-N 3.32Å; K348-A350 PolarHBondContact O-N 3Å; K348-T351 WeakPolarHBondContact O-CA 3.27Å; K348-T351 WeakPolarHBondContact O-CB 3.37Å; K348-T351 PolarHBondContact O-N 2.83Å; K348-T351 PolarHBondContact O-OG1 2.86Å; K348-E352 WeakPolarHBondContact CE-OE1 3.2Å; K348-E352 HydrophobicContact CG-CG 4.28Å; K348-E352 IonicContact NZ-OE1 3.29Å; K348-E352 WeakPolarHBondContact O-CG 3.41Å; K348-E352 PolarHBondContact O-N 3.04Å
349	F	95.9	Very high	94.5	Very high	3 Å²	3	43.2 Å²	43.2	1%	0.013	21%	0.213	C	C	.	.	H	α-helix	trans	-52.3	-46.5	177.2	168.6	-106.8	0	0	0	112.8	P304 I307 I308 P314 A318 K345 C346 T351 E352 M353 Y881	P304-F349 HydrophobicContact CB-CD2 3.57Å; P304-F349 HydrophobicContact CB-CE2 3.7Å; P304-F349 HydrophobicContact CB-CG 4.44Å; P304-F349 HydrophobicContact CG-CB 4.42Å; P304-F349 HydrophobicContact CG-CD2 3.82Å; P304-F349 HydrophobicContact CG-CE2 4.44Å; P304-F349 HydrophobicContact CG-CG 4.33Å; I307-F349 HydrophobicContact CB-CE1 4.25Å; I307-F349 HydrophobicContact CB-CZ 4.35Å; I307-F349 HydrophobicContact CD1-CD1 4.38Å; I307-F349 HydrophobicContact CD1-CE1 4.26Å; I307-F349 HydrophobicContact CG2-CE1 3.84Å; I307-F349 HydrophobicContact CG2-CZ 4.2Å; I308-F349 HydrophobicContact CD1-CE2 4.09Å; I308-F349 HydrophobicContact CD1-CZ 4.45Å; I308-F349 HydrophobicContact CG1-CE2 4.18Å; I308-F349 HydrophobicContact CG1-CZ 4.04Å; P314-F349 HydrophobicContact CB-CE1 4.06Å; P314-F349 HydrophobicContact CB-CZ 3.98Å; A318-F349 HydrophobicContact CB-CD1 3.78Å; A318-F349 HydrophobicContact CB-CE1 4.15Å; K345-F349 WeakPolarHBondContact O-CB 3.27Å; K345-F349 PolarHBondContact O-N 2.98Å; C346-F349 PolarHBondContact O-N 3.25Å; F349-T351 VanDerWaalsContact C-N 3.28Å; F349-T351 PolarHBondContact O-N 2.94Å; F349-E352 PolarHBondContact O-N 3.12Å; F349-M353 HydrophobicContact CE2-CE 3.52Å; F349-M353 HydrophobicContact CE2-CG 4.12Å; F349-M353 HydrophobicContact CZ-CE 3.69Å; F349-M353 HydrophobicContact CZ-CG 4.17Å; F349-M353 PolarHBondContact O-N 3.09Å; F349-Y881 HydrophobicContact CD2-CE1 4.09Å; F349-Y881 HydrophobicContact CD2-CE2 4.45Å; F349-Y881 AromaticContact CD2-CZ 3.84Å; F349-Y881 HydrophobicContact CE2-CD1 4.42Å; F349-Y881 AromaticContact CE2-CE1 3.92Å; F349-Y881 HydrophobicContact CE2-CE1 3.92Å
350	A	95.7	Very high	93.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.3	-32.8	177	0	0	0	0	0	112.9	A318 F319 C346 Q347 K348 L354 F411	A318-A350 HydrophobicContact CB-CB 4.14Å; F319-A350 HydrophobicContact CD1-CB 4.16Å; F319-A350 HydrophobicContact CE1-CB 3.73Å; C346-A350 PolarHBondContact O-N 3.33Å; C346-A350 VanDerWaalsContact O-N 3.1Å; Q347-A350 PolarHBondContact O-N 3.22Å; K348-A350 VanDerWaalsContact C-N 3.32Å; K348-A350 PolarHBondContact O-N 3Å; A350-L354 PolarHBondContact O-N 3.35Å; A350-F411 HydrophobicContact CB-CD2 4.29Å; A350-F411 WeakPolarHBondContact O-CD2 3.37Å
351	T	94.8	Very high	93.3	Very high	18 Å²	18	47 Å²	47	11%	0.11	25%	0.248	C	C	.	.	H	α-helix	trans	-72.4	-38.3	173.5	71.1	0	0	0	0	113.5	Q347 K348 F349 M353 L354 A355 Q410 F411	Q347-T351 VanDerWaalsContact O-CG2 3.28Å; Q347-T351 WeakPolarHBondContact O-CG2 3.41Å; Q347-T351 PolarHBondContact O-N 2.67Å; Q347-T351 VanDerWaalsContact O-N 3.13Å; K348-T351 WeakPolarHBondContact O-CA 3.27Å; K348-T351 WeakPolarHBondContact O-CB 3.37Å; K348-T351 PolarHBondContact O-N 2.83Å; K348-T351 PolarHBondContact O-OG1 2.86Å; F349-T351 VanDerWaalsContact C-N 3.28Å; F349-T351 PolarHBondContact O-N 2.94Å; T351-M353 VanDerWaalsContact C-N 3.34Å; T351-L354 CarbonylContact O-C 3.52Å; T351-L354 WeakPolarHBondContact O-CB 3.5Å; T351-L354 PolarHBondContact O-N 3.5Å; T351-A355 PolarHBondContact O-N 2.93Å; T351-Q410 HydrophobicContact CG2-CB 3.47Å; T351-Q410 VanDerWaalsContact CG2-CB 3.47Å; T351-F411 HydrophobicContact CG2-CB 4.17Å; T351-F411 VanDerWaalsContact CG2-N 3.34Å
352	E	95.1	Very high	93	Very high	57 Å²	57	41.7 Å²	41.7	27%	0.266	22%	0.223	S	C	.	.	H	α-helix	trans	-70.2	-34.4	-179.6	-65.8	175.6	155.8	0	0	111.4	K348 F349 A355 Q356 Y881	K348-E352 WeakPolarHBondContact CE-OE1 3.2Å; K348-E352 HydrophobicContact CG-CG 4.28Å; K348-E352 IonicContact NZ-OE1 3.29Å; K348-E352 WeakPolarHBondContact O-CG 3.41Å; K348-E352 PolarHBondContact O-N 3.04Å; F349-E352 PolarHBondContact O-N 3.12Å; E352-A355 WeakPolarHBondContact O-CB 3.36Å; E352-A355 PolarHBondContact O-N 3.23Å; E352-Q356 WeakPolarHBondContact O-CG 3.5Å; E352-Q356 PolarHBondContact O-N 2.95Å; E352-Q356 PolarHBondContact O-NE2 3.5Å; E352-Q356 VanDerWaalsContact O-NE2 3.12Å; E352-Y881 HydrophobicContact CB-CD2 4.09Å; E352-Y881 HydrophobicContact CB-CE2 3.55Å; E352-Y881 HydrophobicContact CG-CE2 4.47Å; E352-Y881 WeakPolarHBondContact OE2-CE2 3.27Å; E352-Y881 PolarHBondContact OE2-OH 3.11Å
353	M	93.6	Very high	92.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.6	-44.3	167.8	-80	-68.7	178	0	0	111.9	I308 I315 F349 T351 A355 Q356 Y881	I308-M353 HydrophobicContact CD1-CE 3.57Å; I308-M353 HydrophobicContact CG1-CE 3.71Å; I315-M353 HydrophobicContact CG1-CB 4.37Å; F349-M353 HydrophobicContact CE2-CE 3.52Å; F349-M353 HydrophobicContact CE2-CG 4.12Å; F349-M353 HydrophobicContact CZ-CE 3.69Å; F349-M353 HydrophobicContact CZ-CG 4.17Å; F349-M353 PolarHBondContact O-N 3.09Å; T351-M353 VanDerWaalsContact C-N 3.34Å; M353-A355 PolarHBondContact O-N 3.45Å; M353-Q356 PolarHBondContact O-N 3.03Å; M353-Q356 VanDerWaalsContact O-N 3.13Å; M353-Y881 HydrophobicContact CE-CD1 3.56Å; M353-Y881 HydrophobicContact CE-CD2 4.24Å; M353-Y881 HydrophobicContact CE-CE1 4.28Å; M353-Y881 HydrophobicContact CE-CG 3.52Å; M353-Y881 HydrophobicContact SD-CD2 4.35Å; M353-Y881 HydrophobicContact SD-CG 3.99Å
354	L	93.2	Very high	92	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-66.5	-25.9	175.3	-167.4	68.2	0	0	0	112.6	A350 T351 Q356 T357 L363 V366 L367 F411 H414 C417	A350-L354 PolarHBondContact O-N 3.35Å; T351-L354 CarbonylContact O-C 3.52Å; T351-L354 WeakPolarHBondContact O-CB 3.5Å; T351-L354 PolarHBondContact O-N 3.5Å; L354-Q356 VanDerWaalsContact C-N 3.27Å; L354-Q356 PolarHBondContact O-N 3.19Å; L354-T357 HydrophobicContact CD1-CG2 4.48Å; L354-T357 PolarHBondContact O-OG1 3.19Å; L354-T357 VanDerWaalsContact O-OG1 3.08Å; L354-L363 HydrophobicContact CD1-CD1 3.66Å; L354-L363 HydrophobicContact CG-CD1 4.4Å; L354-V366 HydrophobicContact CD1-CG1 4.38Å; L354-L367 HydrophobicContact CD1-CD2 4.42Å; L354-F411 HydrophobicContact CB-CD2 4.18Å; L354-F411 HydrophobicContact CB-CE2 3.87Å; L354-F411 HydrophobicContact CD1-CE2 4.02Å; L354-F411 HydrophobicContact CD1-CZ 3.92Å; L354-F411 HydrophobicContact CD2-CD1 4.27Å; L354-F411 HydrophobicContact CD2-CD2 3.89Å; L354-F411 HydrophobicContact CD2-CE1 4.14Å; L354-F411 HydrophobicContact CD2-CE2 3.77Å; L354-F411 HydrophobicContact CD2-CG 4.15Å; L354-F411 HydrophobicContact CD2-CZ 3.9Å; L354-F411 HydrophobicContact CG-CE2 4.1Å; L354-F411 HydrophobicContact CG-CZ 4.36Å; L354-H414 HydrophobicContact CD2-CB 3.9Å; L354-C417 HydrophobicContact CD2-CB 4.22Å
355	A	93.7	Very high	91.5	Very high	42 Å²	42	41.9 Å²	41.9	35%	0.347	22%	0.221	S	C	.	.	H	α-helix	trans	-72.9	-15	173.5	0	0	0	0	0	113.8	T351 E352 M353 T357	T351-A355 PolarHBondContact O-N 2.93Å; E352-A355 WeakPolarHBondContact O-CB 3.36Å; E352-A355 PolarHBondContact O-N 3.23Å; M353-A355 PolarHBondContact O-N 3.45Å; A355-T357 VanDerWaalsContact C-N 3.33Å
356	Q	93.8	Very high	91.2	Very high	29 Å²	29	38.7 Å²	38.7	14%	0.136	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-5.9	176.6	-54.4	-45.1	-52.3	0	0	114.3	E352 M353 L354 R358 L877 R880	E352-Q356 WeakPolarHBondContact O-CG 3.5Å; E352-Q356 PolarHBondContact O-N 2.95Å; E352-Q356 PolarHBondContact O-NE2 3.5Å; E352-Q356 VanDerWaalsContact O-NE2 3.12Å; M353-Q356 PolarHBondContact O-N 3.03Å; M353-Q356 VanDerWaalsContact O-N 3.13Å; L354-Q356 VanDerWaalsContact C-N 3.27Å; L354-Q356 PolarHBondContact O-N 3.19Å; Q356-R358 PolarHBondContact O-N 3.44Å; Q356-L877 HydrophobicContact CB-CD2 3.82Å; Q356-L877 WeakPolarHBondContact O-CD2 3.2Å; Q356-R880 HydrophobicContact CB-CB 4.05Å; Q356-R880 HydrophobicContact CG-CB 4.21Å; Q356-R880 PolarHBondContact O-NH1 3.41Å; Q356-R880 VanDerWaalsContact O-NH1 3.14Å
357	T	92	Very high	90.7	Very high	8 Å²	8	38.7 Å²	38.7	5%	0.049	21%	0.207	C	C	.	.			trans	-71.2	115.6	176.4	65	0	0	0	0	110	L354 A355 E362 L363 L877	L354-T357 HydrophobicContact CD1-CG2 4.48Å; L354-T357 PolarHBondContact O-OG1 3.19Å; L354-T357 VanDerWaalsContact O-OG1 3.08Å; A355-T357 VanDerWaalsContact C-N 3.33Å; T357-E362 HydrophobicContact CG2-CB 4.46Å; T357-L363 HydrophobicContact CG2-CB 4.46Å; T357-L363 HydrophobicContact CG2-CD1 4.33Å; T357-L877 HydrophobicContact CG2-CD1 4.16Å; T357-L877 HydrophobicContact CG2-CD2 3.84Å
358	R	89.8	Confident	90	Very high	194 Å²	194	39.7 Å²	39.7	73%	0.732	21%	0.213	S	C	*	.			trans	-94.9	-21.1	-178.4	-66.5	178.4	-178.7	176.5	-0.2	112.8	Q356 E362	Q356-R358 PolarHBondContact O-N 3.44Å; R358-E362 PolarHBondContact N-OE2 3.02Å
359	S	87.5	Confident	89.3	Confident	42 Å²	42	35 Å²	35	29%	0.294	19%	0.193	S	C	.	.	S	Bend	trans	-121.7	158.8	177.9	77.4	0	0	0	0	113	S361 E362 L363	S359-S361 PolarHBondContact O-N 3.14Å; S359-S361 PolarHBondContact OG-N 3.14Å; S359-S361 PolarHBondContact OG-OG 3.06Å; S359-E362 PolarHBondContact N-OE2 2.97Å; S359-E362 PolarHBondContact O-N 2.88Å; S359-E362 WeakPolarHBondContact OG-CG 3.2Å; S359-E362 PolarHBondContact OG-N 3.25Å; S359-L363 WeakPolarHBondContact O-CB 3.49Å; S359-L363 PolarHBondContact O-N 2.99Å
360	S	83.3	Confident	88.2	Confident	93 Å²	93	39.5 Å²	39.5	65%	0.65	21%	0.21	S	C	*	.	H	α-helix	trans	-64.1	-25.1	169.2	48.8	0	0	0	0	113	S364	S360-S364 VanDerWaalsContact O-CB 3.3Å; S360-S364 WeakPolarHBondContact O-CB 3.47Å; S360-S364 PolarHBondContact O-N 2.93Å; S360-S364 PolarHBondContact O-OG 2.91Å
361	S	84.2	Confident	86.5	Confident	67 Å²	67	42.1 Å²	42.1	47%	0.469	23%	0.226	S	C	.	.	H	α-helix	trans	-76.6	-40.1	176.9	51.6	0	0	0	0	113	S359 L363 S364 I365	S359-S361 PolarHBondContact O-N 3.14Å; S359-S361 PolarHBondContact OG-N 3.14Å; S359-S361 PolarHBondContact OG-OG 3.06Å; S361-L363 VanDerWaalsContact C-N 3.34Å; S361-S364 PolarHBondContact O-N 3.1Å; S361-S364 PolarHBondContact O-OG 3.22Å; S361-I365 WeakPolarHBondContact O-CB 3.3Å; S361-I365 WeakPolarHBondContact O-CD1 3.34Å; S361-I365 WeakPolarHBondContact O-CG1 2.82Å; S361-I365 PolarHBondContact O-N 3.08Å
362	E	90	Very high	84.5	Confident	29 Å²	29	44.3 Å²	44.3	14%	0.136	25%	0.253	C	S	.	.	H	α-helix	trans	-60.8	-47.6	170.5	-71.5	169.8	174.3	0	0	110.1	T357 R358 S359 S364 I365 V366 V873 R880	T357-E362 HydrophobicContact CG2-CB 4.46Å; R358-E362 PolarHBondContact N-OE2 3.02Å; S359-E362 PolarHBondContact N-OE2 2.97Å; S359-E362 PolarHBondContact O-N 2.88Å; S359-E362 WeakPolarHBondContact OG-CG 3.2Å; S359-E362 PolarHBondContact OG-N 3.25Å; E362-S364 PolarHBondContact O-N 3.24Å; E362-I365 PolarHBondContact O-N 3.42Å; E362-V366 WeakPolarHBondContact O-CG2 3.44Å; E362-V366 PolarHBondContact O-N 3.17Å; E362-V873 HydrophobicContact CB-CG1 4.13Å; E362-V873 HydrophobicContact CG-CG1 4.24Å; E362-V873 HydrophobicContact CG-CG2 4.48Å; E362-R880 IonicContact OE1-CZ 3.44Å; E362-R880 VanDerWaalsContact OE1-CZ 3.25Å; E362-R880 IonicContact OE1-NH1 3.36Å; E362-R880 PolarHBondContact OE1-NH1 3.41Å; E362-R880 IonicContact OE1-NH2 2.82Å; E362-R880 PolarHBondContact OE1-NH2 3.37Å; E362-R880 IonicContact OE2-CZ 2.71Å; E362-R880 IonicContact OE2-NH1 3.66Å; E362-R880 PolarHBondContact OE2-NH1 3.2Å
363	L	88.8	Confident	82.1	Confident	12 Å²	12	45.6 Å²	45.6	6%	0.063	27%	0.273	C	S	.	.	H	α-helix	trans	-61.8	-42.9	178.7	-176.9	68.7	0	0	0	112.7	L354 T357 S359 S361 V366 L367 H416 L420	L354-L363 HydrophobicContact CD1-CD1 3.66Å; L354-L363 HydrophobicContact CG-CD1 4.4Å; T357-L363 HydrophobicContact CG2-CB 4.46Å; T357-L363 HydrophobicContact CG2-CD1 4.33Å; S359-L363 WeakPolarHBondContact O-CB 3.49Å; S359-L363 PolarHBondContact O-N 2.99Å; S361-L363 VanDerWaalsContact C-N 3.34Å; L363-V366 PolarHBondContact O-N 3.32Å; L363-L367 HydrophobicContact CD1-CD1 3.76Å; L363-L367 HydrophobicContact CD1-CG 4.26Å; L363-L367 HydrophobicContact CG-CD1 3.96Å; L363-L367 WeakPolarHBondContact O-CB 3.35Å; L363-L367 WeakPolarHBondContact O-CG 3.47Å; L363-L367 PolarHBondContact O-N 3.1Å; L363-H416 HydrophobicContact CD1-CB 4.18Å; L363-H416 HydrophobicContact CD2-CB 4Å; L363-L420 HydrophobicContact CD2-CB 4.03Å; L363-L420 HydrophobicContact CD2-CD2 4.33Å; L363-L420 HydrophobicContact CG-CD2 4.38Å
364	S	82.4	Confident	79.7	Confident	32 Å²	32	49.5 Å²	49.5	22%	0.224	29%	0.294	C	S	.	.	H	α-helix	trans	-71.4	-35.1	179.1	70.9	0	0	0	0	112.1	S360 S361 E362 N368	S360-S364 VanDerWaalsContact O-CB 3.3Å; S360-S364 WeakPolarHBondContact O-CB 3.47Å; S360-S364 PolarHBondContact O-N 2.93Å; S360-S364 PolarHBondContact O-OG 2.91Å; S361-S364 PolarHBondContact O-N 3.1Å; S361-S364 PolarHBondContact O-OG 3.22Å; E362-S364 PolarHBondContact O-N 3.24Å; S364-N368 VanDerWaalsContact O-CB 3.26Å; S364-N368 WeakPolarHBondContact O-CB 3.33Å; S364-N368 PolarHBondContact O-N 3.5Å; S364-N368 PolarHBondContact O-ND2 2.92Å
365	I	85.8	Confident	77.2	Confident	50 Å²	50	53.7 Å²	53.7	26%	0.256	32%	0.32	S	S	.	.	H	α-helix	trans	-62.7	-45.6	172.7	-73	166	0	0	0	110.5	S361 E362 H369 Y870 V873	S361-I365 WeakPolarHBondContact O-CB 3.3Å; S361-I365 WeakPolarHBondContact O-CD1 3.34Å; S361-I365 WeakPolarHBondContact O-CG1 2.82Å; S361-I365 PolarHBondContact O-N 3.08Å; E362-I365 PolarHBondContact O-N 3.42Å; I365-H369 PolarHBondContact O-N 3.39Å; I365-H369 VanDerWaalsContact O-N 3.15Å; I365-Y870 HydrophobicContact CG2-CD2 4.06Å; I365-V873 HydrophobicContact CB-CG2 4.48Å; I365-V873 HydrophobicContact CD1-CG2 4Å; I365-V873 HydrophobicContact CG2-CB 4.28Å; I365-V873 HydrophobicContact CG2-CG2 4.07Å
366	V	88	Confident	74.3	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-64.1	-45	177.8	170.9	0	0	0	0	112.2	I315 L354 E362 L363 R399 Y870 V873 M874 L877	I315-V366 HydrophobicContact CD1-CG1 3.73Å; L354-V366 HydrophobicContact CD1-CG1 4.38Å; E362-V366 WeakPolarHBondContact O-CG2 3.44Å; E362-V366 PolarHBondContact O-N 3.17Å; L363-V366 PolarHBondContact O-N 3.32Å; V366-R399 WeakPolarHBondContact O-CB 3.34Å; V366-R399 WeakPolarHBondContact O-CG 3.3Å; V366-Y870 HydrophobicContact CG2-CE2 4.4Å; V366-V873 HydrophobicContact CG2-CG1 4.03Å; V366-M874 HydrophobicContact CG2-SD 4.12Å; V366-L877 HydrophobicContact CG2-CD1 3.64Å
367	L	86	Confident	71.4	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-80.8	-18.4	-173.9	-66.7	178.4	0	0	0	114.6	L354 L363 L397 R399 L400 F411 L420	L354-L367 HydrophobicContact CD1-CD2 4.42Å; L363-L367 HydrophobicContact CD1-CD1 3.76Å; L363-L367 HydrophobicContact CD1-CG 4.26Å; L363-L367 HydrophobicContact CG-CD1 3.96Å; L363-L367 WeakPolarHBondContact O-CB 3.35Å; L363-L367 WeakPolarHBondContact O-CG 3.47Å; L363-L367 PolarHBondContact O-N 3.1Å; L367-L397 HydrophobicContact CB-CD2 4.22Å; L367-L397 CarbonylContact O-C 3.56Å; L367-L397 WeakPolarHBondContact O-CA 3.35Å; L367-R399 WeakPolarHBondContact O-CB 3.5Å; L367-R399 PolarHBondContact O-N 2.98Å; L367-L400 HydrophobicContact CD2-CB 4.39Å; L367-L400 HydrophobicContact CD2-CD1 4.48Å; L367-F411 HydrophobicContact CD2-CE1 3.67Å; L367-F411 HydrophobicContact CD2-CZ 3.82Å; L367-L420 HydrophobicContact CD1-CD2 3.75Å
368	N	81.8	Confident	68.5	Low	40 Å²	40	63.1 Å²	63.1	21%	0.214	40%	0.396	C	S	.	.	H	α-helix	trans	-104.6	1.6	175.3	-62.6	-68.2	0	0	0	114.1	S364 M395 Q396 L397 S398	S364-N368 VanDerWaalsContact O-CB 3.26Å; S364-N368 WeakPolarHBondContact O-CB 3.33Å; S364-N368 PolarHBondContact O-N 3.5Å; S364-N368 PolarHBondContact O-ND2 2.92Å; N368-M395 WeakPolarHBondContact ND2-CG 3.32Å; N368-M395 VanDerWaalsContact OD1-C 3.22Å; N368-M395 VanDerWaalsContact OD1-CA 3.25Å; N368-M395 WeakPolarHBondContact OD1-CA 3.41Å; N368-M395 WeakPolarHBondContact OD1-CB 3.19Å; N368-Q396 PolarHBondContact OD1-N 2.76Å; N368-Q396 VanDerWaalsContact OD1-N 3.1Å; N368-L397 WeakPolarHBondContact OD1-CA 3.4Å; N368-L397 PolarHBondContact OD1-N 3.33Å; N368-S398 VanDerWaalsContact C-OG 3.27Å; N368-S398 PolarHBondContact O-OG 3.48Å; N368-S398 VanDerWaalsContact O-OG 3.04Å
369	H	80.4	Confident	65.6	Low	19 Å²	19	61.6 Å²	61.6	9%	0.088	40%	0.397	C	S	.	.			trans	-60.4	142.8	173.8	-173	84.1	0	0	0	111.2	I365 S398 R399 Y870	I365-H369 PolarHBondContact O-N 3.39Å; I365-H369 VanDerWaalsContact O-N 3.15Å; H369-S398 WeakPolarHBondContact O-CB 3.38Å; H369-S398 PolarHBondContact O-OG 3.45Å; H369-R399 PolarHBondContact CD2-NH2 2.9Å; H369-Y870 HydrophobicContact CB-CD2 3.75Å; H369-Y870 HydrophobicContact CB-CE2 3.85Å; H369-Y870 HydrophobicContact CB-CG 4.21Å; H369-Y870 AromaticContact CE1-CD1 3.49Å; H369-Y870 VanDerWaalsContact CE1-CD1 3.49Å; H369-Y870 WeakPolarHBondContact CE1-CD1 3.35Å; H369-Y870 AromaticContact CE1-CG 3.78Å; H369-Y870 AromaticContact CG-CD1 3.85Å; H369-Y870 AromaticContact CG-CD2 3.78Å; H369-Y870 AromaticContact CG-CE2 3.98Å; H369-Y870 AromaticContact CG-CG 3.73Å; H369-Y870 WeakPolarHBondContact ND1-CB 3.19Å; H369-Y870 AromaticContact ND1-CD1 3.37Å; H369-Y870 WeakPolarHBondContact ND1-CD1 3.31Å; H369-Y870 AromaticContact ND1-CD2 3.68Å; H369-Y870 AromaticContact ND1-CE1 4Å; H369-Y870 AromaticContact ND1-CG 3.19Å
370	Y	71.3	Confident	63.2	Low	96 Å²	96	64.3 Å²	64.3	38%	0.376	41%	0.412	S	S	.	.			trans	-129.9	117.1	-171.4	172.3	-91.8	0	0	0	110.6	D374 V375	Y370-D374 HydrophobicContact CE2-CB 4.05Å; Y370-D374 WeakPolarHBondContact OH-CA 3.31Å; Y370-D374 PolarHBondContact OH-N 3.43Å; Y370-V375 HydrophobicContact CE1-CG2 4.41Å; Y370-V375 WeakPolarHBondContact OH-CA 3.34Å; Y370-V375 WeakPolarHBondContact OH-CG2 3.45Å; Y370-V375 PolarHBondContact OH-N 3.09Å
371	T	61.3	Low	60.6	Low	55 Å²	55	63.6 Å²	63.6	34%	0.337	41%	0.407	S	S	.	.			trans	-79.8	133.7	171.3	49.5	0	0	0	0	110	L316 A373	L316-T371 HydrophobicContact CD2-CG2 3.94Å; T371-A373 PolarHBondContact O-N 3.19Å
372	G	51.9	Low	57.8	Low	65 Å²	65	63.1 Å²	63.1	67%	0.67	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	11.4	-163.4	0	0	0	0	0	120.1	V375	G372-V375 VanDerWaalsContact O-CG2 3.25Å; G372-V375 WeakPolarHBondContact O-CG2 3.44Å
373	A	45.5	Very low	54.9	Low	84 Å²	84	68.7 Å²	68.7	69%	0.694	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-38.8	-170.5	0	0	0	0	0	115.6	T371 V375	T371-A373 PolarHBondContact O-N 3.19Å; A373-V375 PolarHBondContact O-N 2.8Å
374	D	42.2	Very low	52.1	Low	82 Å²	82	74 Å²	74	44%	0.439	47%	0.47	S	S	.	.			trans	-78.9	24.4	-172.1	-86.9	16.6	0	0	0	113.5	Y370 S376 G377 R405	Y370-D374 HydrophobicContact CE2-CB 4.05Å; Y370-D374 WeakPolarHBondContact OH-CA 3.31Å; Y370-D374 PolarHBondContact OH-N 3.43Å; D374-S376 VanDerWaalsContact C-N 3.26Å; D374-S376 PolarHBondContact O-N 3.35Å; D374-S376 VanDerWaalsContact O-N 3.13Å; D374-G377 PolarHBondContact O-N 3.09Å; D374-R405 IonicContact OD1-NH1 3.85Å; D374-R405 IonicContact OD2-CZ 3.79Å; D374-R405 IonicContact OD2-NH1 3.98Å; D374-R405 PolarHBondContact OD2-NH1 2.84Å; D374-R405 IonicContact OD2-NH2 3.74Å; D374-R405 PolarHBondContact OD2-NH2 3.4Å
375	V	40.9	Very low	49.6	Very low	89 Å²	89	80.7 Å²	80.7	54%	0.539	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-62.3	-29.2	-166.5	171.7	0	0	0	0	113.2	Y370 G372 A373 G377 C378	Y370-V375 HydrophobicContact CE1-CG2 4.41Å; Y370-V375 WeakPolarHBondContact OH-CA 3.34Å; Y370-V375 WeakPolarHBondContact OH-CG2 3.45Å; Y370-V375 PolarHBondContact OH-N 3.09Å; G372-V375 VanDerWaalsContact O-CG2 3.25Å; G372-V375 WeakPolarHBondContact O-CG2 3.44Å; A373-V375 PolarHBondContact O-N 2.8Å; V375-G377 PolarHBondContact O-N 3.26Å; V375-C378 PolarHBondContact O-N 2.67Å
376	S	33.9	Very low	46.9	Very low	119 Å²	119	82.8 Å²	82.8	83%	0.832	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-58.2	-15	175.4	-47.1	0	0	0	0	114.3	D374	D374-S376 VanDerWaalsContact C-N 3.26Å; D374-S376 PolarHBondContact O-N 3.35Å; D374-S376 VanDerWaalsContact O-N 3.13Å
377	G	33.4	Very low	44.2	Very low	69 Å²	69	86.7 Å²	86.7	71%	0.711	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-80.2	-17.2	174.7	0	0	0	0	0	115.2	D374 V375 H379	D374-G377 PolarHBondContact O-N 3.09Å; V375-G377 PolarHBondContact O-N 3.26Å; G377-H379 VanDerWaalsContact C-N 3.31Å; G377-H379 PolarHBondContact O-N 3.44Å
378	C	30.5	Very low	41.5	Very low	88 Å²	88	90 Å²	90	60%	0.595	56%	0.56	S	S	*	*			trans	-88.2	58.1	-168.1	-157.3	0	0	0	0	113.6	V375 V380	V375-C378 PolarHBondContact O-N 2.67Å; C378-V380 PolarHBondContact O-N 3.32Å
379	H	28.9	Very low	39.1	Very low	163 Å²	163	95.8 Å²	95.8	76%	0.755	59%	0.586	S	S	*	*			trans	-75.2	57.1	179	-111.8	-66.4	0	0	0	113.4	G377 S381	G377-H379 VanDerWaalsContact C-N 3.31Å; G377-H379 PolarHBondContact O-N 3.44Å; H379-S381 VanDerWaalsContact C-N 3.28Å; H379-S381 PolarHBondContact O-N 2.98Å
380	V	36.4	Very low	36.8	Very low	99 Å²	99	98 Å²	98	60%	0.6	60%	0.598	S	S	*	*			trans	-81.6	78.5	169.3	-174	0	0	0	0	108.9	C378 G382	C378-V380 PolarHBondContact O-N 3.32Å; V380-G382 VanDerWaalsContact C-N 3.27Å; V380-G382 PolarHBondContact O-N 2.91Å
381	S	28.4	Very low	35.2	Very low	78 Å²	78	98.9 Å²	98.9	55%	0.545	61%	0.609	S	S	.	*			trans	-72.6	75.4	179.9	-59.4	0	0	0	0	112.5	H379	H379-S381 VanDerWaalsContact C-N 3.28Å; H379-S381 PolarHBondContact O-N 2.98Å
382	G	26.7	Very low	33.9	Very low	57 Å²	57	101.1 Å²	101.1	59%	0.588	63%	0.627	S	S	*	*			trans	76	-175.1	165.3	0	0	0	0	0	117	V380	V380-G382 VanDerWaalsContact C-N 3.27Å; V380-G382 PolarHBondContact O-N 2.91Å
383	I	29	Very low	33.6	Very low	146 Å²	146	105.6 Å²	105.6	75%	0.749	63%	0.63	S	S	*	*			trans	77	102.8	175	-52.1	179.4	0	0	0	115.6
384	N	28.6	Very low	33.9	Very low	123 Å²	123	107.1 Å²	107.1	66%	0.658	62%	0.618	S	S	*	*			trans	79.8	120.4	151.1	-60.7	2.5	0	0	0	120.3	S386	N384-S386 PolarHBondContact O-N 3.22Å; N384-S386 VanDerWaalsContact O-N 3.12Å
385	Q	30.3	Very low	34.8	Very low	173 Å²	173	106.6 Å²	106.6	81%	0.808	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	8.1	-180	-151.6	163.3	8.3	0	0	113.9
386	S	29.6	Very low	36	Very low	93 Å²	93	108.4 Å²	108.4	65%	0.65	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	5.7	178.2	64.8	0	0	0	0	113.4	N384	N384-S386 PolarHBondContact O-N 3.22Å; N384-S386 VanDerWaalsContact O-N 3.12Å
387	L	31.1	Very low	38.1	Very low	83 Å²	83	102.9 Å²	102.9	44%	0.435	58%	0.577	S	S	.	*			trans	-106	22.1	-177	-153.3	74.3	0	0	0	112.6	D390 I391	L387-D390 HydrophobicContact CD1-CB 3.92Å; L387-D390 HydrophobicContact CG-CB 3.87Å; L387-I391 WeakPolarHBondContact O-CG1 3.24Å
388	S	30.1	Very low	40.4	Very low	69 Å²	69	100.8 Å²	100.8	48%	0.483	55%	0.552	S	S	.	*	S	Bend	trans	-75.3	-26.9	-179.3	40	0	0	0	0	113.6
389	E	30.5	Very low	43.2	Very low	161 Å²	161	96.7 Å²	96.7	75%	0.752	52%	0.524	S	S	*	.	S	Bend	trans	-80.1	-44.4	-179.8	-60.5	-174.9	136.7	0	0	111.4	I391 S392	E389-I391 PolarHBondContact O-N 3.4Å; E389-S392 WeakPolarHBondContact O-CB 3.48Å; E389-S392 PolarHBondContact O-N 3.46Å
390	D	33.3	Very low	46	Very low	65 Å²	65	89 Å²	89	35%	0.348	49%	0.488	S	S	.	.	H	α-helix	trans	-46.6	-32.4	173.2	-104.9	68.3	0	0	0	115.1	L387 S392 R394	L387-D390 HydrophobicContact CD1-CB 3.92Å; L387-D390 HydrophobicContact CG-CB 3.87Å; D390-S392 VanDerWaalsContact C-N 3.33Å; D390-R394 IonicContact OD2-CZ 2.6Å; D390-R394 IonicContact OD2-NH2 3.84Å; D390-R394 PolarHBondContact OD2-NH2 2.91Å
391	I	37.4	Very low	48.5	Very low	116 Å²	116	88.4 Å²	88.4	60%	0.595	48%	0.478	S	S	*	.	H	α-helix	trans	-74.9	-26.6	-178.4	-64.4	169.8	0	0	0	111	L387 E389	L387-I391 WeakPolarHBondContact O-CG1 3.24Å; E389-I391 PolarHBondContact O-N 3.4Å
392	S	33.6	Very low	51.4	Low	102 Å²	102	86 Å²	86	71%	0.713	46%	0.458	S	S	*	.	H	α-helix	trans	-71.3	-31.6	176.9	-159.5	0	0	0	0	112.3	E389 D390	E389-S392 WeakPolarHBondContact O-CB 3.48Å; E389-S392 PolarHBondContact O-N 3.46Å; D390-S392 VanDerWaalsContact C-N 3.33Å
393	E	44.6	Very low	54.5	Low	159 Å²	159	83.2 Å²	83.2	74%	0.743	43%	0.43	S	S	*	.	H	α-helix	trans	-82.1	-35.1	-178	-59.8	-160.3	135.3	0	0	113.5	M395	E393-M395 PolarHBondContact O-N 2.99Å
394	R	52.9	Low	57.4	Low	115 Å²	115	77.8 Å²	77.8	43%	0.434	40%	0.402	S	S	.	.			trans	-79.8	81.8	-174.9	-92.4	-177.8	-89.2	-176.1	-4	113	D390 Q396 E811	D390-R394 IonicContact OD2-CZ 2.6Å; D390-R394 IonicContact OD2-NH2 3.84Å; D390-R394 PolarHBondContact OD2-NH2 2.91Å; R394-Q396 WeakPolarHBondContact O-CG 3.47Å; R394-Q396 PolarHBondContact O-N 3.49Å; R394-E811 IonicContact CZ-OE1 2.82Å; R394-E811 IonicContact NH1-OE1 3.53Å; R394-E811 PolarHBondContact NH1-OE1 3.17Å
395	M	61.7	Low	60.3	Low	72 Å²	72	79.6 Å²	79.6	36%	0.355	40%	0.4	S	S	.	.			trans	-54	98.2	172.5	-69	-171.5	-92.2	0	0	112.6	N368 E393 L397 L420 I424	N368-M395 WeakPolarHBondContact ND2-CG 3.32Å; N368-M395 VanDerWaalsContact OD1-C 3.22Å; N368-M395 VanDerWaalsContact OD1-CA 3.25Å; N368-M395 WeakPolarHBondContact OD1-CA 3.41Å; N368-M395 WeakPolarHBondContact OD1-CB 3.19Å; E393-M395 PolarHBondContact O-N 2.99Å; M395-L397 VanDerWaalsContact C-N 3.28Å; M395-L397 PolarHBondContact O-N 3.47Å; M395-L420 HydrophobicContact CE-CD1 4.22Å; M395-L420 HydrophobicContact SD-CD1 4.05Å; M395-L420 HydrophobicContact SD-CD2 4.45Å; M395-I424 HydrophobicContact CB-CD1 4.34Å; M395-I424 HydrophobicContact CE-CD1 3.89Å; M395-I424 HydrophobicContact CE-CG1 3.94Å; M395-I424 HydrophobicContact SD-CD1 4.15Å
396	Q	64.8	Low	63.2	Low	127 Å²	127	74.1 Å²	74.1	59%	0.593	37%	0.372	S	S	*	.			trans	-74.9	-13.7	-177.7	-60	-164.2	11.1	0	0	114.2	N368 R394 S398 K401	N368-Q396 PolarHBondContact OD1-N 2.76Å; N368-Q396 VanDerWaalsContact OD1-N 3.1Å; R394-Q396 WeakPolarHBondContact O-CG 3.47Å; R394-Q396 PolarHBondContact O-N 3.49Å; Q396-S398 VanDerWaalsContact C-N 3.28Å; Q396-S398 PolarHBondContact O-N 2.88Å; Q396-K401 VanDerWaalsContact O-CE 3.27Å; Q396-K401 WeakPolarHBondContact O-CE 3.31Å; Q396-K401 PolarHBondContact O-NZ 2.73Å
397	L	79.3	Confident	66.2	Low	2 Å²	2	71.1 Å²	71.1	1%	0.01	36%	0.356	C	S	.	.			trans	53.2	39.5	176.2	-61.3	174.5	0	0	0	113.9	L367 N368 M395 L400 K401 L420 L421 I424 F809	L367-L397 HydrophobicContact CB-CD2 4.22Å; L367-L397 CarbonylContact O-C 3.56Å; L367-L397 WeakPolarHBondContact O-CA 3.35Å; N368-L397 WeakPolarHBondContact OD1-CA 3.4Å; N368-L397 PolarHBondContact OD1-N 3.33Å; M395-L397 VanDerWaalsContact C-N 3.28Å; M395-L397 PolarHBondContact O-N 3.47Å; L397-L400 HydrophobicContact CB-CB 4.19Å; L397-L400 HydrophobicContact CD1-CD2 4.34Å; L397-L400 HydrophobicContact CD2-CD2 4.36Å; L397-L400 PolarHBondContact O-N 2.9Å; L397-K401 WeakPolarHBondContact O-CG 3.39Å; L397-K401 PolarHBondContact O-N 3.01Å; L397-L420 HydrophobicContact CD2-CD2 4.33Å; L397-L421 HydrophobicContact CD1-CD2 4.18Å; L397-I424 HydrophobicContact CD1-CD1 3.92Å; L397-I424 HydrophobicContact CD2-CD1 4.41Å; L397-I424 HydrophobicContact CG-CD1 4.47Å; L397-F809 HydrophobicContact CD1-CD2 3.81Å; L397-F809 HydrophobicContact CD1-CE2 3.65Å
398	S	81.6	Confident	69.2	Low	25 Å²	25	67.2 Å²	67.2	18%	0.175	34%	0.335	C	S	.	.	H	α-helix	trans	-53.9	-53.7	179.1	39.5	0	0	0	0	112.9	N368 H369 Q396 L400 K401 L402	N368-S398 VanDerWaalsContact C-OG 3.27Å; N368-S398 PolarHBondContact O-OG 3.48Å; N368-S398 VanDerWaalsContact O-OG 3.04Å; H369-S398 WeakPolarHBondContact O-CB 3.38Å; H369-S398 PolarHBondContact O-OG 3.45Å; Q396-S398 VanDerWaalsContact C-N 3.28Å; Q396-S398 PolarHBondContact O-N 2.88Å; S398-L400 PolarHBondContact O-N 3.24Å; S398-K401 PolarHBondContact O-N 3.25Å; S398-L402 WeakPolarHBondContact O-CB 3.27Å; S398-L402 PolarHBondContact O-N 2.96Å
399	R	87.5	Confident	72.2	Confident	3 Å²	3	67 Å²	67	1%	0.011	33%	0.326	C	S	.	.	H	α-helix	trans	-58.9	-38	177.7	-174.8	72.8	68.3	-179.5	9.5	111.9	D313 F319 V366 L367 H369 L402 A403 Y870	D313-R399 IonicContact OD1-CZ 2.71Å; D313-R399 IonicContact OD1-NH1 2.66Å; D313-R399 IonicContact OD1-NH2 3.75Å; D313-R399 IonicContact OD2-CZ 3.67Å; D313-R399 IonicContact OD2-NH1 3.79Å; D313-R399 PolarHBondContact OD2-NH1 3.22Å; D313-R399 IonicContact OD2-NH2 3.71Å; D313-R399 PolarHBondContact OD2-NH2 2.88Å; F319-R399 HydrophobicContact CE2-CG 4.44Å; V366-R399 WeakPolarHBondContact O-CB 3.34Å; V366-R399 WeakPolarHBondContact O-CG 3.3Å; L367-R399 WeakPolarHBondContact O-CB 3.5Å; L367-R399 PolarHBondContact O-N 2.98Å; H369-R399 PolarHBondContact CD2-NH2 2.9Å; R399-L402 WeakPolarHBondContact O-CB 3.37Å; R399-L402 PolarHBondContact O-N 3.15Å; R399-A403 WeakPolarHBondContact O-CB 3.29Å; R399-A403 PolarHBondContact O-N 3.41Å; R399-Y870 VanDerWaalsContact NH2-CZ 3.34Å; R399-Y870 PolarHBondContact NH2-OH 2.67Å
400	L	88.7	Confident	75.2	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-74.1	-36.4	-178.6	-171.8	58.8	0	0	0	112.4	L367 L397 S398 L402 A403 I404 F411 V412 C417 L421 I806	L367-L400 HydrophobicContact CD2-CB 4.39Å; L367-L400 HydrophobicContact CD2-CD1 4.48Å; L397-L400 HydrophobicContact CB-CB 4.19Å; L397-L400 HydrophobicContact CD1-CD2 4.34Å; L397-L400 HydrophobicContact CD2-CD2 4.36Å; L397-L400 PolarHBondContact O-N 2.9Å; S398-L400 PolarHBondContact O-N 3.24Å; L400-L402 VanDerWaalsContact C-N 3.31Å; L400-A403 PolarHBondContact O-N 3Å; L400-I404 WeakPolarHBondContact O-CG1 3.5Å; L400-I404 PolarHBondContact O-N 3.4Å; L400-F411 HydrophobicContact CD1-CD1 4.48Å; L400-F411 HydrophobicContact CD1-CE1 4.35Å; L400-V412 HydrophobicContact CD1-CG2 3.9Å; L400-C417 VanDerWaalsContact CD1-SG 3.5Å; L400-L421 HydrophobicContact CD2-CD1 4.12Å; L400-L421 HydrophobicContact CD2-CD2 3.66Å; L400-L421 HydrophobicContact CD2-CG 3.94Å; L400-I806 HydrophobicContact CD2-CD1 4.07Å; L400-I806 HydrophobicContact CG-CD1 4.09Å
401	K	89.1	Confident	78.2	Confident	87 Å²	87	59.8 Å²	59.8	38%	0.378	29%	0.29	S	S	.	.	H	α-helix	trans	-61.3	-41.3	168.5	-72.3	162.1	176.8	168.2	0	110.8	Q396 L397 S398 I404 R405 I806	Q396-K401 VanDerWaalsContact O-CE 3.27Å; Q396-K401 WeakPolarHBondContact O-CE 3.31Å; Q396-K401 PolarHBondContact O-NZ 2.73Å; L397-K401 WeakPolarHBondContact O-CG 3.39Å; L397-K401 PolarHBondContact O-N 3.01Å; S398-K401 PolarHBondContact O-N 3.25Å; K401-I404 PolarHBondContact O-N 3.27Å; K401-R405 WeakPolarHBondContact O-CG 3.47Å; K401-R405 PolarHBondContact O-N 3.42Å; K401-I806 HydrophobicContact CG-CG2 3.97Å
402	L	89	Confident	80.9	Confident	26 Å²	26	54.3 Å²	54.3	14%	0.136	26%	0.262	C	S	.	.	H	α-helix	trans	-65.3	-43.7	175.7	-170.7	64.6	0	0	0	112	L316 S398 R399 L400 I404 R405 Y406	L316-L402 HydrophobicContact CD1-CD2 3.72Å; S398-L402 WeakPolarHBondContact O-CB 3.27Å; S398-L402 PolarHBondContact O-N 2.96Å; R399-L402 WeakPolarHBondContact O-CB 3.37Å; R399-L402 PolarHBondContact O-N 3.15Å; L400-L402 VanDerWaalsContact C-N 3.31Å; L402-I404 VanDerWaalsContact C-N 3.26Å; L402-I404 PolarHBondContact O-N 3.21Å; L402-R405 WeakPolarHBondContact O-CB 3.42Å; L402-R405 PolarHBondContact O-N 2.86Å; L402-R405 VanDerWaalsContact O-N 3.08Å; L402-Y406 HydrophobicContact CD1-CD2 4.02Å; L402-Y406 HydrophobicContact CD1-CE2 3.53Å; L402-Y406 HydrophobicContact CD2-CE2 4.12Å; L402-Y406 HydrophobicContact CG-CD2 3.83Å; L402-Y406 HydrophobicContact CG-CE2 3.6Å; L402-Y406 WeakPolarHBondContact O-CD2 3.43Å; L402-Y406 PolarHBondContact O-N 2.89Å
403	A	92.2	Very high	83.8	Confident	0 Å²	0	50 Å²	50	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57.7	-37.7	173.1	0	0	0	0	0	112.2	F319 R399 L400 Y406 G407 Q408 F411 V412	F319-A403 HydrophobicContact CD2-CB 4.45Å; F319-A403 HydrophobicContact CE2-CB 3.64Å; F319-A403 HydrophobicContact CZ-CB 3.74Å; R399-A403 WeakPolarHBondContact O-CB 3.29Å; R399-A403 PolarHBondContact O-N 3.41Å; L400-A403 PolarHBondContact O-N 3Å; A403-Y406 CarbonylContact O-C 3.46Å; A403-G407 PolarHBondContact O-N 3.4Å; A403-G407 VanDerWaalsContact O-N 3.09Å; A403-Q408 HydrophobicContact CB-CB 4.07Å; A403-Q408 HydrophobicContact CB-CG 4.3Å; A403-Q408 VanDerWaalsContact O-CB 3.3Å; A403-Q408 WeakPolarHBondContact O-CB 3.34Å; A403-Q408 WeakPolarHBondContact O-CG 3.37Å; A403-Q408 PolarHBondContact O-N 3.12Å; A403-F411 HydrophobicContact CB-CD1 3.91Å; A403-F411 HydrophobicContact CB-CE1 4.16Å; A403-V412 HydrophobicContact CB-CG2 4.37Å
404	I	90.3	Very high	86.1	Confident	31 Å²	31	44 Å²	44	16%	0.159	21%	0.205	C	C	.	.	H	α-helix	trans	-71.9	-38.1	173.8	-69.1	171.2	0	0	0	112	L400 K401 L402 Y406 G407 V412 F799 K803 I806	L400-I404 WeakPolarHBondContact O-CG1 3.5Å; L400-I404 PolarHBondContact O-N 3.4Å; K401-I404 PolarHBondContact O-N 3.27Å; L402-I404 VanDerWaalsContact C-N 3.26Å; L402-I404 PolarHBondContact O-N 3.21Å; I404-Y406 VanDerWaalsContact C-N 3.3Å; I404-Y406 PolarHBondContact O-N 3.08Å; I404-G407 PolarHBondContact O-N 3.04Å; I404-G407 VanDerWaalsContact O-N 3.12Å; I404-V412 HydrophobicContact CG1-CG2 3.8Å; I404-F799 HydrophobicContact CB-CE2 4.42Å; I404-F799 HydrophobicContact CG1-CE2 3.98Å; I404-F799 HydrophobicContact CG1-CZ 4.49Å; I404-F799 HydrophobicContact CG2-CE2 4.47Å; I404-F799 HydrophobicContact CG2-CZ 4.16Å; I404-K803 HydrophobicContact CG2-CG 4.46Å; I404-I806 HydrophobicContact CD1-CD1 3.43Å; I404-I806 VanDerWaalsContact CD1-CD1 3.43Å
405	R	88.8	Confident	87.9	Confident	162 Å²	162	42.8 Å²	42.8	61%	0.611	21%	0.211	S	C	*	.	H	α-helix	trans	-58.1	-42.1	171.7	-72.6	177.5	179.2	165.5	1.3	111.1	D374 K401 L402 G407	D374-R405 IonicContact OD1-NH1 3.85Å; D374-R405 IonicContact OD2-CZ 3.79Å; D374-R405 IonicContact OD2-NH1 3.98Å; D374-R405 PolarHBondContact OD2-NH1 2.84Å; D374-R405 IonicContact OD2-NH2 3.74Å; D374-R405 PolarHBondContact OD2-NH2 3.4Å; K401-R405 WeakPolarHBondContact O-CG 3.47Å; K401-R405 PolarHBondContact O-N 3.42Å; L402-R405 WeakPolarHBondContact O-CB 3.42Å; L402-R405 PolarHBondContact O-N 2.86Å; L402-R405 VanDerWaalsContact O-N 3.08Å; R405-G407 VanDerWaalsContact C-N 3.32Å; R405-G407 PolarHBondContact O-N 3.18Å
406	Y	91.7	Very high	89.3	Confident	58 Å²	58	42.4 Å²	42.4	23%	0.227	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	2.3	176	-69.2	-58.5	0	0	0	114.8	F319 W323 L402 A403 I404 Q408	F319-Y406 HydrophobicContact CB-CD2 3.7Å; F319-Y406 HydrophobicContact CB-CE2 4.18Å; F319-Y406 HydrophobicContact CB-CG 4.22Å; F319-Y406 HydrophobicContact CD2-CD2 4.35Å; F319-Y406 HydrophobicContact CG-CD2 4.42Å; W323-Y406 HydrophobicContact CB-CD1 3.54Å; W323-Y406 HydrophobicContact CB-CE1 4.02Å; W323-Y406 HydrophobicContact CB-CG 4.48Å; W323-Y406 AromaticContact CD1-CD1 3.93Å; W323-Y406 HydrophobicContact CD2-CD1 4.28Å; W323-Y406 HydrophobicContact CD2-CE1 4.22Å; W323-Y406 AromaticContact CG-CD1 3.62Å; W323-Y406 HydrophobicContact CG-CD1 3.62Å; W323-Y406 AromaticContact CG-CE1 4Å; W323-Y406 HydrophobicContact CG-CE1 4Å; L402-Y406 HydrophobicContact CD1-CD2 4.02Å; L402-Y406 HydrophobicContact CD1-CE2 3.53Å; L402-Y406 HydrophobicContact CD2-CE2 4.12Å; L402-Y406 HydrophobicContact CG-CD2 3.83Å; L402-Y406 HydrophobicContact CG-CE2 3.6Å; L402-Y406 WeakPolarHBondContact O-CD2 3.43Å; L402-Y406 PolarHBondContact O-N 2.89Å; A403-Y406 CarbonylContact O-C 3.46Å; I404-Y406 VanDerWaalsContact C-N 3.3Å; I404-Y406 PolarHBondContact O-N 3.08Å; Y406-Q408 PolarHBondContact O-N 3.34Å
407	G	90.9	Very high	90.6	Very high	30 Å²	30	36.3 Å²	36.3	31%	0.309	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	22.8	174.5	0	0	0	0	0	116	A403 I404 R405 K409	A403-G407 PolarHBondContact O-N 3.4Å; A403-G407 VanDerWaalsContact O-N 3.09Å; I404-G407 PolarHBondContact O-N 3.04Å; I404-G407 VanDerWaalsContact O-N 3.12Å; R405-G407 VanDerWaalsContact C-N 3.32Å; R405-G407 PolarHBondContact O-N 3.18Å; G407-K409 VanDerWaalsContact C-N 3.29Å; G407-K409 WeakPolarHBondContact O-CG 3.33Å; G407-K409 PolarHBondContact O-N 3.36Å
408	Q	94.5	Very high	91.1	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	18%	0.183	C	C	.	.			trans	-71.9	70.9	-172.3	-60.8	-69.5	-38.2	0	0	113.2	F319 S322 A403 Y406 Q410 F411 V412	F319-Q408 HydrophobicContact CD1-CG 3.52Å; F319-Q408 HydrophobicContact CE1-CB 4.21Å; F319-Q408 HydrophobicContact CE1-CG 3.65Å; F319-Q408 HydrophobicContact CG-CG 3.98Å; F319-Q408 HydrophobicContact CZ-CG 4.24Å; S322-Q408 PolarHBondContact OG-NE2 3.13Å; A403-Q408 HydrophobicContact CB-CB 4.07Å; A403-Q408 HydrophobicContact CB-CG 4.3Å; A403-Q408 VanDerWaalsContact O-CB 3.3Å; A403-Q408 WeakPolarHBondContact O-CB 3.34Å; A403-Q408 WeakPolarHBondContact O-CG 3.37Å; A403-Q408 PolarHBondContact O-N 3.12Å; Y406-Q408 PolarHBondContact O-N 3.34Å; Q408-Q410 PolarHBondContact O-N 3.1Å; Q408-F411 HydrophobicContact CB-CB 4.07Å; Q408-F411 PolarHBondContact O-N 3.29Å; Q408-V412 WeakPolarHBondContact O-CG2 3.15Å; Q408-V412 PolarHBondContact O-N 2.87Å
409	K	94.3	Very high	91.3	Very high	64 Å²	64	41.1 Å²	41.1	28%	0.278	20%	0.2	S	C	.	.	H	α-helix	trans	-52.7	-51.9	-172.5	-59.1	173.7	-176	175.7	0	112.9	G407 A413 I795 E796 F799	G407-K409 VanDerWaalsContact C-N 3.29Å; G407-K409 WeakPolarHBondContact O-CG 3.33Å; G407-K409 PolarHBondContact O-N 3.36Å; K409-A413 VanDerWaalsContact O-CB 3.3Å; K409-A413 WeakPolarHBondContact O-CB 3.24Å; K409-A413 PolarHBondContact O-N 3.09Å; K409-I795 HydrophobicContact CB-CG2 3.94Å; K409-E796 HydrophobicContact CD-CG 4.09Å; K409-E796 IonicContact NZ-OE1 2.67Å; K409-E796 PolarHBondContact NZ-OE1 2.61Å; K409-F799 HydrophobicContact CG-CG 4.49Å
410	Q	93.9	Very high	91.1	Very high	74 Å²	74	42.1 Å²	42.1	35%	0.346	21%	0.205	S	C	.	.	H	α-helix	trans	-65.9	-44.9	-174.1	-57.6	-172.6	15.4	0	0	111.7	T351 Q408 V412 A413 H414 I795	T351-Q410 HydrophobicContact CG2-CB 3.47Å; T351-Q410 VanDerWaalsContact CG2-CB 3.47Å; Q408-Q410 PolarHBondContact O-N 3.1Å; Q410-V412 PolarHBondContact O-N 2.98Å; Q410-A413 PolarHBondContact O-N 2.92Å; Q410-H414 PolarHBondContact O-N 3.44Å; Q410-I795 HydrophobicContact CG-CG2 4.44Å
411	F	95.1	Very high	91	Very high	1 Å²	1	42.1 Å²	42.1	0%	0.004	21%	0.205	C	C	.	.	H	α-helix	trans	-58.1	-47.3	179.2	-177.5	-86.7	0	0	0	111.7	I315 F319 A350 T351 L354 L367 L400 A403 Q408 H414	I315-F411 HydrophobicContact CG2-CE2 4.04Å; I315-F411 HydrophobicContact CG2-CZ 4.33Å; F319-F411 HydrophobicContact CE1-CB 4.5Å; F319-F411 AromaticContact CE1-CD2 3.96Å; F319-F411 HydrophobicContact CE1-CD2 3.96Å; F319-F411 HydrophobicContact CE1-CE2 4.29Å; F319-F411 HydrophobicContact CE1-CG 4.12Å; F319-F411 AromaticContact CZ-CD1 3.92Å; F319-F411 HydrophobicContact CZ-CD1 3.92Å; F319-F411 AromaticContact CZ-CD2 3.81Å; F319-F411 HydrophobicContact CZ-CD2 3.81Å; F319-F411 AromaticContact CZ-CE1 3.92Å; F319-F411 HydrophobicContact CZ-CE1 3.92Å; F319-F411 AromaticContact CZ-CE2 3.79Å; F319-F411 HydrophobicContact CZ-CE2 3.79Å; F319-F411 AromaticContact CZ-CG 3.88Å; F319-F411 HydrophobicContact CZ-CG 3.88Å; F319-F411 AromaticContact CZ-CZ 3.85Å; F319-F411 HydrophobicContact CZ-CZ 3.85Å; A350-F411 HydrophobicContact CB-CD2 4.29Å; A350-F411 WeakPolarHBondContact O-CD2 3.37Å; T351-F411 HydrophobicContact CG2-CB 4.17Å; T351-F411 VanDerWaalsContact CG2-N 3.34Å; L354-F411 HydrophobicContact CB-CD2 4.18Å; L354-F411 HydrophobicContact CB-CE2 3.87Å; L354-F411 HydrophobicContact CD1-CE2 4.02Å; L354-F411 HydrophobicContact CD1-CZ 3.92Å; L354-F411 HydrophobicContact CD2-CD1 4.27Å; L354-F411 HydrophobicContact CD2-CD2 3.89Å; L354-F411 HydrophobicContact CD2-CE1 4.14Å; L354-F411 HydrophobicContact CD2-CE2 3.77Å; L354-F411 HydrophobicContact CD2-CG 4.15Å; L354-F411 HydrophobicContact CD2-CZ 3.9Å; L354-F411 HydrophobicContact CG-CE2 4.1Å; L354-F411 HydrophobicContact CG-CZ 4.36Å; L367-F411 HydrophobicContact CD2-CE1 3.67Å; L367-F411 HydrophobicContact CD2-CZ 3.82Å; L400-F411 HydrophobicContact CD1-CD1 4.48Å; L400-F411 HydrophobicContact CD1-CE1 4.35Å; A403-F411 HydrophobicContact CB-CD1 3.91Å; A403-F411 HydrophobicContact CB-CE1 4.16Å; Q408-F411 HydrophobicContact CB-CB 4.07Å; Q408-F411 PolarHBondContact O-N 3.29Å; F411-H414 VanDerWaalsContact O-CB 3.29Å; F411-H414 WeakPolarHBondContact O-CB 3.47Å; F411-H414 PolarHBondContact O-N 3.46Å
412	V	94.4	Very high	90.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66.3	-38.5	177.7	177.2	0	0	0	0	111.2	L400 A403 I404 Q408 Q410 H414 Q418 F799 S802	L400-V412 HydrophobicContact CD1-CG2 3.9Å; A403-V412 HydrophobicContact CB-CG2 4.37Å; I404-V412 HydrophobicContact CG1-CG2 3.8Å; Q408-V412 WeakPolarHBondContact O-CG2 3.15Å; Q408-V412 PolarHBondContact O-N 2.87Å; Q410-V412 PolarHBondContact O-N 2.98Å; V412-H414 VanDerWaalsContact C-N 3.26Å; V412-H414 PolarHBondContact O-N 2.9Å; V412-Q418 PolarHBondContact O-NE2 3.22Å; V412-F799 HydrophobicContact CB-CD2 3.94Å; V412-F799 HydrophobicContact CG1-CD2 4.14Å; V412-F799 HydrophobicContact CG2-CD2 3.99Å; V412-F799 HydrophobicContact CG2-CE2 4.16Å; V412-S802 VanDerWaalsContact CG1-CB 3.43Å; V412-S802 WeakPolarHBondContact CG1-OG 3.46Å
413	A	93.7	Very high	90.2	Very high	12 Å²	12	39.8 Å²	39.8	10%	0.099	21%	0.206	C	C	.	.	H	α-helix	trans	-73.2	-12.7	179.5	0	0	0	0	0	114.5	K409 Q410 Q418 I795 K798	K409-A413 VanDerWaalsContact O-CB 3.3Å; K409-A413 WeakPolarHBondContact O-CB 3.24Å; K409-A413 PolarHBondContact O-N 3.09Å; Q410-A413 PolarHBondContact O-N 2.92Å; A413-Q418 WeakPolarHBondContact O-CG 3.3Å; A413-I795 HydrophobicContact CB-CB 4.28Å; A413-I795 HydrophobicContact CB-CG2 3.7Å; A413-K798 HydrophobicContact CB-CB 3.95Å; A413-K798 HydrophobicContact CB-CD 4.21Å
414	H	94.2	Very high	89.5	Confident	34 Å²	34	40.6 Å²	40.6	16%	0.157	21%	0.21	C	C	.	.	S	Bend	trans	-56.1	137.5	-176.1	-168.8	-109.8	0	0	0	112.3	L354 Q410 F411 V412 H416 C417 Q418	L354-H414 HydrophobicContact CD2-CB 3.9Å; Q410-H414 PolarHBondContact O-N 3.44Å; F411-H414 VanDerWaalsContact O-CB 3.29Å; F411-H414 WeakPolarHBondContact O-CB 3.47Å; F411-H414 PolarHBondContact O-N 3.46Å; V412-H414 VanDerWaalsContact C-N 3.26Å; V412-H414 PolarHBondContact O-N 2.9Å; H414-H416 VanDerWaalsContact C-N 3.29Å; H414-H416 AromaticContact CE1-CD2 3.49Å; H414-H416 PolarHBondContact CE1-CD2 3.45Å; H414-H416 VanDerWaalsContact CE1-CD2 3.49Å; H414-H416 AromaticContact CE1-CG 3.87Å; H414-H416 AromaticContact ND1-CD2 3.95Å; H414-H416 AromaticContact ND1-CG 3.99Å; H414-H416 PolarHBondContact O-N 3.42Å; H414-H416 VanDerWaalsContact O-N 3.14Å; H414-C417 PolarHBondContact O-N 3.38Å; H414-Q418 PolarHBondContact O-N 3.5Å
415	P	91.3	Very high	89	Confident	89 Å²	89	39.2 Å²	39.2	58%	0.578	20%	0.203	S	C	*	.	H	α-helix	trans	-53.6	-38.3	-174.2	-31.2	37.8	0	0	0	115	Q418 Q419	P415-Q418 PolarHBondContact O-N 3.01Å; P415-Q419 VanDerWaalsContact O-CB 3.24Å; P415-Q419 WeakPolarHBondContact O-CB 3.33Å; P415-Q419 PolarHBondContact O-N 3.03Å
416	H	90.5	Very high	88.4	Confident	63 Å²	63	34.7 Å²	34.7	29%	0.292	19%	0.186	S	C	.	.	H	α-helix	trans	-66	-44.8	176.9	-60.5	-25	0	0	0	112.4	L363 H414 Q419 L420	L363-H416 HydrophobicContact CD1-CB 4.18Å; L363-H416 HydrophobicContact CD2-CB 4Å; H414-H416 VanDerWaalsContact C-N 3.29Å; H414-H416 AromaticContact CE1-CD2 3.49Å; H414-H416 PolarHBondContact CE1-CD2 3.45Å; H414-H416 VanDerWaalsContact CE1-CD2 3.49Å; H414-H416 AromaticContact CE1-CG 3.87Å; H414-H416 AromaticContact ND1-CD2 3.95Å; H414-H416 AromaticContact ND1-CG 3.99Å; H414-H416 PolarHBondContact O-N 3.42Å; H414-H416 VanDerWaalsContact O-N 3.14Å; H416-Q419 PolarHBondContact O-N 3.02Å; H416-L420 PolarHBondContact O-N 2.95Å
417	C	90.6	Very high	87.3	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62	-46.6	175.4	-174.6	0	0	0	0	111	L354 L400 H414 Q419 L420 L421	L354-C417 HydrophobicContact CD2-CB 4.22Å; L400-C417 VanDerWaalsContact CD1-SG 3.5Å; H414-C417 PolarHBondContact O-N 3.38Å; C417-Q419 VanDerWaalsContact C-N 3.27Å; C417-Q419 PolarHBondContact O-N 2.89Å; C417-L420 PolarHBondContact O-N 3.3Å; C417-L421 VanDerWaalsContact O-CB 3.29Å; C417-L421 WeakPolarHBondContact O-CB 3.47Å; C417-L421 WeakPolarHBondContact O-CG 3.22Å; C417-L421 PolarHBondContact O-N 3.1Å
418	Q	90.1	Very high	85.8	Confident	14 Å²	14	37.5 Å²	37.5	7%	0.065	20%	0.204	C	C	.	.	H	α-helix	trans	-63.1	-31.5	175.5	-68.5	-61.6	-51.9	0	0	112.7	V412 A413 H414 P415 A422 S802	V412-Q418 PolarHBondContact O-NE2 3.22Å; A413-Q418 WeakPolarHBondContact O-CG 3.3Å; H414-Q418 PolarHBondContact O-N 3.5Å; P415-Q418 PolarHBondContact O-N 3.01Å; Q418-A422 VanDerWaalsContact O-CB 3.27Å; Q418-A422 WeakPolarHBondContact O-CB 3.11Å; Q418-A422 PolarHBondContact O-N 3.17Å; Q418-A422 VanDerWaalsContact O-N 3.09Å; Q418-S802 PolarHBondContact NE2-OG 3.06Å
419	Q	86.2	Confident	84.2	Confident	114 Å²	114	38.6 Å²	38.6	53%	0.533	21%	0.21	S	C	.	.	H	α-helix	trans	-68.5	-46.7	175.6	-178.9	171.8	-13	0	0	112.2	P415 H416 C417 A423 R433	P415-Q419 VanDerWaalsContact O-CB 3.24Å; P415-Q419 WeakPolarHBondContact O-CB 3.33Å; P415-Q419 PolarHBondContact O-N 3.03Å; H416-Q419 PolarHBondContact O-N 3.02Å; C417-Q419 VanDerWaalsContact C-N 3.27Å; C417-Q419 PolarHBondContact O-N 2.89Å; Q419-A423 PolarHBondContact O-N 3.48Å; Q419-A423 VanDerWaalsContact O-N 3.1Å; Q419-R433 PolarHBondContact O-NH1 3.08Å
420	L	84.4	Confident	82.2	Confident	23 Å²	23	39.3 Å²	39.3	12%	0.12	22%	0.221	C	C	.	.	H	α-helix	trans	-65.1	-49.5	175.8	-176.5	68.8	0	0	0	111.5	L363 L367 M395 L397 H416 C417 A422 A423 I424	L363-L420 HydrophobicContact CD2-CB 4.03Å; L363-L420 HydrophobicContact CD2-CD2 4.33Å; L363-L420 HydrophobicContact CG-CD2 4.38Å; L367-L420 HydrophobicContact CD1-CD2 3.75Å; M395-L420 HydrophobicContact CE-CD1 4.22Å; M395-L420 HydrophobicContact SD-CD1 4.05Å; M395-L420 HydrophobicContact SD-CD2 4.45Å; L397-L420 HydrophobicContact CD2-CD2 4.33Å; H416-L420 PolarHBondContact O-N 2.95Å; C417-L420 PolarHBondContact O-N 3.3Å; L420-A422 VanDerWaalsContact C-N 3.3Å; L420-A422 PolarHBondContact O-N 2.89Å; L420-A423 WeakPolarHBondContact O-CA 3.49Å; L420-A423 WeakPolarHBondContact O-CB 3.25Å; L420-A423 PolarHBondContact O-N 3.31Å; L420-I424 HydrophobicContact CD1-CD1 4.49Å; L420-I424 HydrophobicContact CG-CD1 4.16Å; L420-I424 PolarHBondContact O-N 3.1Å
421	L	85.1	Confident	80.1	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-53.4	-46.6	177.4	-83.2	175.7	0	0	0	112.2	L397 L400 C417 A423 I424 W425 S802 W805 I806 F809	L397-L421 HydrophobicContact CD1-CD2 4.18Å; L400-L421 HydrophobicContact CD2-CD1 4.12Å; L400-L421 HydrophobicContact CD2-CD2 3.66Å; L400-L421 HydrophobicContact CD2-CG 3.94Å; C417-L421 VanDerWaalsContact O-CB 3.29Å; C417-L421 WeakPolarHBondContact O-CB 3.47Å; C417-L421 WeakPolarHBondContact O-CG 3.22Å; C417-L421 PolarHBondContact O-N 3.1Å; L421-A423 VanDerWaalsContact C-N 3.31Å; L421-A423 PolarHBondContact O-N 2.62Å; L421-I424 PolarHBondContact O-N 2.95Å; L421-W425 WeakPolarHBondContact O-CB 3.28Å; L421-W425 PolarHBondContact O-N 3.1Å; L421-S802 WeakPolarHBondContact CD1-OG 3.48Å; L421-W805 HydrophobicContact CB-CE3 3.97Å; L421-W805 HydrophobicContact CB-CZ3 3.96Å; L421-I806 HydrophobicContact CD2-CD1 4.28Å; L421-I806 HydrophobicContact CD2-CG1 4.28Å; L421-F809 HydrophobicContact CD2-CE2 3.64Å; L421-F809 HydrophobicContact CD2-CZ 4.08Å
422	A	82.5	Confident	78.1	Confident	6 Å²	6	39.6 Å²	39.6	5%	0.05	23%	0.227	C	C	.	.	H	α-helix	trans	-75.7	-16	178.3	0	0	0	0	0	113.6	Q418 L420 Y426 W805	Q418-A422 VanDerWaalsContact O-CB 3.27Å; Q418-A422 WeakPolarHBondContact O-CB 3.11Å; Q418-A422 PolarHBondContact O-N 3.17Å; Q418-A422 VanDerWaalsContact O-N 3.09Å; L420-A422 VanDerWaalsContact C-N 3.3Å; L420-A422 PolarHBondContact O-N 2.89Å; A422-Y426 WeakPolarHBondContact O-CD2 3.42Å; A422-Y426 PolarHBondContact O-N 3.11Å; A422-W805 HydrophobicContact CB-CH2 3.93Å; A422-W805 HydrophobicContact CB-CZ3 3.99Å
423	A	78.9	Confident	76.2	Confident	57 Å²	57	45.5 Å²	45.5	47%	0.471	25%	0.249	S	C	.	.	H	α-helix	trans	-73	-45.5	169.3	0	0	0	0	0	110.9	Q419 L420 L421 E427	Q419-A423 PolarHBondContact O-N 3.48Å; Q419-A423 VanDerWaalsContact O-N 3.1Å; L420-A423 WeakPolarHBondContact O-CA 3.49Å; L420-A423 WeakPolarHBondContact O-CB 3.25Å; L420-A423 PolarHBondContact O-N 3.31Å; L421-A423 VanDerWaalsContact C-N 3.31Å; L421-A423 PolarHBondContact O-N 2.62Å; A423-E427 PolarHBondContact O-N 2.68Å; A423-E427 VanDerWaalsContact O-N 3.17Å
424	I	78.5	Confident	74.2	Confident	18 Å²	18	48.2 Å²	48.2	9%	0.092	26%	0.259	C	S	.	.	H	α-helix	trans	-66.4	-37.5	174.8	-59	168.1	0	0	0	110.8	M395 L397 L420 L421 E427 P499 F809	M395-I424 HydrophobicContact CB-CD1 4.34Å; M395-I424 HydrophobicContact CE-CD1 3.89Å; M395-I424 HydrophobicContact CE-CG1 3.94Å; M395-I424 HydrophobicContact SD-CD1 4.15Å; L397-I424 HydrophobicContact CD1-CD1 3.92Å; L397-I424 HydrophobicContact CD2-CD1 4.41Å; L397-I424 HydrophobicContact CG-CD1 4.47Å; L420-I424 HydrophobicContact CD1-CD1 4.49Å; L420-I424 HydrophobicContact CG-CD1 4.16Å; L420-I424 PolarHBondContact O-N 3.1Å; L421-I424 PolarHBondContact O-N 2.95Å; I424-E427 VanDerWaalsContact O-CB 3.27Å; I424-E427 WeakPolarHBondContact O-CB 3.26Å; I424-E427 PolarHBondContact O-N 2.94Å; I424-P499 VanDerWaalsContact O-CG 3.26Å; I424-P499 WeakPolarHBondContact O-CG 3.48Å; I424-F809 HydrophobicContact CB-CE1 4.32Å; I424-F809 HydrophobicContact CB-CZ 4.1Å; I424-F809 HydrophobicContact CG2-CD1 4.09Å; I424-F809 HydrophobicContact CG2-CE1 3.68Å; I424-F809 HydrophobicContact CG2-CE2 4.3Å; I424-F809 HydrophobicContact CG2-CZ 3.81Å
425	W	79.7	Confident	72	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.008	29%	0.286	C	S	.	.	H	α-helix	trans	-62.6	-44.3	178.1	-174.9	-107.1	0	0	0	113.2	L421 E427 P499 F500 F503 W805 Y808 F809	L421-W425 WeakPolarHBondContact O-CB 3.28Å; L421-W425 PolarHBondContact O-N 3.1Å; W425-E427 VanDerWaalsContact C-N 3.35Å; W425-P499 HydrophobicContact CE3-CB 4.02Å; W425-P499 HydrophobicContact CE3-CG 4.41Å; W425-P499 HydrophobicContact CZ3-CB 4.15Å; W425-F500 AromaticContact CE2-CD2 3.97Å; W425-F500 HydrophobicContact CZ2-CD2 4.17Å; W425-F500 AromaticContact NE1-CD2 3.51Å; W425-F500 VanDerWaalsContact O-CB 3.24Å; W425-F500 WeakPolarHBondContact O-CB 3.4Å; W425-F500 PolarHBondContact O-N 2.99Å; W425-F503 HydrophobicContact CH2-CB 3.55Å; W425-F503 HydrophobicContact CH2-CD1 4.39Å; W425-F503 HydrophobicContact CH2-CD2 4.36Å; W425-F503 AromaticContact CH2-CG 3.83Å; W425-F503 HydrophobicContact CH2-CG 3.83Å; W425-F503 HydrophobicContact CZ2-CB 3.9Å; W425-F503 AromaticContact CZ2-CD1 3.97Å; W425-F503 HydrophobicContact CZ2-CD1 3.97Å; W425-F503 AromaticContact CZ2-CG 3.88Å; W425-F503 HydrophobicContact CZ2-CG 3.88Å; W425-W805 HydrophobicContact CB-CD2 4.45Å; W425-W805 HydrophobicContact CD2-CB 4.41Å; W425-W805 AromaticContact CD2-CD1 3.58Å; W425-W805 HydrophobicContact CD2-CD2 4.04Å; W425-W805 AromaticContact CD2-CE2 3.96Å; W425-W805 AromaticContact CD2-CG 3.79Å; W425-W805 HydrophobicContact CD2-CG 3.79Å; W425-W805 AromaticContact CD2-NE1 3.67Å; W425-W805 AromaticContact CE2-CD1 3.59Å; W425-W805 AromaticContact CE2-NE1 3.42Å; W425-W805 HydrophobicContact CE3-CB 3.69Å; W425-W805 AromaticContact CE3-CD1 3.5Å; W425-W805 VanDerWaalsContact CE3-CD1 3.5Å; W425-W805 HydrophobicContact CE3-CD2 4.22Å; W425-W805 AromaticContact CE3-CG 3.54Å; W425-W805 HydrophobicContact CE3-CG 3.54Å; W425-W805 HydrophobicContact CG-CD2 4.15Å; W425-W805 AromaticContact CG-CE2 3.99Å; W425-W805 HydrophobicContact CG-CG 4.38Å; W425-W805 HydrophobicContact CG-CZ2 4.35Å; W425-W805 AromaticContact CH2-CD1 3.48Å; W425-W805 VanDerWaalsContact CH2-CD1 3.48Å; W425-W805 HydrophobicContact CH2-CG 4.29Å; W425-W805 AromaticContact CZ2-CD1 3.57Å; W425-W805 AromaticContact CZ2-NE1 3.65Å; W425-W805 HydrophobicContact CZ3-CB 3.85Å; W425-W805 AromaticContact CZ3-CD1 3.46Å; W425-W805 VanDerWaalsContact CZ3-CD1 3.46Å; W425-W805 AromaticContact CZ3-CG 3.82Å; W425-W805 HydrophobicContact CZ3-CG 3.82Å; W425-W805 AromaticContact NE1-NE1 3.75Å; W425-Y808 HydrophobicContact CH2-CD2 4.1Å; W425-Y808 HydrophobicContact CZ3-CD2 4.22Å; W425-Y808 HydrophobicContact CZ3-CG 4.48Å; W425-F809 AromaticContact CE3-CE1 3.96Å; W425-F809 HydrophobicContact CE3-CE1 3.96Å
