A0A087Y3X6_POEFO Loading...

Splicing factor Cactin

AlphaFold DB , UniProt , Accession A0A087Y3X6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 852 aa.

						>A0A087Y3X6_POEFO|A0A087Y3X6
MGSKSRRRTRSRTRSRSRDRRNKSKISKSQSPDERRGRSRSPDARRAAHGRTRSSSSSAASNHGSPVRRRPQHWGRSGSGSGSEADRRRREHRSSRSKGRSSSPDSDNSKMRRRGKETERRKGRSQSGSGSSSGSSDRERRRRRKSPERGSPARGRETRDQERKSDRSRERKKRSEDRERGRSKKSKERDDRRRGRRGSSASDSSESSDSDNENLEVKEKEERKKQKELMKALETPEEKRARRLAKKEAKEKKRREKMGWSEEYMGYTNADNPFGDNNLLGTFKWQKALDKKGIGHFSEKELKERNKCIQEENRRELQKVKQLRLEREREKAMRETELEMLQREKEAEHFKTWAEQEDNFHLQQAKLRSKIRIRDGRAKPIDLLAKYISAEDDDLAVEMHEPYTFLNGLTVTDMEDLLEDIKVYMELEQGKNVDFWRDMTTITEDEISKLRKLEASGKGPGDRRDGINTAVSTDVQSVFKGKTYSQLQALHLNIEGKIRAGGSNLDIGYWESLLQQVRVYMARARLRERHQDVLRQKLFKLKQEQGVESEPLFPIIKEEPRSEEDEDEERTRERTAEESGLSASSSRRNKNREMEEDEEGPGPSTSTAGGQDEEGGEKDEGKDEEGKGEAAEAVLTEEDLIQQSQAEYDSGRYSPTLLTLSELPLDTHTITPEEDAHRLQLARRQLQVTGDASESAEDAFVRRAKEGMGNDEAQFSVEIPVSGKMYLWADKYRPRKPRFFNRVHTGFEWNKYNQTHYDFDNPPPKIVQGYKFNIFYPDLIDKRSTPQYFLEPCPDNKDFGILRFHAGPPYEDIAFKIVNREWEYSHRHGFRCQFANGIFQLWFHFKRYRYRR
					

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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	42.7	Very low	34.1	Very low	238 Å²	238	173.1 Å²	173.1	100%	1.172	87%	0.869	S	S	*	*				0	146.6	0	-60.8	-47.1	-173.2	0	0	109.5
2	G	32	Very low	33.8	Very low	84 Å²	84	177.3 Å²	177.3	87%	0.866	87%	0.867	S	S	*	*			trans	-72.4	163.9	-161.7	0	0	0	0	0	116.6
3	S	35.6	Very low	33.6	Very low	113 Å²	113	175.1 Å²	175.1	79%	0.79	87%	0.87	S	S	*	*			trans	-124.1	156.1	-169.7	-71.4	0	0	0	0	114.7
4	K	40.7	Very low	33.4	Very low	206 Å²	206	179.4 Å²	179.4	90%	0.896	87%	0.871	S	S	*	*			trans	14	123.1	148.9	-57	171.5	-178.8	173.2	0	118.3
5	S	34.4	Very low	33.1	Very low	109 Å²	109	175.3 Å²	175.3	76%	0.762	87%	0.868	S	S	*	*				171.9	127	123.5	178.1	0	0	0	0	117
6	R	32.5	Very low	32.9	Very low	221 Å²	221	179.1 Å²	179.1	83%	0.834	87%	0.87	S	S	*	*			trans	7.2	143.7	137.6	-45.3	164.1	159.4	169.4	-7.3	121.6
7	R	31.6	Very low	32.6	Very low	217 Å²	217	176.1 Å²	176.1	82%	0.819	87%	0.871	S	S	*	*				129	126.2	125.6	-84.3	-173.8	172.6	178	0	118.7
8	R	31.5	Very low	32.7	Very low	229 Å²	229	177.6 Å²	177.6	86%	0.864	87%	0.865	S	S	*	*				22.8	128	129.5	-68.5	179.1	170.2	170.7	-3.5	121.1
9	T	31.9	Very low	32.6	Very low	141 Å²	141	175.9 Å²	175.9	87%	0.865	86%	0.861	S	S	*	*			trans	-93	178.9	144.4	57.3	0	0	0	0	111.5
10	R	31.3	Very low	32.6	Very low	228 Å²	228	177 Å²	177	86%	0.86	86%	0.855	S	S	*	*			trans	-163.7	85.2	-171.4	-163.4	-172.8	-170.8	-165.6	4.3	117.8
11	S	30.4	Very low	32.5	Very low	118 Å²	118	180 Å²	180	83%	0.825	86%	0.857	S	S	*	*			trans	-149.6	135	172.2	44.3	0	0	0	0	111.8
12	R	31	Very low	32.1	Very low	224 Å²	224	175.4 Å²	175.4	85%	0.845	84%	0.837	S	S	*	*			cis	93.9	81.7	-11.1	-160.6	-176.2	172.5	-97.4	8.9	120
13	T	31.3	Very low	32.3	Very low	148 Å²	148	179.9 Å²	179.9	91%	0.908	83%	0.833	S	S	*	*			trans	-133.3	169.3	158.5	43.7	0	0	0	0	112.5
14	R	30.4	Very low	32.1	Very low	235 Å²	235	179.5 Å²	179.5	89%	0.887	83%	0.831	S	S	*	*			trans	-147.8	134	-170.2	-91.6	174.9	153.5	-175.4	-3.6	112.3
15	S	29	Very low	31.8	Very low	118 Å²	118	178.3 Å²	178.3	83%	0.825	83%	0.825	S	S	*	*			trans	-165	125.4	152.8	35.8	0	0	0	0	107.1
16	R	30.3	Very low	31.6	Very low	237 Å²	237	179.6 Å²	179.6	89%	0.894	82%	0.822	S	S	*	*			cis	68.5	101.9	39.5	-81.4	-168.9	168.5	-176.3	-3.2	115.4
17	S	28.3	Very low	31.5	Very low	127 Å²	127	173.9 Å²	173.9	89%	0.888	82%	0.816	S	S	*	*			trans	-149.5	171.7	131.5	-162	0	0	0	0	110.8
18	R	32.9	Very low	31.4	Very low	203 Å²	203	173.4 Å²	173.4	77%	0.766	82%	0.82	S	S	*	*			trans	-151.6	148.6	-178.2	-95.1	-179.7	166	172.3	-4.4	108.9
19	D	31.6	Very low	31.2	Very low	147 Å²	147	168.2 Å²	168.2	79%	0.786	82%	0.819	S	S	*	*			trans	177.7	151.6	131.3	-89.6	-24.1	0	0	0	109.6
20	R	32.8	Very low	31	Very low	197 Å²	197	170.5 Å²	170.5	74%	0.743	82%	0.819	S	S	*	*			cis	108.8	105.8	9.6	-79	-174	151	-165.7	-5.5	116
21	R	31.3	Very low	31.1	Very low	240 Å²	240	164.9 Å²	164.9	91%	0.906	82%	0.815	S	S	*	*			trans	-162.6	129.3	141.8	-96.1	157.7	-169.4	-154.9	1.9	106.1
22	N	33.9	Very low	32.1	Very low	141 Å²	141	164.6 Å²	164.6	75%	0.754	81%	0.81	S	S	*	*				67.1	133.6	56.2	-78.3	-22	0	0	0	113.3
23	K	35.6	Very low	32.1	Very low	178 Å²	178	160.9 Å²	160.9	77%	0.774	81%	0.807	S	S	*	*			cis	-166.4	172.9	8.9	-137.4	173.5	-178.2	178.9	0	112.7
24	S	31.9	Very low	32	Very low	106 Å²	106	159.7 Å²	159.7	74%	0.741	79%	0.792	S	S	*	*			trans	79.4	152.7	153.5	81.1	0	0	0	0	119.1
25	K	33.6	Very low	31.9	Very low	181 Å²	181	157 Å²	157	79%	0.787	78%	0.782	S	S	*	*			cis	-166.8	154.4	-5.6	-120.3	173.2	174.6	-173.9	0	112.8
26	I	30.7	Very low	31.8	Very low	135 Å²	135	162.1 Å²	162.1	69%	0.692	78%	0.783	S	S	*	*			trans	82.9	113.2	142.3	-71.4	167.5	0	0	0	124.1
27	S	30.1	Very low	31.6	Very low	101 Å²	101	154.6 Å²	154.6	71%	0.706	78%	0.779	S	S	*	*			trans	35.4	126.8	143.3	73.4	0	0	0	0	128.5
28	K	28.9	Very low	31.7	Very low	208 Å²	208	159.9 Å²	159.9	90%	0.904	78%	0.78	S	S	*	*				29.7	127.9	128.6	-70.6	-173.8	173.1	-175.5	0	122.4
29	S	28.8	Very low	31.4	Very low	119 Å²	119	154.7 Å²	154.7	83%	0.832	77%	0.774	S	S	*	*				-161.4	-174.7	121.8	62	0	0	0	0	111.4
30	Q	28.1	Very low	31.3	Very low	189 Å²	189	159.6 Å²	159.6	88%	0.883	78%	0.782	S	S	*	*			trans	-91.5	162	-156.7	-62.2	138.1	-86.1	0	0	116.9
31	S	31.5	Very low	31.6	Very low	111 Å²	111	155.9 Å²	155.9	78%	0.776	79%	0.786	S	S	*	*			trans	-64.4	174.6	154.7	-42.9	0	0	0	0	111.8
32	P	53.2	Low	32.3	Very low	111 Å²	111	150.6 Å²	150.6	72%	0.721	78%	0.782	S	S	*	*			cis	-138.8	-166.8	11.1	41.2	-20.4	0	0	0	116
33	D	29.7	Very low	32.2	Very low	146 Å²	146	149.6 Å²	149.6	78%	0.781	78%	0.777	S	S	*	*			trans	127	152.1	130.8	-111.1	-37.7	0	0	0	121.5
34	E	28.6	Very low	32.1	Very low	124 Å²	124	145 Å²	145	58%	0.579	77%	0.773	S	S	*	*			trans	-30.3	154.4	-171.5	-90	-161.5	125	0	0	125.6
35	R	28.8	Very low	32.2	Very low	179 Å²	179	149.1 Å²	149.1	68%	0.675	77%	0.772	S	S	*	*			trans	88.8	126.2	136.2	-80.4	168	-168.5	-174.4	21	123.7
36	R	27.3	Very low	32.1	Very low	225 Å²	225	150.8 Å²	150.8	85%	0.849	77%	0.773	S	S	*	*			trans	68.1	74.2	133.6	-65.3	176.3	177.1	-128.5	-0.9	120.9
37	G	25.8	Very low	32.1	Very low	79 Å²	79	148.8 Å²	148.8	81%	0.814	78%	0.777	S	S	*	*				74.6	-178.1	101.7	0	0	0	0	0	122.9
38	R	30.2	Very low	32.3	Very low	238 Å²	238	147.1 Å²	147.1	90%	0.898	77%	0.77	S	S	*	*			trans	78.3	99.6	172.6	-106.7	-175.4	-178.5	-119.3	-0.3	120.8
39	S	27.3	Very low	32.4	Very low	93 Å²	93	146.4 Å²	146.4	65%	0.65	77%	0.769	S	S	*	*				66.1	122	122.1	65	0	0	0	0	121.9
40	R	28.6	Very low	32.5	Very low	251 Å²	251	144 Å²	144	95%	0.947	76%	0.763	S	S	*	*			trans	-138.4	110.9	134.9	-74.8	-165.6	174.9	178.9	-0.5	111.9
41	S	39.3	Very low	32.7	Very low	119 Å²	119	140.7 Å²	140.7	83%	0.832	74%	0.742	S	S	*	*			trans	-123.3	150.4	150.2	-49.5	0	0	0	0	106.5
42	P	46.8	Very low	32.8	Very low	128 Å²	128	140.4 Å²	140.4	83%	0.831	74%	0.736	S	S	*	*				-150.3	-167.5	97.6	40.6	-23	0	0	0	111.8
43	D	31.8	Very low	31.8	Very low	120 Å²	120	143.8 Å²	143.8	64%	0.642	73%	0.734	S	S	*	*			cis	-106.7	-165.2	-18.5	-169.9	5.4	0	0	0	107.8	R45	D43-R45 IonicContact OD2-CZ 2.68Å; D43-R45 VanDerWaalsContact OD2-CZ 3.31Å; D43-R45 IonicContact OD2-NE 2.67Å; D43-R45 PolarHBondContact OD2-NE 3.48Å; D43-R45 IonicContact OD2-NH2 2.66Å; D43-R45 PolarHBondContact OD2-NH2 3.29Å
44	A	34	Very low	31.9	Very low	83 Å²	83	141.9 Å²	141.9	69%	0.686	73%	0.732	S	S	*	*			trans	-133	-147.7	169.1	0	0	0	0	0	110.4
45	R	32.5	Very low	32.2	Very low	191 Å²	191	141 Å²	141	72%	0.721	74%	0.74	S	S	*	*			trans	121.6	138.7	166.4	-65.4	153.8	-159	-114.4	1.8	112.1	D43	D43-R45 IonicContact OD2-CZ 2.68Å; D43-R45 VanDerWaalsContact OD2-CZ 3.31Å; D43-R45 IonicContact OD2-NE 2.67Å; D43-R45 PolarHBondContact OD2-NE 3.48Å; D43-R45 IonicContact OD2-NH2 2.66Å; D43-R45 PolarHBondContact OD2-NH2 3.29Å
46	R	31.6	Very low	32.5	Very low	216 Å²	216	138.1 Å²	138.1	82%	0.815	75%	0.747	S	S	*	*			cis	-160.6	132.6	-12.6	-107.8	176.8	179.5	-140.1	-5	105.5
47	A	32	Very low	32.8	Very low	93 Å²	93	132.6 Å²	132.6	77%	0.769	74%	0.743	S	S	*	*				64.3	137.4	80.1	0	0	0	0	0	115
48	A	33.3	Very low	33	Very low	67 Å²	67	134 Å²	134	55%	0.554	74%	0.741	S	S	*	*			cis	-175.2	176.4	-9.2	0	0	0	0	0	112.1
49	H	31.2	Very low	33.1	Very low	192 Å²	192	127.7 Å²	127.7	89%	0.889	74%	0.739	S	S	*	*			trans	75.9	143.9	160.2	-44.6	-68.1	0	0	0	119.7
50	G	30.2	Very low	33.3	Very low	68 Å²	68	128.2 Å²	128.2	70%	0.701	75%	0.749	S	S	*	*			cis	149.6	157.1	-15.7	0	0	0	0	0	116.6
51	R	33.3	Very low	33.5	Very low	121 Å²	121	121.3 Å²	121.3	46%	0.457	74%	0.74	S	S	.	*			trans	56.8	132.7	160.1	-66	178.6	161	156.6	-6.4	118.3	Q342	R51-Q342 VanDerWaalsContact CZ-OE1 3.24Å
52	T	32.8	Very low	33	Very low	105 Å²	105	123.5 Å²	123.5	64%	0.644	74%	0.742	S	S	*	*			cis	79.7	126	36.2	72.7	0	0	0	0	117.2
53	R	33.5	Very low	32.3	Very low	181 Å²	181	126.9 Å²	126.9	68%	0.683	75%	0.746	S	S	*	*			trans	169.7	145.6	143.5	-89.8	161.4	-179.8	-151.3	-4.2	109.7
54	S	31.5	Very low	32.1	Very low	106 Å²	106	124.8 Å²	124.8	74%	0.741	75%	0.753	S	S	*	*			cis	77.6	150.8	38.5	-45.9	0	0	0	0	113.4
55	S	34	Very low	31.8	Very low	106 Å²	106	126.5 Å²	126.5	74%	0.741	76%	0.76	S	S	*	*			cis	169.3	144.4	-19.1	54.7	0	0	0	0	109.4
56	S	35.3	Very low	32.9	Very low	119 Å²	119	123 Å²	123	83%	0.832	76%	0.762	S	S	*	*			trans	168.9	162	161.8	47	0	0	0	0	110.9
57	S	33.7	Very low	32.8	Very low	108 Å²	108	117.9 Å²	117.9	76%	0.755	75%	0.754	S	S	*	*			cis	-166	-170.8	-21	54.7	0	0	0	0	106.2
58	S	29.4	Very low	32.6	Very low	110 Å²	110	123.6 Å²	123.6	77%	0.769	76%	0.756	S	S	*	*			cis	-152.4	-171.9	16	-57.2	0	0	0	0	109.8
59	A	32.3	Very low	32.4	Very low	104 Å²	104	131.2 Å²	131.2	86%	0.86	77%	0.771	S	S	*	*			trans	-143.4	165.4	175.2	0	0	0	0	0	113.4
60	A	32	Very low	32.3	Very low	105 Å²	105	133.4 Å²	133.4	87%	0.868	77%	0.771	S	S	*	*			trans	-159.6	165.2	167.4	0	0	0	0	0	111.1
61	S	33.2	Very low	33.3	Very low	106 Å²	106	135 Å²	135	74%	0.741	77%	0.769	S	S	*	*			trans	-142	147.1	-163.2	56.2	0	0	0	0	115.2
62	N	28.7	Very low	33.3	Very low	164 Å²	164	137.4 Å²	137.4	88%	0.877	79%	0.786	S	S	*	*			trans	-175.4	159.5	137.4	-107.6	-3	0	0	0	114.3
63	H	32	Very low	33.2	Very low	199 Å²	199	138.8 Å²	138.8	92%	0.921	78%	0.784	S	S	*	*			trans	-109.2	153.3	163.8	-83.4	-49.5	0	0	0	110.7
64	G	26.8	Very low	32.9	Very low	77 Å²	77	140.6 Å²	140.6	79%	0.794	79%	0.791	S	S	*	*			trans	164.7	105.9	172.4	0	0	0	0	0	113.7
65	S	27.7	Very low	32.7	Very low	119 Å²	119	138.7 Å²	138.7	83%	0.832	79%	0.788	S	S	*	*			trans	-106.6	-172.1	176.1	-41	0	0	0	0	110
66	P	55.5	Low	32.4	Very low	116 Å²	116	144.5 Å²	144.5	75%	0.753	79%	0.794	S	S	*	*			cis	-127.5	-166.5	-28.9	26.6	-4.7	0	0	0	111.8
67	V	29.5	Very low	32.1	Very low	109 Å²	109	143.5 Å²	143.5	66%	0.661	79%	0.787	S	S	*	*				154.8	113.5	123.1	163.1	0	0	0	0	114.7
68	R	28.9	Very low	31.9	Very low	213 Å²	213	141.9 Å²	141.9	80%	0.804	79%	0.788	S	S	*	*			trans	62.8	160.9	153.2	-67.6	170.7	-155	-112.3	6.2	117.4
69	R	29.5	Very low	31.9	Very low	228 Å²	228	143 Å²	143	86%	0.86	80%	0.796	S	S	*	*			cis	-139.9	-174.9	9.3	-134.3	161.6	-152.1	-107.2	8.2	111.6
70	R	28.2	Very low	31.6	Very low	238 Å²	238	141.2 Å²	141.2	90%	0.898	79%	0.787	S	S	*	*			trans	-96.3	-175.8	-166.6	-118.4	-161.8	162.2	-174.5	-3.8	113.2
71	P	50.8	Low	31.4	Very low	102 Å²	102	142.6 Å²	142.6	66%	0.662	79%	0.79	S	S	*	*			trans	-129.6	-142.4	-139.5	42.2	-19.3	0	0	0	114.2
72	Q	34.3	Very low	31.1	Very low	171 Å²	171	141 Å²	141	80%	0.799	79%	0.79	S	S	*	*			trans	86.1	153.6	173.9	-54.5	-174.6	-24.7	0	0	115.1
73	H	29.5	Very low	31.1	Very low	133 Å²	133	137.9 Å²	137.9	62%	0.616	78%	0.781	S	S	*	*			cis	-154.8	179.4	3.1	-149.9	-116.5	0	0	0	112.6
74	W	28.4	Very low	31.1	Very low	219 Å²	219	137.1 Å²	137.1	83%	0.83	78%	0.778	S	S	*	*			trans	64.7	147.3	166.6	-96.5	-80.1	0	0	0	119.6
75	G	27.3	Very low	31.3	Very low	66 Å²	66	137.2 Å²	137.2	68%	0.68	77%	0.771	S	S	*	*			cis	145.3	144.9	-18.7	0	0	0	0	0	116.5
76	R	27.9	Very low	31.4	Very low	228 Å²	228	137.3 Å²	137.3	86%	0.86	76%	0.762	S	S	*	*			trans	77.5	99.2	166.3	-80.2	-175	160.1	-116	-1.4	122
77	S	28.3	Very low	30.3	Very low	98 Å²	98	140 Å²	140	69%	0.685	76%	0.758	S	S	*	*				33.2	114.1	113.9	64.7	0	0	0	0	122.6
78	G	29.1	Very low	30.4	Very low	75 Å²	75	144.7 Å²	144.7	77%	0.773	76%	0.764	S	S	*	*				80.6	128.6	108.9	0	0	0	0	0	121.8
79	S	29.1	Very low	30.5	Very low	134 Å²	134	144.3 Å²	144.3	94%	0.937	76%	0.762	S	S	*	*			trans	-170.1	166.2	152.7	-81.2	0	0	0	0	110.3
80	G	26.7	Very low	30.6	Very low	65 Å²	65	142.3 Å²	142.3	67%	0.67	75%	0.754	S	S	*	*			trans	-136.3	-159.5	-175.6	0	0	0	0	0	114.8
81	S	27.6	Very low	30.8	Very low	134 Å²	134	137.6 Å²	137.6	94%	0.937	74%	0.743	S	S	*	*			trans	65.5	154.9	-161.9	76.3	0	0	0	0	113.1
82	G	27.4	Very low	29.9	Very low	72 Å²	72	138.5 Å²	138.5	74%	0.742	74%	0.738	S	S	*	*			cis	177.7	178.7	-0.9	0	0	0	0	0	106.4
83	S	29.4	Very low	29.8	Very low	99 Å²	99	141 Å²	141	69%	0.692	74%	0.74	S	S	*	*			cis	-165.2	165.4	-11.3	49.6	0	0	0	0	108.1
84	E	30.6	Very low	29.7	Very low	184 Å²	184	139.1 Å²	139.1	86%	0.86	74%	0.742	S	S	*	*			trans	65.5	163	160.5	-68.8	176.2	109.7	0	0	119.2
85	A	31.1	Very low	29.9	Very low	78 Å²	78	134.1 Å²	134.1	65%	0.645	74%	0.741	S	S	*	*			cis	-165.7	-179.4	-29.8	0	0	0	0	0	111.1
86	D	31.1	Very low	30.1	Very low	121 Å²	121	142 Å²	142	65%	0.647	75%	0.75	S	S	*	*			trans	70.8	151.6	162.9	-89.1	23.6	0	0	0	121.6
87	R	31.9	Very low	30.2	Very low	172 Å²	172	135.6 Å²	135.6	65%	0.649	74%	0.74	S	S	*	*			cis	-174.8	140.5	-47.9	-113.8	-178.1	-160.5	133.5	-6	111.2
88	R	31.7	Very low	30.5	Very low	209 Å²	209	141 Å²	141	79%	0.789	75%	0.751	S	S	*	*			trans	66.5	160.6	152.7	-59.8	167	177.8	171.9	1.3	115.9
89	R	31.6	Very low	30.4	Very low	204 Å²	204	140.9 Å²	140.9	77%	0.77	75%	0.75	S	S	*	*			cis	-151.8	171.5	-8.8	-131.6	-176.3	178.6	-152.6	3.1	111.7
90	R	31.6	Very low	30.4	Very low	186 Å²	186	146 Å²	146	70%	0.702	75%	0.749	S	S	*	*			trans	-45.6	175.1	173.9	-52	172.8	162.4	-168.9	-4.8	117.1
91	E	31.3	Very low	30.4	Very low	139 Å²	139	147.8 Å²	147.8	65%	0.65	75%	0.751	S	S	*	*			cis	-157.2	161.9	45.8	-75.3	-160.6	167.2	0	0	118.2
92	H	32.5	Very low	30.4	Very low	122 Å²	122	147 Å²	147	57%	0.565	75%	0.745	S	S	*	*			trans	17.7	151.8	138.7	-57.3	-48.8	0	0	0	121.2
93	R	31.1	Very low	30.7	Very low	222 Å²	222	149.1 Å²	149.1	84%	0.838	75%	0.748	S	S	*	*			cis	-172.1	176.8	15.5	-108	157.1	-171.4	171.7	1.8	107.7
94	S	28.7	Very low	31.3	Very low	95 Å²	95	149.8 Å²	149.8	66%	0.664	75%	0.75	S	S	*	*			cis	-179.6	148.1	-37.6	58.1	0	0	0	0	113.6
95	S	33.2	Very low	31.1	Very low	114 Å²	114	148 Å²	148	80%	0.797	75%	0.747	S	S	*	*			trans	91.4	138.5	151.7	84.4	0	0	0	0	124.6
96	R	29.8	Very low	31	Very low	230 Å²	230	149.1 Å²	149.1	87%	0.868	75%	0.75	S	S	*	*			trans	74.2	96	142.2	-87	-178.3	168.6	166.7	-3.4	125.7
97	S	31.7	Very low	30.8	Very low	94 Å²	94	149.9 Å²	149.9	66%	0.657	75%	0.754	S	S	*	*				71.7	141.2	109.3	72.5	0	0	0	0	125.9
98	K	33.1	Very low	30.7	Very low	212 Å²	212	147 Å²	147	92%	0.922	75%	0.752	S	S	*	*			trans	65.3	131.5	162	-62.3	178.8	178.1	-179.7	0	116.5
99	G	27.5	Very low	30.6	Very low	72 Å²	72	140.2 Å²	140.2	74%	0.742	74%	0.736	S	S	*	*			cis	139.6	154	17.1	0	0	0	0	0	110.2
100	R	28.9	Very low	30.6	Very low	243 Å²	243	138.6 Å²	138.6	92%	0.917	74%	0.735	S	S	*	*			trans	77.2	116.3	168.4	-67.2	-169.8	171.6	-151	-2.7	121.4
101	S	27.3	Very low	30.4	Very low	102 Å²	102	136.8 Å²	136.8	71%	0.713	74%	0.736	S	S	*	*			trans	31.8	128.8	134.6	61.3	0	0	0	0	122.4
102	S	27.2	Very low	30.4	Very low	118 Å²	118	140.3 Å²	140.3	83%	0.825	74%	0.743	S	S	*	*				176.2	150.4	105.5	-84.1	0	0	0	0	112.8
103	S	33.2	Very low	30.3	Very low	115 Å²	115	146.2 Å²	146.2	80%	0.804	76%	0.761	S	S	*	*			trans	-90.1	160.7	157.3	-49	0	0	0	0	108.8
104	P	41.8	Very low	30.2	Very low	113 Å²	113	147.6 Å²	147.6	73%	0.734	77%	0.766	S	S	*	*				-154.2	174.1	80	42.7	-23.3	0	0	0	117.5
105	D	27	Very low	30.2	Very low	146 Å²	146	146.4 Å²	146.4	78%	0.781	77%	0.768	S	S	*	*			trans	31.3	128.3	145.3	-80.4	-71.6	0	0	0	126.5