426	Y	75.3	Confident	70	Confident	67 Å²	67	55.7 Å²	55.7	26%	0.263	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	22.1	178.7	-61.8	-62.1	0	0	0	113.3	A422 G428 L429 F432 F500	A422-Y426 WeakPolarHBondContact O-CD2 3.42Å; A422-Y426 PolarHBondContact O-N 3.11Å; Y426-G428 PolarHBondContact O-N 3.13Å; Y426-L429 PolarHBondContact O-N 3.34Å; Y426-F432 HydrophobicContact CD1-CB 3.96Å; Y426-F432 HydrophobicContact CD1-CG 4.36Å; Y426-F432 HydrophobicContact CE1-CB 4.14Å; Y426-F432 HydrophobicContact CG-CB 4.34Å; Y426-F500 HydrophobicContact CD1-CD2 4.46Å; Y426-F500 HydrophobicContact CD1-CG 4.4Å; Y426-F500 HydrophobicContact CE1-CD2 4.06Å; Y426-F500 HydrophobicContact CE1-CE2 4.19Å; Y426-F500 HydrophobicContact CE1-CG 4.44Å
427	E	68.8	Low	68	Low	106 Å²	106	60.8 Å²	60.8	50%	0.495	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	126.7	-174	-167.6	-173.3	120.5	0	0	111.9	A423 I424 W425 L429 K498	A423-E427 PolarHBondContact O-N 2.68Å; A423-E427 VanDerWaalsContact O-N 3.17Å; I424-E427 VanDerWaalsContact O-CB 3.27Å; I424-E427 WeakPolarHBondContact O-CB 3.26Å; I424-E427 PolarHBondContact O-N 2.94Å; W425-E427 VanDerWaalsContact C-N 3.35Å; E427-L429 VanDerWaalsContact C-N 3.27Å; E427-L429 PolarHBondContact O-N 2.93Å; E427-K498 VanDerWaalsContact O-CD 3.29Å; E427-K498 WeakPolarHBondContact O-CD 3.23Å; E427-K498 WeakPolarHBondContact O-CE 3.12Å
428	G	59.6	Low	66	Low	40 Å²	40	62.2 Å²	62.2	41%	0.412	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	27.7	-176.3	0	0	0	0	0	115	Y426 K498	Y426-G428 PolarHBondContact O-N 3.13Å; G428-K498 PolarHBondContact O-NZ 2.84Å
429	L	60.3	Low	64.1	Low	24 Å²	24	65.5 Å²	65.5	13%	0.126	35%	0.354	C	S	.	.			trans	-125.3	70.4	167.2	-68.9	171.8	0	0	0	110.6	Y426 E427 G431 F432 F500 I501	Y426-L429 PolarHBondContact O-N 3.34Å; E427-L429 VanDerWaalsContact C-N 3.27Å; E427-L429 PolarHBondContact O-N 2.93Å; L429-G431 PolarHBondContact O-N 3.29Å; L429-F432 HydrophobicContact CB-CD2 3.95Å; L429-F432 HydrophobicContact CB-CE2 4.15Å; L429-F500 HydrophobicContact CD1-CB 4.37Å; L429-F500 HydrophobicContact CD1-CD1 3.47Å; L429-F500 VanDerWaalsContact CD1-CD1 3.47Å; L429-F500 HydrophobicContact CD1-CE1 4.2Å; L429-F500 HydrophobicContact CD1-CG 4.32Å; L429-I501 HydrophobicContact CD1-CD1 3.94Å; L429-I501 HydrophobicContact CD1-CG1 4.33Å; L429-I501 HydrophobicContact CD2-CD1 4.44Å
430	P	52.2	Low	62.5	Low	80 Å²	80	66.3 Å²	66.3	52%	0.519	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	103.2	-169.1	27.7	-35.6	0	0	0	113
431	G	51.6	Low	61.1	Low	19 Å²	19	68.5 Å²	68.5	20%	0.196	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	150.9	-29.2	168.4	0	0	0	0	0	115.3	L429 R433 Q434	L429-G431 PolarHBondContact O-N 3.29Å; G431-R433 PolarHBondContact O-N 3.36Å; G431-Q434 PolarHBondContact O-N 3.23Å
432	F	53	Low	59.7	Low	62 Å²	62	76.3 Å²	76.3	27%	0.272	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-24.6	-169.5	-84.8	-95.3	0	0	0	115.8	Y426 L429 F458 I470 F500	Y426-F432 HydrophobicContact CD1-CB 3.96Å; Y426-F432 HydrophobicContact CD1-CG 4.36Å; Y426-F432 HydrophobicContact CE1-CB 4.14Å; Y426-F432 HydrophobicContact CG-CB 4.34Å; L429-F432 HydrophobicContact CB-CD2 3.95Å; L429-F432 HydrophobicContact CB-CE2 4.15Å; F432-F458 HydrophobicContact CE1-CE1 4.49Å; F432-F458 HydrophobicContact CE2-CD1 4.47Å; F432-F458 AromaticContact CE2-CE1 3.87Å; F432-F458 HydrophobicContact CE2-CE1 3.87Å; F432-F458 HydrophobicContact CE2-CZ 4.08Å; F432-F458 AromaticContact CZ-CE1 3.71Å; F432-F458 HydrophobicContact CZ-CE1 3.71Å; F432-F458 AromaticContact CZ-CZ 3.65Å; F432-F458 HydrophobicContact CZ-CZ 3.65Å; F432-I470 HydrophobicContact CE1-CD1 4.21Å; F432-F500 HydrophobicContact CE1-CE1 4.21Å; F432-F500 HydrophobicContact CE1-CZ 4.24Å; F432-F500 HydrophobicContact CZ-CE1 4.27Å
433	R	53.9	Low	58.6	Low	124 Å²	124	78.5 Å²	78.5	47%	0.468	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-13.7	-174.5	-166.5	174.5	176.8	-169	0.6	115.3	Q419 G431 K435	Q419-R433 PolarHBondContact O-NH1 3.08Å; G431-R433 PolarHBondContact O-N 3.36Å; R433-K435 VanDerWaalsContact C-N 3.31Å; R433-K435 PolarHBondContact O-N 3.01Å
434	Q	51.4	Low	57.6	Low	68 Å²	68	80.3 Å²	80.3	32%	0.318	43%	0.428	S	S	.	.			trans	-86.5	45.1	-163.3	-63	-167.6	3.8	0	0	114.9	G431 V438	G431-Q434 PolarHBondContact O-N 3.23Å; Q434-V438 HydrophobicContact CB-CG2 4Å; Q434-V438 HydrophobicContact CG-CG2 4.03Å
435	K	48.5	Very low	56.6	Low	166 Å²	166	90 Å²	90	72%	0.722	46%	0.464	S	S	*	.	S	Bend	trans	-81.1	-17.1	-171.1	-77.5	-166.7	174.2	-176.6	0	117.8	R433	R433-K435 VanDerWaalsContact C-N 3.31Å; R433-K435 PolarHBondContact O-N 3.01Å
436	P	50	Low	55.4	Low	114 Å²	114	96 Å²	96	74%	0.74	50%	0.495	S	S	*	.	S	Bend	trans	-129.1	-37.1	166.5	34.1	-21.8	0	0	0	116.7	V438	P436-V438 PolarHBondContact O-N 2.6Å
437	F	48.4	Very low	54.4	Low	170 Å²	170	95.9 Å²	95.9	75%	0.746	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-72.5	-17.8	-162.2	-171.1	-108.5	0	0	0	115.9	A439	F437-A439 VanDerWaalsContact C-N 3.29Å; F437-A439 PolarHBondContact O-N 2.94Å
438	V	48.1	Very low	53.6	Low	31 Å²	31	92.9 Å²	92.9	19%	0.188	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-96.1	32.1	-167.4	-166.8	0	0	0	0	112.6	Q434 P436 Q444 L447	Q434-V438 HydrophobicContact CB-CG2 4Å; Q434-V438 HydrophobicContact CG-CG2 4.03Å; P436-V438 PolarHBondContact O-N 2.6Å; V438-Q444 PolarHBondContact O-NE2 3.17Å; V438-L447 HydrophobicContact CG1-CD1 3.68Å
439	A	49	Very low	53.1	Low	83 Å²	83	95.3 Å²	95.3	69%	0.686	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-82	-17.8	168.5	0	0	0	0	0	113	F437 A441	F437-A439 VanDerWaalsContact C-N 3.29Å; F437-A439 PolarHBondContact O-N 2.94Å; A439-A441 PolarHBondContact O-N 3.27Å
440	H	53.7	Low	52.9	Low	130 Å²	130	100.8 Å²	100.8	60%	0.602	54%	0.536	S	S	*	.			trans	-72	119.2	-175.3	-121.4	-79.1	0	0	0	112.7	H442 C443 Q444	H440-H442 VanDerWaalsContact C-N 3.28Å; H440-H442 PolarHBondContact O-N 3.13Å; H440-C443 PolarHBondContact O-N 3.37Å; H440-Q444 PolarHBondContact O-N 3.26Å
441	A	54.5	Low	52.7	Low	69 Å²	69	103.3 Å²	103.3	57%	0.57	54%	0.535	S	S	*	.	H	α-helix	trans	-56.9	-34.9	-175.8	0	0	0	0	0	114.3	A439 C443 Q444 R445	A439-A441 PolarHBondContact O-N 3.27Å; A441-C443 PolarHBondContact O-N 3.42Å; A441-Q444 PolarHBondContact O-N 2.76Å; A441-R445 PolarHBondContact O-N 3.45Å
442	H	56.6	Low	52.5	Low	166 Å²	166	111.8 Å²	111.8	77%	0.769	56%	0.563	S	S	*	*	H	α-helix	trans	-63.7	-38.4	176.5	-108	-88.6	0	0	0	113	H440	H440-H442 VanDerWaalsContact C-N 3.28Å; H440-H442 PolarHBondContact O-N 3.13Å
443	C	59.4	Low	52.1	Low	52 Å²	52	118.3 Å²	118.3	35%	0.351	59%	0.594	S	S	.	*	H	α-helix	trans	-72.9	-34.1	177.8	-59.2	0	0	0	0	111.8	H440 A441 L446 L447	H440-C443 PolarHBondContact O-N 3.37Å; A441-C443 PolarHBondContact O-N 3.42Å; C443-L446 PolarHBondContact O-N 3.24Å; C443-L447 WeakPolarHBondContact O-CB 3.35Å; C443-L447 WeakPolarHBondContact O-CG 3.41Å; C443-L447 PolarHBondContact O-N 3.12Å
444	Q	58	Low	51.7	Low	96 Å²	96	115.4 Å²	115.4	45%	0.449	60%	0.602	S	S	.	*	H	α-helix	trans	-65.3	-39.4	-179.2	-68.5	174.9	-2.4	0	0	112.4	V438 H440 A441 L447 A448	V438-Q444 PolarHBondContact O-NE2 3.17Å; H440-Q444 PolarHBondContact O-N 3.26Å; A441-Q444 PolarHBondContact O-N 2.76Å; Q444-L447 PolarHBondContact O-N 2.9Å; Q444-A448 WeakPolarHBondContact O-CB 3.44Å; Q444-A448 PolarHBondContact O-N 3.08Å
445	R	56.6	Low	51.8	Low	222 Å²	222	117.1 Å²	117.1	84%	0.838	61%	0.613	S	S	*	*	H	α-helix	trans	-61.7	-42.5	175.6	-90.6	-177.8	165.6	151.9	-2.9	113.2	A441	A441-R445 PolarHBondContact O-N 3.45Å
446	L	55.5	Low	51.5	Low	128 Å²	128	115.3 Å²	115.3	67%	0.67	62%	0.618	S	S	*	*	H	α-helix	trans	-71.7	-40	177.9	-169.7	69.3	0	0	0	111.9	C443 A448 A449	C443-L446 PolarHBondContact O-N 3.24Å; L446-A448 PolarHBondContact O-N 3.46Å; L446-A449 PolarHBondContact O-N 3.06Å
447	L	54.1	Low	51.7	Low	64 Å²	64	112.1 Å²	112.1	34%	0.335	61%	0.606	S	S	.	*	H	α-helix	trans	-63.7	-38.2	178	-82.4	164.5	0	0	0	112.7	V438 C443 Q444 A449 I450 W451	V438-L447 HydrophobicContact CG1-CD1 3.68Å; C443-L447 WeakPolarHBondContact O-CB 3.35Å; C443-L447 WeakPolarHBondContact O-CG 3.41Å; C443-L447 PolarHBondContact O-N 3.12Å; Q444-L447 PolarHBondContact O-N 2.9Å; L447-A449 VanDerWaalsContact C-N 3.29Å; L447-A449 PolarHBondContact O-N 3.47Å; L447-I450 PolarHBondContact O-N 3.49Å; L447-I450 VanDerWaalsContact O-N 3.16Å; L447-W451 WeakPolarHBondContact O-CB 3.28Å; L447-W451 PolarHBondContact O-N 3.3Å
448	A	50.3	Low	51.9	Low	43 Å²	43	107 Å²	107	36%	0.355	58%	0.584	S	S	.	*	H	α-helix	trans	-59.7	-36.2	-179.7	0	0	0	0	0	113.2	Q444 L446 I450 W451	Q444-A448 WeakPolarHBondContact O-CB 3.44Å; Q444-A448 PolarHBondContact O-N 3.08Å; L446-A448 PolarHBondContact O-N 3.46Å; A448-I450 PolarHBondContact O-N 3.14Å; A448-W451 WeakPolarHBondContact O-CB 3.48Å; A448-W451 PolarHBondContact O-N 2.87Å
449	A	50.6	Low	52	Low	90 Å²	90	109.8 Å²	109.8	74%	0.744	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-19	179.6	0	0	0	0	0	113.9	L446 L447	L446-A449 PolarHBondContact O-N 3.06Å; L447-A449 VanDerWaalsContact C-N 3.29Å; L447-A449 PolarHBondContact O-N 3.47Å
450	I	55.5	Low	52.2	Low	139 Å²	139	114 Å²	114	71%	0.713	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	0.4	-177.5	-54.9	171.7	0	0	0	110.6	L447 A448	L447-I450 PolarHBondContact O-N 3.49Å; L447-I450 VanDerWaalsContact O-N 3.16Å; A448-I450 PolarHBondContact O-N 3.14Å
451	W	48.5	Very low	52.5	Low	134 Å²	134	112.1 Å²	112.1	51%	0.508	59%	0.587	S	S	.	*			trans	-89.2	-18.7	-155.8	-145	31.6	0	0	0	116.7	L447 A448	L447-W451 WeakPolarHBondContact O-CB 3.28Å; L447-W451 PolarHBondContact O-N 3.3Å; A448-W451 WeakPolarHBondContact O-CB 3.48Å; A448-W451 PolarHBondContact O-N 2.87Å
452	Y	47.6	Very low	53.4	Low	197 Å²	197	113.2 Å²	113.2	77%	0.773	59%	0.588	S	S	*	*	S	Bend	trans	-92.3	-10.8	-152.1	-83	-81.6	0	0	0	117.7
453	E	43.7	Very low	54.1	Low	199 Å²	199	110.4 Å²	110.4	93%	0.93	58%	0.582	S	S	*	*	S	Bend	trans	-100.6	-10.5	-169.5	-59.6	-165.6	130.2	0	0	116
454	G	46.5	Very low	54.8	Low	62 Å²	62	115.1 Å²	115.1	64%	0.639	60%	0.597	S	S	*	*	S	Bend	trans	-85.6	-76.4	-165.1	0	0	0	0	0	116.1
455	L	53.6	Low	55.6	Low	104 Å²	104	111.6 Å²	111.6	55%	0.545	58%	0.584	S	S	.	*			trans	-161.3	94.8	-169.4	-102.1	155.3	0	0	0	109.1
456	P	41.8	Very low	56.1	Low	129 Å²	129	103.3 Å²	103.3	84%	0.838	56%	0.555	S	S	*	*			trans	-71.2	147.9	-175.7	27.4	-33.8	0	0	0	113	F458	P456-F458 PolarHBondContact O-N 3.19Å
457	G	53.4	Low	57.1	Low	47 Å²	47	102.7 Å²	102.7	49%	0.485	55%	0.551	S	S	.	*	S	Bend	trans	80.7	-9.9	160.6	0	0	0	0	0	119	R459	G457-R459 VanDerWaalsContact C-N 3.3Å; G457-R459 PolarHBondContact O-N 3.42Å
458	F	53.2	Low	58.2	Low	62 Å²	62	102.5 Å²	102.5	27%	0.272	55%	0.553	S	S	.	*	S	Bend	trans	-60.6	-39.1	178.5	-170.1	-75.8	0	0	0	112.4	F432 P456 K461 Q466 T469	F432-F458 HydrophobicContact CE1-CE1 4.49Å; F432-F458 HydrophobicContact CE2-CD1 4.47Å; F432-F458 AromaticContact CE2-CE1 3.87Å; F432-F458 HydrophobicContact CE2-CE1 3.87Å; F432-F458 HydrophobicContact CE2-CZ 4.08Å; F432-F458 AromaticContact CZ-CE1 3.71Å; F432-F458 HydrophobicContact CZ-CE1 3.71Å; F432-F458 AromaticContact CZ-CZ 3.65Å; F432-F458 HydrophobicContact CZ-CZ 3.65Å; P456-F458 PolarHBondContact O-N 3.19Å; F458-K461 WeakPolarHBondContact O-CB 3.32Å; F458-K461 PolarHBondContact O-N 3.25Å; F458-Q466 HydrophobicContact CE1-CG 4.31Å; F458-T469 HydrophobicContact CE2-CG2 4.36Å; F458-T469 WeakPolarHBondContact CE2-OG1 3.22Å; F458-T469 VanDerWaalsContact CZ-OG1 3.27Å; F458-T469 WeakPolarHBondContact CZ-OG1 3.44Å
459	R	49.4	Very low	59.2	Low	89 Å²	89	101.7 Å²	101.7	34%	0.336	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-27.5	-166.2	-177.3	180	171.1	170.4	2.9	115.4	G457 K461	G457-R459 VanDerWaalsContact C-N 3.3Å; G457-R459 PolarHBondContact O-N 3.42Å; R459-K461 VanDerWaalsContact C-N 3.33Å
460	Q	54	Low	60.5	Low	173 Å²	173	99.6 Å²	99.6	81%	0.808	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-8.3	179.6	-73	174	-20.5	0	0	112.9
461	K	60.2	Low	61.7	Low	90 Å²	90	94.7 Å²	94.7	39%	0.391	50%	0.503	S	S	.	.	S	Bend	trans	-67.4	139.2	179.5	-70.7	-176.9	178.3	-171.3	0	110.9	F458 R459 A465 Q466 T469	F458-K461 WeakPolarHBondContact O-CB 3.32Å; F458-K461 PolarHBondContact O-N 3.25Å; R459-K461 VanDerWaalsContact C-N 3.33Å; K461-A465 HydrophobicContact CB-CB 3.81Å; K461-A465 HydrophobicContact CD-CB 4.29Å; K461-A465 HydrophobicContact CG-CB 4.3Å; K461-Q466 HydrophobicContact CB-CG 4.41Å; K461-Q466 PolarHBondContact O-NE2 3.35Å; K461-T469 HydrophobicContact CD-CG2 4.42Å
462	P	73.9	Confident	63.3	Low	91 Å²	91	92 Å²	92	59%	0.591	50%	0.502	S	S	*	.			trans	-61.1	164.6	174.7	25.7	-35.5	0	0	0	111.5	F464 A465 Q466	P462-F464 PolarHBondContact O-N 2.71Å; P462-F464 VanDerWaalsContact O-N 3.13Å; P462-A465 HydrophobicContact CG-CB 3.95Å; P462-A465 CarbonylContact O-C 3.59Å; P462-A465 WeakPolarHBondContact O-CA 3.44Å; P462-A465 PolarHBondContact O-N 3.22Å; P462-Q466 PolarHBondContact O-N 2.74Å
463	V	69.4	Low	64.7	Low	107 Å²	107	83.9 Å²	83.9	65%	0.648	47%	0.472	S	S	*	.	H	α-helix	trans	-52.5	-40.9	-176.1	-179.4	0	0	0	0	112.3	A465 Q466 L467	V463-A465 PolarHBondContact O-N 2.79Å; V463-Q466 PolarHBondContact O-N 2.93Å; V463-L467 WeakPolarHBondContact O-CB 3.47Å; V463-L467 PolarHBondContact O-N 3.27Å
464	F	75.9	Confident	66.6	Low	152 Å²	152	75.6 Å²	75.6	67%	0.667	44%	0.435	S	S	*	.	H	α-helix	trans	-57.6	-46.9	173	179.6	-101.7	0	0	0	112.5	P462 Q466 L467 T468	P462-F464 PolarHBondContact O-N 2.71Å; P462-F464 VanDerWaalsContact O-N 3.13Å; F464-Q466 VanDerWaalsContact C-N 3.29Å; F464-Q466 PolarHBondContact O-N 3.25Å; F464-L467 CarbonylContact O-C 3.45Å; F464-L467 WeakPolarHBondContact O-CB 3.47Å; F464-L467 PolarHBondContact O-N 2.92Å; F464-L467 VanDerWaalsContact O-N 3.15Å; F464-T468 HydrophobicContact CD1-CG2 4.16Å; F464-T468 HydrophobicContact CE1-CG2 3.7Å; F464-T468 HydrophobicContact CE2-CG2 4.2Å; F464-T468 HydrophobicContact CZ-CG2 3.72Å; F464-T468 WeakPolarHBondContact O-CG2 3.46Å; F464-T468 PolarHBondContact O-N 2.92Å
465	A	73.3	Confident	68.4	Low	22 Å²	22	77.1 Å²	77.1	18%	0.182	44%	0.436	C	S	.	.	H	α-helix	trans	-80.4	-6	-179.8	0	0	0	0	0	114.2	K461 P462 V463 T468 T469	K461-A465 HydrophobicContact CB-CB 3.81Å; K461-A465 HydrophobicContact CD-CB 4.29Å; K461-A465 HydrophobicContact CG-CB 4.3Å; P462-A465 HydrophobicContact CG-CB 3.95Å; P462-A465 CarbonylContact O-C 3.59Å; P462-A465 WeakPolarHBondContact O-CA 3.44Å; P462-A465 PolarHBondContact O-N 3.22Å; V463-A465 PolarHBondContact O-N 2.79Å; A465-T468 WeakPolarHBondContact CA-OG1 3.43Å; A465-T469 WeakPolarHBondContact O-CG2 3.2Å; A465-T469 PolarHBondContact O-OG1 2.9Å
466	Q	68.3	Low	69.9	Low	48 Å²	48	76 Å²	76	22%	0.224	43%	0.43	C	S	.	.	H	α-helix	trans	-82.2	-42.4	160.6	-64.8	174.4	17.4	0	0	110	F458 K461 P462 V463 F464 T469 I470	F458-Q466 HydrophobicContact CE1-CG 4.31Å; K461-Q466 HydrophobicContact CB-CG 4.41Å; K461-Q466 PolarHBondContact O-NE2 3.35Å; P462-Q466 PolarHBondContact O-N 2.74Å; V463-Q466 PolarHBondContact O-N 2.93Å; F464-Q466 VanDerWaalsContact C-N 3.29Å; F464-Q466 PolarHBondContact O-N 3.25Å; Q466-T469 WeakPolarHBondContact CA-OG1 3.33Å; Q466-T469 PolarHBondContact O-N 3.48Å; Q466-T469 PolarHBondContact O-OG1 3.05Å; Q466-I470 WeakPolarHBondContact O-CG1 3.33Å; Q466-I470 PolarHBondContact O-N 3.33Å
467	L	76	Confident	72.2	Confident	114 Å²	114	70.5 Å²	70.5	60%	0.597	39%	0.393	S	S	*	.	H	α-helix	trans	-63.9	-42.4	176.3	-176.7	64.3	0	0	0	112	V463 F464 T469 I470 G471	V463-L467 WeakPolarHBondContact O-CB 3.47Å; V463-L467 PolarHBondContact O-N 3.27Å; F464-L467 CarbonylContact O-C 3.45Å; F464-L467 WeakPolarHBondContact O-CB 3.47Å; F464-L467 PolarHBondContact O-N 2.92Å; F464-L467 VanDerWaalsContact O-N 3.15Å; L467-T469 PolarHBondContact O-N 2.98Å; L467-I470 PolarHBondContact O-N 3.19Å; L467-G471 PolarHBondContact O-N 3.22Å
468	T	76.9	Confident	73.8	Confident	60 Å²	60	70.3 Å²	70.3	37%	0.368	38%	0.383	S	S	.	.	H	α-helix	trans	-66.1	-36.2	175.4	60	0	0	0	0	112.1	F464 A465 G471 T472	F464-T468 HydrophobicContact CD1-CG2 4.16Å; F464-T468 HydrophobicContact CE1-CG2 3.7Å; F464-T468 HydrophobicContact CE2-CG2 4.2Å; F464-T468 HydrophobicContact CZ-CG2 3.72Å; F464-T468 WeakPolarHBondContact O-CG2 3.46Å; F464-T468 PolarHBondContact O-N 2.92Å; A465-T468 WeakPolarHBondContact CA-OG1 3.43Å; T468-G471 CarbonylContact O-C 3.53Å; T468-G471 PolarHBondContact O-N 3.35Å; T468-T472 WeakPolarHBondContact O-CG2 2.76Å; T468-T472 PolarHBondContact O-N 2.99Å; T468-T472 PolarHBondContact O-OG1 3.21Å
469	T	72	Confident	75.4	Confident	27 Å²	27	71.9 Å²	71.9	17%	0.166	39%	0.394	C	S	.	.	H	α-helix	trans	-73.5	-29.4	175.5	49.8	0	0	0	0	113.7	F458 K461 A465 Q466 L467 T472 L473	F458-T469 HydrophobicContact CE2-CG2 4.36Å; F458-T469 WeakPolarHBondContact CE2-OG1 3.22Å; F458-T469 VanDerWaalsContact CZ-OG1 3.27Å; F458-T469 WeakPolarHBondContact CZ-OG1 3.44Å; K461-T469 HydrophobicContact CD-CG2 4.42Å; A465-T469 WeakPolarHBondContact O-CG2 3.2Å; A465-T469 PolarHBondContact O-OG1 2.9Å; Q466-T469 WeakPolarHBondContact CA-OG1 3.33Å; Q466-T469 PolarHBondContact O-N 3.48Å; Q466-T469 PolarHBondContact O-OG1 3.05Å; L467-T469 PolarHBondContact O-N 2.98Å; T469-T472 PolarHBondContact O-OG1 3.43Å; T469-L473 VanDerWaalsContact O-CB 3.23Å; T469-L473 WeakPolarHBondContact O-CB 3.07Å; T469-L473 PolarHBondContact O-N 2.89Å; T469-L473 VanDerWaalsContact O-N 3.15Å
470	I	76.7	Confident	77.1	Confident	45 Å²	45	68.2 Å²	68.2	23%	0.231	38%	0.381	C	S	.	.	H	α-helix	trans	-68.4	-41.3	166.6	-70.3	160.1	0	0	0	109.3	F432 Q466 L467 L473 C474 L504	F432-I470 HydrophobicContact CE1-CD1 4.21Å; Q466-I470 WeakPolarHBondContact O-CG1 3.33Å; Q466-I470 PolarHBondContact O-N 3.33Å; L467-I470 PolarHBondContact O-N 3.19Å; I470-L473 WeakPolarHBondContact O-CB 3.3Å; I470-L473 PolarHBondContact O-N 2.96Å; I470-C474 WeakPolarHBondContact O-CB 3.49Å; I470-C474 PolarHBondContact O-N 3.45Å; I470-C474 PolarHBondContact O-SG 3.49Å; I470-L504 HydrophobicContact CG2-CD1 4.16Å; I470-L504 HydrophobicContact CG2-CD2 4.23Å
471	G	81.2	Confident	78.6	Confident	36 Å²	36	60 Å²	60	37%	0.371	34%	0.343	S	S	.	.	H	α-helix	trans	-63.6	-42.6	178	0	0	0	0	0	113.8	L467 T468 C474 S475	L467-G471 PolarHBondContact O-N 3.22Å; T468-G471 CarbonylContact O-C 3.53Å; T468-G471 PolarHBondContact O-N 3.35Å; G471-C474 WeakPolarHBondContact O-CB 3.25Å; G471-C474 PolarHBondContact O-N 2.9Å; G471-S475 WeakPolarHBondContact O-CB 3.49Å; G471-S475 PolarHBondContact O-N 2.73Å
472	T	81.5	Confident	79.7	Confident	78 Å²	78	58 Å²	58	48%	0.479	34%	0.338	S	S	.	.	H	α-helix	trans	-67.1	-41.6	172.7	55.6	0	0	0	0	110.9	T468 T469 C474 S475 L476	T468-T472 WeakPolarHBondContact O-CG2 2.76Å; T468-T472 PolarHBondContact O-N 2.99Å; T468-T472 PolarHBondContact O-OG1 3.21Å; T469-T472 PolarHBondContact O-OG1 3.43Å; T472-C474 VanDerWaalsContact C-N 3.32Å; T472-C474 PolarHBondContact O-N 3.01Å; T472-S475 PolarHBondContact O-N 2.66Å; T472-L476 VanDerWaalsContact O-CB 3.28Å; T472-L476 WeakPolarHBondContact O-CB 3.23Å; T472-L476 WeakPolarHBondContact O-CD1 3.32Å; T472-L476 WeakPolarHBondContact O-CG 3.32Å; T472-L476 PolarHBondContact O-N 3.31Å
473	L	78.7	Confident	80.3	Confident	27 Å²	27	57.9 Å²	57.9	14%	0.141	33%	0.329	C	S	.	.	H	α-helix	trans	-59.7	-40.6	174.5	176.6	57.9	0	0	0	112.4	T469 I470 L476 F477 L480 M495 I501 L504	T469-L473 VanDerWaalsContact O-CB 3.23Å; T469-L473 WeakPolarHBondContact O-CB 3.07Å; T469-L473 PolarHBondContact O-N 2.89Å; T469-L473 VanDerWaalsContact O-N 3.15Å; I470-L473 WeakPolarHBondContact O-CB 3.3Å; I470-L473 PolarHBondContact O-N 2.96Å; L473-L476 PolarHBondContact O-N 3.46Å; L473-F477 PolarHBondContact O-N 3.08Å; L473-L480 HydrophobicContact CD1-CD1 3.52Å; L473-M495 HydrophobicContact CD1-CE 3.47Å; L473-M495 VanDerWaalsContact CD1-CE 3.47Å; L473-M495 HydrophobicContact CD2-CE 4.39Å; L473-I501 HydrophobicContact CD2-CD1 3.81Å; L473-L504 HydrophobicContact CB-CD2 4.42Å; L473-L504 HydrophobicContact CD2-CD2 3.53Å; L473-L504 HydrophobicContact CG-CD2 3.76Å
474	C	83.2	Confident	81	Confident	24 Å²	24	54.6 Å²	54.6	16%	0.162	31%	0.305	C	S	.	.	H	α-helix	trans	-60.1	-55.5	169.2	-71.9	0	0	0	0	110.9	I470 G471 T472 L476 F477 L504 S508	I470-C474 WeakPolarHBondContact O-CB 3.49Å; I470-C474 PolarHBondContact O-N 3.45Å; I470-C474 PolarHBondContact O-SG 3.49Å; G471-C474 WeakPolarHBondContact O-CB 3.25Å; G471-C474 PolarHBondContact O-N 2.9Å; T472-C474 VanDerWaalsContact C-N 3.32Å; T472-C474 PolarHBondContact O-N 3.01Å; C474-L476 PolarHBondContact O-N 3.2Å; C474-L476 VanDerWaalsContact O-N 3.1Å; C474-F477 WeakPolarHBondContact O-CB 3.26Å; C474-F477 VanDerWaalsContact O-CD1 3.31Å; C474-F477 WeakPolarHBondContact O-CD1 3.41Å; C474-F477 PolarHBondContact O-N 2.86Å; C474-L504 VanDerWaalsContact SG-CD1 3.56Å; C474-S508 WeakPolarHBondContact CA-OG 3.23Å; C474-S508 WeakPolarHBondContact CB-OG 3.38Å; C474-S508 PolarHBondContact O-OG 3.4Å; C474-S508 VanDerWaalsContact O-OG 3.04Å
475	S	83.6	Confident	81.3	Confident	94 Å²	94	49 Å²	49	66%	0.657	28%	0.281	S	S	*	.	H	α-helix	trans	-59.5	-25.7	-179.3	-169.3	0	0	0	0	113.9	G471 T472 P478	G471-S475 WeakPolarHBondContact O-CB 3.49Å; G471-S475 PolarHBondContact O-N 2.73Å; T472-S475 PolarHBondContact O-N 2.66Å; S475-P478 WeakPolarHBondContact O-CD 3.49Å
476	L	85.9	Confident	81.8	Confident	81 Å²	81	55 Å²	55	42%	0.424	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	4.8	179	-66.7	166.3	0	0	0	113.3	T472 L473 C474 P478 L479 L480	T472-L476 VanDerWaalsContact O-CB 3.28Å; T472-L476 WeakPolarHBondContact O-CB 3.23Å; T472-L476 WeakPolarHBondContact O-CD1 3.32Å; T472-L476 WeakPolarHBondContact O-CG 3.32Å; T472-L476 PolarHBondContact O-N 3.31Å; L473-L476 PolarHBondContact O-N 3.46Å; C474-L476 PolarHBondContact O-N 3.2Å; C474-L476 VanDerWaalsContact O-N 3.1Å; L476-P478 VanDerWaalsContact C-N 3.28Å; L476-L479 HydrophobicContact CD2-CD1 3.88Å; L476-L479 PolarHBondContact O-N 3.08Å; L476-L479 VanDerWaalsContact O-N 3.17Å; L476-L480 HydrophobicContact CB-CD1 4.39Å; L476-L480 PolarHBondContact O-N 3.4Å
477	F	88.8	Confident	82.5	Confident	13 Å²	13	54.7 Å²	54.7	6%	0.057	32%	0.315	C	S	.	.	H	α-helix	trans	-50.7	-36.1	177	91.4	-98.2	0	0	0	114.8	L473 C474 A481 C505 S512 P816 F819	L473-F477 PolarHBondContact O-N 3.08Å; C474-F477 WeakPolarHBondContact O-CB 3.26Å; C474-F477 VanDerWaalsContact O-CD1 3.31Å; C474-F477 WeakPolarHBondContact O-CD1 3.41Å; C474-F477 PolarHBondContact O-N 2.86Å; F477-A481 WeakPolarHBondContact O-CB 3.41Å; F477-A481 PolarHBondContact O-N 2.81Å; F477-C505 HydrophobicContact CB-CB 4.14Å; F477-S512 WeakPolarHBondContact CE1-OG 3.29Å; F477-S512 WeakPolarHBondContact CZ-OG 3.45Å; F477-P816 HydrophobicContact CD2-CG 3.89Å; F477-P816 HydrophobicContact CE2-CG 4.37Å; F477-F819 HydrophobicContact CE2-CD2 4.46Å; F477-F819 HydrophobicContact CE2-CE2 4.06Å
478	P	86.6	Confident	82.5	Confident	43 Å²	43	51.3 Å²	51.3	28%	0.279	30%	0.3	S	S	.	.	H	α-helix	trans	-66.8	-43.9	179.6	-22.2	36.2	0	0	0	112.2	S475 L476 A481 T482 F819	S475-P478 WeakPolarHBondContact O-CD 3.49Å; L476-P478 VanDerWaalsContact C-N 3.28Å; P478-A481 PolarHBondContact O-N 2.88Å; P478-T482 PolarHBondContact O-N 3.32Å; P478-T482 PolarHBondContact O-OG1 2.83Å; P478-F819 HydrophobicContact CB-CE2 3.94Å; P478-F819 HydrophobicContact CB-CZ 3.84Å
479	L	87.3	Confident	82.6	Confident	95 Å²	95	56.3 Å²	56.3	50%	0.497	32%	0.319	S	S	.	.	H	α-helix	trans	-68.5	-39.9	179.1	-63.4	178.5	0	0	0	111.2	L476 A481 T482 F483	L476-L479 HydrophobicContact CD2-CD1 3.88Å; L476-L479 PolarHBondContact O-N 3.08Å; L476-L479 VanDerWaalsContact O-N 3.17Å; L479-A481 VanDerWaalsContact C-N 3.31Å; L479-A481 PolarHBondContact O-N 3.29Å; L479-T482 PolarHBondContact O-N 2.86Å; L479-T482 PolarHBondContact O-OG1 2.71Å; L479-F483 HydrophobicContact CB-CD2 4.43Å; L479-F483 HydrophobicContact CB-CE2 4.25Å; L479-F483 WeakPolarHBondContact O-CB 3.12Å; L479-F483 WeakPolarHBondContact O-CD2 3.45Å; L479-F483 WeakPolarHBondContact O-CG 3.48Å; L479-F483 PolarHBondContact O-N 3.21Å
480	L	85.1	Confident	83.2	Confident	12 Å²	12	56.8 Å²	56.8	6%	0.063	32%	0.324	C	S	.	.	H	α-helix	trans	-63	-37.8	174.9	-74.4	163.2	0	0	0	112	L473 L476 Y484 L492 M496	L473-L480 HydrophobicContact CD1-CD1 3.52Å; L476-L480 HydrophobicContact CB-CD1 4.39Å; L476-L480 PolarHBondContact O-N 3.4Å; L480-Y484 WeakPolarHBondContact O-CB 3.38Å; L480-Y484 PolarHBondContact O-N 2.83Å; L480-L492 HydrophobicContact CD2-CD2 4.16Å; L480-M496 HydrophobicContact CB-CG 3.87Å; L480-M496 HydrophobicContact CB-SD 3.78Å; L480-M496 HydrophobicContact CD2-CG 4.42Å
481	A	85.7	Confident	83.4	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-65.1	-44.7	173.5	0	0	0	0	0	112.5	F477 P478 L479 Y484 M485 P816 F819	F477-A481 WeakPolarHBondContact O-CB 3.41Å; F477-A481 PolarHBondContact O-N 2.81Å; P478-A481 PolarHBondContact O-N 2.88Å; L479-A481 VanDerWaalsContact C-N 3.31Å; L479-A481 PolarHBondContact O-N 3.29Å; A481-Y484 WeakPolarHBondContact O-CB 3.32Å; A481-Y484 PolarHBondContact O-N 3Å; A481-M485 WeakPolarHBondContact O-CG 3.34Å; A481-M485 PolarHBondContact O-N 3.27Å; A481-M485 VanDerWaalsContact O-N 3.09Å; A481-P816 HydrophobicContact CB-CG 4.37Å; A481-F819 HydrophobicContact CB-CB 4.32Å; A481-F819 HydrophobicContact CB-CD2 3.89Å; A481-F819 HydrophobicContact CB-CE2 4.47Å; A481-F819 HydrophobicContact CB-CG 4.08Å
482	T	84.2	Confident	83.3	Confident	49 Å²	49	65.7 Å²	65.7	30%	0.301	35%	0.353	S	S	.	.	H	α-helix	trans	-68.4	-39.8	178.2	57.3	0	0	0	0	112.5	P478 L479 Y484 M485 L486 F819	P478-T482 PolarHBondContact O-N 3.32Å; P478-T482 PolarHBondContact O-OG1 2.83Å; L479-T482 PolarHBondContact O-N 2.86Å; L479-T482 PolarHBondContact O-OG1 2.71Å; T482-Y484 VanDerWaalsContact C-N 3.31Å; T482-Y484 PolarHBondContact O-N 2.91Å; T482-M485 PolarHBondContact O-N 3.35Å; T482-M485 VanDerWaalsContact O-N 3.16Å; T482-L486 WeakPolarHBondContact O-CG 3.39Å; T482-L486 PolarHBondContact O-N 2.72Å; T482-F819 HydrophobicContact CG2-CE1 4.32Å
483	F	85.6	Confident	83.2	Confident	88 Å²	88	62 Å²	62	39%	0.386	33%	0.331	S	S	.	.	H	α-helix	trans	-61.2	-37.3	172.5	-74.6	-55.5	0	0	0	112.6	L479 A487 L492	L479-F483 HydrophobicContact CB-CD2 4.43Å; L479-F483 HydrophobicContact CB-CE2 4.25Å; L479-F483 WeakPolarHBondContact O-CB 3.12Å; L479-F483 WeakPolarHBondContact O-CD2 3.45Å; L479-F483 WeakPolarHBondContact O-CG 3.48Å; L479-F483 PolarHBondContact O-N 3.21Å; F483-A487 CarbonylContact O-C 3.56Å; F483-A487 PolarHBondContact O-N 2.83Å; F483-L492 HydrophobicContact CB-CB 4.21Å; F483-L492 HydrophobicContact CD2-CB 4.46Å; F483-L492 HydrophobicContact CD2-CD1 3.72Å; F483-L492 HydrophobicContact CE2-CD1 3.83Å; F483-L492 HydrophobicContact CG-CB 4.42Å; F483-L492 HydrophobicContact CG-CD1 4.14Å; F483-L492 HydrophobicContact CZ-CD1 4.31Å
484	Y	83.9	Confident	83.2	Confident	39 Å²	39	63.3 Å²	63.3	15%	0.153	34%	0.342	C	S	.	.	H	α-helix	trans	-64	-39.9	173.5	-178.5	-95.8	0	0	0	112.5	L480 A481 T482 P488 G493 M496 R497 T814 V815	L480-Y484 WeakPolarHBondContact O-CB 3.38Å; L480-Y484 PolarHBondContact O-N 2.83Å; A481-Y484 WeakPolarHBondContact O-CB 3.32Å; A481-Y484 PolarHBondContact O-N 3Å; T482-Y484 VanDerWaalsContact C-N 3.31Å; T482-Y484 PolarHBondContact O-N 2.91Å; Y484-P488 WeakPolarHBondContact O-CB 3.41Å; Y484-G493 WeakPolarHBondContact CD2-O 3.48Å; Y484-M496 HydrophobicContact CD2-CB 3.81Å; Y484-M496 HydrophobicContact CG-CB 4.21Å; Y484-R497 HydrophobicContact CE2-CG 3.87Å; Y484-T814 WeakPolarHBondContact CE1-OG1 3.34Å; Y484-T814 PolarHBondContact OH-OG1 3.17Å; Y484-V815 HydrophobicContact CD1-CG2 3.73Å; Y484-V815 HydrophobicContact CE1-CG2 4.02Å
485	M	82.6	Confident	83	Confident	35 Å²	35	64 Å²	64	17%	0.172	34%	0.343	C	S	.	.	H	α-helix	trans	-71.5	-38.9	179.7	-70.6	169.6	60.8	0	0	113.2	A481 T482 V815 F819 I822	A481-M485 WeakPolarHBondContact O-CG 3.34Å; A481-M485 PolarHBondContact O-N 3.27Å; A481-M485 VanDerWaalsContact O-N 3.09Å; T482-M485 PolarHBondContact O-N 3.35Å; T482-M485 VanDerWaalsContact O-N 3.16Å; M485-V815 HydrophobicContact CG-CG2 4.47Å; M485-F819 HydrophobicContact SD-CB 4.36Å; M485-I822 HydrophobicContact CE-CB 3.63Å; M485-I822 HydrophobicContact CE-CD1 4.07Å; M485-I822 HydrophobicContact CE-CG1 4.45Å; M485-I822 HydrophobicContact CE-CG2 3.51Å
486	L	84.1	Confident	82.8	Confident	146 Å²	146	59.5 Å²	59.5	76%	0.764	31%	0.312	S	S	*	.	H	α-helix	trans	-82.9	-44.5	-177.5	-66.8	171.6	0	0	0	112.9	T482	T482-L486 WeakPolarHBondContact O-CG 3.39Å; T482-L486 PolarHBondContact O-N 2.72Å
487	A	82.3	Confident	82.5	Confident	42 Å²	42	60.1 Å²	60.1	35%	0.347	31%	0.309	S	S	.	.			trans	-137.7	69.8	-171	0	0	0	0	0	111.6	F483 H489 S490	F483-A487 CarbonylContact O-C 3.56Å; F483-A487 PolarHBondContact O-N 2.83Å; A487-H489 PolarHBondContact O-N 3.1Å; A487-S490 VanDerWaalsContact O-CB 3.32Å; A487-S490 WeakPolarHBondContact O-CB 3.36Å; A487-S490 PolarHBondContact O-N 3.02Å; A487-S490 PolarHBondContact O-OG 2.82Å
488	P	77.2	Confident	82.1	Confident	43 Å²	43	61.9 Å²	61.9	28%	0.279	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-6.9	-172.5	24.4	-33.8	0	0	0	115.3	Y484 R497	Y484-P488 WeakPolarHBondContact O-CB 3.41Å; P488-R497 PolarHBondContact O-NE 3.5Å; P488-R497 PolarHBondContact O-NH2 2.85Å
489	H	78	Confident	81.9	Confident	165 Å²	165	60.3 Å²	60.3	76%	0.764	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-4.5	174.2	-67.1	-99.3	0	0	0	113.4	A487	A487-H489 PolarHBondContact O-N 3.1Å
490	S	84	Confident	81.7	Confident	38 Å²	38	56.9 Å²	56.9	27%	0.266	29%	0.287	S	S	.	.	S	Bend	trans	-66.3	159.5	173.1	67.6	0	0	0	0	111.5	A487 L492 G493 S494	A487-S490 VanDerWaalsContact O-CB 3.32Å; A487-S490 WeakPolarHBondContact O-CB 3.36Å; A487-S490 PolarHBondContact O-N 3.02Å; A487-S490 PolarHBondContact O-OG 2.82Å; S490-L492 PolarHBondContact O-N 3.39Å; S490-L492 VanDerWaalsContact O-N 3.17Å; S490-G493 PolarHBondContact O-N 2.7Å; S490-G493 PolarHBondContact OG-N 2.74Å; S490-S494 PolarHBondContact O-N 2.78Å; S490-S494 PolarHBondContact O-OG 3.01Å
491	K	81.2	Confident	81.6	Confident	191 Å²	191	56.3 Å²	56.3	83%	0.83	29%	0.285	S	S	*	.	H	α-helix	trans	-57.9	-29.4	176.6	-67.3	-171.6	177.1	-173.4	0	113.2	S494 M495	K491-S494 PolarHBondContact O-OG 3.17Å; K491-M495 WeakPolarHBondContact O-CB 3.48Å; K491-M495 PolarHBondContact O-N 3.38Å
492	L	80.7	Confident	81.6	Confident	76 Å²	76	56.8 Å²	56.8	40%	0.398	29%	0.287	S	S	.	.	H	α-helix	trans	-79.6	-39.5	174.4	-66.5	172.1	0	0	0	112.1	L480 F483 S490 M495 M496	L480-L492 HydrophobicContact CD2-CD2 4.16Å; F483-L492 HydrophobicContact CB-CB 4.21Å; F483-L492 HydrophobicContact CD2-CB 4.46Å; F483-L492 HydrophobicContact CD2-CD1 3.72Å; F483-L492 HydrophobicContact CE2-CD1 3.83Å; F483-L492 HydrophobicContact CG-CB 4.42Å; F483-L492 HydrophobicContact CG-CD1 4.14Å; F483-L492 HydrophobicContact CZ-CD1 4.31Å; S490-L492 PolarHBondContact O-N 3.39Å; S490-L492 VanDerWaalsContact O-N 3.17Å; L492-M495 WeakPolarHBondContact O-CB 3.37Å; L492-M495 PolarHBondContact O-N 3.04Å; L492-M496 PolarHBondContact O-N 3.05Å
493	G	78.3	Confident	81.7	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.3	-42.6	173.7	0	0	0	0	0	112.9	Y484 S490 M495 M496	Y484-G493 WeakPolarHBondContact CD2-O 3.48Å; S490-G493 PolarHBondContact O-N 2.7Å; S490-G493 PolarHBondContact OG-N 2.74Å; G493-M495 VanDerWaalsContact C-N 3.35Å; G493-M496 PolarHBondContact O-N 2.66Å
494	S	77.7	Confident	81.7	Confident	56 Å²	56	52 Å²	52	39%	0.392	26%	0.262	S	S	.	.	H	α-helix	trans	-69	-32.5	175	66.1	0	0	0	0	112.3	S490 K491 M496 R497	S490-S494 PolarHBondContact O-N 2.78Å; S490-S494 PolarHBondContact O-OG 3.01Å; K491-S494 PolarHBondContact O-OG 3.17Å; S494-M496 VanDerWaalsContact C-N 3.31Å; S494-M496 PolarHBondContact O-N 2.89Å; S494-R497 WeakPolarHBondContact O-CB 3.41Å; S494-R497 PolarHBondContact O-N 2.85Å
495	M	80.1	Confident	81.9	Confident	37 Å²	37	50.2 Å²	50.2	18%	0.182	26%	0.255	C	S	.	.	H	α-helix	trans	-59.4	-38.5	171	175	171	159.5	0	0	112.5	L473 K491 L492 G493 R497 K498 I501	L473-M495 HydrophobicContact CD1-CE 3.47Å; L473-M495 VanDerWaalsContact CD1-CE 3.47Å; L473-M495 HydrophobicContact CD2-CE 4.39Å; K491-M495 WeakPolarHBondContact O-CB 3.48Å; K491-M495 PolarHBondContact O-N 3.38Å; L492-M495 WeakPolarHBondContact O-CB 3.37Å; L492-M495 PolarHBondContact O-N 3.04Å; G493-M495 VanDerWaalsContact C-N 3.35Å; M495-R497 PolarHBondContact O-N 3.2Å; M495-K498 WeakPolarHBondContact O-CB 3.35Å; M495-K498 PolarHBondContact O-N 3.48Å; M495-K498 VanDerWaalsContact O-N 3.17Å; M495-I501 HydrophobicContact CE-CD1 3.91Å; M495-I501 HydrophobicContact CG-CG1 4.18Å; M495-I501 HydrophobicContact CG-CG2 4.42Å; M495-I501 WeakPolarHBondContact O-CB 3.23Å
496	M	79.8	Confident	82.2	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-12.1	173.2	-81.2	-66.8	-72.7	0	0	114.6	L480 Y484 L492 G493 S494 I501 K502 C505	L480-M496 HydrophobicContact CB-CG 3.87Å; L480-M496 HydrophobicContact CB-SD 3.78Å; L480-M496 HydrophobicContact CD2-CG 4.42Å; Y484-M496 HydrophobicContact CD2-CB 3.81Å; Y484-M496 HydrophobicContact CG-CB 4.21Å; L492-M496 PolarHBondContact O-N 3.05Å; G493-M496 PolarHBondContact O-N 2.66Å; S494-M496 VanDerWaalsContact C-N 3.31Å; S494-M496 PolarHBondContact O-N 2.89Å; M496-I501 HydrophobicContact SD-CG2 3.71Å; M496-K502 WeakPolarHBondContact O-CG 3.24Å; M496-C505 HydrophobicContact CE-CB 4.14Å; M496-C505 HydrophobicContact SD-CB 4.32Å; M496-C505 VanDerWaalsContact SD-SG 3.61Å
497	R	78.6	Confident	82.4	Confident	94 Å²	94	43.4 Å²	43.4	36%	0.355	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-17.7	171.2	-59.5	-175.6	-170.8	-169.9	4.2	112.9	Y484 P488 S494 M495 K502	Y484-R497 HydrophobicContact CE2-CG 3.87Å; P488-R497 PolarHBondContact O-NE 3.5Å; P488-R497 PolarHBondContact O-NH2 2.85Å; S494-R497 WeakPolarHBondContact O-CB 3.41Å; S494-R497 PolarHBondContact O-N 2.85Å; M495-R497 PolarHBondContact O-N 3.2Å; R497-K502 WeakPolarHBondContact O-CE 3.41Å; R497-K502 PolarHBondContact O-NZ 3.03Å
498	K	80	Confident	82.8	Confident	51 Å²	51	42 Å²	42	22%	0.222	21%	0.209	C	C	.	.	S	Bend	trans	-70.5	133.1	180	-66.1	171.6	171.5	175.2	0	111	E427 G428 M495 F500 I501 K502	E427-K498 VanDerWaalsContact O-CD 3.29Å; E427-K498 WeakPolarHBondContact O-CD 3.23Å; E427-K498 WeakPolarHBondContact O-CE 3.12Å; G428-K498 PolarHBondContact O-NZ 2.84Å; M495-K498 WeakPolarHBondContact O-CB 3.35Å; M495-K498 PolarHBondContact O-N 3.48Å; M495-K498 VanDerWaalsContact O-N 3.17Å; K498-F500 PolarHBondContact O-N 3.28Å; K498-I501 HydrophobicContact CB-CB 4.31Å; K498-I501 HydrophobicContact CB-CG1 3.94Å; K498-I501 WeakPolarHBondContact O-CB 3.47Å; K498-I501 PolarHBondContact O-N 3.12Å; K498-I501 VanDerWaalsContact O-N 3.1Å; K498-K502 PolarHBondContact O-N 3.34Å
499	P	83.5	Confident	83.5	Confident	9 Å²	9	40.1 Å²	40.1	6%	0.058	20%	0.196	C	C	.	.	H	α-helix	trans	-67.6	-38.9	-167.3	25.2	-34.4	0	0	0	114.3	I424 W425 I501 K502 F503 F809	I424-P499 VanDerWaalsContact O-CG 3.26Å; I424-P499 WeakPolarHBondContact O-CG 3.48Å; W425-P499 HydrophobicContact CE3-CB 4.02Å; W425-P499 HydrophobicContact CE3-CG 4.41Å; W425-P499 HydrophobicContact CZ3-CB 4.15Å; P499-I501 VanDerWaalsContact C-N 3.28Å; P499-I501 PolarHBondContact O-N 3.2Å; P499-K502 PolarHBondContact O-N 2.66Å; P499-F503 PolarHBondContact O-N 3.11Å; P499-F809 HydrophobicContact CB-CD1 3.65Å; P499-F809 HydrophobicContact CB-CE1 3.97Å; P499-F809 HydrophobicContact CG-CD1 3.82Å; P499-F809 HydrophobicContact CG-CE1 3.82Å
500	F	82.3	Confident	84.2	Confident	24 Å²	24	33 Å²	33	11%	0.105	16%	0.163	C	C	.	.	H	α-helix	trans	-61.9	-35.3	172.8	177.7	-104.1	0	0	0	112.6	W425 Y426 L429 F432 K498 F503 L504	W425-F500 AromaticContact CE2-CD2 3.97Å; W425-F500 HydrophobicContact CZ2-CD2 4.17Å; W425-F500 AromaticContact NE1-CD2 3.51Å; W425-F500 VanDerWaalsContact O-CB 3.24Å; W425-F500 WeakPolarHBondContact O-CB 3.4Å; W425-F500 PolarHBondContact O-N 2.99Å; Y426-F500 HydrophobicContact CD1-CD2 4.46Å; Y426-F500 HydrophobicContact CD1-CG 4.4Å; Y426-F500 HydrophobicContact CE1-CD2 4.06Å; Y426-F500 HydrophobicContact CE1-CE2 4.19Å; Y426-F500 HydrophobicContact CE1-CG 4.44Å; L429-F500 HydrophobicContact CD1-CB 4.37Å; L429-F500 HydrophobicContact CD1-CD1 3.47Å; L429-F500 VanDerWaalsContact CD1-CD1 3.47Å; L429-F500 HydrophobicContact CD1-CE1 4.2Å; L429-F500 HydrophobicContact CD1-CG 4.32Å; F432-F500 HydrophobicContact CE1-CE1 4.21Å; F432-F500 HydrophobicContact CE1-CZ 4.24Å; F432-F500 HydrophobicContact CZ-CE1 4.27Å; K498-F500 PolarHBondContact O-N 3.28Å; F500-F503 PolarHBondContact O-N 3.04Å; F500-L504 HydrophobicContact CE1-CD2 4.46Å; F500-L504 WeakPolarHBondContact O-CB 3.28Å; F500-L504 PolarHBondContact O-N 3.06Å
501	I	83.3	Confident	84.5	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-68.9	-44.3	176.2	-56.6	-62	0	0	0	110.5	L429 L473 M495 M496 K498 P499 F503 L504 C505	L429-I501 HydrophobicContact CD1-CD1 3.94Å; L429-I501 HydrophobicContact CD1-CG1 4.33Å; L429-I501 HydrophobicContact CD2-CD1 4.44Å; L473-I501 HydrophobicContact CD2-CD1 3.81Å; M495-I501 HydrophobicContact CE-CD1 3.91Å; M495-I501 HydrophobicContact CG-CG1 4.18Å; M495-I501 HydrophobicContact CG-CG2 4.42Å; M495-I501 WeakPolarHBondContact O-CB 3.23Å; M496-I501 HydrophobicContact SD-CG2 3.71Å; K498-I501 HydrophobicContact CB-CB 4.31Å; K498-I501 HydrophobicContact CB-CG1 3.94Å; K498-I501 WeakPolarHBondContact O-CB 3.47Å; K498-I501 PolarHBondContact O-N 3.12Å; K498-I501 VanDerWaalsContact O-N 3.1Å; P499-I501 VanDerWaalsContact C-N 3.28Å; P499-I501 PolarHBondContact O-N 3.2Å; I501-F503 VanDerWaalsContact C-N 3.35Å; I501-F503 PolarHBondContact O-N 3.33Å; I501-L504 PolarHBondContact O-N 3.05Å; I501-C505 WeakPolarHBondContact O-CB 3.38Å; I501-C505 PolarHBondContact O-N 3.09Å; I501-C505 PolarHBondContact O-SG 3.03Å; I501-C505 VanDerWaalsContact O-SG 3.39Å
502	K	86.1	Confident	85	Confident	10 Å²	10	28.3 Å²	28.3	4%	0.043	15%	0.146	C	C	.	.	H	α-helix	trans	-54.2	-51.5	172.1	-62.5	178.8	-158.8	166.5	0	110.9	M496 R497 K498 P499 L504 C505 H506 Y808 G810 T814	M496-K502 WeakPolarHBondContact O-CG 3.24Å; R497-K502 WeakPolarHBondContact O-CE 3.41Å; R497-K502 PolarHBondContact O-NZ 3.03Å; K498-K502 PolarHBondContact O-N 3.34Å; P499-K502 PolarHBondContact O-N 2.66Å; K502-L504 VanDerWaalsContact C-N 3.34Å; K502-L504 PolarHBondContact O-N 3.2Å; K502-C505 PolarHBondContact O-N 3.35Å; K502-H506 WeakPolarHBondContact O-CB 3.49Å; K502-H506 PolarHBondContact O-CD2 3.47Å; K502-H506 VanDerWaalsContact O-CD2 3.27Å; K502-H506 PolarHBondContact O-N 3.41Å; K502-Y808 HydrophobicContact CB-CD1 3.92Å; K502-Y808 WeakPolarHBondContact CD-O 3.24Å; K502-Y808 PolarHBondContact NZ-O 3Å; K502-G810 PolarHBondContact NZ-O 3.12Å; K502-T814 HydrophobicContact CD-CG2 4.27Å
503	F	86.2	Confident	85.6	Confident	19 Å²	19	24.7 Å²	24.7	8%	0.083	13%	0.127	C	C	.	.	H	α-helix	trans	-58.6	-44.7	179.6	166.1	-98.4	0	0	0	112.3	W425 P499 F500 I501 H506 S507 V644 V647 Y808	W425-F503 HydrophobicContact CH2-CB 3.55Å; W425-F503 HydrophobicContact CH2-CD1 4.39Å; W425-F503 HydrophobicContact CH2-CD2 4.36Å; W425-F503 AromaticContact CH2-CG 3.83Å; W425-F503 HydrophobicContact CH2-CG 3.83Å; W425-F503 HydrophobicContact CZ2-CB 3.9Å; W425-F503 AromaticContact CZ2-CD1 3.97Å; W425-F503 HydrophobicContact CZ2-CD1 3.97Å; W425-F503 AromaticContact CZ2-CG 3.88Å; W425-F503 HydrophobicContact CZ2-CG 3.88Å; P499-F503 PolarHBondContact O-N 3.11Å; F500-F503 PolarHBondContact O-N 3.04Å; I501-F503 VanDerWaalsContact C-N 3.35Å; I501-F503 PolarHBondContact O-N 3.33Å; F503-H506 PolarHBondContact O-N 3.14Å; F503-S507 WeakPolarHBondContact CE2-OG 3.26Å; F503-S507 WeakPolarHBondContact CZ-OG 3.34Å; F503-S507 VanDerWaalsContact O-CB 3.31Å; F503-S507 WeakPolarHBondContact O-CB 3.38Å; F503-S507 PolarHBondContact O-N 3.18Å; F503-S507 PolarHBondContact O-OG 2.8Å; F503-V644 HydrophobicContact CZ-CG1 4.47Å; F503-V647 HydrophobicContact CE1-CG1 4.45Å; F503-V647 HydrophobicContact CE1-CG2 4.4Å; F503-V647 HydrophobicContact CE2-CG2 3.98Å; F503-V647 HydrophobicContact CZ-CB 4.44Å; F503-V647 HydrophobicContact CZ-CG1 4.46Å; F503-V647 HydrophobicContact CZ-CG2 3.69Å; F503-Y808 HydrophobicContact CB-CD1 4.29Å; F503-Y808 HydrophobicContact CB-CD2 4.23Å; F503-Y808 HydrophobicContact CB-CE1 4.25Å; F503-Y808 HydrophobicContact CB-CE2 4.19Å; F503-Y808 HydrophobicContact CB-CG 4.28Å; F503-Y808 HydrophobicContact CD2-CD2 4.46Å; F503-Y808 AromaticContact CD2-CE2 3.74Å; F503-Y808 HydrophobicContact CD2-CE2 3.74Å; F503-Y808 AromaticContact CD2-CZ 3.87Å; F503-Y808 HydrophobicContact CG-CE2 4.44Å
504	L	85.3	Confident	86.3	Confident	18 Å²	18	25.4 Å²	25.4	9%	0.094	13%	0.131	C	C	.	.	H	α-helix	trans	-66.5	-42.3	-179.9	-168.8	66.8	0	0	0	111.8	I470 L473 C474 F500 I501 K502 S507 S508	I470-L504 HydrophobicContact CG2-CD1 4.16Å; I470-L504 HydrophobicContact CG2-CD2 4.23Å; L473-L504 HydrophobicContact CB-CD2 4.42Å; L473-L504 HydrophobicContact CD2-CD2 3.53Å; L473-L504 HydrophobicContact CG-CD2 3.76Å; C474-L504 VanDerWaalsContact SG-CD1 3.56Å; F500-L504 HydrophobicContact CE1-CD2 4.46Å; F500-L504 WeakPolarHBondContact O-CB 3.28Å; F500-L504 PolarHBondContact O-N 3.06Å; I501-L504 PolarHBondContact O-N 3.05Å; K502-L504 VanDerWaalsContact C-N 3.34Å; K502-L504 PolarHBondContact O-N 3.2Å; L504-S507 PolarHBondContact O-N 3.38Å; L504-S508 WeakPolarHBondContact O-CB 3.21Å; L504-S508 PolarHBondContact O-N 3.49Å
505	C	88.1	Confident	86.9	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-68.2	-38.4	176.9	-69.6	0	0	0	0	112.8	F477 M496 I501 K502 S509 P816	F477-C505 HydrophobicContact CB-CB 4.14Å; M496-C505 HydrophobicContact CE-CB 4.14Å; M496-C505 HydrophobicContact SD-CB 4.32Å; M496-C505 VanDerWaalsContact SD-SG 3.61Å; I501-C505 WeakPolarHBondContact O-CB 3.38Å; I501-C505 PolarHBondContact O-N 3.09Å; I501-C505 PolarHBondContact O-SG 3.03Å; I501-C505 VanDerWaalsContact O-SG 3.39Å; K502-C505 PolarHBondContact O-N 3.35Å; C505-S509 VanDerWaalsContact O-CB 3.25Å; C505-S509 WeakPolarHBondContact O-CB 3.09Å; C505-S509 PolarHBondContact O-N 3.33Å; C505-P816 HydrophobicContact CB-CG 4.43Å
506	H	89	Confident	87.4	Confident	19 Å²	19	24.7 Å²	24.7	9%	0.088	13%	0.13	C	C	.	.	H	α-helix	trans	-65.1	-40.1	171	-87	-86.4	0	0	0	111.9	K502 F503 S509 Y510 Q560 Y808 C813	K502-H506 WeakPolarHBondContact O-CB 3.49Å; K502-H506 PolarHBondContact O-CD2 3.47Å; K502-H506 VanDerWaalsContact O-CD2 3.27Å; K502-H506 PolarHBondContact O-N 3.41Å; F503-H506 PolarHBondContact O-N 3.14Å; H506-S509 WeakPolarHBondContact O-CB 3.3Å; H506-Y510 PolarHBondContact O-N 3.31Å; H506-Q560 PolarHBondContact CE1-NE2 3.01Å; H506-Y808 HydrophobicContact CB-CE1 4.28Å; H506-C813 PolarHBondContact NE2-O 3.07Å
507	S	88.9	Confident	88	Confident	20 Å²	20	25.2 Å²	25.2	14%	0.14	13%	0.133	C	C	.	.	H	α-helix	trans	-68.2	-41.4	177.1	-57.9	0	0	0	0	112	F503 L504 Y510 L511	F503-S507 WeakPolarHBondContact CE2-OG 3.26Å; F503-S507 WeakPolarHBondContact CZ-OG 3.34Å; F503-S507 VanDerWaalsContact O-CB 3.31Å; F503-S507 WeakPolarHBondContact O-CB 3.38Å; F503-S507 PolarHBondContact O-N 3.18Å; F503-S507 PolarHBondContact O-OG 2.8Å; L504-S507 PolarHBondContact O-N 3.38Å; S507-Y510 PolarHBondContact O-N 3.39Å; S507-L511 WeakPolarHBondContact O-CG 3.16Å; S507-L511 PolarHBondContact O-N 3.38Å
508	S	89.5	Confident	88.4	Confident	13 Å²	13	24.7 Å²	24.7	9%	0.091	14%	0.141	C	C	.	.	H	α-helix	trans	-65.9	-39.6	176.3	-169	0	0	0	0	112.1	C474 L504 Y510 L511 S512	C474-S508 WeakPolarHBondContact CA-OG 3.23Å; C474-S508 WeakPolarHBondContact CB-OG 3.38Å; C474-S508 PolarHBondContact O-OG 3.4Å; C474-S508 VanDerWaalsContact O-OG 3.04Å; L504-S508 WeakPolarHBondContact O-CB 3.21Å; L504-S508 PolarHBondContact O-N 3.49Å; S508-Y510 VanDerWaalsContact C-N 3.3Å; S508-Y510 PolarHBondContact O-N 3.39Å; S508-L511 PolarHBondContact O-N 3.05Å; S508-S512 PolarHBondContact O-N 3.35Å; S508-S512 PolarHBondContact O-OG 3.17Å
509	S	92.3	Very high	88.8	Confident	2 Å²	2	26.3 Å²	26.3	1%	0.014	15%	0.151	C	C	.	.	H	α-helix	trans	-57.5	-42.3	170.7	157.9	0	0	0	0	112	C505 H506 S512 F513 V817	C505-S509 VanDerWaalsContact O-CB 3.25Å; C505-S509 WeakPolarHBondContact O-CB 3.09Å; C505-S509 PolarHBondContact O-N 3.33Å; H506-S509 WeakPolarHBondContact O-CB 3.3Å; S509-S512 WeakPolarHBondContact CA-OG 3.38Å; S509-S512 PolarHBondContact O-N 2.8Å; S509-S512 PolarHBondContact O-OG 3.35Å; S509-F513 PolarHBondContact O-N 3.43Å; S509-V817 WeakPolarHBondContact CB-O 3.07Å; S509-V817 PolarHBondContact OG-O 2.94Å
510	Y	92.2	Very high	88.9	Confident	17 Å²	17	26.7 Å²	26.7	7%	0.067	16%	0.155	C	C	.	.	H	α-helix	trans	-68.3	-39.6	176	-160.2	-107.7	0	0	0	112.5	H506 S507 S508 F513 L514 F557 S637 K640 L641	H506-Y510 PolarHBondContact O-N 3.31Å; S507-Y510 PolarHBondContact O-N 3.39Å; S508-Y510 VanDerWaalsContact C-N 3.3Å; S508-Y510 PolarHBondContact O-N 3.39Å; Y510-F513 HydrophobicContact CD2-CD1 4.31Å; Y510-F513 AromaticContact CE2-CD1 3.86Å; Y510-F513 HydrophobicContact CE2-CD1 3.86Å; Y510-F513 HydrophobicContact CE2-CE1 4.27Å; Y510-F513 WeakPolarHBondContact O-CB 3.39Å; Y510-F513 PolarHBondContact O-N 3.42Å; Y510-L514 HydrophobicContact CD1-CD1 4.16Å; Y510-L514 HydrophobicContact CD1-CG 4.35Å; Y510-L514 HydrophobicContact CE1-CD1 3.89Å; Y510-L514 HydrophobicContact CE1-CD2 4.2Å; Y510-L514 HydrophobicContact CE1-CG 4.06Å; Y510-L514 WeakPolarHBondContact O-CG 3.38Å; Y510-L514 PolarHBondContact O-N 3.28Å; Y510-F557 AromaticContact CD2-CE1 3.95Å; Y510-F557 HydrophobicContact CD2-CE1 3.95Å; Y510-F557 AromaticContact CD2-CZ 3.67Å; Y510-F557 HydrophobicContact CD2-CZ 3.67Å; Y510-F557 HydrophobicContact CE2-CE1 4.33Å; Y510-F557 HydrophobicContact CE2-CE2 4.46Å; Y510-F557 AromaticContact CE2-CZ 3.92Å; Y510-F557 HydrophobicContact CE2-CZ 3.92Å; Y510-S637 WeakPolarHBondContact OH-CA 3.45Å; Y510-S637 PolarHBondContact OH-O 3.26Å; Y510-K640 HydrophobicContact CE1-CB 4.25Å; Y510-K640 HydrophobicContact CE1-CD 4.21Å; Y510-K640 HydrophobicContact CE1-CG 4.26Å; Y510-K640 HydrophobicContact CE2-CD 4.2Å; Y510-L641 HydrophobicContact CD1-CD2 4.47Å
511	L	91.2	Very high	89	Confident	95 Å²	95	29 Å²	29	50%	0.497	18%	0.179	S	C	.	.	H	α-helix	trans	-65.6	-37.4	174.3	-70	171.1	0	0	0	112.4	S507 S508 F513 L514 A515 L641	S507-L511 WeakPolarHBondContact O-CG 3.16Å; S507-L511 PolarHBondContact O-N 3.38Å; S508-L511 PolarHBondContact O-N 3.05Å; L511-F513 VanDerWaalsContact C-N 3.33Å; L511-L514 PolarHBondContact O-N 2.94Å; L511-A515 WeakPolarHBondContact O-CB 3.46Å; L511-A515 PolarHBondContact O-N 3.04Å; L511-L641 HydrophobicContact CD2-CD2 4.04Å
512	S	90.8	Very high	89	Confident	34 Å²	34	33.1 Å²	33.1	24%	0.238	20%	0.204	C	C	.	.	H	α-helix	trans	-69.4	-30.1	173.6	54.8	0	0	0	0	112.9	F477 S508 S509 L516 Y553	F477-S512 WeakPolarHBondContact CE1-OG 3.29Å; F477-S512 WeakPolarHBondContact CZ-OG 3.45Å; S508-S512 PolarHBondContact O-N 3.35Å; S508-S512 PolarHBondContact O-OG 3.17Å; S509-S512 WeakPolarHBondContact CA-OG 3.38Å; S509-S512 PolarHBondContact O-N 2.8Å; S509-S512 PolarHBondContact O-OG 3.35Å; S512-L516 WeakPolarHBondContact O-CB 3.47Å; S512-L516 PolarHBondContact O-N 3Å; S512-Y553 PolarHBondContact OG-OH 2.76Å
513	F	93.4	Very high	88.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.1	-46.1	169.5	170.2	-107	0	0	0	111.9	S509 Y510 L511 A515 L516 L517 L550 Y553 F557 Y589	S509-F513 PolarHBondContact O-N 3.43Å; Y510-F513 HydrophobicContact CD2-CD1 4.31Å; Y510-F513 AromaticContact CE2-CD1 3.86Å; Y510-F513 HydrophobicContact CE2-CD1 3.86Å; Y510-F513 HydrophobicContact CE2-CE1 4.27Å; Y510-F513 WeakPolarHBondContact O-CB 3.39Å; Y510-F513 PolarHBondContact O-N 3.42Å; L511-F513 VanDerWaalsContact C-N 3.33Å; F513-A515 VanDerWaalsContact C-N 3.34Å; F513-A515 PolarHBondContact O-N 3.14Å; F513-L516 PolarHBondContact O-N 3.44Å; F513-L517 HydrophobicContact CD1-CD1 4.21Å; F513-L517 HydrophobicContact CE1-CD1 3.6Å; F513-L517 HydrophobicContact CE1-CG 4.32Å; F513-L517 HydrophobicContact CE2-CD1 4.37Å; F513-L517 HydrophobicContact CE2-CG 4.27Å; F513-L517 HydrophobicContact CZ-CD1 3.7Å; F513-L517 HydrophobicContact CZ-CD2 4.4Å; F513-L517 HydrophobicContact CZ-CG 4.08Å; F513-L517 PolarHBondContact O-N 3.21Å; F513-L550 HydrophobicContact CD2-CD2 3.86Å; F513-L550 HydrophobicContact CE2-CD2 3.64Å; F513-Y553 HydrophobicContact CB-CD1 3.78Å; F513-Y553 HydrophobicContact CB-CE1 3.95Å; F513-Y553 HydrophobicContact CB-CG 4.37Å; F513-Y553 AromaticContact CD2-CD1 3.99Å; F513-Y553 HydrophobicContact CD2-CD1 3.99Å; F513-Y553 AromaticContact CD2-CG 3.82Å; F513-Y553 HydrophobicContact CD2-CG 3.82Å; F513-Y553 HydrophobicContact CG-CD1 4.25Å; F513-F557 HydrophobicContact CB-CE2 4.32Å; F513-F557 HydrophobicContact CB-CZ 4.18Å; F513-F557 AromaticContact CD1-CE2 3.79Å; F513-F557 HydrophobicContact CD1-CE2 3.79Å; F513-F557 HydrophobicContact CD1-CZ 4.08Å; F513-F557 AromaticContact CD2-CE2 3.77Å; F513-F557 HydrophobicContact CD2-CE2 3.77Å; F513-F557 HydrophobicContact CD2-CZ 4.46Å; F513-F557 AromaticContact CE1-CE2 3.96Å; F513-F557 HydrophobicContact CE1-CE2 3.96Å; F513-F557 AromaticContact CE2-CE2 3.93Å; F513-F557 HydrophobicContact CE2-CE2 3.93Å; F513-F557 AromaticContact CG-CE2 3.68Å; F513-F557 HydrophobicContact CG-CE2 3.68Å; F513-F557 AromaticContact CG-CZ 3.98Å; F513-F557 HydrophobicContact CG-CZ 3.98Å; F513-F557 HydrophobicContact CZ-CE2 4.02Å; F513-Y589 AromaticContact CZ-CE2 3.94Å; F513-Y589 HydrophobicContact CZ-CE2 3.94Å; F513-Y589 AromaticContact CZ-CZ 3.97Å
514	L	92.9	Very high	88	Confident	16 Å²	16	40 Å²	40	8%	0.084	24%	0.235	C	C	.	.	H	α-helix	trans	-65.8	-35.2	175.8	-63.9	-178	0	0	0	112.5	Y510 L511 L517 T518 T638 L641	Y510-L514 HydrophobicContact CD1-CD1 4.16Å; Y510-L514 HydrophobicContact CD1-CG 4.35Å; Y510-L514 HydrophobicContact CE1-CD1 3.89Å; Y510-L514 HydrophobicContact CE1-CD2 4.2Å; Y510-L514 HydrophobicContact CE1-CG 4.06Å; Y510-L514 WeakPolarHBondContact O-CG 3.38Å; Y510-L514 PolarHBondContact O-N 3.28Å; L511-L514 PolarHBondContact O-N 2.94Å; L514-L517 HydrophobicContact CD2-CD1 4.1Å; L514-L517 PolarHBondContact O-N 3.49Å; L514-T518 WeakPolarHBondContact O-CB 3.43Å; L514-T518 PolarHBondContact O-N 3.37Å; L514-T518 PolarHBondContact O-OG1 3.11Å; L514-T638 HydrophobicContact CD2-CG2 4.38Å; L514-L641 HydrophobicContact CD1-CD1 3.7Å; L514-L641 HydrophobicContact CD1-CD2 3.69Å; L514-L641 HydrophobicContact CD1-CG 3.67Å
515	A	90.7	Very high	87.2	Confident	50 Å²	50	41.6 Å²	41.6	41%	0.413	24%	0.242	S	C	.	.	H	α-helix	trans	-64.1	-41.4	171.7	0	0	0	0	0	111.6	L511 F513 T518 L519	L511-A515 WeakPolarHBondContact O-CB 3.46Å; L511-A515 PolarHBondContact O-N 3.04Å; F513-A515 VanDerWaalsContact C-N 3.34Å; F513-A515 PolarHBondContact O-N 3.14Å; A515-T518 WeakPolarHBondContact O-CB 3.4Å; A515-T518 PolarHBondContact O-N 3.49Å; A515-T518 VanDerWaalsContact O-N 3.15Å; A515-L519 WeakPolarHBondContact O-CG 3.24Å; A515-L519 PolarHBondContact O-N 3.09Å
516	L	91.5	Very high	86.2	Confident	27 Å²	27	42.8 Å²	42.8	14%	0.141	25%	0.248	C	C	.	.	H	α-helix	trans	-66	-39.7	175.8	-176.7	64.1	0	0	0	112.3	S512 F513 T518 L519 A520 T546 A549 L550 Y553	S512-L516 WeakPolarHBondContact O-CB 3.47Å; S512-L516 PolarHBondContact O-N 3Å; F513-L516 PolarHBondContact O-N 3.44Å; L516-T518 VanDerWaalsContact C-N 3.29Å; L516-T518 PolarHBondContact O-N 2.79Å; L516-L519 PolarHBondContact O-N 3.42Å; L516-A520 WeakPolarHBondContact O-CB 3.43Å; L516-A520 PolarHBondContact O-N 3.07Å; L516-T546 HydrophobicContact CD1-CG2 4.02Å; L516-A549 HydrophobicContact CD1-CB 4.45Å; L516-A549 HydrophobicContact CD2-CB 3.71Å; L516-L550 HydrophobicContact CB-CD2 4.2Å; L516-L550 HydrophobicContact CD2-CD2 3.74Å; L516-L550 HydrophobicContact CD2-CG 3.84Å; L516-L550 HydrophobicContact CG-CD2 3.77Å; L516-L550 HydrophobicContact CG-CG 3.88Å; L516-Y553 HydrophobicContact CD2-CD2 4Å; L516-Y553 HydrophobicContact CD2-CE2 4.09Å