106	S	28.5	Very low	30.2	Very low	102 Å²	102	149.3 Å²	149.3	71%	0.713	77%	0.767	S	S	*	*				90	147.7	121.3	75.5	0	0	0	0	123.2
107	D	27.9	Very low	30.3	Very low	137 Å²	137	145.2 Å²	145.2	73%	0.733	76%	0.758	S	S	*	*			trans	68.3	152.5	151.4	-112.8	18.3	0	0	0	119.5
108	N	28.4	Very low	30.4	Very low	113 Å²	113	147.2 Å²	147.2	60%	0.604	77%	0.766	S	S	*	*			cis	-158.2	155.7	-10.2	-151	-27.5	0	0	0	113.4
109	S	29.9	Very low	30.5	Very low	66 Å²	66	142.1 Å²	142.1	46%	0.462	75%	0.745	S	S	.	*			trans	83.7	137.8	132.1	82.8	0	0	0	0	125.1
110	K	31.4	Very low	30.7	Very low	170 Å²	170	147.8 Å²	147.8	74%	0.739	74%	0.744	S	S	*	*			trans	71.6	154.1	142.5	-65.8	153	-159.4	146.3	0	117.3
111	M	28.6	Very low	30.9	Very low	148 Å²	148	144.4 Å²	144.4	73%	0.729	73%	0.732	S	S	*	*			cis	-161.5	-176.8	-4.7	-118.7	-176.2	-165	0	0	108.7
112	R	30.6	Very low	31	Very low	213 Å²	213	149.2 Å²	149.2	80%	0.804	74%	0.74	S	S	*	*			cis	-153.6	103.8	3.8	-144	171.3	-161.6	-170.9	4.1	112.9
113	R	29.8	Very low	31	Very low	245 Å²	245	146.8 Å²	146.8	93%	0.925	73%	0.733	S	S	*	*			trans	16.1	133.9	151.4	-59.1	174.6	175.2	176	-3.2	123
114	R	29.6	Very low	30.7	Very low	251 Å²	251	152 Å²	152	95%	0.947	74%	0.735	S	S	*	*				-158.4	143.2	126.3	-105.8	-178.6	173.9	-170.2	-2.7	107.2
115	G	29.5	Very low	30.1	Very low	70 Å²	70	150.6 Å²	150.6	72%	0.722	73%	0.728	S	S	*	*			cis	101.1	116.5	12.3	0	0	0	0	0	109.9
116	K	33.4	Very low	30.2	Very low	176 Å²	176	150.7 Å²	150.7	77%	0.765	72%	0.724	S	S	*	*			cis	-145	145	25	-109.7	-175.4	176.3	-114.5	0	111
117	E	32	Very low	30.1	Very low	144 Å²	144	151.8 Å²	151.8	67%	0.673	73%	0.731	S	S	*	*				65.6	140.3	98.2	-75.1	177.7	178.3	0	0	116.3
118	T	33.5	Very low	29.9	Very low	135 Å²	135	148.1 Å²	148.1	83%	0.828	73%	0.726	S	S	*	*			cis	-121.3	-113.8	38.1	63.6	0	0	0	0	118
119	E	34.2	Very low	29.8	Very low	105 Å²	105	149.2 Å²	149.2	49%	0.491	74%	0.742	S	S	.	*			trans	-148.1	-166.1	-168.9	-105.8	-160.6	93	0	0	108.2	R121	E119-R121 WeakPolarHBondContact OE1-CG 3.45Å; E119-R121 IonicContact OE1-CZ 3.05Å; E119-R121 IonicContact OE1-NE 2.55Å; E119-R121 PolarHBondContact OE1-NE 3.34Å; E119-R121 IonicContact OE1-NH2 3.62Å; E119-R121 PolarHBondContact OE1-NH2 3.31Å; E119-R121 IonicContact OE2-CZ 3.14Å; E119-R121 IonicContact OE2-NE 3.28Å; E119-R121 IonicContact OE2-NH2 2.82Å; E119-R121 PolarHBondContact OE2-NH2 3.38Å
120	R	32	Very low	29.5	Very low	191 Å²	191	149 Å²	149	72%	0.721	75%	0.75	S	S	*	*			cis	-156.5	151.7	20.6	-118.1	112.5	-147	-152.1	14.2	107.4
121	R	32.4	Very low	29.2	Very low	173 Å²	173	146.3 Å²	146.3	65%	0.653	75%	0.753	S	S	*	*			cis	-151.2	-85	-6.9	-151.8	160.8	-133.5	-162.4	2	116.3	E119	E119-R121 WeakPolarHBondContact OE1-CG 3.45Å; E119-R121 IonicContact OE1-CZ 3.05Å; E119-R121 IonicContact OE1-NE 2.55Å; E119-R121 PolarHBondContact OE1-NE 3.34Å; E119-R121 IonicContact OE1-NH2 3.62Å; E119-R121 PolarHBondContact OE1-NH2 3.31Å; E119-R121 IonicContact OE2-CZ 3.14Å; E119-R121 IonicContact OE2-NE 3.28Å; E119-R121 IonicContact OE2-NH2 2.82Å; E119-R121 PolarHBondContact OE2-NH2 3.38Å
122	K	29.9	Very low	29.1	Very low	203 Å²	203	144.7 Å²	144.7	88%	0.883	76%	0.756	S	S	*	*			trans	-167.3	165.8	-156.9	-73.9	-175.4	-179	179.2	0	109.7
123	G	27.1	Very low	29	Very low	66 Å²	66	139.8 Å²	139.8	68%	0.68	75%	0.754	S	S	*	*			cis	-150.9	169.4	2	0	0	0	0	0	111.2
124	R	28.1	Very low	28.9	Very low	225 Å²	225	132 Å²	132	85%	0.849	75%	0.75	S	S	*	*				62.8	131.9	69.8	-127.8	-159.6	-175.4	-157.3	2.3	112
125	S	28.2	Very low	28.8	Very low	83 Å²	83	125.1 Å²	125.1	58%	0.58	74%	0.741	S	S	*	*			cis	-152.6	143.4	20.3	-36.6	0	0	0	0	111
126	Q	29.9	Very low	28.7	Very low	149 Å²	149	126.2 Å²	126.2	70%	0.696	74%	0.737	S	S	*	*				76.9	142.2	103.1	-72.7	-177.9	-92.2	0	0	119.2
127	S	25.6	Very low	28.5	Very low	124 Å²	124	123.7 Å²	123.7	87%	0.867	73%	0.732	S	S	*	*			trans	62.1	146.8	157.2	44.5	0	0	0	0	119.6
128	G	24.5	Very low	28.3	Very low	60 Å²	60	127.3 Å²	127.3	62%	0.619	74%	0.74	S	S	*	*			cis	158.4	154.1	-6.8	0	0	0	0	0	112.8
129	S	25	Very low	28	Very low	137 Å²	137	127.2 Å²	127.2	96%	0.958	73%	0.73	S	S	*	*			trans	59.1	153.8	-179.3	53.3	0	0	0	0	116.8
130	G	24.7	Very low	27.7	Very low	61 Å²	61	131.5 Å²	131.5	63%	0.629	74%	0.742	S	S	*	*			cis	179	165.6	-10.5	0	0	0	0	0	114.6
131	S	25.1	Very low	27.5	Very low	114 Å²	114	131.9 Å²	131.9	80%	0.797	74%	0.743	S	S	*	*			trans	60.8	140.7	148.4	55.9	0	0	0	0	123.1
132	S	26.9	Very low	27.2	Very low	114 Å²	114	133.9 Å²	133.9	80%	0.797	75%	0.751	S	S	*	*			trans	70.9	151.3	158.1	76.8	0	0	0	0	118.1
133	S	27.4	Very low	27.1	Very low	109 Å²	109	135.2 Å²	135.2	76%	0.762	75%	0.75	S	S	*	*			cis	-170.2	139.7	-24.4	48.8	0	0	0	0	111.2
134	G	27.3	Very low	27.3	Very low	81 Å²	81	143.8 Å²	143.8	84%	0.835	76%	0.762	S	S	*	*			trans	66.7	174.2	169.2	0	0	0	0	0	115.9
135	S	27.4	Very low	27.2	Very low	108 Å²	108	142.7 Å²	142.7	76%	0.755	76%	0.763	S	S	*	*			cis	-166.2	151.1	-26.2	-176.9	0	0	0	0	108.8
136	S	28.7	Very low	27.6	Very low	92 Å²	92	144 Å²	144	64%	0.643	77%	0.772	S	S	*	*			trans	42.1	110.4	149.8	57	0	0	0	0	121.3
137	D	28.5	Very low	28.2	Very low	124 Å²	124	142.9 Å²	142.9	66%	0.663	78%	0.778	S	S	*	*				61.3	117.4	126.8	-77.4	-75.5	0	0	0	124.4
138	R	27	Very low	28.3	Very low	220 Å²	220	144.9 Å²	144.9	83%	0.83	77%	0.774	S	S	*	*				77.5	148.8	120.8	-76.6	176	-162	-164.8	-2	124.2
139	E	28.7	Very low	28.5	Very low	133 Å²	133	153.4 Å²	153.4	62%	0.621	79%	0.787	S	S	*	*			trans	66.9	101.6	152.6	-70.4	-137.4	104.4	0	0	121.5
140	R	26.9	Very low	28.6	Very low	194 Å²	194	150.7 Å²	150.7	73%	0.732	78%	0.78	S	S	*	*				42.3	103.7	106.4	-72.9	164.3	149.2	-171.6	2.6	116.8
141	R	27.3	Very low	28.9	Very low	200 Å²	200	153.2 Å²	153.2	76%	0.755	79%	0.789	S	S	*	*				170.2	128.4	98.5	-93.4	152.6	-179	-160.3	3.3	115
142	R	27.6	Very low	29.8	Very low	215 Å²	215	154.3 Å²	154.3	81%	0.811	79%	0.793	S	S	*	*				56.6	140	128.5	-65	178.7	168.5	179.3	-4.5	121.7
143	R	27.7	Very low	30	Very low	231 Å²	231	153.2 Å²	153.2	87%	0.872	79%	0.791	S	S	*	*			trans	91.2	112.8	148.5	-77.3	174.3	175.1	-155.6	-1.8	119.5
144	R	30.4	Very low	30.3	Very low	246 Å²	246	160.1 Å²	160.1	93%	0.928	80%	0.8	S	S	*	*				5.6	133.4	122.3	-54.9	177.4	179	-174	-2.2	114.1
145	K	26.9	Very low	30.3	Very low	201 Å²	201	159.8 Å²	159.8	87%	0.874	80%	0.797	S	S	*	*				-174	145.3	69.4	-174.1	179.9	179.7	-171.4	0	110.4
146	S	36.6	Very low	30.5	Very low	110 Å²	110	165.2 Å²	165.2	77%	0.769	80%	0.8	S	S	*	*			trans	-75.9	160.1	-180	-31.1	0	0	0	0	114.2
147	P	41.5	Very low	30.6	Very low	126 Å²	126	168.1 Å²	168.1	82%	0.818	80%	0.804	S	S	*	*			trans	-123.1	166.4	139	37.4	-28.7	0	0	0	112.8
148	E	27.9	Very low	30.7	Very low	166 Å²	166	168.8 Å²	168.8	78%	0.776	81%	0.813	S	S	*	*			trans	-90.5	155.4	174.6	-61.6	-178.5	156.2	0	0	112.6
149	R	28.6	Very low	30.9	Very low	240 Å²	240	169.4 Å²	169.4	91%	0.906	82%	0.815	S	S	*	*				164.3	155.5	104.2	-90	-170.7	172.9	-167.7	-3.7	112.1
150	G	27.3	Very low	31.1	Very low	79 Å²	79	169 Å²	169	81%	0.814	82%	0.817	S	S	*	*			trans	125.8	89.8	160.5	0	0	0	0	0	115.4
151	S	31.5	Very low	31.5	Very low	115 Å²	115	167 Å²	167	80%	0.804	82%	0.816	S	S	*	*			trans	-121.2	153.8	158.4	-50.3	0	0	0	0	108.4
152	P	43.2	Very low	31.7	Very low	137 Å²	137	163 Å²	163	89%	0.89	81%	0.806	S	S	*	*				-132.1	175.4	110.1	37.3	-29.4	0	0	0	112.8
153	A	31.8	Very low	31.7	Very low	90 Å²	90	161.5 Å²	161.5	74%	0.744	80%	0.8	S	S	*	*			trans	-146.8	162.1	-170	0	0	0	0	0	113.1
154	R	33.3	Very low	31.8	Very low	255 Å²	255	159.8 Å²	159.8	96%	0.962	80%	0.799	S	S	*	*			trans	175.9	149.6	147.3	-95.8	152.2	-169.5	-147.8	3.6	108.7
155	G	26.5	Very low	31.7	Very low	74 Å²	74	153.2 Å²	153.2	76%	0.763	79%	0.791	S	S	*	*			cis	-162.2	-160	-4.8	0	0	0	0	0	108.6
156	R	33.5	Very low	31.7	Very low	221 Å²	221	150.6 Å²	150.6	83%	0.834	79%	0.786	S	S	*	*			cis	-163.1	174.8	-6.6	-159.5	-167.8	-177.6	-156.5	4.6	107.8
157	E	30.5	Very low	31.5	Very low	153 Å²	153	156.6 Å²	156.6	72%	0.715	79%	0.792	S	S	*	*			trans	82.6	136.5	165	-59	178.8	-179.4	0	0	115.8
158	T	30	Very low	31	Very low	138 Å²	138	156 Å²	156	85%	0.847	79%	0.791	S	S	*	*			cis	-147.3	173.3	-0.2	-7.1	0	0	0	0	113.2
159	R	31.4	Very low	31.2	Very low	234 Å²	234	159 Å²	159	88%	0.883	80%	0.795	S	S	*	*			trans	-95.1	173.9	179.5	-87	-178.5	163.1	169.3	-6.2	112.4
160	D	33.6	Very low	31.3	Very low	124 Å²	124	153.5 Å²	153.5	66%	0.663	78%	0.78	S	S	*	*			cis	174.5	167.6	-25.9	-166.9	-2.7	0	0	0	108.2
161	Q	34.1	Very low	31.5	Very low	152 Å²	152	159.4 Å²	159.4	71%	0.71	78%	0.778	S	S	*	*			trans	70.9	156.5	164.3	-60.5	-172	-2.7	0	0	119.3
162	E	31.2	Very low	31.6	Very low	117 Å²	117	162.9 Å²	162.9	55%	0.547	78%	0.778	S	S	.	*			cis	-162.7	159.8	-9.6	-117.2	-164.8	158.6	0	0	116.1
163	R	28.2	Very low	31	Very low	183 Å²	183	166 Å²	166	69%	0.691	78%	0.778	S	S	*	*			trans	58.7	121.1	143.5	-68.7	177.5	-168.9	168.2	24.6	127.9
164	K	30.1	Very low	30.8	Very low	194 Å²	194	171.7 Å²	171.7	84%	0.843	78%	0.78	S	S	*	*				73.9	169.9	123.6	-67.3	-174.3	175.9	-176.8	0	123.9
165	S	27.2	Very low	30.7	Very low	109 Å²	109	163 Å²	163	76%	0.762	76%	0.759	S	S	*	*			trans	87.6	143.9	170.5	-165.9	0	0	0	0	116.3
166	D	28.9	Very low	31	Very low	145 Å²	145	167.8 Å²	167.8	78%	0.775	76%	0.761	S	S	*	*			cis	-155	-164.7	-8.4	-128.6	-68.5	0	0	0	116.6
167	R	31.7	Very low	30.9	Very low	237 Å²	237	162.3 Å²	162.3	89%	0.894	75%	0.748	S	S	*	*			trans	-123.2	138.5	-177.2	-69.3	170.7	160.6	176.4	-4.7	117.1
168	S	30.1	Very low	30.9	Very low	113 Å²	113	164.2 Å²	164.2	79%	0.79	75%	0.749	S	S	*	*			trans	-166.5	142.3	152.8	52.5	0	0	0	0	110.2
169	R	31.8	Very low	31.1	Very low	228 Å²	228	163.4 Å²	163.4	86%	0.86	74%	0.735	S	S	*	*				59.5	130.7	56.8	-68	-173.8	173.5	158.4	-4.1	113
170	E	32.5	Very low	31	Very low	125 Å²	125	163.1 Å²	163.1	58%	0.584	73%	0.734	S	S	*	*			cis	-158.4	-157.9	-5.2	-105.4	-170.9	73.7	0	0	108.1
171	R	30.1	Very low	30.8	Very low	203 Å²	203	161.1 Å²	161.1	77%	0.766	74%	0.743	S	S	*	*			cis	-159.8	142	11.2	-162.5	153.3	-82.8	159.3	-2.8	114.6
172	K	33.6	Very low	30.5	Very low	189 Å²	189	165.8 Å²	165.8	82%	0.822	75%	0.754	S	S	*	*			trans	-28.4	151.4	163.1	-71.9	172.3	168.3	177.4	0	122.7
173	K	30.9	Very low	30.4	Very low	202 Å²	202	165.8 Å²	165.8	88%	0.878	77%	0.767	S	S	*	*			trans	162.4	156.3	130.8	-93.6	172	-179.3	-179.3	0	111.8
174	R	26.8	Very low	30.7	Very low	210 Å²	210	166.5 Å²	166.5	79%	0.792	78%	0.775	S	S	*	*			cis	-169.5	156.3	-16	-164.7	-161.1	171.4	174.4	-2.3	111
175	S	32	Very low	30.6	Very low	73 Å²	73	166.5 Å²	166.5	51%	0.51	78%	0.775	S	S	.	*			trans	56.1	114.8	146.6	48.3	0	0	0	0	122
176	E	33.5	Very low	30.7	Very low	173 Å²	173	166.1 Å²	166.1	81%	0.808	77%	0.772	S	S	*	*				100.1	154.1	93.8	-75.1	161.2	152.4	0	0	111.2
177	D	31.3	Very low	31.3	Very low	106 Å²	106	168.6 Å²	168.6	57%	0.567	78%	0.776	S	S	*	*			cis	-159.2	164.4	22	-162.3	14.5	0	0	0	114.7
178	R	31.1	Very low	31.2	Very low	194 Å²	194	166.4 Å²	166.4	73%	0.732	78%	0.776	S	S	*	*			trans	51.4	152.2	151.4	-86.3	174.2	-178.9	114.1	-2.6	123.8
179	E	33.8	Very low	31.4	Very low	120 Å²	120	172.5 Å²	172.5	56%	0.561	78%	0.782	S	S	*	*			cis	-165.8	169.9	-15	-145.3	178	-105.7	0	0	113.3
180	R	29	Very low	31.5	Very low	229 Å²	229	169.2 Å²	169.2	86%	0.864	78%	0.781	S	S	*	*			trans	81.4	135.7	155.6	-67.3	172.2	-166	-159.1	-1.5	122.6
181	G	28.6	Very low	31.5	Very low	81 Å²	81	168.5 Å²	168.5	84%	0.835	78%	0.781	S	S	*	*			trans	152.8	74.2	159.5	0	0	0	0	0	118.6
182	R	28.5	Very low	31.7	Very low	250 Å²	250	170.6 Å²	170.6	94%	0.943	79%	0.789	S	S	*	*			trans	-77.5	166.4	161.3	-67.4	175.1	165.9	175.1	-4.7	109.2
183	S	29.4	Very low	31.7	Very low	117 Å²	117	172 Å²	172	82%	0.818	79%	0.789	S	S	*	*			cis	-154.9	-148.5	24	78.2	0	0	0	0	114.5
184	K	33.8	Very low	31.9	Very low	199 Å²	199	174.5 Å²	174.5	87%	0.865	79%	0.793	S	S	*	*			trans	-107.4	165.1	-169.6	-48.7	171.1	-178	176.3	0	111.8
185	K	27.3	Very low	32.2	Very low	193 Å²	193	168.3 Å²	168.3	84%	0.839	80%	0.795	S	S	*	*				164.2	141.6	113.4	-177.6	172.1	173.5	-170.7	0	115.7
186	S	30.9	Very low	32.4	Very low	101 Å²	101	176.9 Å²	176.9	71%	0.706	82%	0.816	S	S	*	*			trans	44.2	152.3	157.3	72.5	0	0	0	0	125.4
187	K	40.5	Very low	32.5	Very low	198 Å²	198	180.4 Å²	180.4	86%	0.861	82%	0.822	S	S	*	*			trans	-62.4	162.8	157.1	-50.9	167.4	-179.6	172.3	0	111.1
188	E	29.8	Very low	32.6	Very low	191 Å²	191	178.1 Å²	178.1	89%	0.893	82%	0.824	S	S	*	*			trans	-146.8	159.5	139	-157.6	132.7	-116.6	0	0	110.1
189	R	35.2	Very low	32.8	Very low	241 Å²	241	174.5 Å²	174.5	91%	0.909	83%	0.828	S	S	*	*			trans	-118.8	144.2	164.8	-76.5	177.8	170.7	176.8	-4.3	106.3
190	D	32.6	Very low	32.8	Very low	159 Å²	159	173.9 Å²	173.9	85%	0.85	84%	0.837	S	S	*	*			trans	-150.5	160.1	147.3	-151.7	-1.2	0	0	0	112.4
191	D	33.6	Very low	33	Very low	109 Å²	109	167.6 Å²	167.6	58%	0.583	83%	0.834	S	S	*	*			trans	-75.2	158.2	-176.4	-106.5	-36.9	0	0	0	113.3
192	R	34.7	Very low	33.1	Very low	247 Å²	247	168.8 Å²	168.8	93%	0.932	83%	0.829	S	S	*	*			trans	-155.5	109.6	139.9	-109.8	150.8	-144	-139.2	2	112.3
193	R	32.9	Very low	33.3	Very low	219 Å²	219	164 Å²	164	83%	0.826	82%	0.823	S	S	*	*			trans	-74.1	135.3	-178.9	-56.8	174.7	-179.8	-169.5	-1.5	111.8
194	R	35.7	Very low	33.3	Very low	255 Å²	255	163 Å²	163	96%	0.962	82%	0.815	S	S	*	*			trans	-167.3	124.6	147.8	-100.4	167.5	-166.3	-161.1	3.2	106.7
195	G	31.6	Very low	33.4	Very low	80 Å²	80	158 Å²	158	83%	0.825	81%	0.806	S	S	*	*			cis	141.3	91	0.7	0	0	0	0	0	109.9
196	R	35.9	Very low	33.8	Very low	252 Å²	252	157 Å²	157	95%	0.951	80%	0.804	S	S	*	*			trans	-135.8	98	177.2	-142.4	173.8	-163	-110	1.1	110.9
197	R	37.2	Very low	34.3	Very low	247 Å²	247	157 Å²	157	93%	0.932	80%	0.804	S	S	*	*			trans	-74.7	160.3	157.3	-62.5	177.3	175.5	-174.5	-3.1	108
198	G	33.3	Very low	34.7	Very low	59 Å²	59	153 Å²	153	61%	0.608	80%	0.801	S	S	*	*			cis	-140.7	172.4	-6	0	0	0	0	0	110.2
199	S	34.6	Very low	35.4	Very low	118 Å²	118	149.2 Å²	149.2	83%	0.825	79%	0.787	S	S	*	*				82	132.3	79.4	68.9	0	0	0	0	113.3
200	S	33.6	Very low	36.2	Very low	106 Å²	106	142.5 Å²	142.5	74%	0.741	78%	0.777	S	S	*	*			cis	-177.8	143.1	-5.6	40.9	0	0	0	0	111.1
201	A	32.8	Very low	37.1	Very low	98 Å²	98	140.8 Å²	140.8	81%	0.81	77%	0.767	S	S	*	*			trans	61.5	165.4	164.2	0	0	0	0	0	115.9
202	S	31.6	Very low	38	Very low	105 Å²	105	140 Å²	140	73%	0.734	76%	0.763	S	S	*	*			cis	-150.3	158.4	0.4	-5.4	0	0	0	0	109.9
203	D	31.9	Very low	38.8	Very low	150 Å²	150	134.8 Å²	134.8	80%	0.802	75%	0.749	S	S	*	*			trans	35.5	138.1	132.2	-112.9	-31.6	0	0	0	120.5
204	S	30.5	Very low	39.8	Very low	95 Å²	95	128 Å²	128	66%	0.664	73%	0.73	S	S	*	*			cis	-147.2	-153.5	17.8	-62.6	0	0	0	0	113
205	S	35.3	Very low	40.8	Very low	95 Å²	95	121.2 Å²	121.2	66%	0.664	71%	0.712	S	S	*	*			trans	-51.9	172.6	172.8	57.2	0	0	0	0	115.1
206	E	34.7	Very low	42	Very low	172 Å²	172	122 Å²	122	80%	0.804	69%	0.694	S	S	*	*			cis	-153.2	171.8	24.5	37.6	-126	55.8	0	0	115.7
207	S	42.3	Very low	43.4	Very low	102 Å²	102	113.5 Å²	113.5	71%	0.713	67%	0.67	S	S	*	*			trans	-46.8	128.9	177.4	171.4	0	0	0	0	116.7
208	S	48.2	Very low	44.7	Very low	112 Å²	112	106.9 Å²	106.9	78%	0.783	65%	0.648	S	S	*	*				176.9	94.5	121.2	-76.1	0	0	0	0	113.3
209	D	46.1	Very low	46.3	Very low	113 Å²	113	108.5 Å²	108.5	60%	0.604	64%	0.64	S	S	*	*			trans	-155.2	32.4	164.8	-142	-37.8	0	0	0	113.6	D211 N212	D209-D211 VanDerWaalsContact C-N 3.33Å; D209-D211 PolarHBondContact O-N 3.38Å; D209-N212 WeakPolarHBondContact OD1-CB 3.45Å; D209-N212 PolarHBondContact OD1-ND2 2.9Å
210	S	50.6	Low	47.8	Very low	99 Å²	99	107.4 Å²	107.4	69%	0.692	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-17	-174.3	-58.2	0	0	0	0	114.6
211	D	51.3	Low	49.5	Very low	123 Å²	123	106.2 Å²	106.2	66%	0.658	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-24.8	-174.1	-71	-63.9	0	0	0	113.7	D209 N214 L215	D209-D211 VanDerWaalsContact C-N 3.33Å; D209-D211 PolarHBondContact O-N 3.38Å; D211-N214 PolarHBondContact O-N 3.31Å; D211-L215 WeakPolarHBondContact O-CG 3.33Å; D211-L215 PolarHBondContact O-N 2.76Å
212	N	53.2	Low	51.3	Low	93 Å²	93	106.8 Å²	106.8	50%	0.497	59%	0.589	S	S	.	*	H	α-helix	trans	-76.2	-46.8	-171.3	-161.1	5.1	0	0	0	112.5	D209 N214 L215 E216	D209-N212 WeakPolarHBondContact OD1-CB 3.45Å; D209-N212 PolarHBondContact OD1-ND2 2.9Å; N212-N214 PolarHBondContact O-N 3.04Å; N212-L215 PolarHBondContact O-N 3.28Å; N212-E216 PolarHBondContact O-N 2.88Å
213	E	51.8	Low	53.2	Low	137 Å²	137	107.8 Å²	107.8	64%	0.64	58%	0.576	S	S	*	*	H	α-helix	trans	-53.9	-41.9	168.8	-87	-79.4	150.3	0	0	111.5	L215 E216 V217	E213-L215 PolarHBondContact O-N 3.02Å; E213-E216 PolarHBondContact O-N 3.21Å; E213-V217 WeakPolarHBondContact O-CB 3.44Å; E213-V217 VanDerWaalsContact O-CG2 3.31Å; E213-V217 WeakPolarHBondContact O-CG2 3.38Å; E213-V217 PolarHBondContact O-N 3Å
214	N	54.5	Low	55.1	Low	77 Å²	77	106.2 Å²	106.2	41%	0.412	56%	0.563	S	S	.	*	H	α-helix	trans	-68.7	-35.1	-178.4	-158.5	-11.4	0	0	0	111.8	D211 N212 K218	D211-N214 PolarHBondContact O-N 3.31Å; N212-N214 PolarHBondContact O-N 3.04Å; N214-K218 WeakPolarHBondContact O-CB 3.44Å; N214-K218 WeakPolarHBondContact O-CD 3.37Å; N214-K218 VanDerWaalsContact O-CG 3.25Å; N214-K218 WeakPolarHBondContact O-CG 3.38Å; N214-K218 PolarHBondContact O-N 3.38Å; N214-K218 VanDerWaalsContact OD1-CE 3.32Å; N214-K218 WeakPolarHBondContact OD1-CE 3.49Å
215	L	55.9	Low	57.2	Low	112 Å²	112	107.5 Å²	107.5	59%	0.586	56%	0.556	S	S	*	*	H	α-helix	trans	-68.4	-46.7	171.6	-73.4	168.8	0	0	0	112.1	D211 N212 E213 V217 K218 E219	D211-L215 WeakPolarHBondContact O-CG 3.33Å; D211-L215 PolarHBondContact O-N 2.76Å; N212-L215 PolarHBondContact O-N 3.28Å; E213-L215 PolarHBondContact O-N 3.02Å; L215-V217 VanDerWaalsContact C-N 3.31Å; L215-V217 PolarHBondContact O-N 3.43Å; L215-K218 PolarHBondContact O-N 2.89Å; L215-E219 PolarHBondContact O-N 3.25Å
216	E	56.8	Low	58.7	Low	96 Å²	96	108.4 Å²	108.4	45%	0.449	55%	0.55	S	S	.	.	H	α-helix	trans	-59.6	-40.5	175.4	-92	-136.3	143.4	0	0	111.9	N212 E213 K220	N212-E216 PolarHBondContact O-N 2.88Å; E213-E216 PolarHBondContact O-N 3.21Å; E216-K220 WeakPolarHBondContact O-CB 3.2Å; E216-K220 WeakPolarHBondContact O-CD 3.33Å; E216-K220 WeakPolarHBondContact O-CG 3.4Å; E216-K220 PolarHBondContact O-N 2.96Å; E216-K220 WeakPolarHBondContact OE2-CE 3.29Å; E216-K220 IonicContact OE2-NZ 2.73Å; E216-K220 PolarHBondContact OE2-NZ 3.47Å
217	V	65.1	Low	60.4	Low	74 Å²	74	106.3 Å²	106.3	45%	0.448	54%	0.538	S	S	.	.	H	α-helix	trans	-66.2	-43	176.8	170.8	0	0	0	0	111.3	E213 L215 K220 E221	E213-V217 WeakPolarHBondContact O-CB 3.44Å; E213-V217 VanDerWaalsContact O-CG2 3.31Å; E213-V217 WeakPolarHBondContact O-CG2 3.38Å; E213-V217 PolarHBondContact O-N 3Å; L215-V217 VanDerWaalsContact C-N 3.31Å; L215-V217 PolarHBondContact O-N 3.43Å; V217-K220 PolarHBondContact O-N 2.95Å; V217-E221 WeakPolarHBondContact O-CB 3.39Å; V217-E221 WeakPolarHBondContact O-CG 3.29Å; V217-E221 PolarHBondContact O-N 2.99Å
218	K	65.3	Low	61.8	Low	108 Å²	108	106.8 Å²	106.8	47%	0.47	53%	0.529	S	S	.	.	H	α-helix	trans	-62.9	-44.8	174.4	-76.3	168.8	-176.7	168.9	0	112.4	N214 L215 K220 E221 E222	N214-K218 WeakPolarHBondContact O-CB 3.44Å; N214-K218 WeakPolarHBondContact O-CD 3.37Å; N214-K218 VanDerWaalsContact O-CG 3.25Å; N214-K218 WeakPolarHBondContact O-CG 3.38Å; N214-K218 PolarHBondContact O-N 3.38Å; N214-K218 VanDerWaalsContact OD1-CE 3.32Å; N214-K218 WeakPolarHBondContact OD1-CE 3.49Å; L215-K218 PolarHBondContact O-N 2.89Å; K218-K220 VanDerWaalsContact C-N 3.32Å; K218-K220 PolarHBondContact O-N 3.43Å; K218-E221 CarbonylContact O-C 3.59Å; K218-E221 WeakPolarHBondContact O-CA 3.49Å; K218-E221 WeakPolarHBondContact O-CB 3.31Å; K218-E221 PolarHBondContact O-N 3.19Å; K218-E221 VanDerWaalsContact O-N 3.11Å; K218-E222 WeakPolarHBondContact O-CG 3.24Å; K218-E222 PolarHBondContact O-N 2.73Å
219	E	65.2	Low	62.7	Low	93 Å²	93	106.7 Å²	106.7	44%	0.435	52%	0.519	S	S	.	.	H	α-helix	trans	-64.1	-38.3	177.6	-160.8	-140.6	123.2	0	0	111.3	L215 E222 R223	L215-E219 PolarHBondContact O-N 3.25Å; E219-E222 PolarHBondContact O-N 3.45Å; E219-R223 VanDerWaalsContact O-CB 3.23Å; E219-R223 WeakPolarHBondContact O-CB 3.48Å; E219-R223 VanDerWaalsContact O-CG 3.32Å; E219-R223 WeakPolarHBondContact O-CG 3.47Å; E219-R223 PolarHBondContact O-N 2.9Å; E219-R223 WeakPolarHBondContact OE1-CD 3.27Å; E219-R223 IonicContact OE1-CZ 2.59Å; E219-R223 IonicContact OE1-NE 2.82Å; E219-R223 PolarHBondContact OE1-NE 3.49Å; E219-R223 IonicContact OE1-NH1 3.16Å; E219-R223 PolarHBondContact OE1-NH1 3.4Å
220	K	67.3	Low	63.5	Low	96 Å²	96	107.8 Å²	107.8	42%	0.417	52%	0.522	S	S	.	.	H	α-helix	trans	-66.4	-34	173.2	-69.8	161.2	-162.7	166.9	0	112.2	E216 V217 K218 K224	E216-K220 WeakPolarHBondContact O-CB 3.2Å; E216-K220 WeakPolarHBondContact O-CD 3.33Å; E216-K220 WeakPolarHBondContact O-CG 3.4Å; E216-K220 PolarHBondContact O-N 2.96Å; E216-K220 WeakPolarHBondContact OE2-CE 3.29Å; E216-K220 IonicContact OE2-NZ 2.73Å; E216-K220 PolarHBondContact OE2-NZ 3.47Å; V217-K220 PolarHBondContact O-N 2.95Å; K218-K220 VanDerWaalsContact C-N 3.32Å; K218-K220 PolarHBondContact O-N 3.43Å; K220-K224 VanDerWaalsContact O-CG 3.24Å; K220-K224 WeakPolarHBondContact O-CG 3.34Å; K220-K224 PolarHBondContact O-N 2.87Å
221	E	68.7	Low	64.4	Low	81 Å²	81	107 Å²	107	38%	0.379	51%	0.506	S	S	.	.	H	α-helix	trans	-68.7	-49.5	171.9	-79.5	-104	123.7	0	0	112.2	V217 K218 R223 K224 K225	V217-E221 WeakPolarHBondContact O-CB 3.39Å; V217-E221 WeakPolarHBondContact O-CG 3.29Å; V217-E221 PolarHBondContact O-N 2.99Å; K218-E221 CarbonylContact O-C 3.59Å; K218-E221 WeakPolarHBondContact O-CA 3.49Å; K218-E221 WeakPolarHBondContact O-CB 3.31Å; K218-E221 PolarHBondContact O-N 3.19Å; K218-E221 VanDerWaalsContact O-N 3.11Å; E221-R223 PolarHBondContact O-N 3.27Å; E221-K224 CarbonylContact O-C 3.59Å; E221-K224 WeakPolarHBondContact O-CA 3.5Å; E221-K224 WeakPolarHBondContact O-CB 3.35Å; E221-K224 PolarHBondContact O-N 3.28Å; E221-K225 WeakPolarHBondContact O-CG 3.23Å; E221-K225 PolarHBondContact O-N 2.62Å; E221-K225 WeakPolarHBondContact OE2-CE 3.43Å; E221-K225 IonicContact OE2-NZ 2.68Å; E221-K225 PolarHBondContact OE2-NZ 3.22Å
222	E	70.7	Confident	65.2	Low	110 Å²	110	105.2 Å²	105.2	51%	0.514	51%	0.509	S	S	.	.	H	α-helix	trans	-63.8	-41.8	179.3	-72.4	-178	-175.5	0	0	111	K218 E219 K224 K225 Q226	K218-E222 WeakPolarHBondContact O-CG 3.24Å; K218-E222 PolarHBondContact O-N 2.73Å; E219-E222 PolarHBondContact O-N 3.45Å; E222-K224 PolarHBondContact O-N 3.04Å; E222-K225 PolarHBondContact O-N 3.26Å; E222-K225 VanDerWaalsContact O-N 3.17Å; E222-Q226 WeakPolarHBondContact O-CB 3.38Å; E222-Q226 VanDerWaalsContact O-CG 3.26Å; E222-Q226 WeakPolarHBondContact O-CG 3.37Å; E222-Q226 PolarHBondContact O-N 3.25Å
223	R	71	Confident	65.8	Low	125 Å²	125	106.9 Å²	106.9	47%	0.472	52%	0.517	S	S	.	.	H	α-helix	trans	-71.4	-7.5	171.9	-69.5	169.8	72.3	-162	7.1	113.7	E219 E221 K227	E219-R223 VanDerWaalsContact O-CB 3.23Å; E219-R223 WeakPolarHBondContact O-CB 3.48Å; E219-R223 VanDerWaalsContact O-CG 3.32Å; E219-R223 WeakPolarHBondContact O-CG 3.47Å; E219-R223 PolarHBondContact O-N 2.9Å; E219-R223 WeakPolarHBondContact OE1-CD 3.27Å; E219-R223 IonicContact OE1-CZ 2.59Å; E219-R223 IonicContact OE1-NE 2.82Å; E219-R223 PolarHBondContact OE1-NE 3.49Å; E219-R223 IonicContact OE1-NH1 3.16Å; E219-R223 PolarHBondContact OE1-NH1 3.4Å; E221-R223 PolarHBondContact O-N 3.27Å; R223-K227 VanDerWaalsContact O-CD 3.23Å; R223-K227 WeakPolarHBondContact O-CD 3.39Å; R223-K227 WeakPolarHBondContact O-CE 3.48Å; R223-K227 WeakPolarHBondContact O-CG 3.23Å; R223-K227 PolarHBondContact O-NZ 2.98Å
224	K	73.5	Confident	66.4	Low	118 Å²	118	101.2 Å²	101.2	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-83.6	-56.2	160	-69.9	161.2	-165.6	168	0	109	K220 E221 E222 Q226 K227 E228	K220-K224 VanDerWaalsContact O-CG 3.24Å; K220-K224 WeakPolarHBondContact O-CG 3.34Å; K220-K224 PolarHBondContact O-N 2.87Å; E221-K224 CarbonylContact O-C 3.59Å; E221-K224 WeakPolarHBondContact O-CA 3.5Å; E221-K224 WeakPolarHBondContact O-CB 3.35Å; E221-K224 PolarHBondContact O-N 3.28Å; E222-K224 PolarHBondContact O-N 3.04Å; K224-Q226 VanDerWaalsContact C-N 3.34Å; K224-Q226 PolarHBondContact O-N 2.81Å; K224-K227 CarbonylContact O-C 3.55Å; K224-K227 WeakPolarHBondContact O-CA 3.35Å; K224-K227 WeakPolarHBondContact O-CB 3.48Å; K224-K227 PolarHBondContact O-N 3.31Å; K224-E228 WeakPolarHBondContact O-CG 3.38Å; K224-E228 PolarHBondContact O-N 3Å
225	K	73.6	Confident	67.3	Low	121 Å²	121	101 Å²	101	53%	0.526	49%	0.492	S	S	.	.	H	α-helix	trans	-51.9	-47	-178.2	-68.9	162.6	-174.9	164.5	0	112.1	E221 E222 E228 L229	E221-K225 WeakPolarHBondContact O-CG 3.23Å; E221-K225 PolarHBondContact O-N 2.62Å; E221-K225 WeakPolarHBondContact OE2-CE 3.43Å; E221-K225 IonicContact OE2-NZ 2.68Å; E221-K225 PolarHBondContact OE2-NZ 3.22Å; E222-K225 PolarHBondContact O-N 3.26Å; E222-K225 VanDerWaalsContact O-N 3.17Å; K225-E228 PolarHBondContact O-N 3.01Å; K225-L229 WeakPolarHBondContact O-CB 3.5Å; K225-L229 PolarHBondContact O-N 2.78Å
226	Q	67	Low	67.7	Low	114 Å²	114	100.7 Å²	100.7	53%	0.533	50%	0.497	S	S	.	.	H	α-helix	trans	-59.8	-46.1	172.1	-70.3	170.7	-1.2	0	0	112.8	E222 K224 E228 L229 M230	E222-Q226 WeakPolarHBondContact O-CB 3.38Å; E222-Q226 VanDerWaalsContact O-CG 3.26Å; E222-Q226 WeakPolarHBondContact O-CG 3.37Å; E222-Q226 PolarHBondContact O-N 3.25Å; K224-Q226 VanDerWaalsContact C-N 3.34Å; K224-Q226 PolarHBondContact O-N 2.81Å; Q226-E228 PolarHBondContact O-N 3.49Å; Q226-L229 PolarHBondContact O-N 3.04Å; Q226-M230 WeakPolarHBondContact O-CB 3.41Å; Q226-M230 VanDerWaalsContact O-CG 3.24Å; Q226-M230 WeakPolarHBondContact O-CG 3.39Å; Q226-M230 PolarHBondContact O-N 2.99Å
227	K	70.1	Confident	67.7	Low	128 Å²	128	103.3 Å²	103.3	56%	0.557	51%	0.509	S	S	*	.	H	α-helix	trans	-67.2	-22.9	177.2	-73.1	-177.6	-164.6	102	0	112.8	R223 K224 K231	R223-K227 VanDerWaalsContact O-CD 3.23Å; R223-K227 WeakPolarHBondContact O-CD 3.39Å; R223-K227 WeakPolarHBondContact O-CE 3.48Å; R223-K227 WeakPolarHBondContact O-CG 3.23Å; R223-K227 PolarHBondContact O-NZ 2.98Å; K224-K227 CarbonylContact O-C 3.55Å; K224-K227 WeakPolarHBondContact O-CA 3.35Å; K224-K227 WeakPolarHBondContact O-CB 3.48Å; K224-K227 PolarHBondContact O-N 3.31Å; K227-K231 WeakPolarHBondContact O-CB 3.26Å; K227-K231 PolarHBondContact O-N 2.97Å
228	E	71.4	Confident	67.9	Low	112 Å²	112	105 Å²	105	52%	0.523	51%	0.512	S	S	.	.	H	α-helix	trans	-86.3	-38.1	175.9	-61.1	-147.4	113.6	0	0	112	K224 K225 Q226 K231 A232	K224-E228 WeakPolarHBondContact O-CG 3.38Å; K224-E228 PolarHBondContact O-N 3Å; K225-E228 PolarHBondContact O-N 3.01Å; Q226-E228 PolarHBondContact O-N 3.49Å; E228-K231 CarbonylContact O-C 3.58Å; E228-K231 WeakPolarHBondContact O-CA 3.13Å; E228-K231 PolarHBondContact O-N 2.63Å; E228-K231 IonicContact OE1-NZ 2.64Å; E228-K231 PolarHBondContact OE1-NZ 3.47Å; E228-A232 PolarHBondContact O-N 3.49Å
229	L	68.3	Low	68.1	Low	111 Å²	111	103.9 Å²	103.9	58%	0.581	51%	0.507	S	S	*	.	H	α-helix	trans	-62.3	-47.3	171.1	-169.5	144	0	0	0	111.3	K225 Q226 K231 A232 L233	K225-L229 WeakPolarHBondContact O-CB 3.5Å; K225-L229 PolarHBondContact O-N 2.78Å; Q226-L229 PolarHBondContact O-N 3.04Å; L229-K231 PolarHBondContact O-N 3.17Å; L229-A232 PolarHBondContact O-N 2.9Å; L229-A232 VanDerWaalsContact O-N 3.17Å; L229-L233 HydrophobicContact CD2-CD1 3.89Å; L229-L233 WeakPolarHBondContact O-CG 3.16Å; L229-L233 PolarHBondContact O-N 3.3Å
230	M	62.8	Low	68.1	Low	135 Å²	135	108 Å²	108	67%	0.665	52%	0.518	S	S	*	.	H	α-helix	trans	-59.8	-25.8	170.7	-70.3	-67.1	-68.2	0	0	113.3	Q226 E234	Q226-M230 WeakPolarHBondContact O-CB 3.41Å; Q226-M230 VanDerWaalsContact O-CG 3.24Å; Q226-M230 WeakPolarHBondContact O-CG 3.39Å; Q226-M230 PolarHBondContact O-N 2.99Å; M230-E234 WeakPolarHBondContact O-CB 3.29Å; M230-E234 PolarHBondContact O-N 3.26Å; M230-E234 VanDerWaalsContact O-N 3.07Å
231	K	69.5	Low	68.3	Low	83 Å²	83	106 Å²	106	36%	0.361	52%	0.52	S	S	.	.	H	α-helix	trans	-93.5	-12	-179.5	166.6	174.7	148.8	-96.8	0	113.5	K227 E228 L229	K227-K231 WeakPolarHBondContact O-CB 3.26Å; K227-K231 PolarHBondContact O-N 2.97Å; E228-K231 CarbonylContact O-C 3.58Å; E228-K231 WeakPolarHBondContact O-CA 3.13Å; E228-K231 PolarHBondContact O-N 2.63Å; E228-K231 IonicContact OE1-NZ 2.64Å; E228-K231 PolarHBondContact OE1-NZ 3.47Å; L229-K231 PolarHBondContact O-N 3.17Å
232	A	67.7	Low	68.7	Low	85 Å²	85	107 Å²	107	70%	0.702	52%	0.52	S	S	*	.	H	α-helix	trans	-84.3	-37	166.8	0	0	0	0	0	110.7	E228 L229	E228-A232 PolarHBondContact O-N 3.49Å; L229-A232 PolarHBondContact O-N 2.9Å; L229-A232 VanDerWaalsContact O-N 3.17Å
233	L	66.1	Low	68.5	Low	128 Å²	128	110.5 Å²	110.5	67%	0.67	53%	0.529	S	S	*	.	S	Bend	trans	-79.6	-16.7	172.6	-61.4	172.8	0	0	0	113.5	L229 T235	L229-L233 HydrophobicContact CD2-CD1 3.89Å; L229-L233 WeakPolarHBondContact O-CG 3.16Å; L229-L233 PolarHBondContact O-N 3.3Å; L233-T235 PolarHBondContact O-N 3.18Å
234	E	64.9	Low	68.5	Low	18 Å²	18	109.9 Å²	109.9	8%	0.084	53%	0.534	C	S	.	.			trans	-56.7	115.4	178.2	179.7	-174.8	-137.5	0	0	112.4	M230 E238 K239 R242	M230-E234 WeakPolarHBondContact O-CB 3.29Å; M230-E234 PolarHBondContact O-N 3.26Å; M230-E234 VanDerWaalsContact O-N 3.07Å; E234-E238 HydrophobicContact CG-CB 4.08Å; E234-E238 HydrophobicContact CG-CG 4.06Å; E234-K239 HydrophobicContact CG-CB 3.96Å; E234-K239 HydrophobicContact CG-CG 4.45Å; E234-K239 WeakPolarHBondContact OE2-CG 3.47Å; E234-R242 VanDerWaalsContact CD-CZ 3.41Å; E234-R242 VanDerWaalsContact CD-NH2 3.28Å; E234-R242 IonicContact OE1-CZ 2.95Å; E234-R242 IonicContact OE1-NE 2.84Å; E234-R242 PolarHBondContact OE1-NE 2.9Å; E234-R242 IonicContact OE1-NH1 2.66Å; E234-R242 PolarHBondContact OE1-NH1 2.95Å; E234-R242 IonicContact OE1-NH2 3.13Å; E234-R242 PolarHBondContact OE1-NH2 2.68Å; E234-R242 IonicContact OE2-CZ 3.51Å; E234-R242 IonicContact OE2-NH1 3.71Å; E234-R242 PolarHBondContact OE2-NH1 2.92Å; E234-R242 IonicContact OE2-NH2 2.7Å; E234-R242 PolarHBondContact OE2-NH2 3.2Å
235	T	72.6	Confident	68.5	Low	74 Å²	74	106.7 Å²	106.7	45%	0.454	53%	0.53	S	S	.	.			trans	-62.4	153.9	-178.4	65.1	0	0	0	0	111.9	L233 E237 E238 K239	L233-T235 PolarHBondContact O-N 3.18Å; T235-E237 PolarHBondContact O-N 3.19Å; T235-E237 VanDerWaalsContact O-N 3.07Å; T235-E238 PolarHBondContact N-OE2 3.21Å; T235-E238 PolarHBondContact O-N 3.36Å; T235-E238 WeakPolarHBondContact OG1-CB 3.5Å; T235-E238 PolarHBondContact OG1-N 3.25Å; T235-K239 VanDerWaalsContact O-CB 3.28Å; T235-K239 WeakPolarHBondContact O-CB 3.3Å; T235-K239 PolarHBondContact O-N 3.02Å
236	P	63.3	Low	68.8	Low	104 Å²	104	107.8 Å²	107.8	68%	0.675	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-21	-177.5	23.3	-34.2	0	0	0	114.3	R240	P236-R240 WeakPolarHBondContact O-CG 3.48Å
237	E	58.5	Low	69.2	Low	152 Å²	152	109 Å²	109	71%	0.71	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-46.7	174	-177.4	158.5	-152.9	0	0	112.2	T235 K239 R240 A241	T235-E237 PolarHBondContact O-N 3.19Å; T235-E237 VanDerWaalsContact O-N 3.07Å; E237-K239 PolarHBondContact O-N 3.36Å; E237-R240 CarbonylContact O-C 3.48Å; E237-R240 WeakPolarHBondContact O-CA 3.5Å; E237-R240 VanDerWaalsContact O-CB 3.26Å; E237-R240 WeakPolarHBondContact O-CB 3.46Å; E237-R240 PolarHBondContact O-N 2.75Å; E237-A241 PolarHBondContact O-N 3.5Å
238	E	69.3	Low	69.3	Low	108 Å²	108	109.4 Å²	109.4	51%	0.505	54%	0.542	S	S	.	.	H	α-helix	trans	-59.4	-37.2	173.8	-169.5	172.6	-149.7	0	0	111.8	E234 T235 R240 A241 R242	E234-E238 HydrophobicContact CG-CB 4.08Å; E234-E238 HydrophobicContact CG-CG 4.06Å; T235-E238 PolarHBondContact N-OE2 3.21Å; T235-E238 PolarHBondContact O-N 3.36Å; T235-E238 WeakPolarHBondContact OG1-CB 3.5Å; T235-E238 PolarHBondContact OG1-N 3.25Å; E238-R240 VanDerWaalsContact C-N 3.26Å; E238-R240 PolarHBondContact O-N 2.83Å; E238-A241 CarbonylContact O-C 3.54Å; E238-A241 WeakPolarHBondContact O-CA 3.46Å; E238-A241 WeakPolarHBondContact O-CB 3.25Å; E238-A241 PolarHBondContact O-N 2.92Å; E238-A241 VanDerWaalsContact O-N 3.07Å; E238-R242 PolarHBondContact O-N 3Å