517	L	91.9	Very high	85.2	Confident	11 Å²	11	48 Å²	48	6%	0.058	28%	0.275	C	S	.	.	H	α-helix	trans	-60.2	-39.3	169.4	-75.9	177.8	0	0	0	111.8	F513 L514 A520 A521 L550 Y589 F630 N634 S637	F513-L517 HydrophobicContact CD1-CD1 4.21Å; F513-L517 HydrophobicContact CE1-CD1 3.6Å; F513-L517 HydrophobicContact CE1-CG 4.32Å; F513-L517 HydrophobicContact CE2-CD1 4.37Å; F513-L517 HydrophobicContact CE2-CG 4.27Å; F513-L517 HydrophobicContact CZ-CD1 3.7Å; F513-L517 HydrophobicContact CZ-CD2 4.4Å; F513-L517 HydrophobicContact CZ-CG 4.08Å; F513-L517 PolarHBondContact O-N 3.21Å; L514-L517 HydrophobicContact CD2-CD1 4.1Å; L514-L517 PolarHBondContact O-N 3.49Å; L517-A520 PolarHBondContact O-N 3.03Å; L517-A521 WeakPolarHBondContact O-CB 3.32Å; L517-A521 PolarHBondContact O-N 3.44Å; L517-L550 HydrophobicContact CD2-CD1 3.86Å; L517-L550 HydrophobicContact CD2-CD2 3.56Å; L517-L550 HydrophobicContact CD2-CG 4.37Å; L517-L550 HydrophobicContact CG-CD2 3.81Å; L517-Y589 WeakPolarHBondContact CD1-OH 3.36Å; L517-F630 HydrophobicContact CD2-CE2 4.03Å; L517-F630 HydrophobicContact CD2-CZ 3.92Å; L517-N634 VanDerWaalsContact CD2-OD1 3.31Å; L517-N634 WeakPolarHBondContact CD2-OD1 3.28Å; L517-S637 WeakPolarHBondContact CD1-OG 3.44Å
518	T	88.3	Confident	84.2	Confident	84 Å²	84	53.7 Å²	53.7	52%	0.515	30%	0.304	S	S	.	.	H	α-helix	trans	-65.6	-42.7	177.5	-54.6	0	0	0	0	111.2	L514 A515 L516 A521 T522	L514-T518 WeakPolarHBondContact O-CB 3.43Å; L514-T518 PolarHBondContact O-N 3.37Å; L514-T518 PolarHBondContact O-OG1 3.11Å; A515-T518 WeakPolarHBondContact O-CB 3.4Å; A515-T518 PolarHBondContact O-N 3.49Å; A515-T518 VanDerWaalsContact O-N 3.15Å; L516-T518 VanDerWaalsContact C-N 3.29Å; L516-T518 PolarHBondContact O-N 2.79Å; T518-A521 PolarHBondContact O-N 2.81Å; T518-T522 PolarHBondContact O-N 3.19Å; T518-T522 PolarHBondContact O-OG1 3.17Å; T518-T522 VanDerWaalsContact O-OG1 3.06Å
519	L	87.5	Confident	83.1	Confident	84 Å²	84	57.1 Å²	57.1	44%	0.44	32%	0.324	S	S	.	.	H	α-helix	trans	-65.2	-35.7	175	-69.8	168.6	0	0	0	113	A515 L516 T522 R523 V524	A515-L519 WeakPolarHBondContact O-CG 3.24Å; A515-L519 PolarHBondContact O-N 3.09Å; L516-L519 PolarHBondContact O-N 3.42Å; L519-T522 PolarHBondContact O-OG1 3.38Å; L519-R523 PolarHBondContact O-N 3.49Å; L519-V524 HydrophobicContact CD2-CG2 3.86Å; L519-V524 PolarHBondContact O-N 2.75Å
520	A	85.8	Confident	81.8	Confident	18 Å²	18	64.4 Å²	64.4	15%	0.149	36%	0.363	C	S	.	.	H	α-helix	trans	-67.9	-42	172.5	0	0	0	0	0	111.5	L516 L517 R523 L550	L516-A520 WeakPolarHBondContact O-CB 3.43Å; L516-A520 PolarHBondContact O-N 3.07Å; L517-A520 PolarHBondContact O-N 3.03Å; A520-R523 PolarHBondContact O-N 2.97Å; A520-R523 VanDerWaalsContact O-N 3.15Å; A520-L550 HydrophobicContact CB-CD1 3.87Å
521	A	84.8	Confident	80.8	Confident	73 Å²	73	65.2 Å²	65.2	60%	0.603	37%	0.371	S	S	*	.	H	α-helix	trans	-65.1	-38.2	176.9	0	0	0	0	0	112.8	L517 T518 R523	L517-A521 WeakPolarHBondContact O-CB 3.32Å; L517-A521 PolarHBondContact O-N 3.44Å; T518-A521 PolarHBondContact O-N 2.81Å; A521-R523 VanDerWaalsContact C-N 3.25Å; A521-R523 PolarHBondContact O-N 3Å
522	T	82.7	Confident	79.8	Confident	85 Å²	85	63.6 Å²	63.6	52%	0.521	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	3	174	57.3	0	0	0	0	114	T518 L519 V524	T518-T522 PolarHBondContact O-N 3.19Å; T518-T522 PolarHBondContact O-OG1 3.17Å; T518-T522 VanDerWaalsContact O-OG1 3.06Å; L519-T522 PolarHBondContact O-OG1 3.38Å; T522-V524 PolarHBondContact O-N 3.02Å; T522-V524 VanDerWaalsContact O-N 3.13Å; T522-V524 VanDerWaalsContact OG1-CG2 3.27Å; T522-V524 WeakPolarHBondContact OG1-CG2 3.18Å
523	R	79.3	Confident	78.8	Confident	115 Å²	115	67.4 Å²	67.4	43%	0.434	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	28.8	170.1	-66.1	-174.9	179.7	-170.6	-0.6	115.1	L519 A520 A521 E525 F526 L527	L519-R523 PolarHBondContact O-N 3.49Å; A520-R523 PolarHBondContact O-N 2.97Å; A520-R523 VanDerWaalsContact O-N 3.15Å; A521-R523 VanDerWaalsContact C-N 3.25Å; A521-R523 PolarHBondContact O-N 3Å; R523-E525 VanDerWaalsContact C-N 3.29Å; R523-E525 PolarHBondContact O-N 3.33Å; R523-E525 VanDerWaalsContact O-N 3.12Å; R523-F526 HydrophobicContact CB-CD2 3.96Å; R523-F526 HydrophobicContact CG-CD2 4.37Å; R523-F526 PolarHBondContact O-N 2.8Å; R523-L527 PolarHBondContact O-N 3.21Å
524	V	71.7	Confident	77.7	Confident	59 Å²	59	74.3 Å²	74.3	36%	0.358	41%	0.412	S	S	.	.	H	α-helix	trans	-54.5	-39.3	-168.2	-173	0	0	0	0	113.7	L519 T522 F526 L527 L528	L519-V524 HydrophobicContact CD2-CG2 3.86Å; L519-V524 PolarHBondContact O-N 2.75Å; T522-V524 PolarHBondContact O-N 3.02Å; T522-V524 VanDerWaalsContact O-N 3.13Å; T522-V524 VanDerWaalsContact OG1-CG2 3.27Å; T522-V524 WeakPolarHBondContact OG1-CG2 3.18Å; V524-F526 VanDerWaalsContact C-N 3.25Å; V524-F526 PolarHBondContact O-N 3Å; V524-L527 PolarHBondContact O-N 3.45Å; V524-L528 PolarHBondContact O-N 3.37Å
525	E	69.1	Low	76.8	Confident	51 Å²	51	76 Å²	76	24%	0.238	42%	0.418	C	S	.	.	H	α-helix	trans	-62.4	-31.3	-179.7	-59.7	-175.1	143.5	0	0	113.1	R523 T529 S544 L545 T546	R523-E525 VanDerWaalsContact C-N 3.29Å; R523-E525 PolarHBondContact O-N 3.33Å; R523-E525 VanDerWaalsContact O-N 3.12Å; E525-T529 WeakPolarHBondContact O-CG2 3.4Å; E525-T529 PolarHBondContact O-N 3.04Å; E525-T529 PolarHBondContact O-OG1 2.86Å; E525-S544 WeakPolarHBondContact OE2-CB 3.4Å; E525-S544 PolarHBondContact OE2-OG 3.01Å; E525-L545 VanDerWaalsContact OE1-CB 3.26Å; E525-L545 WeakPolarHBondContact OE1-CB 3.27Å; E525-L545 PolarHBondContact OE2-N 3.47Å; E525-T546 VanDerWaalsContact CD-CG2 3.47Å; E525-T546 VanDerWaalsContact CD-N 3.32Å; E525-T546 HydrophobicContact CG-CG2 4Å; E525-T546 WeakPolarHBondContact OE1-CG2 3.35Å; E525-T546 PolarHBondContact OE1-N 3.47Å; E525-T546 WeakPolarHBondContact OE2-CB 3.32Å; E525-T546 PolarHBondContact OE2-N 3.43Å; E525-T546 PolarHBondContact OE2-OG1 3.21Å
526	F	67.5	Low	76.1	Confident	25 Å²	25	77.7 Å²	77.7	11%	0.11	42%	0.418	C	S	.	.	H	α-helix	trans	-83.3	-29.2	179.9	-51.3	-67	0	0	0	111.9	R523 V524 L528 T529 N530 L532 R535	R523-F526 HydrophobicContact CB-CD2 3.96Å; R523-F526 HydrophobicContact CG-CD2 4.37Å; R523-F526 PolarHBondContact O-N 2.8Å; V524-F526 VanDerWaalsContact C-N 3.25Å; V524-F526 PolarHBondContact O-N 3Å; F526-L528 PolarHBondContact O-N 2.89Å; F526-T529 WeakPolarHBondContact CA-OG1 3.42Å; F526-T529 PolarHBondContact O-N 3.43Å; F526-N530 PolarHBondContact O-N 2.96Å; F526-N530 VanDerWaalsContact O-N 3.15Å; F526-L532 HydrophobicContact CB-CD2 3.45Å; F526-L532 VanDerWaalsContact CB-CD2 3.45Å; F526-L532 HydrophobicContact CB-CG 3.69Å; F526-L532 HydrophobicContact CG-CD2 4.2Å; F526-R535 VanDerWaalsContact CZ-NE 3.26Å
527	L	66.7	Low	75.4	Confident	128 Å²	128	79.4 Å²	79.4	67%	0.67	43%	0.425	S	S	*	.	H	α-helix	trans	-67.9	-23.7	171.7	-166.3	144.1	0	0	0	112.1	R523 V524	R523-L527 PolarHBondContact O-N 3.21Å; V524-L527 PolarHBondContact O-N 3.45Å
528	L	67.6	Low	75	Confident	141 Å²	141	79.4 Å²	79.4	74%	0.738	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-18.1	171.6	-118.7	83.5	0	0	0	114.7	V524 F526	V524-L528 PolarHBondContact O-N 3.37Å; F526-L528 PolarHBondContact O-N 2.89Å
529	T	67.7	Low	74.7	Confident	85 Å²	85	76.4 Å²	76.4	52%	0.521	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	4.6	-166.3	56.3	0	0	0	0	114.8	E525 F526 S531	E525-T529 WeakPolarHBondContact O-CG2 3.4Å; E525-T529 PolarHBondContact O-N 3.04Å; E525-T529 PolarHBondContact O-OG1 2.86Å; F526-T529 WeakPolarHBondContact CA-OG1 3.42Å; F526-T529 PolarHBondContact O-N 3.43Å; T529-S531 PolarHBondContact O-N 3.49Å; T529-S531 PolarHBondContact OG1-OG 3.33Å
530	N	65.1	Low	74.5	Confident	155 Å²	155	72.6 Å²	72.6	83%	0.829	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	25.3	178.7	-66.7	-9.8	0	0	0	114.8	F526	F526-N530 PolarHBondContact O-N 2.96Å; F526-N530 VanDerWaalsContact O-N 3.15Å
531	S	70.7	Confident	74.2	Confident	34 Å²	34	73.2 Å²	73.2	24%	0.238	39%	0.388	C	S	.	.			trans	-104	7.7	-171.2	59.7	0	0	0	0	114	T529 D533 R535	T529-S531 PolarHBondContact O-N 3.49Å; T529-S531 PolarHBondContact OG1-OG 3.33Å; S531-D533 PolarHBondContact O-N 2.9Å; S531-R535 PolarHBondContact O-N 3.5Å
532	L	69.4	Low	74.1	Confident	60 Å²	60	73.6 Å²	73.6	31%	0.314	38%	0.383	S	S	.	.	H	α-helix	trans	-54.5	-55.1	-175	-82.5	169.9	0	0	0	113	F526 Q534 R535 M536	F526-L532 HydrophobicContact CB-CD2 3.45Å; F526-L532 VanDerWaalsContact CB-CD2 3.45Å; F526-L532 HydrophobicContact CB-CG 3.69Å; F526-L532 HydrophobicContact CG-CD2 4.2Å; L532-Q534 PolarHBondContact O-N 2.88Å; L532-R535 PolarHBondContact O-N 2.65Å; L532-R535 VanDerWaalsContact O-N 3.16Å; L532-M536 WeakPolarHBondContact O-CG 3.32Å; L532-M536 PolarHBondContact O-N 3.36Å
533	D	69.5	Low	74.2	Confident	114 Å²	114	73.5 Å²	73.5	61%	0.61	38%	0.384	S	S	*	.	H	α-helix	trans	-65.3	-44.6	-170.6	-54.9	-35.1	0	0	0	111.4	S531 R535 M536 H537	S531-D533 PolarHBondContact O-N 2.9Å; D533-R535 VanDerWaalsContact C-N 3.26Å; D533-R535 PolarHBondContact O-N 3.33Å; D533-M536 PolarHBondContact O-N 2.9Å; D533-M536 VanDerWaalsContact O-N 3.08Å; D533-H537 PolarHBondContact O-CD2 2.88Å; D533-H537 PolarHBondContact O-N 3.33Å
534	Q	70.7	Confident	74.3	Confident	145 Å²	145	68.5 Å²	68.5	68%	0.678	37%	0.367	S	S	*	.	H	α-helix	trans	-57	-40.7	175.5	-67.2	-176.4	-8.7	0	0	111.8	L532 H537 D538	L532-Q534 PolarHBondContact O-N 2.88Å; Q534-H537 PolarHBondContact O-N 3.44Å; Q534-D538 PolarHBondContact O-N 2.85Å
535	R	74	Confident	75	Confident	53 Å²	53	72.2 Å²	72.2	20%	0.2	38%	0.384	C	S	.	.	H	α-helix	trans	-76.3	-24.6	177.8	-164.6	178	-177.7	92.4	-4	113.3	F526 S531 L532 D533 H537 P541 T542 E547	F526-R535 VanDerWaalsContact CZ-NE 3.26Å; S531-R535 PolarHBondContact O-N 3.5Å; L532-R535 PolarHBondContact O-N 2.65Å; L532-R535 VanDerWaalsContact O-N 3.16Å; D533-R535 VanDerWaalsContact C-N 3.26Å; D533-R535 PolarHBondContact O-N 3.33Å; R535-H537 VanDerWaalsContact C-N 3.28Å; R535-P541 HydrophobicContact CG-CB 3.97Å; R535-T542 VanDerWaalsContact CZ-O 3.26Å; R535-T542 PolarHBondContact NH1-O 3.46Å; R535-T542 PolarHBondContact NH2-O 2.81Å; R535-E547 IonicContact NH2-OE1 2.72Å; R535-E547 IonicContact NH2-OE2 2.73Å; R535-E547 PolarHBondContact NH2-OE2 2.84Å
536	M	76.8	Confident	75.8	Confident	85 Å²	85	70.4 Å²	70.4	42%	0.419	38%	0.376	S	S	.	.	H	α-helix	trans	-72.2	-22.1	174.1	-80.4	178	43.1	0	0	113.4	L532 D533	L532-M536 WeakPolarHBondContact O-CG 3.32Å; L532-M536 PolarHBondContact O-N 3.36Å; D533-M536 PolarHBondContact O-N 2.9Å; D533-M536 VanDerWaalsContact O-N 3.08Å
537	H	77.5	Confident	76.8	Confident	63 Å²	63	70.9 Å²	70.9	29%	0.292	38%	0.379	S	S	.	.	H	α-helix	trans	-98.6	-12.7	176.3	-70.6	-67.4	0	0	0	114.2	D533 Q534 R535 Y611 I612 N613	D533-H537 PolarHBondContact O-CD2 2.88Å; D533-H537 PolarHBondContact O-N 3.33Å; Q534-H537 PolarHBondContact O-N 3.44Å; R535-H537 VanDerWaalsContact C-N 3.28Å; H537-Y611 WeakPolarHBondContact O-CA 3.49Å; H537-I612 PolarHBondContact ND1-O 2.88Å; H537-I612 PolarHBondContact O-N 2.91Å; H537-N613 PolarHBondContact CE1-OD1 2.73Å
538	D	81.5	Confident	77.8	Confident	11 Å²	11	67 Å²	67	6%	0.059	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-78.1	119.6	-179.4	-168.5	-7	0	0	0	111.7	Q534 G540 P541 R610 Y611	Q534-D538 PolarHBondContact O-N 2.85Å; D538-G540 VanDerWaalsContact C-N 3.33Å; D538-G540 PolarHBondContact OD1-N 3.36Å; D538-P541 HydrophobicContact CB-CB 4.29Å; D538-P541 WeakPolarHBondContact O-CD 3.22Å; D538-P541 VanDerWaalsContact OD2-CA 3.28Å; D538-P541 WeakPolarHBondContact OD2-CA 3.47Å; D538-R610 WeakPolarHBondContact CA-O 3.35Å; D538-R610 VanDerWaalsContact CG-NE 3.32Å; D538-R610 WeakPolarHBondContact OD1-CG 3.33Å; D538-R610 IonicContact OD1-CZ 3.81Å; D538-R610 IonicContact OD1-NE 3.77Å; D538-R610 PolarHBondContact OD1-NE 2.96Å; D538-R610 IonicContact OD1-NH2 3.35Å; D538-R610 IonicContact OD2-CZ 2.69Å; D538-R610 IonicContact OD2-NE 2.85Å; D538-R610 PolarHBondContact OD2-NE 2.85Å; D538-R610 IonicContact OD2-NH2 3.2Å; D538-R610 PolarHBondContact OD2-NH2 3.24Å; D538-Y611 HydrophobicContact CB-CD1 4.21Å; D538-Y611 HydrophobicContact CB-CE1 3.95Å
539	R	83.4	Confident	79	Confident	20 Å²	20	61.8 Å²	61.8	8%	0.075	34%	0.34	C	S	.	.	S	Bend	trans	-83.8	-2.1	175	-72.4	-179.7	63.5	-124.6	-2.5	113.9	I603 E608 P609 R610 W617 D621 V623	R539-I603 HydrophobicContact CB-CD1 3.78Å; R539-I603 WeakPolarHBondContact O-CD1 3.42Å; R539-E608 IonicContact CZ-OE2 3.81Å; R539-E608 VanDerWaalsContact CZ-OE2 3.31Å; R539-E608 IonicContact NH1-OE2 2.71Å; R539-E608 PolarHBondContact NH1-OE2 3.15Å; R539-E608 IonicContact NH2-OE2 2.72Å; R539-E608 PolarHBondContact NH2-OE2 2.9Å; R539-P609 PolarHBondContact NH1-O 2.74Å; R539-R610 PolarHBondContact N-O 3.47Å; R539-W617 HydrophobicContact CG-CD2 4.06Å; R539-W617 HydrophobicContact CG-CH2 4.38Å; R539-W617 HydrophobicContact CG-CZ2 3.76Å; R539-D621 IonicContact CZ-OD1 2.66Å; R539-D621 IonicContact CZ-OD2 2.73Å; R539-D621 IonicContact NE-OD1 2.86Å; R539-D621 IonicContact NE-OD2 3.83Å; R539-D621 PolarHBondContact NE-OD2 2.77Å; R539-D621 IonicContact NH2-OD1 3.18Å; R539-D621 PolarHBondContact NH2-OD1 3.47Å; R539-D621 IonicContact NH2-OD2 3.76Å; R539-V623 WeakPolarHBondContact O-CG2 3.34Å
540	G	82.2	Confident	80.2	Confident	4 Å²	4	58.2 Å²	58.2	4%	0.041	32%	0.318	C	S	.	.	S	Bend	trans	-146	51.7	177.7	0	0	0	0	0	113.6	D538 T542 I603	D538-G540 VanDerWaalsContact C-N 3.33Å; D538-G540 PolarHBondContact OD1-N 3.36Å; G540-T542 PolarHBondContact O-N 2.81Å; G540-I603 VanDerWaalsContact N-CD1 3.28Å
541	P	81.1	Confident	81.5	Confident	32 Å²	32	53.2 Å²	53.2	21%	0.208	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-66.1	134.9	-173.3	28.7	-35.1	0	0	0	111.4	R535 D538	R535-P541 HydrophobicContact CG-CB 3.97Å; D538-P541 HydrophobicContact CB-CB 4.29Å; D538-P541 WeakPolarHBondContact O-CD 3.22Å; D538-P541 VanDerWaalsContact OD2-CA 3.28Å; D538-P541 WeakPolarHBondContact OD2-CA 3.47Å
542	T	82.5	Confident	82.5	Confident	80 Å²	80	55.8 Å²	55.8	49%	0.491	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-58.9	142.8	171.3	46.6	0	0	0	0	110.1	R535 G540 S544	R535-T542 VanDerWaalsContact CZ-O 3.26Å; R535-T542 PolarHBondContact NH1-O 3.46Å; R535-T542 PolarHBondContact NH2-O 2.81Å; G540-T542 PolarHBondContact O-N 2.81Å; T542-S544 PolarHBondContact O-N 2.9Å
543	P	83.3	Confident	83.7	Confident	84 Å²	84	54.3 Å²	54.3	55%	0.545	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-59.1	133	-177.6	25.5	-34.6	0	0	0	110.1	E547	P543-E547 WeakPolarHBondContact CA-OE2 3.41Å; P543-E547 HydrophobicContact CB-CB 4.33Å
544	S	83.1	Confident	84.9	Confident	10 Å²	10	49.2 Å²	49.2	7%	0.07	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-66.5	172.4	174.1	70.5	0	0	0	0	111.4	E525 T542 T546 E547 S548	E525-S544 WeakPolarHBondContact OE2-CB 3.4Å; E525-S544 PolarHBondContact OE2-OG 3.01Å; T542-S544 PolarHBondContact O-N 2.9Å; S544-T546 PolarHBondContact OG-OG1 3.48Å; S544-E547 PolarHBondContact N-OE2 2.98Å; S544-E547 PolarHBondContact O-N 3.17Å; S544-E547 WeakPolarHBondContact OG-CB 3.42Å; S544-E547 WeakPolarHBondContact OG-CG 3.47Å; S544-E547 PolarHBondContact OG-N 3.34Å; S544-S548 VanDerWaalsContact O-CB 3.25Å; S544-S548 WeakPolarHBondContact O-CB 3.1Å; S544-S548 PolarHBondContact O-N 3.1Å; S544-S548 PolarHBondContact O-OG 2.96Å
545	L	85.4	Confident	85.9	Confident	137 Å²	137	46.5 Å²	46.5	72%	0.717	26%	0.255	S	S	*	.	H	α-helix	trans	-67.7	-39.8	176.2	172.5	67.1	0	0	0	110.5	E525 S548 A549	E525-L545 VanDerWaalsContact OE1-CB 3.26Å; E525-L545 WeakPolarHBondContact OE1-CB 3.27Å; E525-L545 PolarHBondContact OE2-N 3.47Å; L545-S548 PolarHBondContact O-N 3.31Å; L545-A549 WeakPolarHBondContact O-CB 3.25Å; L545-A549 PolarHBondContact O-N 3.39Å
546	T	86.9	Confident	86.8	Confident	13 Å²	13	44 Å²	44	8%	0.08	25%	0.246	C	C	.	.	H	α-helix	trans	-57.5	-48.9	168	39.2	0	0	0	0	113.1	L516 E525 S544 A549 L550	L516-T546 HydrophobicContact CD1-CG2 4.02Å; E525-T546 VanDerWaalsContact CD-CG2 3.47Å; E525-T546 VanDerWaalsContact CD-N 3.32Å; E525-T546 HydrophobicContact CG-CG2 4Å; E525-T546 WeakPolarHBondContact OE1-CG2 3.35Å; E525-T546 PolarHBondContact OE1-N 3.47Å; E525-T546 WeakPolarHBondContact OE2-CB 3.32Å; E525-T546 PolarHBondContact OE2-N 3.43Å; E525-T546 PolarHBondContact OE2-OG1 3.21Å; S544-T546 PolarHBondContact OG-OG1 3.48Å; T546-A549 PolarHBondContact O-N 2.95Å; T546-L550 WeakPolarHBondContact O-CG 3.49Å; T546-L550 PolarHBondContact O-N 3.45Å
547	E	87.8	Confident	87.6	Confident	35 Å²	35	40.2 Å²	40.2	16%	0.164	23%	0.227	C	C	.	.	H	α-helix	trans	-65.6	-39.8	179.3	-71.5	167.2	165.1	0	0	111.7	R535 P543 S544 L550 V551 R596	R535-E547 IonicContact NH2-OE1 2.72Å; R535-E547 IonicContact NH2-OE2 2.73Å; R535-E547 PolarHBondContact NH2-OE2 2.84Å; P543-E547 WeakPolarHBondContact CA-OE2 3.41Å; P543-E547 HydrophobicContact CB-CB 4.33Å; S544-E547 PolarHBondContact N-OE2 2.98Å; S544-E547 PolarHBondContact O-N 3.17Å; S544-E547 WeakPolarHBondContact OG-CB 3.42Å; S544-E547 WeakPolarHBondContact OG-CG 3.47Å; S544-E547 PolarHBondContact OG-N 3.34Å; E547-L550 WeakPolarHBondContact O-CB 3.44Å; E547-L550 PolarHBondContact O-N 3.47Å; E547-V551 WeakPolarHBondContact O-CG2 3.31Å; E547-V551 PolarHBondContact O-N 3.23Å; E547-R596 IonicContact OE1-CZ 3.87Å; E547-R596 IonicContact OE1-NH1 3.18Å; E547-R596 PolarHBondContact OE1-NH1 3.22Å; E547-R596 IonicContact OE1-NH2 3.65Å; E547-R596 IonicContact OE2-NH1 3.98Å; E547-R596 PolarHBondContact OE2-NH1 2.96Å
548	S	88.6	Confident	88.4	Confident	45 Å²	45	38.9 Å²	38.9	32%	0.315	22%	0.223	S	C	.	.	H	α-helix	trans	-62.9	-42.1	175.7	-60.2	0	0	0	0	111.5	S544 L545 V551 I552	S544-S548 VanDerWaalsContact O-CB 3.25Å; S544-S548 WeakPolarHBondContact O-CB 3.1Å; S544-S548 PolarHBondContact O-N 3.1Å; S544-S548 PolarHBondContact O-OG 2.96Å; L545-S548 PolarHBondContact O-N 3.31Å; S548-V551 PolarHBondContact O-N 3.26Å; S548-I552 WeakPolarHBondContact O-CG1 3.39Å; S548-I552 PolarHBondContact O-N 3.31Å
549	A	91.2	Very high	88.8	Confident	33 Å²	33	43.9 Å²	43.9	27%	0.273	24%	0.241	S	C	.	.	H	α-helix	trans	-64.1	-41	173.1	0	0	0	0	0	111.8	L516 L545 T546 V551 I552 Y553	L516-A549 HydrophobicContact CD1-CB 4.45Å; L516-A549 HydrophobicContact CD2-CB 3.71Å; L545-A549 WeakPolarHBondContact O-CB 3.25Å; L545-A549 PolarHBondContact O-N 3.39Å; T546-A549 PolarHBondContact O-N 2.95Å; A549-V551 PolarHBondContact O-N 2.81Å; A549-I552 PolarHBondContact O-N 3.27Å; A549-Y553 WeakPolarHBondContact O-CD2 3.43Å; A549-Y553 PolarHBondContact O-N 3.44Å; A549-Y553 VanDerWaalsContact O-N 3.13Å
550	L	93.1	Very high	89.1	Confident	10 Å²	10	44.3 Å²	44.3	5%	0.052	24%	0.244	C	C	.	.	H	α-helix	trans	-61.9	-40.6	174.8	-73.7	167.9	0	0	0	112.4	F513 L516 L517 A520 T546 E547 I552 Y553 V554 F630	F513-L550 HydrophobicContact CD2-CD2 3.86Å; F513-L550 HydrophobicContact CE2-CD2 3.64Å; L516-L550 HydrophobicContact CB-CD2 4.2Å; L516-L550 HydrophobicContact CD2-CD2 3.74Å; L516-L550 HydrophobicContact CD2-CG 3.84Å; L516-L550 HydrophobicContact CG-CD2 3.77Å; L516-L550 HydrophobicContact CG-CG 3.88Å; L517-L550 HydrophobicContact CD2-CD1 3.86Å; L517-L550 HydrophobicContact CD2-CD2 3.56Å; L517-L550 HydrophobicContact CD2-CG 4.37Å; L517-L550 HydrophobicContact CG-CD2 3.81Å; A520-L550 HydrophobicContact CB-CD1 3.87Å; T546-L550 WeakPolarHBondContact O-CG 3.49Å; T546-L550 PolarHBondContact O-N 3.45Å; E547-L550 WeakPolarHBondContact O-CB 3.44Å; E547-L550 PolarHBondContact O-N 3.47Å; L550-I552 VanDerWaalsContact C-N 3.31Å; L550-I552 PolarHBondContact O-N 3.04Å; L550-Y553 WeakPolarHBondContact O-CB 3.3Å; L550-Y553 PolarHBondContact O-N 2.97Å; L550-Y553 VanDerWaalsContact O-N 3.14Å; L550-V554 WeakPolarHBondContact O-CG2 3.23Å; L550-V554 PolarHBondContact O-N 3.18Å; L550-F630 HydrophobicContact CD1-CZ 4.42Å
551	V	92.8	Very high	89.5	Confident	49 Å²	49	44.8 Å²	44.8	30%	0.297	25%	0.245	S	C	.	.	H	α-helix	trans	-59.3	-41.5	174.9	168.8	0	0	0	0	111.3	E547 S548 A549 Y553 V554 I555 I593	E547-V551 WeakPolarHBondContact O-CG2 3.31Å; E547-V551 PolarHBondContact O-N 3.23Å; S548-V551 PolarHBondContact O-N 3.26Å; A549-V551 PolarHBondContact O-N 2.81Å; V551-Y553 VanDerWaalsContact C-N 3.35Å; V551-Y553 PolarHBondContact O-N 3.4Å; V551-V554 PolarHBondContact O-N 3.45Å; V551-I555 HydrophobicContact CG1-CD1 3.78Å; V551-I555 HydrophobicContact CG1-CG1 4.41Å; V551-I555 VanDerWaalsContact O-CG1 3.3Å; V551-I555 WeakPolarHBondContact O-CG1 3.37Å; V551-I555 PolarHBondContact O-N 3.4Å; V551-I593 HydrophobicContact CG2-CD1 4.05Å; V551-I593 HydrophobicContact CG2-CG1 4.17Å
552	I	92.5	Very high	90	Very high	88 Å²	88	48.4 Å²	48.4	45%	0.451	26%	0.261	S	S	.	.	H	α-helix	trans	-62.7	-40.7	175.4	-63.6	166	0	0	0	111.1	S548 A549 L550 G556 P818 I821	S548-I552 WeakPolarHBondContact O-CG1 3.39Å; S548-I552 PolarHBondContact O-N 3.31Å; A549-I552 PolarHBondContact O-N 3.27Å; L550-I552 VanDerWaalsContact C-N 3.31Å; L550-I552 PolarHBondContact O-N 3.04Å; I552-G556 PolarHBondContact O-N 2.99Å; I552-G556 VanDerWaalsContact O-N 3.11Å; I552-P818 HydrophobicContact CG2-CB 3.72Å; I552-I821 HydrophobicContact CG2-CD1 4.13Å; I552-I821 WeakPolarHBondContact O-CD1 3.35Å
553	Y	94	Very high	90.2	Very high	29 Å²	29	47.5 Å²	47.5	11%	0.114	25%	0.25	C	S	.	.	H	α-helix	trans	-63.2	-46	173	-88.8	-89.7	0	0	0	112.3	S512 F513 L516 A549 L550 V551 G556 F557 V817	S512-Y553 PolarHBondContact OG-OH 2.76Å; F513-Y553 HydrophobicContact CB-CD1 3.78Å; F513-Y553 HydrophobicContact CB-CE1 3.95Å; F513-Y553 HydrophobicContact CB-CG 4.37Å; F513-Y553 AromaticContact CD2-CD1 3.99Å; F513-Y553 HydrophobicContact CD2-CD1 3.99Å; F513-Y553 AromaticContact CD2-CG 3.82Å; F513-Y553 HydrophobicContact CD2-CG 3.82Å; F513-Y553 HydrophobicContact CG-CD1 4.25Å; L516-Y553 HydrophobicContact CD2-CD2 4Å; L516-Y553 HydrophobicContact CD2-CE2 4.09Å; A549-Y553 WeakPolarHBondContact O-CD2 3.43Å; A549-Y553 PolarHBondContact O-N 3.44Å; A549-Y553 VanDerWaalsContact O-N 3.13Å; L550-Y553 WeakPolarHBondContact O-CB 3.3Å; L550-Y553 PolarHBondContact O-N 2.97Å; L550-Y553 VanDerWaalsContact O-N 3.14Å; V551-Y553 VanDerWaalsContact C-N 3.35Å; V551-Y553 PolarHBondContact O-N 3.4Å; Y553-G556 PolarHBondContact O-N 2.93Å; Y553-G556 VanDerWaalsContact O-N 3.15Å; Y553-F557 HydrophobicContact CD1-CE2 4.22Å; Y553-F557 HydrophobicContact CD1-CZ 4.19Å; Y553-F557 WeakPolarHBondContact O-CD2 3.31Å; Y553-F557 PolarHBondContact O-N 3.26Å; Y553-V817 HydrophobicContact CD1-CB 4.48Å; Y553-V817 HydrophobicContact CD1-CG1 3.55Å; Y553-V817 HydrophobicContact CE1-CG1 4.21Å; Y553-V817 HydrophobicContact CG-CG1 4.23Å; Y553-V817 WeakPolarHBondContact O-CG1 3.45Å
554	V	94.3	Very high	90.3	Very high	7 Å²	7	45.7 Å²	45.7	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-60.3	-47	178.8	171.3	0	0	0	0	111.2	L550 V551 G556 F557 V558 Y589 I593	L550-V554 WeakPolarHBondContact O-CG2 3.23Å; L550-V554 PolarHBondContact O-N 3.18Å; V551-V554 PolarHBondContact O-N 3.45Å; V554-G556 VanDerWaalsContact C-N 3.26Å; V554-G556 PolarHBondContact O-N 2.87Å; V554-F557 PolarHBondContact O-N 3.5Å; V554-F557 VanDerWaalsContact O-N 3.17Å; V554-V558 HydrophobicContact CG1-CG2 4.3Å; V554-V558 VanDerWaalsContact O-CG2 3.31Å; V554-V558 WeakPolarHBondContact O-CG2 3.46Å; V554-V558 PolarHBondContact O-N 3.43Å; V554-Y589 HydrophobicContact CG2-CD1 4.34Å; V554-Y589 HydrophobicContact CG2-CD2 4.15Å; V554-Y589 HydrophobicContact CG2-CG 3.88Å; V554-I593 HydrophobicContact CB-CD1 4.34Å; V554-I593 HydrophobicContact CG1-CD1 3.94Å
555	I	93.1	Very high	90.6	Very high	89 Å²	89	48.4 Å²	48.4	46%	0.456	25%	0.247	S	C	.	.	H	α-helix	trans	-57.2	-42.8	175.1	-67.7	165.5	0	0	0	110.5	V551 V558 W559 I821	V551-I555 HydrophobicContact CG1-CD1 3.78Å; V551-I555 HydrophobicContact CG1-CG1 4.41Å; V551-I555 VanDerWaalsContact O-CG1 3.3Å; V551-I555 WeakPolarHBondContact O-CG1 3.37Å; V551-I555 PolarHBondContact O-N 3.4Å; I555-V558 PolarHBondContact O-N 3.23Å; I555-W559 VanDerWaalsContact O-CB 3.28Å; I555-W559 WeakPolarHBondContact O-CB 3.47Å; I555-W559 PolarHBondContact O-N 2.96Å; I555-I821 HydrophobicContact CB-CD1 4.16Å; I555-I821 HydrophobicContact CG2-CD1 3.82Å; I555-I821 HydrophobicContact CG2-CG1 4.31Å
556	G	92.6	Very high	90.8	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-66.4	-35.7	178	0	0	0	0	0	114.1	I552 Y553 V554 Q560 N820	I552-G556 PolarHBondContact O-N 2.99Å; I552-G556 VanDerWaalsContact O-N 3.11Å; Y553-G556 PolarHBondContact O-N 2.93Å; Y553-G556 VanDerWaalsContact O-N 3.15Å; V554-G556 VanDerWaalsContact C-N 3.26Å; V554-G556 PolarHBondContact O-N 2.87Å; G556-Q560 WeakPolarHBondContact O-CB 3.34Å; G556-Q560 PolarHBondContact O-N 3.13Å; G556-N820 PolarHBondContact O-ND2 3.06Å
557	F	93.4	Very high	90.5	Very high	6 Å²	6	56.9 Å²	56.9	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-70	-45.5	172.7	-69.2	-50.3	0	0	0	112	Y510 F513 Y553 V554 W559 Q560 Q561 N586 V817	Y510-F557 AromaticContact CD2-CE1 3.95Å; Y510-F557 HydrophobicContact CD2-CE1 3.95Å; Y510-F557 AromaticContact CD2-CZ 3.67Å; Y510-F557 HydrophobicContact CD2-CZ 3.67Å; Y510-F557 HydrophobicContact CE2-CE1 4.33Å; Y510-F557 HydrophobicContact CE2-CE2 4.46Å; Y510-F557 AromaticContact CE2-CZ 3.92Å; Y510-F557 HydrophobicContact CE2-CZ 3.92Å; F513-F557 HydrophobicContact CB-CE2 4.32Å; F513-F557 HydrophobicContact CB-CZ 4.18Å; F513-F557 AromaticContact CD1-CE2 3.79Å; F513-F557 HydrophobicContact CD1-CE2 3.79Å; F513-F557 HydrophobicContact CD1-CZ 4.08Å; F513-F557 AromaticContact CD2-CE2 3.77Å; F513-F557 HydrophobicContact CD2-CE2 3.77Å; F513-F557 HydrophobicContact CD2-CZ 4.46Å; F513-F557 AromaticContact CE1-CE2 3.96Å; F513-F557 HydrophobicContact CE1-CE2 3.96Å; F513-F557 AromaticContact CE2-CE2 3.93Å; F513-F557 HydrophobicContact CE2-CE2 3.93Å; F513-F557 AromaticContact CG-CE2 3.68Å; F513-F557 HydrophobicContact CG-CE2 3.68Å; F513-F557 AromaticContact CG-CZ 3.98Å; F513-F557 HydrophobicContact CG-CZ 3.98Å; F513-F557 HydrophobicContact CZ-CE2 4.02Å; Y553-F557 HydrophobicContact CD1-CE2 4.22Å; Y553-F557 HydrophobicContact CD1-CZ 4.19Å; Y553-F557 WeakPolarHBondContact O-CD2 3.31Å; Y553-F557 PolarHBondContact O-N 3.26Å; V554-F557 PolarHBondContact O-N 3.5Å; V554-F557 VanDerWaalsContact O-N 3.17Å; F557-W559 VanDerWaalsContact C-N 3.33Å; F557-W559 PolarHBondContact O-N 3.1Å; F557-Q560 CarbonylContact O-C 3.56Å; F557-Q560 WeakPolarHBondContact O-CA 3.49Å; F557-Q560 WeakPolarHBondContact O-CB 3.44Å; F557-Q560 PolarHBondContact O-N 3.18Å; F557-Q560 VanDerWaalsContact O-N 3.07Å; F557-Q561 WeakPolarHBondContact O-CG 3.49Å; F557-Q561 PolarHBondContact O-N 3.15Å; F557-N586 WeakPolarHBondContact CB-OD1 3.26Å; F557-V817 HydrophobicContact CD1-CB 4.22Å; F557-V817 HydrophobicContact CD1-CG1 4.16Å; F557-V817 HydrophobicContact CD1-CG2 3.72Å; F557-V817 HydrophobicContact CE1-CB 3.98Å; F557-V817 HydrophobicContact CE1-CG1 4.04Å; F557-V817 HydrophobicContact CE1-CG2 3.92Å; F557-V817 HydrophobicContact CE2-CG1 4.47Å; F557-V817 HydrophobicContact CG-CG1 4.4Å; F557-V817 HydrophobicContact CG-CG2 4.48Å; F557-V817 HydrophobicContact CZ-CB 4.49Å; F557-V817 HydrophobicContact CZ-CG1 4.19Å
558	V	93.6	Very high	90.3	Very high	34 Å²	34	61 Å²	61	21%	0.206	29%	0.291	C	S	.	.	H	α-helix	trans	-56.8	-48.5	175.5	171.3	0	0	0	0	110.2	V554 I555 Q560 Q561 M562 N586 I590	V554-V558 HydrophobicContact CG1-CG2 4.3Å; V554-V558 VanDerWaalsContact O-CG2 3.31Å; V554-V558 WeakPolarHBondContact O-CG2 3.46Å; V554-V558 PolarHBondContact O-N 3.43Å; I555-V558 PolarHBondContact O-N 3.23Å; V558-Q560 VanDerWaalsContact C-N 3.29Å; V558-Q560 PolarHBondContact O-N 3.03Å; V558-Q561 PolarHBondContact O-N 3.31Å; V558-Q561 VanDerWaalsContact O-N 3.15Å; V558-M562 HydrophobicContact CG1-CG 4.45Å; V558-M562 HydrophobicContact CG1-SD 4.05Å; V558-M562 WeakPolarHBondContact O-CG 3.04Å; V558-M562 PolarHBondContact O-N 3.38Å; V558-N586 HydrophobicContact CG2-CB 4.13Å; V558-I590 HydrophobicContact CG2-CD1 3.84Å; V558-I590 HydrophobicContact CG2-CG1 4.23Å
559	W	90.6	Very high	90.2	Very high	116 Å²	116	60.4 Å²	60.4	44%	0.439	29%	0.291	S	S	.	.	H	α-helix	trans	-60.5	-35	175.2	-171.6	-133.1	0	0	0	113	I555 F557 K563 N820	I555-W559 VanDerWaalsContact O-CB 3.28Å; I555-W559 WeakPolarHBondContact O-CB 3.47Å; I555-W559 PolarHBondContact O-N 2.96Å; F557-W559 VanDerWaalsContact C-N 3.33Å; F557-W559 PolarHBondContact O-N 3.1Å; W559-K563 VanDerWaalsContact NE1-NZ 3.11Å; W559-K563 WeakPolarHBondContact O-CB 3.5Å; W559-K563 WeakPolarHBondContact O-CG 3.38Å; W559-K563 PolarHBondContact O-N 3.26Å; W559-K563 VanDerWaalsContact O-N 3.1Å; W559-N820 VanDerWaalsContact CD1-O 3.26Å; W559-N820 PolarHBondContact NE1-O 3.17Å
560	Q	89.7	Confident	90.2	Very high	29 Å²	29	64.1 Å²	64.1	14%	0.136	31%	0.306	C	S	.	.	H	α-helix	trans	-68.9	-41.7	173.8	-169.3	179.7	16.9	0	0	112.2	H506 G556 F557 V558 K563 K564	H506-Q560 PolarHBondContact CE1-NE2 3.01Å; G556-Q560 WeakPolarHBondContact O-CB 3.34Å; G556-Q560 PolarHBondContact O-N 3.13Å; F557-Q560 CarbonylContact O-C 3.56Å; F557-Q560 WeakPolarHBondContact O-CA 3.49Å; F557-Q560 WeakPolarHBondContact O-CB 3.44Å; F557-Q560 PolarHBondContact O-N 3.18Å; F557-Q560 VanDerWaalsContact O-N 3.07Å; V558-Q560 VanDerWaalsContact C-N 3.29Å; V558-Q560 PolarHBondContact O-N 3.03Å; Q560-K563 PolarHBondContact O-N 3.13Å; Q560-K564 WeakPolarHBondContact O-CG 3.37Å; Q560-K564 PolarHBondContact O-N 3.35Å
561	Q	90.9	Very high	90	Very high	14 Å²	14	74.1 Å²	74.1	7%	0.065	34%	0.343	C	S	.	.	H	α-helix	trans	-69.1	-40.6	176.2	-56.5	-53.1	-25.4	0	0	111.8	F557 V558 K563 K564 L565 Y573 D582	F557-Q561 WeakPolarHBondContact O-CG 3.49Å; F557-Q561 PolarHBondContact O-N 3.15Å; V558-Q561 PolarHBondContact O-N 3.31Å; V558-Q561 VanDerWaalsContact O-N 3.15Å; Q561-K563 VanDerWaalsContact C-N 3.31Å; Q561-K563 PolarHBondContact O-N 2.86Å; Q561-K564 PolarHBondContact O-N 3Å; Q561-K564 VanDerWaalsContact OE1-CD 3.28Å; Q561-L565 WeakPolarHBondContact O-CB 3.38Å; Q561-L565 PolarHBondContact O-N 3.49Å; Q561-Y573 PolarHBondContact OE1-OH 2.7Å; Q561-D582 PolarHBondContact NE2-OD2 3.27Å
562	M	90.4	Very high	89.6	Confident	108 Å²	108	74.2 Å²	74.2	53%	0.532	35%	0.349	S	S	.	.	H	α-helix	trans	-58.1	-43.4	173.8	-70.4	177.8	77.5	0	0	111.5	V558 L565 Y566	V558-M562 HydrophobicContact CG1-CG 4.45Å; V558-M562 HydrophobicContact CG1-SD 4.05Å; V558-M562 WeakPolarHBondContact O-CG 3.04Å; V558-M562 PolarHBondContact O-N 3.38Å; M562-L565 PolarHBondContact O-N 3.09Å; M562-Y566 WeakPolarHBondContact O-CB 3.46Å; M562-Y566 PolarHBondContact O-N 2.93Å
563	K	86.6	Confident	89.4	Confident	62 Å²	62	70.4 Å²	70.4	27%	0.27	33%	0.329	S	S	.	.	H	α-helix	trans	-61.5	-45.1	173.6	-77.1	172	177.6	176.3	0	112.5	W559 Q560 Q561 Y566 I567 N820	W559-K563 VanDerWaalsContact NE1-NZ 3.11Å; W559-K563 WeakPolarHBondContact O-CB 3.5Å; W559-K563 WeakPolarHBondContact O-CG 3.38Å; W559-K563 PolarHBondContact O-N 3.26Å; W559-K563 VanDerWaalsContact O-N 3.1Å; Q560-K563 PolarHBondContact O-N 3.13Å; Q561-K563 VanDerWaalsContact C-N 3.31Å; Q561-K563 PolarHBondContact O-N 2.86Å; K563-Y566 PolarHBondContact O-N 3.2Å; K563-I567 WeakPolarHBondContact O-CD1 3.36Å; K563-I567 WeakPolarHBondContact O-CG1 3.45Å; K563-I567 PolarHBondContact O-N 3.12Å; K563-I567 VanDerWaalsContact O-N 3.09Å; K563-N820 PolarHBondContact NZ-OD1 3.28Å
564	K	86.3	Confident	89.2	Confident	46 Å²	46	73 Å²	73	20%	0.2	34%	0.344	C	S	.	.	H	α-helix	trans	-60.2	-47.6	174.4	-70.7	175.4	-174	173	0	111.7	Q560 Q561 Y566 I567 W568 Y573 D582	Q560-K564 WeakPolarHBondContact O-CG 3.37Å; Q560-K564 PolarHBondContact O-N 3.35Å; Q561-K564 PolarHBondContact O-N 3Å; Q561-K564 VanDerWaalsContact OE1-CD 3.28Å; K564-Y566 VanDerWaalsContact C-N 3.31Å; K564-Y566 PolarHBondContact O-N 2.8Å; K564-I567 PolarHBondContact O-N 3.48Å; K564-W568 WeakPolarHBondContact O-CB 3.3Å; K564-W568 PolarHBondContact O-N 2.87Å; K564-Y573 HydrophobicContact CB-CD2 4.45Å; K564-Y573 HydrophobicContact CB-CE2 4.34Å; K564-Y573 HydrophobicContact CD-CE2 4.47Å; K564-D582 IonicContact NZ-OD2 2.83Å; K564-D582 PolarHBondContact NZ-OD2 2.99Å
565	L	89.9	Confident	88.7	Confident	67 Å²	67	77.6 Å²	77.6	35%	0.351	37%	0.372	S	S	.	.	H	α-helix	trans	-61.3	-39.8	-178.3	-180	62.5	0	0	0	111.6	Q561 M562 G569 L570 Y573	Q561-L565 WeakPolarHBondContact O-CB 3.38Å; Q561-L565 PolarHBondContact O-N 3.49Å; M562-L565 PolarHBondContact O-N 3.09Å; L565-G569 VanDerWaalsContact O-CA 3.23Å; L565-G569 WeakPolarHBondContact O-CA 3.44Å; L565-G569 PolarHBondContact O-N 3.05Å; L565-L570 HydrophobicContact CD1-CB 4.24Å; L565-L570 HydrophobicContact CD1-CD1 3.91Å; L565-Y573 HydrophobicContact CB-CD2 4.35Å; L565-Y573 HydrophobicContact CD1-CD1 4.26Å; L565-Y573 HydrophobicContact CD1-CD2 4.37Å; L565-Y573 HydrophobicContact CD1-CG 3.9Å
566	Y	87.8	Confident	88.3	Confident	213 Å²	213	74.7 Å²	74.7	84%	0.835	36%	0.358	S	S	*	.	H	α-helix	trans	-65.9	-42	174	-175.9	-95.1	0	0	0	112.7	M562 K563 K564	M562-Y566 WeakPolarHBondContact O-CB 3.46Å; M562-Y566 PolarHBondContact O-N 2.93Å; K563-Y566 PolarHBondContact O-N 3.2Å; K564-Y566 VanDerWaalsContact C-N 3.31Å; K564-Y566 PolarHBondContact O-N 2.8Å
567	I	82	Confident	88	Confident	115 Å²	115	80.3 Å²	80.3	59%	0.59	39%	0.386	S	S	*	.	H	α-helix	trans	-77.9	-31.8	-176.4	-63.8	165.1	0	0	0	112.6	K563 K564	K563-I567 WeakPolarHBondContact O-CD1 3.36Å; K563-I567 WeakPolarHBondContact O-CG1 3.45Å; K563-I567 PolarHBondContact O-N 3.12Å; K563-I567 VanDerWaalsContact O-N 3.09Å; K564-I567 PolarHBondContact O-N 3.48Å
568	W	82.4	Confident	87.8	Confident	122 Å²	122	83.3 Å²	83.3	46%	0.462	40%	0.397	S	S	.	.	H	α-helix	trans	-100.3	-22.7	-178.2	-65.4	-9.3	0	0	0	114	K564 A572	K564-W568 WeakPolarHBondContact O-CB 3.3Å; K564-W568 PolarHBondContact O-N 2.87Å; W568-A572 HydrophobicContact CB-CB 4.31Å; W568-A572 WeakPolarHBondContact O-CB 3.29Å
569	G	88.1	Confident	87.6	Confident	31 Å²	31	82.1 Å²	82.1	32%	0.32	39%	0.389	S	S	.	.			trans	75.7	155.2	-171	0	0	0	0	0	113.4	L565 R571 A572 Y573	L565-G569 VanDerWaalsContact O-CA 3.23Å; L565-G569 WeakPolarHBondContact O-CA 3.44Å; L565-G569 PolarHBondContact O-N 3.05Å; G569-R571 PolarHBondContact O-N 3.08Å; G569-A572 PolarHBondContact O-N 3.32Å; G569-Y573 PolarHBondContact O-N 3.22Å
570	L	90.3	Very high	87.6	Confident	111 Å²	111	80.1 Å²	80.1	58%	0.581	39%	0.387	S	S	*	.	H	α-helix	trans	-56.2	-43.1	-171.5	-177	63.8	0	0	0	113.8	L565 Y573 L574	L565-L570 HydrophobicContact CD1-CB 4.24Å; L565-L570 HydrophobicContact CD1-CD1 3.91Å; L570-Y573 PolarHBondContact O-N 3.09Å; L570-L574 HydrophobicContact CD1-CD1 3.81Å; L570-L574 HydrophobicContact CD1-CG 4.01Å; L570-L574 HydrophobicContact CG-CD1 3.91Å; L570-L574 HydrophobicContact CG-CG 4.43Å; L570-L574 WeakPolarHBondContact O-CG 3.42Å; L570-L574 PolarHBondContact O-N 3.49Å
571	R	88.6	Confident	87.8	Confident	221 Å²	221	80.8 Å²	80.8	83%	0.834	39%	0.393	S	S	*	.	H	α-helix	trans	-64.8	-43.9	-177.1	-169.8	176.3	-176.9	178.9	1.9	112.2	G569 T575	G569-R571 PolarHBondContact O-N 3.08Å; R571-T575 WeakPolarHBondContact O-CG2 3.46Å; R571-T575 PolarHBondContact O-N 2.66Å; R571-T575 PolarHBondContact O-OG1 2.84Å
572	A	84.4	Confident	87.8	Confident	50 Å²	50	80.6 Å²	80.6	41%	0.413	39%	0.392	S	S	.	.	H	α-helix	trans	-74.5	-28.4	178.7	0	0	0	0	0	112.4	W568 G569 T575	W568-A572 HydrophobicContact CB-CB 4.31Å; W568-A572 WeakPolarHBondContact O-CB 3.29Å; G569-A572 PolarHBondContact O-N 3.32Å; A572-T575 WeakPolarHBondContact CA-OG1 3.18Å; A572-T575 PolarHBondContact O-OG1 3.3Å
573	Y	88.1	Confident	88	Confident	8 Å²	8	81.4 Å²	81.4	3%	0.031	39%	0.393	C	S	.	.	H	α-helix	trans	-63.3	-53.2	171.2	-172.8	-90.8	0	0	0	111.1	Q561 K564 L565 G569 L570 T575 D576 N579 F583	Q561-Y573 PolarHBondContact OE1-OH 2.7Å; K564-Y573 HydrophobicContact CB-CD2 4.45Å; K564-Y573 HydrophobicContact CB-CE2 4.34Å; K564-Y573 HydrophobicContact CD-CE2 4.47Å; L565-Y573 HydrophobicContact CB-CD2 4.35Å; L565-Y573 HydrophobicContact CD1-CD1 4.26Å; L565-Y573 HydrophobicContact CD1-CD2 4.37Å; L565-Y573 HydrophobicContact CD1-CG 3.9Å; G569-Y573 PolarHBondContact O-N 3.22Å; L570-Y573 PolarHBondContact O-N 3.09Å; Y573-T575 VanDerWaalsContact C-N 3.33Å; Y573-T575 PolarHBondContact O-N 3Å; Y573-D576 PolarHBondContact O-N 2.92Å; Y573-N579 HydrophobicContact CD1-CB 3.99Å; Y573-N579 HydrophobicContact CD2-CB 4.11Å; Y573-N579 HydrophobicContact CE1-CB 3.72Å; Y573-N579 WeakPolarHBondContact CE1-O 3.49Å; Y573-N579 HydrophobicContact CE2-CB 3.86Å; Y573-N579 HydrophobicContact CG-CB 4.17Å; Y573-N579 VanDerWaalsContact O-CB 3.28Å; Y573-N579 WeakPolarHBondContact O-CB 3.41Å; Y573-N579 PolarHBondContact O-ND2 2.88Å; Y573-N579 PolarHBondContact OH-O 2.93Å; Y573-F583 HydrophobicContact CE1-CB 4.42Å
574	L	89.2	Confident	88.3	Confident	83 Å²	83	81.4 Å²	81.4	44%	0.435	40%	0.398	S	S	.	.	H	α-helix	trans	-68.9	-22.6	-175.9	-68.5	175.4	0	0	0	114.7	L570 D576 M577	L570-L574 HydrophobicContact CD1-CD1 3.81Å; L570-L574 HydrophobicContact CD1-CG 4.01Å; L570-L574 HydrophobicContact CG-CD1 3.91Å; L570-L574 HydrophobicContact CG-CG 4.43Å; L570-L574 WeakPolarHBondContact O-CG 3.42Å; L570-L574 PolarHBondContact O-N 3.49Å; L574-D576 PolarHBondContact O-N 2.89Å; L574-M577 WeakPolarHBondContact O-CE 3.47Å
575	T	85	Confident	88.7	Confident	104 Å²	104	79.3 Å²	79.3	64%	0.638	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-11.2	175.9	43.7	0	0	0	0	114.7	R571 A572 Y573	R571-T575 WeakPolarHBondContact O-CG2 3.46Å; R571-T575 PolarHBondContact O-N 2.66Å; R571-T575 PolarHBondContact O-OG1 2.84Å; A572-T575 WeakPolarHBondContact CA-OG1 3.18Å; A572-T575 PolarHBondContact O-OG1 3.3Å; Y573-T575 VanDerWaalsContact C-N 3.33Å; Y573-T575 PolarHBondContact O-N 3Å
576	D	84.9	Confident	88.9	Confident	29 Å²	29	76.4 Å²	76.4	16%	0.155	37%	0.374	C	S	.	.	S	Bend	trans	-104.2	115.5	173.9	-157.7	-45.5	0	0	0	110.3	Y573 L574 W578 N579 L580 K803	Y573-D576 PolarHBondContact O-N 2.92Å; L574-D576 PolarHBondContact O-N 2.89Å; D576-W578 PolarHBondContact O-N 3.38Å; D576-W578 VanDerWaalsContact O-N 3.14Å; D576-W578 PolarHBondContact OD1-N 3.45Å; D576-N579 HydrophobicContact CB-CB 4.36Å; D576-N579 WeakPolarHBondContact O-CB 3.37Å; D576-N579 PolarHBondContact O-N 3.27Å; D576-L580 PolarHBondContact O-N 3.46Å; D576-K803 IonicContact OD2-NZ 2.67Å; D576-K803 PolarHBondContact OD2-NZ 3.29Å
577	M	86.3	Confident	89.3	Confident	118 Å²	118	68.2 Å²	68.2	58%	0.581	35%	0.35	S	S	*	.	H	α-helix	trans	-61.3	-26.6	-176.3	-60.4	-62	95.4	0	0	112.5	L574 L580 V581	L574-M577 WeakPolarHBondContact O-CE 3.47Å; M577-L580 WeakPolarHBondContact O-CB 3.46Å; M577-L580 PolarHBondContact O-N 2.96Å; M577-V581 WeakPolarHBondContact O-CG2 3.36Å; M577-V581 PolarHBondContact O-N 2.85Å
578	W	88.8	Confident	90	Very high	68 Å²	68	64.4 Å²	64.4	26%	0.258	33%	0.331	S	S	.	.	H	α-helix	trans	-71.6	-28.5	175.4	-64.5	105.5	0	0	0	113.1	D576 L580 D582 V642 Y643	D576-W578 PolarHBondContact O-N 3.38Å; D576-W578 VanDerWaalsContact O-N 3.14Å; D576-W578 PolarHBondContact OD1-N 3.45Å; W578-L580 VanDerWaalsContact C-N 3.32Å; W578-D582 WeakPolarHBondContact O-CB 3.49Å; W578-D582 PolarHBondContact O-N 3.01Å; W578-V642 HydrophobicContact CH2-CB 4.11Å; W578-V642 HydrophobicContact CH2-CG1 4.04Å; W578-Y643 HydrophobicContact CB-CD2 4.12Å; W578-Y643 HydrophobicContact CB-CE2 4.15Å; W578-Y643 AromaticContact CD1-CD2 3.74Å; W578-Y643 AromaticContact CD1-CE2 3.87Å; W578-Y643 AromaticContact CD2-CD2 3.64Å; W578-Y643 HydrophobicContact CD2-CD2 3.64Å; W578-Y643 HydrophobicContact CD2-CE2 4.44Å; W578-Y643 HydrophobicContact CD2-CG 4.4Å; W578-Y643 AromaticContact CE2-CD2 3.87Å; W578-Y643 HydrophobicContact CE3-CD2 4.24Å; W578-Y643 AromaticContact CG-CD2 3.56Å; W578-Y643 HydrophobicContact CG-CD2 3.56Å; W578-Y643 AromaticContact CG-CE2 3.88Å; W578-Y643 HydrophobicContact CG-CE2 3.88Å; W578-Y643 AromaticContact NE1-CD2 3.89Å
579	N	89.9	Confident	90.6	Very high	10 Å²	10	59 Å²	59	5%	0.053	31%	0.31	C	S	.	.	H	α-helix	trans	-70	-31.8	171.3	-73.7	-23.4	0	0	0	111.6	Y573 D576 F583	Y573-N579 HydrophobicContact CD1-CB 3.99Å; Y573-N579 HydrophobicContact CD2-CB 4.11Å; Y573-N579 HydrophobicContact CE1-CB 3.72Å; Y573-N579 WeakPolarHBondContact CE1-O 3.49Å; Y573-N579 HydrophobicContact CE2-CB 3.86Å; Y573-N579 HydrophobicContact CG-CB 4.17Å; Y573-N579 VanDerWaalsContact O-CB 3.28Å; Y573-N579 WeakPolarHBondContact O-CB 3.41Å; Y573-N579 PolarHBondContact O-ND2 2.88Å; Y573-N579 PolarHBondContact OH-O 2.93Å; D576-N579 HydrophobicContact CB-CB 4.36Å; D576-N579 WeakPolarHBondContact O-CB 3.37Å; D576-N579 PolarHBondContact O-N 3.27Å; N579-F583 WeakPolarHBondContact O-CB 3.37Å; N579-F583 PolarHBondContact O-N 3.12Å
580	L	91	Very high	91	Very high	73 Å²	73	61.5 Å²	61.5	38%	0.382	32%	0.316	S	S	.	.	H	α-helix	trans	-70	-42.4	174	-176.6	62.2	0	0	0	111.3	D576 M577 W578 D582 F583 V584	D576-L580 PolarHBondContact O-N 3.46Å; M577-L580 WeakPolarHBondContact O-CB 3.46Å; M577-L580 PolarHBondContact O-N 2.96Å; W578-L580 VanDerWaalsContact C-N 3.32Å; L580-D582 VanDerWaalsContact C-N 3.34Å; L580-F583 WeakPolarHBondContact O-CB 3.33Å; L580-F583 PolarHBondContact O-N 2.99Å; L580-F583 VanDerWaalsContact O-N 3.17Å; L580-V584 WeakPolarHBondContact O-CG2 3.38Å; L580-V584 PolarHBondContact O-N 2.63Å
581	V	92.1	Very high	91.3	Very high	43 Å²	43	57.7 Å²	57.7	26%	0.261	30%	0.3	S	S	.	.	H	α-helix	trans	-59.9	-44.4	171.1	174.4	0	0	0	0	110.9	M577 F583 V584 M585 V636	M577-V581 WeakPolarHBondContact O-CG2 3.36Å; M577-V581 PolarHBondContact O-N 2.85Å; V581-F583 VanDerWaalsContact C-N 3.31Å; V581-F583 PolarHBondContact O-N 2.86Å; V581-V584 PolarHBondContact O-N 3.34Å; V581-M585 WeakPolarHBondContact O-CB 3.43Å; V581-M585 PolarHBondContact O-N 2.99Å; V581-V636 HydrophobicContact CG1-CG1 3.79Å
582	D	92.6	Very high	91.6	Very high	10 Å²	10	47.6 Å²	47.6	5%	0.053	26%	0.263	C	S	.	.	H	α-helix	trans	-60	-38.7	173.5	-94.2	2.6	0	0	0	112.4	Q561 K564 W578 L580 N586 K640	Q561-D582 PolarHBondContact NE2-OD2 3.27Å; K564-D582 IonicContact NZ-OD2 2.83Å; K564-D582 PolarHBondContact NZ-OD2 2.99Å; W578-D582 WeakPolarHBondContact O-CB 3.49Å; W578-D582 PolarHBondContact O-N 3.01Å; L580-D582 VanDerWaalsContact C-N 3.34Å; D582-N586 PolarHBondContact O-N 2.78Å; D582-N586 VanDerWaalsContact O-N 3.15Å; D582-N586 PolarHBondContact O-ND2 3.17Å; D582-K640 VanDerWaalsContact CG-NZ 3.31Å; D582-K640 VanDerWaalsContact OD1-CD 3.27Å; D582-K640 WeakPolarHBondContact OD1-CD 3.44Å; D582-K640 WeakPolarHBondContact OD1-CE 3.35Å; D582-K640 IonicContact OD1-NZ 3.6Å; D582-K640 PolarHBondContact OD1-NZ 3.08Å; D582-K640 IonicContact OD2-NZ 2.75Å; D582-K640 PolarHBondContact OD2-NZ 2.83Å
583	F	93.4	Very high	92	Very high	126 Å²	126	47.9 Å²	47.9	55%	0.553	26%	0.257	S	S	*	.	H	α-helix	trans	-66.6	-48.8	176.4	176.9	-98.6	0	0	0	111.6	Y573 N579 L580 V581 M585 N586 A587	Y573-F583 HydrophobicContact CE1-CB 4.42Å; N579-F583 WeakPolarHBondContact O-CB 3.37Å; N579-F583 PolarHBondContact O-N 3.12Å; L580-F583 WeakPolarHBondContact O-CB 3.33Å; L580-F583 PolarHBondContact O-N 2.99Å; L580-F583 VanDerWaalsContact O-N 3.17Å; V581-F583 VanDerWaalsContact C-N 3.31Å; V581-F583 PolarHBondContact O-N 2.86Å; F583-M585 PolarHBondContact O-N 2.79Å; F583-N586 PolarHBondContact O-N 2.88Å; F583-A587 WeakPolarHBondContact O-CB 3.29Å; F583-A587 PolarHBondContact O-N 3.36Å
584	V	94.1	Very high	92.3	Very high	62 Å²	62	50.3 Å²	50.3	38%	0.376	28%	0.275	S	S	.	.	H	α-helix	trans	-59.8	-45.4	177.5	171.8	0	0	0	0	111.2	L580 V581 N586 A587 L588	L580-V584 WeakPolarHBondContact O-CG2 3.38Å; L580-V584 PolarHBondContact O-N 2.63Å; V581-V584 PolarHBondContact O-N 3.34Å; V584-N586 PolarHBondContact O-N 2.98Å; V584-A587 PolarHBondContact O-N 3.47Å; V584-L588 HydrophobicContact CG1-CD1 3.97Å; V584-L588 HydrophobicContact CG1-CG 4.42Å; V584-L588 WeakPolarHBondContact O-CG 3.36Å; V584-L588 PolarHBondContact O-N 3.15Å
585	M	94.7	Very high	92.5	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-55.8	-49.7	176.2	-172.8	-165.1	69.7	0	0	111.7	V581 F583 Y589 V636 K640	V581-M585 WeakPolarHBondContact O-CB 3.43Å; V581-M585 PolarHBondContact O-N 2.99Å; F583-M585 PolarHBondContact O-N 2.79Å; M585-Y589 HydrophobicContact CG-CD2 4.07Å; M585-Y589 HydrophobicContact CG-CE2 3.71Å; M585-Y589 WeakPolarHBondContact O-CD2 3.28Å; M585-Y589 PolarHBondContact O-N 3.09Å; M585-Y589 HydrophobicContact SD-CE2 4.33Å; M585-V636 HydrophobicContact CB-CG1 3.82Å; M585-V636 HydrophobicContact CG-CG1 4.34Å; M585-K640 HydrophobicContact SD-CD 4.46Å
586	N	94.2	Very high	92.9	Very high	7 Å²	7	47 Å²	47	4%	0.037	25%	0.248	C	C	.	.	H	α-helix	trans	-69.8	-35.7	-179.9	-74.5	-68.2	0	0	0	112.4	F557 V558 D582 F583 V584 Y589 I590	F557-N586 WeakPolarHBondContact CB-OD1 3.26Å; V558-N586 HydrophobicContact CG2-CB 4.13Å; D582-N586 PolarHBondContact O-N 2.78Å; D582-N586 VanDerWaalsContact O-N 3.15Å; D582-N586 PolarHBondContact O-ND2 3.17Å; F583-N586 PolarHBondContact O-N 2.88Å; V584-N586 PolarHBondContact O-N 2.98Å; N586-Y589 PolarHBondContact O-N 3.31Å; N586-I590 VanDerWaalsContact O-CG1 3.27Å; N586-I590 WeakPolarHBondContact O-CG1 3.4Å; N586-I590 PolarHBondContact O-N 2.86Å
587	A	96	Very high	93.2	Very high	41 Å²	41	49.4 Å²	49.4	34%	0.339	26%	0.264	S	S	.	.	H	α-helix	trans	-63.6	-42.4	176.1	0	0	0	0	0	112	F583 V584 I590 A591	F583-A587 WeakPolarHBondContact O-CB 3.29Å; F583-A587 PolarHBondContact O-N 3.36Å; V584-A587 PolarHBondContact O-N 3.47Å; A587-I590 PolarHBondContact O-N 3.38Å; A587-A591 WeakPolarHBondContact O-CB 3.37Å; A587-A591 PolarHBondContact O-N 3.33Å
588	L	96.3	Very high	93.5	Very high	35 Å²	35	47.2 Å²	47.2	18%	0.183	26%	0.257	C	S	.	.	H	α-helix	trans	-64.7	-39.8	175.3	-67.1	169	0	0	0	112	V584 A591 T592 L629 A632 A633 V636	V584-L588 HydrophobicContact CG1-CD1 3.97Å; V584-L588 HydrophobicContact CG1-CG 4.42Å; V584-L588 WeakPolarHBondContact O-CG 3.36Å; V584-L588 PolarHBondContact O-N 3.15Å; L588-A591 PolarHBondContact O-N 3.34Å; L588-T592 WeakPolarHBondContact O-CB 3.45Å; L588-T592 PolarHBondContact O-N 3.36Å; L588-T592 PolarHBondContact O-OG1 2.91Å; L588-L629 HydrophobicContact CD2-CD2 3.81Å; L588-A632 HydrophobicContact CD1-CB 4.23Å; L588-A633 HydrophobicContact CB-CB 3.69Å; L588-A633 HydrophobicContact CD1-CB 4.48Å; L588-V636 HydrophobicContact CD1-CG2 4.27Å
589	Y	95.5	Very high	93.6	Very high	8 Å²	8	44.1 Å²	44.1	3%	0.031	25%	0.246	C	C	.	.	H	α-helix	trans	-67.3	-40	173.6	-74.1	-54.2	0	0	0	112.8	F513 L517 V554 M585 N586 T592 I593 F630 A633 N634 S637	F513-Y589 AromaticContact CZ-CE2 3.94Å; F513-Y589 HydrophobicContact CZ-CE2 3.94Å; F513-Y589 AromaticContact CZ-CZ 3.97Å; L517-Y589 WeakPolarHBondContact CD1-OH 3.36Å; V554-Y589 HydrophobicContact CG2-CD1 4.34Å; V554-Y589 HydrophobicContact CG2-CD2 4.15Å; V554-Y589 HydrophobicContact CG2-CG 3.88Å; M585-Y589 HydrophobicContact CG-CD2 4.07Å; M585-Y589 HydrophobicContact CG-CE2 3.71Å; M585-Y589 WeakPolarHBondContact O-CD2 3.28Å; M585-Y589 PolarHBondContact O-N 3.09Å; M585-Y589 HydrophobicContact SD-CE2 4.33Å; N586-Y589 PolarHBondContact O-N 3.31Å; Y589-T592 WeakPolarHBondContact O-CB 3.47Å; Y589-T592 PolarHBondContact O-N 3.23Å; Y589-I593 VanDerWaalsContact O-CG1 3.29Å; Y589-I593 WeakPolarHBondContact O-CG1 3.21Å; Y589-I593 PolarHBondContact O-N 3.34Å; Y589-F630 HydrophobicContact CD1-CD2 4.22Å; Y589-F630 HydrophobicContact CD1-CE2 4.42Å; Y589-F630 AromaticContact CE1-CD2 3.9Å; Y589-F630 HydrophobicContact CE1-CD2 3.9Å; Y589-F630 AromaticContact CE1-CE2 3.88Å; Y589-F630 HydrophobicContact CE1-CE2 3.88Å; Y589-A633 HydrophobicContact CD1-CB 3.63Å; Y589-A633 HydrophobicContact CD2-CB 4.19Å; Y589-A633 HydrophobicContact CE1-CB 3.4Å; Y589-A633 HydrophobicContact CE2-CB 4Å; Y589-A633 HydrophobicContact CG-CB 4Å; Y589-A633 PolarHBondContact OH-O 2.98Å; Y589-N634 WeakPolarHBondContact CE1-OD1 3.27Å; Y589-N634 PolarHBondContact OH-OD1 3.04Å; Y589-S637 PolarHBondContact OH-OG 3.12Å
590	I	96	Very high	93.6	Very high	84 Å²	84	49.5 Å²	49.5	43%	0.431	27%	0.266	S	S	.	.	H	α-helix	trans	-62.3	-44.3	174.2	-70.1	163.6	0	0	0	110.7	V558 N586 A587 T592 I593 S594	V558-I590 HydrophobicContact CG2-CD1 3.84Å; V558-I590 HydrophobicContact CG2-CG1 4.23Å; N586-I590 VanDerWaalsContact O-CG1 3.27Å; N586-I590 WeakPolarHBondContact O-CG1 3.4Å; N586-I590 PolarHBondContact O-N 2.86Å; A587-I590 PolarHBondContact O-N 3.38Å; I590-T592 VanDerWaalsContact C-N 3.33Å; I590-T592 PolarHBondContact O-N 3Å; I590-I593 PolarHBondContact O-N 3.1Å; I590-S594 PolarHBondContact O-N 3.06Å; I590-S594 PolarHBondContact O-OG 2.95Å
591	A	96.2	Very high	93.6	Very high	31 Å²	31	47.1 Å²	47.1	26%	0.256	26%	0.257	S	S	.	.	H	α-helix	trans	-64.6	-35.9	176.9	0	0	0	0	0	112.6	A587 L588 S594 L595 L629	A587-A591 WeakPolarHBondContact O-CB 3.37Å; A587-A591 PolarHBondContact O-N 3.33Å; L588-A591 PolarHBondContact O-N 3.34Å; A591-S594 PolarHBondContact O-OG 2.92Å; A591-L595 WeakPolarHBondContact O-CB 3.35Å; A591-L595 VanDerWaalsContact O-CG 3.3Å; A591-L595 WeakPolarHBondContact O-CG 3.49Å; A591-L595 PolarHBondContact O-N 3.49Å; A591-L629 HydrophobicContact CB-CD1 4.02Å
592	T	94.7	Very high	93.5	Very high	8 Å²	8	49.1 Å²	49.1	5%	0.049	26%	0.26	C	S	.	.	H	α-helix	trans	-61.6	-47.9	172.2	-58.9	0	0	0	0	111	L588 Y589 I590 R596 F630	L588-T592 WeakPolarHBondContact O-CB 3.45Å; L588-T592 PolarHBondContact O-N 3.36Å; L588-T592 PolarHBondContact O-OG1 2.91Å; Y589-T592 WeakPolarHBondContact O-CB 3.47Å; Y589-T592 PolarHBondContact O-N 3.23Å; I590-T592 VanDerWaalsContact C-N 3.33Å; I590-T592 PolarHBondContact O-N 3Å; T592-R596 WeakPolarHBondContact O-CG 3.3Å; T592-R596 PolarHBondContact O-N 3.22Å; T592-R596 VanDerWaalsContact O-N 3.14Å; T592-F630 HydrophobicContact CG2-CB 3.79Å; T592-F630 HydrophobicContact CG2-CD2 4.1Å; T592-F630 HydrophobicContact CG2-CG 4.28Å; T592-F630 PolarHBondContact OG1-N 3.3Å
593	I	93.3	Very high	93.2	Very high	56 Å²	56	49.8 Å²	49.8	29%	0.287	26%	0.263	S	S	.	.	H	α-helix	trans	-64.1	-47.9	-179.9	-67.7	165	0	0	0	110.2	V551 V554 Y589 I590 L595 R596 T597	V551-I593 HydrophobicContact CG2-CD1 4.05Å; V551-I593 HydrophobicContact CG2-CG1 4.17Å; V554-I593 HydrophobicContact CB-CD1 4.34Å; V554-I593 HydrophobicContact CG1-CD1 3.94Å; Y589-I593 VanDerWaalsContact O-CG1 3.29Å; Y589-I593 WeakPolarHBondContact O-CG1 3.21Å; Y589-I593 PolarHBondContact O-N 3.34Å; I590-I593 PolarHBondContact O-N 3.1Å; I593-L595 PolarHBondContact O-N 3.39Å; I593-R596 PolarHBondContact O-N 3.34Å; I593-T597 PolarHBondContact O-N 2.77Å; I593-T597 PolarHBondContact O-OG1 2.93Å; I593-T597 VanDerWaalsContact O-OG1 3.11Å
594	S	94.5	Very high	93	Very high	59 Å²	59	47.1 Å²	47.1	41%	0.413	26%	0.257	S	S	.	.	H	α-helix	trans	-64.6	-41.6	-178.2	65.7	0	0	0	0	112.7	I590 A591 R596 T597 V598	I590-S594 PolarHBondContact O-N 3.06Å; I590-S594 PolarHBondContact O-OG 2.95Å; A591-S594 PolarHBondContact O-OG 2.92Å; S594-R596 VanDerWaalsContact C-N 3.34Å; S594-R596 PolarHBondContact O-N 3.33Å; S594-T597 PolarHBondContact O-N 3.01Å; S594-V598 WeakPolarHBondContact O-CB 3.37Å; S594-V598 WeakPolarHBondContact O-CG2 3.2Å; S594-V598 PolarHBondContact O-N 2.81Å
595	L	94	Very high	92.8	Very high	43 Å²	43	51.4 Å²	51.4	23%	0.225	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-37.8	175.2	-73.9	172.1	0	0	0	112.5	A591 I593 V598 A599 P622 V625 L629	A591-L595 WeakPolarHBondContact O-CB 3.35Å; A591-L595 VanDerWaalsContact O-CG 3.3Å; A591-L595 WeakPolarHBondContact O-CG 3.49Å; A591-L595 PolarHBondContact O-N 3.49Å; I593-L595 PolarHBondContact O-N 3.39Å; L595-V598 PolarHBondContact O-N 3.36Å; L595-A599 WeakPolarHBondContact O-CB 3.4Å; L595-A599 PolarHBondContact O-N 3.16Å; L595-P622 HydrophobicContact CD2-CB 4.12Å; L595-V625 HydrophobicContact CD1-CB 4.09Å; L595-V625 HydrophobicContact CD1-CG1 3.72Å; L595-L629 HydrophobicContact CD1-CD1 3.73Å
596	R	91.8	Very high	92.4	Very high	74 Å²	74	60 Å²	60	28%	0.279	30%	0.304	S	S	.	.	H	α-helix	trans	-68.9	-39.3	174.1	-74.7	-175.3	168.9	-152.3	0.9	112.6	E547 T592 I593 S594 V598 A599 W600 S626	E547-R596 IonicContact OE1-CZ 3.87Å; E547-R596 IonicContact OE1-NH1 3.18Å; E547-R596 PolarHBondContact OE1-NH1 3.22Å; E547-R596 IonicContact OE1-NH2 3.65Å; E547-R596 IonicContact OE2-NH1 3.98Å; E547-R596 PolarHBondContact OE2-NH1 2.96Å; T592-R596 WeakPolarHBondContact O-CG 3.3Å; T592-R596 PolarHBondContact O-N 3.22Å; T592-R596 VanDerWaalsContact O-N 3.14Å; I593-R596 PolarHBondContact O-N 3.34Å; S594-R596 VanDerWaalsContact C-N 3.34Å; S594-R596 PolarHBondContact O-N 3.33Å; R596-V598 VanDerWaalsContact C-N 3.3Å; R596-V598 PolarHBondContact O-N 3.11Å; R596-A599 PolarHBondContact O-N 3.05Å; R596-W600 WeakPolarHBondContact O-CB 3.41Å; R596-W600 PolarHBondContact O-N 3.25Å; R596-S626 WeakPolarHBondContact CG-OG 3.25Å; R596-S626 PolarHBondContact NE-OG 3.23Å
597	T	91.4	Very high	91.8	Very high	80 Å²	80	66.4 Å²	66.4	49%	0.491	34%	0.339	S	S	.	.	H	α-helix	trans	-61.7	-39.3	170.9	-57.4	0	0	0	0	111.4	I593 S594 A601	I593-T597 PolarHBondContact O-N 2.77Å; I593-T597 PolarHBondContact O-OG1 2.93Å; I593-T597 VanDerWaalsContact O-OG1 3.11Å; S594-T597 PolarHBondContact O-N 3.01Å; T597-A601 WeakPolarHBondContact O-CB 3.32Å; T597-A601 PolarHBondContact O-N 2.94Å
598	V	92.5	Very high	91.3	Very high	72 Å²	72	66.6 Å²	66.6	44%	0.436	33%	0.332	S	S	.	.	H	α-helix	trans	-67	-41.2	175	167.5	0	0	0	0	112	S594 L595 R596 A601 R602	S594-V598 WeakPolarHBondContact O-CB 3.37Å; S594-V598 WeakPolarHBondContact O-CG2 3.2Å; S594-V598 PolarHBondContact O-N 2.81Å; L595-V598 PolarHBondContact O-N 3.36Å; R596-V598 VanDerWaalsContact C-N 3.3Å; R596-V598 PolarHBondContact O-N 3.11Å; V598-A601 PolarHBondContact O-N 3.05Å; V598-R602 HydrophobicContact CG1-CG 4.44Å; V598-R602 WeakPolarHBondContact O-CB 3.46Å; V598-R602 WeakPolarHBondContact O-CG 3.22Å; V598-R602 PolarHBondContact O-N 3.4Å
599	A	91	Very high	90.7	Very high	4 Å²	4	69 Å²	69	3%	0.033	35%	0.35	C	S	.	.	H	α-helix	trans	-62.5	-47.2	176.4	0	0	0	0	0	111.8	L595 R596 A601 R602 I603 P622 V623	L595-A599 WeakPolarHBondContact O-CB 3.4Å; L595-A599 PolarHBondContact O-N 3.16Å; R596-A599 PolarHBondContact O-N 3.05Å; A599-A601 PolarHBondContact O-N 3.02Å; A599-R602 PolarHBondContact O-N 2.89Å; A599-I603 PolarHBondContact O-N 3.1Å; A599-P622 HydrophobicContact CB-CB 4.4Å; A599-P622 HydrophobicContact CB-CG 4.21Å; A599-V623 HydrophobicContact CB-CG2 3.78Å
600	W	89.7	Confident	90.2	Very high	122 Å²	122	73 Å²	73	46%	0.462	37%	0.365	S	S	.	.	H	α-helix	trans	-59.5	-45.8	172.5	178.3	81	0	0	0	112	R596 R602 I603 V604	R596-W600 WeakPolarHBondContact O-CB 3.41Å; R596-W600 PolarHBondContact O-N 3.25Å; W600-R602 PolarHBondContact O-N 3.48Å; W600-I603 PolarHBondContact O-N 3.29Å; W600-V604 HydrophobicContact CD2-CG2 4.14Å; W600-V604 HydrophobicContact CH2-CG2 4.47Å; W600-V604 HydrophobicContact CZ2-CG2 3.95Å; W600-V604 WeakPolarHBondContact O-CG2 3.48Å; W600-V604 PolarHBondContact O-N 3.07Å
601	A	90.8	Very high	89.6	Confident	23 Å²	23	75.4 Å²	75.4	19%	0.19	37%	0.37	C	S	.	.	H	α-helix	trans	-64.6	-35.4	178.3	0	0	0	0	0	113.1	T597 V598 A599 V604 F605	T597-A601 WeakPolarHBondContact O-CB 3.32Å; T597-A601 PolarHBondContact O-N 2.94Å; V598-A601 PolarHBondContact O-N 3.05Å; A599-A601 PolarHBondContact O-N 3.02Å; A601-V604 PolarHBondContact O-N 3.24Å; A601-F605 HydrophobicContact CB-CD2 3.95Å; A601-F605 HydrophobicContact CB-CE2 4.15Å; A601-F605 WeakPolarHBondContact O-CB 3.46Å; A601-F605 VanDerWaalsContact O-CD2 3.27Å; A601-F605 WeakPolarHBondContact O-CD2 3.3Å; A601-F605 PolarHBondContact O-N 3.4Å
602	R	90	Very high	89	Confident	86 Å²	86	75.9 Å²	75.9	33%	0.325	37%	0.368	S	S	.	.	H	α-helix	trans	-60.1	-45.8	174.2	-80.2	175.9	67.6	172.7	-2.5	111.1	V598 A599 W600 Y606 E608	V598-R602 HydrophobicContact CG1-CG 4.44Å; V598-R602 WeakPolarHBondContact O-CB 3.46Å; V598-R602 WeakPolarHBondContact O-CG 3.22Å; V598-R602 PolarHBondContact O-N 3.4Å; A599-R602 PolarHBondContact O-N 2.89Å; W600-R602 PolarHBondContact O-N 3.48Å; R602-Y606 WeakPolarHBondContact O-CA 3.34Å; R602-Y606 VanDerWaalsContact O-CB 3.3Å; R602-Y606 WeakPolarHBondContact O-CB 3.25Å; R602-Y606 PolarHBondContact O-N 3.29Å; R602-E608 IonicContact CZ-OE1 2.9Å; R602-E608 IonicContact CZ-OE2 2.83Å; R602-E608 IonicContact NE-OE1 2.89Å; R602-E608 PolarHBondContact NE-OE1 3Å; R602-E608 IonicContact NE-OE2 2.66Å; R602-E608 VanDerWaalsContact NH2-CD 3.32Å; R602-E608 IonicContact NH2-OE1 3.05Å; R602-E608 PolarHBondContact NH2-OE1 3.49Å; R602-E608 IonicContact NH2-OE2 3.08Å; R602-E608 PolarHBondContact NH2-OE2 2.99Å
603	I	87.4	Confident	88.5	Confident	23 Å²	23	80 Å²	80	12%	0.118	39%	0.389	C	S	.	.	H	α-helix	trans	-69.2	-38	179	-71	156.6	0	0	0	111.8	R539 G540 A599 W600 N607 E608 R610	R539-I603 HydrophobicContact CB-CD1 3.78Å; R539-I603 WeakPolarHBondContact O-CD1 3.42Å; G540-I603 VanDerWaalsContact N-CD1 3.28Å; A599-I603 PolarHBondContact O-N 3.1Å; W600-I603 PolarHBondContact O-N 3.29Å; I603-N607 PolarHBondContact O-N 3.3Å; I603-E608 HydrophobicContact CG1-CB 4.22Å; I603-R610 HydrophobicContact CD1-CG 4.36Å; I603-R610 HydrophobicContact CG2-CB 3.96Å; I603-R610 HydrophobicContact CG2-CG 4.18Å
604	V	88.2	Confident	88.1	Confident	70 Å²	70	82.3 Å²	82.3	42%	0.424	40%	0.395	S	S	.	.	H	α-helix	trans	-75.5	-37	-179.6	171.6	0	0	0	0	113.7	W600 A601	W600-V604 HydrophobicContact CD2-CG2 4.14Å; W600-V604 HydrophobicContact CH2-CG2 4.47Å; W600-V604 HydrophobicContact CZ2-CG2 3.95Å; W600-V604 WeakPolarHBondContact O-CG2 3.48Å; W600-V604 PolarHBondContact O-N 3.07Å; A601-V604 PolarHBondContact O-N 3.24Å
605	F	89.7	Confident	87.6	Confident	153 Å²	153	83.4 Å²	83.4	67%	0.671	42%	0.415	S	S	*	.	H	α-helix	trans	-101.4	-26.9	-175.1	-65.4	-64.1	0	0	0	114.7	A601	A601-F605 HydrophobicContact CB-CD2 3.95Å; A601-F605 HydrophobicContact CB-CE2 4.15Å; A601-F605 WeakPolarHBondContact O-CB 3.46Å; A601-F605 VanDerWaalsContact O-CD2 3.27Å; A601-F605 WeakPolarHBondContact O-CD2 3.3Å; A601-F605 PolarHBondContact O-N 3.4Å
606	Y	86.9	Confident	87.2	Confident	180 Å²	180	88 Å²	88	71%	0.706	44%	0.435	S	S	*	.	H	α-helix	trans	-110.3	2.8	-177.3	-61	-102.4	0	0	0	113.1	R602 E608	R602-Y606 WeakPolarHBondContact O-CA 3.34Å; R602-Y606 VanDerWaalsContact O-CB 3.3Å; R602-Y606 WeakPolarHBondContact O-CB 3.25Å; R602-Y606 PolarHBondContact O-N 3.29Å; Y606-E608 PolarHBondContact O-N 3.19Å
607	N	82	Confident	87	Confident	142 Å²	142	85.6 Å²	85.6	76%	0.759	43%	0.426	S	S	*	.			trans	52.5	34.8	180	-68.3	-29	0	0	0	114.2	I603	I603-N607 PolarHBondContact O-N 3.3Å
608	E	85.1	Confident	86.9	Confident	45 Å²	45	86.6 Å²	86.6	21%	0.21	43%	0.429	C	S	.	.			trans	-61.9	145.7	174.1	-83.3	-173.5	-134.1	0	0	112	R539 R602 I603 Y606 R610	R539-E608 IonicContact CZ-OE2 3.81Å; R539-E608 VanDerWaalsContact CZ-OE2 3.31Å; R539-E608 IonicContact NH1-OE2 2.71Å; R539-E608 PolarHBondContact NH1-OE2 3.15Å; R539-E608 IonicContact NH2-OE2 2.72Å; R539-E608 PolarHBondContact NH2-OE2 2.9Å; R602-E608 IonicContact CZ-OE1 2.9Å; R602-E608 IonicContact CZ-OE2 2.83Å; R602-E608 IonicContact NE-OE1 2.89Å; R602-E608 PolarHBondContact NE-OE1 3Å; R602-E608 IonicContact NE-OE2 2.66Å; R602-E608 VanDerWaalsContact NH2-CD 3.32Å; R602-E608 IonicContact NH2-OE1 3.05Å; R602-E608 PolarHBondContact NH2-OE1 3.49Å; R602-E608 IonicContact NH2-OE2 3.08Å; R602-E608 PolarHBondContact NH2-OE2 2.99Å; I603-E608 HydrophobicContact CG1-CB 4.22Å; Y606-E608 PolarHBondContact O-N 3.19Å; E608-R610 PolarHBondContact O-N 3.45Å
609	P	85	Confident	86.6	Confident	86 Å²	86	87.8 Å²	87.8	56%	0.558	44%	0.44	S	S	*	.			trans	-57.7	113.5	175.8	19.3	-29	0	0	0	111	R539 I612	R539-P609 PolarHBondContact NH1-O 2.74Å; P609-I612 HydrophobicContact CB-CD1 4.14Å; P609-I612 HydrophobicContact CB-CG1 4.22Å; P609-I612 HydrophobicContact CG-CD1 3.9Å
610	R	83.3	Confident	86.6	Confident	91 Å²	91	95.4 Å²	95.4	34%	0.343	47%	0.473	S	S	.	.	S	Bend	trans	-71.1	-39.4	-175.1	-178.5	172.7	178.1	-170.7	-7.2	113.3	D538 R539 I603 E608	D538-R610 WeakPolarHBondContact CA-O 3.35Å; D538-R610 VanDerWaalsContact CG-NE 3.32Å; D538-R610 WeakPolarHBondContact OD1-CG 3.33Å; D538-R610 IonicContact OD1-CZ 3.81Å; D538-R610 IonicContact OD1-NE 3.77Å; D538-R610 PolarHBondContact OD1-NE 2.96Å; D538-R610 IonicContact OD1-NH2 3.35Å; D538-R610 IonicContact OD2-CZ 2.69Å; D538-R610 IonicContact OD2-NE 2.85Å; D538-R610 PolarHBondContact OD2-NE 2.85Å; D538-R610 IonicContact OD2-NH2 3.2Å; D538-R610 PolarHBondContact OD2-NH2 3.24Å; R539-R610 PolarHBondContact N-O 3.47Å; I603-R610 HydrophobicContact CD1-CG 4.36Å; I603-R610 HydrophobicContact CG2-CB 3.96Å; I603-R610 HydrophobicContact CG2-CG 4.18Å; E608-R610 PolarHBondContact O-N 3.45Å
611	Y	83.7	Confident	86.6	Confident	136 Å²	136	89.7 Å²	89.7	53%	0.533	45%	0.452	S	S	.	.	B	Isolated β-bridge	trans	-108.3	114.3	-176.8	-59.7	-68.2	0	0	0	110.3	H537 D538	H537-Y611 WeakPolarHBondContact O-CA 3.49Å; D538-Y611 HydrophobicContact CB-CD1 4.21Å; D538-Y611 HydrophobicContact CB-CE1 3.95Å
612	I	83.5	Confident	86.6	Confident	41 Å²	41	89.1 Å²	89.1	21%	0.21	45%	0.446	C	S	.	.			trans	-141.8	147.9	179.2	-46.1	-179.6	0	0	0	109.1	H537 P609 R614 Q616 W617	H537-I612 PolarHBondContact ND1-O 2.88Å; H537-I612 PolarHBondContact O-N 2.91Å; P609-I612 HydrophobicContact CB-CD1 4.14Å; P609-I612 HydrophobicContact CB-CG1 4.22Å; P609-I612 HydrophobicContact CG-CD1 3.9Å; I612-R614 PolarHBondContact O-N 3.33Å; I612-Q616 HydrophobicContact CG2-CB 4.04Å; I612-W617 PolarHBondContact O-NE1 3.08Å
613	N	84.4	Confident	86.7	Confident	94 Å²	94	85.3 Å²	85.3	50%	0.503	43%	0.432	S	S	.	.			trans	-58.6	128.5	169.1	-69.5	-46.1	0	0	0	111.1	H537 G615 Q616 W617	H537-N613 PolarHBondContact CE1-OD1 2.73Å; N613-G615 PolarHBondContact O-N 3.47Å; N613-G615 VanDerWaalsContact O-N 3.1Å; N613-Q616 HydrophobicContact CB-CG 4.32Å; N613-Q616 WeakPolarHBondContact O-CA 3.35Å; N613-Q616 WeakPolarHBondContact O-CB 3.45Å; N613-Q616 PolarHBondContact O-N 3.09Å; N613-W617 VanDerWaalsContact O-CD1 3.22Å
614	R	84.6	Confident	86.9	Confident	105 Å²	105	86 Å²	86	40%	0.396	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-61	-23.9	-174	-175.3	167.9	165.2	137.9	-1.4	114.4	I612 Q616 W617 E627	I612-R614 PolarHBondContact O-N 3.33Å; R614-Q616 VanDerWaalsContact C-N 3.25Å; R614-Q616 PolarHBondContact O-N 3.23Å; R614-W617 HydrophobicContact CB-CD2 4.34Å; R614-W617 HydrophobicContact CB-CZ2 4.24Å; R614-W617 HydrophobicContact CG-CD2 4.06Å; R614-W617 HydrophobicContact CG-CE3 4.01Å; R614-W617 HydrophobicContact CG-CH2 4.29Å; R614-W617 HydrophobicContact CG-CZ2 4.32Å; R614-W617 HydrophobicContact CG-CZ3 4.12Å; R614-E627 IonicContact CZ-OE1 2.93Å; R614-E627 IonicContact CZ-OE2 2.79Å; R614-E627 VanDerWaalsContact CZ-OE2 3.26Å; R614-E627 VanDerWaalsContact NH1-CD 3.32Å; R614-E627 IonicContact NH1-OE1 3.14Å; R614-E627 PolarHBondContact NH1-OE1 3.47Å; R614-E627 IonicContact NH1-OE2 3.83Å; R614-E627 PolarHBondContact NH1-OE2 3.27Å; R614-E627 IonicContact NH2-OE2 2.71Å; R614-E627 PolarHBondContact NH2-OE2 3.13Å
615	G	84.3	Confident	87.2	Confident	82 Å²	82	85 Å²	85	85%	0.845	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-76.3	-3.2	171.2	0	0	0	0	0	115.4	N613	N613-G615 PolarHBondContact O-N 3.47Å; N613-G615 VanDerWaalsContact O-N 3.1Å
616	Q	85.7	Confident	87.3	Confident	139 Å²	139	77.8 Å²	77.8	65%	0.65	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-113.2	5.5	175.7	-60.1	178.4	-58.8	0	0	112.3	I612 N613 R614	I612-Q616 HydrophobicContact CG2-CB 4.04Å; N613-Q616 HydrophobicContact CB-CG 4.32Å; N613-Q616 WeakPolarHBondContact O-CA 3.35Å; N613-Q616 WeakPolarHBondContact O-CB 3.45Å; N613-Q616 PolarHBondContact O-N 3.09Å; R614-Q616 VanDerWaalsContact C-N 3.25Å; R614-Q616 PolarHBondContact O-N 3.23Å
617	W	88.2	Confident	87.5	Confident	24 Å²	24	71.9 Å²	71.9	9%	0.091	38%	0.377	C	S	.	.	S	Bend	trans	-73.3	151.6	173.5	-62.9	5.4	0	0	0	110	R539 I612 N613 R614 V623 L624	R539-W617 HydrophobicContact CG-CD2 4.06Å; R539-W617 HydrophobicContact CG-CH2 4.38Å; R539-W617 HydrophobicContact CG-CZ2 3.76Å; I612-W617 PolarHBondContact O-NE1 3.08Å; N613-W617 VanDerWaalsContact O-CD1 3.22Å; R614-W617 HydrophobicContact CB-CD2 4.34Å; R614-W617 HydrophobicContact CB-CZ2 4.24Å; R614-W617 HydrophobicContact CG-CD2 4.06Å; R614-W617 HydrophobicContact CG-CE3 4.01Å; R614-W617 HydrophobicContact CG-CH2 4.29Å; R614-W617 HydrophobicContact CG-CZ2 4.32Å; R614-W617 HydrophobicContact CG-CZ3 4.12Å; W617-V623 HydrophobicContact CH2-CG1 4.28Å; W617-V623 HydrophobicContact CZ3-CB 4.07Å; W617-V623 HydrophobicContact CZ3-CG1 3.85Å; W617-L624 HydrophobicContact CB-CD1 4.41Å; W617-L624 HydrophobicContact CE3-CD1 4.27Å; W617-L624 HydrophobicContact CE3-CD2 3.74Å; W617-L624 HydrophobicContact CE3-CG 3.85Å; W617-L624 HydrophobicContact CZ3-CD2 3.9Å; W617-L624 HydrophobicContact CZ3-CG 4.31Å
618	D	88	Confident	88.1	Confident	100 Å²	100	69.3 Å²	69.3	54%	0.535	37%	0.369	S	S	.	.			trans	-64	146.4	172.3	176.1	39.6	0	0	0	111	F620 D621 L624	D618-F620 PolarHBondContact O-N 2.67Å; D618-F620 VanDerWaalsContact O-N 3.1Å; D618-F620 PolarHBondContact OD2-N 3.42Å; D618-D621 WeakPolarHBondContact O-CB 3.27Å; D618-D621 PolarHBondContact O-N 3.01Å; D618-D621 VanDerWaalsContact O-N 3.08Å; D618-L624 WeakPolarHBondContact O-CD1 3.22Å
619	S	87.6	Confident	88.6	Confident	97 Å²	97	69.5 Å²	69.5	68%	0.678	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-19.4	-179.1	-63.3	0	0	0	0	113.2
620	F	89.7	Confident	89	Confident	164 Å²	164	67.7 Å²	67.7	72%	0.719	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.6	19.1	177.9	-58	-78	0	0	0	113.3	D618	D618-F620 PolarHBondContact O-N 2.67Å; D618-F620 VanDerWaalsContact O-N 3.1Å; D618-F620 PolarHBondContact OD2-N 3.42Å
621	D	90.4	Very high	89.5	Confident	3 Å²	3	65.8 Å²	65.8	2%	0.016	36%	0.358	C	S	.	.			trans	-57	125.9	176.5	-165.8	24	0	0	0	110.4	R539 D618 V623 L624 V625	R539-D621 IonicContact CZ-OD1 2.66Å; R539-D621 IonicContact CZ-OD2 2.73Å; R539-D621 IonicContact NE-OD1 2.86Å; R539-D621 IonicContact NE-OD2 3.83Å; R539-D621 PolarHBondContact NE-OD2 2.77Å; R539-D621 IonicContact NH2-OD1 3.18Å; R539-D621 PolarHBondContact NH2-OD1 3.47Å; R539-D621 IonicContact NH2-OD2 3.76Å; D618-D621 WeakPolarHBondContact O-CB 3.27Å; D618-D621 PolarHBondContact O-N 3.01Å; D618-D621 VanDerWaalsContact O-N 3.08Å; D621-V623 PolarHBondContact O-N 2.94Å; D621-L624 HydrophobicContact CB-CD1 4.42Å; D621-L624 PolarHBondContact O-N 3.45Å; D621-V625 PolarHBondContact O-N 3.24Å
622	P	92	Very high	90	Very high	10 Å²	10	61 Å²	61	7%	0.065	35%	0.348	C	S	.	.	H	α-helix	trans	-53.2	-24.8	-172.6	13.7	-31.9	0	0	0	115.5	L595 A599 S626	L595-P622 HydrophobicContact CD2-CB 4.12Å; A599-P622 HydrophobicContact CB-CB 4.4Å; A599-P622 HydrophobicContact CB-CG 4.21Å; P622-S626 VanDerWaalsContact O-CB 3.28Å; P622-S626 WeakPolarHBondContact O-CB 3.38Å; P622-S626 PolarHBondContact O-N 3.01Å
623	V	91.3	Very high	90.5	Very high	7 Å²	7	59.1 Å²	59.1	4%	0.042	34%	0.338	C	S	.	.	H	α-helix	trans	-62.6	-51.2	172.5	-176.2	0	0	0	0	111.2	R539 A599 W617 D621 V625 S626 E627	R539-V623 WeakPolarHBondContact O-CG2 3.34Å; A599-V623 HydrophobicContact CB-CG2 3.78Å; W617-V623 HydrophobicContact CH2-CG1 4.28Å; W617-V623 HydrophobicContact CZ3-CB 4.07Å; W617-V623 HydrophobicContact CZ3-CG1 3.85Å; D621-V623 PolarHBondContact O-N 2.94Å; V623-V625 PolarHBondContact O-N 3.31Å; V623-S626 WeakPolarHBondContact O-CB 3.37Å; V623-S626 PolarHBondContact O-N 2.83Å; V623-S626 VanDerWaalsContact O-N 3.15Å; V623-S626 PolarHBondContact O-OG 2.76Å; V623-E627 PolarHBondContact O-N 3.35Å
624	L	91.4	Very high	90.9	Very high	36 Å²	36	56.1 Å²	56.1	19%	0.188	32%	0.322	C	S	.	.	H	α-helix	trans	-62.3	-44.8	-179.6	-61.9	176.6	0	0	0	110.9	W617 D618 D621 S626 E627 C628	W617-L624 HydrophobicContact CB-CD1 4.41Å; W617-L624 HydrophobicContact CE3-CD1 4.27Å; W617-L624 HydrophobicContact CE3-CD2 3.74Å; W617-L624 HydrophobicContact CE3-CG 3.85Å; W617-L624 HydrophobicContact CZ3-CD2 3.9Å; W617-L624 HydrophobicContact CZ3-CG 4.31Å; D618-L624 WeakPolarHBondContact O-CD1 3.22Å; D621-L624 HydrophobicContact CB-CD1 4.42Å; D621-L624 PolarHBondContact O-N 3.45Å; L624-S626 VanDerWaalsContact C-N 3.3Å; L624-S626 PolarHBondContact O-N 3.44Å; L624-E627 PolarHBondContact O-N 3.29Å; L624-E627 VanDerWaalsContact O-N 3.17Å; L624-C628 PolarHBondContact O-N 3.18Å; L624-C628 PolarHBondContact O-SG 3.45Å; L624-C628 VanDerWaalsContact O-SG 3.35Å
625	V	94	Very high	91.4	Very high	51 Å²	51	56.6 Å²	56.6	31%	0.309	33%	0.331	S	S	.	.	H	α-helix	trans	-61.3	-40.2	175.8	-173.8	0	0	0	0	110.8	L595 D621 V623 C628 L629	L595-V625 HydrophobicContact CD1-CB 4.09Å; L595-V625 HydrophobicContact CD1-CG1 3.72Å; D621-V625 PolarHBondContact O-N 3.24Å; V623-V625 PolarHBondContact O-N 3.31Å; V625-C628 PolarHBondContact O-N 3.34Å; V625-L629 HydrophobicContact CG1-CD1 4.24Å; V625-L629 WeakPolarHBondContact O-CG 3.37Å; V625-L629 PolarHBondContact O-N 3.08Å
626	S	93.2	Very high	91.9	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.2	-37.4	175.4	83.9	0	0	0	0	112.9	R596 P622 V623 L624 L629 F630	R596-S626 WeakPolarHBondContact CG-OG 3.25Å; R596-S626 PolarHBondContact NE-OG 3.23Å; P622-S626 VanDerWaalsContact O-CB 3.28Å; P622-S626 WeakPolarHBondContact O-CB 3.38Å; P622-S626 PolarHBondContact O-N 3.01Å; V623-S626 WeakPolarHBondContact O-CB 3.37Å; V623-S626 PolarHBondContact O-N 2.83Å; V623-S626 VanDerWaalsContact O-N 3.15Å; V623-S626 PolarHBondContact O-OG 2.76Å; L624-S626 VanDerWaalsContact C-N 3.3Å; L624-S626 PolarHBondContact O-N 3.44Å; S626-L629 PolarHBondContact O-N 2.92Å; S626-F630 VanDerWaalsContact O-CB 3.23Å; S626-F630 WeakPolarHBondContact O-CB 3.42Å; S626-F630 PolarHBondContact O-N 3.04Å
627	E	90.8	Very high	92.2	Very high	56 Å²	56	47.5 Å²	47.5	26%	0.262	27%	0.269	S	S	.	.	H	α-helix	trans	-67	-41.1	176.2	-73.3	-175.2	177.7	0	0	111.6	R614 V623 L624 F630 A631	R614-E627 IonicContact CZ-OE1 2.93Å; R614-E627 IonicContact CZ-OE2 2.79Å; R614-E627 VanDerWaalsContact CZ-OE2 3.26Å; R614-E627 VanDerWaalsContact NH1-CD 3.32Å; R614-E627 IonicContact NH1-OE1 3.14Å; R614-E627 PolarHBondContact NH1-OE1 3.47Å; R614-E627 IonicContact NH1-OE2 3.83Å; R614-E627 PolarHBondContact NH1-OE2 3.27Å; R614-E627 IonicContact NH2-OE2 2.71Å; R614-E627 PolarHBondContact NH2-OE2 3.13Å; V623-E627 PolarHBondContact O-N 3.35Å; L624-E627 PolarHBondContact O-N 3.29Å; L624-E627 VanDerWaalsContact O-N 3.17Å; E627-F630 PolarHBondContact O-N 3.42Å; E627-A631 WeakPolarHBondContact O-CB 3.32Å; E627-A631 PolarHBondContact O-N 3.07Å
628	C	93.8	Very high	92.3	Very high	89 Å²	89	50.1 Å²	50.1	60%	0.601	29%	0.287	S	S	*	.	H	α-helix	trans	-63.3	-44.7	174.9	-66	0	0	0	0	112.1	L624 V625 A631 A632	L624-C628 PolarHBondContact O-N 3.18Å; L624-C628 PolarHBondContact O-SG 3.45Å; L624-C628 VanDerWaalsContact O-SG 3.35Å; V625-C628 PolarHBondContact O-N 3.34Å; C628-A631 PolarHBondContact O-N 2.92Å; C628-A632 PolarHBondContact O-N 3.33Å
629	L	95.2	Very high	92.5	Very high	48 Å²	48	50 Å²	50	25%	0.251	29%	0.286	S	S	.	.	H	α-helix	trans	-68.6	-33.8	176.6	-66.9	176.8	0	0	0	112.4	L588 A591 L595 V625 S626 A632 A633	L588-L629 HydrophobicContact CD2-CD2 3.81Å; A591-L629 HydrophobicContact CB-CD1 4.02Å; L595-L629 HydrophobicContact CD1-CD1 3.73Å; V625-L629 HydrophobicContact CG1-CD1 4.24Å; V625-L629 WeakPolarHBondContact O-CG 3.37Å; V625-L629 PolarHBondContact O-N 3.08Å; S626-L629 PolarHBondContact O-N 2.92Å; L629-A632 PolarHBondContact O-N 2.95Å; L629-A633 WeakPolarHBondContact O-CB 3.5Å; L629-A633 PolarHBondContact O-N 3.31Å
630	F	93.7	Very high	92.6	Very high	48 Å²	48	47 Å²	47	21%	0.211	26%	0.261	C	S	.	.	H	α-helix	trans	-65	-44.1	172.8	-175.7	-120.1	0	0	0	111.7	L517 L550 Y589 T592 S626 E627 A632 A633 N634	L517-F630 HydrophobicContact CD2-CE2 4.03Å; L517-F630 HydrophobicContact CD2-CZ 3.92Å; L550-F630 HydrophobicContact CD1-CZ 4.42Å; Y589-F630 HydrophobicContact CD1-CD2 4.22Å; Y589-F630 HydrophobicContact CD1-CE2 4.42Å; Y589-F630 AromaticContact CE1-CD2 3.9Å; Y589-F630 HydrophobicContact CE1-CD2 3.9Å; Y589-F630 AromaticContact CE1-CE2 3.88Å; Y589-F630 HydrophobicContact CE1-CE2 3.88Å; T592-F630 HydrophobicContact CG2-CB 3.79Å; T592-F630 HydrophobicContact CG2-CD2 4.1Å; T592-F630 HydrophobicContact CG2-CG 4.28Å; T592-F630 PolarHBondContact OG1-N 3.3Å; S626-F630 VanDerWaalsContact O-CB 3.23Å; S626-F630 WeakPolarHBondContact O-CB 3.42Å; S626-F630 PolarHBondContact O-N 3.04Å; E627-F630 PolarHBondContact O-N 3.42Å; F630-A632 PolarHBondContact O-N 3.34Å; F630-A633 PolarHBondContact O-N 2.67Å; F630-N634 WeakPolarHBondContact CD1-ND2 3.47Å; F630-N634 WeakPolarHBondContact CE1-ND2 3.41Å; F630-N634 VanDerWaalsContact CZ-ND2 3.33Å; F630-N634 WeakPolarHBondContact CZ-ND2 3.44Å; F630-N634 WeakPolarHBondContact O-CB 3.5Å; F630-N634 PolarHBondContact O-N 3.41Å; F630-N634 PolarHBondContact O-ND2 3.41Å; F630-N634 PolarHBondContact O-OD1 2.83Å
631	A	93.9	Very high	92.5	Very high	51 Å²	51	41.8 Å²	41.8	42%	0.421	24%	0.24	S	C	.	.	H	α-helix	trans	-59.9	-44.9	174.8	0	0	0	0	0	111.5	E627 C628 N634 I635	E627-A631 WeakPolarHBondContact O-CB 3.32Å; E627-A631 PolarHBondContact O-N 3.07Å; C628-A631 PolarHBondContact O-N 2.92Å; A631-N634 PolarHBondContact O-N 3.46Å; A631-I635 WeakPolarHBondContact O-CG1 3.41Å; A631-I635 PolarHBondContact O-N 3.31Å; A631-I635 VanDerWaalsContact O-N 3.07Å
632	A	94.6	Very high	92.5	Very high	37 Å²	37	43.9 Å²	43.9	31%	0.306	25%	0.253	S	S	.	.	H	α-helix	trans	-61.3	-45.3	174.2	0	0	0	0	0	112.3	L588 C628 L629 F630 N634 I635 V636	L588-A632 HydrophobicContact CD1-CB 4.23Å; C628-A632 PolarHBondContact O-N 3.33Å; L629-A632 PolarHBondContact O-N 2.95Å; F630-A632 PolarHBondContact O-N 3.34Å; A632-N634 VanDerWaalsContact C-N 3.28Å; A632-N634 PolarHBondContact O-N 3.14Å; A632-I635 PolarHBondContact O-N 3.39Å; A632-V636 WeakPolarHBondContact O-CG2 3.48Å; A632-V636 PolarHBondContact O-N 3.29Å
633	A	94.6	Very high	92.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-58.5	-40.9	176.4	0	0	0	0	0	111.8	L588 Y589 L629 F630 V636 S637	L588-A633 HydrophobicContact CB-CB 3.69Å; L588-A633 HydrophobicContact CD1-CB 4.48Å; Y589-A633 HydrophobicContact CD1-CB 3.63Å; Y589-A633 HydrophobicContact CD2-CB 4.19Å; Y589-A633 HydrophobicContact CE1-CB 3.4Å; Y589-A633 HydrophobicContact CE2-CB 4Å; Y589-A633 HydrophobicContact CG-CB 4Å; Y589-A633 PolarHBondContact OH-O 2.98Å; L629-A633 WeakPolarHBondContact O-CB 3.5Å; L629-A633 PolarHBondContact O-N 3.31Å; F630-A633 PolarHBondContact O-N 2.67Å; A633-V636 PolarHBondContact O-N 3.23Å; A633-S637 WeakPolarHBondContact O-CB 3.48Å; A633-S637 PolarHBondContact O-N 3.04Å
634	N	92.8	Very high	91.9	Very high	31 Å²	31	49.3 Å²	49.3	17%	0.166	28%	0.278	C	S	.	.	H	α-helix	trans	-67.1	-39.7	179.4	-66	-19.1	0	0	0	112	L517 Y589 F630 A631 A632 S637 T638	L517-N634 VanDerWaalsContact CD2-OD1 3.31Å; L517-N634 WeakPolarHBondContact CD2-OD1 3.28Å; Y589-N634 WeakPolarHBondContact CE1-OD1 3.27Å; Y589-N634 PolarHBondContact OH-OD1 3.04Å; F630-N634 WeakPolarHBondContact CD1-ND2 3.47Å; F630-N634 WeakPolarHBondContact CE1-ND2 3.41Å; F630-N634 VanDerWaalsContact CZ-ND2 3.33Å; F630-N634 WeakPolarHBondContact CZ-ND2 3.44Å; F630-N634 WeakPolarHBondContact O-CB 3.5Å; F630-N634 PolarHBondContact O-N 3.41Å; F630-N634 PolarHBondContact O-ND2 3.41Å; F630-N634 PolarHBondContact O-OD1 2.83Å; A631-N634 PolarHBondContact O-N 3.46Å; A632-N634 VanDerWaalsContact C-N 3.28Å; A632-N634 PolarHBondContact O-N 3.14Å; N634-S637 WeakPolarHBondContact CA-OG 3.45Å; N634-S637 PolarHBondContact O-N 2.66Å; N634-S637 PolarHBondContact O-OG 3.28Å; N634-T638 PolarHBondContact O-N 3.39Å; N634-T638 PolarHBondContact O-OG1 2.99Å
635	I	94.5	Very high	91.6	Very high	116 Å²	116	52 Å²	52	60%	0.595	29%	0.289	S	S	*	.	H	α-helix	trans	-60.8	-46	172.2	-66.2	164.7	0	0	0	111	A631 A632 S637 T638 L639	A631-I635 WeakPolarHBondContact O-CG1 3.41Å; A631-I635 PolarHBondContact O-N 3.31Å; A631-I635 VanDerWaalsContact O-N 3.07Å; A632-I635 PolarHBondContact O-N 3.39Å; I635-S637 VanDerWaalsContact C-N 3.3Å; I635-S637 PolarHBondContact O-N 3.26Å; I635-T638 PolarHBondContact O-N 2.91Å; I635-T638 PolarHBondContact O-OG1 3.3Å; I635-T638 VanDerWaalsContact O-OG1 3.09Å; I635-L639 WeakPolarHBondContact O-CB 3.41Å; I635-L639 PolarHBondContact O-N 3.18Å; I635-L639 VanDerWaalsContact O-N 3.07Å
636	V	94	Very high	91.2	Very high	30 Å²	30	50 Å²	50	18%	0.182	28%	0.277	C	S	.	.	H	α-helix	trans	-65	-36.3	177.9	-179.3	0	0	0	0	111.3	V581 M585 L588 A632 A633 K640	V581-V636 HydrophobicContact CG1-CG1 3.79Å; M585-V636 HydrophobicContact CB-CG1 3.82Å; M585-V636 HydrophobicContact CG-CG1 4.34Å; L588-V636 HydrophobicContact CD1-CG2 4.27Å; A632-V636 WeakPolarHBondContact O-CG2 3.48Å; A632-V636 PolarHBondContact O-N 3.29Å; A633-V636 PolarHBondContact O-N 3.23Å; V636-K640 PolarHBondContact O-N 3.28Å
637	S	92.5	Very high	90.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-68	-41.9	177.3	81.7	0	0	0	0	113.1	Y510 L517 Y589 A633 N634 I635 K640	Y510-S637 WeakPolarHBondContact OH-CA 3.45Å; Y510-S637 PolarHBondContact OH-O 3.26Å; L517-S637 WeakPolarHBondContact CD1-OG 3.44Å; Y589-S637 PolarHBondContact OH-OG 3.12Å; A633-S637 WeakPolarHBondContact O-CB 3.48Å; A633-S637 PolarHBondContact O-N 3.04Å; N634-S637 WeakPolarHBondContact CA-OG 3.45Å; N634-S637 PolarHBondContact O-N 2.66Å; N634-S637 PolarHBondContact O-OG 3.28Å; I635-S637 VanDerWaalsContact C-N 3.3Å; I635-S637 PolarHBondContact O-N 3.26Å; S637-K640 WeakPolarHBondContact O-CB 3.47Å; S637-K640 PolarHBondContact O-N 3.38Å
638	T	91.5	Very high	90.3	Very high	78 Å²	78	50.5 Å²	50.5	48%	0.479	28%	0.284	S	S	.	.	H	α-helix	trans	-70.1	-37.1	178.1	53.2	0	0	0	0	111.2	L514 N634 I635 K640 L641	L514-T638 HydrophobicContact CD2-CG2 4.38Å; N634-T638 PolarHBondContact O-N 3.39Å; N634-T638 PolarHBondContact O-OG1 2.99Å; I635-T638 PolarHBondContact O-N 2.91Å; I635-T638 PolarHBondContact O-OG1 3.3Å; I635-T638 VanDerWaalsContact O-OG1 3.09Å; T638-K640 PolarHBondContact O-N 3.1Å; T638-L641 WeakPolarHBondContact O-CB 3.46Å; T638-L641 PolarHBondContact O-N 2.82Å; T638-L641 VanDerWaalsContact O-N 3.14Å
639	L	91	Very high	89.9	Confident	99 Å²	99	50.3 Å²	50.3	52%	0.518	28%	0.282	S	S	.	.	H	α-helix	trans	-58.4	-31	173.7	-177.2	61.8	0	0	0	113	I635 L641 V642	I635-L639 WeakPolarHBondContact O-CB 3.41Å; I635-L639 PolarHBondContact O-N 3.18Å; I635-L639 VanDerWaalsContact O-N 3.07Å; L639-L641 PolarHBondContact O-N 2.92Å; L639-L641 VanDerWaalsContact O-N 3.09Å; L639-V642 HydrophobicContact CD1-CG2 4.16Å; L639-V642 WeakPolarHBondContact O-CB 3.44Å; L639-V642 WeakPolarHBondContact O-CG2 3.36Å; L639-V642 PolarHBondContact O-N 2.83Å
640	K	90.2	Very high	89.4	Confident	32 Å²	32	55.5 Å²	55.5	14%	0.139	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-20.3	177.5	-175.7	171.5	171	176.7	0	113.7	Y510 D582 M585 V636 S637 T638 V642 Y643	Y510-K640 HydrophobicContact CE1-CB 4.25Å; Y510-K640 HydrophobicContact CE1-CD 4.21Å; Y510-K640 HydrophobicContact CE1-CG 4.26Å; Y510-K640 HydrophobicContact CE2-CD 4.2Å; D582-K640 VanDerWaalsContact CG-NZ 3.31Å; D582-K640 VanDerWaalsContact OD1-CD 3.27Å; D582-K640 WeakPolarHBondContact OD1-CD 3.44Å; D582-K640 WeakPolarHBondContact OD1-CE 3.35Å; D582-K640 IonicContact OD1-NZ 3.6Å; D582-K640 PolarHBondContact OD1-NZ 3.08Å; D582-K640 IonicContact OD2-NZ 2.75Å; D582-K640 PolarHBondContact OD2-NZ 2.83Å; M585-K640 HydrophobicContact SD-CD 4.46Å; V636-K640 PolarHBondContact O-N 3.28Å; S637-K640 WeakPolarHBondContact O-CB 3.47Å; S637-K640 PolarHBondContact O-N 3.38Å; T638-K640 PolarHBondContact O-N 3.1Å; K640-V642 PolarHBondContact O-N 3.31Å; K640-V642 VanDerWaalsContact O-N 3.16Å; K640-Y643 VanDerWaalsContact O-CB 3.26Å; K640-Y643 WeakPolarHBondContact O-CB 3.5Å; K640-Y643 PolarHBondContact O-N 3.43Å
641	L	87.9	Confident	89.1	Confident	56 Å²	56	56.7 Å²	56.7	29%	0.293	31%	0.313	S	S	.	.	H	α-helix	trans	-57.3	-27.4	172.9	-72.6	175.4	0	0	0	113.2	Y510 L511 L514 T638 L639 Y643 V644	Y510-L641 HydrophobicContact CD1-CD2 4.47Å; L511-L641 HydrophobicContact CD2-CD2 4.04Å; L514-L641 HydrophobicContact CD1-CD1 3.7Å; L514-L641 HydrophobicContact CD1-CD2 3.69Å; L514-L641 HydrophobicContact CD1-CG 3.67Å; T638-L641 WeakPolarHBondContact O-CB 3.46Å; T638-L641 PolarHBondContact O-N 2.82Å; T638-L641 VanDerWaalsContact O-N 3.14Å; L639-L641 PolarHBondContact O-N 2.92Å; L639-L641 VanDerWaalsContact O-N 3.09Å; L641-Y643 PolarHBondContact O-N 2.92Å; L641-V644 WeakPolarHBondContact O-CB 3.5Å; L641-V644 PolarHBondContact O-N 2.94Å
642	V	89.3	Confident	89	Confident	47 Å²	47	54.3 Å²	54.3	29%	0.285	29%	0.293	S	S	.	.	H	α-helix	trans	-58.8	-30.4	175.6	177.8	0	0	0	0	112	W578 L639 K640 V644 F645 Q655	W578-V642 HydrophobicContact CH2-CB 4.11Å; W578-V642 HydrophobicContact CH2-CG1 4.04Å; L639-V642 HydrophobicContact CD1-CG2 4.16Å; L639-V642 WeakPolarHBondContact O-CB 3.44Å; L639-V642 WeakPolarHBondContact O-CG2 3.36Å; L639-V642 PolarHBondContact O-N 2.83Å; K640-V642 PolarHBondContact O-N 3.31Å; K640-V642 VanDerWaalsContact O-N 3.16Å; V642-V644 VanDerWaalsContact C-N 3.29Å; V642-V644 PolarHBondContact O-N 2.89Å; V642-F645 HydrophobicContact CG1-CD2 4.5Å; V642-F645 HydrophobicContact CG2-CE2 4.38Å; V642-F645 WeakPolarHBondContact O-CB 3.44Å; V642-F645 PolarHBondContact O-N 2.88Å; V642-Q655 HydrophobicContact CG1-CG 3.9Å
643	Y	86	Confident	88.8	Confident	73 Å²	73	53.8 Å²	53.8	29%	0.286	29%	0.287	S	S	.	.	H	α-helix	trans	-62.4	-35	174.3	-176.5	-103.8	0	0	0	112.5	W578 K640 L641 F645 T646 L804	W578-Y643 HydrophobicContact CB-CD2 4.12Å; W578-Y643 HydrophobicContact CB-CE2 4.15Å; W578-Y643 AromaticContact CD1-CD2 3.74Å; W578-Y643 AromaticContact CD1-CE2 3.87Å; W578-Y643 AromaticContact CD2-CD2 3.64Å; W578-Y643 HydrophobicContact CD2-CD2 3.64Å; W578-Y643 HydrophobicContact CD2-CE2 4.44Å; W578-Y643 HydrophobicContact CD2-CG 4.4Å; W578-Y643 AromaticContact CE2-CD2 3.87Å; W578-Y643 HydrophobicContact CE3-CD2 4.24Å; W578-Y643 AromaticContact CG-CD2 3.56Å; W578-Y643 HydrophobicContact CG-CD2 3.56Å; W578-Y643 AromaticContact CG-CE2 3.88Å; W578-Y643 HydrophobicContact CG-CE2 3.88Å; W578-Y643 AromaticContact NE1-CD2 3.89Å; K640-Y643 VanDerWaalsContact O-CB 3.26Å; K640-Y643 WeakPolarHBondContact O-CB 3.5Å; K640-Y643 PolarHBondContact O-N 3.43Å; L641-Y643 PolarHBondContact O-N 2.92Å; Y643-F645 VanDerWaalsContact C-N 3.28Å; Y643-F645 PolarHBondContact O-N 3.48Å; Y643-T646 WeakPolarHBondContact O-CB 3.25Å; Y643-T646 VanDerWaalsContact O-CG2 3.28Å; Y643-T646 WeakPolarHBondContact O-CG2 3.42Å; Y643-T646 PolarHBondContact O-N 3.17Å; Y643-T646 PolarHBondContact O-OG1 3.15Å; Y643-L804 HydrophobicContact CE1-CD1 3.9Å; Y643-L804 WeakPolarHBondContact OH-CD1 3.35Å
644	V	84.7	Confident	88.6	Confident	57 Å²	57	58.6 Å²	58.6	35%	0.345	31%	0.312	S	S	.	.	H	α-helix	trans	-69.5	-28.2	-178.8	-172.8	0	0	0	0	111.3	F503 L641 V642 T646 V647	F503-V644 HydrophobicContact CZ-CG1 4.47Å; L641-V644 WeakPolarHBondContact O-CB 3.5Å; L641-V644 PolarHBondContact O-N 2.94Å; V642-V644 VanDerWaalsContact C-N 3.29Å; V642-V644 PolarHBondContact O-N 2.89Å; V644-T646 PolarHBondContact O-N 2.9Å; V644-T646 VanDerWaalsContact O-N 3.14Å; V644-V647 PolarHBondContact O-N 2.85Å
645	F	85.1	Confident	88.5	Confident	94 Å²	94	58.4 Å²	58.4	41%	0.412	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-61.9	-21.2	177.8	-60.8	-20.1	0	0	0	113.6	V642 Y643 V647 S648 L651 G652	V642-F645 HydrophobicContact CG1-CD2 4.5Å; V642-F645 HydrophobicContact CG2-CE2 4.38Å; V642-F645 WeakPolarHBondContact O-CB 3.44Å; V642-F645 PolarHBondContact O-N 2.88Å; Y643-F645 VanDerWaalsContact C-N 3.28Å; Y643-F645 PolarHBondContact O-N 3.48Å; F645-V647 PolarHBondContact O-N 3.37Å; F645-V647 VanDerWaalsContact O-N 3.12Å; F645-S648 WeakPolarHBondContact O-CB 3.31Å; F645-S648 PolarHBondContact O-N 3.13Å; F645-L651 HydrophobicContact CB-CB 3.94Å; F645-L651 HydrophobicContact CB-CD1 4.37Å; F645-L651 HydrophobicContact CD1-CD1 3.98Å; F645-L651 HydrophobicContact CE1-CD1 4.42Å; F645-L651 HydrophobicContact CG-CB 4.43Å; F645-L651 HydrophobicContact CG-CD1 4.06Å; F645-G652 PolarHBondContact O-N 2.85Å
646	T	85.4	Confident	88.3	Confident	9 Å²	9	54.2 Å²	54.2	6%	0.055	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-55.4	-26.6	173.7	59.8	0	0	0	0	113.8	Y643 V644 W797	Y643-T646 WeakPolarHBondContact O-CB 3.25Å; Y643-T646 VanDerWaalsContact O-CG2 3.28Å; Y643-T646 WeakPolarHBondContact O-CG2 3.42Å; Y643-T646 PolarHBondContact O-N 3.17Å; Y643-T646 PolarHBondContact O-OG1 3.15Å; V644-T646 PolarHBondContact O-N 2.9Å; V644-T646 VanDerWaalsContact O-N 3.14Å; T646-W797 PolarHBondContact O-NE1 2.82Å
647	V	84.2	Confident	88.2	Confident	39 Å²	39	53 Å²	53	24%	0.236	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-76	-26.6	178.5	-179.7	0	0	0	0	112.1	F503 V644 F645 L804	F503-V647 HydrophobicContact CE1-CG1 4.45Å; F503-V647 HydrophobicContact CE1-CG2 4.4Å; F503-V647 HydrophobicContact CE2-CG2 3.98Å; F503-V647 HydrophobicContact CZ-CB 4.44Å; F503-V647 HydrophobicContact CZ-CG1 4.46Å; F503-V647 HydrophobicContact CZ-CG2 3.69Å; V644-V647 PolarHBondContact O-N 2.85Å; F645-V647 PolarHBondContact O-N 3.37Å; F645-V647 VanDerWaalsContact O-N 3.12Å; V647-L804 HydrophobicContact CG2-CD2 3.41Å; V647-L804 VanDerWaalsContact CG2-CD2 3.41Å
648	S	82.5	Confident	88.1	Confident	27 Å²	27	57.8 Å²	57.8	19%	0.189	31%	0.306	C	S	.	.	S	Bend	trans	-73.4	133.5	-178.8	174.3	0	0	0	0	111.4	F645 Q650 L651 G652	F645-S648 WeakPolarHBondContact O-CB 3.31Å; F645-S648 PolarHBondContact O-N 3.13Å; S648-Q650 PolarHBondContact O-N 3.47Å; S648-Q650 PolarHBondContact OG-N 3.23Å; S648-L651 PolarHBondContact OG-N 2.92Å; S648-G652 WeakPolarHBondContact O-CA 3.28Å; S648-G652 PolarHBondContact O-N 3.34Å
649	P	83.7	Confident	87.9	Confident	85 Å²	85	56 Å²	56	55%	0.552	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-14.3	173.9	31.3	-36.2	0	0	0	114	W797	P649-W797 VanDerWaalsContact CA-CZ2 3.45Å; P649-W797 HydrophobicContact CB-CH2 3.75Å; P649-W797 HydrophobicContact CB-CZ2 4.09Å
650	Q	84.8	Confident	87.9	Confident	157 Å²	157	55.6 Å²	55.6	73%	0.734	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-40.2	180	-66.8	139.4	-30.9	0	0	111.7	S648	S648-Q650 PolarHBondContact O-N 3.47Å; S648-Q650 PolarHBondContact OG-N 3.23Å
651	L	88.8	Confident	87.9	Confident	73 Å²	73	55.3 Å²	55.3	38%	0.382	30%	0.295	S	S	.	.	H	α-helix	trans	-93.6	-25.8	-175.7	-54.3	176.6	0	0	0	113.3	F645 S648 L654 Q655	F645-L651 HydrophobicContact CB-CB 3.94Å; F645-L651 HydrophobicContact CB-CD1 4.37Å; F645-L651 HydrophobicContact CD1-CD1 3.98Å; F645-L651 HydrophobicContact CE1-CD1 4.42Å; F645-L651 HydrophobicContact CG-CB 4.43Å; F645-L651 HydrophobicContact CG-CD1 4.06Å; S648-L651 PolarHBondContact OG-N 2.92Å; L651-L654 PolarHBondContact O-N 3.31Å; L651-Q655 WeakPolarHBondContact O-CB 3.38Å; L651-Q655 PolarHBondContact O-N 3.04Å
652	G	90.4	Very high	88	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-60.2	-49.3	-179.9	0	0	0	0	0	113.8	F645 S648 L654 Q655 I656	F645-G652 PolarHBondContact O-N 2.85Å; S648-G652 WeakPolarHBondContact O-CA 3.28Å; S648-G652 PolarHBondContact O-N 3.34Å; G652-L654 VanDerWaalsContact C-N 3.34Å; G652-L654 PolarHBondContact O-N 2.84Å; G652-Q655 PolarHBondContact O-N 3.34Å; G652-I656 WeakPolarHBondContact O-CG1 3.33Å; G652-I656 PolarHBondContact O-N 3.45Å; G652-I656 VanDerWaalsContact O-N 3.08Å
653	P	91.7	Very high	87.9	Confident	26 Å²	26	59.2 Å²	59.2	17%	0.169	31%	0.31	C	S	.	.	H	α-helix	trans	-54.1	-45.9	173	-30.9	38.9	0	0	0	113.5	I656 S657 V793 W797	P653-I656 PolarHBondContact O-N 3.32Å; P653-S657 PolarHBondContact O-N 3.03Å; P653-S657 PolarHBondContact O-OG 2.9Å; P653-V793 VanDerWaalsContact CA-CG1 3.45Å; P653-V793 HydrophobicContact CB-CG1 3.57Å; P653-V793 VanDerWaalsContact O-CG1 3.26Å; P653-V793 WeakPolarHBondContact O-CG1 3.49Å; P653-W797 HydrophobicContact CG-CB 4.44Å; P653-W797 HydrophobicContact CG-CD2 3.95Å; P653-W797 HydrophobicContact CG-CE3 3.99Å; P653-W797 HydrophobicContact CG-CG 4.11Å
654	L	90.2	Very high	88.1	Confident	102 Å²	102	57.2 Å²	57.2	53%	0.534	30%	0.304	S	S	.	.	H	α-helix	trans	-65.1	-40.2	179.4	-179.2	63.4	0	0	0	112.6	L651 G652 I656 S657 L658	L651-L654 PolarHBondContact O-N 3.31Å; G652-L654 VanDerWaalsContact C-N 3.34Å; G652-L654 PolarHBondContact O-N 2.84Å; L654-I656 VanDerWaalsContact C-N 3.34Å; L654-S657 PolarHBondContact O-N 3.42Å; L654-S657 PolarHBondContact O-OG 3.42Å; L654-L658 WeakPolarHBondContact O-CB 3.46Å; L654-L658 PolarHBondContact O-N 2.92Å; L654-L658 VanDerWaalsContact O-N 3.09Å
655	Q	90.7	Very high	88.5	Confident	26 Å²	26	57 Å²	57	12%	0.121	30%	0.301	C	S	.	.	H	α-helix	trans	-63.7	-40.8	176.3	-176.4	-75.6	-47.7	0	0	111.3	V642 L651 G652 G659	V642-Q655 HydrophobicContact CG1-CG 3.9Å; L651-Q655 WeakPolarHBondContact O-CB 3.38Å; L651-Q655 PolarHBondContact O-N 3.04Å; G652-Q655 PolarHBondContact O-N 3.34Å; Q655-G659 PolarHBondContact O-N 2.96Å
656	I	90.4	Very high	88.8	Confident	29 Å²	29	59 Å²	59	15%	0.149	31%	0.309	C	S	.	.	H	α-helix	trans	-69.1	-41	178.9	-66	-68.1	0	0	0	111.5	G652 P653 L654 G659 R660 E796 W797 A800	G652-I656 WeakPolarHBondContact O-CG1 3.33Å; G652-I656 PolarHBondContact O-N 3.45Å; G652-I656 VanDerWaalsContact O-N 3.08Å; P653-I656 PolarHBondContact O-N 3.32Å; L654-I656 VanDerWaalsContact C-N 3.34Å; I656-G659 PolarHBondContact O-N 3.33Å; I656-R660 PolarHBondContact O-N 2.82Å; I656-E796 HydrophobicContact CG2-CB 4.19Å; I656-W797 HydrophobicContact CG1-CB 4.3Å; I656-A800 HydrophobicContact CD1-CB 3.93Å
657	S	91.1	Very high	89	Confident	4 Å²	4	65.8 Å²	65.8	3%	0.028	33%	0.334	C	S	.	.	H	α-helix	trans	-65.6	-42.8	177.1	62	0	0	0	0	112.2	P653 L654 G659 R660 M661	P653-S657 PolarHBondContact O-N 3.03Å; P653-S657 PolarHBondContact O-OG 2.9Å; L654-S657 PolarHBondContact O-N 3.42Å; L654-S657 PolarHBondContact O-OG 3.42Å; S657-G659 PolarHBondContact O-N 3.23Å; S657-R660 PolarHBondContact O-N 3.24Å; S657-M661 WeakPolarHBondContact O-CG 3.27Å; S657-M661 PolarHBondContact O-N 3.06Å
658	L	90.2	Very high	89.3	Confident	101 Å²	101	65 Å²	65	53%	0.529	33%	0.327	S	S	.	.	H	α-helix	trans	-58.3	-47.4	172.6	-174.5	155.1	0	0	0	111.4	L654 R660 M661 L662	L654-L658 WeakPolarHBondContact O-CB 3.46Å; L654-L658 PolarHBondContact O-N 2.92Å; L654-L658 VanDerWaalsContact O-N 3.09Å; L658-R660 PolarHBondContact O-N 3.24Å; L658-R660 VanDerWaalsContact O-N 3.13Å; L658-M661 PolarHBondContact O-N 3.47Å; L658-L662 HydrophobicContact CD2-CD1 3.85Å; L658-L662 HydrophobicContact CD2-CG 4.14Å; L658-L662 WeakPolarHBondContact O-CG 3.24Å; L658-L662 PolarHBondContact O-N 3.39Å; L658-L662 VanDerWaalsContact O-N 3.1Å
659	G	88.7	Confident	89.7	Confident	41 Å²	41	68.9 Å²	68.9	42%	0.423	34%	0.341	S	S	.	.	H	α-helix	trans	-58.8	-24.6	178.8	0	0	0	0	0	114.5	Q655 I656 S657	Q655-G659 PolarHBondContact O-N 2.96Å; I656-G659 PolarHBondContact O-N 3.33Å; S657-G659 PolarHBondContact O-N 3.23Å
660	R	89.5	Confident	90.1	Very high	89 Å²	89	68.6 Å²	68.6	34%	0.336	34%	0.34	S	S	.	.	H	α-helix	trans	-86.4	-46.6	173.6	-76.9	-163.6	162.8	-179.9	10.1	113.8	I656 S657 L658 L662 H663 I789 E796	I656-R660 PolarHBondContact O-N 2.82Å; S657-R660 PolarHBondContact O-N 3.24Å; L658-R660 PolarHBondContact O-N 3.24Å; L658-R660 VanDerWaalsContact O-N 3.13Å; R660-L662 PolarHBondContact O-N 2.96Å; R660-H663 WeakPolarHBondContact O-CB 3.42Å; R660-H663 PolarHBondContact O-N 3.15Å; R660-I789 HydrophobicContact CB-CD1 3.55Å; R660-I789 HydrophobicContact CB-CG1 4.21Å; R660-E796 IonicContact CZ-OE1 3.71Å; R660-E796 IonicContact CZ-OE2 3.38Å; R660-E796 IonicContact NE-OE2 3.58Å; R660-E796 PolarHBondContact NE-OE2 2.94Å; R660-E796 IonicContact NH1-OE1 3.4Å; R660-E796 PolarHBondContact NH1-OE1 3.18Å; R660-E796 IonicContact NH1-OE2 2.68Å; R660-E796 PolarHBondContact NH1-OE2 3.09Å; R660-E796 IonicContact NH2-OE1 2.8Å; R660-E796 PolarHBondContact NH2-OE1 3.16Å; R660-E796 IonicContact NH2-OE2 3.66Å; R660-E796 PolarHBondContact NH2-OE2 3.41Å
661	M	91.6	Very high	90.5	Very high	27 Å²	27	64.6 Å²	64.6	13%	0.133	33%	0.326	C	S	.	.	H	α-helix	trans	-58.1	-30.9	178.5	-68.8	-176	-67.7	0	0	111.9	S657 L658 H663 D664 I665 Y786 I789	S657-M661 WeakPolarHBondContact O-CG 3.27Å; S657-M661 PolarHBondContact O-N 3.06Å; L658-M661 PolarHBondContact O-N 3.47Å; M661-H663 PolarHBondContact O-N 3.22Å; M661-D664 PolarHBondContact O-N 2.81Å; M661-D664 VanDerWaalsContact O-N 3.13Å; M661-I665 HydrophobicContact CB-CD1 4.43Å; M661-I665 VanDerWaalsContact O-CG1 3.31Å; M661-I665 WeakPolarHBondContact O-CG1 3.27Å; M661-I665 PolarHBondContact O-N 3.43Å; M661-Y786 HydrophobicContact CE-CD2 4.05Å; M661-Y786 HydrophobicContact SD-CD2 3.91Å; M661-Y786 HydrophobicContact SD-CG 4.39Å; M661-I789 HydrophobicContact CG-CD1 3.83Å
662	L	90.1	Very high	90.7	Very high	73 Å²	73	62.9 Å²	62.9	38%	0.382	32%	0.315	S	S	.	.	H	α-helix	trans	-51.7	-36	172.8	-78.5	175.8	0	0	0	113.9	L658 R660 I665 F666	L658-L662 HydrophobicContact CD2-CD1 3.85Å; L658-L662 HydrophobicContact CD2-CG 4.14Å; L658-L662 WeakPolarHBondContact O-CG 3.24Å; L658-L662 PolarHBondContact O-N 3.39Å; L658-L662 VanDerWaalsContact O-N 3.1Å; R660-L662 PolarHBondContact O-N 2.96Å; L662-I665 PolarHBondContact O-N 2.86Å; L662-F666 HydrophobicContact CB-CE2 4.44Å; L662-F666 WeakPolarHBondContact O-CD2 3.47Å; L662-F666 PolarHBondContact O-N 3.16Å
663	H	86.7	Confident	90.7	Very high	112 Å²	112	68 Å²	68	52%	0.519	34%	0.337	S	S	.	.	H	α-helix	trans	-67.8	-37.4	-179.5	-177.3	-99.3	0	0	0	112.5	R660 M661 F666 R667	R660-H663 WeakPolarHBondContact O-CB 3.42Å; R660-H663 PolarHBondContact O-N 3.15Å; M661-H663 PolarHBondContact O-N 3.22Å; H663-F666 PolarHBondContact O-N 2.64Å; H663-R667 VanDerWaalsContact CE1-CZ 3.42Å; H663-R667 PolarHBondContact CE1-NE 2.88Å; H663-R667 WeakPolarHBondContact O-CG 3.42Å; H663-R667 PolarHBondContact O-N 3.49Å
664	D	90.5	Very high	90.8	Very high	30 Å²	30	72.6 Å²	72.6	16%	0.16	36%	0.36	C	S	.	.	H	α-helix	trans	-76.4	-34.5	175	-63.5	-29.1	0	0	0	111.5	M661 F666 R667 F668 M781 S785	M661-D664 PolarHBondContact O-N 2.81Å; M661-D664 VanDerWaalsContact O-N 3.13Å; D664-F666 VanDerWaalsContact C-N 3.32Å; D664-F666 PolarHBondContact O-N 2.78Å; D664-R667 WeakPolarHBondContact O-CB 3.36Å; D664-R667 PolarHBondContact O-N 2.87Å; D664-R667 IonicContact OD1-CZ 3.57Å; D664-R667 IonicContact OD1-NH1 2.8Å; D664-R667 PolarHBondContact OD1-NH1 3.04Å; D664-F668 WeakPolarHBondContact O-CB 3.43Å; D664-F668 PolarHBondContact O-N 3.24Å; D664-M781 HydrophobicContact CB-SD 4.47Å; D664-S785 PolarHBondContact OD2-OG 3.19Å
665	I	92.3	Very high	91	Very high	53 Å²	53	69.1 Å²	69.1	27%	0.272	34%	0.343	S	S	.	.	H	α-helix	trans	-60.6	-40.6	170.2	-65	164.6	0	0	0	110.8	M661 L662 F668 F669 L778 M782	M661-I665 HydrophobicContact CB-CD1 4.43Å; M661-I665 VanDerWaalsContact O-CG1 3.31Å; M661-I665 WeakPolarHBondContact O-CG1 3.27Å; M661-I665 PolarHBondContact O-N 3.43Å; L662-I665 PolarHBondContact O-N 2.86Å; I665-F668 PolarHBondContact O-N 3.14Å; I665-F669 WeakPolarHBondContact O-CB 3.43Å; I665-F669 PolarHBondContact O-N 2.94Å; I665-L778 HydrophobicContact CG1-CD1 4.32Å; I665-M782 HydrophobicContact CD1-CE 4.18Å; I665-M782 HydrophobicContact CD1-SD 4.01Å; I665-M782 HydrophobicContact CG1-CG 4.29Å; I665-M782 HydrophobicContact CG1-SD 4.14Å
666	F	90.8	Very high	91.1	Very high	135 Å²	135	68.3 Å²	68.3	59%	0.592	34%	0.34	S	S	*	.	H	α-helix	trans	-64.6	-42.9	174.5	-79.6	-59.5	0	0	0	112.6	L662 H663 D664 F668 F669 C670	L662-F666 HydrophobicContact CB-CE2 4.44Å; L662-F666 WeakPolarHBondContact O-CD2 3.47Å; L662-F666 PolarHBondContact O-N 3.16Å; H663-F666 PolarHBondContact O-N 2.64Å; D664-F666 VanDerWaalsContact C-N 3.32Å; D664-F666 PolarHBondContact O-N 2.78Å; F666-F668 VanDerWaalsContact C-N 3.28Å; F666-F668 PolarHBondContact O-N 3.21Å; F666-F669 PolarHBondContact O-N 3.07Å; F666-C670 PolarHBondContact O-N 3.09Å; F666-C670 PolarHBondContact O-SG 2.63Å
667	R	90.1	Very high	91.3	Very high	153 Å²	153	68.9 Å²	68.9	58%	0.577	34%	0.344	S	S	*	.	H	α-helix	trans	-57.3	-43	173.1	-72	160.2	154.9	176.4	-10.1	111.4	H663 D664	H663-R667 VanDerWaalsContact CE1-CZ 3.42Å; H663-R667 PolarHBondContact CE1-NE 2.88Å; H663-R667 WeakPolarHBondContact O-CG 3.42Å; H663-R667 PolarHBondContact O-N 3.49Å; D664-R667 WeakPolarHBondContact O-CB 3.36Å; D664-R667 PolarHBondContact O-N 2.87Å; D664-R667 IonicContact OD1-CZ 3.57Å; D664-R667 IonicContact OD1-NH1 2.8Å; D664-R667 PolarHBondContact OD1-NH1 3.04Å
668	F	91.1	Very high	91.4	Very high	21 Å²	21	71.6 Å²	71.6	9%	0.092	37%	0.367	C	S	.	.	H	α-helix	trans	-69.1	-39.7	177.5	-167	-88.5	0	0	0	112.7	D664 I665 F666 C670 V671 Y672 L774 M777 L778 M781	D664-F668 WeakPolarHBondContact O-CB 3.43Å; D664-F668 PolarHBondContact O-N 3.24Å; I665-F668 PolarHBondContact O-N 3.14Å; F666-F668 VanDerWaalsContact C-N 3.28Å; F666-F668 PolarHBondContact O-N 3.21Å; F668-C670 PolarHBondContact O-N 3.33Å; F668-V671 WeakPolarHBondContact O-CB 3.4Å; F668-V671 PolarHBondContact O-N 2.89Å; F668-Y672 PolarHBondContact O-N 2.97Å; F668-Y672 VanDerWaalsContact O-N 3.1Å; F668-L774 HydrophobicContact CE1-CB 4.07Å; F668-L774 HydrophobicContact CE1-CD2 4.42Å; F668-L774 HydrophobicContact CE2-CD2 4.39Å; F668-L774 HydrophobicContact CZ-CB 3.77Å; F668-L774 HydrophobicContact CZ-CD2 3.71Å; F668-L774 HydrophobicContact CZ-CG 4.29Å; F668-L774 WeakPolarHBondContact CZ-O 3.47Å; F668-M777 HydrophobicContact CE2-CB 3.98Å; F668-M777 HydrophobicContact CZ-CB 4.27Å; F668-L778 HydrophobicContact CB-CD1 4.1Å; F668-L778 HydrophobicContact CD1-CB 4.06Å; F668-L778 HydrophobicContact CD1-CD1 3.88Å; F668-L778 HydrophobicContact CD1-CD2 4.26Å; F668-L778 HydrophobicContact CD1-CG 4.28Å; F668-L778 HydrophobicContact CD2-CD1 4.49Å; F668-L778 HydrophobicContact CE1-CB 3.82Å; F668-L778 HydrophobicContact CE1-CD2 4.43Å; F668-L778 HydrophobicContact CE1-CG 4.48Å; F668-L778 HydrophobicContact CE2-CB 4.35Å; F668-L778 HydrophobicContact CG-CB 4.43Å; F668-L778 HydrophobicContact CG-CD1 3.88Å; F668-L778 HydrophobicContact CZ-CB 3.99Å; F668-M781 HydrophobicContact CD2-CE 4.02Å; F668-M781 HydrophobicContact CD2-SD 4.3Å
669	F	90.5	Very high	91.7	Very high	110 Å²	110	68.5 Å²	68.5	48%	0.482	35%	0.349	S	S	.	.	H	α-helix	trans	-59.3	-34.1	178.1	-177.7	-97.8	0	0	0	112.3	I665 F666 V671 Y672 F673	I665-F669 WeakPolarHBondContact O-CB 3.43Å; I665-F669 PolarHBondContact O-N 2.94Å; F666-F669 PolarHBondContact O-N 3.07Å; F669-V671 VanDerWaalsContact C-N 3.3Å; F669-V671 PolarHBondContact O-N 2.85Å; F669-Y672 HydrophobicContact CD2-CD1 4.26Å; F669-Y672 HydrophobicContact CE2-CD1 4.18Å; F669-Y672 PolarHBondContact O-N 3.21Å; F669-F673 WeakPolarHBondContact O-CB 3.46Å; F669-F673 PolarHBondContact O-N 3.14Å
670	C	92.6	Very high	91.9	Very high	79 Å²	79	66.5 Å²	66.5	53%	0.534	33%	0.329	S	S	.	.	H	α-helix	trans	-59.4	-38.1	171.9	-65.6	0	0	0	0	112.8	F666 F668 L674	F666-C670 PolarHBondContact O-N 3.09Å; F666-C670 PolarHBondContact O-SG 2.63Å; F668-C670 PolarHBondContact O-N 3.33Å; C670-L674 WeakPolarHBondContact O-CG 3.2Å; C670-L674 PolarHBondContact O-N 3.4Å; C670-L674 VanDerWaalsContact O-N 3.13Å
671	V	92.6	Very high	92.2	Very high	72 Å²	72	67.8 Å²	67.8	44%	0.436	34%	0.337	S	S	.	.	H	α-helix	trans	-70.4	-44.1	176.9	-176.1	0	0	0	0	110.7	F668 F669 F673 L674 V675 L774	F668-V671 WeakPolarHBondContact O-CB 3.4Å; F668-V671 PolarHBondContact O-N 2.89Å; F669-V671 VanDerWaalsContact C-N 3.3Å; F669-V671 PolarHBondContact O-N 2.85Å; V671-F673 VanDerWaalsContact C-N 3.34Å; V671-F673 PolarHBondContact O-N 2.78Å; V671-L674 PolarHBondContact O-N 3.16Å; V671-V675 PolarHBondContact O-N 2.84Å; V671-V675 VanDerWaalsContact O-N 3.17Å; V671-L774 HydrophobicContact CG1-CD2 4.34Å
672	Y	92.3	Very high	92.3	Very high	37 Å²	37	68.2 Å²	68.2	15%	0.145	35%	0.349	C	S	.	.	H	α-helix	trans	-59.8	-43.2	174.2	174.5	-104.4	0	0	0	112.2	F668 F669 L674 V675 L676 Y766 A770 L774	F668-Y672 PolarHBondContact O-N 2.97Å; F668-Y672 VanDerWaalsContact O-N 3.1Å; F669-Y672 HydrophobicContact CD2-CD1 4.26Å; F669-Y672 HydrophobicContact CE2-CD1 4.18Å; F669-Y672 PolarHBondContact O-N 3.21Å; Y672-L674 PolarHBondContact O-N 3.03Å; Y672-V675 PolarHBondContact O-N 3.44Å; Y672-L676 HydrophobicContact CE1-CD1 3.8Å; Y672-L676 WeakPolarHBondContact O-CB 3.46Å; Y672-L676 PolarHBondContact O-N 3.33Å; Y672-Y766 PolarHBondContact OH-OH 3Å; Y672-A770 HydrophobicContact CE2-CB 4.19Å; Y672-L774 HydrophobicContact CD2-CD1 4.02Å
673	F	92	Very high	92.5	Very high	108 Å²	108	64.8 Å²	64.8	47%	0.474	33%	0.33	S	S	.	.	H	α-helix	trans	-62.5	-40.7	177.9	-177.6	-100.6	0	0	0	112.4	F669 V671 V675 L676 V677	F669-F673 WeakPolarHBondContact O-CB 3.46Å; F669-F673 PolarHBondContact O-N 3.14Å; V671-F673 VanDerWaalsContact C-N 3.34Å; V671-F673 PolarHBondContact O-N 2.78Å; F673-V675 VanDerWaalsContact C-N 3.35Å; F673-V675 PolarHBondContact O-N 3.2Å; F673-L676 PolarHBondContact O-N 3.36Å; F673-V677 HydrophobicContact CD1-CG2 4.18Å; F673-V677 HydrophobicContact CD2-CG2 4.44Å; F673-V677 HydrophobicContact CE1-CG2 3.77Å; F673-V677 HydrophobicContact CE2-CG2 4.04Å; F673-V677 HydrophobicContact CZ-CG2 3.69Å; F673-V677 WeakPolarHBondContact O-CB 3.45Å; F673-V677 WeakPolarHBondContact O-CG2 3.41Å; F673-V677 PolarHBondContact O-N 3.4Å
674	L	93.2	Very high	92.8	Very high	122 Å²	122	61.5 Å²	61.5	64%	0.639	32%	0.317	S	S	*	.	H	α-helix	trans	-60.8	-42.2	173.8	-74.1	169.2	0	0	0	112.1	C670 V671 Y672 A678	C670-L674 WeakPolarHBondContact O-CG 3.2Å; C670-L674 PolarHBondContact O-N 3.4Å; C670-L674 VanDerWaalsContact O-N 3.13Å; V671-L674 PolarHBondContact O-N 3.16Å; Y672-L674 PolarHBondContact O-N 3.03Å; L674-A678 WeakPolarHBondContact O-CB 3.5Å; L674-A678 PolarHBondContact O-N 2.72Å
675	V	94.1	Very high	92.8	Very high	30 Å²	30	67.7 Å²	67.7	18%	0.182	35%	0.345	C	S	.	.	H	α-helix	trans	-64.8	-46.2	175.4	173	0	0	0	0	111	V671 Y672 F673 V677 A678 F679 I769 L774	V671-V675 PolarHBondContact O-N 2.84Å; V671-V675 VanDerWaalsContact O-N 3.17Å; Y672-V675 PolarHBondContact O-N 3.44Å; F673-V675 VanDerWaalsContact C-N 3.35Å; F673-V675 PolarHBondContact O-N 3.2Å; V675-V677 PolarHBondContact O-N 3.41Å; V675-A678 PolarHBondContact O-N 2.93Å; V675-F679 HydrophobicContact CG1-CD2 3.82Å; V675-F679 HydrophobicContact CG1-CE2 4.02Å; V675-F679 WeakPolarHBondContact O-CD2 3.25Å; V675-F679 PolarHBondContact O-N 2.95Å; V675-I769 HydrophobicContact CG1-CG2 3.98Å; V675-L774 HydrophobicContact CB-CD1 4.43Å; V675-L774 HydrophobicContact CG2-CD1 4.23Å
676	L	93.8	Very high	92.8	Very high	9 Å²	9	67.4 Å²	67.4	5%	0.047	34%	0.344	C	S	.	.	H	α-helix	trans	-58.8	-47.2	178.6	-166.2	163.1	0	0	0	111.1	Y672 F673 F679 A680 V730 L733	Y672-L676 HydrophobicContact CE1-CD1 3.8Å; Y672-L676 WeakPolarHBondContact O-CB 3.46Å; Y672-L676 PolarHBondContact O-N 3.33Å; F673-L676 PolarHBondContact O-N 3.36Å; L676-F679 PolarHBondContact O-N 3.41Å; L676-A680 VanDerWaalsContact O-CB 3.27Å; L676-A680 WeakPolarHBondContact O-CB 3.49Å; L676-A680 PolarHBondContact O-N 2.84Å; L676-V730 HydrophobicContact CD2-CB 4.05Å; L676-V730 HydrophobicContact CD2-CG1 3.86Å; L676-V730 HydrophobicContact CD2-CG2 3.83Å; L676-L733 HydrophobicContact CD2-CB 4.35Å; L676-L733 HydrophobicContact CG-CB 4.13Å