239	K	69.8	Low	69.4	Low	86 Å²	86	107 Å²	107	37%	0.374	54%	0.542	S	S	.	.	H	α-helix	trans	-62.3	-27.9	171.5	-157	156	-171.3	159.3	0	113.3	E234 T235 E237 R243	E234-K239 HydrophobicContact CG-CB 3.96Å; E234-K239 HydrophobicContact CG-CG 4.45Å; E234-K239 WeakPolarHBondContact OE2-CG 3.47Å; T235-K239 VanDerWaalsContact O-CB 3.28Å; T235-K239 WeakPolarHBondContact O-CB 3.3Å; T235-K239 PolarHBondContact O-N 3.02Å; E237-K239 PolarHBondContact O-N 3.36Å; K239-R243 VanDerWaalsContact O-CG 3.29Å; K239-R243 WeakPolarHBondContact O-CG 3.37Å; K239-R243 PolarHBondContact O-N 3.05Å
240	R	63.3	Low	69.6	Low	178 Å²	178	109 Å²	109	67%	0.672	55%	0.546	S	S	*	.	H	α-helix	trans	-77.8	-44.8	168.6	-66.5	167.3	-179.5	-178.6	0.1	110.6	P236 E237 E238 R242 R243 L244	P236-R240 WeakPolarHBondContact O-CG 3.48Å; E237-R240 CarbonylContact O-C 3.48Å; E237-R240 WeakPolarHBondContact O-CA 3.5Å; E237-R240 VanDerWaalsContact O-CB 3.26Å; E237-R240 WeakPolarHBondContact O-CB 3.46Å; E237-R240 PolarHBondContact O-N 2.75Å; E238-R240 VanDerWaalsContact C-N 3.26Å; E238-R240 PolarHBondContact O-N 2.83Å; R240-R242 PolarHBondContact O-N 2.91Å; R240-R243 CarbonylContact O-C 3.51Å; R240-R243 WeakPolarHBondContact O-CA 3.27Å; R240-R243 WeakPolarHBondContact O-CB 3.43Å; R240-R243 PolarHBondContact O-N 3.46Å; R240-L244 PolarHBondContact O-N 3.19Å
241	A	73.1	Confident	69.7	Low	55 Å²	55	106 Å²	106	46%	0.455	53%	0.53	S	S	.	.	H	α-helix	trans	-56.6	-47.9	177.3	0	0	0	0	0	111.9	E237 E238 R243 L244 A245	E237-A241 PolarHBondContact O-N 3.5Å; E238-A241 CarbonylContact O-C 3.54Å; E238-A241 WeakPolarHBondContact O-CA 3.46Å; E238-A241 WeakPolarHBondContact O-CB 3.25Å; E238-A241 PolarHBondContact O-N 2.92Å; E238-A241 VanDerWaalsContact O-N 3.07Å; A241-R243 VanDerWaalsContact C-N 3.29Å; A241-R243 PolarHBondContact O-N 3.4Å; A241-L244 PolarHBondContact O-N 2.97Å; A241-L244 VanDerWaalsContact O-N 3.16Å; A241-A245 WeakPolarHBondContact O-CB 3.35Å; A241-A245 PolarHBondContact O-N 2.83Å
242	R	76	Confident	69.5	Low	101 Å²	101	106 Å²	106	38%	0.381	53%	0.53	S	S	.	.	H	α-helix	trans	-64.7	-30.1	175.2	-163.1	-166.2	63.4	-136.7	-33.1	112.9	E234 E238 R240 K246	E234-R242 VanDerWaalsContact CD-CZ 3.41Å; E234-R242 VanDerWaalsContact CD-NH2 3.28Å; E234-R242 IonicContact OE1-CZ 2.95Å; E234-R242 IonicContact OE1-NE 2.84Å; E234-R242 PolarHBondContact OE1-NE 2.9Å; E234-R242 IonicContact OE1-NH1 2.66Å; E234-R242 PolarHBondContact OE1-NH1 2.95Å; E234-R242 IonicContact OE1-NH2 3.13Å; E234-R242 PolarHBondContact OE1-NH2 2.68Å; E234-R242 IonicContact OE2-CZ 3.51Å; E234-R242 IonicContact OE2-NH1 3.71Å; E234-R242 PolarHBondContact OE2-NH1 2.92Å; E234-R242 IonicContact OE2-NH2 2.7Å; E234-R242 PolarHBondContact OE2-NH2 3.2Å; E238-R242 PolarHBondContact O-N 3Å; R240-R242 PolarHBondContact O-N 2.91Å; R242-K246 WeakPolarHBondContact O-CB 3.46Å; R242-K246 PolarHBondContact O-N 3.19Å
243	R	66.6	Low	69.4	Low	185 Å²	185	109.4 Å²	109.4	70%	0.698	53%	0.529	S	S	*	.	H	α-helix	trans	-71	-38.7	173	-80.1	176.2	174.4	-165.9	-0.6	111.8	K239 R240 A241 K247	K239-R243 VanDerWaalsContact O-CG 3.29Å; K239-R243 WeakPolarHBondContact O-CG 3.37Å; K239-R243 PolarHBondContact O-N 3.05Å; R240-R243 CarbonylContact O-C 3.51Å; R240-R243 WeakPolarHBondContact O-CA 3.27Å; R240-R243 WeakPolarHBondContact O-CB 3.43Å; R240-R243 PolarHBondContact O-N 3.46Å; A241-R243 VanDerWaalsContact C-N 3.29Å; A241-R243 PolarHBondContact O-N 3.4Å; R243-K247 WeakPolarHBondContact O-CB 3.33Å; R243-K247 PolarHBondContact O-N 3.03Å
244	L	70.4	Confident	69.2	Low	111 Å²	111	112.2 Å²	112.2	58%	0.581	53%	0.531	S	S	*	.	H	α-helix	trans	-65.6	-53	172.8	-71.8	169.5	0	0	0	110.8	R240 A241 K246 K247 E248	R240-L244 PolarHBondContact O-N 3.19Å; A241-L244 PolarHBondContact O-N 2.97Å; A241-L244 VanDerWaalsContact O-N 3.16Å; L244-K246 VanDerWaalsContact C-N 3.27Å; L244-K246 PolarHBondContact O-N 3.41Å; L244-K247 CarbonylContact O-C 3.51Å; L244-K247 WeakPolarHBondContact O-CA 3.32Å; L244-K247 WeakPolarHBondContact O-CB 3.32Å; L244-K247 PolarHBondContact O-N 2.64Å; L244-E248 WeakPolarHBondContact O-CB 3.49Å; L244-E248 PolarHBondContact O-N 3.4Å
245	A	73.9	Confident	68.8	Low	51 Å²	51	116.5 Å²	116.5	42%	0.421	55%	0.546	S	S	.	.	H	α-helix	trans	-57.5	-36.7	176.6	0	0	0	0	0	112.7	A241 A249	A241-A245 WeakPolarHBondContact O-CB 3.35Å; A241-A245 PolarHBondContact O-N 2.83Å; A245-A249 WeakPolarHBondContact O-CB 3.29Å; A245-A249 PolarHBondContact O-N 2.96Å
246	K	79.8	Confident	67.9	Low	144 Å²	144	118 Å²	118	63%	0.626	55%	0.548	S	S	*	.	H	α-helix	trans	-73.2	-25.4	174.4	-170.9	168.7	-176.5	173.1	0	113.5	R242 L244 K250	R242-K246 WeakPolarHBondContact O-CB 3.46Å; R242-K246 PolarHBondContact O-N 3.19Å; L244-K246 VanDerWaalsContact C-N 3.27Å; L244-K246 PolarHBondContact O-N 3.41Å; K246-K250 WeakPolarHBondContact O-CB 3.22Å; K246-K250 WeakPolarHBondContact O-CG 3.32Å; K246-K250 PolarHBondContact O-N 3.34Å
247	K	75.3	Confident	67.8	Low	139 Å²	139	122.1 Å²	122.1	60%	0.604	56%	0.555	S	S	*	*	H	α-helix	trans	-73.8	-49.6	170.1	-176.7	-171.5	174.3	-168.8	0	110	R243 L244 K250 E251	R243-K247 WeakPolarHBondContact O-CB 3.33Å; R243-K247 PolarHBondContact O-N 3.03Å; L244-K247 CarbonylContact O-C 3.51Å; L244-K247 WeakPolarHBondContact O-CA 3.32Å; L244-K247 WeakPolarHBondContact O-CB 3.32Å; L244-K247 PolarHBondContact O-N 2.64Å; K247-K250 CarbonylContact O-C 3.46Å; K247-K250 WeakPolarHBondContact O-CB 3.45Å; K247-K250 PolarHBondContact O-N 2.94Å; K247-E251 WeakPolarHBondContact O-CB 3.27Å; K247-E251 PolarHBondContact O-N 3.39Å
248	E	73.2	Confident	67.2	Low	138 Å²	138	121.9 Å²	121.9	65%	0.645	56%	0.556	S	S	*	*	H	α-helix	trans	-62.4	-45.4	179.9	-174.1	171	-150.9	0	0	112.3	L244 K250 E251 K252	L244-E248 WeakPolarHBondContact O-CB 3.49Å; L244-E248 PolarHBondContact O-N 3.4Å; E248-K250 VanDerWaalsContact C-N 3.34Å; E248-K250 PolarHBondContact O-N 3.49Å; E248-E251 CarbonylContact O-C 3.58Å; E248-E251 WeakPolarHBondContact O-CA 3.36Å; E248-E251 PolarHBondContact O-N 3.06Å; E248-K252 PolarHBondContact O-N 2.93Å
249	A	74.1	Confident	66.3	Low	62 Å²	62	119.7 Å²	119.7	51%	0.512	56%	0.562	S	S	.	*	H	α-helix	trans	-65.3	-34.4	174.2	0	0	0	0	0	112.8	A245 E251 K253	A245-A249 WeakPolarHBondContact O-CB 3.29Å; A245-A249 PolarHBondContact O-N 2.96Å; A249-E251 VanDerWaalsContact C-N 3.33Å; A249-K253 WeakPolarHBondContact O-CB 3.46Å; A249-K253 PolarHBondContact O-N 2.85Å
250	K	71.7	Confident	65.1	Low	153 Å²	153	121.4 Å²	121.4	67%	0.665	57%	0.566	S	S	*	*	H	α-helix	trans	-67.6	-35	170	-87.2	-171	169.7	-165.7	0	111.8	K246 K247 E248 R254	K246-K250 WeakPolarHBondContact O-CB 3.22Å; K246-K250 WeakPolarHBondContact O-CG 3.32Å; K246-K250 PolarHBondContact O-N 3.34Å; K247-K250 CarbonylContact O-C 3.46Å; K247-K250 WeakPolarHBondContact O-CB 3.45Å; K247-K250 PolarHBondContact O-N 2.94Å; E248-K250 VanDerWaalsContact C-N 3.34Å; E248-K250 PolarHBondContact O-N 3.49Å; K250-R254 WeakPolarHBondContact O-CB 3.45Å; K250-R254 PolarHBondContact O-N 3.11Å
251	E	65.9	Low	64.3	Low	70 Å²	70	116.5 Å²	116.5	33%	0.327	56%	0.559	S	S	.	*	H	α-helix	trans	-74.1	-47.3	179.7	-178.3	156.9	-168.6	0	0	111.9	K247 E248 A249 K253 R254 R255	K247-E251 WeakPolarHBondContact O-CB 3.27Å; K247-E251 PolarHBondContact O-N 3.39Å; E248-E251 CarbonylContact O-C 3.58Å; E248-E251 WeakPolarHBondContact O-CA 3.36Å; E248-E251 PolarHBondContact O-N 3.06Å; A249-E251 VanDerWaalsContact C-N 3.33Å; E251-K253 PolarHBondContact O-N 3.42Å; E251-R254 CarbonylContact O-C 3.45Å; E251-R254 WeakPolarHBondContact O-CA 3.37Å; E251-R254 WeakPolarHBondContact O-CB 3.48Å; E251-R254 PolarHBondContact O-N 3.02Å; E251-R255 HydrophobicContact CG-CG 4.47Å; E251-R255 WeakPolarHBondContact O-CG 3.33Å; E251-R255 PolarHBondContact O-N 3.25Å; E251-R255 IonicContact OE1-CZ 3.7Å; E251-R255 IonicContact OE1-NE 2.69Å; E251-R255 PolarHBondContact OE1-NE 3Å; E251-R255 IonicContact OE1-NH2 3.87Å; E251-R255 PolarHBondContact OE1-NH2 3.36Å
252	K	63.9	Low	63	Low	85 Å²	85	120 Å²	120	37%	0.37	57%	0.566	S	S	.	*	H	α-helix	trans	-56.1	-49.6	171.2	-180	155.7	-175.8	160.9	0	110.7	E248 R254 R255 E256 E262	E248-K252 PolarHBondContact O-N 2.93Å; K252-R254 PolarHBondContact O-N 2.87Å; K252-R255 PolarHBondContact O-N 3.2Å; K252-E256 WeakPolarHBondContact CE-OE1 3.48Å; K252-E256 HydrophobicContact CG-CG 4.1Å; K252-E256 WeakPolarHBondContact CG-OE1 3.44Å; K252-E256 WeakPolarHBondContact O-CB 3Å; K252-E256 WeakPolarHBondContact O-CG 3.38Å; K252-E256 PolarHBondContact O-N 3.13Å; K252-E262 IonicContact NZ-OE1 3.6Å; K252-E262 PolarHBondContact NZ-OE1 2.64Å; K252-E262 IonicContact NZ-OE2 3.74Å; K252-E262 PolarHBondContact NZ-OE2 3.39Å
253	K	66.4	Low	61.7	Low	155 Å²	155	124.2 Å²	124.2	67%	0.674	59%	0.59	S	S	*	*	H	α-helix	trans	-65.2	-20.4	176.4	-162.7	161.1	-171.6	164.5	0	114.1	A249 E251 K257	A249-K253 WeakPolarHBondContact O-CB 3.46Å; A249-K253 PolarHBondContact O-N 2.85Å; E251-K253 PolarHBondContact O-N 3.42Å; K253-K257 WeakPolarHBondContact O-CB 3.31Å
254	R	61.8	Low	60.7	Low	188 Å²	188	123.6 Å²	123.6	71%	0.709	59%	0.589	S	S	*	*	H	α-helix	trans	-81.4	-37.5	169.9	-164	179	83.2	157.9	4.4	112.1	K250 E251 K252 M258	K250-R254 WeakPolarHBondContact O-CB 3.45Å; K250-R254 PolarHBondContact O-N 3.11Å; E251-R254 CarbonylContact O-C 3.45Å; E251-R254 WeakPolarHBondContact O-CA 3.37Å; E251-R254 WeakPolarHBondContact O-CB 3.48Å; E251-R254 PolarHBondContact O-N 3.02Å; K252-R254 PolarHBondContact O-N 2.87Å; R254-M258 VanDerWaalsContact O-CG 3.29Å; R254-M258 WeakPolarHBondContact O-CG 3.44Å; R254-M258 PolarHBondContact O-N 3.35Å
255	R	55.6	Low	59.9	Low	107 Å²	107	124.1 Å²	124.1	40%	0.404	59%	0.59	S	S	.	*	H	α-helix	trans	-72.1	-44.9	177.4	-68.1	178.1	-175	-155.2	3.7	111.7	E251 K252 K257 M258 G259	E251-R255 HydrophobicContact CG-CG 4.47Å; E251-R255 WeakPolarHBondContact O-CG 3.33Å; E251-R255 PolarHBondContact O-N 3.25Å; E251-R255 IonicContact OE1-CZ 3.7Å; E251-R255 IonicContact OE1-NE 2.69Å; E251-R255 PolarHBondContact OE1-NE 3Å; E251-R255 IonicContact OE1-NH2 3.87Å; E251-R255 PolarHBondContact OE1-NH2 3.36Å; K252-R255 PolarHBondContact O-N 3.2Å; R255-K257 VanDerWaalsContact C-N 3.32Å; R255-K257 PolarHBondContact O-N 3.26Å; R255-M258 WeakPolarHBondContact O-CA 3.21Å; R255-M258 WeakPolarHBondContact O-CB 3.2Å; R255-M258 PolarHBondContact O-N 3.16Å; R255-G259 PolarHBondContact O-N 3.04Å
256	E	54	Low	58.8	Low	106 Å²	106	124.7 Å²	124.7	50%	0.495	60%	0.6	S	S	.	*	H	α-helix	trans	-54.8	-45.3	171.8	-73.1	170.1	169.1	0	0	111.7	K252 M258 G259	K252-E256 WeakPolarHBondContact CE-OE1 3.48Å; K252-E256 HydrophobicContact CG-CG 4.1Å; K252-E256 WeakPolarHBondContact CG-OE1 3.44Å; K252-E256 WeakPolarHBondContact O-CB 3Å; K252-E256 WeakPolarHBondContact O-CG 3.38Å; K252-E256 PolarHBondContact O-N 3.13Å; E256-M258 PolarHBondContact O-N 3Å; E256-M258 VanDerWaalsContact O-N 3.17Å; E256-G259 PolarHBondContact O-N 3.33Å
257	K	60.8	Low	57.3	Low	191 Å²	191	124.6 Å²	124.6	83%	0.83	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-10.3	178.7	-168.4	163	-177.7	175.1	0	113.8	K253 R255	K253-K257 WeakPolarHBondContact O-CB 3.31Å; R255-K257 VanDerWaalsContact C-N 3.32Å; R255-K257 PolarHBondContact O-N 3.26Å
258	M	46.2	Very low	56.2	Low	147 Å²	147	120.2 Å²	120.2	72%	0.724	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	0.8	170.4	-62.1	-71.4	-76.3	0	0	112.8	R254 R255 E256	R254-M258 VanDerWaalsContact O-CG 3.29Å; R254-M258 WeakPolarHBondContact O-CG 3.44Å; R254-M258 PolarHBondContact O-N 3.35Å; R255-M258 WeakPolarHBondContact O-CA 3.21Å; R255-M258 WeakPolarHBondContact O-CB 3.2Å; R255-M258 PolarHBondContact O-N 3.16Å; E256-M258 PolarHBondContact O-N 3Å; E256-M258 VanDerWaalsContact O-N 3.17Å
259	G	50.3	Low	55.3	Low	61 Å²	61	116.2 Å²	116.2	63%	0.629	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	86.4	16.3	171.3	0	0	0	0	0	116.4	R255 E256	R255-G259 PolarHBondContact O-N 3.04Å; E256-G259 PolarHBondContact O-N 3.33Å
260	W	45.7	Very low	54.3	Low	123 Å²	123	118 Å²	118	47%	0.466	58%	0.58	S	S	.	*			trans	-86.3	134	-178.3	-71.7	46.3	0	0	0	110.9	L280	W260-L280 HydrophobicContact CH2-CD2 3.35Å; W260-L280 HydrophobicContact CZ2-CD2 3.39Å; W260-L280 HydrophobicContact CZ3-CD2 4.26Å
261	S	45.9	Very low	53.5	Low	74 Å²	74	116.8 Å²	116.8	52%	0.517	58%	0.58	S	S	.	*			trans	-88.4	153.2	-178.4	58.5	0	0	0	0	112.8	E263 Y264	S261-E263 PolarHBondContact O-N 3.08Å; S261-Y264 PolarHBondContact O-N 2.99Å; S261-Y264 VanDerWaalsContact O-N 3.12Å
262	E	46.7	Very low	53.1	Low	130 Å²	130	114.5 Å²	114.5	61%	0.607	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-16.5	179.9	-152.7	94	-140.3	0	0	113.5	K252 M265	K252-E262 IonicContact NZ-OE1 3.6Å; K252-E262 PolarHBondContact NZ-OE1 2.64Å; K252-E262 IonicContact NZ-OE2 3.74Å; K252-E262 PolarHBondContact NZ-OE2 3.39Å; E262-M265 WeakPolarHBondContact O-CB 3.45Å; E262-M265 WeakPolarHBondContact O-CG 3.44Å
263	E	47.8	Very low	52.8	Low	188 Å²	188	114.8 Å²	114.8	88%	0.879	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-16.3	-179.1	-164.2	166.5	-160.9	0	0	113	S261	S261-E263 PolarHBondContact O-N 3.08Å
264	Y	45.2	Very low	52.3	Low	173 Å²	173	115.3 Å²	115.3	68%	0.678	58%	0.584	S	S	*	*	S	Bend	trans	-105.9	52.8	176.3	-155.1	-98.3	0	0	0	111	S261	S261-Y264 PolarHBondContact O-N 2.99Å; S261-Y264 VanDerWaalsContact O-N 3.12Å
265	M	54.2	Low	52	Low	121 Å²	121	109.1 Å²	109.1	60%	0.596	58%	0.579	S	S	*	*			trans	-105	21.6	-159.8	-108.6	-83.3	-74.2	0	0	114.7	E262	E262-M265 WeakPolarHBondContact O-CB 3.45Å; E262-M265 WeakPolarHBondContact O-CG 3.44Å
266	G	50.1	Low	52.3	Low	63 Å²	63	108.2 Å²	108.2	65%	0.649	58%	0.582	S	S	*	*			trans	-86.3	-44.6	-166.5	0	0	0	0	0	117.4
267	Y	48.9	Very low	52.6	Low	142 Å²	142	110.2 Å²	110.2	56%	0.557	60%	0.596	S	S	*	*			trans	-121.6	147	-162.4	-59.6	-71.9	0	0	0	114.1	P273 L279	Y267-P273 HydrophobicContact CE1-CG 4.1Å; Y267-L279 HydrophobicContact CG-CD2 4.49Å
268	T	51.2	Low	52.4	Low	48 Å²	48	107.2 Å²	107.2	29%	0.294	59%	0.589	S	S	.	*			trans	-129.7	157.5	170.1	79.3	0	0	0	0	109.9	A270 D271	T268-A270 PolarHBondContact O-N 2.95Å; T268-A270 PolarHBondContact OG1-N 3.45Å; T268-D271 CarbonylContact O-C 3.39Å; T268-D271 PolarHBondContact O-N 3.46Å
269	N	54.1	Low	53.1	Low	54 Å²	54	103.9 Å²	103.9	29%	0.289	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.2	-17.3	177.8	-100.2	31	0	0	0	114.9	N277 L279 L280	N269-N277 PolarHBondContact ND2-O 3.04Å; N269-L279 WeakPolarHBondContact OD1-CB 3.21Å; N269-L279 PolarHBondContact OD1-N 3.14Å; N269-L280 HydrophobicContact CB-CD1 4.02Å; N269-L280 HydrophobicContact CB-CG 4.47Å; N269-L280 VanDerWaalsContact OD1-CB 3.31Å; N269-L280 WeakPolarHBondContact OD1-CB 3.31Å; N269-L280 WeakPolarHBondContact OD1-CG 3.47Å; N269-L280 PolarHBondContact OD1-N 3.23Å
270	A	54.3	Low	53.2	Low	98 Å²	98	105.3 Å²	105.3	81%	0.81	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-1.9	179.5	0	0	0	0	0	113.3	T268	T268-A270 PolarHBondContact O-N 2.95Å; T268-A270 PolarHBondContact OG1-N 3.45Å
271	D	55	Low	53.7	Low	128 Å²	128	101.4 Å²	101.4	68%	0.684	57%	0.565	S	S	*	*	S	Bend	trans	-136.4	46.8	-176.2	-140	-4.6	0	0	0	108.5	T268	T268-D271 CarbonylContact O-C 3.39Å; T268-D271 PolarHBondContact O-N 3.46Å
272	N	57.8	Low	54.1	Low	22 Å²	22	102.9 Å²	102.9	12%	0.118	57%	0.57	C	S	.	*			trans	-94.3	112.3	178.6	179.7	6.5	0	0	0	109.6	F274 G275 D276 L279	N272-F274 PolarHBondContact O-N 2.86Å; N272-F274 VanDerWaalsContact O-N 3.11Å; N272-F274 PolarHBondContact OD1-N 3.22Å; N272-G275 PolarHBondContact O-N 3.49Å; N272-G275 VanDerWaalsContact O-N 3.16Å; N272-D276 WeakPolarHBondContact ND2-CA 3.41Å; N272-D276 WeakPolarHBondContact ND2-CB 3.36Å; N272-D276 PolarHBondContact ND2-N 2.94Å; N272-D276 PolarHBondContact ND2-O 3.19Å; N272-D276 PolarHBondContact ND2-OD2 2.58Å; N272-L279 HydrophobicContact CB-CD2 4.05Å
273	P	57.6	Low	54.3	Low	92 Å²	92	105 Å²	105	60%	0.597	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-10.3	-179.8	28.1	-35.1	0	0	0	114.2	Y267	Y267-P273 HydrophobicContact CE1-CG 4.1Å
274	F	54.8	Low	55	Low	166 Å²	166	100.9 Å²	100.9	73%	0.728	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-5.9	177.2	-56.8	-73.7	0	0	0	113.9	N272 D276	N272-F274 PolarHBondContact O-N 2.86Å; N272-F274 VanDerWaalsContact O-N 3.11Å; N272-F274 PolarHBondContact OD1-N 3.22Å; F274-D276 WeakPolarHBondContact CB-OD2 3.48Å; F274-D276 PolarHBondContact O-N 3.35Å
275	G	56.1	Low	56.1	Low	58 Å²	58	100.9 Å²	100.9	60%	0.598	56%	0.556	S	S	*	*			trans	81.8	0.8	173.3	0	0	0	0	0	116.5	N272 N277	N272-G275 PolarHBondContact O-N 3.49Å; N272-G275 VanDerWaalsContact O-N 3.16Å; G275-N277 PolarHBondContact O-N 2.81Å
276	D	61.9	Low	56.4	Low	88 Å²	88	101.8 Å²	101.8	47%	0.471	56%	0.559	S	S	.	*			trans	-73.8	122.2	178.4	-29	-89.7	0	0	0	111.8	N272 F274 N278	N272-D276 WeakPolarHBondContact ND2-CA 3.41Å; N272-D276 WeakPolarHBondContact ND2-CB 3.36Å; N272-D276 PolarHBondContact ND2-N 2.94Å; N272-D276 PolarHBondContact ND2-O 3.19Å; N272-D276 PolarHBondContact ND2-OD2 2.58Å; F274-D276 WeakPolarHBondContact CB-OD2 3.48Å; F274-D276 PolarHBondContact O-N 3.35Å; D276-N278 PolarHBondContact O-N 3.45Å
277	N	59.3	Low	57.1	Low	147 Å²	147	107.1 Å²	107.1	79%	0.786	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-5.9	178.7	-70.2	-7.3	0	0	0	114.9	N269 G275	N269-N277 PolarHBondContact ND2-O 3.04Å; G275-N277 PolarHBondContact O-N 2.81Å
278	N	58.2	Low	58	Low	128 Å²	128	101.6 Å²	101.6	68%	0.684	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.3	25.4	-164.7	-132.2	18.8	0	0	0	114.7	D276 L280 G281	D276-N278 PolarHBondContact O-N 3.45Å; N278-L280 PolarHBondContact O-N 2.95Å; N278-L280 VanDerWaalsContact O-N 3.11Å; N278-G281 PolarHBondContact O-N 3.27Å
279	L	59.6	Low	58.7	Low	77 Å²	77	101.5 Å²	101.5	40%	0.403	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-30.8	-178.5	-168.2	70.9	0	0	0	114.6	Y267 N269 N272 G281	Y267-L279 HydrophobicContact CG-CD2 4.49Å; N269-L279 WeakPolarHBondContact OD1-CB 3.21Å; N269-L279 PolarHBondContact OD1-N 3.14Å; N272-L279 HydrophobicContact CB-CD2 4.05Å; L279-G281 VanDerWaalsContact C-N 3.33Å
280	L	52.8	Low	59.2	Low	91 Å²	91	103.6 Å²	103.6	48%	0.476	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.6	-6.4	175.7	-71.7	170.3	0	0	0	114.3	W260 N269 N278 T282	W260-L280 HydrophobicContact CH2-CD2 3.35Å; W260-L280 HydrophobicContact CZ2-CD2 3.39Å; W260-L280 HydrophobicContact CZ3-CD2 4.26Å; N269-L280 HydrophobicContact CB-CD1 4.02Å; N269-L280 HydrophobicContact CB-CG 4.47Å; N269-L280 VanDerWaalsContact OD1-CB 3.31Å; N269-L280 WeakPolarHBondContact OD1-CB 3.31Å; N269-L280 WeakPolarHBondContact OD1-CG 3.47Å; N269-L280 PolarHBondContact OD1-N 3.23Å; N278-L280 PolarHBondContact O-N 2.95Å; N278-L280 VanDerWaalsContact O-N 3.11Å; L280-T282 PolarHBondContact O-N 2.85Å
281	G	56.4	Low	60.1	Low	42 Å²	42	108.1 Å²	108.1	43%	0.433	56%	0.558	S	S	.	*	S	Bend	trans	-75.6	112.4	177	0	0	0	0	0	111.3	N278 L279 F283	N278-G281 PolarHBondContact O-N 3.27Å; L279-G281 VanDerWaalsContact C-N 3.33Å; G281-F283 PolarHBondContact O-N 2.91Å
282	T	55	Low	60.7	Low	104 Å²	104	109.6 Å²	109.6	64%	0.638	56%	0.558	S	S	*	*			trans	-64.6	102.3	-179.9	55.4	0	0	0	0	111.4	L280 K284	L280-T282 PolarHBondContact O-N 2.85Å; T282-K284 PolarHBondContact O-N 3.32Å
283	F	50.7	Low	60.9	Low	174 Å²	174	111.2 Å²	111.2	76%	0.763	58%	0.58	S	S	*	*			trans	-58.6	118.3	175.9	177	-103.6	0	0	0	110.9	G281 W285	G281-F283 PolarHBondContact O-N 2.91Å; F283-W285 HydrophobicContact CD1-CB 4.28Å; F283-W285 HydrophobicContact CE1-CB 3.76Å; F283-W285 AromaticContact CE1-CD1 3.68Å; F283-W285 AromaticContact CE1-CG 3.9Å; F283-W285 HydrophobicContact CE1-CG 3.9Å; F283-W285 AromaticContact CZ-CD1 3.95Å
284	K	60.9	Low	61.1	Low	102 Å²	102	108.3 Å²	108.3	44%	0.443	56%	0.559	S	S	.	*			trans	-93.9	107.5	176.5	-61.7	176.6	-169.5	165.5	0	109	T282 Q286 E299	T282-K284 PolarHBondContact O-N 3.32Å; K284-Q286 VanDerWaalsContact C-N 3.31Å; K284-Q286 PolarHBondContact O-N 3.17Å; K284-E299 WeakPolarHBondContact CE-OE1 3.26Å; K284-E299 IonicContact NZ-OE1 3.73Å; K284-E299 PolarHBondContact NZ-OE1 3.17Å; K284-E299 IonicContact NZ-OE2 3.48Å; K284-E299 PolarHBondContact NZ-OE2 3.11Å
285	W	68.5	Low	61.3	Low	174 Å²	174	102.1 Å²	102.1	66%	0.659	54%	0.543	S	S	*	.			trans	-79	79.6	179.4	-160.4	31	0	0	0	110.7	F283 K287 A288 L289	F283-W285 HydrophobicContact CD1-CB 4.28Å; F283-W285 HydrophobicContact CE1-CB 3.76Å; F283-W285 AromaticContact CE1-CD1 3.68Å; F283-W285 AromaticContact CE1-CG 3.9Å; F283-W285 HydrophobicContact CE1-CG 3.9Å; F283-W285 AromaticContact CZ-CD1 3.95Å; W285-K287 PolarHBondContact O-N 2.91Å; W285-A288 HydrophobicContact CB-CB 4.29Å; W285-A288 HydrophobicContact CD2-CB 3.69Å; W285-A288 HydrophobicContact CE3-CB 3.32Å; W285-A288 HydrophobicContact CG-CB 4.11Å; W285-A288 HydrophobicContact CZ3-CB 3.92Å; W285-A288 WeakPolarHBondContact O-CA 3.44Å; W285-A288 WeakPolarHBondContact O-CB 3.48Å; W285-A288 PolarHBondContact O-N 3.32Å; W285-L289 PolarHBondContact O-N 3.33Å
286	Q	60.3	Low	61.5	Low	140 Å²	140	108.3 Å²	108.3	65%	0.654	56%	0.556	S	S	*	*	H	α-helix	trans	-48.7	-53.8	-169.8	-71.1	164.5	-63.6	0	0	112.9	K284 A288 L289 D290	K284-Q286 VanDerWaalsContact C-N 3.31Å; K284-Q286 PolarHBondContact O-N 3.17Å; Q286-A288 PolarHBondContact O-N 2.94Å; Q286-L289 WeakPolarHBondContact O-CA 3.42Å; Q286-L289 WeakPolarHBondContact O-CB 3.37Å; Q286-L289 PolarHBondContact O-N 2.79Å; Q286-D290 VanDerWaalsContact C-OD2 3.25Å; Q286-D290 PolarHBondContact O-N 2.94Å
287	K	66.6	Low	61.4	Low	174 Å²	174	108.8 Å²	108.8	76%	0.757	55%	0.554	S	S	*	*	H	α-helix	trans	-52.4	-26.4	176.6	-72.9	-172	175.2	-177.2	0	114.6	W285 K291	W285-K287 PolarHBondContact O-N 2.91Å; K287-K291 WeakPolarHBondContact O-CB 3.33Å; K287-K291 PolarHBondContact O-N 3.02Å
288	A	66.6	Low	61.7	Low	26 Å²	26	103.9 Å²	103.9	22%	0.215	53%	0.531	C	S	.	.	H	α-helix	trans	-91.3	-17	177.2	0	0	0	0	0	114.1	W285 Q286 K292	W285-A288 HydrophobicContact CB-CB 4.29Å; W285-A288 HydrophobicContact CD2-CB 3.69Å; W285-A288 HydrophobicContact CE3-CB 3.32Å; W285-A288 HydrophobicContact CG-CB 4.11Å; W285-A288 HydrophobicContact CZ3-CB 3.92Å; W285-A288 WeakPolarHBondContact O-CA 3.44Å; W285-A288 WeakPolarHBondContact O-CB 3.48Å; W285-A288 PolarHBondContact O-N 3.32Å; Q286-A288 PolarHBondContact O-N 2.94Å; A288-K292 WeakPolarHBondContact O-CB 3.23Å; A288-K292 WeakPolarHBondContact O-CD 3.42Å; A288-K292 VanDerWaalsContact O-CG 3.23Å; A288-K292 WeakPolarHBondContact O-CG 3.38Å
289	L	65.8	Low	61.9	Low	47 Å²	47	101.9 Å²	101.9	25%	0.246	52%	0.518	C	S	.	.	H	α-helix	trans	-76.6	-44.6	164.6	-61.9	175	0	0	0	109.8	W285 Q286 K292 G293 I294 G295 L302	W285-L289 PolarHBondContact O-N 3.33Å; Q286-L289 WeakPolarHBondContact O-CA 3.42Å; Q286-L289 WeakPolarHBondContact O-CB 3.37Å; Q286-L289 PolarHBondContact O-N 2.79Å; L289-K292 CarbonylContact O-C 3.54Å; L289-K292 PolarHBondContact O-N 2.88Å; L289-K292 VanDerWaalsContact O-N 3.14Å; L289-G293 PolarHBondContact O-N 2.99Å; L289-I294 PolarHBondContact O-N 2.83Å; L289-G295 PolarHBondContact O-N 3.42Å; L289-L302 HydrophobicContact CD1-CD1 4.17Å; L289-L302 HydrophobicContact CD2-CD2 3.94Å
290	D	65.6	Low	62.2	Low	98 Å²	98	105.6 Å²	105.6	52%	0.524	53%	0.53	S	S	.	.	H	α-helix	trans	-62.9	-49.6	178.3	-51.6	-33	0	0	0	110.7	Q286 K292 G293	Q286-D290 VanDerWaalsContact C-OD2 3.25Å; Q286-D290 PolarHBondContact O-N 2.94Å; D290-K292 PolarHBondContact O-N 3.46Å; D290-K292 VanDerWaalsContact O-N 3.1Å; D290-G293 PolarHBondContact O-N 2.67Å
291	K	71.9	Confident	63.1	Low	192 Å²	192	105.3 Å²	105.3	84%	0.835	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-13.6	175.5	-173	169.2	-179.2	177.7	0	114.1	K287	K287-K291 WeakPolarHBondContact O-CB 3.33Å; K287-K291 PolarHBondContact O-N 3.02Å
292	K	67.6	Low	63.7	Low	159 Å²	159	104.8 Å²	104.8	69%	0.691	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-0.2	171.8	-72.8	-178.8	178	-174.4	0	113.4	A288 L289 D290 I294	A288-K292 WeakPolarHBondContact O-CB 3.23Å; A288-K292 WeakPolarHBondContact O-CD 3.42Å; A288-K292 VanDerWaalsContact O-CG 3.23Å; A288-K292 WeakPolarHBondContact O-CG 3.38Å; L289-K292 CarbonylContact O-C 3.54Å; L289-K292 PolarHBondContact O-N 2.88Å; L289-K292 VanDerWaalsContact O-N 3.14Å; D290-K292 PolarHBondContact O-N 3.46Å; D290-K292 VanDerWaalsContact O-N 3.1Å; K292-I294 VanDerWaalsContact C-N 3.27Å; K292-I294 HydrophobicContact CB-CD1 4.07Å; K292-I294 HydrophobicContact CB-CG1 3.86Å; K292-I294 VanDerWaalsContact O-CG1 3.26Å; K292-I294 WeakPolarHBondContact O-CG1 3.25Å; K292-I294 PolarHBondContact O-N 2.85Å
293	G	62.6	Low	64.3	Low	57 Å²	57	105.1 Å²	105.1	59%	0.588	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	15.5	-176.2	0	0	0	0	0	114.6	L289 D290	L289-G293 PolarHBondContact O-N 2.99Å; D290-G293 PolarHBondContact O-N 2.67Å
294	I	62.5	Low	65.4	Low	30 Å²	30	102.5 Å²	102.5	15%	0.154	50%	0.496	C	S	.	.			trans	-108.2	8.4	-173.1	-34.1	-174	0	0	0	111.8	L289 K292 H296 F297 L302	L289-I294 PolarHBondContact O-N 2.83Å; K292-I294 VanDerWaalsContact C-N 3.27Å; K292-I294 HydrophobicContact CB-CD1 4.07Å; K292-I294 HydrophobicContact CB-CG1 3.86Å; K292-I294 VanDerWaalsContact O-CG1 3.26Å; K292-I294 WeakPolarHBondContact O-CG1 3.25Å; K292-I294 PolarHBondContact O-N 2.85Å; I294-H296 PolarHBondContact O-N 3.44Å; I294-F297 HydrophobicContact CB-CD2 4.16Å; I294-F297 HydrophobicContact CG2-CB 4.11Å; I294-F297 HydrophobicContact CG2-CD2 3.33Å; I294-F297 HydrophobicContact CG2-CE2 3.89Å; I294-F297 HydrophobicContact CG2-CG 3.83Å; I294-F297 PolarHBondContact O-N 2.55Å; I294-L302 HydrophobicContact CG2-CD2 3.79Å
295	G	59.4	Low	65.9	Low	37 Å²	37	104.1 Å²	104.1	38%	0.381	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-22.3	-179.4	0	0	0	0	0	115.1	L289	L289-G295 PolarHBondContact O-N 3.42Å
296	H	60.1	Low	66.1	Low	187 Å²	187	100.1 Å²	100.1	87%	0.866	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-13.3	179.6	-63.7	-68.9	0	0	0	114.9	I294	I294-H296 PolarHBondContact O-N 3.44Å
297	F	59.5	Low	67	Low	98 Å²	98	98.8 Å²	98.8	43%	0.43	48%	0.484	S	S	.	.	S	Bend	trans	-77.4	142	-176.3	-72.3	-98.7	0	0	0	111.2	I294 E301 L302	I294-F297 HydrophobicContact CB-CD2 4.16Å; I294-F297 HydrophobicContact CG2-CB 4.11Å; I294-F297 HydrophobicContact CG2-CD2 3.33Å; I294-F297 HydrophobicContact CG2-CE2 3.89Å; I294-F297 HydrophobicContact CG2-CG 3.83Å; I294-F297 PolarHBondContact O-N 2.55Å; F297-E301 WeakPolarHBondContact CA-OE2 3.43Å; F297-E301 HydrophobicContact CB-CB 4.19Å; F297-E301 HydrophobicContact CD1-CB 4.12Å; F297-E301 HydrophobicContact CD1-CG 4.45Å; F297-L302 HydrophobicContact CB-CG 4.18Å
298	S	65.8	Low	67.4	Low	45 Å²	45	94.3 Å²	94.3	32%	0.315	47%	0.473	S	S	.	.			trans	-66.6	159.4	-178.6	88.7	0	0	0	0	111.8	K300 E301 L302	S298-K300 PolarHBondContact O-N 3.07Å; S298-K300 PolarHBondContact OG-N 3.19Å; S298-E301 WeakPolarHBondContact CB-OE1 3.49Å; S298-E301 PolarHBondContact N-OE2 2.71Å; S298-E301 PolarHBondContact O-N 2.65Å; S298-E301 VanDerWaalsContact O-N 3.13Å; S298-E301 PolarHBondContact OG-N 2.74Å; S298-E301 PolarHBondContact OG-OE1 3.32Å; S298-L302 PolarHBondContact O-N 2.72Å
299	E	61.3	Low	67.8	Low	85 Å²	85	96.5 Å²	96.5	40%	0.397	48%	0.48	S	S	.	.	H	α-helix	trans	-60.5	-18.3	175.8	178.8	164.8	-173.9	0	0	113.2	K284 K303	K284-E299 WeakPolarHBondContact CE-OE1 3.26Å; K284-E299 IonicContact NZ-OE1 3.73Å; K284-E299 PolarHBondContact NZ-OE1 3.17Å; K284-E299 IonicContact NZ-OE2 3.48Å; K284-E299 PolarHBondContact NZ-OE2 3.11Å; E299-K303 HydrophobicContact CG-CD 4.21Å; E299-K303 WeakPolarHBondContact O-CD 3.41Å; E299-K303 VanDerWaalsContact O-CG 3.22Å; E299-K303 WeakPolarHBondContact O-CG 3.43Å; E299-K303 PolarHBondContact O-N 2.9Å; E299-K303 VanDerWaalsContact OE1-CE 3.27Å; E299-K303 WeakPolarHBondContact OE1-CE 3.49Å; E299-K303 IonicContact OE1-NZ 3.32Å; E299-K303 PolarHBondContact OE1-NZ 2.86Å
300	K	66.5	Low	67.7	Low	155 Å²	155	100.4 Å²	100.4	67%	0.674	50%	0.497	S	S	*	.	H	α-helix	trans	-77.2	-53.1	171.7	-63.4	179.4	-178.2	175	0	110.7	S298 L302 K303 E304	S298-K300 PolarHBondContact O-N 3.07Å; S298-K300 PolarHBondContact OG-N 3.19Å; K300-L302 VanDerWaalsContact C-N 3.3Å; K300-L302 PolarHBondContact O-N 2.68Å; K300-K303 CarbonylContact O-C 3.59Å; K300-K303 WeakPolarHBondContact O-CA 3.38Å; K300-K303 PolarHBondContact O-N 3.43Å; K300-E304 WeakPolarHBondContact O-CG 3.15Å; K300-E304 PolarHBondContact O-N 3.44Å
301	E	71.9	Confident	68	Low	86 Å²	86	98 Å²	98	40%	0.402	48%	0.483	S	S	.	.	H	α-helix	trans	-57.7	-40.5	177.9	-69.4	126.1	-118.6	0	0	112.4	F297 S298 K303 E304 R305	F297-E301 WeakPolarHBondContact CA-OE2 3.43Å; F297-E301 HydrophobicContact CB-CB 4.19Å; F297-E301 HydrophobicContact CD1-CB 4.12Å; F297-E301 HydrophobicContact CD1-CG 4.45Å; S298-E301 WeakPolarHBondContact CB-OE1 3.49Å; S298-E301 PolarHBondContact N-OE2 2.71Å; S298-E301 PolarHBondContact O-N 2.65Å; S298-E301 VanDerWaalsContact O-N 3.13Å; S298-E301 PolarHBondContact OG-N 2.74Å; S298-E301 PolarHBondContact OG-OE1 3.32Å; E301-K303 VanDerWaalsContact C-N 3.33Å; E301-K303 PolarHBondContact O-N 3.41Å; E301-E304 PolarHBondContact O-N 2.89Å; E301-R305 VanDerWaalsContact O-CB 3.29Å; E301-R305 WeakPolarHBondContact O-CB 3.25Å; E301-R305 PolarHBondContact O-N 2.89Å
302	L	68.3	Low	68	Low	30 Å²	30	94.3 Å²	94.3	16%	0.157	47%	0.469	C	S	.	.	H	α-helix	trans	-63.7	-37	175.6	-78.2	165.8	0	0	0	112.3	L289 I294 F297 S298 K300 N306	L289-L302 HydrophobicContact CD1-CD1 4.17Å; L289-L302 HydrophobicContact CD2-CD2 3.94Å; I294-L302 HydrophobicContact CG2-CD2 3.79Å; F297-L302 HydrophobicContact CB-CG 4.18Å; S298-L302 PolarHBondContact O-N 2.72Å; K300-L302 VanDerWaalsContact C-N 3.3Å; K300-L302 PolarHBondContact O-N 2.68Å; L302-N306 VanDerWaalsContact O-CB 3.31Å; L302-N306 WeakPolarHBondContact O-CB 3.18Å; L302-N306 PolarHBondContact O-N 3.38Å; L302-N306 VanDerWaalsContact O-N 3.1Å; L302-N306 PolarHBondContact O-ND2 3.44Å; L302-N306 VanDerWaalsContact O-ND2 3.17Å
303	K	68.1	Low	68	Low	111 Å²	111	90.6 Å²	90.6	48%	0.483	46%	0.456	S	S	.	.	H	α-helix	trans	-74.4	-37.3	175.7	-73.7	173.1	-171.7	174.2	0	111.9	E299 K300 E301 K307	E299-K303 HydrophobicContact CG-CD 4.21Å; E299-K303 WeakPolarHBondContact O-CD 3.41Å; E299-K303 VanDerWaalsContact O-CG 3.22Å; E299-K303 WeakPolarHBondContact O-CG 3.43Å; E299-K303 PolarHBondContact O-N 2.9Å; E299-K303 VanDerWaalsContact OE1-CE 3.27Å; E299-K303 WeakPolarHBondContact OE1-CE 3.49Å; E299-K303 IonicContact OE1-NZ 3.32Å; E299-K303 PolarHBondContact OE1-NZ 2.86Å; K300-K303 CarbonylContact O-C 3.59Å; K300-K303 WeakPolarHBondContact O-CA 3.38Å; K300-K303 PolarHBondContact O-N 3.43Å; E301-K303 VanDerWaalsContact C-N 3.33Å; E301-K303 PolarHBondContact O-N 3.41Å; K303-K307 VanDerWaalsContact O-CB 3.26Å; K303-K307 WeakPolarHBondContact O-CB 3.31Å; K303-K307 PolarHBondContact O-N 3.36Å
304	E	74.4	Confident	68.4	Low	119 Å²	119	93.9 Å²	93.9	56%	0.556	45%	0.451	S	S	*	.	H	α-helix	trans	-68.7	-44	176.7	-73.6	166.4	-161.7	0	0	111.4	K300 E301 K307 C308	K300-E304 WeakPolarHBondContact O-CG 3.15Å; K300-E304 PolarHBondContact O-N 3.44Å; E301-E304 PolarHBondContact O-N 2.89Å; E304-K307 WeakPolarHBondContact O-CB 3.44Å; E304-K307 PolarHBondContact O-N 2.92Å; E304-C308 PolarHBondContact O-N 2.88Å; E304-C308 PolarHBondContact O-SG 3.36Å; E304-C308 VanDerWaalsContact O-SG 3.34Å
305	R	71.6	Confident	68.9	Low	136 Å²	136	98.6 Å²	98.6	51%	0.513	47%	0.467	S	S	.	.	H	α-helix	trans	-61.2	-45.6	173.1	-172.2	173.6	-173.9	140	4.7	111.9	E301 K307 C308 I309	E301-R305 VanDerWaalsContact O-CB 3.29Å; E301-R305 WeakPolarHBondContact O-CB 3.25Å; E301-R305 PolarHBondContact O-N 2.89Å; R305-K307 VanDerWaalsContact C-N 3.33Å; R305-K307 PolarHBondContact O-N 2.97Å; R305-C308 PolarHBondContact O-N 2.9Å; R305-I309 HydrophobicContact CG-CD1 4.1Å; R305-I309 WeakPolarHBondContact O-CG1 3.25Å; R305-I309 PolarHBondContact O-N 2.76Å
306	N	71.9	Confident	69.7	Low	90 Å²	90	101.8 Å²	101.8	48%	0.481	47%	0.472	S	S	.	.	H	α-helix	trans	-64.1	-37.6	175.3	-74.7	-21.1	0	0	0	112.1	L302 I309 Q310	L302-N306 VanDerWaalsContact O-CB 3.31Å; L302-N306 WeakPolarHBondContact O-CB 3.18Å; L302-N306 PolarHBondContact O-N 3.38Å; L302-N306 VanDerWaalsContact O-N 3.1Å; L302-N306 PolarHBondContact O-ND2 3.44Å; L302-N306 VanDerWaalsContact O-ND2 3.17Å; N306-I309 PolarHBondContact O-N 3.3Å; N306-Q310 WeakPolarHBondContact O-CB 3.38Å; N306-Q310 VanDerWaalsContact O-CG 3.28Å; N306-Q310 WeakPolarHBondContact O-CG 3.23Å; N306-Q310 PolarHBondContact O-N 2.86Å