677	V	92.6	Very high	92.8	Very high	40 Å²	40	61.3 Å²	61.3	24%	0.242	32%	0.317	C	S	.	.	H	α-helix	trans	-64.1	-42.2	177.4	169.5	0	0	0	0	112.1	F673 V675 A680 F681	F673-V677 HydrophobicContact CD1-CG2 4.18Å; F673-V677 HydrophobicContact CD2-CG2 4.44Å; F673-V677 HydrophobicContact CE1-CG2 3.77Å; F673-V677 HydrophobicContact CE2-CG2 4.04Å; F673-V677 HydrophobicContact CZ-CG2 3.69Å; F673-V677 WeakPolarHBondContact O-CB 3.45Å; F673-V677 WeakPolarHBondContact O-CG2 3.41Å; F673-V677 PolarHBondContact O-N 3.4Å; V675-V677 PolarHBondContact O-N 3.41Å; V677-A680 PolarHBondContact O-N 3.07Å; V677-F681 HydrophobicContact CG1-CD2 3.89Å; V677-F681 HydrophobicContact CG1-CE2 3.38Å; V677-F681 HydrophobicContact CG1-CZ 4.13Å; V677-F681 VanDerWaalsContact O-CD2 3.25Å; V677-F681 WeakPolarHBondContact O-CD2 3.49Å; V677-F681 PolarHBondContact O-N 3.24Å; V677-F681 VanDerWaalsContact O-N 3.07Å
678	A	94.9	Very high	92.8	Very high	62 Å²	62	61.2 Å²	61.2	51%	0.512	32%	0.317	S	S	.	.	H	α-helix	trans	-62	-46.2	178.1	0	0	0	0	0	112.1	L674 V675 F681 G682	L674-A678 WeakPolarHBondContact O-CB 3.5Å; L674-A678 PolarHBondContact O-N 2.72Å; V675-A678 PolarHBondContact O-N 2.93Å; A678-F681 PolarHBondContact O-N 3.3Å; A678-G682 PolarHBondContact O-N 3.41Å
679	F	94.8	Very high	92.6	Very high	35 Å²	35	66.2 Å²	66.2	15%	0.154	34%	0.338	C	S	.	.	H	α-helix	trans	-67.6	-35.3	174.3	-84.4	-82.3	0	0	0	112.2	V675 L676 F681 G682 F683 L733 T762 Y766 I769	V675-F679 HydrophobicContact CG1-CD2 3.82Å; V675-F679 HydrophobicContact CG1-CE2 4.02Å; V675-F679 WeakPolarHBondContact O-CD2 3.25Å; V675-F679 PolarHBondContact O-N 2.95Å; L676-F679 PolarHBondContact O-N 3.41Å; F679-F681 VanDerWaalsContact C-N 3.34Å; F679-F681 PolarHBondContact O-N 3.4Å; F679-G682 PolarHBondContact O-N 2.9Å; F679-G682 VanDerWaalsContact O-N 3.1Å; F679-F683 HydrophobicContact CB-CD2 4.46Å; F679-F683 HydrophobicContact CB-CE2 4.47Å; F679-F683 HydrophobicContact CD1-CE2 4.35Å; F679-F683 VanDerWaalsContact O-CD2 3.22Å; F679-F683 WeakPolarHBondContact O-CD2 3.3Å; F679-F683 PolarHBondContact O-N 3.49Å; F679-L733 HydrophobicContact CB-CD1 4.01Å; F679-T762 HydrophobicContact CD1-CG2 3.81Å; F679-T762 HydrophobicContact CE1-CG2 3.95Å; F679-Y766 HydrophobicContact CB-CD2 3.89Å; F679-Y766 HydrophobicContact CD1-CD2 4.43Å; F679-Y766 AromaticContact CD2-CD2 3.73Å; F679-Y766 HydrophobicContact CD2-CD2 3.73Å; F679-Y766 HydrophobicContact CE2-CD2 4.37Å; F679-Y766 AromaticContact CG-CD2 3.76Å; F679-Y766 HydrophobicContact CG-CD2 3.76Å; F679-Y766 HydrophobicContact CG-CG 4.28Å; F679-I769 HydrophobicContact CE2-CD1 3.96Å; F679-I769 HydrophobicContact CZ-CD1 3.96Å
680	A	94.6	Very high	92.5	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-61	-40.5	177.3	0	0	0	0	0	112.6	L676 V677 N684 L726 I729 V730 L733	L676-A680 VanDerWaalsContact O-CB 3.27Å; L676-A680 WeakPolarHBondContact O-CB 3.49Å; L676-A680 PolarHBondContact O-N 2.84Å; V677-A680 PolarHBondContact O-N 3.07Å; A680-N684 VanDerWaalsContact O-CB 3.3Å; A680-N684 WeakPolarHBondContact O-CB 3.5Å; A680-N684 PolarHBondContact O-N 2.97Å; A680-L726 HydrophobicContact CB-CD1 3.97Å; A680-I729 HydrophobicContact CB-CG2 3.78Å; A680-V730 HydrophobicContact CB-CG2 3.8Å; A680-L733 HydrophobicContact CB-CD1 3.99Å
681	F	94.6	Very high	92.1	Very high	116 Å²	116	59.4 Å²	59.4	51%	0.509	30%	0.3	S	S	.	.	H	α-helix	trans	-65.4	-40	172.1	-69	-52.4	0	0	0	112.6	V677 A678 F679 N684 Q685 L726	V677-F681 HydrophobicContact CG1-CD2 3.89Å; V677-F681 HydrophobicContact CG1-CE2 3.38Å; V677-F681 HydrophobicContact CG1-CZ 4.13Å; V677-F681 VanDerWaalsContact O-CD2 3.25Å; V677-F681 WeakPolarHBondContact O-CD2 3.49Å; V677-F681 PolarHBondContact O-N 3.24Å; V677-F681 VanDerWaalsContact O-N 3.07Å; A678-F681 PolarHBondContact O-N 3.3Å; F679-F681 VanDerWaalsContact C-N 3.34Å; F679-F681 PolarHBondContact O-N 3.4Å; F681-N684 PolarHBondContact O-N 3.22Å; F681-Q685 WeakPolarHBondContact O-CB 3.48Å; F681-Q685 PolarHBondContact O-N 3.3Å; F681-L726 HydrophobicContact CD1-CD1 3.78Å; F681-L726 HydrophobicContact CD1-CD2 4.31Å; F681-L726 HydrophobicContact CE1-CD1 3.96Å; F681-L726 HydrophobicContact CE1-CD2 3.67Å; F681-L726 HydrophobicContact CE1-CG 4.5Å; F681-L726 HydrophobicContact CZ-CD2 4.44Å
682	G	94.3	Very high	91.7	Very high	36 Å²	36	62.5 Å²	62.5	37%	0.371	31%	0.308	S	S	.	.	H	α-helix	trans	-59.8	-47.5	175.2	0	0	0	0	0	112.9	A678 F679 Q685 L686	A678-G682 PolarHBondContact O-N 3.41Å; F679-G682 PolarHBondContact O-N 2.9Å; F679-G682 VanDerWaalsContact O-N 3.1Å; G682-Q685 PolarHBondContact O-N 3.44Å; G682-L686 WeakPolarHBondContact O-CB 3.31Å; G682-L686 PolarHBondContact O-N 3.44Å
683	F	93.6	Very high	91.3	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-65	-39.7	174.9	-80.1	-69.1	0	0	0	112.8	F679 Q685 L686 Y687 F723 I729 L733 L746 T762 F763	F679-F683 HydrophobicContact CB-CD2 4.46Å; F679-F683 HydrophobicContact CB-CE2 4.47Å; F679-F683 HydrophobicContact CD1-CE2 4.35Å; F679-F683 VanDerWaalsContact O-CD2 3.22Å; F679-F683 WeakPolarHBondContact O-CD2 3.3Å; F679-F683 PolarHBondContact O-N 3.49Å; F683-Q685 VanDerWaalsContact C-N 3.34Å; F683-Q685 PolarHBondContact O-N 3.39Å; F683-L686 PolarHBondContact O-N 2.93Å; F683-Y687 AromaticContact CD1-CD2 3.92Å; F683-Y687 HydrophobicContact CD1-CD2 3.92Å; F683-Y687 AromaticContact CD1-CE2 3.83Å; F683-Y687 HydrophobicContact CD1-CE2 3.83Å; F683-Y687 HydrophobicContact CE1-CE2 4.2Å; F683-Y687 PolarHBondContact O-N 3.1Å; F683-F723 HydrophobicContact CB-CD1 4.02Å; F683-F723 HydrophobicContact CB-CE1 4.43Å; F683-F723 AromaticContact CD1-CD1 3.9Å; F683-F723 HydrophobicContact CD1-CD1 3.9Å; F683-F723 AromaticContact CD1-CE1 3.87Å; F683-F723 HydrophobicContact CD1-CE1 3.87Å; F683-F723 HydrophobicContact CD2-CE1 4.14Å; F683-F723 HydrophobicContact CE1-CE1 4.13Å; F683-F723 HydrophobicContact CE2-CE1 4.39Å; F683-F723 AromaticContact CG-CD1 3.92Å; F683-F723 HydrophobicContact CG-CD1 3.92Å; F683-F723 AromaticContact CG-CE1 3.88Å; F683-F723 HydrophobicContact CG-CE1 3.88Å; F683-F723 HydrophobicContact CZ-CE1 4.37Å; F683-I729 HydrophobicContact CB-CG2 3.78Å; F683-L733 HydrophobicContact CD2-CD1 4.17Å; F683-L733 HydrophobicContact CD2-CD2 3.93Å; F683-L733 HydrophobicContact CD2-CG 4.48Å; F683-L733 HydrophobicContact CE2-CD2 3.66Å; F683-L746 HydrophobicContact CE1-CD2 4.15Å; F683-T762 HydrophobicContact CD2-CG2 4.46Å; F683-T762 HydrophobicContact CE1-CG2 4.18Å; F683-T762 HydrophobicContact CE2-CG2 3.89Å; F683-T762 HydrophobicContact CZ-CG2 3.74Å; F683-F763 HydrophobicContact CE1-CB 4.41Å; F683-F763 HydrophobicContact CZ-CB 3.86Å; F683-F763 HydrophobicContact CZ-CD2 4.25Å
684	N	92.8	Very high	90.8	Very high	44 Å²	44	58.1 Å²	58.1	24%	0.235	29%	0.29	C	S	.	.	H	α-helix	trans	-59.7	-46.7	176.1	-173.5	90.4	0	0	0	110.6	A680 F681 L686 W688 L726 I729	A680-N684 VanDerWaalsContact O-CB 3.3Å; A680-N684 WeakPolarHBondContact O-CB 3.5Å; A680-N684 PolarHBondContact O-N 2.97Å; F681-N684 PolarHBondContact O-N 3.22Å; N684-L686 VanDerWaalsContact C-N 3.32Å; N684-L686 PolarHBondContact O-N 2.93Å; N684-W688 WeakPolarHBondContact O-CB 3.47Å; N684-W688 PolarHBondContact O-N 2.79Å; N684-L726 HydrophobicContact CB-CD1 4.39Å; N684-I729 VanDerWaalsContact CA-CD1 3.48Å; N684-I729 HydrophobicContact CB-CD1 3.6Å
685	Q	92.4	Very high	90.1	Very high	160 Å²	160	55 Å²	55	75%	0.748	28%	0.281	S	S	*	.	H	α-helix	trans	-64.8	-34	177.9	-174	57.9	36.9	0	0	113.1	F681 G682 F683	F681-Q685 WeakPolarHBondContact O-CB 3.48Å; F681-Q685 PolarHBondContact O-N 3.3Å; G682-Q685 PolarHBondContact O-N 3.44Å; F683-Q685 VanDerWaalsContact C-N 3.34Å; F683-Q685 PolarHBondContact O-N 3.39Å
686	L	91.6	Very high	89.5	Confident	47 Å²	47	62.7 Å²	62.7	25%	0.246	31%	0.307	C	S	.	.	H	α-helix	trans	-77	-41.3	-179.8	-171.3	67	0	0	0	113.1	G682 F683 N684 T755 V758 G759	G682-L686 WeakPolarHBondContact O-CB 3.31Å; G682-L686 PolarHBondContact O-N 3.44Å; F683-L686 PolarHBondContact O-N 2.93Å; N684-L686 VanDerWaalsContact C-N 3.32Å; N684-L686 PolarHBondContact O-N 2.93Å; L686-T755 HydrophobicContact CD1-CG2 3.88Å; L686-T755 HydrophobicContact CG-CG2 4.18Å; L686-V758 HydrophobicContact CD1-CG1 4Å; L686-V758 HydrophobicContact CD2-CG1 4.09Å; L686-G759 VanDerWaalsContact CD2-CA 3.42Å
687	Y	90.7	Very high	88.8	Confident	7 Å²	7	65.4 Å²	65.4	3%	0.027	32%	0.322	C	S	.	.	H	α-helix	trans	-104.2	-12.1	-169	-77.2	-75.3	0	0	0	115.7	F683 F689 Y690 A691 L746 L748	F683-Y687 AromaticContact CD1-CD2 3.92Å; F683-Y687 HydrophobicContact CD1-CD2 3.92Å; F683-Y687 AromaticContact CD1-CE2 3.83Å; F683-Y687 HydrophobicContact CD1-CE2 3.83Å; F683-Y687 HydrophobicContact CE1-CE2 4.2Å; F683-Y687 PolarHBondContact O-N 3.1Å; Y687-F689 VanDerWaalsContact C-N 3.27Å; Y687-F689 PolarHBondContact O-N 3.23Å; Y687-Y690 HydrophobicContact CD1-CD2 4.33Å; Y687-Y690 WeakPolarHBondContact O-CA 2.97Å; Y687-Y690 PolarHBondContact O-N 2.79Å; Y687-A691 WeakPolarHBondContact O-CB 3.35Å; Y687-A691 PolarHBondContact O-N 2.9Å; Y687-L746 HydrophobicContact CE2-CD2 3.87Å; Y687-L746 WeakPolarHBondContact OH-CB 3.23Å; Y687-L746 PolarHBondContact OH-O 3.03Å; Y687-L748 HydrophobicContact CD1-CD2 4.11Å; Y687-L748 HydrophobicContact CE1-CD2 3.78Å; Y687-L748 HydrophobicContact CE1-CG 4.44Å
688	W	89	Confident	88.2	Confident	151 Å²	151	64.8 Å²	64.8	57%	0.572	32%	0.319	S	S	*	.	H	α-helix	trans	-49.1	-39.5	-173.7	176.5	85.7	0	0	0	115.4	N684 K692	N684-W688 WeakPolarHBondContact O-CB 3.47Å; N684-W688 PolarHBondContact O-N 2.79Å; W688-K692 HydrophobicContact CH2-CD 4.41Å; W688-K692 HydrophobicContact CZ2-CD 4.42Å; W688-K692 WeakPolarHBondContact O-CB 3.37Å; W688-K692 PolarHBondContact O-N 3.34Å
689	F	88.6	Confident	87.3	Confident	126 Å²	126	70 Å²	70	55%	0.553	33%	0.33	S	S	*	.	H	α-helix	trans	-65.1	-46	176.4	178	-96.7	0	0	0	112.2	Y687 K692 N693	Y687-F689 VanDerWaalsContact C-N 3.27Å; Y687-F689 PolarHBondContact O-N 3.23Å; F689-K692 WeakPolarHBondContact O-CB 3.36Å; F689-K692 PolarHBondContact O-N 2.82Å; F689-N693 PolarHBondContact O-N 3.49Å
690	Y	87.5	Confident	86.3	Confident	38 Å²	38	74.5 Å²	74.5	15%	0.149	36%	0.356	C	S	.	.	H	α-helix	trans	-70.7	-38	179.5	-56.7	-73.3	0	0	0	111.9	Y687 K692 N693 R694 L748 Y750 H752 T755	Y687-Y690 HydrophobicContact CD1-CD2 4.33Å; Y687-Y690 WeakPolarHBondContact O-CA 2.97Å; Y687-Y690 PolarHBondContact O-N 2.79Å; Y690-K692 VanDerWaalsContact C-N 3.3Å; Y690-K692 PolarHBondContact O-N 3.34Å; Y690-N693 PolarHBondContact O-N 3.15Å; Y690-N693 VanDerWaalsContact O-N 3.12Å; Y690-R694 WeakPolarHBondContact O-CB 3.47Å; Y690-R694 PolarHBondContact O-N 2.84Å; Y690-L748 HydrophobicContact CD1-CD1 4.43Å; Y690-L748 HydrophobicContact CD1-CD2 3.73Å; Y690-L748 HydrophobicContact CD2-CD2 3.98Å; Y690-L748 HydrophobicContact CE1-CD1 4.12Å; Y690-L748 HydrophobicContact CE1-CD2 4.25Å; Y690-L748 HydrophobicContact CE2-CD1 4.25Å; Y690-L748 HydrophobicContact CE2-CD2 4.49Å; Y690-L748 HydrophobicContact CG-CD2 3.55Å; Y690-Y750 HydrophobicContact CD1-CD2 4.13Å; Y690-Y750 HydrophobicContact CE1-CD2 4.07Å; Y690-H752 AromaticContact CE1-CD2 3.87Å; Y690-H752 PolarHBondContact OH-CD2 3.41Å; Y690-H752 VanDerWaalsContact OH-CD2 3.24Å; Y690-T755 HydrophobicContact CE2-CG2 3.81Å
691	A	84.4	Confident	85.1	Confident	8 Å²	8	76.3 Å²	76.3	7%	0.066	37%	0.367	C	S	.	.	H	α-helix	trans	-54.8	-45.5	169.8	0	0	0	0	0	111.7	Y687 N693 R694 A695 T724	Y687-A691 WeakPolarHBondContact O-CB 3.35Å; Y687-A691 PolarHBondContact O-N 2.9Å; A691-N693 VanDerWaalsContact C-N 3.31Å; A691-N693 PolarHBondContact O-N 3.22Å; A691-R694 PolarHBondContact O-N 3.42Å; A691-A695 VanDerWaalsContact O-CB 3.25Å; A691-A695 WeakPolarHBondContact O-CB 3.41Å; A691-A695 PolarHBondContact O-N 3.21Å; A691-T724 HydrophobicContact CB-CG2 4.24Å; A691-T724 WeakPolarHBondContact CB-O 3.42Å
692	K	84.6	Confident	83.7	Confident	137 Å²	137	77.5 Å²	77.5	60%	0.596	37%	0.374	S	S	*	.	H	α-helix	trans	-63.8	-33.1	176.4	-171.2	176.7	-179.9	179.4	0	112.7	W688 F689 Y690 R696	W688-K692 HydrophobicContact CH2-CD 4.41Å; W688-K692 HydrophobicContact CZ2-CD 4.42Å; W688-K692 WeakPolarHBondContact O-CB 3.37Å; W688-K692 PolarHBondContact O-N 3.34Å; F689-K692 WeakPolarHBondContact O-CB 3.36Å; F689-K692 PolarHBondContact O-N 2.82Å; Y690-K692 VanDerWaalsContact C-N 3.3Å; Y690-K692 PolarHBondContact O-N 3.34Å; K692-R696 WeakPolarHBondContact O-CB 3.39Å; K692-R696 PolarHBondContact O-N 3.05Å
693	N	82.8	Confident	82.3	Confident	30 Å²	30	82.4 Å²	82.4	16%	0.16	39%	0.385	C	S	.	.	H	α-helix	trans	-73.2	-49.2	173.6	-157.2	65.6	0	0	0	111.9	F689 Y690 A691 A695 R696 N697 E749 Y750	F689-N693 PolarHBondContact O-N 3.49Å; Y690-N693 PolarHBondContact O-N 3.15Å; Y690-N693 VanDerWaalsContact O-N 3.12Å; A691-N693 VanDerWaalsContact C-N 3.31Å; A691-N693 PolarHBondContact O-N 3.22Å; N693-A695 VanDerWaalsContact C-N 3.33Å; N693-A695 PolarHBondContact O-N 3.05Å; N693-R696 WeakPolarHBondContact O-CA 3.47Å; N693-R696 WeakPolarHBondContact O-CB 3.38Å; N693-R696 PolarHBondContact O-N 3.06Å; N693-N697 PolarHBondContact O-N 2.83Å; N693-E749 PolarHBondContact ND2-OE2 2.99Å; N693-Y750 PolarHBondContact ND2-OH 3.18Å
694	R	81.4	Confident	80.8	Confident	23 Å²	23	84.5 Å²	84.5	9%	0.087	40%	0.398	C	S	.	.	H	α-helix	trans	-54.4	-46.3	176.2	-178.9	171.5	-88.7	173.9	4.3	111.3	Y690 A691 R696 N697 C698 Y715 R719 G720 S745 N747	Y690-R694 WeakPolarHBondContact O-CB 3.47Å; Y690-R694 PolarHBondContact O-N 2.84Å; A691-R694 PolarHBondContact O-N 3.42Å; R694-R696 PolarHBondContact O-N 3.21Å; R694-N697 PolarHBondContact O-N 3.4Å; R694-C698 PolarHBondContact O-N 3.43Å; R694-C698 PolarHBondContact O-SG 2.69Å; R694-C698 VanDerWaalsContact O-SG 3.32Å; R694-Y715 PolarHBondContact NE-OH 2.97Å; R694-Y715 PolarHBondContact NH2-OH 3.32Å; R694-Y715 VanDerWaalsContact NH2-OH 3.16Å; R694-R719 PolarHBondContact NH1-O 2.91Å; R694-G720 VanDerWaalsContact CD-O 3.31Å; R694-G720 WeakPolarHBondContact CD-O 3.38Å; R694-G720 WeakPolarHBondContact CG-O 3.43Å; R694-S745 PolarHBondContact NH1-O 3.27Å; R694-S745 VanDerWaalsContact NH1-O 3.09Å; R694-N747 PolarHBondContact NH2-O 3.49Å
695	A	79.9	Confident	79.2	Confident	55 Å²	55	88.9 Å²	88.9	46%	0.455	42%	0.421	S	S	.	.	H	α-helix	trans	-65.4	-32.5	174.3	0	0	0	0	0	113.8	A691 N693 K699	A691-A695 VanDerWaalsContact O-CB 3.25Å; A691-A695 WeakPolarHBondContact O-CB 3.41Å; A691-A695 PolarHBondContact O-N 3.21Å; N693-A695 VanDerWaalsContact C-N 3.33Å; N693-A695 PolarHBondContact O-N 3.05Å; A695-K699 PolarHBondContact O-N 3.04Å
696	R	81.2	Confident	77.8	Confident	193 Å²	193	87.9 Å²	87.9	73%	0.728	42%	0.416	S	S	*	.	H	α-helix	trans	-68.2	-45.9	173.8	-177.2	-177.7	-178.7	172.9	1.3	111.2	K692 N693 R694 C698 K699	K692-R696 WeakPolarHBondContact O-CB 3.39Å; K692-R696 PolarHBondContact O-N 3.05Å; N693-R696 WeakPolarHBondContact O-CA 3.47Å; N693-R696 WeakPolarHBondContact O-CB 3.38Å; N693-R696 PolarHBondContact O-N 3.06Å; R694-R696 PolarHBondContact O-N 3.21Å; R696-C698 VanDerWaalsContact C-N 3.35Å; R696-K699 WeakPolarHBondContact O-CB 3.39Å; R696-K699 PolarHBondContact O-N 3Å
697	N	77.9	Confident	76.4	Confident	66 Å²	66	93.3 Å²	93.3	35%	0.353	44%	0.44	S	S	.	.	H	α-helix	trans	-63.8	-41.1	-179.6	-69.2	1.2	0	0	0	111.1	N693 R694 K699 V701 E749	N693-N697 PolarHBondContact O-N 2.83Å; R694-N697 PolarHBondContact O-N 3.4Å; N697-K699 VanDerWaalsContact C-N 3.35Å; N697-K699 PolarHBondContact O-N 3.12Å; N697-V701 WeakPolarHBondContact O-CG2 3.26Å; N697-E749 PolarHBondContact ND2-OE1 2.82Å; N697-E749 PolarHBondContact ND2-OE2 3.04Å
698	C	80.5	Confident	75.1	Confident	27 Å²	27	96.1 Å²	96.1	18%	0.182	47%	0.471	C	S	.	.	H	α-helix	trans	-76.3	-13.3	179.6	-63.9	0	0	0	0	115.2	R694 R696 N700 V701 C716	R694-C698 PolarHBondContact O-N 3.43Å; R694-C698 PolarHBondContact O-SG 2.69Å; R694-C698 VanDerWaalsContact O-SG 3.32Å; R696-C698 VanDerWaalsContact C-N 3.35Å; C698-N700 PolarHBondContact O-N 3.12Å; C698-N700 VanDerWaalsContact O-N 3.14Å; C698-V701 PolarHBondContact O-N 2.95Å; C698-C716 WeakPolarHBondContact CA-SG 3.5Å; C698-C716 HydrophobicContact CB-CB 3.71Å; C698-C716 WeakPolarHBondContact CB-SG 3.27Å; C698-C716 WeakPolarHBondContact SG-CA 3.39Å; C698-C716 WeakPolarHBondContact SG-CB 3.46Å; C698-C716 CovalentContact SG-SG 2.04Å; C698-C716 PolarHBondContact SG-SG 3.35Å
699	K	77.3	Confident	74.2	Confident	170 Å²	170	93 Å²	93	74%	0.739	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-30.3	-171	-171.5	176.7	178.6	-174.6	0	114.5	A695 R696 N697	A695-K699 PolarHBondContact O-N 3.04Å; R696-K699 WeakPolarHBondContact O-CB 3.39Å; R696-K699 PolarHBondContact O-N 3Å; N697-K699 VanDerWaalsContact C-N 3.35Å; N697-K699 PolarHBondContact O-N 3.12Å
700	N	72	Confident	73.5	Confident	131 Å²	131	90.9 Å²	90.9	70%	0.701	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	8	-174.4	-61.9	1.5	0	0	0	112.9	C698 H702	C698-N700 PolarHBondContact O-N 3.12Å; C698-N700 VanDerWaalsContact O-N 3.14Å; N700-H702 PolarHBondContact O-N 2.93Å
701	V	69.7	Low	72.8	Confident	37 Å²	37	95.3 Å²	95.3	22%	0.224	48%	0.479	C	S	.	.			trans	-90.8	91.2	-171	-173.2	0	0	0	0	109.9	N697 C698 V712 Y713	N697-V701 WeakPolarHBondContact O-CG2 3.26Å; C698-V701 PolarHBondContact O-N 2.95Å; V701-V712 HydrophobicContact CG1-CG1 4.25Å; V701-V712 HydrophobicContact CG2-CG1 3.99Å; V701-Y713 HydrophobicContact CG1-CD2 4.25Å
702	H	66.5	Low	72.4	Confident	142 Å²	142	98.1 Å²	98.1	66%	0.657	50%	0.496	S	S	*	.			trans	-88.2	157.2	174.9	-66.9	-78.8	0	0	0	111.8	N700 T704	N700-H702 PolarHBondContact O-N 2.93Å; H702-T704 PolarHBondContact O-N 2.73Å; H702-T704 PolarHBondContact O-OG1 2.9Å
703	F	64.5	Low	71.9	Confident	138 Å²	138	95 Å²	95	61%	0.605	48%	0.481	S	S	*	.			trans	-60.8	112	173.4	-179.2	-103.2	0	0	0	109.9	L705 Y713	F703-L705 HydrophobicContact CE1-CD1 4.45Å; F703-L705 HydrophobicContact CE1-CD2 4.38Å; F703-L705 HydrophobicContact CE1-CG 4.11Å; F703-L705 HydrophobicContact CZ-CD2 4.05Å; F703-L705 HydrophobicContact CZ-CG 4.23Å; F703-Y713 HydrophobicContact CB-CE2 3.73Å; F703-Y713 HydrophobicContact CD2-CD1 4.28Å; F703-Y713 AromaticContact CD2-CE1 3.66Å; F703-Y713 HydrophobicContact CD2-CE1 3.66Å; F703-Y713 HydrophobicContact CD2-CE2 4.27Å; F703-Y713 AromaticContact CD2-CZ 3.65Å; F703-Y713 HydrophobicContact CE2-CE1 4.41Å
704	T	61.5	Low	71.6	Confident	45 Å²	45	97.9 Å²	97.9	28%	0.276	50%	0.496	S	S	.	.			trans	-137.1	129.8	-171.8	35	0	0	0	0	106.6	H702 E706 Q709	H702-T704 PolarHBondContact O-N 2.73Å; H702-T704 PolarHBondContact O-OG1 2.9Å; T704-E706 PolarHBondContact O-N 3.46Å; T704-Q709 VanDerWaalsContact CB-OE1 3.27Å; T704-Q709 WeakPolarHBondContact OG1-CB 3.4Å; T704-Q709 PolarHBondContact OG1-OE1 2.99Å
705	L	59.1	Low	71.4	Confident	135 Å²	135	99.8 Å²	99.8	71%	0.707	50%	0.504	S	S	*	.			trans	-80.6	-4.8	-172.7	-80.3	155.3	0	0	0	113.2	F703 K710	F703-L705 HydrophobicContact CE1-CD1 4.45Å; F703-L705 HydrophobicContact CE1-CD2 4.38Å; F703-L705 HydrophobicContact CE1-CG 4.11Å; F703-L705 HydrophobicContact CZ-CD2 4.05Å; F703-L705 HydrophobicContact CZ-CG 4.23Å; L705-K710 WeakPolarHBondContact O-CE 3.34Å
706	E	62.7	Low	71.4	Confident	139 Å²	139	97.8 Å²	97.8	65%	0.65	49%	0.486	S	S	*	.			trans	-63	134.1	178.3	-62.7	-171.1	-175.5	0	0	111.8	T704 G708 Q709	T704-E706 PolarHBondContact O-N 3.46Å; E706-G708 PolarHBondContact O-N 2.7Å; E706-G708 VanDerWaalsContact O-N 3.1Å; E706-Q709 PolarHBondContact O-N 2.86Å
707	E	61.7	Low	71.2	Confident	162 Å²	162	93.1 Å²	93.1	76%	0.757	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-9.2	-161.7	-49.5	-152.1	101.7	0	0	114.4	K710	E707-K710 IonicContact OE1-NZ 3.25Å; E707-K710 PolarHBondContact OE1-NZ 3.35Å
708	G	65.4	Low	70.9	Confident	65 Å²	65	92.1 Å²	92.1	67%	0.67	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-13	170.4	0	0	0	0	0	115.2	E706	E706-G708 PolarHBondContact O-N 2.7Å; E706-G708 VanDerWaalsContact O-N 3.1Å
709	Q	69.9	Low	70.6	Confident	85 Å²	85	95.2 Å²	95.2	40%	0.397	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-17.5	-177	-64.3	-166.8	-54.1	0	0	113.5	T704 E706 D711 V712 Y713	T704-Q709 VanDerWaalsContact CB-OE1 3.27Å; T704-Q709 WeakPolarHBondContact OG1-CB 3.4Å; T704-Q709 PolarHBondContact OG1-OE1 2.99Å; E706-Q709 PolarHBondContact O-N 2.86Å; Q709-D711 PolarHBondContact O-N 3.35Å; Q709-V712 PolarHBondContact O-N 3.27Å; Q709-Y713 WeakPolarHBondContact O-CB 3.34Å; Q709-Y713 PolarHBondContact O-N 3.29Å
710	K	72.5	Confident	70.3	Confident	83 Å²	83	87.4 Å²	87.4	36%	0.361	45%	0.446	S	S	.	.	H	α-helix	trans	-54.7	-49.2	177.8	-66.4	172.2	-172	166.1	0	112.5	L705 E707 V712 Y713 D714	L705-K710 WeakPolarHBondContact O-CE 3.34Å; E707-K710 IonicContact OE1-NZ 3.25Å; E707-K710 PolarHBondContact OE1-NZ 3.35Å; K710-V712 VanDerWaalsContact C-N 3.33Å; K710-V712 PolarHBondContact O-N 3.27Å; K710-Y713 PolarHBondContact O-N 3.17Å; K710-D714 WeakPolarHBondContact O-CB 3.42Å; K710-D714 PolarHBondContact O-N 3.39Å
711	D	74.4	Confident	70.6	Confident	130 Å²	130	83.7 Å²	83.7	70%	0.695	43%	0.428	S	S	*	.	H	α-helix	trans	-64.9	-36.1	-178	-66.3	4.1	0	0	0	112.6	Q709 Y715	Q709-D711 PolarHBondContact O-N 3.35Å; D711-Y715 WeakPolarHBondContact O-CB 3.26Å; D711-Y715 PolarHBondContact O-N 2.99Å
712	V	74.3	Confident	71.2	Confident	67 Å²	67	85.2 Å²	85.2	41%	0.406	43%	0.431	S	S	.	.	H	α-helix	trans	-73.1	-39.8	177.3	-173.3	0	0	0	0	110.6	V701 Q709 K710 C716	V701-V712 HydrophobicContact CG1-CG1 4.25Å; V701-V712 HydrophobicContact CG2-CG1 3.99Å; Q709-V712 PolarHBondContact O-N 3.27Å; K710-V712 VanDerWaalsContact C-N 3.33Å; K710-V712 PolarHBondContact O-N 3.27Å; V712-C716 VanDerWaalsContact O-CB 3.24Å; V712-C716 WeakPolarHBondContact O-CB 3.41Å; V712-C716 PolarHBondContact O-N 3.27Å; V712-C716 PolarHBondContact O-SG 2.91Å
713	Y	74.8	Confident	72.1	Confident	73 Å²	73	78.7 Å²	78.7	29%	0.286	40%	0.4	S	S	.	.	H	α-helix	trans	-64.5	-47.1	175.5	178.7	-96	0	0	0	111.8	V701 F703 Q709 K710 C716 I717	V701-Y713 HydrophobicContact CG1-CD2 4.25Å; F703-Y713 HydrophobicContact CB-CE2 3.73Å; F703-Y713 HydrophobicContact CD2-CD1 4.28Å; F703-Y713 AromaticContact CD2-CE1 3.66Å; F703-Y713 HydrophobicContact CD2-CE1 3.66Å; F703-Y713 HydrophobicContact CD2-CE2 4.27Å; F703-Y713 AromaticContact CD2-CZ 3.65Å; F703-Y713 HydrophobicContact CE2-CE1 4.41Å; Q709-Y713 WeakPolarHBondContact O-CB 3.34Å; Q709-Y713 PolarHBondContact O-N 3.29Å; K710-Y713 PolarHBondContact O-N 3.17Å; Y713-C716 PolarHBondContact O-N 2.92Å; Y713-I717 HydrophobicContact CD1-CD1 4.05Å; Y713-I717 HydrophobicContact CD2-CD1 4.17Å; Y713-I717 HydrophobicContact CE1-CD1 3.47Å; Y713-I717 VanDerWaalsContact CE1-CD1 3.47Å; Y713-I717 HydrophobicContact CE2-CD1 3.6Å; Y713-I717 HydrophobicContact CG-CD1 4.36Å; Y713-I717 PolarHBondContact O-N 3.31Å; Y713-I717 WeakPolarHBondContact OH-CD1 3.28Å
714	D	76.1	Confident	73	Confident	90 Å²	90	73 Å²	73	48%	0.481	38%	0.377	S	S	.	.	H	α-helix	trans	-63.6	-45.8	175.4	-175.1	64.4	0	0	0	111.5	K710 C716 I717 T718	K710-D714 WeakPolarHBondContact O-CB 3.42Å; K710-D714 PolarHBondContact O-N 3.39Å; D714-C716 VanDerWaalsContact C-N 3.32Å; D714-C716 PolarHBondContact O-N 3.03Å; D714-I717 PolarHBondContact O-N 3.07Å; D714-T718 WeakPolarHBondContact O-CB 3.44Å; D714-T718 WeakPolarHBondContact O-CG2 2.82Å; D714-T718 PolarHBondContact O-N 3.31Å; D714-T718 PolarHBondContact O-OG1 3.09Å; D714-T718 WeakPolarHBondContact OD1-CG2 3.4Å
715	Y	78.7	Confident	74.2	Confident	62 Å²	62	75.7 Å²	75.7	24%	0.243	39%	0.39	C	S	.	.	H	α-helix	trans	-54.9	-47.1	171.5	168.2	-106.1	0	0	0	111.7	R694 D711 I717 R719 G720	R694-Y715 PolarHBondContact NE-OH 2.97Å; R694-Y715 PolarHBondContact NH2-OH 3.32Å; R694-Y715 VanDerWaalsContact NH2-OH 3.16Å; D711-Y715 WeakPolarHBondContact O-CB 3.26Å; D711-Y715 PolarHBondContact O-N 2.99Å; Y715-I717 PolarHBondContact O-N 2.9Å; Y715-R719 HydrophobicContact CD2-CB 3.92Å; Y715-R719 HydrophobicContact CE2-CB 4.13Å; Y715-R719 CarbonylContact O-C 3.6Å; Y715-R719 WeakPolarHBondContact O-CA 3.48Å; Y715-R719 PolarHBondContact O-N 3.43Å; Y715-G720 PolarHBondContact O-N 3.43Å
716	C	79.6	Confident	75.7	Confident	14 Å²	14	72.6 Å²	72.6	10%	0.095	37%	0.373	C	S	.	.	H	α-helix	trans	-66.8	-34	-177.1	-79.3	0	0	0	0	113.8	C698 V712 Y713 D714 G720	C698-C716 WeakPolarHBondContact CA-SG 3.5Å; C698-C716 HydrophobicContact CB-CB 3.71Å; C698-C716 WeakPolarHBondContact CB-SG 3.27Å; C698-C716 WeakPolarHBondContact SG-CA 3.39Å; C698-C716 WeakPolarHBondContact SG-CB 3.46Å; C698-C716 CovalentContact SG-SG 2.04Å; C698-C716 PolarHBondContact SG-SG 3.35Å; V712-C716 VanDerWaalsContact O-CB 3.24Å; V712-C716 WeakPolarHBondContact O-CB 3.41Å; V712-C716 PolarHBondContact O-N 3.27Å; V712-C716 PolarHBondContact O-SG 2.91Å; Y713-C716 PolarHBondContact O-N 2.92Å; D714-C716 VanDerWaalsContact C-N 3.32Å; D714-C716 PolarHBondContact O-N 3.03Å; C716-G720 WeakPolarHBondContact O-CA 3.33Å
717	I	76.4	Confident	77	Confident	95 Å²	95	72.3 Å²	72.3	49%	0.487	37%	0.371	S	S	.	.	H	α-helix	trans	-83.3	-40.1	178.9	-73	175.9	0	0	0	112.1	Y713 D714 Y715	Y713-I717 HydrophobicContact CD1-CD1 4.05Å; Y713-I717 HydrophobicContact CD2-CD1 4.17Å; Y713-I717 HydrophobicContact CE1-CD1 3.47Å; Y713-I717 VanDerWaalsContact CE1-CD1 3.47Å; Y713-I717 HydrophobicContact CE2-CD1 3.6Å; Y713-I717 HydrophobicContact CG-CD1 4.36Å; Y713-I717 PolarHBondContact O-N 3.31Å; Y713-I717 WeakPolarHBondContact OH-CD1 3.28Å; D714-I717 PolarHBondContact O-N 3.07Å; Y715-I717 PolarHBondContact O-N 2.9Å
718	T	71.9	Confident	78.3	Confident	45 Å²	45	67.3 Å²	67.3	28%	0.276	35%	0.347	S	S	.	.	H	α-helix	trans	-82.8	-62.9	-178.4	61.8	0	0	0	0	111.9	D714 Y722	D714-T718 WeakPolarHBondContact O-CB 3.44Å; D714-T718 WeakPolarHBondContact O-CG2 2.82Å; D714-T718 PolarHBondContact O-N 3.31Å; D714-T718 PolarHBondContact O-OG1 3.09Å; D714-T718 WeakPolarHBondContact OD1-CG2 3.4Å; T718-Y722 WeakPolarHBondContact O-CD2 3.21Å; T718-Y722 WeakPolarHBondContact O-CE2 3.48Å
719	R	73.3	Confident	79.6	Confident	92 Å²	92	64.2 Å²	64.2	35%	0.347	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-15.4	-170.7	-64.8	174.1	178.7	136	5.1	113.6	R694 Y715 D742 T744	R694-R719 PolarHBondContact NH1-O 2.91Å; Y715-R719 HydrophobicContact CD2-CB 3.92Å; Y715-R719 HydrophobicContact CE2-CB 4.13Å; Y715-R719 CarbonylContact O-C 3.6Å; Y715-R719 WeakPolarHBondContact O-CA 3.48Å; Y715-R719 PolarHBondContact O-N 3.43Å; R719-D742 IonicContact NH2-OD2 3.31Å; R719-T744 PolarHBondContact NE-OG1 3.27Å
720	G	71.4	Confident	80.7	Confident	5 Å²	5	62.1 Å²	62.1	5%	0.052	31%	0.308	C	S	.	.	S	Bend	trans	-73.3	-26.9	-174.6	0	0	0	0	0	114.1	R694 Y715 C716 T724	R694-G720 VanDerWaalsContact CD-O 3.31Å; R694-G720 WeakPolarHBondContact CD-O 3.38Å; R694-G720 WeakPolarHBondContact CG-O 3.43Å; Y715-G720 PolarHBondContact O-N 3.43Å; C716-G720 WeakPolarHBondContact O-CA 3.33Å; G720-T724 WeakPolarHBondContact O-CG2 3.23Å
721	T	77.6	Confident	81.6	Confident	53 Å²	53	61.6 Å²	61.6	33%	0.325	31%	0.307	S	S	.	.	S	Bend	trans	-85.4	-36.4	-179.9	48.9	0	0	0	0	112.6	T724	T721-T724 WeakPolarHBondContact O-CB 3.39Å; T721-T724 VanDerWaalsContact O-CG2 3.27Å; T721-T724 WeakPolarHBondContact O-CG2 3.46Å; T721-T724 PolarHBondContact O-N 3.29Å; T721-T724 PolarHBondContact O-OG1 2.86Å
722	Y	83.8	Confident	82.4	Confident	69 Å²	69	55.5 Å²	55.5	27%	0.271	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	139.8	-176.6	-58.5	-34.1	0	0	0	113.1	T718 T724 I741	T718-Y722 WeakPolarHBondContact O-CD2 3.21Å; T718-Y722 WeakPolarHBondContact O-CE2 3.48Å; Y722-T724 PolarHBondContact O-N 3.28Å; Y722-I741 HydrophobicContact CD1-CD1 4.06Å; Y722-I741 HydrophobicContact CD2-CG1 4.3Å; Y722-I741 HydrophobicContact CE1-CD1 4.07Å; Y722-I741 HydrophobicContact CE1-CG1 4.3Å; Y722-I741 HydrophobicContact CE2-CG1 4Å; Y722-I741 HydrophobicContact CG-CD1 4.33Å
723	F	84.7	Confident	83.3	Confident	5 Å²	5	52.3 Å²	52.3	2%	0.022	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	22.2	-179	-57	-82.6	0	0	0	116.3	F683 I729 L733 L746 F763	F683-F723 HydrophobicContact CB-CD1 4.02Å; F683-F723 HydrophobicContact CB-CE1 4.43Å; F683-F723 AromaticContact CD1-CD1 3.9Å; F683-F723 HydrophobicContact CD1-CD1 3.9Å; F683-F723 AromaticContact CD1-CE1 3.87Å; F683-F723 HydrophobicContact CD1-CE1 3.87Å; F683-F723 HydrophobicContact CD2-CE1 4.14Å; F683-F723 HydrophobicContact CE1-CE1 4.13Å; F683-F723 HydrophobicContact CE2-CE1 4.39Å; F683-F723 AromaticContact CG-CD1 3.92Å; F683-F723 HydrophobicContact CG-CD1 3.92Å; F683-F723 AromaticContact CG-CE1 3.88Å; F683-F723 HydrophobicContact CG-CE1 3.88Å; F683-F723 HydrophobicContact CZ-CE1 4.37Å; F723-I729 HydrophobicContact CB-CG1 4.21Å; F723-I729 HydrophobicContact CD1-CG1 4.15Å; F723-I729 HydrophobicContact CD1-CG2 4.18Å; F723-L733 HydrophobicContact CE1-CD2 4.23Å; F723-L746 HydrophobicContact CD2-CD2 3.94Å; F723-L746 HydrophobicContact CE1-CD2 4.47Å; F723-L746 HydrophobicContact CE2-CD2 3.64Å; F723-L746 HydrophobicContact CE2-CG 4.42Å; F723-L746 HydrophobicContact CG-CD2 4.48Å; F723-L746 HydrophobicContact CZ-CD2 3.94Å; F723-F763 HydrophobicContact CZ-CD2 4.39Å; F723-F763 HydrophobicContact CZ-CE2 4.48Å
724	T	83.6	Confident	84.1	Confident	18 Å²	18	53.1 Å²	53.1	11%	0.11	26%	0.258	C	S	.	.	S	Bend	trans	-83.4	-54	-176.9	54.6	0	0	0	0	115.2	A691 G720 T721 Y722	A691-T724 HydrophobicContact CB-CG2 4.24Å; A691-T724 WeakPolarHBondContact CB-O 3.42Å; G720-T724 WeakPolarHBondContact O-CG2 3.23Å; T721-T724 WeakPolarHBondContact O-CB 3.39Å; T721-T724 VanDerWaalsContact O-CG2 3.27Å; T721-T724 WeakPolarHBondContact O-CG2 3.46Å; T721-T724 PolarHBondContact O-N 3.29Å; T721-T724 PolarHBondContact O-OG1 2.86Å; Y722-T724 PolarHBondContact O-N 3.28Å
725	N	86	Confident	84.9	Confident	102 Å²	102	54.5 Å²	54.5	55%	0.545	26%	0.257	S	S	.	.	S	Bend	trans	-115.4	159	178.9	-67.3	-57.3	0	0	0	110.2	F727 E728 I729	N725-F727 PolarHBondContact O-N 2.64Å; N725-F727 VanDerWaalsContact O-N 3.12Å; N725-E728 HydrophobicContact CB-CB 4.4Å; N725-E728 HydrophobicContact CB-CG 4.09Å; N725-E728 CarbonylContact O-C 3.57Å; N725-E728 PolarHBondContact O-N 2.93Å; N725-I729 WeakPolarHBondContact O-CD1 3.47Å; N725-I729 VanDerWaalsContact O-CG1 3.25Å; N725-I729 WeakPolarHBondContact O-CG1 3.1Å; N725-I729 PolarHBondContact O-N 3.29Å
726	L	91.3	Very high	85.5	Confident	70 Å²	70	51.7 Å²	51.7	37%	0.366	25%	0.246	S	C	.	.	H	α-helix	trans	-52.1	-38.2	177.3	-174.7	66.2	0	0	0	113.4	A680 F681 N684 V730	A680-L726 HydrophobicContact CB-CD1 3.97Å; F681-L726 HydrophobicContact CD1-CD1 3.78Å; F681-L726 HydrophobicContact CD1-CD2 4.31Å; F681-L726 HydrophobicContact CE1-CD1 3.96Å; F681-L726 HydrophobicContact CE1-CD2 3.67Å; F681-L726 HydrophobicContact CE1-CG 4.5Å; F681-L726 HydrophobicContact CZ-CD2 4.44Å; N684-L726 HydrophobicContact CB-CD1 4.39Å; L726-V730 WeakPolarHBondContact O-CB 3.43Å; L726-V730 VanDerWaalsContact O-CG2 3.31Å; L726-V730 WeakPolarHBondContact O-CG2 3.31Å; L726-V730 PolarHBondContact O-N 3.05Å
727	F	90.7	Very high	85.9	Confident	134 Å²	134	52.9 Å²	52.9	59%	0.588	26%	0.257	S	S	*	.	H	α-helix	trans	-69.3	-45.7	176.2	-174.9	-101.7	0	0	0	112.6	N725 I729 V730 Q731	N725-F727 PolarHBondContact O-N 2.64Å; N725-F727 VanDerWaalsContact O-N 3.12Å; F727-I729 VanDerWaalsContact C-N 3.27Å; F727-I729 PolarHBondContact O-N 3.18Å; F727-V730 WeakPolarHBondContact O-CB 3.33Å; F727-V730 PolarHBondContact O-N 3.19Å; F727-V730 VanDerWaalsContact O-N 3.15Å; F727-Q731 HydrophobicContact CD1-CG 4.43Å; F727-Q731 HydrophobicContact CE1-CG 4.12Å; F727-Q731 HydrophobicContact CZ-CG 4.31Å; F727-Q731 PolarHBondContact O-N 3.24Å
728	E	88.8	Confident	86.6	Confident	56 Å²	56	55 Å²	55	26%	0.262	26%	0.26	S	S	.	.	H	α-helix	trans	-61.7	-36	174.5	-62.3	-63.3	150.4	0	0	111.5	N725 Q731 S732	N725-E728 HydrophobicContact CB-CB 4.4Å; N725-E728 HydrophobicContact CB-CG 4.09Å; N725-E728 CarbonylContact O-C 3.57Å; N725-E728 PolarHBondContact O-N 2.93Å; E728-Q731 PolarHBondContact O-N 2.73Å; E728-S732 VanDerWaalsContact O-CB 3.23Å; E728-S732 WeakPolarHBondContact O-CB 3.35Å; E728-S732 PolarHBondContact O-N 2.91Å; E728-S732 PolarHBondContact O-OG 3.07Å
729	I	92.7	Very high	87.4	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-65.6	-46.5	173.1	-65.8	159.7	0	0	0	110.3	A680 F683 N684 F723 N725 F727 Q731 S732 L733	A680-I729 HydrophobicContact CB-CG2 3.78Å; F683-I729 HydrophobicContact CB-CG2 3.78Å; N684-I729 VanDerWaalsContact CA-CD1 3.48Å; N684-I729 HydrophobicContact CB-CD1 3.6Å; F723-I729 HydrophobicContact CB-CG1 4.21Å; F723-I729 HydrophobicContact CD1-CG1 4.15Å; F723-I729 HydrophobicContact CD1-CG2 4.18Å; N725-I729 WeakPolarHBondContact O-CD1 3.47Å; N725-I729 VanDerWaalsContact O-CG1 3.25Å; N725-I729 WeakPolarHBondContact O-CG1 3.1Å; N725-I729 PolarHBondContact O-N 3.29Å; F727-I729 VanDerWaalsContact C-N 3.27Å; F727-I729 PolarHBondContact O-N 3.18Å; I729-Q731 VanDerWaalsContact C-N 3.32Å; I729-Q731 PolarHBondContact O-N 2.97Å; I729-S732 WeakPolarHBondContact O-CB 3.29Å; I729-S732 PolarHBondContact O-N 2.99Å; I729-S732 VanDerWaalsContact O-N 3.16Å; I729-L733 HydrophobicContact CG2-CD1 4.07Å; I729-L733 HydrophobicContact CG2-CG 4.35Å; I729-L733 WeakPolarHBondContact O-CG 3.21Å; I729-L733 PolarHBondContact O-N 3.13Å
730	V	93	Very high	88.2	Confident	41 Å²	41	56.9 Å²	56.9	25%	0.248	29%	0.29	C	S	.	.	H	α-helix	trans	-58.7	-43.4	175.8	160.6	0	0	0	0	111.2	L676 A680 L726 F727 Y734	L676-V730 HydrophobicContact CD2-CB 4.05Å; L676-V730 HydrophobicContact CD2-CG1 3.86Å; L676-V730 HydrophobicContact CD2-CG2 3.83Å; A680-V730 HydrophobicContact CB-CG2 3.8Å; L726-V730 WeakPolarHBondContact O-CB 3.43Å; L726-V730 VanDerWaalsContact O-CG2 3.31Å; L726-V730 WeakPolarHBondContact O-CG2 3.31Å; L726-V730 PolarHBondContact O-N 3.05Å; F727-V730 WeakPolarHBondContact O-CB 3.33Å; F727-V730 PolarHBondContact O-N 3.19Å; F727-V730 VanDerWaalsContact O-N 3.15Å; V730-Y734 WeakPolarHBondContact O-CB 3.45Å; V730-Y734 PolarHBondContact O-N 3.44Å
731	Q	91.3	Very high	89	Confident	71 Å²	71	57.3 Å²	57.3	33%	0.332	29%	0.29	S	S	.	.	H	α-helix	trans	-67.5	-38.4	174.2	-70.6	-175.2	-44	0	0	112.4	F727 E728 I729 Y734 W735	F727-Q731 HydrophobicContact CD1-CG 4.43Å; F727-Q731 HydrophobicContact CE1-CG 4.12Å; F727-Q731 HydrophobicContact CZ-CG 4.31Å; F727-Q731 PolarHBondContact O-N 3.24Å; E728-Q731 PolarHBondContact O-N 2.73Å; I729-Q731 VanDerWaalsContact C-N 3.32Å; I729-Q731 PolarHBondContact O-N 2.97Å; Q731-Y734 PolarHBondContact O-N 2.76Å; Q731-W735 PolarHBondContact O-N 3.28Å
732	S	91.3	Very high	89.4	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.014	30%	0.3	C	S	.	.	H	α-helix	trans	-63.1	-44.7	176.9	-61.3	0	0	0	0	111.5	E728 I729 Y734 W735 S736 I741	E728-S732 VanDerWaalsContact O-CB 3.23Å; E728-S732 WeakPolarHBondContact O-CB 3.35Å; E728-S732 PolarHBondContact O-N 2.91Å; E728-S732 PolarHBondContact O-OG 3.07Å; I729-S732 WeakPolarHBondContact O-CB 3.29Å; I729-S732 PolarHBondContact O-N 2.99Å; I729-S732 VanDerWaalsContact O-N 3.16Å; S732-Y734 VanDerWaalsContact C-N 3.35Å; S732-W735 PolarHBondContact O-N 3.26Å; S732-S736 WeakPolarHBondContact O-CB 3.19Å; S732-S736 PolarHBondContact O-N 2.92Å; S732-S736 PolarHBondContact O-OG 2.9Å; S732-I741 VanDerWaalsContact CA-CD1 3.45Å; S732-I741 VanDerWaalsContact O-CD1 3.25Å; S732-I741 WeakPolarHBondContact O-CD1 3.27Å
733	L	93	Very high	89.5	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-68.9	-32.2	176.3	-67.1	177.3	0	0	0	112.7	L676 F679 A680 F683 F723 I729 S736 Y766	L676-L733 HydrophobicContact CD2-CB 4.35Å; L676-L733 HydrophobicContact CG-CB 4.13Å; F679-L733 HydrophobicContact CB-CD1 4.01Å; A680-L733 HydrophobicContact CB-CD1 3.99Å; F683-L733 HydrophobicContact CD2-CD1 4.17Å; F683-L733 HydrophobicContact CD2-CD2 3.93Å; F683-L733 HydrophobicContact CD2-CG 4.48Å; F683-L733 HydrophobicContact CE2-CD2 3.66Å; F723-L733 HydrophobicContact CE1-CD2 4.23Å; I729-L733 HydrophobicContact CG2-CD1 4.07Å; I729-L733 HydrophobicContact CG2-CG 4.35Å; I729-L733 WeakPolarHBondContact O-CG 3.21Å; I729-L733 PolarHBondContact O-N 3.13Å; L733-S736 PolarHBondContact O-OG 3.45Å; L733-Y766 HydrophobicContact CB-CE1 4.18Å; L733-Y766 HydrophobicContact CB-CE2 4.43Å; L733-Y766 HydrophobicContact CD2-CD1 3.8Å; L733-Y766 HydrophobicContact CD2-CD2 4.39Å; L733-Y766 HydrophobicContact CD2-CE1 3.82Å; L733-Y766 HydrophobicContact CD2-CE2 4.41Å; L733-Y766 HydrophobicContact CD2-CG 4.09Å; L733-Y766 PolarHBondContact O-OH 3.33Å
734	Y	91.9	Very high	89.5	Confident	91 Å²	91	62.9 Å²	62.9	36%	0.357	33%	0.325	S	S	.	.	H	α-helix	trans	-67.6	-48.6	172	173.5	-95.3	0	0	0	111.7	V730 Q731 S732 S736 A737 Y738	V730-Y734 WeakPolarHBondContact O-CB 3.45Å; V730-Y734 PolarHBondContact O-N 3.44Å; Q731-Y734 PolarHBondContact O-N 2.76Å; S732-Y734 VanDerWaalsContact C-N 3.35Å; Y734-S736 PolarHBondContact O-N 3.39Å; Y734-A737 VanDerWaalsContact O-CB 3.3Å; Y734-A737 WeakPolarHBondContact O-CB 3.42Å; Y734-A737 PolarHBondContact O-N 2.8Å; Y734-Y738 HydrophobicContact CD1-CE2 4.38Å; Y734-Y738 AromaticContact CE1-CE2 3.83Å; Y734-Y738 HydrophobicContact CE1-CE2 3.83Å; Y734-Y738 HydrophobicContact CE2-CE2 4.05Å; Y734-Y738 AromaticContact CZ-CE2 3.65Å; Y734-Y738 WeakPolarHBondContact O-CD2 3.41Å; Y734-Y738 PolarHBondContact OH-OH 3.32Å
735	W	91.5	Very high	89.6	Confident	119 Å²	119	62.1 Å²	62.1	45%	0.451	32%	0.32	S	S	.	.	H	α-helix	trans	-70	-30.1	-179.6	-72.1	126	0	0	0	113.3	Q731 S732 A737 Y738 L740 I741	Q731-W735 PolarHBondContact O-N 3.28Å; S732-W735 PolarHBondContact O-N 3.26Å; W735-A737 PolarHBondContact O-N 2.84Å; W735-Y738 AromaticContact CE3-CD2 3.99Å; W735-Y738 HydrophobicContact CE3-CD2 3.99Å; W735-Y738 HydrophobicContact CE3-CE2 4.49Å; W735-Y738 HydrophobicContact CZ3-CD2 4.4Å; W735-Y738 PolarHBondContact O-N 2.76Å; W735-L740 HydrophobicContact CE3-CD1 3.83Å; W735-L740 HydrophobicContact CZ3-CD1 4.21Å; W735-L740 PolarHBondContact O-N 3.49Å; W735-I741 HydrophobicContact CB-CD1 4.32Å
736	S	91.3	Very high	89.6	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-23	172.4	71.9	0	0	0	0	113.2	S732 L733 Y734 Y738 G739 F771	S732-S736 WeakPolarHBondContact O-CB 3.19Å; S732-S736 PolarHBondContact O-N 2.92Å; S732-S736 PolarHBondContact O-OG 2.9Å; L733-S736 PolarHBondContact O-OG 3.45Å; Y734-S736 PolarHBondContact O-N 3.39Å; S736-Y738 PolarHBondContact O-N 3.28Å; S736-G739 PolarHBondContact O-N 2.88Å; S736-F771 WeakPolarHBondContact O-CZ 3.48Å
737	A	89	Confident	89.3	Confident	38 Å²	38	56.9 Å²	56.9	31%	0.314	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-14.7	172.8	0	0	0	0	0	114.3	Y734 W735 F771	Y734-A737 VanDerWaalsContact O-CB 3.3Å; Y734-A737 WeakPolarHBondContact O-CB 3.42Å; Y734-A737 PolarHBondContact O-N 2.8Å; W735-A737 PolarHBondContact O-N 2.84Å; A737-F771 VanDerWaalsContact CA-CE1 3.41Å; A737-F771 HydrophobicContact CB-CD1 4.47Å; A737-F771 HydrophobicContact CB-CE1 3.73Å; A737-F771 HydrophobicContact CB-CZ 4.37Å
738	Y	90.2	Very high	88.9	Confident	140 Å²	140	51.7 Å²	51.7	55%	0.549	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	6.7	171.4	-57.3	-80.6	0	0	0	112.7	Y734 W735 S736 L740	Y734-Y738 HydrophobicContact CD1-CE2 4.38Å; Y734-Y738 AromaticContact CE1-CE2 3.83Å; Y734-Y738 HydrophobicContact CE1-CE2 3.83Å; Y734-Y738 HydrophobicContact CE2-CE2 4.05Å; Y734-Y738 AromaticContact CZ-CE2 3.65Å; Y734-Y738 WeakPolarHBondContact O-CD2 3.41Å; Y734-Y738 PolarHBondContact OH-OH 3.32Å; W735-Y738 AromaticContact CE3-CD2 3.99Å; W735-Y738 HydrophobicContact CE3-CD2 3.99Å; W735-Y738 HydrophobicContact CE3-CE2 4.49Å; W735-Y738 HydrophobicContact CZ3-CD2 4.4Å; W735-Y738 PolarHBondContact O-N 2.76Å; S736-Y738 PolarHBondContact O-N 3.28Å; Y738-L740 VanDerWaalsContact C-N 3.26Å; Y738-L740 PolarHBondContact O-N 2.92Å
739	G	89.3	Confident	88.5	Confident	64 Å²	64	54.3 Å²	54.3	66%	0.66	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	13.4	-175.5	0	0	0	0	0	114.6	S736 I741	S736-G739 PolarHBondContact O-N 2.88Å; G739-I741 VanDerWaalsContact C-N 3.28Å; G739-I741 PolarHBondContact O-N 3.36Å
740	L	90	Very high	88	Confident	113 Å²	113	58.6 Å²	58.6	59%	0.592	30%	0.3	S	S	*	.			trans	-85.6	11.5	-174.7	-66.2	173.6	0	0	0	114.4	W735 Y738	W735-L740 HydrophobicContact CE3-CD1 3.83Å; W735-L740 HydrophobicContact CZ3-CD1 4.21Å; W735-L740 PolarHBondContact O-N 3.49Å; Y738-L740 VanDerWaalsContact C-N 3.26Å; Y738-L740 PolarHBondContact O-N 2.92Å
741	I	88.2	Confident	87.7	Confident	13 Å²	13	62.7 Å²	62.7	7%	0.067	33%	0.327	C	S	.	.	S	Bend	trans	-128.2	120.9	178.2	-99.4	164	0	0	0	110.9	Y722 S732 W735 G739 F763	Y722-I741 HydrophobicContact CD1-CD1 4.06Å; Y722-I741 HydrophobicContact CD2-CG1 4.3Å; Y722-I741 HydrophobicContact CE1-CD1 4.07Å; Y722-I741 HydrophobicContact CE1-CG1 4.3Å; Y722-I741 HydrophobicContact CE2-CG1 4Å; Y722-I741 HydrophobicContact CG-CD1 4.33Å; S732-I741 VanDerWaalsContact CA-CD1 3.45Å; S732-I741 VanDerWaalsContact O-CD1 3.25Å; S732-I741 WeakPolarHBondContact O-CD1 3.27Å; W735-I741 HydrophobicContact CB-CD1 4.32Å; G739-I741 VanDerWaalsContact C-N 3.28Å; G739-I741 PolarHBondContact O-N 3.36Å; I741-F763 HydrophobicContact CG2-CE2 4.12Å; I741-F763 HydrophobicContact CG2-CZ 3.96Å
742	D	84.9	Confident	87.6	Confident	97 Å²	97	63.5 Å²	63.5	52%	0.519	33%	0.331	S	S	.	.			trans	-72.2	146.7	177.9	-72.3	-25.6	0	0	0	111.9	R719 T744 S745	R719-D742 IonicContact NH2-OD2 3.31Å; D742-T744 WeakPolarHBondContact CB-OG1 3.49Å; D742-T744 PolarHBondContact O-N 3.43Å; D742-T744 VanDerWaalsContact O-N 3.08Å; D742-S745 WeakPolarHBondContact O-CB 3.47Å; D742-S745 PolarHBondContact O-N 2.93Å; D742-S745 VanDerWaalsContact O-N 3.09Å; D742-S745 PolarHBondContact O-OG 3.43Å
743	L	86.7	Confident	87.6	Confident	93 Å²	93	66.8 Å²	66.8	49%	0.487	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-60.5	-17.4	168.1	-158.7	75.8	0	0	0	112.9	S745 L746 K760 F763	L743-S745 VanDerWaalsContact C-N 3.29Å; L743-S745 PolarHBondContact O-N 2.91Å; L743-L746 HydrophobicContact CD1-CD1 4.05Å; L743-L746 PolarHBondContact O-N 3.47Å; L743-K760 HydrophobicContact CD1-CB 4.43Å; L743-K760 HydrophobicContact CD1-CG 4.08Å; L743-K760 HydrophobicContact CD2-CD 4.25Å; L743-K760 HydrophobicContact CD2-CG 4.5Å; L743-K760 HydrophobicContact CG-CD 4.25Å; L743-K760 HydrophobicContact CG-CG 4.13Å; L743-F763 HydrophobicContact CD1-CD1 3.91Å; L743-F763 HydrophobicContact CD1-CE1 4.35Å
744	T	84.7	Confident	87.6	Confident	54 Å²	54	74.2 Å²	74.2	33%	0.331	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-70.4	-21.3	175.9	61.8	0	0	0	0	113.4	R719 D742 L746 N747	R719-T744 PolarHBondContact NE-OG1 3.27Å; D742-T744 WeakPolarHBondContact CB-OG1 3.49Å; D742-T744 PolarHBondContact O-N 3.43Å; D742-T744 VanDerWaalsContact O-N 3.08Å; T744-L746 PolarHBondContact O-N 3.02Å; T744-N747 WeakPolarHBondContact O-CB 3.43Å; T744-N747 PolarHBondContact O-N 2.78Å
745	S	85	Confident	87.6	Confident	2 Å²	2	71.2 Å²	71.2	1%	0.014	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-61.7	-29.4	174.9	61.5	0	0	0	0	113.2	R694 D742 L743	R694-S745 PolarHBondContact NH1-O 3.27Å; R694-S745 VanDerWaalsContact NH1-O 3.09Å; D742-S745 WeakPolarHBondContact O-CB 3.47Å; D742-S745 PolarHBondContact O-N 2.93Å; D742-S745 VanDerWaalsContact O-N 3.09Å; D742-S745 PolarHBondContact O-OG 3.43Å; L743-S745 VanDerWaalsContact C-N 3.29Å; L743-S745 PolarHBondContact O-N 2.91Å
746	L	86.4	Confident	87.6	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-83.4	-9.4	-179.7	-61.8	173.3	0	0	0	113.5	F683 Y687 F723 L743 T744 K760 F763	F683-L746 HydrophobicContact CE1-CD2 4.15Å; Y687-L746 HydrophobicContact CE2-CD2 3.87Å; Y687-L746 WeakPolarHBondContact OH-CB 3.23Å; Y687-L746 PolarHBondContact OH-O 3.03Å; F723-L746 HydrophobicContact CD2-CD2 3.94Å; F723-L746 HydrophobicContact CE1-CD2 4.47Å; F723-L746 HydrophobicContact CE2-CD2 3.64Å; F723-L746 HydrophobicContact CE2-CG 4.42Å; F723-L746 HydrophobicContact CG-CD2 4.48Å; F723-L746 HydrophobicContact CZ-CD2 3.94Å; L743-L746 HydrophobicContact CD1-CD1 4.05Å; L743-L746 PolarHBondContact O-N 3.47Å; T744-L746 PolarHBondContact O-N 3.02Å; L746-K760 HydrophobicContact CB-CG 4.13Å; L746-K760 HydrophobicContact CD1-CG 4Å; L746-F763 HydrophobicContact CD1-CB 3.59Å; L746-F763 HydrophobicContact CD1-CD1 4.09Å; L746-F763 HydrophobicContact CD1-CD2 4.35Å; L746-F763 HydrophobicContact CD1-CG 3.77Å
747	N	85.2	Confident	87.7	Confident	62 Å²	62	73.7 Å²	73.7	33%	0.332	40%	0.397	S	S	.	.			trans	-66.1	143	177.5	-67.4	2.7	0	0	0	110.8	R694 T744 E756 K760	R694-N747 PolarHBondContact NH2-O 3.49Å; T744-N747 WeakPolarHBondContact O-CB 3.43Å; T744-N747 PolarHBondContact O-N 2.78Å; N747-E756 VanDerWaalsContact CA-OE2 3.3Å; N747-E756 WeakPolarHBondContact CA-OE2 3.42Å; N747-K760 WeakPolarHBondContact OD1-CE 3.28Å; N747-K760 PolarHBondContact OD1-NZ 3.46Å
748	L	83.2	Confident	88	Confident	26 Å²	26	73.8 Å²	73.8	14%	0.136	39%	0.393	C	S	.	.			trans	-101.7	148.3	-180	-67.4	177.7	0	0	0	112.5	Y687 Y690 Y750 H752 T755 E756	Y687-L748 HydrophobicContact CD1-CD2 4.11Å; Y687-L748 HydrophobicContact CE1-CD2 3.78Å; Y687-L748 HydrophobicContact CE1-CG 4.44Å; Y690-L748 HydrophobicContact CD1-CD1 4.43Å; Y690-L748 HydrophobicContact CD1-CD2 3.73Å; Y690-L748 HydrophobicContact CD2-CD2 3.98Å; Y690-L748 HydrophobicContact CE1-CD1 4.12Å; Y690-L748 HydrophobicContact CE1-CD2 4.25Å; Y690-L748 HydrophobicContact CE2-CD1 4.25Å; Y690-L748 HydrophobicContact CE2-CD2 4.49Å; Y690-L748 HydrophobicContact CG-CD2 3.55Å; L748-Y750 VanDerWaalsContact C-N 3.31Å; L748-Y750 WeakPolarHBondContact CB-O 3.41Å; L748-H752 HydrophobicContact CD1-CB 4.16Å; L748-T755 HydrophobicContact CD1-CG2 4.02Å; L748-E756 HydrophobicContact CD1-CB 4.34Å; L748-E756 HydrophobicContact CG-CB 4.47Å; L748-E756 PolarHBondContact N-OE2 2.69Å
749	E	78.6	Confident	88.1	Confident	111 Å²	111	67.1 Å²	67.1	52%	0.519	37%	0.367	S	S	.	.	S	Bend	trans	-70.6	-29.2	172.6	-175.3	179.4	-172.1	0	0	111.8	N693 N697	N693-E749 PolarHBondContact ND2-OE2 2.99Å; N697-E749 PolarHBondContact ND2-OE1 2.82Å; N697-E749 PolarHBondContact ND2-OE2 3.04Å
750	Y	84	Confident	88.3	Confident	90 Å²	90	66.6 Å²	66.6	35%	0.353	35%	0.346	S	S	.	.	S	Bend	trans	-95.4	147.6	174.2	-60.1	-76.9	0	0	0	110.6	Y690 N693 L748 H752	Y690-Y750 HydrophobicContact CD1-CD2 4.13Å; Y690-Y750 HydrophobicContact CE1-CD2 4.07Å; N693-Y750 PolarHBondContact ND2-OH 3.18Å; L748-Y750 VanDerWaalsContact C-N 3.31Å; L748-Y750 WeakPolarHBondContact CB-O 3.41Å; Y750-H752 VanDerWaalsContact CB-CD2 3.46Å; Y750-H752 WeakPolarHBondContact CB-CD2 3.36Å; Y750-H752 PolarHBondContact O-N 2.87Å
751	P	86.1	Confident	88.5	Confident	127 Å²	127	65.6 Å²	65.6	83%	0.825	34%	0.341	S	S	*	.			trans	-74	39	-178.1	32.5	-37.6	0	0	0	114.1	A753	P751-A753 PolarHBondContact O-N 2.82Å
752	H	90.1	Very high	88.8	Confident	88 Å²	88	66.5 Å²	66.5	41%	0.407	35%	0.347	S	S	.	.			trans	-82.4	62.8	176.8	-61.8	-43.8	0	0	0	111.1	Y690 L748 Y750 F754 T755 E756	Y690-H752 AromaticContact CE1-CD2 3.87Å; Y690-H752 PolarHBondContact OH-CD2 3.41Å; Y690-H752 VanDerWaalsContact OH-CD2 3.24Å; L748-H752 HydrophobicContact CD1-CB 4.16Å; Y750-H752 VanDerWaalsContact CB-CD2 3.46Å; Y750-H752 WeakPolarHBondContact CB-CD2 3.36Å; Y750-H752 PolarHBondContact O-N 2.87Å; H752-F754 PolarHBondContact O-N 3.39Å; H752-T755 PolarHBondContact O-N 3.4Å; H752-E756 PolarHBondContact O-N 3.23Å; H752-E756 VanDerWaalsContact O-N 3.11Å
753	A	89.9	Confident	89.2	Confident	71 Å²	71	62.9 Å²	62.9	59%	0.587	33%	0.327	S	S	*	.	H	α-helix	trans	-52.7	-30.1	-176.5	0	0	0	0	0	113.7	P751 F757	P751-A753 PolarHBondContact O-N 2.82Å; A753-F757 WeakPolarHBondContact O-CB 3.41Å; A753-F757 PolarHBondContact O-N 3.41Å
754	F	93.2	Very high	89.5	Confident	157 Å²	157	60.2 Å²	60.2	69%	0.689	32%	0.322	S	S	*	.	H	α-helix	trans	-67	-44.8	174.1	-177	-100.9	0	0	0	113	H752 F757 V758	H752-F754 PolarHBondContact O-N 3.39Å; F754-F757 PolarHBondContact O-N 3.2Å; F754-V758 HydrophobicContact CD1-CG2 4.29Å; F754-V758 HydrophobicContact CE1-CG2 3.85Å; F754-V758 HydrophobicContact CE2-CG2 4.22Å; F754-V758 HydrophobicContact CZ-CG2 3.82Å; F754-V758 WeakPolarHBondContact O-CG2 3.42Å; F754-V758 PolarHBondContact O-N 3.28Å
755	T	91.7	Very high	89.9	Confident	28 Å²	28	60.5 Å²	60.5	17%	0.172	32%	0.324	C	S	.	.	H	α-helix	trans	-66.5	-41.1	177	-54.6	0	0	0	0	111.1	L686 Y690 L748 H752 V758 G759	L686-T755 HydrophobicContact CD1-CG2 3.88Å; L686-T755 HydrophobicContact CG-CG2 4.18Å; Y690-T755 HydrophobicContact CE2-CG2 3.81Å; L748-T755 HydrophobicContact CD1-CG2 4.02Å; H752-T755 PolarHBondContact O-N 3.4Å; T755-V758 PolarHBondContact O-N 3.5Å; T755-G759 PolarHBondContact O-N 3.23Å
756	E	91.4	Very high	90.4	Very high	47 Å²	47	60.4 Å²	60.4	22%	0.22	32%	0.323	C	S	.	.	H	α-helix	trans	-62.2	-43.3	174.4	-174	179.2	118.1	0	0	111.8	N747 L748 H752 G759 K760	N747-E756 VanDerWaalsContact CA-OE2 3.3Å; N747-E756 WeakPolarHBondContact CA-OE2 3.42Å; L748-E756 HydrophobicContact CD1-CB 4.34Å; L748-E756 HydrophobicContact CG-CB 4.47Å; L748-E756 PolarHBondContact N-OE2 2.69Å; H752-E756 PolarHBondContact O-N 3.23Å; H752-E756 VanDerWaalsContact O-N 3.11Å; E756-G759 PolarHBondContact O-N 3.17Å; E756-K760 HydrophobicContact CG-CD 4.03Å; E756-K760 WeakPolarHBondContact O-CB 3.42Å; E756-K760 VanDerWaalsContact O-CG 3.32Å; E756-K760 WeakPolarHBondContact O-CG 3.47Å; E756-K760 PolarHBondContact O-N 3.28Å; E756-K760 IonicContact OE1-NZ 2.96Å; E756-K760 PolarHBondContact OE1-NZ 3.01Å
757	F	93.8	Very high	90.8	Very high	127 Å²	127	61.4 Å²	61.4	56%	0.557	33%	0.33	S	S	*	.	H	α-helix	trans	-61.1	-46.7	174.1	173.8	-99.6	0	0	0	111.9	A753 F754 G759 K760 L761	A753-F757 WeakPolarHBondContact O-CB 3.41Å; A753-F757 PolarHBondContact O-N 3.41Å; F754-F757 PolarHBondContact O-N 3.2Å; F757-G759 VanDerWaalsContact C-N 3.32Å; F757-G759 PolarHBondContact O-N 3.36Å; F757-K760 PolarHBondContact O-N 2.92Å; F757-L761 HydrophobicContact CE1-CD2 4.18Å; F757-L761 HydrophobicContact CZ-CD2 4.46Å; F757-L761 WeakPolarHBondContact O-CB 3.42Å; F757-L761 PolarHBondContact O-N 3.22Å
758	V	95.1	Very high	91.1	Very high	39 Å²	39	65 Å²	65	24%	0.236	34%	0.34	C	S	.	.	H	α-helix	trans	-62.2	-39	176.4	170.2	0	0	0	0	111.4	L686 F754 T755 L761 T762	L686-V758 HydrophobicContact CD1-CG1 4Å; L686-V758 HydrophobicContact CD2-CG1 4.09Å; F754-V758 HydrophobicContact CD1-CG2 4.29Å; F754-V758 HydrophobicContact CE1-CG2 3.85Å; F754-V758 HydrophobicContact CE2-CG2 4.22Å; F754-V758 HydrophobicContact CZ-CG2 3.82Å; F754-V758 WeakPolarHBondContact O-CG2 3.42Å; F754-V758 PolarHBondContact O-N 3.28Å; T755-V758 PolarHBondContact O-N 3.5Å; V758-L761 PolarHBondContact O-N 3.36Å; V758-T762 VanDerWaalsContact O-CB 3.32Å; V758-T762 WeakPolarHBondContact O-CB 3.49Å; V758-T762 PolarHBondContact O-N 3.3Å; V758-T762 PolarHBondContact O-OG1 2.84Å
759	G	93	Very high	91.7	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-65.8	-45.9	176	0	0	0	0	0	112.6	L686 T755 E756 F757 L761 T762 F763	L686-G759 VanDerWaalsContact CD2-CA 3.42Å; T755-G759 PolarHBondContact O-N 3.23Å; E756-G759 PolarHBondContact O-N 3.17Å; F757-G759 VanDerWaalsContact C-N 3.32Å; F757-G759 PolarHBondContact O-N 3.36Å; G759-L761 PolarHBondContact O-N 2.85Å; G759-T762 PolarHBondContact O-N 3.27Å; G759-F763 WeakPolarHBondContact O-CB 3.35Å; G759-F763 PolarHBondContact O-N 3.28Å