307	K	78.4	Confident	70.1	Confident	113 Å²	113	98.6 Å²	98.6	49%	0.491	46%	0.461	S	S	.	.	H	α-helix	trans	-63.2	-44.8	173.5	-179.8	178.7	179.8	-78.3	0	111.4	K303 E304 R305 Q310 E311	K303-K307 VanDerWaalsContact O-CB 3.26Å; K303-K307 WeakPolarHBondContact O-CB 3.31Å; K303-K307 PolarHBondContact O-N 3.36Å; E304-K307 WeakPolarHBondContact O-CB 3.44Å; E304-K307 PolarHBondContact O-N 2.92Å; R305-K307 VanDerWaalsContact C-N 3.33Å; R305-K307 PolarHBondContact O-N 2.97Å; K307-Q310 PolarHBondContact O-N 3.44Å; K307-E311 HydrophobicContact CG-CG 4.45Å; K307-E311 IonicContact NZ-OE1 2.65Å; K307-E311 PolarHBondContact NZ-OE1 2.81Å; K307-E311 VanDerWaalsContact O-CB 3.28Å; K307-E311 WeakPolarHBondContact O-CB 3.35Å; K307-E311 WeakPolarHBondContact O-CG 3.45Å; K307-E311 PolarHBondContact O-N 3.31Å
308	C	75.3	Confident	70.8	Confident	80 Å²	80	99 Å²	99	54%	0.541	46%	0.464	S	S	.	.	H	α-helix	trans	-60.1	-45.9	175.4	-69.9	0	0	0	0	111.4	E304 R305 Q310 E311 E312	E304-C308 PolarHBondContact O-N 2.88Å; E304-C308 PolarHBondContact O-SG 3.36Å; E304-C308 VanDerWaalsContact O-SG 3.34Å; R305-C308 PolarHBondContact O-N 2.9Å; C308-Q310 PolarHBondContact O-N 3.34Å; C308-E311 CarbonylContact O-C 3.55Å; C308-E311 WeakPolarHBondContact O-CB 3.45Å; C308-E311 PolarHBondContact O-N 2.97Å; C308-E311 VanDerWaalsContact O-N 3.15Å; C308-E312 WeakPolarHBondContact O-CB 3.45Å; C308-E312 PolarHBondContact O-N 2.93Å
309	I	75.6	Confident	71.7	Confident	71 Å²	71	103.3 Å²	103.3	36%	0.364	48%	0.477	S	S	.	.	H	α-helix	trans	-61.2	-41.4	176.2	-67.8	165	0	0	0	111.5	R305 N306 E312 N313	R305-I309 HydrophobicContact CG-CD1 4.1Å; R305-I309 WeakPolarHBondContact O-CG1 3.25Å; R305-I309 PolarHBondContact O-N 2.76Å; N306-I309 PolarHBondContact O-N 3.3Å; I309-E312 PolarHBondContact O-N 2.93Å; I309-N313 WeakPolarHBondContact CG2-ND2 3.29Å; I309-N313 WeakPolarHBondContact O-CB 3.12Å; I309-N313 PolarHBondContact O-N 3.38Å; I309-N313 PolarHBondContact O-ND2 3.24Å
310	Q	62.9	Low	72.4	Confident	129 Å²	129	102.2 Å²	102.2	60%	0.603	48%	0.476	S	S	*	.	H	α-helix	trans	-65.1	-39.1	174.1	-73.9	170.9	-5.3	0	0	112.4	N306 K307 C308 E312 R314	N306-Q310 WeakPolarHBondContact O-CB 3.38Å; N306-Q310 VanDerWaalsContact O-CG 3.28Å; N306-Q310 WeakPolarHBondContact O-CG 3.23Å; N306-Q310 PolarHBondContact O-N 2.86Å; K307-Q310 PolarHBondContact O-N 3.44Å; C308-Q310 PolarHBondContact O-N 3.34Å; Q310-E312 VanDerWaalsContact C-N 3.34Å; Q310-R314 VanDerWaalsContact O-CB 3.24Å; Q310-R314 WeakPolarHBondContact O-CB 3.5Å; Q310-R314 PolarHBondContact O-N 3.36Å
311	E	71.9	Confident	73	Confident	47 Å²	47	102 Å²	102	22%	0.22	48%	0.475	C	S	.	.	H	α-helix	trans	-70.4	-27.9	177.1	-83.7	-147.6	-139.9	0	0	113.8	K307 C308 R314 R315	K307-E311 HydrophobicContact CG-CG 4.45Å; K307-E311 IonicContact NZ-OE1 2.65Å; K307-E311 PolarHBondContact NZ-OE1 2.81Å; K307-E311 VanDerWaalsContact O-CB 3.28Å; K307-E311 WeakPolarHBondContact O-CB 3.35Å; K307-E311 WeakPolarHBondContact O-CG 3.45Å; K307-E311 PolarHBondContact O-N 3.31Å; C308-E311 CarbonylContact O-C 3.55Å; C308-E311 WeakPolarHBondContact O-CB 3.45Å; C308-E311 PolarHBondContact O-N 2.97Å; C308-E311 VanDerWaalsContact O-N 3.15Å; E311-R314 IonicContact OE2-NH2 3.5Å; E311-R314 PolarHBondContact OE2-NH2 3.22Å; E311-R314 VanDerWaalsContact OE2-NH2 3.13Å; E311-R315 WeakPolarHBondContact O-CG 3.43Å; E311-R315 PolarHBondContact O-N 2.92Å; E311-R315 PolarHBondContact O-NH1 2.85Å; E311-R315 IonicContact OE2-CZ 2.67Å; E311-R315 IonicContact OE2-NH1 2.65Å; E311-R315 PolarHBondContact OE2-NH1 3.4Å; E311-R315 IonicContact OE2-NH2 2.59Å
312	E	71.9	Confident	73.4	Confident	116 Å²	116	104.1 Å²	104.1	54%	0.542	49%	0.485	S	S	.	.	H	α-helix	trans	-77.1	-53.9	173.5	-175	162.3	-129.4	0	0	110.4	C308 I309 Q310 R314 R315 E316	C308-E312 WeakPolarHBondContact O-CB 3.45Å; C308-E312 PolarHBondContact O-N 2.93Å; I309-E312 PolarHBondContact O-N 2.93Å; Q310-E312 VanDerWaalsContact C-N 3.34Å; E312-R314 PolarHBondContact O-N 3.2Å; E312-R314 VanDerWaalsContact O-N 3.12Å; E312-R315 CarbonylContact O-C 3.54Å; E312-R315 WeakPolarHBondContact O-CA 3.2Å; E312-R315 WeakPolarHBondContact O-CB 3.3Å; E312-R315 PolarHBondContact O-N 2.93Å; E312-E316 PolarHBondContact O-N 3.35Å
313	N	67.4	Low	73.7	Confident	80 Å²	80	107.2 Å²	107.2	43%	0.428	50%	0.501	S	S	.	.	H	α-helix	trans	-51.5	-38.4	171.8	-85.8	-98.1	0	0	0	111.9	I309 E316 L317	I309-N313 WeakPolarHBondContact CG2-ND2 3.29Å; I309-N313 WeakPolarHBondContact O-CB 3.12Å; I309-N313 PolarHBondContact O-N 3.38Å; I309-N313 PolarHBondContact O-ND2 3.24Å; N313-E316 PolarHBondContact O-N 3.12Å; N313-L317 VanDerWaalsContact O-CB 3.31Å; N313-L317 WeakPolarHBondContact O-CB 3.49Å; N313-L317 VanDerWaalsContact O-CG 3.29Å; N313-L317 WeakPolarHBondContact O-CG 3.48Å; N313-L317 PolarHBondContact O-N 3.2Å
314	R	70.9	Confident	73.9	Confident	126 Å²	126	110.2 Å²	110.2	48%	0.475	51%	0.51	S	S	.	.	H	α-helix	trans	-66.2	-38.6	175.1	-175.9	-178.8	65.4	-162.4	-3.4	112.8	Q310 E311 E312 Q318	Q310-R314 VanDerWaalsContact O-CB 3.24Å; Q310-R314 WeakPolarHBondContact O-CB 3.5Å; Q310-R314 PolarHBondContact O-N 3.36Å; E311-R314 IonicContact OE2-NH2 3.5Å; E311-R314 PolarHBondContact OE2-NH2 3.22Å; E311-R314 VanDerWaalsContact OE2-NH2 3.13Å; E312-R314 PolarHBondContact O-N 3.2Å; E312-R314 VanDerWaalsContact O-N 3.12Å; R314-Q318 VanDerWaalsContact O-CG 3.27Å; R314-Q318 WeakPolarHBondContact O-CG 3.4Å; R314-Q318 PolarHBondContact O-N 2.91Å
315	R	73.6	Confident	74	Confident	130 Å²	130	107.9 Å²	107.9	49%	0.491	50%	0.501	S	S	.	.	H	α-helix	trans	-71	-37	175.4	-75.1	171.2	175	90.2	-7.9	111.2	E311 E312 Q318 K319	E311-R315 WeakPolarHBondContact O-CG 3.43Å; E311-R315 PolarHBondContact O-N 2.92Å; E311-R315 PolarHBondContact O-NH1 2.85Å; E311-R315 IonicContact OE2-CZ 2.67Å; E311-R315 IonicContact OE2-NH1 2.65Å; E311-R315 PolarHBondContact OE2-NH1 3.4Å; E311-R315 IonicContact OE2-NH2 2.59Å; E312-R315 CarbonylContact O-C 3.54Å; E312-R315 WeakPolarHBondContact O-CA 3.2Å; E312-R315 WeakPolarHBondContact O-CB 3.3Å; E312-R315 PolarHBondContact O-N 2.93Å; R315-Q318 WeakPolarHBondContact O-CB 3.45Å; R315-Q318 PolarHBondContact O-N 3.43Å; R315-K319 WeakPolarHBondContact O-CG 3.37Å; R315-K319 PolarHBondContact O-N 3Å
316	E	76.9	Confident	74.3	Confident	103 Å²	103	107.2 Å²	107.2	48%	0.481	50%	0.503	S	S	.	.	H	α-helix	trans	-65.9	-46.3	173.1	-67.4	-177.9	145.7	0	0	111.6	E312 N313 Q318 K319 V320	E312-E316 PolarHBondContact O-N 3.35Å; N313-E316 PolarHBondContact O-N 3.12Å; E316-Q318 PolarHBondContact O-N 3.46Å; E316-K319 PolarHBondContact O-N 3.41Å; E316-K319 VanDerWaalsContact O-N 3.12Å; E316-V320 WeakPolarHBondContact O-CB 3.42Å; E316-V320 WeakPolarHBondContact O-CG2 3.43Å; E316-V320 PolarHBondContact O-N 2.71Å
317	L	68.1	Low	74.4	Confident	121 Å²	121	111 Å²	111	63%	0.634	51%	0.511	S	S	*	.	H	α-helix	trans	-57.6	-35.8	171.8	-79.4	164.9	0	0	0	112.3	N313 K321	N313-L317 VanDerWaalsContact O-CB 3.31Å; N313-L317 WeakPolarHBondContact O-CB 3.49Å; N313-L317 VanDerWaalsContact O-CG 3.29Å; N313-L317 WeakPolarHBondContact O-CG 3.48Å; N313-L317 PolarHBondContact O-N 3.2Å; L317-K321 VanDerWaalsContact O-CB 3.23Å; L317-K321 WeakPolarHBondContact O-CB 3.43Å; L317-K321 PolarHBondContact O-N 3.3Å
318	Q	74.4	Confident	74.3	Confident	107 Å²	107	111.9 Å²	111.9	50%	0.5	52%	0.517	S	S	.	.	H	α-helix	trans	-67.7	-45.1	173.3	-76.9	171.2	-19.6	0	0	112.3	R314 R315 E316 K321 Q322	R314-Q318 VanDerWaalsContact O-CG 3.27Å; R314-Q318 WeakPolarHBondContact O-CG 3.4Å; R314-Q318 PolarHBondContact O-N 2.91Å; R315-Q318 WeakPolarHBondContact O-CB 3.45Å; R315-Q318 PolarHBondContact O-N 3.43Å; E316-Q318 PolarHBondContact O-N 3.46Å; Q318-K321 PolarHBondContact O-N 3.47Å; Q318-Q322 WeakPolarHBondContact O-CG 3.15Å; Q318-Q322 PolarHBondContact O-N 3.21Å
319	K	85.3	Confident	74.5	Confident	134 Å²	134	116.3 Å²	116.3	58%	0.583	52%	0.522	S	S	*	.	H	α-helix	trans	-61.5	-45	173.5	-71.7	176.8	178	-178.6	0	112	R315 E316 K321 Q322 L323	R315-K319 WeakPolarHBondContact O-CG 3.37Å; R315-K319 PolarHBondContact O-N 3Å; E316-K319 PolarHBondContact O-N 3.41Å; E316-K319 VanDerWaalsContact O-N 3.12Å; K319-K321 VanDerWaalsContact C-N 3.3Å; K319-K321 PolarHBondContact O-N 3.11Å; K319-Q322 WeakPolarHBondContact O-CB 3.27Å; K319-Q322 PolarHBondContact O-N 3.3Å; K319-L323 WeakPolarHBondContact O-CG 3.42Å; K319-L323 PolarHBondContact O-N 2.89Å
320	V	75.1	Confident	74.7	Confident	63 Å²	63	117.7 Å²	117.7	38%	0.382	53%	0.527	S	S	.	.	H	α-helix	trans	-62.7	-37.4	175.4	170.5	0	0	0	0	111	E316 R324	E316-V320 WeakPolarHBondContact O-CB 3.42Å; E316-V320 WeakPolarHBondContact O-CG2 3.43Å; E316-V320 PolarHBondContact O-N 2.71Å; V320-R324 WeakPolarHBondContact O-CB 3.41Å; V320-R324 WeakPolarHBondContact O-CG 3.4Å; V320-R324 PolarHBondContact O-N 3.18Å
321	K	79.3	Confident	75.5	Confident	149 Å²	149	118 Å²	118	65%	0.648	53%	0.526	S	S	*	.	H	α-helix	trans	-68	-37.6	173.7	-173.3	171.9	-178	174.6	0	112.3	L317 Q318 K319 L325	L317-K321 VanDerWaalsContact O-CB 3.23Å; L317-K321 WeakPolarHBondContact O-CB 3.43Å; L317-K321 PolarHBondContact O-N 3.3Å; Q318-K321 PolarHBondContact O-N 3.47Å; K319-K321 VanDerWaalsContact C-N 3.3Å; K319-K321 PolarHBondContact O-N 3.11Å; K321-L325 VanDerWaalsContact O-CB 3.31Å; K321-L325 WeakPolarHBondContact O-CB 3.13Å; K321-L325 PolarHBondContact O-N 3.19Å
322	Q	79.1	Confident	76.1	Confident	131 Å²	131	118 Å²	118	61%	0.612	54%	0.535	S	S	*	.	H	α-helix	trans	-63.6	-50.9	173.1	-74	167.8	-26.4	0	0	111.1	Q318 K319 R324 L325 E326	Q318-Q322 WeakPolarHBondContact O-CG 3.15Å; Q318-Q322 PolarHBondContact O-N 3.21Å; K319-Q322 WeakPolarHBondContact O-CB 3.27Å; K319-Q322 PolarHBondContact O-N 3.3Å; Q322-R324 VanDerWaalsContact C-N 3.3Å; Q322-R324 PolarHBondContact O-N 2.9Å; Q322-L325 CarbonylContact O-C 3.56Å; Q322-L325 PolarHBondContact O-N 2.85Å; Q322-L325 VanDerWaalsContact O-N 3.09Å; Q322-E326 WeakPolarHBondContact O-CB 3.25Å; Q322-E326 PolarHBondContact O-N 3.21Å
323	L	76.4	Confident	76.6	Confident	96 Å²	96	118.8 Å²	118.8	50%	0.503	54%	0.54	S	S	.	.	H	α-helix	trans	-61.6	-34.2	177.1	-70.2	167.7	0	0	0	113.1	K319 R327	K319-L323 WeakPolarHBondContact O-CG 3.42Å; K319-L323 PolarHBondContact O-N 2.89Å; L323-R327 VanDerWaalsContact O-CB 3.31Å; L323-R327 WeakPolarHBondContact O-CB 3.4Å; L323-R327 PolarHBondContact O-N 3.03Å; L323-R327 VanDerWaalsContact O-N 3.07Å
324	R	70.6	Confident	77	Confident	173 Å²	173	121.6 Å²	121.6	65%	0.653	54%	0.544	S	S	*	.	H	α-helix	trans	-65.3	-46.4	171.4	-77.3	174	-173.6	-160.4	3	111.5	V320 Q322 R327 E328	V320-R324 WeakPolarHBondContact O-CB 3.41Å; V320-R324 WeakPolarHBondContact O-CG 3.4Å; V320-R324 PolarHBondContact O-N 3.18Å; Q322-R324 VanDerWaalsContact C-N 3.3Å; Q322-R324 PolarHBondContact O-N 2.9Å; R324-R327 PolarHBondContact O-N 3.35Å; R324-E328 VanDerWaalsContact O-CB 3.24Å; R324-E328 WeakPolarHBondContact O-CB 3.33Å; R324-E328 PolarHBondContact O-N 2.88Å
325	L	76.5	Confident	77.2	Confident	71 Å²	71	120 Å²	120	37%	0.372	54%	0.543	S	S	.	.	H	α-helix	trans	-71	-30.4	-178.4	-172.8	147.9	0	0	0	112.5	K321 Q322 R329	K321-L325 VanDerWaalsContact O-CB 3.31Å; K321-L325 WeakPolarHBondContact O-CB 3.13Å; K321-L325 PolarHBondContact O-N 3.19Å; Q322-L325 CarbonylContact O-C 3.56Å; Q322-L325 PolarHBondContact O-N 2.85Å; Q322-L325 VanDerWaalsContact O-N 3.09Å; L325-R329 VanDerWaalsContact CD2-CZ 3.47Å; L325-R329 WeakPolarHBondContact O-CG 2.92Å; L325-R329 PolarHBondContact O-N 2.71Å
326	E	79	Confident	77.5	Confident	122 Å²	122	117.3 Å²	117.3	57%	0.57	54%	0.54	S	S	*	.	H	α-helix	trans	-67.2	-49.4	170.6	-177.9	168.1	-132.3	0	0	111.4	Q322 E328 R329 E330	Q322-E326 WeakPolarHBondContact O-CB 3.25Å; Q322-E326 PolarHBondContact O-N 3.21Å; E326-E328 VanDerWaalsContact C-N 3.27Å; E326-E328 PolarHBondContact O-N 3.37Å; E326-R329 WeakPolarHBondContact O-CB 3.25Å; E326-R329 PolarHBondContact O-N 3Å; E326-E330 PolarHBondContact O-N 3.5Å
327	R	74.4	Confident	77.8	Confident	169 Å²	169	118.2 Å²	118.2	64%	0.638	55%	0.545	S	S	*	.	H	α-helix	trans	-62.3	-33.3	173	-170.2	-177.1	-58.3	163.8	2.7	112.8	L323 R324 K331	L323-R327 VanDerWaalsContact O-CB 3.31Å; L323-R327 WeakPolarHBondContact O-CB 3.4Å; L323-R327 PolarHBondContact O-N 3.03Å; L323-R327 VanDerWaalsContact O-N 3.07Å; R324-R327 PolarHBondContact O-N 3.35Å; R327-K331 VanDerWaalsContact O-CB 3.25Å; R327-K331 WeakPolarHBondContact O-CB 3.33Å; R327-K331 PolarHBondContact O-N 2.7Å
328	E	75.3	Confident	78.5	Confident	131 Å²	131	116.4 Å²	116.4	61%	0.612	54%	0.535	S	S	*	.	H	α-helix	trans	-67.9	-41.3	174.6	-174.6	172.5	-153.8	0	0	111.4	R324 E326 A332	R324-E328 VanDerWaalsContact O-CB 3.24Å; R324-E328 WeakPolarHBondContact O-CB 3.33Å; R324-E328 PolarHBondContact O-N 2.88Å; E326-E328 VanDerWaalsContact C-N 3.27Å; E326-E328 PolarHBondContact O-N 3.37Å; E328-A332 VanDerWaalsContact O-CB 3.28Å; E328-A332 WeakPolarHBondContact O-CB 3.17Å; E328-A332 PolarHBondContact O-N 3.24Å
329	R	80.5	Confident	79.1	Confident	173 Å²	173	114.9 Å²	114.9	65%	0.653	53%	0.528	S	S	*	.	H	α-helix	trans	-64.7	-46	171	-75.9	170.3	174.8	169.7	-2.2	112.5	L325 E326 K331 A332 M333	L325-R329 VanDerWaalsContact CD2-CZ 3.47Å; L325-R329 WeakPolarHBondContact O-CG 2.92Å; L325-R329 PolarHBondContact O-N 2.71Å; E326-R329 WeakPolarHBondContact O-CB 3.25Å; E326-R329 PolarHBondContact O-N 3Å; R329-K331 VanDerWaalsContact C-N 3.34Å; R329-K331 PolarHBondContact O-N 2.68Å; R329-A332 PolarHBondContact O-N 3.12Å; R329-M333 WeakPolarHBondContact O-CG 3.34Å; R329-M333 PolarHBondContact O-N 2.97Å
330	E	80.1	Confident	79	Confident	101 Å²	101	113.8 Å²	113.8	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-60.4	-45.9	177.7	-169.6	-164.3	-170.3	0	0	110.8	E326 A332 M333 R334	E326-E330 PolarHBondContact O-N 3.5Å; E330-A332 PolarHBondContact O-N 2.64Å; E330-M333 PolarHBondContact O-N 3.34Å; E330-R334 PolarHBondContact O-N 3.04Å; E330-R334 VanDerWaalsContact O-N 3.11Å; E330-R334 IonicContact OE1-CZ 3.23Å; E330-R334 IonicContact OE1-NE 3.58Å; E330-R334 IonicContact OE1-NH2 2.86Å; E330-R334 PolarHBondContact OE1-NH2 3.17Å; E330-R334 IonicContact OE2-NH2 2.74Å
331	K	79.1	Confident	79.4	Confident	134 Å²	134	114.6 Å²	114.6	58%	0.583	53%	0.528	S	S	*	.	H	α-helix	trans	-59.9	-45	173.8	-170.7	-167.3	173.3	-151.9	0	111.2	R327 R329 M333 R334 E335	R327-K331 VanDerWaalsContact O-CB 3.25Å; R327-K331 WeakPolarHBondContact O-CB 3.33Å; R327-K331 PolarHBondContact O-N 2.7Å; R329-K331 VanDerWaalsContact C-N 3.34Å; R329-K331 PolarHBondContact O-N 2.68Å; K331-M333 PolarHBondContact O-N 2.86Å; K331-R334 PolarHBondContact O-N 2.96Å; K331-E335 IonicContact NZ-OE2 2.88Å; K331-E335 VanDerWaalsContact O-CB 3.23Å; K331-E335 WeakPolarHBondContact O-CB 3.47Å; K331-E335 PolarHBondContact O-N 2.87Å
332	A	84.9	Confident	79.7	Confident	48 Å²	48	110 Å²	110	40%	0.397	51%	0.509	S	S	.	.	H	α-helix	trans	-61.8	-41.1	178.6	0	0	0	0	0	112.3	E328 R329 E330 E335 T336	E328-A332 VanDerWaalsContact O-CB 3.28Å; E328-A332 WeakPolarHBondContact O-CB 3.17Å; E328-A332 PolarHBondContact O-N 3.24Å; R329-A332 PolarHBondContact O-N 3.12Å; E330-A332 PolarHBondContact O-N 2.64Å; A332-E335 PolarHBondContact O-N 2.81Å; A332-T336 PolarHBondContact O-N 3.21Å; A332-T336 PolarHBondContact O-OG1 3.32Å
333	M	80.8	Confident	79.9	Confident	133 Å²	133	110.5 Å²	110.5	66%	0.655	51%	0.505	S	S	*	.	H	α-helix	trans	-59.4	-52.2	174.8	-71.6	-60.8	-59.1	0	0	111.2	R329 E330 K331 E335 T336 E337	R329-M333 WeakPolarHBondContact O-CG 3.34Å; R329-M333 PolarHBondContact O-N 2.97Å; E330-M333 PolarHBondContact O-N 3.34Å; K331-M333 PolarHBondContact O-N 2.86Å; M333-E335 VanDerWaalsContact C-N 3.27Å; M333-E335 PolarHBondContact O-N 3.12Å; M333-T336 PolarHBondContact O-N 2.93Å; M333-T336 PolarHBondContact O-OG1 3.21Å; M333-E337 WeakPolarHBondContact O-CB 3.45Å; M333-E337 PolarHBondContact O-N 2.93Å