760	K	93.6	Very high	92.3	Very high	53 Å²	53	61.5 Å²	61.5	23%	0.23	33%	0.325	C	S	.	.	H	α-helix	trans	-64.4	-37.4	174.9	-71	173.6	179.2	175.8	0	112.3	L743 L746 N747 E756 F757 F763 G764	L743-K760 HydrophobicContact CD1-CB 4.43Å; L743-K760 HydrophobicContact CD1-CG 4.08Å; L743-K760 HydrophobicContact CD2-CD 4.25Å; L743-K760 HydrophobicContact CD2-CG 4.5Å; L743-K760 HydrophobicContact CG-CD 4.25Å; L743-K760 HydrophobicContact CG-CG 4.13Å; L746-K760 HydrophobicContact CB-CG 4.13Å; L746-K760 HydrophobicContact CD1-CG 4Å; N747-K760 WeakPolarHBondContact OD1-CE 3.28Å; N747-K760 PolarHBondContact OD1-NZ 3.46Å; E756-K760 HydrophobicContact CG-CD 4.03Å; E756-K760 WeakPolarHBondContact O-CB 3.42Å; E756-K760 VanDerWaalsContact O-CG 3.32Å; E756-K760 WeakPolarHBondContact O-CG 3.47Å; E756-K760 PolarHBondContact O-N 3.28Å; E756-K760 IonicContact OE1-NZ 2.96Å; E756-K760 PolarHBondContact OE1-NZ 3.01Å; F757-K760 PolarHBondContact O-N 2.92Å; K760-F763 PolarHBondContact O-N 3.36Å; K760-G764 PolarHBondContact O-N 2.98Å
761	L	94.1	Very high	92.5	Very high	92 Å²	92	60.3 Å²	60.3	48%	0.482	32%	0.322	S	S	.	.	H	α-helix	trans	-66	-45.6	173.6	-178.2	63.9	0	0	0	111.6	F757 V758 G759 F763 G764 T765	F757-L761 HydrophobicContact CE1-CD2 4.18Å; F757-L761 HydrophobicContact CZ-CD2 4.46Å; F757-L761 WeakPolarHBondContact O-CB 3.42Å; F757-L761 PolarHBondContact O-N 3.22Å; V758-L761 PolarHBondContact O-N 3.36Å; G759-L761 PolarHBondContact O-N 2.85Å; L761-F763 VanDerWaalsContact C-N 3.3Å; L761-F763 PolarHBondContact O-N 3.41Å; L761-G764 PolarHBondContact O-N 3.32Å; L761-T765 PolarHBondContact O-N 2.04Å; L761-T765 PolarHBondContact O-OG1 2.88Å
762	T	93.5	Very high	92.8	Very high	32 Å²	32	58.6 Å²	58.6	20%	0.196	31%	0.305	C	S	.	.	H	α-helix	trans	-62.3	-37.9	176.4	-57.2	0	0	0	0	111.4	F679 F683 V758 G759 T765 Y766	F679-T762 HydrophobicContact CD1-CG2 3.81Å; F679-T762 HydrophobicContact CE1-CG2 3.95Å; F683-T762 HydrophobicContact CD2-CG2 4.46Å; F683-T762 HydrophobicContact CE1-CG2 4.18Å; F683-T762 HydrophobicContact CE2-CG2 3.89Å; F683-T762 HydrophobicContact CZ-CG2 3.74Å; V758-T762 VanDerWaalsContact O-CB 3.32Å; V758-T762 WeakPolarHBondContact O-CB 3.49Å; V758-T762 PolarHBondContact O-N 3.3Å; V758-T762 PolarHBondContact O-OG1 2.84Å; G759-T762 PolarHBondContact O-N 3.27Å; T762-T765 WeakPolarHBondContact CA-OG1 3.27Å; T762-T765 PolarHBondContact O-N 3.27Å; T762-T765 PolarHBondContact O-OG1 3.4Å; T762-Y766 WeakPolarHBondContact O-CB 3.42Å; T762-Y766 PolarHBondContact O-N 3.04Å
763	F	94.1	Very high	92.9	Very high	22 Å²	22	56.7 Å²	56.7	10%	0.096	30%	0.299	C	S	.	.	H	α-helix	trans	-68.9	-39.7	174.5	-173.6	-104.3	0	0	0	112.3	F683 F723 I741 L743 L746 G759 K760 L761 Y766 S767	F683-F763 HydrophobicContact CE1-CB 4.41Å; F683-F763 HydrophobicContact CZ-CB 3.86Å; F683-F763 HydrophobicContact CZ-CD2 4.25Å; F723-F763 HydrophobicContact CZ-CD2 4.39Å; F723-F763 HydrophobicContact CZ-CE2 4.48Å; I741-F763 HydrophobicContact CG2-CE2 4.12Å; I741-F763 HydrophobicContact CG2-CZ 3.96Å; L743-F763 HydrophobicContact CD1-CD1 3.91Å; L743-F763 HydrophobicContact CD1-CE1 4.35Å; L746-F763 HydrophobicContact CD1-CB 3.59Å; L746-F763 HydrophobicContact CD1-CD1 4.09Å; L746-F763 HydrophobicContact CD1-CD2 4.35Å; L746-F763 HydrophobicContact CD1-CG 3.77Å; G759-F763 WeakPolarHBondContact O-CB 3.35Å; G759-F763 PolarHBondContact O-N 3.28Å; K760-F763 PolarHBondContact O-N 3.36Å; L761-F763 VanDerWaalsContact C-N 3.3Å; L761-F763 PolarHBondContact O-N 3.41Å; F763-Y766 PolarHBondContact O-N 3.45Å; F763-S767 WeakPolarHBondContact O-CB 3.13Å; F763-S767 PolarHBondContact O-N 3.43Å; F763-S767 PolarHBondContact O-OG 2.92Å
764	G	93.2	Very high	93.1	Very high	37 Å²	37	53.9 Å²	53.9	38%	0.381	27%	0.274	S	S	.	.	H	α-helix	trans	-60.7	-43.2	171.9	0	0	0	0	0	112.7	K760 L761 S767 Y768	K760-G764 PolarHBondContact O-N 2.98Å; L761-G764 PolarHBondContact O-N 3.32Å; G764-S767 PolarHBondContact O-N 3.28Å; G764-Y768 VanDerWaalsContact O-CB 3.32Å; G764-Y768 WeakPolarHBondContact O-CB 3.41Å; G764-Y768 PolarHBondContact O-N 3.02Å
765	T	93.8	Very high	93	Very high	60 Å²	60	50.5 Å²	50.5	37%	0.368	26%	0.263	S	S	.	.	H	α-helix	trans	-70.6	-38.3	177.2	56.4	0	0	0	0	112.6	L761 T762 Y768 I769	L761-T765 PolarHBondContact O-N 2.04Å; L761-T765 PolarHBondContact O-OG1 2.88Å; T762-T765 WeakPolarHBondContact CA-OG1 3.27Å; T762-T765 PolarHBondContact O-N 3.27Å; T762-T765 PolarHBondContact O-OG1 3.4Å; T765-Y768 PolarHBondContact O-N 3.24Å; T765-I769 VanDerWaalsContact O-CG1 3.3Å; T765-I769 WeakPolarHBondContact O-CG1 3.25Å; T765-I769 PolarHBondContact O-N 3.38Å
766	Y	95.2	Very high	93	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-57.4	-52.3	169.6	171.2	-103.3	0	0	0	111.3	Y672 F679 L733 T762 F763 Y768 I769 A770 F771	Y672-Y766 PolarHBondContact OH-OH 3Å; F679-Y766 HydrophobicContact CB-CD2 3.89Å; F679-Y766 HydrophobicContact CD1-CD2 4.43Å; F679-Y766 AromaticContact CD2-CD2 3.73Å; F679-Y766 HydrophobicContact CD2-CD2 3.73Å; F679-Y766 HydrophobicContact CE2-CD2 4.37Å; F679-Y766 AromaticContact CG-CD2 3.76Å; F679-Y766 HydrophobicContact CG-CD2 3.76Å; F679-Y766 HydrophobicContact CG-CG 4.28Å; L733-Y766 HydrophobicContact CB-CE1 4.18Å; L733-Y766 HydrophobicContact CB-CE2 4.43Å; L733-Y766 HydrophobicContact CD2-CD1 3.8Å; L733-Y766 HydrophobicContact CD2-CD2 4.39Å; L733-Y766 HydrophobicContact CD2-CE1 3.82Å; L733-Y766 HydrophobicContact CD2-CE2 4.41Å; L733-Y766 HydrophobicContact CD2-CG 4.09Å; L733-Y766 PolarHBondContact O-OH 3.33Å; T762-Y766 WeakPolarHBondContact O-CB 3.42Å; T762-Y766 PolarHBondContact O-N 3.04Å; F763-Y766 PolarHBondContact O-N 3.45Å; Y766-Y768 VanDerWaalsContact C-N 3.33Å; Y766-Y768 PolarHBondContact O-N 3.26Å; Y766-I769 PolarHBondContact O-N 3.1Å; Y766-A770 HydrophobicContact CE1-CB 4.47Å; Y766-A770 HydrophobicContact CE2-CB 4.3Å; Y766-A770 VanDerWaalsContact O-CB 3.31Å; Y766-A770 WeakPolarHBondContact O-CB 3.37Å; Y766-A770 PolarHBondContact O-N 2.84Å; Y766-F771 HydrophobicContact CE1-CE1 4.22Å; Y766-F771 HydrophobicContact CE1-CZ 4.1Å
767	S	93.1	Very high	93.1	Very high	20 Å²	20	56.7 Å²	56.7	14%	0.14	29%	0.294	C	S	.	.	H	α-helix	trans	-62.8	-38.5	-178.3	-57.9	0	0	0	0	112.2	F763 G764 F771	F763-S767 WeakPolarHBondContact O-CB 3.13Å; F763-S767 PolarHBondContact O-N 3.43Å; F763-S767 PolarHBondContact O-OG 2.92Å; G764-S767 PolarHBondContact O-N 3.28Å; S767-F771 VanDerWaalsContact O-CB 3.26Å; S767-F771 WeakPolarHBondContact O-CB 3.44Å; S767-F771 WeakPolarHBondContact O-CD2 3.39Å; S767-F771 VanDerWaalsContact O-CG 3.25Å; S767-F771 WeakPolarHBondContact O-CG 3.46Å; S767-F771 PolarHBondContact O-N 3.26Å; S767-F771 WeakPolarHBondContact OG-CE2 3.3Å
768	Y	93.4	Very high	93.1	Very high	139 Å²	139	52.4 Å²	52.4	55%	0.545	28%	0.277	S	S	.	.	I	π-helix	trans	-61.5	-49.4	173.1	178.6	-91	0	0	0	111.7	G764 T765 Y766 I772 V773	G764-Y768 VanDerWaalsContact O-CB 3.32Å; G764-Y768 WeakPolarHBondContact O-CB 3.41Å; G764-Y768 PolarHBondContact O-N 3.02Å; T765-Y768 PolarHBondContact O-N 3.24Å; Y766-Y768 VanDerWaalsContact C-N 3.33Å; Y766-Y768 PolarHBondContact O-N 3.26Å; Y768-I772 HydrophobicContact CD2-CB 4.5Å; Y768-I772 HydrophobicContact CD2-CD1 3.9Å; Y768-I772 HydrophobicContact CE2-CD1 4.33Å; Y768-I772 WeakPolarHBondContact O-CA 3.49Å; Y768-I772 WeakPolarHBondContact O-CB 3.48Å; Y768-I772 PolarHBondContact O-N 3.36Å; Y768-I772 VanDerWaalsContact O-N 3.08Å; Y768-V773 HydrophobicContact CD1-CG2 4.1Å; Y768-V773 HydrophobicContact CE1-CG2 3.7Å; Y768-V773 PolarHBondContact O-N 3.43Å; Y768-V773 VanDerWaalsContact O-N 3.08Å
769	I	94	Very high	93	Very high	57 Å²	57	54.3 Å²	54.3	29%	0.292	29%	0.285	S	S	.	.	I	π-helix	trans	-66.2	-47	-179.6	-67.3	167.3	0	0	0	110.6	V675 F679 T765 Y766 V773 L774	V675-I769 HydrophobicContact CG1-CG2 3.98Å; F679-I769 HydrophobicContact CE2-CD1 3.96Å; F679-I769 HydrophobicContact CZ-CD1 3.96Å; T765-I769 VanDerWaalsContact O-CG1 3.3Å; T765-I769 WeakPolarHBondContact O-CG1 3.25Å; T765-I769 PolarHBondContact O-N 3.38Å; Y766-I769 PolarHBondContact O-N 3.1Å; I769-V773 WeakPolarHBondContact O-CB 3.38Å; I769-V773 PolarHBondContact O-N 3.48Å; I769-L774 HydrophobicContact CG2-CD1 4.39Å; I769-L774 HydrophobicContact CG2-CG 4.4Å; I769-L774 WeakPolarHBondContact O-CB 3.47Å; I769-L774 WeakPolarHBondContact O-CG 3.41Å; I769-L774 PolarHBondContact O-N 2.97Å
770	A	91.2	Very high	93.1	Very high	6 Å²	6	57.2 Å²	57.2	5%	0.05	31%	0.309	C	S	.	.	I	π-helix	trans	-70.5	-49.4	-177.1	0	0	0	0	0	112.8	Y672 Y766 L775	Y672-A770 HydrophobicContact CE2-CB 4.19Å; Y766-A770 HydrophobicContact CE1-CB 4.47Å; Y766-A770 HydrophobicContact CE2-CB 4.3Å; Y766-A770 VanDerWaalsContact O-CB 3.31Å; Y766-A770 WeakPolarHBondContact O-CB 3.37Å; Y766-A770 PolarHBondContact O-N 2.84Å; A770-L775 PolarHBondContact O-N 3.01Å
771	F	89.4	Confident	93	Very high	65 Å²	65	58.3 Å²	58.3	29%	0.285	32%	0.316	S	S	.	.	I	π-helix	trans	-96.3	-21.7	-166.7	-40.7	-25	0	0	0	113.1	S736 A737 Y766 S767 L775	S736-F771 WeakPolarHBondContact O-CZ 3.48Å; A737-F771 VanDerWaalsContact CA-CE1 3.41Å; A737-F771 HydrophobicContact CB-CD1 4.47Å; A737-F771 HydrophobicContact CB-CE1 3.73Å; A737-F771 HydrophobicContact CB-CZ 4.37Å; Y766-F771 HydrophobicContact CE1-CE1 4.22Å; Y766-F771 HydrophobicContact CE1-CZ 4.1Å; S767-F771 VanDerWaalsContact O-CB 3.26Å; S767-F771 WeakPolarHBondContact O-CB 3.44Å; S767-F771 WeakPolarHBondContact O-CD2 3.39Å; S767-F771 VanDerWaalsContact O-CG 3.25Å; S767-F771 WeakPolarHBondContact O-CG 3.46Å; S767-F771 PolarHBondContact O-N 3.26Å; S767-F771 WeakPolarHBondContact OG-CE2 3.3Å; F771-L775 WeakPolarHBondContact O-CB 3.32Å
772	I	91.4	Very high	92.9	Very high	90 Å²	90	57.1 Å²	57.1	46%	0.462	31%	0.309	S	S	.	.	I	π-helix	trans	-106.9	-47.3	178.3	-54.6	180	0	0	0	111.2	Y768 N776	Y768-I772 HydrophobicContact CD2-CB 4.5Å; Y768-I772 HydrophobicContact CD2-CD1 3.9Å; Y768-I772 HydrophobicContact CE2-CD1 4.33Å; Y768-I772 WeakPolarHBondContact O-CA 3.49Å; Y768-I772 WeakPolarHBondContact O-CB 3.48Å; Y768-I772 PolarHBondContact O-N 3.36Å; Y768-I772 VanDerWaalsContact O-N 3.08Å; I772-N776 WeakPolarHBondContact O-CB 3.19Å; I772-N776 PolarHBondContact O-ND2 3.06Å
773	V	93.3	Very high	92.8	Very high	49 Å²	49	60.3 Å²	60.3	30%	0.297	32%	0.324	S	S	.	.	I	π-helix	trans	-78.6	-60.4	-179.1	-174.1	0	0	0	0	111.2	Y768 I769 M777	Y768-V773 HydrophobicContact CD1-CG2 4.1Å; Y768-V773 HydrophobicContact CE1-CG2 3.7Å; Y768-V773 PolarHBondContact O-N 3.43Å; Y768-V773 VanDerWaalsContact O-N 3.08Å; I769-V773 WeakPolarHBondContact O-CB 3.38Å; I769-V773 PolarHBondContact O-N 3.48Å; V773-M777 HydrophobicContact CG1-CE 3.87Å; V773-M777 HydrophobicContact CG1-SD 4.1Å; V773-M777 WeakPolarHBondContact O-CG 3.48Å; V773-M777 PolarHBondContact O-N 3.04Å; V773-M777 VanDerWaalsContact O-N 3.1Å
774	L	93	Very high	92.8	Very high	12 Å²	12	63.5 Å²	63.5	6%	0.063	34%	0.342	C	S	.	.	I	π-helix	trans	-68.1	-43.8	-173.3	-69	179.9	0	0	0	112.5	F668 V671 Y672 V675 I769 N776 M777 L778	F668-L774 HydrophobicContact CE1-CB 4.07Å; F668-L774 HydrophobicContact CE1-CD2 4.42Å; F668-L774 HydrophobicContact CE2-CD2 4.39Å; F668-L774 HydrophobicContact CZ-CB 3.77Å; F668-L774 HydrophobicContact CZ-CD2 3.71Å; F668-L774 HydrophobicContact CZ-CG 4.29Å; F668-L774 WeakPolarHBondContact CZ-O 3.47Å; V671-L774 HydrophobicContact CG1-CD2 4.34Å; Y672-L774 HydrophobicContact CD2-CD1 4.02Å; V675-L774 HydrophobicContact CB-CD1 4.43Å; V675-L774 HydrophobicContact CG2-CD1 4.23Å; I769-L774 HydrophobicContact CG2-CD1 4.39Å; I769-L774 HydrophobicContact CG2-CG 4.4Å; I769-L774 WeakPolarHBondContact O-CB 3.47Å; I769-L774 WeakPolarHBondContact O-CG 3.41Å; I769-L774 PolarHBondContact O-N 2.97Å; L774-N776 PolarHBondContact O-N 2.92Å; L774-M777 PolarHBondContact O-N 3.28Å; L774-L778 WeakPolarHBondContact O-CB 3.39Å; L774-L778 PolarHBondContact O-N 3.28Å
775	L	91.9	Very high	92.7	Very high	86 Å²	86	62.3 Å²	62.3	45%	0.45	33%	0.328	S	S	.	.	H	α-helix	trans	-60.1	-43.3	178.9	-175.2	60.7	0	0	0	112.8	A770 F771 L778 I779	A770-L775 PolarHBondContact O-N 3.01Å; F771-L775 WeakPolarHBondContact O-CB 3.32Å; L775-L778 PolarHBondContact O-N 3.43Å; L775-I779 HydrophobicContact CD1-CD1 4.31Å; L775-I779 HydrophobicContact CG-CD1 4.08Å; L775-I779 WeakPolarHBondContact O-CG1 3.34Å; L775-I779 PolarHBondContact O-N 3.46Å
776	N	92.6	Very high	92.6	Very high	97 Å²	97	64.7 Å²	64.7	52%	0.519	33%	0.331	S	S	.	.	H	α-helix	trans	-68.2	-36.5	176.9	-76.2	-50.3	0	0	0	112.2	I772 L774 I779 A780	I772-N776 WeakPolarHBondContact O-CB 3.19Å; I772-N776 PolarHBondContact O-ND2 3.06Å; L774-N776 PolarHBondContact O-N 2.92Å; N776-I779 PolarHBondContact O-N 3.37Å; N776-A780 WeakPolarHBondContact O-CB 3.34Å; N776-A780 PolarHBondContact O-N 2.86Å
777	M	92.2	Very high	92.5	Very high	108 Å²	108	71.7 Å²	71.7	53%	0.532	36%	0.364	S	S	.	.	H	α-helix	trans	-63.7	-40.5	172.4	-74.2	-177.8	174.9	0	0	112.2	F668 V773 L774 A780 M781	F668-M777 HydrophobicContact CE2-CB 3.98Å; F668-M777 HydrophobicContact CZ-CB 4.27Å; V773-M777 HydrophobicContact CG1-CE 3.87Å; V773-M777 HydrophobicContact CG1-SD 4.1Å; V773-M777 WeakPolarHBondContact O-CG 3.48Å; V773-M777 PolarHBondContact O-N 3.04Å; V773-M777 VanDerWaalsContact O-N 3.1Å; L774-M777 PolarHBondContact O-N 3.28Å; M777-A780 PolarHBondContact O-N 3.41Å; M777-M781 VanDerWaalsContact O-CB 3.29Å; M777-M781 WeakPolarHBondContact O-CB 3.31Å; M777-M781 PolarHBondContact O-N 2.88Å
778	L	93.4	Very high	92.3	Very high	37 Å²	37	76.8 Å²	76.8	19%	0.194	39%	0.386	C	S	.	.	H	α-helix	trans	-63.9	-45.3	176.3	178.4	59.3	0	0	0	111.7	I665 F668 L774 L775 M781 M782	I665-L778 HydrophobicContact CG1-CD1 4.32Å; F668-L778 HydrophobicContact CB-CD1 4.1Å; F668-L778 HydrophobicContact CD1-CB 4.06Å; F668-L778 HydrophobicContact CD1-CD1 3.88Å; F668-L778 HydrophobicContact CD1-CD2 4.26Å; F668-L778 HydrophobicContact CD1-CG 4.28Å; F668-L778 HydrophobicContact CD2-CD1 4.49Å; F668-L778 HydrophobicContact CE1-CB 3.82Å; F668-L778 HydrophobicContact CE1-CD2 4.43Å; F668-L778 HydrophobicContact CE1-CG 4.48Å; F668-L778 HydrophobicContact CE2-CB 4.35Å; F668-L778 HydrophobicContact CG-CB 4.43Å; F668-L778 HydrophobicContact CG-CD1 3.88Å; F668-L778 HydrophobicContact CZ-CB 3.99Å; L774-L778 WeakPolarHBondContact O-CB 3.39Å; L774-L778 PolarHBondContact O-N 3.28Å; L775-L778 PolarHBondContact O-N 3.43Å; L778-M781 PolarHBondContact O-N 3.23Å; L778-M782 HydrophobicContact CD1-CG 4.12Å; L778-M782 HydrophobicContact CD1-SD 4.15Å; L778-M782 HydrophobicContact CG-SD 4.18Å; L778-M782 WeakPolarHBondContact O-CB 3.39Å; L778-M782 WeakPolarHBondContact O-CG 3.47Å; L778-M782 PolarHBondContact O-N 3.47Å
779	I	94	Very high	92.2	Very high	79 Å²	79	71 Å²	71	41%	0.405	36%	0.364	S	S	.	.	H	α-helix	trans	-62.3	-45.3	177.1	-67.4	164.3	0	0	0	110.7	L775 N776 M781 M782 N783	L775-I779 HydrophobicContact CD1-CD1 4.31Å; L775-I779 HydrophobicContact CG-CD1 4.08Å; L775-I779 WeakPolarHBondContact O-CG1 3.34Å; L775-I779 PolarHBondContact O-N 3.46Å; N776-I779 PolarHBondContact O-N 3.37Å; I779-M781 PolarHBondContact O-N 2.97Å; I779-M782 PolarHBondContact O-N 3.07Å; I779-N783 VanDerWaalsContact O-CG 3.26Å; I779-N783 PolarHBondContact O-N 2.78Å; I779-N783 PolarHBondContact O-ND2 3.24Å
780	A	94.1	Very high	92	Very high	60 Å²	60	71.7 Å²	71.7	50%	0.496	37%	0.371	S	S	.	.	H	α-helix	trans	-62.4	-41.1	176.7	0	0	0	0	0	112.4	N776 M777 N784	N776-A780 WeakPolarHBondContact O-CB 3.34Å; N776-A780 PolarHBondContact O-N 2.86Å; M777-A780 PolarHBondContact O-N 3.41Å; A780-N784 PolarHBondContact O-N 2.83Å
781	M	91.6	Very high	91.8	Very high	77 Å²	77	74.7 Å²	74.7	38%	0.379	40%	0.402	S	S	.	.	H	α-helix	trans	-65	-47.1	175.8	-173.8	179	-65.4	0	0	111.6	D664 F668 M777 L778 I779 N783 N784 S785	D664-M781 HydrophobicContact CB-SD 4.47Å; F668-M781 HydrophobicContact CD2-CE 4.02Å; F668-M781 HydrophobicContact CD2-SD 4.3Å; M777-M781 VanDerWaalsContact O-CB 3.29Å; M777-M781 WeakPolarHBondContact O-CB 3.31Å; M777-M781 PolarHBondContact O-N 2.88Å; L778-M781 PolarHBondContact O-N 3.23Å; I779-M781 PolarHBondContact O-N 2.97Å; M781-N783 VanDerWaalsContact C-N 3.34Å; M781-N783 PolarHBondContact O-N 2.73Å; M781-N784 PolarHBondContact O-N 3.38Å; M781-S785 PolarHBondContact O-N 3.29Å; M781-S785 PolarHBondContact O-OG 2.92Å
782	M	92.5	Very high	91.7	Very high	67 Å²	67	76.2 Å²	76.2	33%	0.33	41%	0.41	S	S	.	.	H	α-helix	trans	-60.9	-40.1	178.2	-77.4	-177.9	61.3	0	0	112.5	I665 L778 I779 Y786	I665-M782 HydrophobicContact CD1-CE 4.18Å; I665-M782 HydrophobicContact CD1-SD 4.01Å; I665-M782 HydrophobicContact CG1-CG 4.29Å; I665-M782 HydrophobicContact CG1-SD 4.14Å; L778-M782 HydrophobicContact CD1-CG 4.12Å; L778-M782 HydrophobicContact CD1-SD 4.15Å; L778-M782 HydrophobicContact CG-SD 4.18Å; L778-M782 WeakPolarHBondContact O-CB 3.39Å; L778-M782 WeakPolarHBondContact O-CG 3.47Å; L778-M782 PolarHBondContact O-N 3.47Å; I779-M782 PolarHBondContact O-N 3.07Å; M782-Y786 VanDerWaalsContact O-CB 3.24Å; M782-Y786 WeakPolarHBondContact O-CB 3.03Å; M782-Y786 PolarHBondContact O-N 3.27Å
783	N	92.6	Very high	91.7	Very high	99 Å²	99	72.5 Å²	72.5	53%	0.529	39%	0.392	S	S	.	.	H	α-helix	trans	-62.3	-47.1	176	-71	-18.2	0	0	0	111.5	I779 M781 Y786 E787	I779-N783 VanDerWaalsContact O-CG 3.26Å; I779-N783 PolarHBondContact O-N 2.78Å; I779-N783 PolarHBondContact O-ND2 3.24Å; M781-N783 VanDerWaalsContact C-N 3.34Å; M781-N783 PolarHBondContact O-N 2.73Å; N783-Y786 PolarHBondContact O-N 3.09Å; N783-E787 PolarHBondContact O-N 3.15Å
784	N	93	Very high	91.6	Very high	88 Å²	88	74 Å²	74	47%	0.471	40%	0.398	S	S	.	.	H	α-helix	trans	-63.3	-47.2	177.6	-175.1	17.9	0	0	0	112.1	A780 M781 Y786 E787 Q788	A780-N784 PolarHBondContact O-N 2.83Å; M781-N784 PolarHBondContact O-N 3.38Å; N784-Y786 VanDerWaalsContact C-N 3.3Å; N784-Y786 PolarHBondContact O-N 3.18Å; N784-E787 PolarHBondContact O-N 3.05Å; N784-Q788 WeakPolarHBondContact O-CG 3.43Å; N784-Q788 PolarHBondContact O-N 3.4Å; N784-Q788 VanDerWaalsContact O-N 3.08Å; N784-Q788 PolarHBondContact OD1-NE2 2.88Å
785	S	92.2	Very high	91.6	Very high	13 Å²	13	76 Å²	76	9%	0.091	41%	0.409	C	S	.	.	H	α-helix	trans	-60.4	-40.3	174.9	-67.9	0	0	0	0	111.3	D664 M781 Q788 I789	D664-S785 PolarHBondContact OD2-OG 3.19Å; M781-S785 PolarHBondContact O-N 3.29Å; M781-S785 PolarHBondContact O-OG 2.92Å; S785-Q788 PolarHBondContact O-N 3.49Å; S785-I789 VanDerWaalsContact O-CB 3.26Å; S785-I789 WeakPolarHBondContact O-CB 3.39Å; S785-I789 VanDerWaalsContact O-CD1 3.22Å; S785-I789 WeakPolarHBondContact O-CD1 3.48Å; S785-I789 WeakPolarHBondContact O-CG1 3.33Å; S785-I789 PolarHBondContact O-N 2.72Å
786	Y	91.8	Very high	91.6	Very high	109 Å²	109	72.5 Å²	72.5	43%	0.427	39%	0.39	S	S	.	.	H	α-helix	trans	-62.3	-47.7	176.8	-175.7	-103	0	0	0	112.2	M661 M782 N783 N784 Q788 I789 V790	M661-Y786 HydrophobicContact CE-CD2 4.05Å; M661-Y786 HydrophobicContact SD-CD2 3.91Å; M661-Y786 HydrophobicContact SD-CG 4.39Å; M782-Y786 VanDerWaalsContact O-CB 3.24Å; M782-Y786 WeakPolarHBondContact O-CB 3.03Å; M782-Y786 PolarHBondContact O-N 3.27Å; N783-Y786 PolarHBondContact O-N 3.09Å; N784-Y786 VanDerWaalsContact C-N 3.3Å; N784-Y786 PolarHBondContact O-N 3.18Å; Y786-Q788 PolarHBondContact O-N 3.42Å; Y786-I789 PolarHBondContact O-N 3.01Å; Y786-V790 HydrophobicContact CD1-CG2 3.91Å; Y786-V790 HydrophobicContact CD2-CG2 4.25Å; Y786-V790 HydrophobicContact CE1-CG2 3.54Å; Y786-V790 HydrophobicContact CE2-CG2 3.91Å; Y786-V790 HydrophobicContact CG-CG2 4.25Å; Y786-V790 WeakPolarHBondContact O-CB 3.46Å; Y786-V790 VanDerWaalsContact O-CG2 3.25Å; Y786-V790 WeakPolarHBondContact O-CG2 3.44Å; Y786-V790 PolarHBondContact O-N 3.42Å
787	E	92.6	Very high	91.6	Very high	148 Å²	148	68.6 Å²	68.6	69%	0.692	37%	0.368	S	S	*	.	H	α-helix	trans	-59	-44.6	177.3	-73.5	-175.2	170.1	0	0	112.2	N783 N784	N783-E787 PolarHBondContact O-N 3.15Å; N784-E787 PolarHBondContact O-N 3.05Å
788	Q	89.1	Confident	91.6	Very high	127 Å²	127	65.8 Å²	65.8	59%	0.593	35%	0.352	S	S	*	.	H	α-helix	trans	-63.7	-41.1	175.8	-68	176.4	35.6	0	0	112.5	N784 S785 Y786	N784-Q788 WeakPolarHBondContact O-CG 3.43Å; N784-Q788 PolarHBondContact O-N 3.4Å; N784-Q788 VanDerWaalsContact O-N 3.08Å; N784-Q788 PolarHBondContact OD1-NE2 2.88Å; S785-Q788 PolarHBondContact O-N 3.49Å; Y786-Q788 PolarHBondContact O-N 3.42Å
789	I	90	Very high	91.7	Very high	16 Å²	16	65.9 Å²	65.9	8%	0.082	35%	0.351	C	S	.	.	H	α-helix	trans	-68.4	-44.6	-179.1	-73.8	161.6	0	0	0	111	R660 M661 S785 Y786 G791 Q792 V793	R660-I789 HydrophobicContact CB-CD1 3.55Å; R660-I789 HydrophobicContact CB-CG1 4.21Å; M661-I789 HydrophobicContact CG-CD1 3.83Å; S785-I789 VanDerWaalsContact O-CB 3.26Å; S785-I789 WeakPolarHBondContact O-CB 3.39Å; S785-I789 VanDerWaalsContact O-CD1 3.22Å; S785-I789 WeakPolarHBondContact O-CD1 3.48Å; S785-I789 WeakPolarHBondContact O-CG1 3.33Å; S785-I789 PolarHBondContact O-N 2.72Å; Y786-I789 PolarHBondContact O-N 3.01Å; I789-G791 PolarHBondContact O-N 3Å; I789-G791 VanDerWaalsContact O-N 3.11Å; I789-Q792 PolarHBondContact O-N 2.76Å; I789-V793 HydrophobicContact CG2-CG2 3.44Å; I789-V793 VanDerWaalsContact CG2-CG2 3.44Å; I789-V793 WeakPolarHBondContact O-CG2 3.47Å; I789-V793 PolarHBondContact O-N 3.04Å; I789-V793 VanDerWaalsContact O-N 3.1Å
790	V	90	Very high	91.5	Very high	72 Å²	72	63.4 Å²	63.4	44%	0.436	34%	0.343	S	S	.	.	H	α-helix	trans	-51.8	-38.1	-173.4	159.7	0	0	0	0	113.1	Y786 Q792	Y786-V790 HydrophobicContact CD1-CG2 3.91Å; Y786-V790 HydrophobicContact CD2-CG2 4.25Å; Y786-V790 HydrophobicContact CE1-CG2 3.54Å; Y786-V790 HydrophobicContact CE2-CG2 3.91Å; Y786-V790 HydrophobicContact CG-CG2 4.25Å; Y786-V790 WeakPolarHBondContact O-CB 3.46Å; Y786-V790 VanDerWaalsContact O-CG2 3.25Å; Y786-V790 WeakPolarHBondContact O-CG2 3.44Å; Y786-V790 PolarHBondContact O-N 3.42Å; V790-Q792 PolarHBondContact O-N 2.94Å
791	G	87.1	Confident	91.3	Very high	69 Å²	69	62.4 Å²	62.4	71%	0.711	33%	0.326	S	S	*	.	H	α-helix	trans	-62.1	-20.4	177.7	0	0	0	0	0	115	I789	I789-G791 PolarHBondContact O-N 3Å; I789-G791 VanDerWaalsContact O-N 3.11Å
792	Q	87.5	Confident	91.3	Very high	98 Å²	98	58.8 Å²	58.8	46%	0.458	31%	0.308	S	S	.	.	H	α-helix	trans	-117.1	-15.9	-177.5	-59	-171.5	10.7	0	0	114.4	I789 V790 D794 I795 E796	I789-Q792 PolarHBondContact O-N 2.76Å; V790-Q792 PolarHBondContact O-N 2.94Å; Q792-D794 PolarHBondContact O-N 3.46Å; Q792-I795 WeakPolarHBondContact O-CB 3.48Å; Q792-I795 PolarHBondContact O-N 3.15Å; Q792-E796 WeakPolarHBondContact O-CG 3.35Å; Q792-E796 PolarHBondContact O-N 2.88Å; Q792-E796 PolarHBondContact OE1-OE1 3.47Å
793	V	91.9	Very high	91.2	Very high	12 Å²	12	60.1 Å²	60.1	7%	0.073	31%	0.312	C	S	.	.	H	α-helix	trans	-47.1	-43.9	-177.5	174.4	0	0	0	0	112.5	P653 I789 I795 E796 W797	P653-V793 VanDerWaalsContact CA-CG1 3.45Å; P653-V793 HydrophobicContact CB-CG1 3.57Å; P653-V793 VanDerWaalsContact O-CG1 3.26Å; P653-V793 WeakPolarHBondContact O-CG1 3.49Å; I789-V793 HydrophobicContact CG2-CG2 3.44Å; I789-V793 VanDerWaalsContact CG2-CG2 3.44Å; I789-V793 WeakPolarHBondContact O-CG2 3.47Å; I789-V793 PolarHBondContact O-N 3.04Å; I789-V793 VanDerWaalsContact O-N 3.1Å; V793-I795 VanDerWaalsContact C-N 3.3Å; V793-I795 PolarHBondContact O-N 3.46Å; V793-E796 PolarHBondContact O-N 3.02Å; V793-E796 VanDerWaalsContact O-N 3.09Å; V793-W797 WeakPolarHBondContact O-CB 3.45Å; V793-W797 PolarHBondContact O-N 3.01Å
794	D	91.1	Very high	90.9	Very high	80 Å²	80	55.8 Å²	55.8	43%	0.428	29%	0.289	S	S	.	.	H	α-helix	trans	-70.4	-27.4	-171.2	-151	50.1	0	0	0	112.8	Q792 K798	Q792-D794 PolarHBondContact O-N 3.46Å; D794-K798 WeakPolarHBondContact O-CD 3.28Å; D794-K798 WeakPolarHBondContact O-CE 3.39Å; D794-K798 WeakPolarHBondContact O-CG 3.12Å; D794-K798 PolarHBondContact O-NZ 3.35Å; D794-K798 VanDerWaalsContact OD2-CE 3.32Å; D794-K798 WeakPolarHBondContact OD2-CE 3.46Å; D794-K798 IonicContact OD2-NZ 3.99Å; D794-K798 PolarHBondContact OD2-NZ 2.89Å
795	I	92.7	Very high	90.7	Very high	55 Å²	55	52 Å²	52	28%	0.282	27%	0.268	S	S	.	.	H	α-helix	trans	-74.3	-39.6	171.7	-61.5	175.2	0	0	0	109.6	K409 Q410 A413 Q792 V793 K798 F799	K409-I795 HydrophobicContact CB-CG2 3.94Å; Q410-I795 HydrophobicContact CG-CG2 4.44Å; A413-I795 HydrophobicContact CB-CB 4.28Å; A413-I795 HydrophobicContact CB-CG2 3.7Å; Q792-I795 WeakPolarHBondContact O-CB 3.48Å; Q792-I795 PolarHBondContact O-N 3.15Å; V793-I795 VanDerWaalsContact C-N 3.3Å; V793-I795 PolarHBondContact O-N 3.46Å; I795-K798 PolarHBondContact O-N 3.21Å; I795-F799 PolarHBondContact O-N 3.26Å
796	E	91.7	Very high	90.4	Very high	11 Å²	11	52.5 Å²	52.5	5%	0.051	27%	0.27	C	S	.	.	H	α-helix	trans	-80.7	-36.9	-169.9	-66.8	175.9	156.5	0	0	112.8	K409 I656 R660 Q792 V793 F799 A800	K409-E796 HydrophobicContact CD-CG 4.09Å; K409-E796 IonicContact NZ-OE1 2.67Å; K409-E796 PolarHBondContact NZ-OE1 2.61Å; I656-E796 HydrophobicContact CG2-CB 4.19Å; R660-E796 IonicContact CZ-OE1 3.71Å; R660-E796 IonicContact CZ-OE2 3.38Å; R660-E796 IonicContact NE-OE2 3.58Å; R660-E796 PolarHBondContact NE-OE2 2.94Å; R660-E796 IonicContact NH1-OE1 3.4Å; R660-E796 PolarHBondContact NH1-OE1 3.18Å; R660-E796 IonicContact NH1-OE2 2.68Å; R660-E796 PolarHBondContact NH1-OE2 3.09Å; R660-E796 IonicContact NH2-OE1 2.8Å; R660-E796 PolarHBondContact NH2-OE1 3.16Å; R660-E796 IonicContact NH2-OE2 3.66Å; R660-E796 PolarHBondContact NH2-OE2 3.41Å; Q792-E796 WeakPolarHBondContact O-CG 3.35Å; Q792-E796 PolarHBondContact O-N 2.88Å; Q792-E796 PolarHBondContact OE1-OE1 3.47Å; V793-E796 PolarHBondContact O-N 3.02Å; V793-E796 VanDerWaalsContact O-N 3.09Å; E796-F799 PolarHBondContact O-N 3.47Å; E796-A800 WeakPolarHBondContact O-CB 3.34Å; E796-A800 PolarHBondContact O-N 3.22Å
797	W	93.6	Very high	90	Very high	16 Å²	16	50.1 Å²	50.1	6%	0.061	27%	0.269	C	S	.	.	H	α-helix	trans	-61	-43.4	166.5	167	60.6	0	0	0	111.3	T646 P649 P653 I656 V793 F799 A800 R801	T646-W797 PolarHBondContact O-NE1 2.82Å; P649-W797 VanDerWaalsContact CA-CZ2 3.45Å; P649-W797 HydrophobicContact CB-CH2 3.75Å; P649-W797 HydrophobicContact CB-CZ2 4.09Å; P653-W797 HydrophobicContact CG-CB 4.44Å; P653-W797 HydrophobicContact CG-CD2 3.95Å; P653-W797 HydrophobicContact CG-CE3 3.99Å; P653-W797 HydrophobicContact CG-CG 4.11Å; I656-W797 HydrophobicContact CG1-CB 4.3Å; V793-W797 WeakPolarHBondContact O-CB 3.45Å; V793-W797 PolarHBondContact O-N 3.01Å; W797-F799 VanDerWaalsContact C-N 3.34Å; W797-F799 PolarHBondContact O-N 2.91Å; W797-A800 PolarHBondContact O-N 3.43Å; W797-R801 WeakPolarHBondContact O-CB 3.36Å; W797-R801 PolarHBondContact O-N 3.39Å
798	K	92.2	Very high	89.5	Confident	48 Å²	48	45 Å²	45	21%	0.209	24%	0.244	C	C	.	.	H	α-helix	trans	-62	-40.7	174.2	-70.4	164.5	-158	154.9	0	111.7	A413 D794 I795 S802	A413-K798 HydrophobicContact CB-CB 3.95Å; A413-K798 HydrophobicContact CB-CD 4.21Å; D794-K798 WeakPolarHBondContact O-CD 3.28Å; D794-K798 WeakPolarHBondContact O-CE 3.39Å; D794-K798 WeakPolarHBondContact O-CG 3.12Å; D794-K798 PolarHBondContact O-NZ 3.35Å; D794-K798 VanDerWaalsContact OD2-CE 3.32Å; D794-K798 WeakPolarHBondContact OD2-CE 3.46Å; D794-K798 IonicContact OD2-NZ 3.99Å; D794-K798 PolarHBondContact OD2-NZ 2.89Å; I795-K798 PolarHBondContact O-N 3.21Å; K798-S802 WeakPolarHBondContact O-CB 3.48Å; K798-S802 PolarHBondContact O-N 3.27Å; K798-S802 PolarHBondContact O-OG 3.15Å
799	F	93.7	Very high	89.2	Confident	39 Å²	39	41 Å²	41	17%	0.171	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-50.7	174.1	-179.8	-96.7	0	0	0	112.2	I404 K409 V412 I795 E796 W797 R801 S802 K803	I404-F799 HydrophobicContact CB-CE2 4.42Å; I404-F799 HydrophobicContact CG1-CE2 3.98Å; I404-F799 HydrophobicContact CG1-CZ 4.49Å; I404-F799 HydrophobicContact CG2-CE2 4.47Å; I404-F799 HydrophobicContact CG2-CZ 4.16Å; K409-F799 HydrophobicContact CG-CG 4.49Å; V412-F799 HydrophobicContact CB-CD2 3.94Å; V412-F799 HydrophobicContact CG1-CD2 4.14Å; V412-F799 HydrophobicContact CG2-CD2 3.99Å; V412-F799 HydrophobicContact CG2-CE2 4.16Å; I795-F799 PolarHBondContact O-N 3.26Å; E796-F799 PolarHBondContact O-N 3.47Å; W797-F799 VanDerWaalsContact C-N 3.34Å; W797-F799 PolarHBondContact O-N 2.91Å; F799-R801 PolarHBondContact O-N 2.84Å; F799-S802 WeakPolarHBondContact O-CB 3.45Å; F799-S802 PolarHBondContact O-N 2.82Å; F799-S802 VanDerWaalsContact O-N 3.12Å; F799-K803 PolarHBondContact O-N 3.39Å
800	A	90.8	Very high	88.3	Confident	28 Å²	28	42 Å²	42	23%	0.231	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-44.1	178.4	0	0	0	0	0	112.3	I656 E796 W797 S802 K803 L804	I656-A800 HydrophobicContact CD1-CB 3.93Å; E796-A800 WeakPolarHBondContact O-CB 3.34Å; E796-A800 PolarHBondContact O-N 3.22Å; W797-A800 PolarHBondContact O-N 3.43Å; A800-S802 VanDerWaalsContact C-N 3.29Å; A800-S802 PolarHBondContact O-N 3.37Å; A800-K803 WeakPolarHBondContact O-CB 3Å; A800-K803 PolarHBondContact O-N 3.29Å; A800-L804 PolarHBondContact O-N 3.26Å
801	R	90.7	Very high	87.1	Confident	39 Å²	39	45 Å²	45	15%	0.147	25%	0.247	C	C	.	.	H	α-helix	trans	-60.4	-37.7	173.7	-173.4	-178.8	73.5	-170.4	1.5	112.1	W797 F799 L804 W805	W797-R801 WeakPolarHBondContact O-CB 3.36Å; W797-R801 PolarHBondContact O-N 3.39Å; F799-R801 PolarHBondContact O-N 2.84Å; R801-L804 WeakPolarHBondContact O-CB 3.38Å; R801-L804 PolarHBondContact O-N 3.17Å; R801-W805 HydrophobicContact CG-CD2 4.15Å; R801-W805 HydrophobicContact CG-CH2 4.44Å; R801-W805 HydrophobicContact CG-CZ2 3.8Å; R801-W805 VanDerWaalsContact O-CG 3.24Å; R801-W805 PolarHBondContact O-N 3.34Å
802	S	91.1	Very high	86.1	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-70.6	-40	177.3	-54.9	0	0	0	0	112.1	V412 Q418 L421 K798 F799 A800 L804 W805 I806	V412-S802 VanDerWaalsContact CG1-CB 3.43Å; V412-S802 WeakPolarHBondContact CG1-OG 3.46Å; Q418-S802 PolarHBondContact NE2-OG 3.06Å; L421-S802 WeakPolarHBondContact CD1-OG 3.48Å; K798-S802 WeakPolarHBondContact O-CB 3.48Å; K798-S802 PolarHBondContact O-N 3.27Å; K798-S802 PolarHBondContact O-OG 3.15Å; F799-S802 WeakPolarHBondContact O-CB 3.45Å; F799-S802 PolarHBondContact O-N 2.82Å; F799-S802 VanDerWaalsContact O-N 3.12Å; A800-S802 VanDerWaalsContact C-N 3.29Å; A800-S802 PolarHBondContact O-N 3.37Å; S802-L804 VanDerWaalsContact C-N 3.31Å; S802-L804 PolarHBondContact O-N 3.19Å; S802-W805 PolarHBondContact O-N 2.8Å; S802-I806 WeakPolarHBondContact O-CB 3.25Å; S802-I806 WeakPolarHBondContact O-CG1 3.01Å; S802-I806 PolarHBondContact O-N 3.48Å
803	K	89.2	Confident	85	Confident	96 Å²	96	41.7 Å²	41.7	42%	0.417	23%	0.232	S	C	.	.	H	α-helix	trans	-57.6	-44.3	171.1	-171	-168.8	-177.1	-171.1	0	111	I404 D576 F799 A800 S807	I404-K803 HydrophobicContact CG2-CG 4.46Å; D576-K803 IonicContact OD2-NZ 2.67Å; D576-K803 PolarHBondContact OD2-NZ 3.29Å; F799-K803 PolarHBondContact O-N 3.39Å; A800-K803 WeakPolarHBondContact O-CB 3Å; A800-K803 PolarHBondContact O-N 3.29Å; K803-S807 PolarHBondContact O-N 2.94Å
804	L	87.2	Confident	84.2	Confident	8 Å²	8	41.8 Å²	41.8	4%	0.042	23%	0.232	C	C	.	.	H	α-helix	trans	-61.4	-51.4	174.7	177.1	66	0	0	0	111.7	Y643 V647 A800 R801 S802 I806 S807 Y808	Y643-L804 HydrophobicContact CE1-CD1 3.9Å; Y643-L804 WeakPolarHBondContact OH-CD1 3.35Å; V647-L804 HydrophobicContact CG2-CD2 3.41Å; V647-L804 VanDerWaalsContact CG2-CD2 3.41Å; A800-L804 PolarHBondContact O-N 3.26Å; R801-L804 WeakPolarHBondContact O-CB 3.38Å; R801-L804 PolarHBondContact O-N 3.17Å; S802-L804 VanDerWaalsContact C-N 3.31Å; S802-L804 PolarHBondContact O-N 3.19Å; L804-I806 PolarHBondContact O-N 2.86Å; L804-S807 PolarHBondContact O-N 2.97Å; L804-S807 PolarHBondContact O-OG 2.99Å; L804-Y808 HydrophobicContact CD1-CE2 3.89Å; L804-Y808 HydrophobicContact CG-CE2 4.49Å; L804-Y808 WeakPolarHBondContact O-CD2 3.42Å
805	W	88.1	Confident	83.8	Confident	8 Å²	8	38.7 Å²	38.7	3%	0.03	22%	0.216	C	C	.	.	H	α-helix	trans	-59.5	-43.9	-178.2	-70.1	-9.7	0	0	0	112.9	L421 A422 W425 R801 S802 S807 Y808 F809	L421-W805 HydrophobicContact CB-CE3 3.97Å; L421-W805 HydrophobicContact CB-CZ3 3.96Å; A422-W805 HydrophobicContact CB-CH2 3.93Å; A422-W805 HydrophobicContact CB-CZ3 3.99Å; W425-W805 HydrophobicContact CB-CD2 4.45Å; W425-W805 HydrophobicContact CD2-CB 4.41Å; W425-W805 AromaticContact CD2-CD1 3.58Å; W425-W805 HydrophobicContact CD2-CD2 4.04Å; W425-W805 AromaticContact CD2-CE2 3.96Å; W425-W805 AromaticContact CD2-CG 3.79Å; W425-W805 HydrophobicContact CD2-CG 3.79Å; W425-W805 AromaticContact CD2-NE1 3.67Å; W425-W805 AromaticContact CE2-CD1 3.59Å; W425-W805 AromaticContact CE2-NE1 3.42Å; W425-W805 HydrophobicContact CE3-CB 3.69Å; W425-W805 AromaticContact CE3-CD1 3.5Å; W425-W805 VanDerWaalsContact CE3-CD1 3.5Å; W425-W805 HydrophobicContact CE3-CD2 4.22Å; W425-W805 AromaticContact CE3-CG 3.54Å; W425-W805 HydrophobicContact CE3-CG 3.54Å; W425-W805 HydrophobicContact CG-CD2 4.15Å; W425-W805 AromaticContact CG-CE2 3.99Å; W425-W805 HydrophobicContact CG-CG 4.38Å; W425-W805 HydrophobicContact CG-CZ2 4.35Å; W425-W805 AromaticContact CH2-CD1 3.48Å; W425-W805 VanDerWaalsContact CH2-CD1 3.48Å; W425-W805 HydrophobicContact CH2-CG 4.29Å; W425-W805 AromaticContact CZ2-CD1 3.57Å; W425-W805 AromaticContact CZ2-NE1 3.65Å; W425-W805 HydrophobicContact CZ3-CB 3.85Å; W425-W805 AromaticContact CZ3-CD1 3.46Å; W425-W805 VanDerWaalsContact CZ3-CD1 3.46Å; W425-W805 AromaticContact CZ3-CG 3.82Å; W425-W805 HydrophobicContact CZ3-CG 3.82Å; W425-W805 AromaticContact NE1-NE1 3.75Å; R801-W805 HydrophobicContact CG-CD2 4.15Å; R801-W805 HydrophobicContact CG-CH2 4.44Å; R801-W805 HydrophobicContact CG-CZ2 3.8Å; R801-W805 VanDerWaalsContact O-CG 3.24Å; R801-W805 PolarHBondContact O-N 3.34Å; S802-W805 PolarHBondContact O-N 2.8Å; W805-S807 PolarHBondContact O-N 3.29Å; W805-Y808 PolarHBondContact O-N 3.5Å; W805-Y808 VanDerWaalsContact O-N 3.07Å; W805-F809 HydrophobicContact CB-CZ 4.26Å; W805-F809 PolarHBondContact O-N 2.81Å
806	I	85.7	Confident	83.5	Confident	23 Å²	23	36 Å²	36	12%	0.118	20%	0.203	C	C	.	.	H	α-helix	trans	-64.5	-25.1	-179	-74.2	163.9	0	0	0	112.4	L400 K401 I404 L421 S802 L804 Y808 F809	L400-I806 HydrophobicContact CD2-CD1 4.07Å; L400-I806 HydrophobicContact CG-CD1 4.09Å; K401-I806 HydrophobicContact CG-CG2 3.97Å; I404-I806 HydrophobicContact CD1-CD1 3.43Å; I404-I806 VanDerWaalsContact CD1-CD1 3.43Å; L421-I806 HydrophobicContact CD2-CD1 4.28Å; L421-I806 HydrophobicContact CD2-CG1 4.28Å; S802-I806 WeakPolarHBondContact O-CB 3.25Å; S802-I806 WeakPolarHBondContact O-CG1 3.01Å; S802-I806 PolarHBondContact O-N 3.48Å; L804-I806 PolarHBondContact O-N 2.86Å; I806-Y808 VanDerWaalsContact C-N 3.28Å; I806-Y808 PolarHBondContact O-N 3.1Å; I806-F809 HydrophobicContact CB-CD2 4.27Å; I806-F809 HydrophobicContact CG1-CD2 3.73Å; I806-F809 HydrophobicContact CG1-CE2 3.77Å; I806-F809 PolarHBondContact O-N 3.44Å
807	S	83.2	Confident	83.3	Confident	59 Å²	59	35.6 Å²	35.6	41%	0.413	20%	0.2	S	C	.	.	H	α-helix	trans	-67	-27.8	174.6	82.1	0	0	0	0	113.2	K803 L804 W805	K803-S807 PolarHBondContact O-N 2.94Å; L804-S807 PolarHBondContact O-N 2.97Å; L804-S807 PolarHBondContact O-OG 2.99Å; W805-S807 PolarHBondContact O-N 3.29Å
808	Y	83.6	Confident	82.9	Confident	42 Å²	42	36 Å²	36	17%	0.165	21%	0.206	C	C	.	.	H	α-helix	trans	-92.2	-10.4	175.9	-66.1	-81.3	0	0	0	114.2	W425 K502 F503 H506 L804 W805 I806 G810	W425-Y808 HydrophobicContact CH2-CD2 4.1Å; W425-Y808 HydrophobicContact CZ3-CD2 4.22Å; W425-Y808 HydrophobicContact CZ3-CG 4.48Å; K502-Y808 HydrophobicContact CB-CD1 3.92Å; K502-Y808 WeakPolarHBondContact CD-O 3.24Å; K502-Y808 PolarHBondContact NZ-O 3Å; F503-Y808 HydrophobicContact CB-CD1 4.29Å; F503-Y808 HydrophobicContact CB-CD2 4.23Å; F503-Y808 HydrophobicContact CB-CE1 4.25Å; F503-Y808 HydrophobicContact CB-CE2 4.19Å; F503-Y808 HydrophobicContact CB-CG 4.28Å; F503-Y808 HydrophobicContact CD2-CD2 4.46Å; F503-Y808 AromaticContact CD2-CE2 3.74Å; F503-Y808 HydrophobicContact CD2-CE2 3.74Å; F503-Y808 AromaticContact CD2-CZ 3.87Å; F503-Y808 HydrophobicContact CG-CE2 4.44Å; H506-Y808 HydrophobicContact CB-CE1 4.28Å; L804-Y808 HydrophobicContact CD1-CE2 3.89Å; L804-Y808 HydrophobicContact CG-CE2 4.49Å; L804-Y808 WeakPolarHBondContact O-CD2 3.42Å; W805-Y808 PolarHBondContact O-N 3.5Å; W805-Y808 VanDerWaalsContact O-N 3.07Å; I806-Y808 VanDerWaalsContact C-N 3.28Å; I806-Y808 PolarHBondContact O-N 3.1Å; Y808-G810 VanDerWaalsContact C-N 3.3Å
809	F	82.4	Confident	82.6	Confident	43 Å²	43	35.8 Å²	35.8	19%	0.189	20%	0.204	C	C	.	.	H	α-helix	trans	-69.8	-26.4	174.3	-66.8	-17.6	0	0	0	112.7	L397 L421 I424 W425 P499 W805 I806	L397-F809 HydrophobicContact CD1-CD2 3.81Å; L397-F809 HydrophobicContact CD1-CE2 3.65Å; L421-F809 HydrophobicContact CD2-CE2 3.64Å; L421-F809 HydrophobicContact CD2-CZ 4.08Å; I424-F809 HydrophobicContact CB-CE1 4.32Å; I424-F809 HydrophobicContact CB-CZ 4.1Å; I424-F809 HydrophobicContact CG2-CD1 4.09Å; I424-F809 HydrophobicContact CG2-CE1 3.68Å; I424-F809 HydrophobicContact CG2-CE2 4.3Å; I424-F809 HydrophobicContact CG2-CZ 3.81Å; W425-F809 AromaticContact CE3-CE1 3.96Å; W425-F809 HydrophobicContact CE3-CE1 3.96Å; P499-F809 HydrophobicContact CB-CD1 3.65Å; P499-F809 HydrophobicContact CB-CE1 3.97Å; P499-F809 HydrophobicContact CG-CD1 3.82Å; P499-F809 HydrophobicContact CG-CE1 3.82Å; W805-F809 HydrophobicContact CB-CZ 4.26Å; W805-F809 PolarHBondContact O-N 2.81Å; I806-F809 HydrophobicContact CB-CD2 4.27Å; I806-F809 HydrophobicContact CG1-CD2 3.73Å; I806-F809 HydrophobicContact CG1-CE2 3.77Å; I806-F809 PolarHBondContact O-N 3.44Å
810	G	71.7	Confident	82.2	Confident	35 Å²	35	34.6 Å²	34.6	36%	0.361	20%	0.2	S	C	.	.	S	Bend	trans	-63.6	153.8	176.7	0	0	0	0	0	113.9	K502 Y808 G812	K502-G810 PolarHBondContact NZ-O 3.12Å; Y808-G810 VanDerWaalsContact C-N 3.3Å; G810-G812 PolarHBondContact O-N 3.05Å
811	E	64.6	Low	81.7	Confident	135 Å²	135	36.4 Å²	36.4	63%	0.631	21%	0.205	S	C	*	.	S	Bend	trans	-77.9	-5.1	172.8	-60.5	-166.6	173.4	0	0	113	R394 T814	R394-E811 IonicContact CZ-OE1 2.82Å; R394-E811 IonicContact NH1-OE1 3.53Å; R394-E811 PolarHBondContact NH1-OE1 3.17Å; E811-T814 WeakPolarHBondContact O-CG2 3.19Å
812	G	66	Low	81.1	Confident	50 Å²	50	38.8 Å²	38.8	52%	0.515	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	153.9	172.6	0	0	0	0	0	113.4	G810 T814	G810-G812 PolarHBondContact O-N 3.05Å; G812-T814 VanDerWaalsContact C-N 3.26Å; G812-T814 PolarHBondContact O-N 2.82Å; G812-T814 VanDerWaalsContact O-N 3.15Å
813	C	64.2	Low	80.1	Confident	49 Å²	49	42.8 Å²	42.8	33%	0.331	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	33.9	173.7	-58.9	0	0	0	0	115.7	H506 V815	H506-C813 PolarHBondContact NE2-O 3.07Å; C813-V815 PolarHBondContact O-N 3Å
814	T	73.9	Confident	79.1	Confident	13 Å²	13	40.4 Å²	40.4	8%	0.08	24%	0.239	C	C	.	.			trans	-62.7	-26.7	178.5	56.2	0	0	0	0	114.1	Y484 K502 E811 G812	Y484-T814 WeakPolarHBondContact CE1-OG1 3.34Å; Y484-T814 PolarHBondContact OH-OG1 3.17Å; K502-T814 HydrophobicContact CD-CG2 4.27Å; E811-T814 WeakPolarHBondContact O-CG2 3.19Å; G812-T814 VanDerWaalsContact C-N 3.26Å; G812-T814 PolarHBondContact O-N 2.82Å; G812-T814 VanDerWaalsContact O-N 3.15Å
815	V	82.8	Confident	78.1	Confident	15 Å²	15	44.5 Å²	44.5	9%	0.091	27%	0.266	C	S	.	.	S	Bend	trans	-92.9	128.8	-176.3	-179.8	0	0	0	0	110.1	Y484 M485 C813 F819	Y484-V815 HydrophobicContact CD1-CG2 3.73Å; Y484-V815 HydrophobicContact CE1-CG2 4.02Å; M485-V815 HydrophobicContact CG-CG2 4.47Å; C813-V815 PolarHBondContact O-N 3Å; V815-F819 HydrophobicContact CG1-CB 3.36Å
816	P	86.5	Confident	77.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-74.3	166.7	177.3	31.8	-35.8	0	0	0	112.8	F477 A481 C505 F819 N820	F477-P816 HydrophobicContact CD2-CG 3.89Å; F477-P816 HydrophobicContact CE2-CG 4.37Å; A481-P816 HydrophobicContact CB-CG 4.37Å; C505-P816 HydrophobicContact CB-CG 4.43Å; P816-F819 PolarHBondContact O-N 3.34Å; P816-N820 PolarHBondContact O-N 3.44Å; P816-N820 VanDerWaalsContact O-N 3.16Å
817	V	87.4	Confident	76.2	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.006	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	140.5	168.4	176.2	0	0	0	0	108.8	S509 Y553 F557	S509-V817 WeakPolarHBondContact CB-O 3.07Å; S509-V817 PolarHBondContact OG-O 2.94Å; Y553-V817 HydrophobicContact CD1-CB 4.48Å; Y553-V817 HydrophobicContact CD1-CG1 3.55Å; Y553-V817 HydrophobicContact CE1-CG1 4.21Å; Y553-V817 HydrophobicContact CG-CG1 4.23Å; Y553-V817 WeakPolarHBondContact O-CG1 3.45Å; F557-V817 HydrophobicContact CD1-CB 4.22Å; F557-V817 HydrophobicContact CD1-CG1 4.16Å; F557-V817 HydrophobicContact CD1-CG2 3.72Å; F557-V817 HydrophobicContact CE1-CB 3.98Å; F557-V817 HydrophobicContact CE1-CG1 4.04Å; F557-V817 HydrophobicContact CE1-CG2 3.92Å; F557-V817 HydrophobicContact CE2-CG1 4.47Å; F557-V817 HydrophobicContact CG-CG1 4.4Å; F557-V817 HydrophobicContact CG-CG2 4.48Å; F557-V817 HydrophobicContact CZ-CB 4.49Å; F557-V817 HydrophobicContact CZ-CG1 4.19Å
818	P	85.9	Confident	75.5	Confident	26 Å²	26	54 Å²	54	17%	0.169	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	cis	-83.6	-13.6	3	33.9	-36.2	0	0	0	115.1	I552 N820 I821	I552-P818 HydrophobicContact CG2-CB 3.72Å; P818-N820 PolarHBondContact O-N 3.14Å; P818-I821 WeakPolarHBondContact O-CG1 3.35Å; P818-I821 PolarHBondContact O-N 3.24Å; P818-I821 VanDerWaalsContact O-N 3.1Å
819	F	85.5	Confident	74.7	Confident	42 Å²	42	57.1 Å²	57.1	18%	0.184	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-59.3	-20	-169.5	-59.5	-76.2	0	0	0	115	F477 P478 A481 T482 M485 V815 P816 I821 I822	F477-F819 HydrophobicContact CE2-CD2 4.46Å; F477-F819 HydrophobicContact CE2-CE2 4.06Å; P478-F819 HydrophobicContact CB-CE2 3.94Å; P478-F819 HydrophobicContact CB-CZ 3.84Å; A481-F819 HydrophobicContact CB-CB 4.32Å; A481-F819 HydrophobicContact CB-CD2 3.89Å; A481-F819 HydrophobicContact CB-CE2 4.47Å; A481-F819 HydrophobicContact CB-CG 4.08Å; T482-F819 HydrophobicContact CG2-CE1 4.32Å; M485-F819 HydrophobicContact SD-CB 4.36Å; V815-F819 HydrophobicContact CG1-CB 3.36Å; P816-F819 PolarHBondContact O-N 3.34Å; F819-I821 PolarHBondContact O-N 2.99Å; F819-I821 VanDerWaalsContact O-N 3.1Å; F819-I822 HydrophobicContact CD1-CD1 4.49Å; F819-I822 PolarHBondContact O-N 3.27Å; F819-I822 VanDerWaalsContact O-N 3.16Å
820	N	84.6	Confident	74	Confident	15 Å²	15	60.4 Å²	60.4	8%	0.08	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-56.4	-16.7	171.1	176.8	45.9	0	0	0	115.2	G556 W559 K563 P816 P818	G556-N820 PolarHBondContact O-ND2 3.06Å; W559-N820 VanDerWaalsContact CD1-O 3.26Å; W559-N820 PolarHBondContact NE1-O 3.17Å; K563-N820 PolarHBondContact NZ-OD1 3.28Å; P816-N820 PolarHBondContact O-N 3.44Å; P816-N820 VanDerWaalsContact O-N 3.16Å; P818-N820 PolarHBondContact O-N 3.14Å
821	I	82.2	Confident	74	Confident	65 Å²	65	63.6 Å²	63.6	33%	0.333	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-73.3	-37.4	175.6	-62.7	170.2	0	0	0	111.5	I552 I555 P818 F819	I552-I821 HydrophobicContact CG2-CD1 4.13Å; I552-I821 WeakPolarHBondContact O-CD1 3.35Å; I555-I821 HydrophobicContact CB-CD1 4.16Å; I555-I821 HydrophobicContact CG2-CD1 3.82Å; I555-I821 HydrophobicContact CG2-CG1 4.31Å; P818-I821 WeakPolarHBondContact O-CG1 3.35Å; P818-I821 PolarHBondContact O-N 3.24Å; P818-I821 VanDerWaalsContact O-N 3.1Å; F819-I821 PolarHBondContact O-N 2.99Å; F819-I821 VanDerWaalsContact O-N 3.1Å
822	I	78.1	Confident	74.4	Confident	90 Å²	90	60.7 Å²	60.7	46%	0.462	33%	0.332	S	S	.	.	S	Bend	trans	-74.7	122	-171.9	-54.9	170.8	0	0	0	109.3	M485 F819 T824	M485-I822 HydrophobicContact CE-CB 3.63Å; M485-I822 HydrophobicContact CE-CD1 4.07Å; M485-I822 HydrophobicContact CE-CG1 4.45Å; M485-I822 HydrophobicContact CE-CG2 3.51Å; F819-I822 HydrophobicContact CD1-CD1 4.49Å; F819-I822 PolarHBondContact O-N 3.27Å; F819-I822 VanDerWaalsContact O-N 3.16Å; I822-T824 PolarHBondContact O-N 3.38Å
823	P	68.9	Low	74.6	Confident	83 Å²	83	61.9 Å²	61.9	54%	0.539	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-67	132.5	178.2	27.7	-33.8	0	0	0	110.3
824	T	68	Low	74.8	Confident	47 Å²	47	63.6 Å²	63.6	29%	0.288	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-70.9	151.5	173.3	63.4	0	0	0	0	110.1	I822 K826 A827 F828	I822-T824 PolarHBondContact O-N 3.38Å; T824-K826 PolarHBondContact O-N 3.35Å; T824-K826 VanDerWaalsContact O-N 3.12Å; T824-A827 WeakPolarHBondContact O-CA 3.36Å; T824-A827 WeakPolarHBondContact O-CB 3.32Å; T824-A827 PolarHBondContact O-N 3.4Å; T824-A827 WeakPolarHBondContact OG1-CB 3.23Å; T824-A827 PolarHBondContact OG1-N 3.01Å; T824-F828 PolarHBondContact O-N 2.82Å
825	P	66.5	Low	74.8	Confident	93 Å²	93	66.5 Å²	66.5	60%	0.604	35%	0.35	S	S	*	.	H	α-helix	trans	-54.4	-34.5	175.9	-27.7	35.4	0	0	0	112.7	F828 M829	P825-F828 PolarHBondContact O-N 2.92Å; P825-M829 WeakPolarHBondContact O-CG 3.49Å; P825-M829 PolarHBondContact O-N 2.87Å
826	K	66.5	Low	74	Confident	137 Å²	137	71.6 Å²	71.6	60%	0.596	37%	0.371	S	S	*	.	H	α-helix	trans	-65.1	-40.9	174.6	-152.2	-170.8	-173.6	-162.3	0	112.4	T824 M829 Y830	T824-K826 PolarHBondContact O-N 3.35Å; T824-K826 VanDerWaalsContact O-N 3.12Å; K826-M829 PolarHBondContact O-N 3.39Å; K826-Y830 HydrophobicContact CD-CE2 3.76Å; K826-Y830 WeakPolarHBondContact CE-OH 3.44Å; K826-Y830 HydrophobicContact CG-CD2 4.14Å; K826-Y830 HydrophobicContact CG-CE2 3.68Å; K826-Y830 PolarHBondContact NZ-OH 2.87Å; K826-Y830 VanDerWaalsContact NZ-OH 3.14Å; K826-Y830 WeakPolarHBondContact O-CD2 3.42Å; K826-Y830 PolarHBondContact O-N 3.37Å
827	A	68.5	Low	72.9	Confident	43 Å²	43	75.7 Å²	75.7	36%	0.355	39%	0.393	S	S	.	.	H	α-helix	trans	-67.3	-38.1	175.8	0	0	0	0	0	112.1	T824 Y830 M831	T824-A827 WeakPolarHBondContact O-CA 3.36Å; T824-A827 WeakPolarHBondContact O-CB 3.32Å; T824-A827 PolarHBondContact O-N 3.4Å; T824-A827 WeakPolarHBondContact OG1-CB 3.23Å; T824-A827 PolarHBondContact OG1-N 3.01Å; A827-Y830 PolarHBondContact O-N 3Å; A827-M831 WeakPolarHBondContact O-CB 3.39Å; A827-M831 PolarHBondContact O-N 3.5Å
828	F	67.9	Low	71.9	Confident	110 Å²	110	82.1 Å²	82.1	48%	0.482	43%	0.426	S	S	.	.	H	α-helix	trans	-64.5	-43.7	173.7	-170.9	-110.4	0	0	0	111.7	T824 P825 Y830 M831 L832	T824-F828 PolarHBondContact O-N 2.82Å; P825-F828 PolarHBondContact O-N 2.92Å; F828-Y830 PolarHBondContact O-N 3.38Å; F828-M831 WeakPolarHBondContact O-CB 3.22Å; F828-M831 PolarHBondContact O-N 3Å; F828-L832 HydrophobicContact CD1-CD1 3.86Å; F828-L832 HydrophobicContact CD1-CG 4.4Å; F828-L832 HydrophobicContact CE1-CD1 3.54Å; F828-L832 HydrophobicContact CE1-CG 4.18Å; F828-L832 HydrophobicContact CZ-CD1 4.12Å; F828-L832 HydrophobicContact CZ-CD2 4.49Å; F828-L832 HydrophobicContact CZ-CG 4.35Å; F828-L832 WeakPolarHBondContact O-CG 3.43Å; F828-L832 PolarHBondContact O-N 2.92Å
829	M	67.7	Low	70.8	Confident	107 Å²	107	89.1 Å²	89.1	53%	0.527	45%	0.454	S	S	.	.	H	α-helix	trans	-64.4	-37	174.3	-71.4	-64.4	-71.1	0	0	113.1	P825 K826 L832 N833	P825-M829 WeakPolarHBondContact O-CG 3.49Å; P825-M829 PolarHBondContact O-N 2.87Å; K826-M829 PolarHBondContact O-N 3.39Å; M829-L832 HydrophobicContact SD-CD1 4.42Å; M829-N833 WeakPolarHBondContact O-CB 3.4Å; M829-N833 PolarHBondContact O-N 3.47Å
830	Y	66.4	Low	69.6	Low	113 Å²	113	93 Å²	93	44%	0.443	48%	0.476	S	S	.	.	H	α-helix	trans	-66.3	-42.8	171.7	-75.2	-53.9	0	0	0	111.8	K826 A827 F828 N833 T834	K826-Y830 HydrophobicContact CD-CE2 3.76Å; K826-Y830 WeakPolarHBondContact CE-OH 3.44Å; K826-Y830 HydrophobicContact CG-CD2 4.14Å; K826-Y830 HydrophobicContact CG-CE2 3.68Å; K826-Y830 PolarHBondContact NZ-OH 2.87Å; K826-Y830 VanDerWaalsContact NZ-OH 3.14Å; K826-Y830 WeakPolarHBondContact O-CD2 3.42Å; K826-Y830 PolarHBondContact O-N 3.37Å; A827-Y830 PolarHBondContact O-N 3Å; F828-Y830 PolarHBondContact O-N 3.38Å; Y830-N833 PolarHBondContact O-N 2.77Å; Y830-T834 PolarHBondContact O-N 3.35Å; Y830-T834 PolarHBondContact O-OG1 3.36Å; Y830-T834 VanDerWaalsContact O-OG1 3.11Å
831	M	71.1	Confident	67.8	Low	101 Å²	101	97 Å²	97	50%	0.498	50%	0.498	S	S	.	.	H	α-helix	trans	-59.1	-48.2	175.1	-173.5	-166.4	-59	0	0	111.4	A827 F828 N833 T834 I835	A827-M831 WeakPolarHBondContact O-CB 3.39Å; A827-M831 PolarHBondContact O-N 3.5Å; F828-M831 WeakPolarHBondContact O-CB 3.22Å; F828-M831 PolarHBondContact O-N 3Å; M831-N833 VanDerWaalsContact C-N 3.33Å; M831-N833 PolarHBondContact O-N 2.9Å; M831-T834 PolarHBondContact O-N 3.45Å; M831-I835 HydrophobicContact CG-CD1 4.03Å; M831-I835 VanDerWaalsContact O-CG1 3.3Å; M831-I835 WeakPolarHBondContact O-CG1 3.48Å; M831-I835 PolarHBondContact O-N 2.89Å
832	L	73.2	Confident	66.3	Low	74 Å²	74	99.4 Å²	99.4	39%	0.387	52%	0.519	S	S	.	.	H	α-helix	trans	-60.3	-39.7	174.7	-74	178	0	0	0	112.2	F828 M829 I835 K836	F828-L832 HydrophobicContact CD1-CD1 3.86Å; F828-L832 HydrophobicContact CD1-CG 4.4Å; F828-L832 HydrophobicContact CE1-CD1 3.54Å; F828-L832 HydrophobicContact CE1-CG 4.18Å; F828-L832 HydrophobicContact CZ-CD1 4.12Å; F828-L832 HydrophobicContact CZ-CD2 4.49Å; F828-L832 HydrophobicContact CZ-CG 4.35Å; F828-L832 WeakPolarHBondContact O-CG 3.43Å; F828-L832 PolarHBondContact O-N 2.92Å; M829-L832 HydrophobicContact SD-CD1 4.42Å; L832-I835 PolarHBondContact O-N 3.15Å; L832-K836 WeakPolarHBondContact O-CB 3.47Å; L832-K836 PolarHBondContact O-N 3.1Å
833	N	70.4	Confident	65.1	Low	76 Å²	76	100.3 Å²	100.3	41%	0.406	53%	0.533	S	S	.	.	H	α-helix	trans	-70.4	-34.6	175.3	-79.8	-20.9	0	0	0	112.9	M829 Y830 M831 K836 N837	M829-N833 WeakPolarHBondContact O-CB 3.4Å; M829-N833 PolarHBondContact O-N 3.47Å; Y830-N833 PolarHBondContact O-N 2.77Å; M831-N833 VanDerWaalsContact C-N 3.33Å; M831-N833 PolarHBondContact O-N 2.9Å; N833-K836 PolarHBondContact O-N 3.46Å; N833-N837 VanDerWaalsContact O-CB 3.32Å; N833-N837 WeakPolarHBondContact O-CB 3.49Å; N833-N837 PolarHBondContact O-N 2.94Å; N833-N837 PolarHBondContact O-OD1 2.87Å
834	T	69.7	Low	64	Low	84 Å²	84	102.8 Å²	102.8	52%	0.515	54%	0.542	S	S	.	.	H	α-helix	trans	-65.3	-43.3	172.7	-61.6	0	0	0	0	110.9	Y830 M831 N837 L838	Y830-T834 PolarHBondContact O-N 3.35Å; Y830-T834 PolarHBondContact O-OG1 3.36Å; Y830-T834 VanDerWaalsContact O-OG1 3.11Å; M831-T834 PolarHBondContact O-N 3.45Å; T834-N837 PolarHBondContact O-N 3.21Å; T834-L838 HydrophobicContact CG2-CD1 4.27Å; T834-L838 WeakPolarHBondContact O-CB 3.42Å; T834-L838 WeakPolarHBondContact O-CG 3.28Å; T834-L838 PolarHBondContact O-N 3.18Å
835	I	72.8	Confident	63.2	Low	74 Å²	74	108.1 Å²	108.1	38%	0.379	56%	0.561	S	S	.	*	H	α-helix	trans	-62.6	-47.9	173.1	-67.7	165.2	0	0	0	110.2	M831 L832 N837 L838 F839	M831-I835 HydrophobicContact CG-CD1 4.03Å; M831-I835 VanDerWaalsContact O-CG1 3.3Å; M831-I835 WeakPolarHBondContact O-CG1 3.48Å; M831-I835 PolarHBondContact O-N 2.89Å; L832-I835 PolarHBondContact O-N 3.15Å; I835-N837 VanDerWaalsContact C-N 3.3Å; I835-N837 PolarHBondContact O-N 2.88Å; I835-L838 WeakPolarHBondContact O-CB 3.47Å; I835-L838 PolarHBondContact O-N 3.33Å; I835-L838 VanDerWaalsContact O-N 3.12Å; I835-F839 HydrophobicContact CG2-CD2 3.78Å; I835-F839 HydrophobicContact CG2-CE2 3.97Å; I835-F839 WeakPolarHBondContact O-CD2 3.44Å; I835-F839 PolarHBondContact O-N 2.87Å
836	K	66.7	Low	62.3	Low	122 Å²	122	113.1 Å²	113.1	53%	0.53	57%	0.574	S	S	.	*	H	α-helix	trans	-58.2	-42	177.6	-170.9	179.1	-178.7	178.3	0	111.9	L832 N833 F839 L840	L832-K836 WeakPolarHBondContact O-CB 3.47Å; L832-K836 PolarHBondContact O-N 3.1Å; N833-K836 PolarHBondContact O-N 3.46Å; K836-F839 PolarHBondContact O-N 3.17Å; K836-L840 HydrophobicContact CG-CD1 3.76Å; K836-L840 WeakPolarHBondContact O-CB 3.37Å; K836-L840 PolarHBondContact O-N 2.88Å
837	N	63.9	Low	61.5	Low	87 Å²	87	114.7 Å²	114.7	47%	0.465	58%	0.583	S	S	.	*	H	α-helix	trans	-66.1	-44.2	175.1	-70.7	-2.6	0	0	0	111	N833 T834 I835 F839 L840 N841	N833-N837 VanDerWaalsContact O-CB 3.32Å; N833-N837 WeakPolarHBondContact O-CB 3.49Å; N833-N837 PolarHBondContact O-N 2.94Å; N833-N837 PolarHBondContact O-OD1 2.87Å; T834-N837 PolarHBondContact O-N 3.21Å; I835-N837 VanDerWaalsContact C-N 3.3Å; I835-N837 PolarHBondContact O-N 2.88Å; N837-F839 PolarHBondContact O-N 3.27Å; N837-L840 PolarHBondContact O-N 3.15Å; N837-N841 WeakPolarHBondContact O-CB 3.4Å; N837-N841 PolarHBondContact O-N 3.33Å; N837-N841 VanDerWaalsContact O-N 3.11Å; N837-N841 PolarHBondContact O-ND2 2.89Å; N837-N841 VanDerWaalsContact O-ND2 3.12Å
838	L	64.8	Low	60.6	Low	135 Å²	135	118 Å²	118	71%	0.707	59%	0.594	S	S	*	*	H	α-helix	trans	-56.8	-33.9	174.1	-81.6	161.4	0	0	0	113.1	T834 I835	T834-L838 HydrophobicContact CG2-CD1 4.27Å; T834-L838 WeakPolarHBondContact O-CB 3.42Å; T834-L838 WeakPolarHBondContact O-CG 3.28Å; T834-L838 PolarHBondContact O-N 3.18Å; I835-L838 WeakPolarHBondContact O-CB 3.47Å; I835-L838 PolarHBondContact O-N 3.33Å; I835-L838 VanDerWaalsContact O-N 3.12Å
839	F	64.4	Low	59.8	Low	173 Å²	173	118.1 Å²	118.1	76%	0.759	60%	0.596	S	S	*	*	H	α-helix	trans	-94.2	-11.5	-179.4	-79.2	-74.8	0	0	0	116	I835 K836 N837	I835-F839 HydrophobicContact CG2-CD2 3.78Å; I835-F839 HydrophobicContact CG2-CE2 3.97Å; I835-F839 WeakPolarHBondContact O-CD2 3.44Å; I835-F839 PolarHBondContact O-N 2.87Å; K836-F839 PolarHBondContact O-N 3.17Å; N837-F839 PolarHBondContact O-N 3.27Å
840	L	59.2	Low	59.1	Low	123 Å²	123	123.4 Å²	123.4	64%	0.644	61%	0.61	S	S	*	*	H	α-helix	trans	-130.2	9.8	-175.1	-71.6	163.1	0	0	0	115.2	K836 N837 C842	K836-L840 HydrophobicContact CG-CD1 3.76Å; K836-L840 WeakPolarHBondContact O-CB 3.37Å; K836-L840 PolarHBondContact O-N 2.88Å; N837-L840 PolarHBondContact O-N 3.15Å; L840-C842 VanDerWaalsContact C-N 3.32Å; L840-C842 PolarHBondContact O-N 3.07Å
841	N	48	Very low	58.5	Low	99 Å²	99	123.6 Å²	123.6	53%	0.529	62%	0.619	S	S	.	*			trans	-74.9	63.8	-174.4	-96.9	-15.3	0	0	0	115.5	N837	N837-N841 WeakPolarHBondContact O-CB 3.4Å; N837-N841 PolarHBondContact O-N 3.33Å; N837-N841 VanDerWaalsContact O-N 3.11Å; N837-N841 PolarHBondContact O-ND2 2.89Å; N837-N841 VanDerWaalsContact O-ND2 3.12Å
842	C	49.4	Very low	58.1	Low	117 Å²	117	121.5 Å²	121.5	79%	0.791	61%	0.61	S	S	*	*	S	Bend	trans	-127.5	-62.4	165.6	-81	0	0	0	0	114.5	L840	L840-C842 VanDerWaalsContact C-N 3.32Å; L840-C842 PolarHBondContact O-N 3.07Å
843	S	53.1	Low	57.7	Low	108 Å²	108	123.5 Å²	123.5	76%	0.755	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-42.2	-158.2	-70.5	0	0	0	0	117.8	K845	S843-K845 PolarHBondContact O-N 3.05Å
844	N	46.8	Very low	57.6	Low	136 Å²	136	125.6 Å²	125.6	73%	0.727	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	9.5	-154.6	-70.3	11.9	0	0	0	116.3	K846	N844-K846 PolarHBondContact O-N 2.93Å
845	K	51.2	Low	57.5	Low	158 Å²	158	124.3 Å²	124.3	69%	0.687	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-63.8	-33.7	-173.1	-78.2	-175.3	175.2	178.4	0	114.8	S843 Q847	S843-K845 PolarHBondContact O-N 3.05Å; K845-Q847 VanDerWaalsContact C-N 3.29Å; K845-Q847 PolarHBondContact O-N 3.44Å
846	K	47.6	Very low	57.5	Low	199 Å²	199	123.8 Å²	123.8	87%	0.865	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-71.9	-14.1	-171.7	-68.6	-164	173.5	-167	0	115.2	N844	N844-K846 PolarHBondContact O-N 2.93Å
847	Q	48.1	Very low	57.9	Low	170 Å²	170	125.1 Å²	125.1	79%	0.794	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-101.1	-11.7	-171.8	-141.8	162.1	6.7	0	0	114.3	K845	K845-Q847 VanDerWaalsContact C-N 3.29Å; K845-Q847 PolarHBondContact O-N 3.44Å
848	L	50.6	Low	58.4	Low	112 Å²	112	125.2 Å²	125.2	59%	0.586	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-38.8	177.5	-161.4	72.3	0	0	0	112.3	R850 N851 D852	L848-R850 PolarHBondContact O-N 3.44Å; L848-N851 PolarHBondContact O-N 3.43Å; L848-D852 WeakPolarHBondContact CG-OD2 3.41Å; L848-D852 PolarHBondContact O-N 3.44Å
849	H	51.5	Low	58.7	Low	113 Å²	113	125.1 Å²	125.1	52%	0.523	60%	0.601	S	S	.	*	H	α-helix	trans	-54.5	-28.6	-169	-166.6	-124.4	0	0	0	115	D852 W853	H849-D852 PolarHBondContact O-N 3.15Å; H849-W853 AromaticContact CE1-CD1 3.98Å; H849-W853 PolarHBondContact O-N 3.06Å; H849-W853 VanDerWaalsContact O-N 3.08Å
850	R	51.8	Low	59.3	Low	218 Å²	218	120.8 Å²	120.8	82%	0.823	59%	0.585	S	S	*	*	H	α-helix	trans	-71.4	-37	-179.2	-139.8	179.8	-163.8	-165.4	3.5	112.6	L848	L848-R850 PolarHBondContact O-N 3.44Å
851	N	54.7	Low	60.2	Low	116 Å²	116	121 Å²	121	62%	0.62	58%	0.581	S	S	*	*	H	α-helix	trans	-78.1	-35.6	175.1	-65.3	3.7	0	0	0	110.5	L848 W853 E854 T855	L848-N851 PolarHBondContact O-N 3.43Å; N851-W853 VanDerWaalsContact C-N 3.29Å; N851-W853 PolarHBondContact O-N 3.13Å; N851-E854 PolarHBondContact O-N 2.92Å; N851-T855 PolarHBondContact O-N 3.28Å
852	D	62.3	Low	61.5	Low	58 Å²	58	121 Å²	121	31%	0.31	58%	0.577	S	S	.	*	H	α-helix	trans	-56.6	-44.2	174.4	-65.1	-41.1	0	0	0	110.9	L848 H849 E854 T855 I856	L848-D852 WeakPolarHBondContact CG-OD2 3.41Å; L848-D852 PolarHBondContact O-N 3.44Å; H849-D852 PolarHBondContact O-N 3.15Å; D852-E854 VanDerWaalsContact C-N 3.32Å; D852-E854 PolarHBondContact O-N 3.19Å; D852-T855 CarbonylContact O-C 3.38Å; D852-T855 PolarHBondContact O-N 3.4Å; D852-T855 PolarHBondContact O-OG1 3.38Å; D852-I856 HydrophobicContact CB-CD1 4.4Å; D852-I856 VanDerWaalsContact O-CG1 3.28Å; D852-I856 WeakPolarHBondContact O-CG1 3.42Å; D852-I856 PolarHBondContact O-N 2.95Å
853	W	64.1	Low	62.8	Low	116 Å²	116	119.2 Å²	119.2	44%	0.439	56%	0.563	S	S	.	*	H	α-helix	trans	-57.7	-37.7	179.3	-123.8	106.5	0	0	0	113.7	H849 N851 I856 R857	H849-W853 AromaticContact CE1-CD1 3.98Å; H849-W853 PolarHBondContact O-N 3.06Å; H849-W853 VanDerWaalsContact O-N 3.08Å; N851-W853 VanDerWaalsContact C-N 3.29Å; N851-W853 PolarHBondContact O-N 3.13Å; W853-I856 PolarHBondContact O-N 3.45Å; W853-R857 HydrophobicContact CE3-CG 3.67Å; W853-R857 HydrophobicContact CZ3-CG 3.62Å; W853-R857 VanDerWaalsContact CZ3-NE 3.3Å; W853-R857 WeakPolarHBondContact O-CG 3.38Å; W853-R857 PolarHBondContact O-N 2.94Å
854	E	68.1	Low	64.1	Low	120 Å²	120	120.1 Å²	120.1	56%	0.561	55%	0.553	S	S	*	*	H	α-helix	trans	-68.3	-42	174.4	-65.7	-165.4	158.5	0	0	111.8	N851 D852 I856 R857 L858	N851-E854 PolarHBondContact O-N 2.92Å; D852-E854 VanDerWaalsContact C-N 3.32Å; D852-E854 PolarHBondContact O-N 3.19Å; E854-I856 VanDerWaalsContact C-N 3.27Å; E854-I856 PolarHBondContact O-N 2.92Å; E854-R857 PolarHBondContact O-N 2.98Å; E854-L858 WeakPolarHBondContact O-CG 3.25Å; E854-L858 PolarHBondContact O-N 3.16Å
855	T	69.3	Low	65.7	Low	57 Å²	57	117.8 Å²	117.8	35%	0.35	54%	0.538	S	S	.	.	H	α-helix	trans	-65.3	-32.1	174.3	74.2	0	0	0	0	112.2	N851 D852 L858 R859	N851-T855 PolarHBondContact O-N 3.28Å; D852-T855 CarbonylContact O-C 3.38Å; D852-T855 PolarHBondContact O-N 3.4Å; D852-T855 PolarHBondContact O-OG1 3.38Å; T855-L858 PolarHBondContact O-N 2.89Å; T855-R859 WeakPolarHBondContact O-CB 3.07Å; T855-R859 WeakPolarHBondContact O-CD 3.31Å; T855-R859 WeakPolarHBondContact O-CG 3.47Å; T855-R859 PolarHBondContact O-N 2.76Å
856	I	72.3	Confident	67.1	Low	63 Å²	63	112.7 Å²	112.7	32%	0.323	52%	0.522	S	S	.	.	H	α-helix	trans	-67.3	-45.2	174.4	-71.5	163.2	0	0	0	110.4	D852 W853 E854 L858 R859 I860	D852-I856 HydrophobicContact CB-CD1 4.4Å; D852-I856 VanDerWaalsContact O-CG1 3.28Å; D852-I856 WeakPolarHBondContact O-CG1 3.42Å; D852-I856 PolarHBondContact O-N 2.95Å; W853-I856 PolarHBondContact O-N 3.45Å; E854-I856 VanDerWaalsContact C-N 3.27Å; E854-I856 PolarHBondContact O-N 2.92Å; I856-L858 PolarHBondContact O-N 3.34Å; I856-R859 PolarHBondContact O-N 3.06Å; I856-I860 HydrophobicContact CG2-CD1 3.65Å; I856-I860 HydrophobicContact CG2-CG1 4.41Å; I856-I860 WeakPolarHBondContact O-CB 3.4Å; I856-I860 VanDerWaalsContact O-CG1 3.3Å; I856-I860 WeakPolarHBondContact O-CG1 3.4Å; I856-I860 PolarHBondContact O-N 3.38Å
857	R	75.1	Confident	68.7	Low	150 Å²	150	107.7 Å²	107.7	57%	0.566	50%	0.501	S	S	*	.	H	α-helix	trans	-58.6	-45.4	172.9	-73.4	172.6	-167.4	172.7	6.8	112.1	W853 E854 I860 K861	W853-R857 HydrophobicContact CE3-CG 3.67Å; W853-R857 HydrophobicContact CZ3-CG 3.62Å; W853-R857 VanDerWaalsContact CZ3-NE 3.3Å; W853-R857 WeakPolarHBondContact O-CG 3.38Å; W853-R857 PolarHBondContact O-N 2.94Å; E854-R857 PolarHBondContact O-N 2.98Å; R857-I860 PolarHBondContact O-N 3.5Å; R857-K861 WeakPolarHBondContact O-CB 3.4Å; R857-K861 PolarHBondContact O-N 3.22Å
858	L	74.2	Confident	70.6	Confident	88 Å²	88	102 Å²	102	46%	0.461	48%	0.483	S	S	.	.	H	α-helix	trans	-63.4	-41.6	178.2	-70.2	171.1	0	0	0	111.6	E854 T855 I856 K861 Q862	E854-L858 WeakPolarHBondContact O-CG 3.25Å; E854-L858 PolarHBondContact O-N 3.16Å; T855-L858 PolarHBondContact O-N 2.89Å; I856-L858 PolarHBondContact O-N 3.34Å; L858-K861 PolarHBondContact O-N 3.04Å; L858-Q862 WeakPolarHBondContact O-CB 3.42Å; L858-Q862 VanDerWaalsContact O-CG 3.28Å; L858-Q862 WeakPolarHBondContact O-CG 3.46Å; L858-Q862 PolarHBondContact O-N 3.04Å
859	R	71.4	Confident	72.3	Confident	134 Å²	134	102.9 Å²	102.9	51%	0.506	48%	0.479	S	S	.	.	H	α-helix	trans	-63.3	-47.3	173.7	-74.4	166.6	-179.8	178.8	1.3	112.1	T855 I856 K861 Q862 V863	T855-R859 WeakPolarHBondContact O-CB 3.07Å; T855-R859 WeakPolarHBondContact O-CD 3.31Å; T855-R859 WeakPolarHBondContact O-CG 3.47Å; T855-R859 PolarHBondContact O-N 2.76Å; I856-R859 PolarHBondContact O-N 3.06Å; R859-K861 VanDerWaalsContact C-N 3.31Å; R859-K861 PolarHBondContact O-N 2.87Å; R859-Q862 PolarHBondContact O-N 3.08Å; R859-V863 WeakPolarHBondContact O-CG2 3.17Å; R859-V863 PolarHBondContact O-N 3.14Å
860	I	75.8	Confident	74.1	Confident	82 Å²	82	97.6 Å²	97.6	42%	0.421	45%	0.454	S	S	.	.	H	α-helix	trans	-60.1	-42.2	177.2	-70.2	163.7	0	0	0	110.7	I856 R857 V863 K864	I856-I860 HydrophobicContact CG2-CD1 3.65Å; I856-I860 HydrophobicContact CG2-CG1 4.41Å; I856-I860 WeakPolarHBondContact O-CB 3.4Å; I856-I860 VanDerWaalsContact O-CG1 3.3Å; I856-I860 WeakPolarHBondContact O-CG1 3.4Å; I856-I860 PolarHBondContact O-N 3.38Å; R857-I860 PolarHBondContact O-N 3.5Å; I860-V863 PolarHBondContact O-N 3.03Å; I860-K864 HydrophobicContact CG2-CD 4.2Å; I860-K864 WeakPolarHBondContact O-CG 3.32Å; I860-K864 PolarHBondContact O-N 3.33Å
861	K	79.3	Confident	75.9	Confident	128 Å²	128	89.9 Å²	89.9	56%	0.557	43%	0.428	S	S	*	.	H	α-helix	trans	-61.8	-48.1	174.6	-178.2	173.5	172	177.2	0	111.6	R857 L858 R859 V863 K864 E865	R857-K861 WeakPolarHBondContact O-CB 3.4Å; R857-K861 PolarHBondContact O-N 3.22Å; L858-K861 PolarHBondContact O-N 3.04Å; R859-K861 VanDerWaalsContact C-N 3.31Å; R859-K861 PolarHBondContact O-N 2.87Å; K861-V863 VanDerWaalsContact C-N 3.33Å; K861-V863 PolarHBondContact O-N 3.32Å; K861-K864 PolarHBondContact O-N 3.44Å; K861-E865 WeakPolarHBondContact CE-OE1 3.46Å; K861-E865 WeakPolarHBondContact CG-OE1 3.36Å; K861-E865 IonicContact NZ-OE1 3.55Å; K861-E865 WeakPolarHBondContact O-CB 3.37Å; K861-E865 WeakPolarHBondContact O-CG 3.49Å; K861-E865 PolarHBondContact O-N 3.45Å
862	Q	75.7	Confident	77.7	Confident	97 Å²	97	88.4 Å²	88.4	45%	0.453	42%	0.42	S	S	.	.	H	α-helix	trans	-61.5	-37.4	176.9	-75.1	172.6	-15.2	0	0	113	L858 R859 C866	L858-Q862 WeakPolarHBondContact O-CB 3.42Å; L858-Q862 VanDerWaalsContact O-CG 3.28Å; L858-Q862 WeakPolarHBondContact O-CG 3.46Å; L858-Q862 PolarHBondContact O-N 3.04Å; R859-Q862 PolarHBondContact O-N 3.08Å; Q862-C866 VanDerWaalsContact O-CB 3.31Å; Q862-C866 WeakPolarHBondContact O-CB 3.37Å; Q862-C866 PolarHBondContact O-N 3.16Å
863	V	76	Confident	79.1	Confident	81 Å²	81	86.5 Å²	86.5	49%	0.491	41%	0.41	S	S	.	.	H	α-helix	trans	-65.2	-51.2	174.2	169.7	0	0	0	0	110.3	R859 I860 K861 E865 C866 E867	R859-V863 WeakPolarHBondContact O-CG2 3.17Å; R859-V863 PolarHBondContact O-N 3.14Å; I860-V863 PolarHBondContact O-N 3.03Å; K861-V863 VanDerWaalsContact C-N 3.33Å; K861-V863 PolarHBondContact O-N 3.32Å; V863-E865 VanDerWaalsContact C-N 3.29Å; V863-E865 PolarHBondContact O-N 3.09Å; V863-C866 CarbonylContact O-C 3.57Å; V863-C866 WeakPolarHBondContact O-CA 3.37Å; V863-C866 VanDerWaalsContact O-CB 3.28Å; V863-C866 WeakPolarHBondContact O-CB 3.45Å; V863-C866 PolarHBondContact O-N 3.32Å; V863-E867 HydrophobicContact CG1-CG 4.4Å; V863-E867 WeakPolarHBondContact O-CG 3.39Å; V863-E867 PolarHBondContact O-N 3.06Å
864	K	80.4	Confident	80.5	Confident	126 Å²	126	81.1 Å²	81.1	55%	0.548	39%	0.39	S	S	.	.	H	α-helix	trans	-61.5	-36	178.3	-70.3	-176	177.2	-170.3	0	112.5	I860 K861 A868	I860-K864 HydrophobicContact CG2-CD 4.2Å; I860-K864 WeakPolarHBondContact O-CG 3.32Å; I860-K864 PolarHBondContact O-N 3.33Å; K861-K864 PolarHBondContact O-N 3.44Å; K864-A868 VanDerWaalsContact O-CB 3.28Å; K864-A868 WeakPolarHBondContact O-CB 3.44Å; K864-A868 PolarHBondContact O-N 3.03Å
865	E	81	Confident	81.7	Confident	88 Å²	88	82.3 Å²	82.3	41%	0.411	39%	0.389	S	S	.	.	H	α-helix	trans	-69.8	-28.3	171.4	-73.9	173.2	-176.9	0	0	113.3	K861 V863 R869	K861-E865 WeakPolarHBondContact CE-OE1 3.46Å; K861-E865 WeakPolarHBondContact CG-OE1 3.36Å; K861-E865 IonicContact NZ-OE1 3.55Å; K861-E865 WeakPolarHBondContact O-CB 3.37Å; K861-E865 WeakPolarHBondContact O-CG 3.49Å; K861-E865 PolarHBondContact O-N 3.45Å; V863-E865 VanDerWaalsContact C-N 3.29Å; V863-E865 PolarHBondContact O-N 3.09Å; E865-R869 WeakPolarHBondContact O-CB 3.41Å; E865-R869 VanDerWaalsContact O-CG 3.32Å; E865-R869 WeakPolarHBondContact O-CG 3.4Å; E865-R869 PolarHBondContact O-N 3.4Å; E865-R869 PolarHBondContact O-NE 2.95Å
866	C	79.3	Confident	82.9	Confident	51 Å²	51	83.4 Å²	83.4	35%	0.345	39%	0.39	S	S	.	.	H	α-helix	trans	-74.5	-45.4	173.1	-166.4	0	0	0	0	111.2	Q862 V863 R869 Y870	Q862-C866 VanDerWaalsContact O-CB 3.31Å; Q862-C866 WeakPolarHBondContact O-CB 3.37Å; Q862-C866 PolarHBondContact O-N 3.16Å; V863-C866 CarbonylContact O-C 3.57Å; V863-C866 WeakPolarHBondContact O-CA 3.37Å; V863-C866 VanDerWaalsContact O-CB 3.28Å; V863-C866 WeakPolarHBondContact O-CB 3.45Å; V863-C866 PolarHBondContact O-N 3.32Å; C866-R869 PolarHBondContact O-N 2.92Å; C866-Y870 WeakPolarHBondContact O-CB 3.27Å; C866-Y870 PolarHBondContact O-N 2.99Å
867	E	82.8	Confident	83.9	Confident	93 Å²	93	80.5 Å²	80.5	44%	0.435	38%	0.375	S	S	.	.	H	α-helix	trans	-61.6	-46.2	175	-70	-179.8	122	0	0	111.6	V863 R869 Y870 Q871	V863-E867 HydrophobicContact CG1-CG 4.4Å; V863-E867 WeakPolarHBondContact O-CG 3.39Å; V863-E867 PolarHBondContact O-N 3.06Å; E867-R869 VanDerWaalsContact C-N 3.33Å; E867-R869 PolarHBondContact O-N 2.73Å; E867-Y870 PolarHBondContact O-N 3.29Å; E867-Q871 WeakPolarHBondContact O-CB 3.39Å; E867-Q871 WeakPolarHBondContact O-CG 3.2Å; E867-Q871 PolarHBondContact O-N 3.17Å
868	A	86.7	Confident	84.8	Confident	51 Å²	51	74.4 Å²	74.4	42%	0.421	36%	0.355	S	S	.	.	H	α-helix	trans	-59.8	-41.5	176.8	0	0	0	0	0	112.3	K864 N872	K864-A868 VanDerWaalsContact O-CB 3.28Å; K864-A868 WeakPolarHBondContact O-CB 3.44Å; K864-A868 PolarHBondContact O-N 3.03Å; A868-N872 WeakPolarHBondContact O-CB 3.37Å; A868-N872 VanDerWaalsContact O-CG 3.27Å; A868-N872 PolarHBondContact O-N 2.94Å; A868-N872 PolarHBondContact O-ND2 2.9Å
869	R	86.4	Confident	85.8	Confident	131 Å²	131	76.1 Å²	76.1	49%	0.494	36%	0.359	S	S	.	.	H	α-helix	trans	-65.4	-43.3	173.8	-77.6	178.9	-70.4	165.1	-2.6	112	E865 C866 E867 N872 V873	E865-R869 WeakPolarHBondContact O-CB 3.41Å; E865-R869 VanDerWaalsContact O-CG 3.32Å; E865-R869 WeakPolarHBondContact O-CG 3.4Å; E865-R869 PolarHBondContact O-N 3.4Å; E865-R869 PolarHBondContact O-NE 2.95Å; C866-R869 PolarHBondContact O-N 2.92Å; E867-R869 VanDerWaalsContact C-N 3.33Å; E867-R869 PolarHBondContact O-N 2.73Å; R869-N872 PolarHBondContact O-N 2.72Å; R869-V873 WeakPolarHBondContact O-CG2 3.18Å; R869-V873 PolarHBondContact O-N 3.5Å; R869-V873 VanDerWaalsContact O-N 3.09Å
870	Y	88.4	Confident	86.9	Confident	1 Å²	1	71.2 Å²	71.2	0%	0.004	34%	0.34	C	S	.	.	H	α-helix	trans	-62.5	-47	176.6	178.1	-109.6	0	0	0	111.8	D313 I365 V366 H369 R399 C866 E867 N872 V873 M874	D313-Y870 VanDerWaalsContact CG-OH 3.31Å; D313-Y870 PolarHBondContact OD1-OH 2.97Å; I365-Y870 HydrophobicContact CG2-CD2 4.06Å; V366-Y870 HydrophobicContact CG2-CE2 4.4Å; H369-Y870 HydrophobicContact CB-CD2 3.75Å; H369-Y870 HydrophobicContact CB-CE2 3.85Å; H369-Y870 HydrophobicContact CB-CG 4.21Å; H369-Y870 AromaticContact CE1-CD1 3.49Å; H369-Y870 VanDerWaalsContact CE1-CD1 3.49Å; H369-Y870 WeakPolarHBondContact CE1-CD1 3.35Å; H369-Y870 AromaticContact CE1-CG 3.78Å; H369-Y870 AromaticContact CG-CD1 3.85Å; H369-Y870 AromaticContact CG-CD2 3.78Å; H369-Y870 AromaticContact CG-CE2 3.98Å; H369-Y870 AromaticContact CG-CG 3.73Å; H369-Y870 WeakPolarHBondContact ND1-CB 3.19Å; H369-Y870 AromaticContact ND1-CD1 3.37Å; H369-Y870 WeakPolarHBondContact ND1-CD1 3.31Å; H369-Y870 AromaticContact ND1-CD2 3.68Å; H369-Y870 AromaticContact ND1-CE1 4Å; H369-Y870 AromaticContact ND1-CG 3.19Å; R399-Y870 VanDerWaalsContact NH2-CZ 3.34Å; R399-Y870 PolarHBondContact NH2-OH 2.67Å; C866-Y870 WeakPolarHBondContact O-CB 3.27Å; C866-Y870 PolarHBondContact O-N 2.99Å; E867-Y870 PolarHBondContact O-N 3.29Å; Y870-N872 VanDerWaalsContact C-N 3.34Å; Y870-N872 PolarHBondContact O-N 3.48Å; Y870-V873 CarbonylContact O-C 3.55Å; Y870-V873 PolarHBondContact O-N 3.4Å; Y870-V873 VanDerWaalsContact O-N 3.11Å; Y870-M874 HydrophobicContact CD1-CG 4.07Å; Y870-M874 HydrophobicContact CD2-CG 4.05Å; Y870-M874 HydrophobicContact CD2-SD 4.47Å; Y870-M874 HydrophobicContact CE1-CG 3.62Å; Y870-M874 HydrophobicContact CE1-SD 4.49Å; Y870-M874 HydrophobicContact CE2-CG 3.56Å; Y870-M874 HydrophobicContact CE2-SD 3.6Å; Y870-M874 HydrophobicContact CG-CG 4.26Å; Y870-M874 WeakPolarHBondContact O-CG 3.31Å; Y870-M874 PolarHBondContact O-N 3.15Å; Y870-M874 PolarHBondContact OH-SD 3.14Å; Y870-M874 VanDerWaalsContact OH-SD 3.42Å
871	Q	91.3	Very high	87.8	Confident	57 Å²	57	68.1 Å²	68.1	27%	0.266	32%	0.323	S	S	.	.	H	α-helix	trans	-64.9	-34.1	178.2	-71.9	-60.5	-22.8	0	0	113.1	N312 E867 R875	N312-Q871 PolarHBondContact O-NE2 2.96Å; N312-Q871 PolarHBondContact O-OE1 3.03Å; E867-Q871 WeakPolarHBondContact O-CB 3.39Å; E867-Q871 WeakPolarHBondContact O-CG 3.2Å; E867-Q871 PolarHBondContact O-N 3.17Å; Q871-R875 WeakPolarHBondContact O-CB 3.33Å; Q871-R875 PolarHBondContact O-N 3.48Å; Q871-R875 PolarHBondContact O-NE 3.19Å
872	N	92.4	Very high	88.4	Confident	84 Å²	84	62.7 Å²	62.7	45%	0.449	30%	0.3	S	S	.	.	H	α-helix	trans	-62.5	-46.6	169.5	-76.5	-21.4	0	0	0	111.6	A868 R869 Y870 R875 E876	A868-N872 WeakPolarHBondContact O-CB 3.37Å; A868-N872 VanDerWaalsContact O-CG 3.27Å; A868-N872 PolarHBondContact O-N 2.94Å; A868-N872 PolarHBondContact O-ND2 2.9Å; R869-N872 PolarHBondContact O-N 2.72Å; Y870-N872 VanDerWaalsContact C-N 3.34Å; Y870-N872 PolarHBondContact O-N 3.48Å; N872-R875 PolarHBondContact OD1-NH1 3.04Å; N872-R875 VanDerWaalsContact OD1-NH1 3.07Å; N872-R875 PolarHBondContact OD1-NH2 3.32Å; N872-E876 PolarHBondContact O-N 2.88Å
873	V	92	Very high	89.2	Confident	18 Å²	18	63.5 Å²	63.5	11%	0.109	31%	0.306	C	S	.	.	H	α-helix	trans	-64.6	-44.7	177.2	171.1	0	0	0	0	111.4	E362 I365 V366 R869 Y870 R875 E876 L877	E362-V873 HydrophobicContact CB-CG1 4.13Å; E362-V873 HydrophobicContact CG-CG1 4.24Å; E362-V873 HydrophobicContact CG-CG2 4.48Å; I365-V873 HydrophobicContact CB-CG2 4.48Å; I365-V873 HydrophobicContact CD1-CG2 4Å; I365-V873 HydrophobicContact CG2-CB 4.28Å; I365-V873 HydrophobicContact CG2-CG2 4.07Å; V366-V873 HydrophobicContact CG2-CG1 4.03Å; R869-V873 WeakPolarHBondContact O-CG2 3.18Å; R869-V873 PolarHBondContact O-N 3.5Å; R869-V873 VanDerWaalsContact O-N 3.09Å; Y870-V873 CarbonylContact O-C 3.55Å; Y870-V873 PolarHBondContact O-N 3.4Å; Y870-V873 VanDerWaalsContact O-N 3.11Å; V873-R875 PolarHBondContact O-N 3.32Å; V873-E876 PolarHBondContact O-N 3.25Å; V873-L877 HydrophobicContact CG1-CD1 3.72Å; V873-L877 HydrophobicContact CG1-CG 4.1Å; V873-L877 WeakPolarHBondContact O-CG 3.4Å; V873-L877 PolarHBondContact O-N 2.96Å
874	M	92.6	Very high	89.9	Confident	4 Å²	4	63.8 Å²	63.8	2%	0.02	30%	0.301	C	S	.	.	H	α-helix	trans	-64.4	-38	-179.7	-69.7	-51	-64.4	0	0	112.8	P314 I315 V366 Y870 L877 T878	P314-M874 HydrophobicContact CG-CE 3.62Å; I315-M874 HydrophobicContact CD1-CE 3.75Å; I315-M874 HydrophobicContact CD1-SD 4.15Å; I315-M874 HydrophobicContact CG1-CE 3.91Å; V366-M874 HydrophobicContact CG2-SD 4.12Å; Y870-M874 HydrophobicContact CD1-CG 4.07Å; Y870-M874 HydrophobicContact CD2-CG 4.05Å; Y870-M874 HydrophobicContact CD2-SD 4.47Å; Y870-M874 HydrophobicContact CE1-CG 3.62Å; Y870-M874 HydrophobicContact CE1-SD 4.49Å; Y870-M874 HydrophobicContact CE2-CG 3.56Å; Y870-M874 HydrophobicContact CE2-SD 3.6Å; Y870-M874 HydrophobicContact CG-CG 4.26Å; Y870-M874 WeakPolarHBondContact O-CG 3.31Å; Y870-M874 PolarHBondContact O-N 3.15Å; Y870-M874 PolarHBondContact OH-SD 3.14Å; Y870-M874 VanDerWaalsContact OH-SD 3.42Å; M874-L877 PolarHBondContact O-N 2.91Å; M874-L877 HydrophobicContact SD-CD1 4.09Å; M874-T878 WeakPolarHBondContact O-CB 3.42Å; M874-T878 PolarHBondContact O-N 2.98Å; M874-T878 PolarHBondContact O-OG1 2.9Å
875	R	93.7	Very high	90.3	Very high	144 Å²	144	60.5 Å²	60.5	54%	0.543	29%	0.287	S	S	.	.	H	α-helix	trans	-61.1	-43.3	171.9	-84.3	-176.7	-89.1	109.4	-1.1	112.2	Q871 N872 V873 K879	Q871-R875 WeakPolarHBondContact O-CB 3.33Å; Q871-R875 PolarHBondContact O-N 3.48Å; Q871-R875 PolarHBondContact O-NE 3.19Å; N872-R875 PolarHBondContact OD1-NH1 3.04Å; N872-R875 VanDerWaalsContact OD1-NH1 3.07Å; N872-R875 PolarHBondContact OD1-NH2 3.32Å; V873-R875 PolarHBondContact O-N 3.32Å; R875-K879 VanDerWaalsContact O-CB 3.31Å; R875-K879 WeakPolarHBondContact O-CB 3.38Å; R875-K879 PolarHBondContact O-N 3.38Å
876	E	93.7	Very high	90.7	Very high	80 Å²	80	60.6 Å²	60.6	37%	0.374	29%	0.29	S	S	.	.	H	α-helix	trans	-70.1	-38.3	177.8	-81.3	-64.6	124.3	0	0	113.3	N872 V873 K879 R880	N872-E876 PolarHBondContact O-N 2.88Å; V873-E876 PolarHBondContact O-N 3.25Å; E876-K879 IonicContact OE1-NZ 3.27Å; E876-R880 WeakPolarHBondContact O-CD 3.32Å; E876-R880 WeakPolarHBondContact O-CG 3.47Å; E876-R880 PolarHBondContact O-N 3.14Å; E876-R880 IonicContact OE2-NE 2.78Å; E876-R880 IonicContact OE2-NH2 2.8Å
877	L	94.4	Very high	91.1	Very high	2 Å²	2	66 Å²	66	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-64.8	-44.8	173.6	-67.1	174.1	0	0	0	111.5	Q356 T357 V366 V873 M874 K879 R880 Y881	Q356-L877 HydrophobicContact CB-CD2 3.82Å; Q356-L877 WeakPolarHBondContact O-CD2 3.2Å; T357-L877 HydrophobicContact CG2-CD1 4.16Å; T357-L877 HydrophobicContact CG2-CD2 3.84Å; V366-L877 HydrophobicContact CG2-CD1 3.64Å; V873-L877 HydrophobicContact CG1-CD1 3.72Å; V873-L877 HydrophobicContact CG1-CG 4.1Å; V873-L877 WeakPolarHBondContact O-CG 3.4Å; V873-L877 PolarHBondContact O-N 2.96Å; M874-L877 PolarHBondContact O-N 2.91Å; M874-L877 HydrophobicContact SD-CD1 4.09Å; L877-K879 PolarHBondContact O-N 3.48Å; L877-R880 PolarHBondContact O-N 2.92Å; L877-Y881 WeakPolarHBondContact O-CB 3.48Å; L877-Y881 PolarHBondContact O-N 2.92Å
878	T	93.6	Very high	91.3	Very high	22 Å²	22	64.3 Å²	64.3	14%	0.135	30%	0.302	C	S	.	.	H	α-helix	trans	-59.2	-47.2	176	-64.4	0	0	0	0	111.5	I308 M874 R880 Y881 L882	I308-T878 HydrophobicContact CB-CG2 4.33Å; I308-T878 HydrophobicContact CD1-CG2 4.32Å; I308-T878 HydrophobicContact CG1-CG2 4.08Å; I308-T878 HydrophobicContact CG2-CG2 3.44Å; I308-T878 VanDerWaalsContact CG2-CG2 3.44Å; M874-T878 WeakPolarHBondContact O-CB 3.42Å; M874-T878 PolarHBondContact O-N 2.98Å; M874-T878 PolarHBondContact O-OG1 2.9Å; T878-R880 PolarHBondContact O-N 2.71Å; T878-Y881 PolarHBondContact O-N 3.46Å; T878-L882 HydrophobicContact CG2-CD1 4.18Å; T878-L882 WeakPolarHBondContact O-CG 3.5Å; T878-L882 PolarHBondContact O-N 3.24Å
879	K	94.1	Very high	91	Very high	124 Å²	124	65.4 Å²	65.4	54%	0.539	31%	0.306	S	S	.	.	H	α-helix	trans	-58.7	-45.4	175.7	-177.9	179	176.1	-175.5	0	111.8	R875 E876 L877 L882 M883	R875-K879 VanDerWaalsContact O-CB 3.31Å; R875-K879 WeakPolarHBondContact O-CB 3.38Å; R875-K879 PolarHBondContact O-N 3.38Å; E876-K879 IonicContact OE1-NZ 3.27Å; L877-K879 PolarHBondContact O-N 3.48Å; K879-L882 PolarHBondContact O-N 3.34Å; K879-M883 WeakPolarHBondContact O-CG 3.4Å; K879-M883 PolarHBondContact O-N 2.98Å
880	R	95.1	Very high	90.7	Very high	32 Å²	32	66.2 Å²	66.2	12%	0.121	32%	0.316	C	S	.	.	H	α-helix	trans	-63.4	-42.2	175.9	-67.9	163.1	-161.3	-178.1	8.1	112.1	Q356 E362 E876 L877 T878 M883 Q884	Q356-R880 HydrophobicContact CB-CB 4.05Å; Q356-R880 HydrophobicContact CG-CB 4.21Å; Q356-R880 PolarHBondContact O-NH1 3.41Å; Q356-R880 VanDerWaalsContact O-NH1 3.14Å; E362-R880 IonicContact OE1-CZ 3.44Å; E362-R880 VanDerWaalsContact OE1-CZ 3.25Å; E362-R880 IonicContact OE1-NH1 3.36Å; E362-R880 PolarHBondContact OE1-NH1 3.41Å; E362-R880 IonicContact OE1-NH2 2.82Å; E362-R880 PolarHBondContact OE1-NH2 3.37Å; E362-R880 IonicContact OE2-CZ 2.71Å; E362-R880 IonicContact OE2-NH1 3.66Å; E362-R880 PolarHBondContact OE2-NH1 3.2Å; E876-R880 WeakPolarHBondContact O-CD 3.32Å; E876-R880 WeakPolarHBondContact O-CG 3.47Å; E876-R880 PolarHBondContact O-N 3.14Å; E876-R880 IonicContact OE2-NE 2.78Å; E876-R880 IonicContact OE2-NH2 2.8Å; L877-R880 PolarHBondContact O-N 2.92Å; T878-R880 PolarHBondContact O-N 2.71Å; R880-M883 PolarHBondContact O-N 3.12Å; R880-Q884 WeakPolarHBondContact O-CB 3.35Å; R880-Q884 PolarHBondContact O-N 2.59Å
881	Y	94.8	Very high	90.3	Very high	17 Å²	17	72.1 Å²	72.1	7%	0.067	35%	0.347	C	S	.	.	H	α-helix	trans	-61	-48.8	177.3	179.7	-96	0	0	0	111.6	P304 I308 F349 E352 M353 L877 T878 Q884 K885	P304-Y881 HydrophobicContact CB-CE1 4.12Å; I308-Y881 HydrophobicContact CD1-CD1 3.64Å; I308-Y881 HydrophobicContact CD1-CE1 3.98Å; F349-Y881 HydrophobicContact CD2-CE1 4.09Å; F349-Y881 HydrophobicContact CD2-CE2 4.45Å; F349-Y881 AromaticContact CD2-CZ 3.84Å; F349-Y881 HydrophobicContact CE2-CD1 4.42Å; F349-Y881 AromaticContact CE2-CE1 3.92Å; F349-Y881 HydrophobicContact CE2-CE1 3.92Å; E352-Y881 HydrophobicContact CB-CD2 4.09Å; E352-Y881 HydrophobicContact CB-CE2 3.55Å; E352-Y881 HydrophobicContact CG-CE2 4.47Å; E352-Y881 WeakPolarHBondContact OE2-CE2 3.27Å; E352-Y881 PolarHBondContact OE2-OH 3.11Å; M353-Y881 HydrophobicContact CE-CD1 3.56Å; M353-Y881 HydrophobicContact CE-CD2 4.24Å; M353-Y881 HydrophobicContact CE-CE1 4.28Å; M353-Y881 HydrophobicContact CE-CG 3.52Å; M353-Y881 HydrophobicContact SD-CD2 4.35Å; M353-Y881 HydrophobicContact SD-CG 3.99Å; L877-Y881 WeakPolarHBondContact O-CB 3.48Å; L877-Y881 PolarHBondContact O-N 2.92Å; T878-Y881 PolarHBondContact O-N 3.46Å; Y881-Q884 CarbonylContact O-C 3.59Å; Y881-Q884 PolarHBondContact O-N 2.79Å; Y881-K885 HydrophobicContact CE1-CD 4.33Å; Y881-K885 WeakPolarHBondContact O-CB 3.32Å; Y881-K885 PolarHBondContact O-N 3.36Å
882	L	92.7	Very high	89.7	Confident	13 Å²	13	74.9 Å²	74.9	7%	0.068	36%	0.364	C	S	.	.	H	α-helix	trans	-60.1	-48.2	177.3	-69.5	171.1	0	0	0	111.4	Y253 I308 T878 K879 Q884 K885 L886	Y253-L882 HydrophobicContact CD2-CD1 3.94Å; Y253-L882 HydrophobicContact CD2-CD2 3.62Å; Y253-L882 HydrophobicContact CD2-CG 4.45Å; Y253-L882 HydrophobicContact CE1-CD1 4.32Å; Y253-L882 HydrophobicContact CE2-CD1 3.5Å; Y253-L882 VanDerWaalsContact CE2-CD1 3.5Å; Y253-L882 HydrophobicContact CE2-CD2 4.06Å; Y253-L882 HydrophobicContact CE2-CG 4.45Å; Y253-L882 HydrophobicContact CG-CD1 4.5Å; Y253-L882 HydrophobicContact CG-CD2 4.03Å; I308-L882 HydrophobicContact CD1-CD2 3.83Å; I308-L882 HydrophobicContact CD1-CG 4.18Å; I308-L882 HydrophobicContact CG2-CD1 4.27Å; T878-L882 HydrophobicContact CG2-CD1 4.18Å; T878-L882 WeakPolarHBondContact O-CG 3.5Å; T878-L882 PolarHBondContact O-N 3.24Å; K879-L882 PolarHBondContact O-N 3.34Å; L882-Q884 VanDerWaalsContact C-N 3.28Å; L882-Q884 PolarHBondContact O-N 3.4Å; L882-K885 PolarHBondContact O-N 2.92Å; L882-K885 VanDerWaalsContact O-N 3.13Å; L882-L886 WeakPolarHBondContact O-CD1 3.4Å; L882-L886 PolarHBondContact O-N 3.13Å
883	M	91.8	Very high	89.2	Confident	115 Å²	115	78.6 Å²	78.6	57%	0.567	38%	0.382	S	S	*	.	H	α-helix	trans	-59.8	-37.2	176.1	-64.2	-70.5	95.4	0	0	112.4	K879 R880 L886 R887	K879-M883 WeakPolarHBondContact O-CG 3.4Å; K879-M883 PolarHBondContact O-N 2.98Å; R880-M883 PolarHBondContact O-N 3.12Å; M883-L886 HydrophobicContact CE-CD2 4.44Å; M883-R887 VanDerWaalsContact O-CB 3.23Å; M883-R887 WeakPolarHBondContact O-CB 3.18Å; M883-R887 PolarHBondContact O-N 3.24Å
884	Q	91.5	Very high	88.9	Confident	86 Å²	86	82.5 Å²	82.5	40%	0.402	41%	0.406	S	S	.	.	H	α-helix	trans	-72.1	-35.7	175	-177.7	56.3	62.2	0	0	112.3	R880 Y881 L882 S888	R880-Q884 WeakPolarHBondContact O-CB 3.35Å; R880-Q884 PolarHBondContact O-N 2.59Å; Y881-Q884 CarbonylContact O-C 3.59Å; Y881-Q884 PolarHBondContact O-N 2.79Å; L882-Q884 VanDerWaalsContact C-N 3.28Å; L882-Q884 PolarHBondContact O-N 3.4Å; Q884-S888 PolarHBondContact NE2-OG 3.1Å; Q884-S888 WeakPolarHBondContact O-CB 3.46Å; Q884-S888 PolarHBondContact O-N 2.96Å; Q884-S888 PolarHBondContact O-OG 3.1Å
885	K	88.8	Confident	88.4	Confident	58 Å²	58	85 Å²	85	25%	0.252	42%	0.422	S	S	.	.	H	α-helix	trans	-66	-49.2	175.9	177.8	178.3	164.2	-177.7	0	111.2	D251 S305 Y881 L882 S888 S889	D251-K885 PolarHBondContact O-NZ 2.98Å; D251-K885 IonicContact OD1-NZ 2.91Å; D251-K885 PolarHBondContact OD1-NZ 2.94Å; D251-K885 IonicContact OD2-NZ 3.8Å; D251-K885 PolarHBondContact OD2-NZ 3.35Å; S305-K885 PolarHBondContact OG-NZ 2.99Å; Y881-K885 HydrophobicContact CE1-CD 4.33Å; Y881-K885 WeakPolarHBondContact O-CB 3.32Å; Y881-K885 PolarHBondContact O-N 3.36Å; L882-K885 PolarHBondContact O-N 2.92Å; L882-K885 VanDerWaalsContact O-N 3.13Å; K885-S888 WeakPolarHBondContact O-CB 3.42Å; K885-S888 PolarHBondContact O-N 3.37Å; K885-S888 VanDerWaalsContact O-N 3.15Å; K885-S889 PolarHBondContact O-N 3.16Å; K885-S889 VanDerWaalsContact O-N 3.15Å
886	L	87.7	Confident	88	Confident	89 Å²	89	81.8 Å²	81.8	47%	0.466	43%	0.425	S	S	.	.	H	α-helix	trans	-55.9	-53	174.1	-89.3	73	0	0	0	110.2	L882 M883 S888 S889 E890	L882-L886 WeakPolarHBondContact O-CD1 3.4Å; L882-L886 PolarHBondContact O-N 3.13Å; M883-L886 HydrophobicContact CE-CD2 4.44Å; L886-S888 PolarHBondContact O-N 3.22Å; L886-S889 PolarHBondContact O-N 2.99Å; L886-E890 PolarHBondContact O-N 3.43Å; L886-E890 VanDerWaalsContact O-N 3.08Å
887	R	89.1	Confident	87.4	Confident	164 Å²	164	83.2 Å²	83.2	62%	0.619	44%	0.436	S	S	*	.	H	α-helix	trans	-62.1	-23.9	178.6	-174	171.1	-175.3	-153.6	-0.4	114.2	M883 E890 N891	M883-R887 VanDerWaalsContact O-CB 3.23Å; M883-R887 WeakPolarHBondContact O-CB 3.18Å; M883-R887 PolarHBondContact O-N 3.24Å; R887-E890 WeakPolarHBondContact CA-OE2 3.5Å; R887-N891 PolarHBondContact O-ND2 3.44Å
888	S	86.1	Confident	86.9	Confident	58 Å²	58	85.7 Å²	85.7	41%	0.406	45%	0.449	S	S	.	.	H	α-helix	trans	-71.8	-43.5	172.2	-65.8	0	0	0	0	110.8	Q884 K885 L886 E890 N891	Q884-S888 PolarHBondContact NE2-OG 3.1Å; Q884-S888 WeakPolarHBondContact O-CB 3.46Å; Q884-S888 PolarHBondContact O-N 2.96Å; Q884-S888 PolarHBondContact O-OG 3.1Å; K885-S888 WeakPolarHBondContact O-CB 3.42Å; K885-S888 PolarHBondContact O-N 3.37Å; K885-S888 VanDerWaalsContact O-N 3.15Å; L886-S888 PolarHBondContact O-N 3.22Å; S888-E890 VanDerWaalsContact C-N 3.31Å; S888-E890 PolarHBondContact O-N 3.23Å; S888-N891 PolarHBondContact O-N 3.29Å; S888-N891 VanDerWaalsContact O-N 3.13Å; S888-N891 PolarHBondContact O-ND2 3.24Å
889	S	80.1	Confident	86.5	Confident	74 Å²	74	90 Å²	90	52%	0.517	47%	0.47	S	S	.	.	H	α-helix	trans	-67.1	-29.1	179.3	-163.7	0	0	0	0	113.3	K885 L886 N891 D892	K885-S889 PolarHBondContact O-N 3.16Å; K885-S889 VanDerWaalsContact O-N 3.15Å; L886-S889 PolarHBondContact O-N 2.99Å; S889-N891 PolarHBondContact O-N 3.21Å; S889-D892 VanDerWaalsContact CA-OD2 3.31Å; S889-D892 WeakPolarHBondContact CA-OD2 3.38Å; S889-D892 WeakPolarHBondContact O-CB 3.46Å; S889-D892 PolarHBondContact O-N 2.91Å; S889-D892 PolarHBondContact OG-OD2 3.45Å
890	E	80.6	Confident	85.9	Confident	149 Å²	149	85.7 Å²	85.7	70%	0.696	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-9.4	169.3	-69.1	174	169.4	0	0	114.9	L886 R887 S888	L886-E890 PolarHBondContact O-N 3.43Å; L886-E890 VanDerWaalsContact O-N 3.08Å; R887-E890 WeakPolarHBondContact CA-OE2 3.5Å; S888-E890 VanDerWaalsContact C-N 3.31Å; S888-E890 PolarHBondContact O-N 3.23Å
891	N	80.9	Confident	85.3	Confident	124 Å²	124	88 Å²	88	66%	0.663	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	4.9	175.8	-35.9	-97.7	0	0	0	113.4	R887 S888 S889	R887-N891 PolarHBondContact O-ND2 3.44Å; S888-N891 PolarHBondContact O-N 3.29Å; S888-N891 VanDerWaalsContact O-N 3.13Å; S888-N891 PolarHBondContact O-ND2 3.24Å; S889-N891 PolarHBondContact O-N 3.21Å
892	D	78.6	Confident	84.9	Confident	116 Å²	116	91.4 Å²	91.4	62%	0.62	49%	0.486	S	S	*	.	S	Bend	trans	-68.5	161.6	174.9	-69.9	-39.3	0	0	0	110.7	S889	S889-D892 VanDerWaalsContact CA-OD2 3.31Å; S889-D892 WeakPolarHBondContact CA-OD2 3.38Å; S889-D892 WeakPolarHBondContact O-CB 3.46Å; S889-D892 PolarHBondContact O-N 2.91Å; S889-D892 PolarHBondContact OG-OD2 3.45Å
893	I	82.2	Confident	84.7	Confident	161 Å²	161	96.1 Å²	96.1	83%	0.826	51%	0.507	S	S	*	.			trans	-84	125.3	-172.6	-59.1	172.2	0	0	0	109.4	T895	I893-T895 PolarHBondContact O-N 3.12Å
894	V	84	Confident	84.3	Confident	100 Å²	100	90.8 Å²	90.8	61%	0.606	48%	0.481	S	S	*	.			trans	-44.5	124	174.6	179.8	0	0	0	0	110.8	D898 L899	V894-D898 WeakPolarHBondContact CA-OD2 3.43Å; V894-D898 HydrophobicContact CG1-CB 4.07Å; V894-D898 WeakPolarHBondContact CG1-OD2 3.02Å; V894-L899 HydrophobicContact CG1-CG 4.5Å
895	T	84	Confident	84	Confident	58 Å²	58	91.5 Å²	91.5	36%	0.356	49%	0.487	S	S	.	.			trans	-87.6	-179.6	-172.8	86.4	0	0	0	0	112.2	I893 D897 D898	I893-T895 PolarHBondContact O-N 3.12Å; T895-D897 WeakPolarHBondContact OG1-CB 3.32Å; T895-D897 PolarHBondContact OG1-N 3.35Å; T895-D898 WeakPolarHBondContact CB-OD1 3.46Å; T895-D898 WeakPolarHBondContact CG2-OD1 3.48Å; T895-D898 VanDerWaalsContact N-CG 3.34Å; T895-D898 PolarHBondContact N-OD2 2.95Å; T895-D898 PolarHBondContact OG1-N 3.1Å; T895-D898 PolarHBondContact OG1-OD1 3.43Å
896	A	84.7	Confident	84	Confident	75 Å²	75	94.2 Å²	94.2	62%	0.62	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-21.1	169.5	0	0	0	0	0	112.2	S900	A896-S900 PolarHBondContact O-N 3.1Å
897	D	80.8	Confident	83.9	Confident	111 Å²	111	90.7 Å²	90.7	59%	0.594	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-37.6	-170.6	-48.2	-47.5	0	0	0	109.5	T895 L899 S900 E901	T895-D897 WeakPolarHBondContact OG1-CB 3.32Å; T895-D897 PolarHBondContact OG1-N 3.35Å; D897-L899 PolarHBondContact O-N 2.83Å; D897-S900 CarbonylContact O-C 3.56Å; D897-S900 VanDerWaalsContact O-CA 3.29Å; D897-S900 WeakPolarHBondContact O-CA 3.23Å; D897-S900 VanDerWaalsContact O-CB 3.23Å; D897-S900 WeakPolarHBondContact O-CB 3.28Å; D897-S900 PolarHBondContact O-N 3.34Å; D897-S900 PolarHBondContact O-OG 3.46Å; D897-E901 PolarHBondContact O-N 3.08Å
898	D	83	Confident	83.7	Confident	53 Å²	53	84.1 Å²	84.1	28%	0.283	47%	0.467	S	S	.	.	H	α-helix	trans	-56.3	-36.9	166.8	-35.1	-0.2	0	0	0	111.7	V894 T895 S900 I902	V894-D898 WeakPolarHBondContact CA-OD2 3.43Å; V894-D898 HydrophobicContact CG1-CB 4.07Å; V894-D898 WeakPolarHBondContact CG1-OD2 3.02Å; T895-D898 WeakPolarHBondContact CB-OD1 3.46Å; T895-D898 WeakPolarHBondContact CG2-OD1 3.48Å; T895-D898 VanDerWaalsContact N-CG 3.34Å; T895-D898 PolarHBondContact N-OD2 2.95Å; T895-D898 PolarHBondContact OG1-N 3.1Å; T895-D898 PolarHBondContact OG1-OD1 3.43Å; D898-S900 PolarHBondContact O-N 2.83Å; D898-I902 WeakPolarHBondContact O-CD1 3.42Å; D898-I902 WeakPolarHBondContact O-CG1 3.46Å; D898-I902 PolarHBondContact O-N 2.93Å
899	L	86.4	Confident	83.8	Confident	113 Å²	113	87.4 Å²	87.4	59%	0.592	47%	0.474	S	S	*	.	H	α-helix	trans	-74.5	-18.2	175.5	-70	172.8	0	0	0	112.4	V894 D897 K903	V894-L899 HydrophobicContact CG1-CG 4.5Å; D897-L899 PolarHBondContact O-N 2.83Å; L899-K903 WeakPolarHBondContact O-CB 3.5Å; L899-K903 PolarHBondContact O-N 2.91Å
900	S	81.4	Confident	84.2	Confident	34 Å²	34	87.7 Å²	87.7	24%	0.238	46%	0.464	C	S	.	.	H	α-helix	trans	-84.6	-40.3	174.9	89.8	0	0	0	0	111.6	A896 D897 D898 K903 G904	A896-S900 PolarHBondContact O-N 3.1Å; D897-S900 CarbonylContact O-C 3.56Å; D897-S900 VanDerWaalsContact O-CA 3.29Å; D897-S900 WeakPolarHBondContact O-CA 3.23Å; D897-S900 VanDerWaalsContact O-CB 3.23Å; D897-S900 WeakPolarHBondContact O-CB 3.28Å; D897-S900 PolarHBondContact O-N 3.34Å; D897-S900 PolarHBondContact O-OG 3.46Å; D898-S900 PolarHBondContact O-N 2.83Å; S900-K903 CarbonylContact O-C 3.35Å; S900-K903 WeakPolarHBondContact O-CB 3.45Å; S900-K903 PolarHBondContact O-N 3.26Å; S900-G904 PolarHBondContact O-N 2.85Å
901	E	81.6	Confident	84.4	Confident	80 Å²	80	81.5 Å²	81.5	37%	0.374	44%	0.435	S	S	.	.	H	α-helix	trans	-53.3	-59.9	169.4	169.4	-158.7	154.8	0	0	109.8	E177 D897 K903 G904 D905	E177-E901 HydrophobicContact CB-CG 4.32Å; E177-E901 HydrophobicContact CG-CB 4.18Å; E177-E901 HydrophobicContact CG-CG 3.98Å; D897-E901 PolarHBondContact O-N 3.08Å; E901-K903 PolarHBondContact O-N 3.32Å; E901-K903 VanDerWaalsContact O-N 3.11Å; E901-G904 CarbonylContact O-C 3.58Å; E901-G904 VanDerWaalsContact O-CA 3.32Å; E901-G904 WeakPolarHBondContact O-CA 3.43Å; E901-G904 PolarHBondContact O-N 3.29Å; E901-D905 PolarHBondContact O-N 3.5Å
902	I	86.9	Confident	84.6	Confident	88 Å²	88	80 Å²	80	45%	0.451	42%	0.424	S	S	.	.	H	α-helix	trans	-57.3	-33.5	-180	-66.9	167.1	0	0	0	111.6	D898 I906	D898-I902 WeakPolarHBondContact O-CD1 3.42Å; D898-I902 WeakPolarHBondContact O-CG1 3.46Å; D898-I902 PolarHBondContact O-N 2.93Å; I902-I906 HydrophobicContact CG2-CD1 3.89Å; I902-I906 WeakPolarHBondContact O-CB 3.19Å; I902-I906 WeakPolarHBondContact O-CD1 3.46Å; I902-I906 WeakPolarHBondContact O-CG1 3.35Å; I902-I906 PolarHBondContact O-N 2.85Å; I902-I906 VanDerWaalsContact O-N 3.11Å
903	K	87.6	Confident	85.1	Confident	113 Å²	113	78 Å²	78	49%	0.491	41%	0.413	S	S	.	.	H	α-helix	trans	-73.4	-35.2	175	165.5	-180	156.4	-81.5	0	112.2	L899 S900 E901 S907	L899-K903 WeakPolarHBondContact O-CB 3.5Å; L899-K903 PolarHBondContact O-N 2.91Å; S900-K903 CarbonylContact O-C 3.35Å; S900-K903 WeakPolarHBondContact O-CB 3.45Å; S900-K903 PolarHBondContact O-N 3.26Å; E901-K903 PolarHBondContact O-N 3.32Å; E901-K903 VanDerWaalsContact O-N 3.11Å; K903-S907 WeakPolarHBondContact O-CB 3.38Å; K903-S907 PolarHBondContact O-N 3.49Å; K903-S907 PolarHBondContact O-OG 3.49Å
904	G	83.9	Confident	85.3	Confident	2 Å²	2	72.7 Å²	72.7	2%	0.021	39%	0.386	C	S	.	.	H	α-helix	trans	-61.2	-55.5	171.3	0	0	0	0	0	110.5	S900 E901 I906 S907 A908	S900-G904 PolarHBondContact O-N 2.85Å; E901-G904 CarbonylContact O-C 3.58Å; E901-G904 VanDerWaalsContact O-CA 3.32Å; E901-G904 WeakPolarHBondContact O-CA 3.43Å; E901-G904 PolarHBondContact O-N 3.29Å; G904-I906 PolarHBondContact O-N 3.16Å; G904-S907 CarbonylContact O-C 3.56Å; G904-S907 WeakPolarHBondContact O-CA 3.46Å; G904-S907 VanDerWaalsContact O-CB 3.29Å; G904-S907 WeakPolarHBondContact O-CB 3.39Å; G904-S907 PolarHBondContact O-N 3.11Å; G904-A908 PolarHBondContact O-N 3.16Å
905	D	85.4	Confident	85.2	Confident	102 Å²	102	70.3 Å²	70.3	55%	0.545	37%	0.37	S	S	.	.	H	α-helix	trans	-52.2	-51.3	177.5	-115.7	21	0	0	0	112.6	E901 S907 A908 F909	E901-D905 PolarHBondContact O-N 3.5Å; D905-S907 PolarHBondContact O-N 3.12Å; D905-A908 PolarHBondContact O-N 3.47Å; D905-F909 WeakPolarHBondContact O-CB 3.29Å; D905-F909 PolarHBondContact O-N 3.25Å
906	I	89.5	Confident	85.3	Confident	114 Å²	114	71 Å²	71	59%	0.585	37%	0.37	S	S	*	.	H	α-helix	trans	-61.9	-29.7	177	-70.4	168	0	0	0	111.6	I902 G904 R910	I902-I906 HydrophobicContact CG2-CD1 3.89Å; I902-I906 WeakPolarHBondContact O-CB 3.19Å; I902-I906 WeakPolarHBondContact O-CD1 3.46Å; I902-I906 WeakPolarHBondContact O-CG1 3.35Å; I902-I906 PolarHBondContact O-N 2.85Å; I902-I906 VanDerWaalsContact O-N 3.11Å; G904-I906 PolarHBondContact O-N 3.16Å; I906-R910 VanDerWaalsContact O-CB 3.31Å; I906-R910 WeakPolarHBondContact O-CB 3.3Å; I906-R910 PolarHBondContact O-N 2.9Å
907	S	85.3	Confident	85.4	Confident	16 Å²	16	69.9 Å²	69.9	11%	0.112	35%	0.354	C	S	.	.	H	α-helix	trans	-77.5	-44.9	176.7	-57.2	0	0	0	0	111.8	Q139 K903 G904 D905 R910 H911	Q139-S907 CarbonylContact O-C 3.54Å; Q139-S907 WeakPolarHBondContact O-CB 3.1Å; K903-S907 WeakPolarHBondContact O-CB 3.38Å; K903-S907 PolarHBondContact O-N 3.49Å; K903-S907 PolarHBondContact O-OG 3.49Å; G904-S907 CarbonylContact O-C 3.56Å; G904-S907 WeakPolarHBondContact O-CA 3.46Å; G904-S907 VanDerWaalsContact O-CB 3.29Å; G904-S907 WeakPolarHBondContact O-CB 3.39Å; G904-S907 PolarHBondContact O-N 3.11Å; D905-S907 PolarHBondContact O-N 3.12Å; S907-R910 WeakPolarHBondContact O-CB 3.28Å; S907-R910 PolarHBondContact O-N 3.08Å; S907-H911 PolarHBondContact O-CE1 2.93Å; S907-H911 VanDerWaalsContact O-CE1 3.31Å; S907-H911 PolarHBondContact O-N 2.91Å; S907-H911 PolarHBondContact O-ND1 3.29Å
908	A	84.8	Confident	85.6	Confident	26 Å²	26	70 Å²	70	22%	0.215	35%	0.349	C	S	.	.	H	α-helix	trans	-62	-53.2	177	0	0	0	0	0	111.4	G904 D905 R910 H911 E912	G904-A908 PolarHBondContact O-N 3.16Å; D905-A908 PolarHBondContact O-N 3.47Å; A908-R910 PolarHBondContact O-N 3.4Å; A908-H911 PolarHBondContact O-N 2.93Å; A908-E912 PolarHBondContact O-N 3.43Å
909	F	89	Confident	85.6	Confident	127 Å²	127	72.1 Å²	72.1	56%	0.557	37%	0.368	S	S	*	.	H	α-helix	trans	-56.4	-34.8	176.3	175.1	-112.9	0	0	0	112.5	D905 L913	D905-F909 WeakPolarHBondContact O-CB 3.29Å; D905-F909 PolarHBondContact O-N 3.25Å; F909-L913 HydrophobicContact CZ-CD2 4.43Å; F909-L913 WeakPolarHBondContact O-CB 3.37Å; F909-L913 PolarHBondContact O-N 3.46Å
910	R	88.6	Confident	85.7	Confident	80 Å²	80	72 Å²	72	30%	0.302	37%	0.368	S	S	.	.	H	α-helix	trans	-62.9	-43.2	173.2	-176.3	-169.2	72.5	-173	-1.2	111.7	I906 S907 A908 L914 Y927	I906-R910 VanDerWaalsContact O-CB 3.31Å; I906-R910 WeakPolarHBondContact O-CB 3.3Å; I906-R910 PolarHBondContact O-N 2.9Å; S907-R910 WeakPolarHBondContact O-CB 3.28Å; S907-R910 PolarHBondContact O-N 3.08Å; A908-R910 PolarHBondContact O-N 3.4Å; R910-L914 HydrophobicContact CG-CD1 4.14Å; R910-L914 VanDerWaalsContact O-CD1 3.29Å; R910-L914 WeakPolarHBondContact O-CD1 3.42Å; R910-L914 WeakPolarHBondContact O-CG 3.49Å; R910-L914 PolarHBondContact O-N 2.78Å; R910-Y927 PolarHBondContact NH1-OH 3.39Å
911	H	84.5	Confident	85.6	Confident	19 Å²	19	73.4 Å²	73.4	9%	0.088	39%	0.388	C	S	.	.	H	α-helix	trans	-72.1	-42.9	179	-59.9	113.3	0	0	0	111.8	Q139 D141 S907 A908 L913 L914 D915	Q139-H911 PolarHBondContact O-CE1 3.11Å; Q139-H911 VanDerWaalsContact O-CE1 3.26Å; Q139-H911 PolarHBondContact O-ND1 2.73Å; D141-H911 HydrophobicContact CB-CB 4.35Å; S907-H911 PolarHBondContact O-CE1 2.93Å; S907-H911 VanDerWaalsContact O-CE1 3.31Å; S907-H911 PolarHBondContact O-N 2.91Å; S907-H911 PolarHBondContact O-ND1 3.29Å; A908-H911 PolarHBondContact O-N 2.93Å; H911-L913 PolarHBondContact O-N 2.79Å; H911-L914 PolarHBondContact O-N 2.82Å; H911-L914 VanDerWaalsContact O-N 3.13Å; H911-D915 PolarHBondContact O-N 2.91Å
912	E	85.3	Confident	85.5	Confident	91 Å²	91	74.6 Å²	74.6	43%	0.425	40%	0.395	S	S	.	.	H	α-helix	trans	-55.7	-51.3	174.9	-168.8	-143.3	168.7	0	0	111.3	A908 L914 D915 I916	A908-E912 PolarHBondContact O-N 3.43Å; E912-L914 VanDerWaalsContact C-N 3.27Å; E912-L914 PolarHBondContact O-N 3.34Å; E912-D915 PolarHBondContact O-N 2.73Å; E912-D915 VanDerWaalsContact O-N 3.14Å; E912-I916 HydrophobicContact CG-CD1 3.94Å; E912-I916 WeakPolarHBondContact O-CG1 3.47Å; E912-I916 PolarHBondContact O-N 2.86Å; E912-I916 WeakPolarHBondContact OE1-CD1 3.44Å
913	L	88.3	Confident	85	Confident	76 Å²	76	80.5 Å²	80.5	40%	0.398	42%	0.417	S	S	.	.	H	α-helix	trans	-58.3	-38.5	177.1	-179.9	62.2	0	0	0	112	F909 H911 L917	F909-L913 HydrophobicContact CZ-CD2 4.43Å; F909-L913 WeakPolarHBondContact O-CB 3.37Å; F909-L913 PolarHBondContact O-N 3.46Å; H911-L913 PolarHBondContact O-N 2.79Å; L913-L917 HydrophobicContact CD1-CD1 4.35Å; L913-L917 HydrophobicContact CD1-CG 4.34Å; L913-L917 HydrophobicContact CG-CD1 4.12Å; L913-L917 WeakPolarHBondContact O-CB 3.46Å; L913-L917 WeakPolarHBondContact O-CG 3.48Å; L913-L917 PolarHBondContact O-N 3.25Å
914	L	86	Confident	84.1	Confident	49 Å²	49	77.7 Å²	77.7	26%	0.257	41%	0.407	S	S	.	.	H	α-helix	trans	-68.8	-40.4	177.1	-66.9	166.2	0	0	0	111.7	R910 H911 E912 L917 K918 I924	R910-L914 HydrophobicContact CG-CD1 4.14Å; R910-L914 VanDerWaalsContact O-CD1 3.29Å; R910-L914 WeakPolarHBondContact O-CD1 3.42Å; R910-L914 WeakPolarHBondContact O-CG 3.49Å; R910-L914 PolarHBondContact O-N 2.78Å; H911-L914 PolarHBondContact O-N 2.82Å; H911-L914 VanDerWaalsContact O-N 3.13Å; E912-L914 VanDerWaalsContact C-N 3.27Å; E912-L914 PolarHBondContact O-N 3.34Å; L914-L917 PolarHBondContact O-N 3.26Å; L914-K918 WeakPolarHBondContact O-CB 3.39Å; L914-K918 PolarHBondContact O-N 2.98Å; L914-I924 HydrophobicContact CB-CD1 4.4Å; L914-I924 HydrophobicContact CD2-CD1 4.34Å; L914-I924 HydrophobicContact CD2-CG2 3.57Å; L914-I924 WeakPolarHBondContact O-CD1 3.36Å
915	D	82.5	Confident	83.3	Confident	50 Å²	50	82.9 Å²	82.9	27%	0.267	44%	0.44	S	S	.	.	H	α-helix	trans	-71.5	-31.6	175.3	-90.9	-24.5	0	0	0	113	G143 H911 E912 K918 S919	G143-D915 VanDerWaalsContact CA-OD2 3.32Å; G143-D915 WeakPolarHBondContact CA-OD2 3.22Å; H911-D915 PolarHBondContact O-N 2.91Å; E912-D915 PolarHBondContact O-N 2.73Å; E912-D915 VanDerWaalsContact O-N 3.14Å; D915-K918 PolarHBondContact O-N 3.45Å; D915-K918 WeakPolarHBondContact OD1-CD 3.1Å; D915-K918 IonicContact OD1-NZ 3.99Å; D915-K918 PolarHBondContact OD1-NZ 3.4Å; D915-S919 WeakPolarHBondContact O-CB 3.46Å; D915-S919 PolarHBondContact O-N 3.21Å; D915-S919 PolarHBondContact O-OG 2.82Å
916	I	86.1	Confident	82	Confident	71 Å²	71	81.7 Å²	81.7	36%	0.364	44%	0.444	S	S	.	.	H	α-helix	trans	-64.8	-46.2	170.2	-69.7	169.1	0	0	0	110.6	E912 K918 S919 N920	E912-I916 HydrophobicContact CG-CD1 3.94Å; E912-I916 WeakPolarHBondContact O-CG1 3.47Å; E912-I916 PolarHBondContact O-N 2.86Å; E912-I916 WeakPolarHBondContact OE1-CD1 3.44Å; I916-K918 VanDerWaalsContact C-N 3.28Å; I916-K918 PolarHBondContact O-N 2.89Å; I916-S919 WeakPolarHBondContact CA-OG 3.26Å; I916-S919 PolarHBondContact O-OG 2.82Å; I916-N920 WeakPolarHBondContact O-CB 3.4Å; I916-N920 PolarHBondContact O-N 3.43Å; I916-N920 VanDerWaalsContact O-N 3.08Å; I916-N920 PolarHBondContact O-ND2 2.94Å
917	L	87.4	Confident	80.4	Confident	52 Å²	52	81.3 Å²	81.3	27%	0.272	44%	0.436	S	S	.	.	H	α-helix	trans	-62.2	-37	176.2	-71.4	170	0	0	0	111.6	L913 L914 N920 G921 M922 I924	L913-L917 HydrophobicContact CD1-CD1 4.35Å; L913-L917 HydrophobicContact CD1-CG 4.34Å; L913-L917 HydrophobicContact CG-CD1 4.12Å; L913-L917 WeakPolarHBondContact O-CB 3.46Å; L913-L917 WeakPolarHBondContact O-CG 3.48Å; L913-L917 PolarHBondContact O-N 3.25Å; L914-L917 PolarHBondContact O-N 3.26Å; L917-N920 CarbonylContact O-C 3.53Å; L917-N920 PolarHBondContact O-N 3.21Å; L917-G921 PolarHBondContact O-N 2.93Å; L917-M922 HydrophobicContact CD2-CE 3.47Å; L917-M922 VanDerWaalsContact CD2-CE 3.47Å; L917-M922 HydrophobicContact CD2-SD 3.71Å; L917-M922 WeakPolarHBondContact O-CB 3.48Å; L917-M922 PolarHBondContact O-N 3.15Å; L917-I924 HydrophobicContact CB-CD1 3.48Å; L917-I924 VanDerWaalsContact CB-CD1 3.48Å; L917-I924 HydrophobicContact CB-CG1 4.16Å
918	K	83.1	Confident	78.9	Confident	114 Å²	114	84.7 Å²	84.7	50%	0.496	45%	0.45	S	S	.	.	H	α-helix	trans	-70.5	-44	-179.6	176.8	-169.1	171.2	-169.2	0	112.3	L914 D915 I916 N920 G921 I924	L914-K918 WeakPolarHBondContact O-CB 3.39Å; L914-K918 PolarHBondContact O-N 2.98Å; D915-K918 PolarHBondContact O-N 3.45Å; D915-K918 WeakPolarHBondContact OD1-CD 3.1Å; D915-K918 IonicContact OD1-NZ 3.99Å; D915-K918 PolarHBondContact OD1-NZ 3.4Å; I916-K918 VanDerWaalsContact C-N 3.28Å; I916-K918 PolarHBondContact O-N 2.89Å; K918-N920 VanDerWaalsContact C-N 3.3Å; K918-G921 PolarHBondContact O-N 3.48Å; K918-I924 HydrophobicContact CB-CD1 3.86Å
919	S	84.2	Confident	77	Confident	97 Å²	97	91.2 Å²	91.2	68%	0.678	47%	0.474	S	S	*	.	H	α-helix	trans	-66.3	-32.3	174.9	51.9	0	0	0	0	112.3	D915 I916 G921	D915-S919 WeakPolarHBondContact O-CB 3.46Å; D915-S919 PolarHBondContact O-N 3.21Å; D915-S919 PolarHBondContact O-OG 2.82Å; I916-S919 WeakPolarHBondContact CA-OG 3.26Å; I916-S919 PolarHBondContact O-OG 2.82Å; S919-G921 PolarHBondContact O-N 3.31Å
920	N	87.5	Confident	74.9	Confident	112 Å²	112	88.8 Å²	88.8	60%	0.599	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	11.9	168.9	-73.5	-77.1	0	0	0	114.1	I916 L917 K918 M922	I916-N920 WeakPolarHBondContact O-CB 3.4Å; I916-N920 PolarHBondContact O-N 3.43Å; I916-N920 VanDerWaalsContact O-N 3.08Å; I916-N920 PolarHBondContact O-ND2 2.94Å; L917-N920 CarbonylContact O-C 3.53Å; L917-N920 PolarHBondContact O-N 3.21Å; K918-N920 VanDerWaalsContact C-N 3.3Å; N920-M922 VanDerWaalsContact C-N 3.28Å; N920-M922 HydrophobicContact CB-CE 3.78Å; N920-M922 PolarHBondContact O-N 3.23Å
921	G	80.4	Confident	73	Confident	63 Å²	63	85.9 Å²	85.9	65%	0.649	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	9.7	172.8	0	0	0	0	0	115.8	L917 K918 S919	L917-G921 PolarHBondContact O-N 2.93Å; K918-G921 PolarHBondContact O-N 3.48Å; S919-G921 PolarHBondContact O-N 3.31Å
922	M	80.1	Confident	71.1	Confident	104 Å²	104	87.4 Å²	87.4	51%	0.512	47%	0.473	S	S	.	.			trans	-76.1	143.1	177.3	-70.1	178.7	-100.9	0	0	111.3	L917 N920 I924	L917-M922 HydrophobicContact CD2-CE 3.47Å; L917-M922 VanDerWaalsContact CD2-CE 3.47Å; L917-M922 HydrophobicContact CD2-SD 3.71Å; L917-M922 WeakPolarHBondContact O-CB 3.48Å; L917-M922 PolarHBondContact O-N 3.15Å; N920-M922 VanDerWaalsContact C-N 3.28Å; N920-M922 HydrophobicContact CB-CE 3.78Å; N920-M922 PolarHBondContact O-N 3.23Å; M922-I924 PolarHBondContact O-N 2.77Å
923	K	76.2	Confident	69.1	Low	213 Å²	213	90.7 Å²	90.7	93%	0.926	49%	0.486	S	S	*	.			trans	-81.7	113.5	-178.1	-67.8	-177.8	-179	177.2	0	110.5
924	I	68	Low	67	Low	54 Å²	54	92.6 Å²	92.6	28%	0.277	50%	0.496	S	S	.	.			trans	-109	143.1	-174.8	-63.4	175.7	0	0	0	110.6	L914 L917 K918 M922 A926	L914-I924 HydrophobicContact CB-CD1 4.4Å; L914-I924 HydrophobicContact CD2-CD1 4.34Å; L914-I924 HydrophobicContact CD2-CG2 3.57Å; L914-I924 WeakPolarHBondContact O-CD1 3.36Å; L917-I924 HydrophobicContact CB-CD1 3.48Å; L917-I924 VanDerWaalsContact CB-CD1 3.48Å; L917-I924 HydrophobicContact CB-CG1 4.16Å; K918-I924 HydrophobicContact CB-CD1 3.86Å; M922-I924 PolarHBondContact O-N 2.77Å; I924-A926 PolarHBondContact O-N 3.45Å
925	P	66.2	Low	65.3	Low	110 Å²	110	95.1 Å²	95.1	71%	0.714	50%	0.502	S	S	*	.			trans	-60.9	122.8	168.3	25.8	-35.2	0	0	0	111.3	Y927	P925-Y927 PolarHBondContact O-N 2.94Å
926	A	59.5	Low	63.6	Low	77 Å²	77	99.8 Å²	99.8	64%	0.636	52%	0.516	S	S	*	.			trans	-71	71.1	-176.9	0	0	0	0	0	113.5	I924 H928 K929	I924-A926 PolarHBondContact O-N 3.45Å; A926-H928 PolarHBondContact O-N 3Å; A926-H928 VanDerWaalsContact O-N 3.11Å; A926-K929 PolarHBondContact O-N 2.83Å
927	Y	55.7	Low	61.8	Low	107 Å²	107	98.4 Å²	98.4	42%	0.42	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-37.1	-171.7	-167.2	-116.9	0	0	0	113.9	R910 P925 K929 T930 V931	R910-Y927 PolarHBondContact NH1-OH 3.39Å; P925-Y927 PolarHBondContact O-N 2.94Å; Y927-K929 VanDerWaalsContact C-N 3.29Å; Y927-K929 PolarHBondContact O-N 2.75Å; Y927-T930 WeakPolarHBondContact O-CA 3.11Å; Y927-T930 WeakPolarHBondContact O-CB 3.48Å; Y927-T930 PolarHBondContact O-N 3.47Å; Y927-V931 HydrophobicContact CD1-CG2 3.63Å; Y927-V931 HydrophobicContact CD2-CG2 4.21Å; Y927-V931 HydrophobicContact CE1-CG2 3.28Å; Y927-V931 HydrophobicContact CE2-CG2 3.9Å; Y927-V931 HydrophobicContact CG-CG2 4.08Å; Y927-V931 VanDerWaalsContact CZ-CG2 3.43Å; Y927-V931 PolarHBondContact O-N 2.82Å