334	R	77.2	Confident	80.1	Confident	138 Å²	138	110.9 Å²	110.9	52%	0.521	51%	0.505	S	S	.	.	H	α-helix	trans	-63.8	-31.2	176.9	-60.9	-167.5	-145.9	154.2	-0.6	112.8	E330 K331 L338	E330-R334 PolarHBondContact O-N 3.04Å; E330-R334 VanDerWaalsContact O-N 3.11Å; E330-R334 IonicContact OE1-CZ 3.23Å; E330-R334 IonicContact OE1-NE 3.58Å; E330-R334 IonicContact OE1-NH2 2.86Å; E330-R334 PolarHBondContact OE1-NH2 3.17Å; E330-R334 IonicContact OE2-NH2 2.74Å; K331-R334 PolarHBondContact O-N 2.96Å; R334-L338 VanDerWaalsContact O-CB 3.32Å; R334-L338 WeakPolarHBondContact O-CB 3.39Å; R334-L338 VanDerWaalsContact O-CG 3.24Å; R334-L338 WeakPolarHBondContact O-CG 3.29Å; R334-L338 PolarHBondContact O-N 3.37Å
335	E	75.1	Confident	81	Confident	94 Å²	94	107.8 Å²	107.8	44%	0.439	50%	0.496	S	S	.	.	H	α-helix	trans	-70.2	-40.4	176.3	-174.5	154.7	-155.2	0	0	111.4	K331 A332 M333 E339	K331-E335 IonicContact NZ-OE2 2.88Å; K331-E335 VanDerWaalsContact O-CB 3.23Å; K331-E335 WeakPolarHBondContact O-CB 3.47Å; K331-E335 PolarHBondContact O-N 2.87Å; A332-E335 PolarHBondContact O-N 2.81Å; M333-E335 VanDerWaalsContact C-N 3.27Å; M333-E335 PolarHBondContact O-N 3.12Å; E335-E339 WeakPolarHBondContact O-CB 3.23Å; E335-E339 PolarHBondContact O-N 3.33Å
336	T	80	Confident	81.3	Confident	72 Å²	72	109.2 Å²	109.2	44%	0.442	50%	0.501	S	S	.	.	H	α-helix	trans	-68.1	-39.2	171.9	50.7	0	0	0	0	112.9	A332 M333 E339 M340	A332-T336 PolarHBondContact O-N 3.21Å; A332-T336 PolarHBondContact O-OG1 3.32Å; M333-T336 PolarHBondContact O-N 2.93Å; M333-T336 PolarHBondContact O-OG1 3.21Å; T336-E339 PolarHBondContact O-N 3.48Å; T336-E339 VanDerWaalsContact O-N 3.1Å; T336-M340 WeakPolarHBondContact O-CG 3.32Å; T336-M340 PolarHBondContact O-N 2.82Å
337	E	81.8	Confident	81.8	Confident	122 Å²	122	106.2 Å²	106.2	57%	0.57	50%	0.497	S	S	*	.	H	α-helix	trans	-61.7	-46.2	175.5	-177.1	178.7	-150.6	0	0	111.3	M333 E339 M340 L341	M333-E337 WeakPolarHBondContact O-CB 3.45Å; M333-E337 PolarHBondContact O-N 2.93Å; E337-E339 PolarHBondContact O-N 3.48Å; E337-M340 PolarHBondContact O-N 3.36Å; E337-L341 WeakPolarHBondContact O-CB 3.35Å; E337-L341 PolarHBondContact O-N 3.15Å
338	L	84.1	Confident	82.4	Confident	84 Å²	84	104 Å²	104	44%	0.44	49%	0.494	S	S	.	.	H	α-helix	trans	-67.1	-19.7	172.7	-73.6	170.7	0	0	0	113.9	R334 Q342	R334-L338 VanDerWaalsContact O-CB 3.32Å; R334-L338 WeakPolarHBondContact O-CB 3.39Å; R334-L338 VanDerWaalsContact O-CG 3.24Å; R334-L338 WeakPolarHBondContact O-CG 3.29Å; R334-L338 PolarHBondContact O-N 3.37Å; L338-Q342 WeakPolarHBondContact O-CB 3.27Å; L338-Q342 PolarHBondContact O-N 2.91Å
339	E	86.2	Confident	82.8	Confident	74 Å²	74	103.4 Å²	103.4	35%	0.346	49%	0.49	S	S	.	.	H	α-helix	trans	-84.5	-38.3	173.8	-159.9	-173.7	138.6	0	0	111.9	E335 T336 E337 Q342 R343	E335-E339 WeakPolarHBondContact O-CB 3.23Å; E335-E339 PolarHBondContact O-N 3.33Å; T336-E339 PolarHBondContact O-N 3.48Å; T336-E339 VanDerWaalsContact O-N 3.1Å; E337-E339 PolarHBondContact O-N 3.48Å; E339-Q342 PolarHBondContact O-N 3.42Å; E339-R343 PolarHBondContact O-N 2.95Å; E339-R343 IonicContact OE1-CZ 3.5Å; E339-R343 IonicContact OE1-NH1 3.76Å; E339-R343 PolarHBondContact OE1-NH1 3.4Å; E339-R343 IonicContact OE1-NH2 2.89Å; E339-R343 PolarHBondContact OE1-NH2 3.34Å
340	M	82.8	Confident	83.2	Confident	112 Å²	112	102.7 Å²	102.7	55%	0.552	49%	0.493	S	S	*	.	H	α-helix	trans	-63.9	-50.6	171.2	-64.5	-163.5	-45	0	0	110.5	T336 E337 Q342 R343 E344	T336-M340 WeakPolarHBondContact O-CG 3.32Å; T336-M340 PolarHBondContact O-N 2.82Å; E337-M340 PolarHBondContact O-N 3.36Å; M340-Q342 PolarHBondContact O-N 2.71Å; M340-Q342 VanDerWaalsContact O-N 3.16Å; M340-R343 CarbonylContact O-C 3.57Å; M340-R343 WeakPolarHBondContact O-CA 3.47Å; M340-R343 PolarHBondContact O-N 3.5Å; M340-E344 WeakPolarHBondContact O-CG 3.38Å; M340-E344 PolarHBondContact O-N 2.93Å
341	L	85.2	Confident	83.6	Confident	80 Å²	80	103.9 Å²	103.9	42%	0.419	50%	0.496	S	S	.	.	H	α-helix	trans	-66.8	-17.6	178.6	-170.7	137.1	0	0	0	113.5	E337 E344 K345	E337-L341 WeakPolarHBondContact O-CB 3.35Å; E337-L341 PolarHBondContact O-N 3.15Å; L341-E344 WeakPolarHBondContact CA-OE2 3.36Å; L341-K345 HydrophobicContact CD2-CD 4.28Å; L341-K345 WeakPolarHBondContact O-CD 3.41Å; L341-K345 WeakPolarHBondContact O-CG 3.38Å
342	Q	83.8	Confident	83.8	Confident	52 Å²	52	100.2 Å²	100.2	24%	0.243	49%	0.485	C	S	.	.	H	α-helix	trans	-78.9	-44.7	166.1	-176.5	174.9	-14.8	0	0	111.4	R51 L338 E339 M340 E344 K345 E346	R51-Q342 VanDerWaalsContact CZ-OE1 3.24Å; L338-Q342 WeakPolarHBondContact O-CB 3.27Å; L338-Q342 PolarHBondContact O-N 2.91Å; E339-Q342 PolarHBondContact O-N 3.42Å; M340-Q342 PolarHBondContact O-N 2.71Å; M340-Q342 VanDerWaalsContact O-N 3.16Å; Q342-E344 VanDerWaalsContact C-N 3.34Å; Q342-E344 PolarHBondContact O-N 3.44Å; Q342-K345 PolarHBondContact O-N 2.95Å; Q342-E346 HydrophobicContact CG-CG 4.4Å; Q342-E346 WeakPolarHBondContact CG-OE1 3.35Å; Q342-E346 PolarHBondContact NE2-OE1 3.41Å; Q342-E346 WeakPolarHBondContact O-CB 3.37Å; Q342-E346 WeakPolarHBondContact O-CG 3.16Å; Q342-E346 PolarHBondContact O-N 3.41Å
343	R	83.3	Confident	83.7	Confident	141 Å²	141	106.6 Å²	106.6	53%	0.532	50%	0.499	S	S	.	.	H	α-helix	trans	-63.5	-37.5	175.9	-78.5	-161.9	-176.4	81.2	11.7	113.3	E339 M340 E346 A347	E339-R343 PolarHBondContact O-N 2.95Å; E339-R343 IonicContact OE1-CZ 3.5Å; E339-R343 IonicContact OE1-NH1 3.76Å; E339-R343 PolarHBondContact OE1-NH1 3.4Å; E339-R343 IonicContact OE1-NH2 2.89Å; E339-R343 PolarHBondContact OE1-NH2 3.34Å; M340-R343 CarbonylContact O-C 3.57Å; M340-R343 WeakPolarHBondContact O-CA 3.47Å; M340-R343 PolarHBondContact O-N 3.5Å; R343-E346 PolarHBondContact O-N 2.91Å; R343-A347 VanDerWaalsContact O-CB 3.28Å; R343-A347 WeakPolarHBondContact O-CB 3.23Å; R343-A347 PolarHBondContact O-N 2.95Å
344	E	81.8	Confident	83.9	Confident	105 Å²	105	101.9 Å²	101.9	49%	0.491	48%	0.481	S	S	.	.	H	α-helix	trans	-60.2	-47.1	175.7	-73.7	160	-176.3	0	0	109.8	M340 L341 Q342 A347 E348	M340-E344 WeakPolarHBondContact O-CG 3.38Å; M340-E344 PolarHBondContact O-N 2.93Å; L341-E344 WeakPolarHBondContact CA-OE2 3.36Å; Q342-E344 VanDerWaalsContact C-N 3.34Å; Q342-E344 PolarHBondContact O-N 3.44Å; E344-A347 CarbonylContact O-C 3.6Å; E344-A347 PolarHBondContact O-N 3.15Å; E344-E348 WeakPolarHBondContact O-CG 3.48Å; E344-E348 PolarHBondContact O-N 3.26Å
345	K	89.1	Confident	84.3	Confident	107 Å²	107	99.9 Å²	99.9	47%	0.465	48%	0.477	S	S	.	.	H	α-helix	trans	-66.4	-38.1	174.7	-70.4	177.4	-179.2	-172.6	0	113.6	L341 Q342 A347 E348 H349	L341-K345 HydrophobicContact CD2-CD 4.28Å; L341-K345 WeakPolarHBondContact O-CD 3.41Å; L341-K345 WeakPolarHBondContact O-CG 3.38Å; Q342-K345 PolarHBondContact O-N 2.95Å; K345-A347 VanDerWaalsContact C-N 3.28Å; K345-A347 PolarHBondContact O-N 2.89Å; K345-E348 PolarHBondContact O-N 3.17Å; K345-H349 WeakPolarHBondContact O-CB 3.17Å; K345-H349 PolarHBondContact O-CD2 3.24Å; K345-H349 VanDerWaalsContact O-CG 3.28Å; K345-H349 PolarHBondContact O-N 3.05Å
346	E	82.4	Confident	84.8	Confident	102 Å²	102	101 Å²	101	48%	0.477	48%	0.483	S	S	.	.	H	α-helix	trans	-64.9	-34.1	173.9	-73.6	167.5	178.1	0	0	111.4	Q342 R343 F350	Q342-E346 HydrophobicContact CG-CG 4.4Å; Q342-E346 WeakPolarHBondContact CG-OE1 3.35Å; Q342-E346 PolarHBondContact NE2-OE1 3.41Å; Q342-E346 WeakPolarHBondContact O-CB 3.37Å; Q342-E346 WeakPolarHBondContact O-CG 3.16Å; Q342-E346 PolarHBondContact O-N 3.41Å; R343-E346 PolarHBondContact O-N 2.91Å; E346-F350 WeakPolarHBondContact O-CB 3.35Å; E346-F350 PolarHBondContact O-N 2.89Å
347	A	90.3	Very high	85.1	Confident	59 Å²	59	103.2 Å²	103.2	49%	0.488	49%	0.488	S	S	.	.	H	α-helix	trans	-76.7	-38.4	174.6	0	0	0	0	0	113.2	R343 E344 K345 F350 K351	R343-A347 VanDerWaalsContact O-CB 3.28Å; R343-A347 WeakPolarHBondContact O-CB 3.23Å; R343-A347 PolarHBondContact O-N 2.95Å; E344-A347 CarbonylContact O-C 3.6Å; E344-A347 PolarHBondContact O-N 3.15Å; K345-A347 VanDerWaalsContact C-N 3.28Å; K345-A347 PolarHBondContact O-N 2.89Å; A347-F350 PolarHBondContact O-N 2.98Å; A347-K351 WeakPolarHBondContact O-CB 3.49Å; A347-K351 PolarHBondContact O-N 3.29Å
348	E	86.4	Confident	85.2	Confident	123 Å²	123	101.2 Å²	101.2	58%	0.575	48%	0.481	S	S	*	.	H	α-helix	trans	-59.4	-47.8	170.1	-75.1	174.7	156.9	0	0	110.4	E344 K345 K351 T352	E344-E348 WeakPolarHBondContact O-CG 3.48Å; E344-E348 PolarHBondContact O-N 3.26Å; K345-E348 PolarHBondContact O-N 3.17Å; E348-K351 PolarHBondContact O-N 2.86Å; E348-T352 WeakPolarHBondContact O-CG2 3.5Å; E348-T352 PolarHBondContact O-N 2.8Å; E348-T352 PolarHBondContact O-OG1 3.35Å
349	H	83.9	Confident	85.1	Confident	117 Å²	117	100.8 Å²	100.8	54%	0.542	48%	0.479	S	S	.	.	H	α-helix	trans	-59	-50.3	173.4	-73.3	-44.4	0	0	0	111.3	K345 K351 T352 W353	K345-H349 WeakPolarHBondContact O-CB 3.17Å; K345-H349 PolarHBondContact O-CD2 3.24Å; K345-H349 VanDerWaalsContact O-CG 3.28Å; K345-H349 PolarHBondContact O-N 3.05Å; H349-K351 VanDerWaalsContact C-N 3.29Å; H349-K351 PolarHBondContact O-N 3.21Å; H349-T352 PolarHBondContact O-N 2.91Å; H349-T352 VanDerWaalsContact O-N 3.12Å; H349-T352 PolarHBondContact O-OG1 3.48Å; H349-W353 VanDerWaalsContact O-CD1 3.29Å; H349-W353 PolarHBondContact O-N 3.43Å
350	F	88.2	Confident	85.2	Confident	159 Å²	159	102.6 Å²	102.6	70%	0.697	49%	0.486	S	S	*	.	H	α-helix	trans	-56.9	-40.7	177.7	-172.3	-95.4	0	0	0	112.6	E346 A347 W353 A354	E346-F350 WeakPolarHBondContact O-CB 3.35Å; E346-F350 PolarHBondContact O-N 2.89Å; A347-F350 PolarHBondContact O-N 2.98Å; F350-W353 PolarHBondContact O-N 2.74Å; F350-A354 PolarHBondContact O-N 2.98Å
351	K	88.2	Confident	85.3	Confident	126 Å²	126	101.9 Å²	101.9	55%	0.548	48%	0.482	S	S	.	.	H	α-helix	trans	-62.1	-46.3	174.7	-175.1	174.9	-176.3	-69.2	0	112.1	A347 E348 H349 W353 A354 E355	A347-K351 WeakPolarHBondContact O-CB 3.49Å; A347-K351 PolarHBondContact O-N 3.29Å; E348-K351 PolarHBondContact O-N 2.86Å; H349-K351 VanDerWaalsContact C-N 3.29Å; H349-K351 PolarHBondContact O-N 3.21Å; K351-W353 PolarHBondContact O-N 2.89Å; K351-A354 PolarHBondContact O-N 2.89Å; K351-E355 IonicContact NZ-OE1 2.78Å; K351-E355 PolarHBondContact NZ-OE1 3.46Å; K351-E355 WeakPolarHBondContact O-CG 3.3Å; K351-E355 PolarHBondContact O-N 3.31Å
352	T	83.3	Confident	85.2	Confident	56 Å²	56	99.1 Å²	99.1	34%	0.344	47%	0.467	S	S	.	.	H	α-helix	trans	-66.9	-23.7	176.3	58.7	0	0	0	0	113.7	E348 H349 Q356	E348-T352 WeakPolarHBondContact O-CG2 3.5Å; E348-T352 PolarHBondContact O-N 2.8Å; E348-T352 PolarHBondContact O-OG1 3.35Å; H349-T352 PolarHBondContact O-N 2.91Å; H349-T352 VanDerWaalsContact O-N 3.12Å; H349-T352 PolarHBondContact O-OG1 3.48Å; T352-Q356 VanDerWaalsContact O-CG 3.25Å; T352-Q356 WeakPolarHBondContact O-CG 3.28Å; T352-Q356 PolarHBondContact O-N 3.04Å; T352-Q356 PolarHBondContact O-NE2 3.25Å
353	W	83.2	Confident	85.2	Confident	183 Å²	183	101.9 Å²	101.9	69%	0.693	48%	0.48	S	S	*	.	H	α-helix	trans	-75.8	-43.4	172.2	-88.2	74.3	0	0	0	111.7	H349 F350 K351 E355 Q356 E357	H349-W353 VanDerWaalsContact O-CD1 3.29Å; H349-W353 PolarHBondContact O-N 3.43Å; F350-W353 PolarHBondContact O-N 2.74Å; K351-W353 PolarHBondContact O-N 2.89Å; W353-E355 VanDerWaalsContact C-N 3.35Å; W353-E355 PolarHBondContact O-N 3.1Å; W353-Q356 WeakPolarHBondContact O-CB 3.48Å; W353-Q356 PolarHBondContact O-N 2.9Å; W353-Q356 VanDerWaalsContact O-N 3.1Å; W353-E357 PolarHBondContact O-N 3.17Å
354	A	85.2	Confident	85.3	Confident	34 Å²	34	98.6 Å²	98.6	28%	0.281	47%	0.471	S	S	.	.	H	α-helix	trans	-58.6	-45.6	173.2	0	0	0	0	0	111.6	F350 K351 Q356 E357 D358	F350-A354 PolarHBondContact O-N 2.98Å; K351-A354 PolarHBondContact O-N 2.89Å; A354-Q356 PolarHBondContact O-N 2.79Å; A354-E357 PolarHBondContact O-N 2.69Å; A354-D358 PolarHBondContact O-N 3.29Å
355	E	85.8	Confident	85.4	Confident	95 Å²	95	94.8 Å²	94.8	44%	0.444	46%	0.457	S	S	.	.	H	α-helix	trans	-61.8	-25.6	175.9	-70.9	168.4	178.7	0	0	113.7	K351 W353 N359	K351-E355 IonicContact NZ-OE1 2.78Å; K351-E355 PolarHBondContact NZ-OE1 3.46Å; K351-E355 WeakPolarHBondContact O-CG 3.3Å; K351-E355 PolarHBondContact O-N 3.31Å; W353-E355 VanDerWaalsContact C-N 3.35Å; W353-E355 PolarHBondContact O-N 3.1Å; E355-N359 WeakPolarHBondContact O-CB 3.48Å; E355-N359 PolarHBondContact O-N 2.92Å
356	Q	86.1	Confident	85.2	Confident	117 Å²	117	93.1 Å²	93.1	55%	0.547	45%	0.45	S	S	.	.	H	α-helix	trans	-81.7	-36.5	173.1	-75.3	167.1	50.7	0	0	112.1	T352 W353 A354 F360	T352-Q356 VanDerWaalsContact O-CG 3.25Å; T352-Q356 WeakPolarHBondContact O-CG 3.28Å; T352-Q356 PolarHBondContact O-N 3.04Å; T352-Q356 PolarHBondContact O-NE2 3.25Å; W353-Q356 WeakPolarHBondContact O-CB 3.48Å; W353-Q356 PolarHBondContact O-N 2.9Å; W353-Q356 VanDerWaalsContact O-N 3.1Å; A354-Q356 PolarHBondContact O-N 2.79Å; Q356-F360 WeakPolarHBondContact O-CB 3.47Å; Q356-F360 PolarHBondContact O-N 3.24Å
357	E	85.5	Confident	85.3	Confident	119 Å²	119	92.5 Å²	92.5	56%	0.556	45%	0.449	S	S	*	.	H	α-helix	trans	-65.8	-45.3	174.9	-173.9	162.1	-140.2	0	0	111.1	W353 A354 N359 F360 H361	W353-E357 PolarHBondContact O-N 3.17Å; A354-E357 PolarHBondContact O-N 2.69Å; E357-N359 PolarHBondContact O-N 3.14Å; E357-F360 WeakPolarHBondContact O-CB 3.48Å; E357-F360 PolarHBondContact O-N 3Å; E357-H361 PolarHBondContact O-CD2 2.85Å; E357-H361 PolarHBondContact O-N 2.89Å
358	D	83.6	Confident	85.1	Confident	81 Å²	81	96.6 Å²	96.6	43%	0.433	45%	0.452	S	S	.	.	H	α-helix	trans	-57.5	-47.5	173.1	-70.5	-28.1	0	0	0	111.9	A354 F360 H361 L362 L427	A354-D358 PolarHBondContact O-N 3.29Å; D358-F360 PolarHBondContact O-N 3.41Å; D358-H361 PolarHBondContact O-N 3.33Å; D358-L362 PolarHBondContact O-N 2.97Å; D358-L427 HydrophobicContact CB-CD2 3.78Å
359	N	83.8	Confident	85.1	Confident	74 Å²	74	91 Å²	91	40%	0.396	43%	0.426	S	S	.	.	H	α-helix	trans	-65.1	-38.6	177.4	-170.8	-3.2	0	0	0	111.7	E355 E357 L362 Q363	E355-N359 WeakPolarHBondContact O-CB 3.48Å; E355-N359 PolarHBondContact O-N 2.92Å; E357-N359 PolarHBondContact O-N 3.14Å; N359-L362 PolarHBondContact O-N 3.44Å; N359-Q363 VanDerWaalsContact O-CG 3.31Å; N359-Q363 WeakPolarHBondContact O-CG 3.23Å; N359-Q363 PolarHBondContact O-N 2.86Å; N359-Q363 PolarHBondContact OD1-NE2 3.06Å
360	F	87.6	Confident	85.2	Confident	112 Å²	112	89.7 Å²	89.7	49%	0.491	42%	0.419	S	S	.	.	H	α-helix	trans	-63.3	-42.5	172.6	178.4	-101.5	0	0	0	111.7	Q356 E357 D358 L362 Q363 Q364	Q356-F360 WeakPolarHBondContact O-CB 3.47Å; Q356-F360 PolarHBondContact O-N 3.24Å; E357-F360 WeakPolarHBondContact O-CB 3.48Å; E357-F360 PolarHBondContact O-N 3Å; D358-F360 PolarHBondContact O-N 3.41Å; F360-L362 PolarHBondContact O-N 3.22Å; F360-Q363 PolarHBondContact O-N 2.76Å; F360-Q364 HydrophobicContact CD1-CG 4.09Å; F360-Q364 HydrophobicContact CD2-CG 4.38Å; F360-Q364 HydrophobicContact CE1-CG 3.65Å; F360-Q364 HydrophobicContact CE2-CG 3.98Å; F360-Q364 HydrophobicContact CG-CG 4.44Å; F360-Q364 HydrophobicContact CZ-CG 3.59Å; F360-Q364 WeakPolarHBondContact O-CB 3.32Å; F360-Q364 VanDerWaalsContact O-CG 3.32Å; F360-Q364 WeakPolarHBondContact O-CG 3.45Å; F360-Q364 PolarHBondContact O-N 2.69Å
361	H	83.9	Confident	85	Confident	98 Å²	98	85.2 Å²	85.2	45%	0.454	40%	0.402	S	S	.	.	H	α-helix	trans	-61.3	-42.2	174.2	-73.1	-49.6	0	0	0	112.3	E357 D358 Q364 A365	E357-H361 PolarHBondContact O-CD2 2.85Å; E357-H361 PolarHBondContact O-N 2.89Å; D358-H361 PolarHBondContact O-N 3.33Å; H361-Q364 PolarHBondContact O-N 3.26Å; H361-A365 WeakPolarHBondContact O-CB 3.25Å; H361-A365 PolarHBondContact O-N 3.18Å
362	L	83.3	Confident	85	Confident	22 Å²	22	82 Å²	82	12%	0.115	39%	0.386	C	S	.	.	H	α-helix	trans	-60.3	-45.6	173.6	-178.8	60.1	0	0	0	111.9	D358 N359 F360 A365 K366 Y424 L427	D358-L362 PolarHBondContact O-N 2.97Å; N359-L362 PolarHBondContact O-N 3.44Å; F360-L362 PolarHBondContact O-N 3.22Å; L362-A365 PolarHBondContact O-N 2.99Å; L362-K366 WeakPolarHBondContact O-CG 3.43Å; L362-K366 PolarHBondContact O-N 3.01Å; L362-Y424 HydrophobicContact CD1-CD1 4.09Å; L362-Y424 HydrophobicContact CD1-CE1 4.02Å; L362-L427 HydrophobicContact CB-CB 4.25Å; L362-L427 HydrophobicContact CB-CD1 4.09Å; L362-L427 HydrophobicContact CD1-CB 4Å; L362-L427 HydrophobicContact CD1-CD1 4.26Å; L362-L427 HydrophobicContact CD2-CB 4.26Å; L362-L427 HydrophobicContact CG-CB 4.39Å