928	H	53.1	Low	60.1	Low	86 Å²	86	104.7 Å²	104.7	40%	0.398	54%	0.539	S	S	.	.	H	α-helix	trans	-57.3	-32.3	-177.6	-159.9	-69.7	0	0	0	114.5	L132 A926 S932	L132-H928 WeakPolarHBondContact CD1-NE2 3.3Å; A926-H928 PolarHBondContact O-N 3Å; A926-H928 VanDerWaalsContact O-N 3.11Å; H928-S932 PolarHBondContact O-OG 3.18Å
929	K	46	Very low	58.4	Low	164 Å²	164	102 Å²	102	71%	0.713	53%	0.528	S	S	*	.	H	α-helix	trans	-83	-12.6	175.8	-75.9	-175.1	177.2	176.9	0	113.6	A926 Y927 K933	A926-K929 PolarHBondContact O-N 2.83Å; Y927-K929 VanDerWaalsContact C-N 3.29Å; Y927-K929 PolarHBondContact O-N 2.75Å; K929-K933 WeakPolarHBondContact O-CG 3.49Å
930	T	44.9	Very low	56.8	Low	76 Å²	76	100.2 Å²	100.2	47%	0.466	52%	0.519	S	S	.	.	H	α-helix	trans	-95.4	-43.2	179	-44.2	0	0	0	0	110.8	Y927 K933 L934	Y927-T930 WeakPolarHBondContact O-CA 3.11Å; Y927-T930 WeakPolarHBondContact O-CB 3.48Å; Y927-T930 PolarHBondContact O-N 3.47Å; T930-K933 PolarHBondContact O-N 2.72Å; T930-L934 HydrophobicContact CG2-CD1 3.93Å; T930-L934 HydrophobicContact CG2-CG 4.43Å; T930-L934 WeakPolarHBondContact O-CB 3.43Å; T930-L934 WeakPolarHBondContact O-CG 3.32Å; T930-L934 PolarHBondContact O-N 3.04Å
931	V	48.8	Very low	54.9	Low	18 Å²	18	101.8 Å²	101.8	11%	0.109	52%	0.518	C	S	.	.	H	α-helix	trans	-66.1	-44	178.4	178.8	0	0	0	0	111.9	Y135 Y927 K933 L934 R935	Y135-V931 HydrophobicContact CE1-CG1 3.96Å; Y135-V931 WeakPolarHBondContact OH-CG1 3.49Å; Y927-V931 HydrophobicContact CD1-CG2 3.63Å; Y927-V931 HydrophobicContact CD2-CG2 4.21Å; Y927-V931 HydrophobicContact CE1-CG2 3.28Å; Y927-V931 HydrophobicContact CE2-CG2 3.9Å; Y927-V931 HydrophobicContact CG-CG2 4.08Å; Y927-V931 VanDerWaalsContact CZ-CG2 3.43Å; Y927-V931 PolarHBondContact O-N 2.82Å; V931-K933 PolarHBondContact O-N 2.73Å; V931-L934 PolarHBondContact O-N 3.18Å; V931-L934 VanDerWaalsContact O-N 3.13Å; V931-R935 VanDerWaalsContact O-CB 3.3Å; V931-R935 WeakPolarHBondContact O-CB 3.47Å; V931-R935 PolarHBondContact O-N 3.06Å
932	S	44.7	Very low	53.5	Low	51 Å²	51	103.7 Å²	103.7	36%	0.357	51%	0.51	S	S	.	.	H	α-helix	trans	-58	-34.5	174.4	48	0	0	0	0	112.8	H928 R936	H928-S932 PolarHBondContact O-OG 3.18Å; S932-R936 VanDerWaalsContact O-CB 3.26Å; S932-R936 WeakPolarHBondContact O-CB 3.44Å; S932-R936 VanDerWaalsContact O-CG 3.31Å; S932-R936 WeakPolarHBondContact O-CG 3.47Å; S932-R936 PolarHBondContact O-N 3.34Å
933	K	42.9	Very low	52.2	Low	161 Å²	161	103.7 Å²	103.7	70%	0.7	51%	0.512	S	S	*	.	H	α-helix	trans	-76.4	-38	172.9	-73.4	-175.9	175.9	-174.2	0	113.6	K929 T930 V931 G937	K929-K933 WeakPolarHBondContact O-CG 3.49Å; T930-K933 PolarHBondContact O-N 2.72Å; V931-K933 PolarHBondContact O-N 2.73Å; K933-G937 WeakPolarHBondContact O-CA 3.4Å; K933-G937 PolarHBondContact O-N 3.01Å
934	L	44.5	Very low	51.2	Low	116 Å²	116	96.1 Å²	96.1	61%	0.607	49%	0.486	S	S	*	.	H	α-helix	trans	-71.2	-35.9	176.7	-75.8	167.2	0	0	0	112.3	T930 V931 G937 R938	T930-L934 HydrophobicContact CG2-CD1 3.93Å; T930-L934 HydrophobicContact CG2-CG 4.43Å; T930-L934 WeakPolarHBondContact O-CB 3.43Å; T930-L934 WeakPolarHBondContact O-CG 3.32Å; T930-L934 PolarHBondContact O-N 3.04Å; V931-L934 PolarHBondContact O-N 3.18Å; V931-L934 VanDerWaalsContact O-N 3.13Å; L934-G937 PolarHBondContact O-N 3.34Å; L934-R938 WeakPolarHBondContact O-CB 3.44Å; L934-R938 PolarHBondContact O-N 3.33Å
935	R	49.8	Very low	50.4	Low	101 Å²	101	98.1 Å²	98.1	38%	0.381	49%	0.494	S	S	.	.	H	α-helix	trans	-75.3	-48.7	176.4	-171.9	163.9	178.6	158.7	4.8	110.5	E138 V931 G937 R938 E939	E138-R935 IonicContact OE2-NH1 2.83Å; E138-R935 PolarHBondContact OE2-NH1 3.31Å; V931-R935 VanDerWaalsContact O-CB 3.3Å; V931-R935 WeakPolarHBondContact O-CB 3.47Å; V931-R935 PolarHBondContact O-N 3.06Å; R935-G937 PolarHBondContact O-N 2.82Å; R935-R938 PolarHBondContact O-N 3.48Å; R935-R938 VanDerWaalsContact O-N 3.08Å; R935-E939 VanDerWaalsContact CG-CD 3.47Å; R935-E939 HydrophobicContact CG-CG 4.16Å; R935-E939 WeakPolarHBondContact CG-OE1 3.25Å; R935-E939 IonicContact CZ-OE1 2.85Å; R935-E939 IonicContact NE-OE1 3.03Å; R935-E939 PolarHBondContact NE-OE1 2.85Å; R935-E939 IonicContact NH2-OE1 2.65Å; R935-E939 PolarHBondContact NH2-OE1 2.86Å; R935-E939 VanDerWaalsContact O-CB 3.27Å; R935-E939 WeakPolarHBondContact O-CB 3.38Å; R935-E939 WeakPolarHBondContact O-CG 3.34Å; R935-E939 PolarHBondContact O-N 2.87Å
936	R	47.7	Very low	49.9	Very low	149 Å²	149	97.2 Å²	97.2	56%	0.562	48%	0.482	S	S	*	.	H	α-helix	trans	-56.9	-32.9	166.7	-74.9	-178.6	-178.8	159.3	0.1	112.5	D128 S932 A940	D128-R936 IonicContact OD2-CZ 3.27Å; D128-R936 IonicContact OD2-NE 2.62Å; D128-R936 IonicContact OD2-NH2 3.66Å; D128-R936 PolarHBondContact OD2-NH2 3.5Å; S932-R936 VanDerWaalsContact O-CB 3.26Å; S932-R936 WeakPolarHBondContact O-CB 3.44Å; S932-R936 VanDerWaalsContact O-CG 3.31Å; S932-R936 WeakPolarHBondContact O-CG 3.47Å; S932-R936 PolarHBondContact O-N 3.34Å; R936-A940 WeakPolarHBondContact O-CA 3.34Å; R936-A940 WeakPolarHBondContact O-CB 3.45Å; R936-A940 PolarHBondContact O-N 2.88Å
937	G	47.7	Very low	49.6	Very low	41 Å²	41	98.1 Å²	98.1	42%	0.423	47%	0.473	S	S	.	.	H	α-helix	trans	-67.6	-44.4	173.8	0	0	0	0	0	113.3	K933 L934 R935 Y941	K933-G937 WeakPolarHBondContact O-CA 3.4Å; K933-G937 PolarHBondContact O-N 3.01Å; L934-G937 PolarHBondContact O-N 3.34Å; R935-G937 PolarHBondContact O-N 2.82Å; G937-Y941 VanDerWaalsContact O-CB 3.25Å; G937-Y941 WeakPolarHBondContact O-CB 3.37Å; G937-Y941 PolarHBondContact O-N 3.47Å
938	R	50.9	Low	49.5	Very low	184 Å²	184	97.8 Å²	97.8	69%	0.694	48%	0.475	S	S	*	.	H	α-helix	trans	-75.3	-36.3	178.4	-177.1	177.4	-72.2	170.4	-3.8	112.6	L934 R935 Y941 Q942	L934-R938 WeakPolarHBondContact O-CB 3.44Å; L934-R938 PolarHBondContact O-N 3.33Å; R935-R938 PolarHBondContact O-N 3.48Å; R935-R938 VanDerWaalsContact O-N 3.08Å; R938-Y941 PolarHBondContact O-N 3.26Å; R938-Q942 WeakPolarHBondContact O-CB 3.42Å; R938-Q942 WeakPolarHBondContact O-CG 3.48Å; R938-Q942 PolarHBondContact O-N 2.97Å
939	E	48.8	Very low	49.2	Very low	57 Å²	57	100.2 Å²	100.2	27%	0.266	49%	0.488	S	S	.	.	H	α-helix	trans	-72	-42.3	174.3	-71.3	168.6	164.5	0	0	110.3	R935 Y941 Q942 L943	R935-E939 VanDerWaalsContact CG-CD 3.47Å; R935-E939 HydrophobicContact CG-CG 4.16Å; R935-E939 WeakPolarHBondContact CG-OE1 3.25Å; R935-E939 IonicContact CZ-OE1 2.85Å; R935-E939 IonicContact NE-OE1 3.03Å; R935-E939 PolarHBondContact NE-OE1 2.85Å; R935-E939 IonicContact NH2-OE1 2.65Å; R935-E939 PolarHBondContact NH2-OE1 2.86Å; R935-E939 VanDerWaalsContact O-CB 3.27Å; R935-E939 WeakPolarHBondContact O-CB 3.38Å; R935-E939 WeakPolarHBondContact O-CG 3.34Å; R935-E939 PolarHBondContact O-N 2.87Å; E939-Y941 VanDerWaalsContact C-N 3.29Å; E939-Y941 PolarHBondContact O-N 2.69Å; E939-Q942 PolarHBondContact O-N 3.19Å; E939-L943 VanDerWaalsContact O-CB 3.27Å; E939-L943 WeakPolarHBondContact O-CB 3.15Å; E939-L943 WeakPolarHBondContact O-CD1 3.46Å; E939-L943 PolarHBondContact O-N 3.12Å
940	A	50.2	Low	49.7	Very low	60 Å²	60	98.1 Å²	98.1	50%	0.496	49%	0.489	S	S	.	.	H	α-helix	trans	-64.5	-33.6	169	0	0	0	0	0	111.9	R936 S944	R936-A940 WeakPolarHBondContact O-CA 3.34Å; R936-A940 WeakPolarHBondContact O-CB 3.45Å; R936-A940 PolarHBondContact O-N 2.88Å; A940-S944 WeakPolarHBondContact O-CB 3.49Å; A940-S944 PolarHBondContact O-N 3.26Å; A940-S944 PolarHBondContact O-OG 3.35Å
941	Y	47	Very low	49.9	Very low	146 Å²	146	103.3 Å²	103.3	57%	0.573	50%	0.5	S	S	*	.	H	α-helix	trans	-65	-51.7	172.4	-165.3	-83.4	0	0	0	110.7	G937 R938 E939 L943 S944 E945	G937-Y941 VanDerWaalsContact O-CB 3.25Å; G937-Y941 WeakPolarHBondContact O-CB 3.37Å; G937-Y941 PolarHBondContact O-N 3.47Å; R938-Y941 PolarHBondContact O-N 3.26Å; E939-Y941 VanDerWaalsContact C-N 3.29Å; E939-Y941 PolarHBondContact O-N 2.69Å; Y941-L943 PolarHBondContact O-N 3.33Å; Y941-S944 CarbonylContact O-C 3.57Å; Y941-S944 PolarHBondContact O-N 2.78Å; Y941-S944 VanDerWaalsContact O-N 3.11Å; Y941-S944 PolarHBondContact O-OG 3.48Å; Y941-E945 VanDerWaalsContact O-CB 3.3Å; Y941-E945 WeakPolarHBondContact O-CB 3.32Å; Y941-E945 PolarHBondContact O-N 3.43Å
942	Q	51.1	Low	49.3	Very low	103 Å²	103	105.5 Å²	105.5	48%	0.481	53%	0.527	S	S	.	.	H	α-helix	trans	-64.6	-39.6	177.7	-75.9	-177	-78.4	0	0	112.8	R938 E939 S944 E945 I946	R938-Q942 WeakPolarHBondContact O-CB 3.42Å; R938-Q942 WeakPolarHBondContact O-CG 3.48Å; R938-Q942 PolarHBondContact O-N 2.97Å; E939-Q942 PolarHBondContact O-N 3.19Å; Q942-S944 VanDerWaalsContact C-N 3.34Å; Q942-E945 PolarHBondContact O-N 2.91Å; Q942-I946 VanDerWaalsContact O-CB 3.22Å; Q942-I946 WeakPolarHBondContact O-CB 3.45Å; Q942-I946 WeakPolarHBondContact O-CD1 3.35Å; Q942-I946 WeakPolarHBondContact O-CG1 3.15Å; Q942-I946 PolarHBondContact O-N 3.34Å
943	L	53.6	Low	49.1	Very low	104 Å²	104	111.6 Å²	111.6	55%	0.545	55%	0.547	S	S	.	.	H	α-helix	trans	-66.2	-34.7	171.1	-91.9	127.2	0	0	0	111.6	E939 Y941 Q947	E939-L943 VanDerWaalsContact O-CB 3.27Å; E939-L943 WeakPolarHBondContact O-CB 3.15Å; E939-L943 WeakPolarHBondContact O-CD1 3.46Å; E939-L943 PolarHBondContact O-N 3.12Å; Y941-L943 PolarHBondContact O-N 3.33Å; L943-Q947 WeakPolarHBondContact O-CA 3.5Å; L943-Q947 WeakPolarHBondContact O-CB 3.06Å; L943-Q947 WeakPolarHBondContact O-CG 3.28Å; L943-Q947 PolarHBondContact O-N 2.97Å
944	S	53.7	Low	48.7	Very low	54 Å²	54	112.3 Å²	112.3	38%	0.378	55%	0.55	S	S	.	.	H	α-helix	trans	-72.1	-33.9	173.8	76	0	0	0	0	112.5	A940 Y941 Q942 Q947 E948	A940-S944 WeakPolarHBondContact O-CB 3.49Å; A940-S944 PolarHBondContact O-N 3.26Å; A940-S944 PolarHBondContact O-OG 3.35Å; Y941-S944 CarbonylContact O-C 3.57Å; Y941-S944 PolarHBondContact O-N 2.78Å; Y941-S944 VanDerWaalsContact O-N 3.11Å; Y941-S944 PolarHBondContact O-OG 3.48Å; Q942-S944 VanDerWaalsContact C-N 3.34Å; S944-Q947 PolarHBondContact O-N 3.25Å; S944-E948 WeakPolarHBondContact O-CB 3.3Å; S944-E948 PolarHBondContact O-N 3.33Å
945	E	51.2	Low	48.3	Very low	96 Å²	96	111.3 Å²	111.3	45%	0.449	55%	0.552	S	S	.	*	H	α-helix	trans	-74.7	-39.5	178	-166.4	164.1	-134.9	0	0	110.2	Y941 Q942 M949	Y941-E945 VanDerWaalsContact O-CB 3.3Å; Y941-E945 WeakPolarHBondContact O-CB 3.32Å; Y941-E945 PolarHBondContact O-N 3.43Å; Q942-E945 PolarHBondContact O-N 2.91Å; E945-M949 HydrophobicContact CG-CE 4.34Å; E945-M949 VanDerWaalsContact O-CB 3.27Å; E945-M949 WeakPolarHBondContact O-CB 3.34Å; E945-M949 WeakPolarHBondContact O-CE 3.19Å; E945-M949 VanDerWaalsContact O-CG 3.25Å; E945-M949 WeakPolarHBondContact O-CG 3.36Å; E945-M949 PolarHBondContact O-N 3.11Å
946	I	55.4	Low	47.7	Very low	90 Å²	90	117.5 Å²	117.5	46%	0.462	58%	0.576	S	S	.	*	H	α-helix	trans	-67	-42.1	169	-68	165	0	0	0	110.7	Q942 M949 V950	Q942-I946 VanDerWaalsContact O-CB 3.22Å; Q942-I946 WeakPolarHBondContact O-CB 3.45Å; Q942-I946 WeakPolarHBondContact O-CD1 3.35Å; Q942-I946 WeakPolarHBondContact O-CG1 3.15Å; Q942-I946 PolarHBondContact O-N 3.34Å; I946-M949 HydrophobicContact CG1-CE 4.14Å; I946-M949 PolarHBondContact O-N 2.85Å; I946-V950 HydrophobicContact CG2-CG2 4.41Å; I946-V950 VanDerWaalsContact O-CB 3.31Å; I946-V950 WeakPolarHBondContact O-CB 3.49Å; I946-V950 WeakPolarHBondContact O-CG2 3.42Å; I946-V950 PolarHBondContact O-N 2.88Å
947	Q	55	Low	47.2	Very low	97 Å²	97	118.8 Å²	118.8	45%	0.453	59%	0.588	S	S	.	*	H	α-helix	trans	-71.1	-34.2	176.7	-77.9	-176.5	-9.5	0	0	113.2	L943 S944 R951	L943-Q947 WeakPolarHBondContact O-CA 3.5Å; L943-Q947 WeakPolarHBondContact O-CB 3.06Å; L943-Q947 WeakPolarHBondContact O-CG 3.28Å; L943-Q947 PolarHBondContact O-N 2.97Å; S944-Q947 PolarHBondContact O-N 3.25Å; Q947-R951 WeakPolarHBondContact O-CB 3.38Å; Q947-R951 VanDerWaalsContact O-CG 3.22Å; Q947-R951 WeakPolarHBondContact O-CG 3.27Å; Q947-R951 PolarHBondContact O-N 3.02Å
948	E	52.6	Low	46.7	Very low	99 Å²	99	122.2 Å²	122.2	46%	0.463	61%	0.606	S	S	.	*	H	α-helix	trans	-74.3	-32.9	171.7	-76.7	-151.8	160.5	0	0	111.3	S944 R951 G952 K954	S944-E948 WeakPolarHBondContact O-CB 3.3Å; S944-E948 PolarHBondContact O-N 3.33Å; E948-R951 PolarHBondContact O-N 3.39Å; E948-G952 PolarHBondContact O-N 3.29Å; E948-K954 IonicContact OE1-NZ 2.64Å; E948-K954 PolarHBondContact OE1-NZ 3.45Å
949	M	46.2	Very low	46.1	Very low	137 Å²	137	120.5 Å²	120.5	68%	0.675	61%	0.609	S	S	*	*	H	α-helix	trans	-62.5	-43.1	167.4	-80.2	-170	-73.1	0	0	112	E945 I946	E945-M949 HydrophobicContact CG-CE 4.34Å; E945-M949 VanDerWaalsContact O-CB 3.27Å; E945-M949 WeakPolarHBondContact O-CB 3.34Å; E945-M949 WeakPolarHBondContact O-CE 3.19Å; E945-M949 VanDerWaalsContact O-CG 3.25Å; E945-M949 WeakPolarHBondContact O-CG 3.36Å; E945-M949 PolarHBondContact O-N 3.11Å; I946-M949 HydrophobicContact CG1-CE 4.14Å; I946-M949 PolarHBondContact O-N 2.85Å
950	V	56.1	Low	45.4	Very low	121 Å²	121	127 Å²	127	73%	0.733	64%	0.636	S	S	*	*	H	α-helix	trans	-74.2	-28.4	177.8	169	0	0	0	0	112.4	I946	I946-V950 HydrophobicContact CG2-CG2 4.41Å; I946-V950 VanDerWaalsContact O-CB 3.31Å; I946-V950 WeakPolarHBondContact O-CB 3.49Å; I946-V950 WeakPolarHBondContact O-CG2 3.42Å; I946-V950 PolarHBondContact O-N 2.88Å
951	R	49	Very low	44.8	Very low	184 Å²	184	135.3 Å²	135.3	69%	0.694	66%	0.655	S	S	*	*	H	α-helix	trans	-90.9	-6.4	176.5	-71.1	176.7	171.7	177.2	-0.3	114.5	Q947 E948 K953	Q947-R951 WeakPolarHBondContact O-CB 3.38Å; Q947-R951 VanDerWaalsContact O-CG 3.22Å; Q947-R951 WeakPolarHBondContact O-CG 3.27Å; Q947-R951 PolarHBondContact O-N 3.02Å; E948-R951 PolarHBondContact O-N 3.39Å; R951-K953 VanDerWaalsContact C-N 3.32Å; R951-K953 PolarHBondContact O-N 3Å; R951-K953 VanDerWaalsContact O-N 3.16Å
952	G	36.8	Very low	44.3	Very low	65 Å²	65	134.8 Å²	134.8	67%	0.67	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	60.5	27.4	163.6	0	0	0	0	0	116.6	E948	E948-G952 PolarHBondContact O-N 3.29Å
953	K	40	Very low	43.4	Very low	178 Å²	178	136.5 Å²	136.5	77%	0.774	68%	0.679	S	S	*	*			trans	-136.1	73.5	-171.2	-77.8	-172	177.5	180	0	115.4	R951	R951-K953 VanDerWaalsContact C-N 3.32Å; R951-K953 PolarHBondContact O-N 3Å; R951-K953 VanDerWaalsContact O-N 3.16Å
954	K	34.5	Very low	42.5	Very low	177 Å²	177	139.5 Å²	139.5	77%	0.77	69%	0.694	S	S	*	*			trans	-158.2	136.2	140.5	-112.3	159.4	-162.1	155.4	0	111.7	E948	E948-K954 IonicContact OE1-NZ 2.64Å; E948-K954 PolarHBondContact OE1-NZ 3.45Å
955	S	38	Very low	41.6	Very low	94 Å²	94	141.8 Å²	141.8	66%	0.657	71%	0.71	S	S	*	*			trans	-124.1	150.4	-178.9	87.9	0	0	0	0	111.9	E957	S955-E957 PolarHBondContact O-N 2.86Å
956	R	35.4	Very low	40.6	Very low	231 Å²	231	144.5 Å²	144.5	87%	0.872	73%	0.726	S	S	*	*	S	Bend	trans	68.1	-21	153	-74	-178.7	158.2	172.3	-5.5	121.9
957	E	37.8	Very low	39.5	Very low	176 Å²	176	146 Å²	146	82%	0.822	74%	0.735	S	S	*	*	S	Bend	trans	-92	-29	-167.8	-63.3	-163.2	126.3	0	0	117.3	S955 I959	S955-E957 PolarHBondContact O-N 2.86Å; E957-I959 PolarHBondContact O-N 3.2Å
958	S	37.2	Very low	38.4	Very low	113 Å²	113	146.6 Å²	146.6	79%	0.79	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-79.3	-7.1	-172.1	-55.1	0	0	0	0	116.1	K960	S958-K960 PolarHBondContact O-N 3.2Å; S958-K960 VanDerWaalsContact O-N 3.08Å
959	I	38.6	Very low	37.5	Very low	149 Å²	149	150.2 Å²	150.2	76%	0.764	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-74.7	1.5	-170.3	-66.5	171.2	0	0	0	113.4	E957	E957-I959 PolarHBondContact O-N 3.2Å
960	K	34.6	Very low	36.6	Very low	192 Å²	192	150.6 Å²	150.6	84%	0.835	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-117.3	7.8	-170.2	-76.3	-172.6	173.2	-177.3	0	117.2	S958	S958-K960 PolarHBondContact O-N 3.2Å; S958-K960 VanDerWaalsContact O-N 3.08Å
961	R	37.5	Very low	35.4	Very low	236 Å²	236	150.3 Å²	150.3	89%	0.891	76%	0.761	S	S	*	*	S	Bend	trans	-113.7	2.3	-172.6	-70	-167.9	-175.2	172	4.3	117.6
962	T	36.6	Very low	34.4	Very low	134 Å²	134	147 Å²	147	82%	0.822	76%	0.762	S	S	*	*	S	Bend	trans	-103.1	6.5	178.7	41.8	0	0	0	0	114.8
963	N	31.1	Very low	34.2	Very low	140 Å²	140	153.4 Å²	153.4	75%	0.749	77%	0.774	S	S	*	*			trans	-123.3	103.5	172.8	-73	-35.9	0	0	0	109.7
964	I	34.4	Very low	33.6	Very low	167 Å²	167	149.6 Å²	149.6	86%	0.856	77%	0.77	S	S	*	*			trans	174.8	98.9	150.9	-89.5	149	0	0	0	108.7
965	S	35.6	Very low	33.2	Very low	102 Å²	102	150.4 Å²	150.4	71%	0.713	77%	0.773	S	S	*	*			trans	160.5	103.1	155.3	54.5	0	0	0	0	108
966	I	31.2	Very low	32.8	Very low	153 Å²	153	152 Å²	152	79%	0.785	78%	0.781	S	S	*	*				65.8	120.9	88.2	-63.6	161.3	0	0	0	111.8
967	N	31.3	Very low	32.4	Very low	121 Å²	121	148.3 Å²	148.3	65%	0.647	78%	0.778	S	S	*	*			cis	-160.6	169.8	-20.9	-122	18	0	0	0	108.8
968	E	31.5	Very low	31.9	Very low	109 Å²	109	149.3 Å²	149.3	51%	0.509	78%	0.78	S	S	.	*			trans	27	116.3	146.6	-64.5	162.6	144.8	0	0	118.1	K970	E968-K970 HydrophobicContact CG-CD 4.09Å; E968-K970 HydrophobicContact CG-CG 4.34Å; E968-K970 IonicContact OE1-NZ 3.5Å; E968-K970 PolarHBondContact OE1-NZ 2.93Å
969	N	34.5	Very low	31.4	Very low	175 Å²	175	148.8 Å²	148.8	94%	0.936	78%	0.777	S	S	*	*				-115.1	146.5	66.3	-77.9	-48.8	0	0	0	115.9
970	K	27.4	Very low	30.8	Very low	146 Å²	146	148.4 Å²	148.4	64%	0.635	78%	0.776	S	S	*	*			trans	-120.9	136.4	-178.4	-59.3	156.1	177.1	158.6	0	110.2	E968 T972	E968-K970 HydrophobicContact CG-CD 4.09Å; E968-K970 HydrophobicContact CG-CG 4.34Å; E968-K970 IonicContact OE1-NZ 3.5Å; E968-K970 PolarHBondContact OE1-NZ 2.93Å; K970-T972 HydrophobicContact CB-CG2 4.33Å
971	S	31.1	Very low	30.4	Very low	114 Å²	114	146 Å²	146	80%	0.797	77%	0.771	S	S	*	*			trans	-175.1	63.1	148.9	47.4	0	0	0	0	111.7
972	T	27.4	Very low	29.9	Very low	114 Å²	114	144.2 Å²	144.2	70%	0.699	77%	0.77	S	S	*	*				53.8	106.9	90.9	69.3	0	0	0	0	116.7	K970	K970-T972 HydrophobicContact CB-CG2 4.33Å
973	Q	32.2	Very low	29.5	Very low	200 Å²	200	145.6 Å²	145.6	94%	0.935	77%	0.767	S	S	*	*				-149.8	140.6	118.4	-105.3	178.8	28.2	0	0	109.2
974	S	27.2	Very low	29.2	Very low	98 Å²	98	144.7 Å²	144.7	69%	0.685	77%	0.769	S	S	*	*			trans	-171.7	147.2	-161.8	60.7	0	0	0	0	113.5
975	K	26.4	Very low	28.8	Very low	194 Å²	194	141.4 Å²	141.4	84%	0.843	76%	0.756	S	S	*	*			trans	65.3	160.7	176.1	-53.1	179.5	175.6	175.9	0	112.3
976	P	29.6	Very low	28.4	Very low	127 Å²	127	144.5 Å²	144.5	83%	0.825	76%	0.759	S	S	*	*				-124	-166.6	62.4	15.2	9	0	0	0	112.2
977	L	27.3	Very low	28.1	Very low	154 Å²	154	147.3 Å²	147.3	81%	0.806	76%	0.76	S	S	*	*				-166.7	166.9	-50.7	-170.7	62.8	0	0	0	106.9
978	F	27.4	Very low	27.8	Very low	197 Å²	197	150.4 Å²	150.4	86%	0.864	77%	0.768	S	S	*	*	S	Bend	trans	-73.4	176	163.7	-124.3	-105.7	0	0	0	111.8
979	S	27.5	Very low	27.6	Very low	102 Å²	102	151.7 Å²	151.7	71%	0.713	78%	0.777	S	S	*	*			trans	76	157.2	167.8	72.8	0	0	0	0	118.6
980	D	25.1	Very low	27.1	Very low	142 Å²	142	150 Å²	150	76%	0.759	77%	0.772	S	S	*	*			trans	-76.6	-176.9	-171.3	-50.8	-99.9	0	0	0	114
981	I	26	Very low	27	Very low	142 Å²	142	147.6 Å²	147.6	73%	0.728	77%	0.77	S	S	*	*			trans	80.1	107.4	160.5	-56.6	161.8	0	0	0	116.6
982	K	27.6	Very low	26.8	Very low	197 Å²	197	147.1 Å²	147.1	86%	0.857	77%	0.767	S	S	*	*			trans	85.9	130.7	151.7	-70.1	167	-170.6	173.1	0	121.5
983	Q	28	Very low	26.7	Very low	164 Å²	164	148 Å²	148	77%	0.766	77%	0.772	S	S	*	*			trans	-53.4	157.6	167.6	-58.4	162	-12.6	0	0	114.8	V985	Q983-V985 HydrophobicContact CB-CG2 4Å
984	P	24.7	Very low	26.4	Very low	121 Å²	121	141.5 Å²	141.5	79%	0.786	76%	0.759	S	S	*	*				-102.1	137	105.9	30.8	-33.1	0	0	0	109.4
985	V	25.5	Very low	26.4	Very low	97 Å²	97	144.1 Å²	144.1	59%	0.588	76%	0.764	S	S	*	*			cis	52.9	97.9	37.5	-169.6	0	0	0	0	110.6	Q983	Q983-V985 HydrophobicContact CB-CG2 4Å
986	H	28	Very low	26.4	Very low	168 Å²	168	141.5 Å²	141.5	78%	0.778	76%	0.759	S	S	*	*	S	Bend	cis	-90.1	149.4	16.1	-68.1	-148.8	0	0	0	113.4
987	R	25.2	Very low	26.4	Very low	212 Å²	212	144.8 Å²	144.8	80%	0.8	76%	0.761	S	S	*	*			cis	-152.2	142.9	-16	-126.9	-177.1	-172.5	-178.1	2.8	107.1
988	K	24	Very low	26.6	Very low	186 Å²	186	141.3 Å²	141.3	81%	0.809	75%	0.749	S	S	*	*			trans	8.7	125.5	142.1	-75.2	-176.4	177.7	-173.9	0	115.9
989	I	27	Very low	26.8	Very low	136 Å²	136	137.3 Å²	137.3	70%	0.697	74%	0.737	S	S	*	*			cis	-160.6	150.7	34.5	-100.9	142.1	0	0	0	112.1	T991	I989-T991 HydrophobicContact CG2-CG2 4.38Å; I989-T991 WeakPolarHBondContact CG2-OG1 3.38Å
990	T	24.2	Very low	27	Very low	138 Å²	138	142.4 Å²	142.4	85%	0.847	75%	0.747	S	S	*	*			trans	-93.8	110	160.5	45.8	0	0	0	0	111.1
991	T	25.2	Very low	27.2	Very low	97 Å²	97	141.5 Å²	141.5	60%	0.595	74%	0.742	S	S	*	*			trans	-160.6	127.1	162.5	36.5	0	0	0	0	106.4	I989	I989-T991 HydrophobicContact CG2-CG2 4.38Å; I989-T991 WeakPolarHBondContact CG2-OG1 3.38Å
992	S	27.3	Very low	27.6	Very low	103 Å²	103	144 Å²	144	72%	0.72	75%	0.747	S	S	*	*			cis	55.1	109.1	28.6	84.6	0	0	0	0	113.4
993	T	25.3	Very low	27.8	Very low	132 Å²	132	140 Å²	140	81%	0.81	74%	0.739	S	S	*	*			trans	65.1	144.9	-152.1	76.6	0	0	0	0	111.5
994	G	26.4	Very low	27.9	Very low	65 Å²	65	139.1 Å²	139.1	67%	0.67	74%	0.739	S	S	*	*			cis	116.5	149.1	5.5	0	0	0	0	0	111.4
995	I	26.9	Very low	28.2	Very low	152 Å²	152	140.7 Å²	140.7	78%	0.779	74%	0.74	S	S	*	*			trans	73.8	86.7	171.5	-52.3	177.7	0	0	0	115.5
996	N	26	Very low	28.6	Very low	140 Å²	140	141.4 Å²	141.4	75%	0.749	75%	0.747	S	S	*	*				71.3	152.5	125.4	-57.9	-9.7	0	0	0	123.2
997	K	30.8	Very low	28.5	Very low	196 Å²	196	138.7 Å²	138.7	85%	0.852	75%	0.747	S	S	*	*			trans	74.5	145.9	160.5	-70.1	179.4	177.5	-178.3	0	118.7
998	S	29.7	Very low	28.7	Very low	81 Å²	81	133.1 Å²	133.1	57%	0.566	74%	0.74	S	S	*	*			cis	-166.3	174.2	-30.1	49.5	0	0	0	0	109
999	D	32.5	Very low	28.9	Very low	112 Å²	112	130.4 Å²	130.4	60%	0.599	74%	0.74	S	S	*	*			trans	59.2	104.9	155.9	-48.9	-51.5	0	0	0	118.7
1000	F	32.5	Very low	28.9	Very low	210 Å²	210	128.5 Å²	128.5	92%	0.921	74%	0.738	S	S	*	*				-144.2	137.7	91.5	-131.2	-93.6	0	0	0	112.3
1001	N	28.1	Very low	29	Very low	123 Å²	123	129.8 Å²	129.8	66%	0.658	74%	0.738	S	S	*	*			trans	-89.9	148.3	-172.1	-72.7	-72.9	0	0	0	112.6
1002	K	34.6	Very low	29.1	Very low	193 Å²	193	128.2 Å²	128.2	84%	0.839	74%	0.741	S	S	*	*				-165	116.9	126.4	-108.4	161.4	-175.3	178	0	113.3
1003	T	31.6	Very low	29	Very low	113 Å²	113	127 Å²	127	69%	0.693	75%	0.745	S	S	*	*			trans	50.4	115.5	149.2	45.6	0	0	0	0	119.1
1004	L	30.4	Very low	29.1	Very low	147 Å²	147	127.9 Å²	127.9	77%	0.77	74%	0.743	S	S	*	*				61.3	129.4	70.2	-62.5	171.2	0	0	0	112
1005	L	30.2	Very low	29.1	Very low	153 Å²	153	132 Å²	132	80%	0.801	75%	0.748	S	S	*	*			cis	-149.2	168.2	6.1	-98.2	147.9	0	0	0	109.8
1006	P	35	Very low	29.1	Very low	113 Å²	113	128.4 Å²	128.4	73%	0.734	75%	0.749	S	S	*	*			trans	-97.9	152.1	-175.6	37.6	-32.8	0	0	0	114.2
1007	S	26.3	Very low	29.5	Very low	110 Å²	110	127 Å²	127	77%	0.769	75%	0.748	S	S	*	*			trans	-167.5	160.9	146.7	56.2	0	0	0	0	113.9
1008	S	28.5	Very low	29.4	Very low	95 Å²	95	123.4 Å²	123.4	66%	0.664	74%	0.741	S	S	*	*			trans	54.7	103.1	145.9	61.8	0	0	0	0	122.1
1009	T	28	Very low	29.3	Very low	130 Å²	130	126 Å²	126	80%	0.798	75%	0.749	S	S	*	*				66.8	134.9	117	-27.1	0	0	0	0	121.6
1010	S	26.5	Very low	29.5	Very low	95 Å²	95	127.8 Å²	127.8	66%	0.664	76%	0.758	S	S	*	*			trans	100	141.2	138.7	88.4	0	0	0	0	120
1011	I	28.2	Very low	29.6	Very low	165 Å²	165	123.1 Å²	123.1	85%	0.846	75%	0.749	S	S	*	*			trans	57.8	113.4	141.4	-61.8	159.4	0	0	0	118.5
1012	G	25.6	Very low	30	Very low	64 Å²	64	121.3 Å²	121.3	66%	0.66	75%	0.752	S	S	*	*				120.2	-0.2	101.1	0	0	0	0	0	121.7
1013	G	26	Very low	29.7	Very low	78 Å²	78	120.8 Å²	120.8	80%	0.804	75%	0.75	S	S	*	*			trans	70.9	-136.8	166.9	0	0	0	0	0	116
1014	I	27.7	Very low	29.7	Very low	151 Å²	151	123.3 Å²	123.3	77%	0.774	75%	0.753	S	S	*	*			trans	80.4	104.7	-179.5	-58.2	-178.2	0	0	0	116.4
1015	I	26.8	Very low	29.6	Very low	151 Å²	151	122.8 Å²	122.8	77%	0.774	75%	0.751	S	S	*	*			trans	60.4	95.6	144.5	-52.7	171.2	0	0	0	119.9
1016	G	27	Very low	29.8	Very low	76 Å²	76	124.4 Å²	124.4	78%	0.784	76%	0.755	S	S	*	*			trans	40.1	-153	133.2	0	0	0	0	0	121
1017	P	34.1	Very low	29.3	Very low	112 Å²	112	127.4 Å²	127.4	73%	0.727	76%	0.759	S	S	*	*			cis	-128.5	-157.1	-26.7	38.4	-20.4	0	0	0	111.3
1018	V	28	Very low	29.3	Very low	119 Å²	119	128 Å²	128	72%	0.721	76%	0.758	S	S	*	*			trans	78.5	121.4	146.7	154.6	0	0	0	0	119.9
1019	D	27.8	Very low	29.2	Very low	136 Å²	136	130.2 Å²	130.2	73%	0.727	76%	0.761	S	S	*	*			trans	68.1	118.4	144.5	-60.4	5.2	0	0	0	124.3
1020	N	37.1	Very low	29.1	Very low	149 Å²	149	129.5 Å²	129.5	80%	0.797	76%	0.756	S	S	*	*				42.6	148.2	100.4	-98.2	5.3	0	0	0	119.2
1021	P	35.1	Very low	29.1	Very low	113 Å²	113	131.7 Å²	131.7	73%	0.734	76%	0.76	S	S	*	*				-154.5	-167.9	58	43	-22.1	0	0	0	117.7
1022	A	35.1	Very low	29	Very low	85 Å²	85	132 Å²	132	70%	0.702	76%	0.756	S	S	*	*			trans	80.2	152.3	144.9	0	0	0	0	0	120.7
1023	F	28.4	Very low	29.1	Very low	182 Å²	182	135 Å²	135	80%	0.798	76%	0.761	S	S	*	*			cis	-171.2	175	-37	-135.7	-85.4	0	0	0	107.4
1024	E	32.5	Very low	29.2	Very low	165 Å²	165	135.4 Å²	135.4	77%	0.771	75%	0.751	S	S	*	*			trans	69.1	158.3	161.8	-65.3	169.8	163.6	0	0	118.3
1025	N	27.8	Very low	29.1	Very low	136 Å²	136	135.1 Å²	135.1	73%	0.727	75%	0.75	S	S	*	*			cis	-166.2	-175.7	-43.4	-100.8	-7.1	0	0	0	108.9
1026	E	33.7	Very low	29.1	Very low	188 Å²	188	132.7 Å²	132.7	88%	0.879	75%	0.747	S	S	*	*			trans	81.8	119.9	-174.1	-53.5	179.8	169.5	0	0	113.8
1027	E	24.7	Very low	29.1	Very low	176 Å²	176	133.4 Å²	133.4	82%	0.822	74%	0.74	S	S	*	*			cis	98.6	158.9	31.2	-68.9	-142.2	137.8	0	0	115.6
1028	V	27.3	Very low	28.8	Very low	121 Å²	121	133 Å²	133	73%	0.733	74%	0.739	S	S	*	*			trans	68.7	93.8	-174.9	-165.4	0	0	0	0	114.3
1029	I	25	Very low	28.7	Very low	143 Å²	143	132.9 Å²	132.9	73%	0.733	74%	0.738	S	S	*	*				80.5	147.3	50.6	-50.5	159.8	0	0	0	113.2
1030	V	27.5	Very low	28.7	Very low	115 Å²	115	132.1 Å²	132.1	70%	0.697	74%	0.735	S	S	*	*			trans	97.3	91	169.5	-167.9	0	0	0	0	117.4
1031	N	25.4	Very low	28.2	Very low	140 Å²	140	132.3 Å²	132.3	75%	0.749	74%	0.735	S	S	*	*				44.7	156.3	119	-64	-34.2	0	0	0	122.6
1032	K	26.5	Very low	27.9	Very low	173 Å²	173	133.7 Å²	133.7	75%	0.752	74%	0.736	S	S	*	*			cis	179.5	175.3	-23.9	-157.2	170.1	-175.2	173.5	0	106.5
1033	T	27.7	Very low	27.6	Very low	126 Å²	126	132 Å²	132	77%	0.773	73%	0.727	S	S	*	*			trans	65.3	146.5	161.6	49.7	0	0	0	0	118.2
1034	S	27.7	Very low	27.5	Very low	86 Å²	86	131.4 Å²	131.4	60%	0.601	72%	0.724	S	S	*	*			cis	-175.9	161.7	-14.4	49.9	0	0	0	0	111.2
1035	I	26.8	Very low	27.3	Very low	145 Å²	145	131.5 Å²	131.5	74%	0.744	72%	0.722	S	S	*	*			trans	66.7	110.7	150.1	-71.7	156.8	0	0	0	114.7
1036	S	26.1	Very low	27.2	Very low	101 Å²	101	133.8 Å²	133.8	71%	0.706	73%	0.728	S	S	*	*				65.4	147.5	59	91.3	0	0	0	0	112.7
1037	S	26.4	Very low	27	Very low	91 Å²	91	128 Å²	128	64%	0.636	72%	0.719	S	S	*	*			cis	-165.6	169	13.9	52.8	0	0	0	0	110.9
1038	S	27.4	Very low	27.1	Very low	103 Å²	103	129 Å²	129	72%	0.72	72%	0.721	S	S	*	*			trans	67.4	154.7	132.3	74.3	0	0	0	0	119.6
1039	V	27.9	Very low	27	Very low	116 Å²	116	128.3 Å²	128.3	70%	0.703	72%	0.721	S	S	*	*			cis	-167.7	154.6	-3.6	108.5	0	0	0	0	111.2
1040	D	26.5	Very low	27.2	Very low	121 Å²	121	126.8 Å²	126.8	65%	0.647	72%	0.719	S	S	*	*			trans	55.5	131.1	151.1	-61.6	-2.2	0	0	0	122.5
1041	L	27.5	Very low	27.3	Very low	152 Å²	152	127.3 Å²	127.3	80%	0.796	72%	0.723	S	S	*	*				64.4	141.4	93.3	-49.5	167.9	0	0	0	113
1042	D	27.3	Very low	27.5	Very low	143 Å²	143	126.3 Å²	126.3	77%	0.765	72%	0.721	S	S	*	*			cis	-162	-179.4	33.6	-167.1	6.7	0	0	0	110.7
1043	G	28.9	Very low	27.7	Very low	50 Å²	50	125.2 Å²	125.2	52%	0.515	72%	0.722	S	S	.	*			trans	114.8	81.1	139	0	0	0	0	0	120.7
1044	K	27.6	Very low	27.5	Very low	168 Å²	168	125.8 Å²	125.8	73%	0.73	72%	0.721	S	S	*	*				66.8	111.8	124.9	-64.3	157.3	-173	156.9	0	121.6
1045	K	27.6	Very low	27.6	Very low	167 Å²	167	130.1 Å²	130.1	73%	0.726	73%	0.732	S	S	*	*				80.8	140	116.4	-70.7	-177.5	179	-175.4	0	121.7
1046	Q	26.7	Very low	27.4	Very low	184 Å²	184	132.3 Å²	132.3	86%	0.86	74%	0.736	S	S	*	*			trans	69.9	133.5	148.7	-69.5	159.6	-15.1	0	0	117.4
1047	G	27.9	Very low	27.5	Very low	67 Å²	67	133.7 Å²	133.7	69%	0.691	74%	0.74	S	S	*	*			cis	136.5	157.6	-13.8	0	0	0	0	0	114.7
1048	K	26.8	Very low	27.4	Very low	197 Å²	197	135 Å²	135	86%	0.857	75%	0.75	S	S	*	*			trans	73.1	123.5	-177.1	-65.7	178.7	175.3	-177.9	0	113.4
1049	S	26.3	Very low	27.5	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	76%	0.755	S	S	*	*				76.7	153.1	73.7	-50.5	0	0	0	0	111.7
1050	T	29.8	Very low	27.3	Very low	112 Å²	112	135.5 Å²	135.5	69%	0.687	75%	0.752	S	S	*	*			cis	-164.1	140.6	35.8	-32.3	0	0	0	0	113.2
1051	T	27.6	Very low	27.4	Very low	126 Å²	126	136.3 Å²	136.3	77%	0.773	76%	0.756	S	S	*	*			trans	64.1	170.3	152.3	43.1	0	0	0	0	117.4
1052	V	30.3	Very low	27.4	Very low	118 Å²	118	134.6 Å²	134.6	72%	0.715	75%	0.751	S	S	*	*			cis	-149	150.4	28.9	-172.4	0	0	0	0	113.3
1053	L	30.3	Very low	27.3	Very low	150 Å²	150	133.4 Å²	133.4	79%	0.785	75%	0.75	S	S	*	*			trans	73.5	110.8	161.2	-113.9	67.7	0	0	0	121.6
1054	D	24.5	Very low	27.1	Very low	138 Å²	138	135.7 Å²	135.7	74%	0.738	76%	0.758	S	S	*	*			trans	-70.6	151.4	146.5	-71.3	-87.9	0	0	0	111.6
1055	Q	29	Very low	27.2	Very low	177 Å²	177	136.8 Å²	136.8	83%	0.827	77%	0.765	S	S	*	*			trans	-136	121.7	139.2	-83.2	-166.6	-14.2	0	0	110.4
1056	K	23.1	Very low	27.1	Very low	192 Å²	192	137.7 Å²	137.7	84%	0.835	77%	0.772	S	S	*	*			trans	-102.6	128	165.2	-75.3	179.9	178.1	174.4	0	109
1057	T	28.3	Very low	27.2	Very low	130 Å²	130	136.5 Å²	136.5	80%	0.798	77%	0.771	S	S	*	*			trans	-124.2	113.5	165.5	36.3	0	0	0	0	109.4
1058	S	23.4	Very low	27.2	Very low	119 Å²	119	140.1 Å²	140.1	83%	0.832	77%	0.774	S	S	*	*			trans	-93.2	119.8	170.1	51.9	0	0	0	0	109.2
1059	V	29.8	Very low	27.3	Very low	139 Å²	139	135.3 Å²	135.3	84%	0.842	76%	0.763	S	S	*	*			trans	-136.1	119.2	168.7	177.5	0	0	0	0	107.3
1060	S	24.5	Very low	27.3	Very low	89 Å²	89	137.5 Å²	137.5	62%	0.622	77%	0.767	S	S	*	*			trans	-78.8	159.9	162	51.9	0	0	0	0	109.4
1061	D	27.4	Very low	27.2	Very low	139 Å²	139	140.9 Å²	140.9	74%	0.743	77%	0.772	S	S	*	*				161.4	138.2	124	-81.8	-2.3	0	0	0	115.2
1062	V	27.3	Very low	27.2	Very low	115 Å²	115	142.7 Å²	142.7	70%	0.697	78%	0.776	S	S	*	*				65.7	96.7	129.1	179.8	0	0	0	0	120.5
1063	T	25.3	Very low	27.4	Very low	119 Å²	119	142.3 Å²	142.3	73%	0.73	78%	0.775	S	S	*	*			trans	70.6	124.4	130.5	66.9	0	0	0	0	124.5
1064	S	25.8	Very low	27.2	Very low	97 Å²	97	140.2 Å²	140.2	68%	0.678	77%	0.772	S	S	*	*				59.1	116.1	128	71.5	0	0	0	0	123.1
1065	Q	28.6	Very low	27.2	Very low	192 Å²	192	139.8 Å²	139.8	90%	0.897	77%	0.774	S	S	*	*				-165.6	114.1	123.3	-98	155.6	20.8	0	0	105.6
1066	Q	25.4	Very low	27.3	Very low	185 Å²	185	135.3 Å²	135.3	86%	0.864	76%	0.763	S	S	*	*				66.1	143.8	65.4	-88.5	-160.1	-14.1	0	0	116.1
1067	L	29.1	Very low	27.5	Very low	160 Å²	160	129.6 Å²	129.6	84%	0.838	75%	0.751	S	S	*	*			trans	74.7	132.2	-173.8	-55.4	161.7	0	0	0	114
1068	N	29.1	Very low	27.5	Very low	142 Å²	142	127.9 Å²	127.9	76%	0.759	74%	0.74	S	S	*	*			cis	-137.5	146.8	2	-134.2	7.6	0	0	0	111.4
1069	P	29.2	Very low	27.7	Very low	96 Å²	96	127.9 Å²	127.9	62%	0.623	74%	0.735	S	S	*	*			trans	-91.4	154.3	-173.9	36.5	-33.9	0	0	0	113.1
1070	N	26.2	Very low	27.5	Very low	152 Å²	152	127.7 Å²	127.7	81%	0.813	74%	0.738	S	S	*	*			trans	167.2	96.7	139.5	-88.3	-31.9	0	0	0	111.3
1071	F	27.1	Very low	27.6	Very low	184 Å²	184	131.8 Å²	131.8	81%	0.807	75%	0.748	S	S	*	*			trans	167	88.6	139.4	-98.5	-65.6	0	0	0	112.1
1072	I	28.4	Very low	27.8	Very low	164 Å²	164	134.3 Å²	134.3	84%	0.841	76%	0.755	S	S	*	*			trans	-143	162.9	162.8	10	176.5	0	0	0	105.2
1073	P	32.9	Very low	27.8	Very low	109 Å²	109	133.8 Å²	133.8	71%	0.708	75%	0.753	S	S	*	*			cis	-137.8	-149	16.4	39.2	-16.5	0	0	0	114.3
1074	C	26.7	Very low	28.1	Very low	107 Å²	107	136.5 Å²	136.5	72%	0.723	76%	0.761	S	S	*	*			trans	98.8	85.2	165.8	-60.9	0	0	0	0	116.4
1075	T	25.7	Very low	28.3	Very low	128 Å²	128	137.4 Å²	137.4	79%	0.785	76%	0.762	S	S	*	*				74.1	100.9	65.8	69.6	0	0	0	0	115.9
1076	S	30.3	Very low	28.2	Very low	84 Å²	84	135 Å²	135	59%	0.587	76%	0.755	S	S	*	*			trans	-163.4	108.5	139.8	50.2	0	0	0	0	108.3
1077	A	27.1	Very low	28.4	Very low	71 Å²	71	132.5 Å²	132.5	59%	0.587	75%	0.748	S	S	*	*			trans	-101.6	148	-174.1	0	0	0	0	0	111.9
1078	V	28.6	Very low	28.4	Very low	94 Å²	94	130.5 Å²	130.5	57%	0.57	74%	0.743	S	S	*	*			trans	-142.5	100.6	153.1	178.6	0	0	0	0	109.2	F1163	V1078-F1163 HydrophobicContact CB-CZ 4.39Å; V1078-F1163 HydrophobicContact CG1-CE1 4.45Å; V1078-F1163 HydrophobicContact CG1-CE2 3.94Å; V1078-F1163 HydrophobicContact CG1-CZ 3.55Å; V1078-F1163 HydrophobicContact CG2-CE1 4.07Å; V1078-F1163 HydrophobicContact CG2-CE2 4.16Å; V1078-F1163 HydrophobicContact CG2-CZ 3.81Å
1079	V	27.4	Very low	28.4	Very low	120 Å²	120	130.4 Å²	130.4	73%	0.727	74%	0.742	S	S	*	*			trans	38.5	109.6	143	-170.4	0	0	0	0	118.9
1080	C	26.5	Very low	28.4	Very low	134 Å²	134	133.4 Å²	133.4	91%	0.905	75%	0.748	S	S	*	*				-163.6	87.7	113.5	-121.3	0	0	0	0	110.3
1081	E	26.3	Very low	28.3	Very low	175 Å²	175	133.3 Å²	133.3	82%	0.818	75%	0.747	S	S	*	*			trans	-132.7	105.6	179.5	-173.3	166.1	-133.1	0	0	108.1
1082	E	30.7	Very low	28.3	Very low	192 Å²	192	130.7 Å²	130.7	90%	0.897	75%	0.746	S	S	*	*			trans	-87.9	117.2	166	-87.5	-162.9	154.8	0	0	108.3
1083	T	27.4	Very low	28.4	Very low	105 Å²	105	128.8 Å²	128.8	64%	0.644	74%	0.742	S	S	*	*			trans	-81	140.3	178	44.8	0	0	0	0	111.6
1084	I	32.3	Very low	28.1	Very low	176 Å²	176	130.1 Å²	130.1	90%	0.903	74%	0.739	S	S	*	*			trans	-119.3	110.9	150.1	-63.4	-178.4	0	0	0	105.6
1085	T	29.5	Very low	28.1	Very low	115 Å²	115	132.2 Å²	132.2	71%	0.706	74%	0.736	S	S	*	*			trans	-89.7	150	-170.6	48.2	0	0	0	0	113.2
1086	N	27.5	Very low	28.4	Very low	142 Å²	142	134.4 Å²	134.4	76%	0.759	74%	0.737	S	S	*	*			trans	-46.2	160.9	151.5	-54.4	-34.3	0	0	0	111.2
1087	N	28.7	Very low	28.5	Very low	133 Å²	133	136.3 Å²	136.3	71%	0.711	74%	0.74	S	S	*	*			cis	-159.5	172.5	1.8	-133.9	-13.8	0	0	0	110.8
1088	T	28.1	Very low	28.6	Very low	118 Å²	118	139.1 Å²	139.1	72%	0.724	74%	0.741	S	S	*	*			trans	33.5	110.8	151.8	57.2	0	0	0	0	119.2
1089	D	29	Very low	28.6	Very low	140 Å²	140	142 Å²	142	75%	0.749	75%	0.748	S	S	*	*			trans	-149.8	165.9	130.3	-131.9	-25.4	0	0	0	114.7
1090	Q	29.3	Very low	28.7	Very low	158 Å²	158	141.4 Å²	141.4	74%	0.738	75%	0.75	S	S	*	*			trans	-38	129.4	-175.4	-67.8	150.5	73.8	0	0	115.7
1091	N	25.2	Very low	28.7	Very low	151 Å²	151	144.6 Å²	144.6	81%	0.807	75%	0.748	S	S	*	*				58.5	122	83.4	-88.4	-19.7	0	0	0	116.1
1092	T	26.1	Very low	28.8	Very low	128 Å²	128	144 Å²	144	79%	0.785	75%	0.75	S	S	*	*			trans	86.5	159	162.5	-27	0	0	0	0	117.2
1093	V	31.3	Very low	28.6	Very low	125 Å²	125	144.4 Å²	144.4	76%	0.758	75%	0.749	S	S	*	*			trans	67.3	76.1	178	-164.1	0	0	0	0	114.3
1094	E	26.3	Very low	28.5	Very low	137 Å²	137	148.1 Å²	148.1	64%	0.64	76%	0.759	S	S	*	*				90	114.9	68.8	-74	-155.9	123.7	0	0	116.6
1095	K	27.5	Very low	28.5	Very low	151 Å²	151	145.1 Å²	145.1	66%	0.657	75%	0.751	S	S	*	*				46.6	115.3	128.9	-55.7	168.9	-176.6	163.4	0	119.5
1096	Q	30.8	Very low	28.7	Very low	174 Å²	174	144.7 Å²	144.7	81%	0.813	75%	0.75	S	S	*	*				167.4	146.8	116.8	-88.3	-179.6	44.4	0	0	107.8
1097	L	33.2	Very low	28.6	Very low	124 Å²	124	142.4 Å²	142.4	65%	0.649	75%	0.745	S	S	*	*			cis	-144.1	129.5	-1.7	-150.1	63.7	0	0	0	104.6
1098	Q	28.8	Very low	28.6	Very low	130 Å²	130	144.2 Å²	144.2	61%	0.607	75%	0.749	S	S	*	*				58.8	142.9	61.7	-57.3	-179.6	4.8	0	0	113.4
1099	Q	28.4	Very low	28.5	Very low	153 Å²	153	146.2 Å²	146.2	72%	0.715	75%	0.754	S	S	*	*			cis	-118.5	177.4	-10.7	-55.9	79.4	27.6	0	0	108.4
1100	S	29.9	Very low	28.3	Very low	109 Å²	109	143.4 Å²	143.4	76%	0.762	75%	0.746	S	S	*	*			cis	-164	160.2	25.6	54.6	0	0	0	0	107.4
1101	K	26.4	Very low	28.3	Very low	200 Å²	200	143.1 Å²	143.1	87%	0.87	75%	0.748	S	S	*	*			cis	72.4	132.5	25.4	-83.3	-165.3	176.7	-176	0	117.6
1102	L	28.1	Very low	28.5	Very low	162 Å²	162	142.7 Å²	142.7	85%	0.848	74%	0.741	S	S	*	*			trans	-30.7	142.7	169.5	-77.9	62	0	0	0	113.4
1103	K	26.3	Very low	28.6	Very low	201 Å²	201	141 Å²	141	87%	0.874	73%	0.731	S	S	*	*				-156.8	135.8	69.7	-87.6	179.6	177.2	-179.4	0	115.2
1104	Q	24.9	Very low	28.5	Very low	184 Å²	184	142.9 Å²	142.9	86%	0.86	73%	0.728	S	S	*	*			trans	-81.4	168.5	135.9	-87	-175.8	-4.4	0	0	108.7
1105	P	34.1	Very low	28.9	Very low	113 Å²	113	142.3 Å²	142.3	73%	0.734	73%	0.734	S	S	*	*			cis	-134.3	-160.3	24.6	48	-30.9	0	0	0	112.4
1106	P	33.5	Very low	29.2	Very low	105 Å²	105	141.1 Å²	141.1	68%	0.682	74%	0.743	S	S	*	*			cis	-130.8	-176.7	-8.3	37.8	-18.9	0	0	0	115.6
1107	S	25	Very low	29	Very low	94 Å²	94	137.9 Å²	137.9	66%	0.657	74%	0.739	S	S	*	*			trans	71.1	144.1	142.9	62.2	0	0	0	0	123
1108	Q	28.6	Very low	28.8	Very low	172 Å²	172	139.3 Å²	139.3	80%	0.804	74%	0.744	S	S	*	*			trans	72.7	119.5	158.9	-71.3	167.1	13.1	0	0	116.5
1109	L	25.2	Very low	28.7	Very low	159 Å²	159	139.2 Å²	139.2	83%	0.832	75%	0.748	S	S	*	*				66.7	126.6	88.1	-105.5	79.3	0	0	0	111.6
1110	S	25.9	Very low	28.6	Very low	82 Å²	82	138.2 Å²	138.2	57%	0.573	75%	0.746	S	S	*	*			cis	-158.7	-175.6	13.8	-46.2	0	0	0	0	110.5
1111	I	28.5	Very low	28.5	Very low	151 Å²	151	139.1 Å²	139.1	77%	0.774	74%	0.741	S	S	*	*			trans	52.6	128.3	137	-70.2	161.8	0	0	0	118
1112	E	29.6	Very low	28.5	Very low	143 Å²	143	137.8 Å²	137.8	67%	0.668	74%	0.735	S	S	*	*			cis	-160	163	6.6	-125.5	-173.2	137.8	0	0	112.7	K1114	E1112-K1114 IonicContact OE1-NZ 2.75Å
1113	T	28.1	Very low	28.5	Very low	92 Å²	92	137.2 Å²	137.2	56%	0.564	73%	0.733	S	S	*	*			trans	2.3	163.1	144.1	65.7	0	0	0	0	122.4
1114	K	29	Very low	28.6	Very low	164 Å²	164	132.8 Å²	132.8	71%	0.713	72%	0.719	S	S	*	*			cis	-161.9	159.3	18.9	-128.7	142.6	-140.8	137.3	0	111	E1112	E1112-K1114 IonicContact OE1-NZ 2.75Å
1115	T	34.2	Very low	28.7	Very low	125 Å²	125	132 Å²	132	77%	0.767	71%	0.713	S	S	*	*			trans	-72.9	166	154.8	51.2	0	0	0	0	110.3
1116	P	34.9	Very low	29.1	Very low	127 Å²	127	135 Å²	135	83%	0.825	72%	0.719	S	S	*	*				-143.8	174.8	105.6	37.7	-23.4	0	0	0	115.1
1117	S	27.4	Very low	29.3	Very low	106 Å²	106	134.6 Å²	134.6	74%	0.741	72%	0.716	S	S	*	*			trans	-100.5	-172	-178.7	56.2	0	0	0	0	112.7
1118	M	27.9	Very low	29.5	Very low	154 Å²	154	136.7 Å²	136.7	76%	0.759	72%	0.72	S	S	*	*			trans	79.4	127.5	161	-84.7	-169.8	169.3	0	0	119.4
1119	N	26.3	Very low	29.5	Very low	128 Å²	128	134.7 Å²	134.7	68%	0.684	71%	0.714	S	S	*	*			trans	72.4	150.7	135.8	-61.6	-7.7	0	0	0	116.5
1120	I	26.5	Very low	29.5	Very low	132 Å²	132	134.7 Å²	134.7	68%	0.677	71%	0.708	S	S	*	*			cis	-159.6	158.6	-0.8	-129.6	171	0	0	0	110.5
1121	I	27.6	Very low	29.5	Very low	128 Å²	128	137.6 Å²	137.6	66%	0.656	72%	0.717	S	S	*	*			trans	55.3	117.9	154.9	-70.7	175.4	0	0	0	119.8
1122	K	27.3	Very low	29.4	Very low	171 Å²	171	135.6 Å²	135.6	74%	0.743	72%	0.716	S	S	*	*			trans	44.6	153.8	135.9	-55.4	179.4	-173.2	177.1	0	121.7
1123	N	28.1	Very low	29.1	Very low	150 Å²	150	134.1 Å²	134.1	80%	0.802	72%	0.717	S	S	*	*			trans	68.2	153	155.1	-66.2	-0	0	0	0	115.2
1124	D	27	Very low	29	Very low	109 Å²	109	138.9 Å²	138.9	58%	0.583	73%	0.73	S	S	*	*			cis	-171.8	166.7	-24.7	-172.9	10.5	0	0	0	104.2
1125	K	28.5	Very low	29	Very low	168 Å²	168	136.1 Å²	136.1	73%	0.73	73%	0.727	S	S	*	*			trans	55.7	101.2	161.9	-70.9	147.5	-175.7	141.4	0	118.7
1126	M	41.5	Very low	28.7	Very low	176 Å²	176	135.7 Å²	135.7	87%	0.867	72%	0.72	S	S	*	*				-17.2	145.8	120.1	-103.7	172.4	57.4	0	0	114
1127	P	38.5	Very low	28.4	Very low	95 Å²	95	137.1 Å²	137.1	62%	0.617	72%	0.716	S	S	*	*				-157	-174.5	81.8	41.6	-22.5	0	0	0	116.8
1128	N	27.9	Very low	28.5	Very low	138 Å²	138	137.3 Å²	137.3	74%	0.738	71%	0.713	S	S	*	*			trans	74.1	149.4	155.4	-62.1	-17.6	0	0	0	117.7
1129	L	28.8	Very low	28.4	Very low	131 Å²	131	140.5 Å²	140.5	69%	0.686	72%	0.716	S	S	*	*			cis	-149.9	141	-11.2	-147.5	76.3	0	0	0	112.9
1130	K	25.8	Very low	28.4	Very low	159 Å²	159	138 Å²	138	69%	0.691	71%	0.709	S	S	*	*			trans	13.9	130.6	143.4	-61.2	173.5	-176.3	176.1	0	122.2
1131	N	26.3	Very low	28.4	Very low	142 Å²	142	139.6 Å²	139.6	76%	0.759	71%	0.714	S	S	*	*				72.4	156.2	125.1	-58.9	7.5	0	0	0	122.1
1132	S	25.1	Very low	28.4	Very low	109 Å²	109	139.1 Å²	139.1	76%	0.762	72%	0.717	S	S	*	*			trans	74.1	148.3	157.5	79.9	0	0	0	0	117.4
1133	T	25.1	Very low	28.4	Very low	113 Å²	113	136.6 Å²	136.6	69%	0.693	72%	0.716	S	S	*	*			cis	-166.8	145	-26.3	17.7	0	0	0	0	107.5
1134	F	26	Very low	28.3	Very low	191 Å²	191	136.8 Å²	136.8	84%	0.838	71%	0.709	S	S	*	*			trans	64.4	163.2	165.6	-75.7	-138	0	0	0	113.3
1135	T	27.7	Very low	28.3	Very low	107 Å²	107	138.3 Å²	138.3	66%	0.656	71%	0.713	S	S	*	*			cis	-150.3	151.2	-1.6	-6.8	0	0	0	0	111
1136	N	27.8	Very low	28.3	Very low	115 Å²	115	135.7 Å²	135.7	62%	0.615	71%	0.707	S	S	*	*			trans	35.9	133.9	136.1	-75.9	31.5	0	0	0	124
1137	E	29.8	Very low	27.7	Very low	158 Å²	158	134.6 Å²	134.6	74%	0.738	70%	0.699	S	S	*	*				72.9	155	128.5	-65.8	171.7	143.8	0	0	119
1138	T	28.4	Very low	27.3	Very low	110 Å²	110	133.7 Å²	133.7	68%	0.675	70%	0.7	S	S	*	*			cis	-150.8	166.4	0.7	-3.3	0	0	0	0	113
1139	R	25.5	Very low	27.3	Very low	220 Å²	220	132.4 Å²	132.4	83%	0.83	69%	0.693	S	S	*	*			trans	79.5	141.6	139.9	-96.1	-177.8	169.3	135.5	-2	122.7
1140	S	26.5	Very low	27.3	Very low	76 Å²	76	133.5 Å²	133.5	53%	0.531	69%	0.692	S	S	.	*			trans	74.3	112.6	141.2	-65.3	0	0	0	0	117.4
1141	Q	27.9	Very low	27.5	Very low	165 Å²	165	133.7 Å²	133.7	77%	0.771	70%	0.699	S	S	*	*				75	144.4	71.7	-70.6	163.2	-35.8	0	0	111.1
1142	T	26.4	Very low	27.5	Very low	118 Å²	118	134.5 Å²	134.5	72%	0.724	70%	0.698	S	S	*	*			cis	-161.6	168.7	25.6	-17.3	0	0	0	0	110.4
1143	V	27.1	Very low	27.6	Very low	119 Å²	119	132.2 Å²	132.2	72%	0.721	68%	0.683	S	S	*	*			trans	69.9	134	143.6	162	0	0	0	0	117.6
1144	K	26.6	Very low	27.9	Very low	154 Å²	154	129.6 Å²	129.6	67%	0.67	67%	0.666	S	S	*	*			cis	-151.4	147.8	-11.5	-109.8	-174.6	-177.5	-179.6	0	108
1145	Q	27.9	Very low	27.9	Very low	140 Å²	140	127.5 Å²	127.5	65%	0.654	66%	0.659	S	S	*	*				43.5	138.1	90.5	-60.1	-172.3	-94.4	0	0	112.7
1146	D	27.4	Very low	27.8	Very low	113 Å²	113	128.4 Å²	128.4	60%	0.604	66%	0.66	S	S	*	*			cis	170.5	174.3	5.5	-90.5	-22.5	0	0	0	101.7
1147	H	28.6	Very low	27.8	Very low	154 Å²	154	131.5 Å²	131.5	71%	0.713	67%	0.671	S	S	*	*			cis	-132.2	155.5	-12.3	-108.3	-63.1	0	0	0	103.8
1148	A	30.8	Very low	27.6	Very low	76 Å²	76	128.5 Å²	128.5	63%	0.628	67%	0.672	S	S	*	*				54.1	153.4	77.9	0	0	0	0	0	113.9
1149	D	28.5	Very low	27.6	Very low	110 Å²	110	130.3 Å²	130.3	59%	0.588	68%	0.684	S	S	*	*			cis	-164.7	155.1	26.4	-147.1	-15.1	0	0	0	112.3
1150	K	28.8	Very low	27.6	Very low	154 Å²	154	124.6 Å²	124.6	67%	0.67	68%	0.678	S	S	*	*			trans	66.3	162.2	158.3	-78.8	142.7	-163.3	158	0	116.8
1151	I	29.3	Very low	27.6	Very low	164 Å²	164	129.3 Å²	129.3	84%	0.841	69%	0.691	S	S	*	*			cis	-112.5	148.6	23.8	-70.8	171.2	0	0	0	114.5
1152	E	26.1	Very low	27.5	Very low	158 Å²	158	127.6 Å²	127.6	74%	0.738	69%	0.686	S	S	*	*			trans	-119.2	-173.2	179.1	-168.4	176.8	-154.4	0	0	108.8
1153	S	27.7	Very low	27.5	Very low	62 Å²	62	130.3 Å²	130.3	43%	0.434	69%	0.689	S	S	.	*			trans	76.9	130.4	-156	76.1	0	0	0	0	110.6
1154	V	30.9	Very low	27.4	Very low	57 Å²	57	129.1 Å²	129.1	35%	0.345	69%	0.686	S	S	.	*			cis	-154.1	155.7	32.1	-143.3	0	0	0	0	110.2	L1200 V1201	V1154-L1200 HydrophobicContact CG1-CB 3.82Å; V1154-L1200 HydrophobicContact CG1-CD2 4.04Å; V1154-L1200 HydrophobicContact CG1-CG 3.69Å; V1154-V1201 HydrophobicContact CB-CG1 3.96Å; V1154-V1201 WeakPolarHBondContact CB-OXT 3.3Å; V1154-V1201 HydrophobicContact CG1-CB 4.37Å; V1154-V1201 HydrophobicContact CG1-CG1 3.82Å; V1154-V1201 HydrophobicContact CG1-CG2 4.35Å; V1154-V1201 WeakPolarHBondContact CG2-OXT 3.41Å
1155	E	26.2	Very low	27.4	Very low	147 Å²	147	128.1 Å²	128.1	69%	0.687	69%	0.687	S	S	*	*			cis	96.7	35.3	8.7	-140.1	172.9	-175.9	0	0	119.8
1156	N	26.6	Very low	27.3	Very low	126 Å²	126	130.5 Å²	130.5	67%	0.674	69%	0.69	S	S	*	*			trans	88.6	107.5	143.8	-39.5	-70.4	0	0	0	122
1157	E	26.1	Very low	27.2	Very low	181 Å²	181	135.3 Å²	135.3	85%	0.846	71%	0.706	S	S	*	*	S	Bend	trans	-163	23.9	134.8	-123	174.5	-157.5	0	0	117.4
1158	A	26.9	Very low	27.2	Very low	94 Å²	94	132.9 Å²	132.9	78%	0.777	71%	0.707	S	S	*	*			trans	-135	45.6	-168.2	0	0	0	0	0	117.4
1159	T	27.8	Very low	27.1	Very low	149 Å²	149	134.8 Å²	134.8	91%	0.914	71%	0.71	S	S	*	*			trans	-132.5	24.6	170.9	47.1	0	0	0	0	115.5
1160	S	26.6	Very low	27.2	Very low	100 Å²	100	136 Å²	136	70%	0.699	72%	0.717	S	S	*	*	S	Bend	trans	-87.4	146.3	142.9	58.4	0	0	0	0	108.2
1161	Q	25.2	Very low	27.4	Very low	175 Å²	175	135.8 Å²	135.8	82%	0.818	72%	0.718	S	S	*	*	S	Bend	trans	70.5	65.8	-174	-47.7	-177.4	15.1	0	0	117.7
1162	L	26.4	Very low	27.4	Very low	128 Å²	128	136.1 Å²	136.1	67%	0.67	71%	0.713	S	S	*	*	S	Bend	trans	-160.9	36.8	145.6	-114.8	168.5	0	0	0	114.8
1163	F	26.6	Very low	27.6	Very low	176 Å²	176	134 Å²	134	77%	0.772	71%	0.711	S	S	*	*	S	Bend	trans	-144.1	34.9	173.8	-115.3	-73.8	0	0	0	112.8	V1078	V1078-F1163 HydrophobicContact CB-CZ 4.39Å; V1078-F1163 HydrophobicContact CG1-CE1 4.45Å; V1078-F1163 HydrophobicContact CG1-CE2 3.94Å; V1078-F1163 HydrophobicContact CG1-CZ 3.55Å; V1078-F1163 HydrophobicContact CG2-CE1 4.07Å; V1078-F1163 HydrophobicContact CG2-CE2 4.16Å; V1078-F1163 HydrophobicContact CG2-CZ 3.81Å
1164	S	24.9	Very low	27.7	Very low	94 Å²	94	137.5 Å²	137.5	66%	0.657	72%	0.724	S	S	*	*			trans	-129.6	14.9	-173.9	52.5	0	0	0	0	115.3
1165	D	25.5	Very low	27.7	Very low	132 Å²	132	142.6 Å²	142.6	71%	0.706	74%	0.744	S	S	*	*			trans	-116.1	75.6	177.9	-90.9	-53.5	0	0	0	113.2
1166	R	26.9	Very low	27.7	Very low	190 Å²	190	141.8 Å²	141.8	72%	0.717	74%	0.74	S	S	*	*	S	Bend	trans	-169	41	156.8	-109.7	166.9	-169.6	-95.6	7.2	113	D271	D271-R1166 IonicContact OD2-CZ 3.4Å; D271-R1166 IonicContact OD2-NH1 3.63Å; D271-R1166 PolarHBondContact OD2-NH1 2.9Å; D271-R1166 IonicContact OD2-NH2 2.78Å
1167	K	24.9	Very low	27.8	Very low	214 Å²	214	141.1 Å²	141.1	93%	0.93	74%	0.744	S	S	*	*			trans	-137.4	94.8	171	-82.4	-168.3	177.8	179.4	0	112.7
1168	S	28.7	Very low	28	Very low	104 Å²	104	140.4 Å²	140.4	73%	0.727	74%	0.738	S	S	*	*			trans	-122.7	138.7	159.2	60.3	0	0	0	0	107.3
1169	T	29.3	Very low	28.2	Very low	115 Å²	115	142.8 Å²	142.8	71%	0.706	74%	0.737	S	S	*	*			cis	-137.5	157.8	0.9	51.5	0	0	0	0	110.6
1170	D	29.8	Very low	28.3	Very low	136 Å²	136	142 Å²	142	73%	0.727	73%	0.727	S	S	*	*				160.4	121.3	119.5	-79.7	-11.1	0	0	0	114.6
1171	H	33.5	Very low	28.5	Very low	149 Å²	149	145.2 Å²	145.2	69%	0.69	73%	0.728	S	S	*	*			trans	55.6	115.3	154.2	-69.8	-31.7	0	0	0	124.5
1172	K	28.8	Very low	28.7	Very low	172 Å²	172	143.4 Å²	143.4	75%	0.748	72%	0.723	S	S	*	*				70.1	141.6	126.5	-63.3	173.6	-179.4	172.4	0	117.6
1173	T	30.3	Very low	28.7	Very low	113 Å²	113	141.6 Å²	141.6	69%	0.693	72%	0.721	S	S	*	*			cis	-163.4	165.6	8.1	-1.6	0	0	0	0	111.1
1174	I	30.9	Very low	29	Very low	135 Å²	135	142.4 Å²	142.4	69%	0.692	73%	0.727	S	S	*	*			trans	69.1	102.1	151.9	-68.8	162.6	0	0	0	115.8
1175	E	29.1	Very low	29.1	Very low	165 Å²	165	146.2 Å²	146.2	77%	0.771	73%	0.734	S	S	*	*				78.5	153.4	95.6	-72.1	178.4	-174.8	0	0	114.5
1176	H	27.1	Very low	29.7	Very low	130 Å²	130	144.6 Å²	144.6	60%	0.602	73%	0.73	S	S	*	*			cis	-149.2	-171.6	4.6	-152.9	-104.9	0	0	0	111.3
1177	C	29.2	Very low	29.6	Very low	112 Å²	112	142.5 Å²	142.5	76%	0.757	73%	0.73	S	S	*	*			trans	75.1	111.6	177.2	-61.3	0	0	0	0	114.8
1178	K	29.7	Very low	29.7	Very low	166 Å²	166	138.8 Å²	138.8	72%	0.722	72%	0.721	S	S	*	*			cis	63.6	138.1	26.9	-86.4	177.6	-176.9	170.2	0	113.9
1179	L	31	Very low	29.8	Very low	144 Å²	144	143.5 Å²	143.5	75%	0.754	73%	0.731	S	S	*	*			cis	-115.7	-147.6	-3	-58.4	84.7	0	0	0	109
1180	N	30.3	Very low	29.5	Very low	133 Å²	133	143.2 Å²	143.2	71%	0.711	73%	0.733	S	S	*	*			cis	-169.2	160.1	-6.9	-123.7	-4.1	0	0	0	105.4
1181	K	29.7	Very low	29.3	Very low	166 Å²	166	141.1 Å²	141.1	72%	0.722	73%	0.729	S	S	*	*			cis	-170	166.5	-22.6	-150.2	-169.8	172.7	-170.4	0	108.2
1182	I	30.9	Very low	29.1	Very low	138 Å²	138	143.1 Å²	143.1	71%	0.708	74%	0.739	S	S	*	*			trans	70.9	112.1	164	-54.5	152.6	0	0	0	114.4
1183	S	26.2	Very low	29	Very low	90 Å²	90	143.2 Å²	143.2	63%	0.629	74%	0.744	S	S	*	*			cis	90.4	109	23.8	86.1	0	0	0	0	116.7
1184	H	31.6	Very low	29	Very low	192 Å²	192	146.9 Å²	146.9	89%	0.889	75%	0.75	S	S	*	*				-168	160.4	119.2	-107.1	-80.4	0	0	0	112.6
1185	H	28.6	Very low	28.9	Very low	174 Å²	174	147.2 Å²	147.2	81%	0.806	75%	0.754	S	S	*	*			trans	-121.3	178.5	-178	-102.1	-53.9	0	0	0	108.2
1186	P	36.5	Very low	28.9	Very low	98 Å²	98	146.7 Å²	146.7	64%	0.636	75%	0.751	S	S	*	*			cis	-137.1	-151.4	-35.2	35.8	-13.8	0	0	0	111.5
1187	M	26.3	Very low	28.9	Very low	146 Å²	146	151.3 Å²	151.3	72%	0.719	76%	0.763	S	S	*	*			trans	88.2	122.1	163.2	-49.7	-52.2	-74.5	0	0	119.3
1188	D	26.9	Very low	28.8	Very low	137 Å²	137	149.7 Å²	149.7	73%	0.733	75%	0.753	S	S	*	*			trans	24	118.4	131.9	-47.6	-15	0	0	0	119.3
1189	E	29.1	Very low	28.8	Very low	202 Å²	202	147.2 Å²	147.2	94%	0.944	75%	0.748	S	S	*	*				-158.7	172.6	105.5	-119.6	179.8	-172.2	0	0	112.8
1190	C	24	Very low	28.7	Very low	109 Å²	109	146 Å²	146	74%	0.736	74%	0.742	S	S	*	*			trans	-94.9	150.7	-167.8	-166.1	0	0	0	0	113.2
1191	S	26.1	Very low	28.8	Very low	93 Å²	93	145.8 Å²	145.8	65%	0.65	75%	0.745	S	S	*	*			trans	49.4	114.6	153.8	63	0	0	0	0	119.2
1192	Q	29.6	Very low	28.8	Very low	191 Å²	191	144.8 Å²	144.8	89%	0.893	75%	0.746	S	S	*	*				-172.6	168.1	111.8	-104.1	172.9	42.8	0	0	113.2	K1194	Q1192-K1194 PolarHBondContact O-N 3.46Å
1193	M	26.2	Very low	28.7	Very low	173 Å²	173	145.2 Å²	145.2	85%	0.852	75%	0.748	S	S	*	*			trans	-65.5	123.9	172.4	-60.5	173.2	180	0	0	111.7
1194	K	30.9	Very low	28.8	Very low	190 Å²	190	148.2 Å²	148.2	83%	0.826	75%	0.754	S	S	*	*				-167.4	123.1	119.5	-90.7	135.6	-165.3	169	0	107.6	Q1192	Q1192-K1194 PolarHBondContact O-N 3.46Å
1195	N	27.7	Very low	28.7	Very low	143 Å²	143	145.6 Å²	145.6	77%	0.765	75%	0.746	S	S	*	*				79.2	134	57.6	-164	14.5	0	0	0	111.9
1196	Q	29.3	Very low	28.7	Very low	154 Å²	154	143.9 Å²	143.9	72%	0.72	74%	0.743	S	S	*	*			trans	73.1	111.2	-179.9	-56.4	-174.1	-6.5	0	0	118.5
1197	R	27.1	Very low	28.2	Very low	227 Å²	227	146.9 Å²	146.9	86%	0.857	75%	0.75	S	S	*	*				64.1	145.9	125.3	-73.3	-173.2	164.9	161.6	-5.9	121.1
1198	S	27.8	Very low	28.3	Very low	77 Å²	77	147 Å²	147	54%	0.538	75%	0.752	S	S	.	*			cis	-169.7	177	-20.3	44.5	0	0	0	0	109.1
1199	D	28.9	Very low	28.4	Very low	115 Å²	115	147.8 Å²	147.8	62%	0.615	75%	0.753	S	S	*	*			trans	72.6	95.3	152.9	-50.7	-41.5	0	0	0	118
1200	L	28.1	Very low	28.3	Very low	119 Å²	119	143.3 Å²	143.3	62%	0.623	74%	0.738	S	S	*	*			trans	86.2	116.2	156.1	-66.5	85.9	0	0	0	120	V1154	V1154-L1200 HydrophobicContact CG1-CB 3.82Å; V1154-L1200 HydrophobicContact CG1-CD2 4.04Å; V1154-L1200 HydrophobicContact CG1-CG 3.69Å
1201	V	34.3	Very low	28.7	Very low	128 Å²	128	146.4 Å²	146.4	78%	0.776	74%	0.738	S	S	*	*			trans	133.6	0	177.4	-81.5	0	0	0	0	111.3	V1154	V1154-V1201 HydrophobicContact CB-CG1 3.96Å; V1154-V1201 WeakPolarHBondContact CB-OXT 3.3Å; V1154-V1201 HydrophobicContact CG1-CB 4.37Å; V1154-V1201 HydrophobicContact CG1-CG1 3.82Å; V1154-V1201 HydrophobicContact CG1-CG2 4.35Å; V1154-V1201 WeakPolarHBondContact CG2-OXT 3.41Å

Retrieved 1,201 of 1,201 residues in 657.6 ms (Link to these results)

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