363	Q	83.4	Confident	85.2	Confident	110 Å²	110	81.2 Å²	81.2	51%	0.514	38%	0.38	S	S	.	.	H	α-helix	trans	-64.7	-41.6	177.7	-70.8	173.6	32	0	0	112	N359 F360 K366 L367	N359-Q363 VanDerWaalsContact O-CG 3.31Å; N359-Q363 WeakPolarHBondContact O-CG 3.23Å; N359-Q363 PolarHBondContact O-N 2.86Å; N359-Q363 PolarHBondContact OD1-NE2 3.06Å; F360-Q363 PolarHBondContact O-N 2.76Å; Q363-K366 PolarHBondContact O-N 3.14Å; Q363-L367 WeakPolarHBondContact O-CB 3.38Å; Q363-L367 PolarHBondContact O-N 3.26Å
364	Q	85.4	Confident	85.3	Confident	72 Å²	72	80.7 Å²	80.7	34%	0.336	38%	0.377	S	S	.	.	H	α-helix	trans	-65.5	-36.5	174.1	-70.7	-59.6	-46.1	0	0	112.2	F360 H361 R368	F360-Q364 HydrophobicContact CD1-CG 4.09Å; F360-Q364 HydrophobicContact CD2-CG 4.38Å; F360-Q364 HydrophobicContact CE1-CG 3.65Å; F360-Q364 HydrophobicContact CE2-CG 3.98Å; F360-Q364 HydrophobicContact CG-CG 4.44Å; F360-Q364 HydrophobicContact CZ-CG 3.59Å; F360-Q364 WeakPolarHBondContact O-CB 3.32Å; F360-Q364 VanDerWaalsContact O-CG 3.32Å; F360-Q364 WeakPolarHBondContact O-CG 3.45Å; F360-Q364 PolarHBondContact O-N 2.69Å; H361-Q364 PolarHBondContact O-N 3.26Å; Q364-R368 VanDerWaalsContact O-CB 3.31Å; Q364-R368 WeakPolarHBondContact O-CB 3.44Å; Q364-R368 WeakPolarHBondContact O-CG 3.49Å; Q364-R368 PolarHBondContact O-N 3.31Å
365	A	85.6	Confident	85.4	Confident	24 Å²	24	82.2 Å²	82.2	20%	0.198	38%	0.381	C	S	.	.	H	α-helix	trans	-64	-48.1	173.9	0	0	0	0	0	111.4	H361 L362 L367 R368 S369	H361-A365 WeakPolarHBondContact O-CB 3.25Å; H361-A365 PolarHBondContact O-N 3.18Å; L362-A365 PolarHBondContact O-N 2.99Å; A365-L367 PolarHBondContact O-N 2.99Å; A365-R368 PolarHBondContact O-N 2.98Å; A365-S369 WeakPolarHBondContact O-CB 3.36Å; A365-S369 PolarHBondContact O-N 3.04Å
366	K	83.6	Confident	85.4	Confident	72 Å²	72	81.1 Å²	81.1	31%	0.313	40%	0.395	S	S	.	.	H	α-helix	trans	-60	-43.9	174.7	-71	-164.2	179.2	-149.1	0	112.5	L362 Q363 S369 K370 S389	L362-K366 WeakPolarHBondContact O-CG 3.43Å; L362-K366 PolarHBondContact O-N 3.01Å; Q363-K366 PolarHBondContact O-N 3.14Å; K366-S369 WeakPolarHBondContact O-CB 3.46Å; K366-S369 PolarHBondContact O-N 2.92Å; K366-K370 PolarHBondContact O-N 3.22Å; K366-S389 PolarHBondContact NZ-OG 3.44Å
367	L	85.2	Confident	85.5	Confident	90 Å²	90	83.1 Å²	83.1	47%	0.471	40%	0.398	S	S	.	.	H	α-helix	trans	-64.5	-43.9	178	-178.3	61.1	0	0	0	112	Q363 A365 S369 K370 I371	Q363-L367 WeakPolarHBondContact O-CB 3.38Å; Q363-L367 PolarHBondContact O-N 3.26Å; A365-L367 PolarHBondContact O-N 2.99Å; L367-S369 VanDerWaalsContact C-N 3.33Å; L367-S369 PolarHBondContact O-N 2.81Å; L367-K370 PolarHBondContact O-N 3.48Å; L367-I371 HydrophobicContact CD1-CD1 4.41Å; L367-I371 HydrophobicContact CG-CD1 4.21Å; L367-I371 WeakPolarHBondContact O-CG1 3.47Å; L367-I371 PolarHBondContact O-N 2.99Å
368	R	86.1	Confident	85.5	Confident	145 Å²	145	79.3 Å²	79.3	55%	0.547	39%	0.387	S	S	.	.	H	α-helix	trans	-65.2	-35.1	176.2	-71.5	170.7	74.2	-146.9	3.9	112.1	Q364 A365 R372	Q364-R368 VanDerWaalsContact O-CB 3.31Å; Q364-R368 WeakPolarHBondContact O-CB 3.44Å; Q364-R368 WeakPolarHBondContact O-CG 3.49Å; Q364-R368 PolarHBondContact O-N 3.31Å; A365-R368 PolarHBondContact O-N 2.98Å; R368-R372 WeakPolarHBondContact O-CB 3.36Å; R368-R372 WeakPolarHBondContact O-CG 3.22Å; R368-R372 PolarHBondContact O-N 3.17Å
369	S	86.3	Confident	85.7	Confident	5 Å²	5	78.9 Å²	78.9	4%	0.035	38%	0.381	C	S	.	.	H	α-helix	trans	-61	-54.6	169.9	162.5	0	0	0	0	111.1	A365 K366 L367 I371 R372 I373 D382	A365-S369 WeakPolarHBondContact O-CB 3.36Å; A365-S369 PolarHBondContact O-N 3.04Å; K366-S369 WeakPolarHBondContact O-CB 3.46Å; K366-S369 PolarHBondContact O-N 2.92Å; L367-S369 VanDerWaalsContact C-N 3.33Å; L367-S369 PolarHBondContact O-N 2.81Å; S369-I371 PolarHBondContact O-N 3.32Å; S369-I371 VanDerWaalsContact O-N 3.14Å; S369-R372 PolarHBondContact O-N 3.43Å; S369-I373 WeakPolarHBondContact O-CG1 3.4Å; S369-I373 PolarHBondContact O-N 3.36Å; S369-D382 WeakPolarHBondContact CB-OD1 3.49Å; S369-D382 WeakPolarHBondContact OG-CA 3.45Å; S369-D382 WeakPolarHBondContact OG-CB 3.46Å; S369-D382 PolarHBondContact OG-O 3.27Å
370	K	85.3	Confident	85.8	Confident	90 Å²	90	76.9 Å²	76.9	39%	0.391	37%	0.372	S	S	.	.	H	α-helix	trans	-57.9	-31.6	179.5	-165.8	168	-173.1	172	0	112.9	K366 L367 R374 D393	K366-K370 PolarHBondContact O-N 3.22Å; L367-K370 PolarHBondContact O-N 3.48Å; K370-R374 PolarHBondContact O-N 3.49Å; K370-D393 WeakPolarHBondContact CE-OD2 3.18Å; K370-D393 IonicContact NZ-OD1 3.93Å; K370-D393 PolarHBondContact NZ-OD1 3.1Å; K370-D393 IonicContact NZ-OD2 3.52Å; K370-D393 PolarHBondContact NZ-OD2 3.4Å
371	I	85.5	Confident	85.9	Confident	65 Å²	65	71.7 Å²	71.7	33%	0.333	35%	0.349	S	S	.	.	H	α-helix	trans	-71.4	-54.4	170.8	-65.1	163.8	0	0	0	111.3	L367 S369 I373 R374 D375	L367-I371 HydrophobicContact CD1-CD1 4.41Å; L367-I371 HydrophobicContact CG-CD1 4.21Å; L367-I371 WeakPolarHBondContact O-CG1 3.47Å; L367-I371 PolarHBondContact O-N 2.99Å; S369-I371 PolarHBondContact O-N 3.32Å; S369-I371 VanDerWaalsContact O-N 3.14Å; I371-I373 PolarHBondContact O-N 2.94Å; I371-R374 WeakPolarHBondContact O-CB 3.26Å; I371-R374 PolarHBondContact O-N 2.64Å; I371-D375 VanDerWaalsContact O-CG 3.23Å; I371-D375 PolarHBondContact O-N 2.98Å
372	R	88.4	Confident	86.1	Confident	57 Å²	57	67.1 Å²	67.1	22%	0.215	33%	0.328	C	S	.	.	H	α-helix	trans	-57.1	-34.8	-178.8	-81.9	-171.7	-114.2	127.7	-0.3	113.6	R368 S369 D375 G376 R377 A378 D382	R368-R372 WeakPolarHBondContact O-CB 3.36Å; R368-R372 WeakPolarHBondContact O-CG 3.22Å; R368-R372 PolarHBondContact O-N 3.17Å; S369-R372 PolarHBondContact O-N 3.43Å; R372-D375 PolarHBondContact O-N 3.45Å; R372-G376 PolarHBondContact O-N 3.41Å; R372-R377 CarbonylContact O-C 3.49Å; R372-R377 WeakPolarHBondContact O-CA 3.15Å; R372-R377 PolarHBondContact O-N 3.37Å; R372-A378 PolarHBondContact O-N 2.89Å; R372-D382 WeakPolarHBondContact CD-OD2 3.35Å; R372-D382 IonicContact CZ-OD1 2.71Å; R372-D382 IonicContact CZ-OD2 2.65Å; R372-D382 IonicContact NE-OD2 3.19Å; R372-D382 IonicContact NH1-OD1 2.72Å; R372-D382 PolarHBondContact NH1-OD1 3.14Å; R372-D382 IonicContact NH1-OD2 2.68Å; R372-D382 PolarHBondContact NH1-OD2 3.35Å
373	I	86.4	Confident	86.2	Confident	40 Å²	40	67.9 Å²	67.9	21%	0.205	33%	0.332	C	S	.	.	H	α-helix	trans	-67.4	-45.9	175.2	-64.7	170.9	0	0	0	111.1	S369 I371 D375 G376 A378 D382 L383 K386	S369-I373 WeakPolarHBondContact O-CG1 3.4Å; S369-I373 PolarHBondContact O-N 3.36Å; I371-I373 PolarHBondContact O-N 2.94Å; I373-D375 VanDerWaalsContact C-N 3.27Å; I373-D375 PolarHBondContact O-N 2.86Å; I373-G376 PolarHBondContact O-N 3Å; I373-A378 HydrophobicContact CG1-CB 3.84Å; I373-D382 HydrophobicContact CD1-CB 4.02Å; I373-D382 HydrophobicContact CG1-CB 3.95Å; I373-L383 HydrophobicContact CG1-CD2 4.38Å; I373-K386 HydrophobicContact CD1-CB 3.75Å; I373-K386 HydrophobicContact CD1-CD 3.8Å; I373-K386 HydrophobicContact CD1-CG 4.29Å; I373-K386 HydrophobicContact CG2-CD 4.34Å
374	R	85.9	Confident	86.3	Confident	172 Å²	172	62.7 Å²	62.7	65%	0.649	31%	0.308	S	S	*	.	H	α-helix	trans	-61.6	-37.8	175.4	-164.2	-165.3	-53.8	105.8	-1.4	112	K370 I371 G376	K370-R374 PolarHBondContact O-N 3.49Å; I371-R374 WeakPolarHBondContact O-CB 3.26Å; I371-R374 PolarHBondContact O-N 2.64Å; R374-G376 PolarHBondContact O-N 3.3Å
375	D	87.9	Confident	86.4	Confident	67 Å²	67	59.4 Å²	59.4	36%	0.358	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-0.1	179	-66.1	5.1	0	0	0	114.2	I371 R372 I373 R377	I371-D375 VanDerWaalsContact O-CG 3.23Å; I371-D375 PolarHBondContact O-N 2.98Å; R372-D375 PolarHBondContact O-N 3.45Å; I373-D375 VanDerWaalsContact C-N 3.27Å; I373-D375 PolarHBondContact O-N 2.86Å; D375-R377 HydrophobicContact CB-CB 4.46Å; D375-R377 VanDerWaalsContact CB-CZ 3.48Å; D375-R377 VanDerWaalsContact CG-NH2 3.33Å; D375-R377 PolarHBondContact O-N 2.66Å; D375-R377 IonicContact OD2-CZ 2.91Å; D375-R377 IonicContact OD2-NH1 3.69Å; D375-R377 PolarHBondContact OD2-NH1 3.01Å; D375-R377 IonicContact OD2-NH2 2.74Å; D375-R377 PolarHBondContact OD2-NH2 2.89Å
376	G	85.3	Confident	86.2	Confident	72 Å²	72	62 Å²	62	74%	0.742	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	11.3	-173.8	0	0	0	0	0	114.7	R372 I373 R374	R372-G376 PolarHBondContact O-N 3.41Å; I373-G376 PolarHBondContact O-N 3Å; R374-G376 PolarHBondContact O-N 3.3Å
377	R	87.4	Confident	86	Confident	158 Å²	158	60.3 Å²	60.3	60%	0.596	29%	0.292	S	S	*	.			trans	-116.5	39.9	-175.6	-69.6	-174	-91.7	84.8	-3.2	111.7	R372 D375	R372-R377 CarbonylContact O-C 3.49Å; R372-R377 WeakPolarHBondContact O-CA 3.15Å; R372-R377 PolarHBondContact O-N 3.37Å; D375-R377 HydrophobicContact CB-CB 4.46Å; D375-R377 VanDerWaalsContact CB-CZ 3.48Å; D375-R377 VanDerWaalsContact CG-NH2 3.33Å; D375-R377 PolarHBondContact O-N 2.66Å; D375-R377 IonicContact OD2-CZ 2.91Å; D375-R377 IonicContact OD2-NH1 3.69Å; D375-R377 PolarHBondContact OD2-NH1 3.01Å; D375-R377 IonicContact OD2-NH2 2.74Å; D375-R377 PolarHBondContact OD2-NH2 2.89Å
378	A	85.9	Confident	85.7	Confident	39 Å²	39	56.9 Å²	56.9	32%	0.322	27%	0.274	S	S	.	.			trans	-63.7	131.4	-179.9	0	0	0	0	0	111.4	R372 I373 D382 L383	R372-A378 PolarHBondContact O-N 2.89Å; I373-A378 HydrophobicContact CG1-CB 3.84Å; A378-D382 HydrophobicContact CB-CB 4.47Å; A378-L383 HydrophobicContact CB-CD2 3.78Å; A378-L383 HydrophobicContact CB-CG 4.01Å
379	K	87.8	Confident	85	Confident	73 Å²	73	51 Å²	51	32%	0.317	26%	0.255	S	S	.	.			trans	-72.4	158.1	160	-87.6	-164	160.9	-145.6	0	109.8	I381 D382 L383 D416 D420	K379-I381 VanDerWaalsContact C-N 3.26Å; K379-I381 HydrophobicContact CB-CG2 3.84Å; K379-I381 HydrophobicContact CD-CG2 4.03Å; K379-I381 PolarHBondContact O-N 3.07Å; K379-D382 WeakPolarHBondContact CB-OD2 3.39Å; K379-D382 PolarHBondContact N-OD2 3Å; K379-D382 WeakPolarHBondContact O-CB 3.35Å; K379-D382 PolarHBondContact O-N 2.89Å; K379-L383 PolarHBondContact O-N 2.89Å; K379-D416 IonicContact NZ-OD2 2.72Å; K379-D416 PolarHBondContact NZ-OD2 2.84Å; K379-D420 IonicContact NZ-OD2 2.88Å; K379-D420 PolarHBondContact NZ-OD2 3.28Å
380	P	85.7	Confident	83.6	Confident	31 Å²	31	51.8 Å²	51.8	20%	0.201	26%	0.262	C	S	.	.	H	α-helix	trans	-53.4	-39.5	169.4	-26.1	34.7	0	0	0	113.6	D382 L383 L384 L409 L417	P380-D382 VanDerWaalsContact C-N 3.29Å; P380-D382 PolarHBondContact O-N 2.9Å; P380-L383 PolarHBondContact O-N 3.43Å; P380-L384 WeakPolarHBondContact O-CG 3.42Å; P380-L384 PolarHBondContact O-N 3.38Å; P380-L384 VanDerWaalsContact O-N 3.15Å; P380-L409 HydrophobicContact CB-CD2 3.87Å; P380-L409 HydrophobicContact CG-CD1 4.24Å; P380-L409 HydrophobicContact CG-CD2 3.53Å; P380-L409 HydrophobicContact CG-CG 4Å; P380-L417 HydrophobicContact CB-CD1 4.36Å; P380-L417 HydrophobicContact CB-CD2 4.18Å
381	I	89.6	Confident	82.2	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-63.2	-33.5	173.9	-171	69.4	0	0	0	112.5	K379 L384 A385 L417 D420 I421 Y424 W436	K379-I381 VanDerWaalsContact C-N 3.26Å; K379-I381 HydrophobicContact CB-CG2 3.84Å; K379-I381 HydrophobicContact CD-CG2 4.03Å; K379-I381 PolarHBondContact O-N 3.07Å; I381-L384 PolarHBondContact O-N 3.39Å; I381-A385 VanDerWaalsContact O-CB 3.25Å; I381-A385 WeakPolarHBondContact O-CB 3.19Å; I381-A385 PolarHBondContact O-N 2.71Å; I381-L417 HydrophobicContact CB-CD1 3.87Å; I381-L417 HydrophobicContact CD1-CD1 4.08Å; I381-D420 HydrophobicContact CB-CB 3.99Å; I381-D420 HydrophobicContact CD1-CB 4.22Å; I381-D420 HydrophobicContact CG1-CB 3.91Å; I381-D420 HydrophobicContact CG2-CB 4.1Å; I381-I421 HydrophobicContact CD1-CG1 3.87Å; I381-Y424 HydrophobicContact CD1-CD2 3.8Å; I381-Y424 HydrophobicContact CD1-CE2 4.07Å; I381-Y424 HydrophobicContact CG1-CD2 3.82Å; I381-Y424 HydrophobicContact CG1-CE2 3.57Å; I381-W436 HydrophobicContact CD1-CH2 3.65Å; I381-W436 HydrophobicContact CD1-CZ3 3.7Å
382	D	88.6	Confident	80.6	Confident	2 Å²	2	57 Å²	57	1%	0.011	29%	0.291	C	S	.	.	H	α-helix	trans	-66.5	-43.4	-178.7	-62.2	-31.3	0	0	0	110.2	S369 R372 I373 A378 K379 P380 A385 K386	S369-D382 WeakPolarHBondContact CB-OD1 3.49Å; S369-D382 WeakPolarHBondContact OG-CA 3.45Å; S369-D382 WeakPolarHBondContact OG-CB 3.46Å; S369-D382 PolarHBondContact OG-O 3.27Å; R372-D382 WeakPolarHBondContact CD-OD2 3.35Å; R372-D382 IonicContact CZ-OD1 2.71Å; R372-D382 IonicContact CZ-OD2 2.65Å; R372-D382 IonicContact NE-OD2 3.19Å; R372-D382 IonicContact NH1-OD1 2.72Å; R372-D382 PolarHBondContact NH1-OD1 3.14Å; R372-D382 IonicContact NH1-OD2 2.68Å; R372-D382 PolarHBondContact NH1-OD2 3.35Å; I373-D382 HydrophobicContact CD1-CB 4.02Å; I373-D382 HydrophobicContact CG1-CB 3.95Å; A378-D382 HydrophobicContact CB-CB 4.47Å; K379-D382 WeakPolarHBondContact CB-OD2 3.39Å; K379-D382 PolarHBondContact N-OD2 3Å; K379-D382 WeakPolarHBondContact O-CB 3.35Å; K379-D382 PolarHBondContact O-N 2.89Å; P380-D382 VanDerWaalsContact C-N 3.29Å; P380-D382 PolarHBondContact O-N 2.9Å; D382-A385 PolarHBondContact O-N 2.98Å; D382-K386 WeakPolarHBondContact O-CB 3.46Å; D382-K386 PolarHBondContact O-N 2.84Å
383	L	85.4	Confident	78.8	Confident	38 Å²	38	57.9 Å²	57.9	20%	0.199	30%	0.3	C	S	.	.	H	α-helix	trans	-63.8	-41.4	175.9	-59.2	177.7	0	0	0	111.9	I373 A378 K379 P380 K386 Y387 F405	I373-L383 HydrophobicContact CG1-CD2 4.38Å; A378-L383 HydrophobicContact CB-CD2 3.78Å; A378-L383 HydrophobicContact CB-CG 4.01Å; K379-L383 PolarHBondContact O-N 2.89Å; P380-L383 PolarHBondContact O-N 3.43Å; L383-K386 PolarHBondContact O-N 2.79Å; L383-Y387 WeakPolarHBondContact O-CB 3.4Å; L383-Y387 PolarHBondContact O-N 2.76Å; L383-F405 HydrophobicContact CB-CD1 4.24Å; L383-F405 HydrophobicContact CB-CD2 4.23Å; L383-F405 HydrophobicContact CB-CE1 4.33Å; L383-F405 HydrophobicContact CB-CE2 4.33Å; L383-F405 HydrophobicContact CB-CG 4.19Å; L383-F405 HydrophobicContact CB-CZ 4.38Å; L383-F405 HydrophobicContact CD1-CD1 3.73Å; L383-F405 HydrophobicContact CD1-CE1 4.11Å; L383-F405 HydrophobicContact CD1-CG 4.24Å
384	L	86.2	Confident	77	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-67.2	-43.1	176.1	-70.6	167	0	0	0	112.3	P380 I381 Y387 I388 P402 F405 L406 L417 F435 W436 M439	P380-L384 WeakPolarHBondContact O-CG 3.42Å; P380-L384 PolarHBondContact O-N 3.38Å; P380-L384 VanDerWaalsContact O-N 3.15Å; I381-L384 PolarHBondContact O-N 3.39Å; L384-Y387 WeakPolarHBondContact O-CB 3.08Å; L384-Y387 PolarHBondContact O-N 2.81Å; L384-I388 WeakPolarHBondContact O-CG1 3.26Å; L384-I388 PolarHBondContact O-N 2.85Å; L384-I388 VanDerWaalsContact O-N 3.15Å; L384-P402 HydrophobicContact CD2-CB 4.21Å; L384-F405 HydrophobicContact CD2-CD2 4.05Å; L384-F405 HydrophobicContact CG-CD2 4.43Å; L384-L406 HydrophobicContact CD1-CD2 4.45Å; L384-L417 HydrophobicContact CD1-CD1 3.98Å; L384-L417 HydrophobicContact CD1-CD2 4.29Å; L384-F435 HydrophobicContact CD2-CE1 4.37Å; L384-F435 HydrophobicContact CD2-CZ 3.97Å; L384-W436 HydrophobicContact CB-CH2 4.18Å; L384-W436 HydrophobicContact CB-CZ3 4.06Å; L384-M439 HydrophobicContact CD1-CG 3.97Å; L384-M439 HydrophobicContact CD1-SD 4.17Å; L384-M439 HydrophobicContact CD2-CE 3.62Å; L384-M439 HydrophobicContact CD2-CG 4.32Å; L384-M439 HydrophobicContact CD2-SD 3.97Å
385	A	85.7	Confident	75.1	Confident	4 Å²	4	58.3 Å²	58.3	3%	0.033	32%	0.315	C	S	.	.	H	α-helix	trans	-68.1	-34.3	176	0	0	0	0	0	112.2	I381 D382 S389 Y424	I381-A385 VanDerWaalsContact O-CB 3.25Å; I381-A385 WeakPolarHBondContact O-CB 3.19Å; I381-A385 PolarHBondContact O-N 2.71Å; D382-A385 PolarHBondContact O-N 2.98Å; A385-S389 VanDerWaalsContact O-CB 3.25Å; A385-S389 WeakPolarHBondContact O-CB 3.31Å; A385-S389 PolarHBondContact O-N 3.37Å; A385-S389 PolarHBondContact O-OG 2.72Å; A385-Y424 HydrophobicContact CB-CE1 3.93Å
386	K	81.9	Confident	73.5	Confident	78 Å²	78	59 Å²	59	34%	0.339	33%	0.33	S	S	.	.	H	α-helix	trans	-62.2	-48.8	168.6	176.6	-178.4	173.3	-170.2	0	110.4	I373 D382 L383 I388 S389 A390 E398	I373-K386 HydrophobicContact CD1-CB 3.75Å; I373-K386 HydrophobicContact CD1-CD 3.8Å; I373-K386 HydrophobicContact CD1-CG 4.29Å; I373-K386 HydrophobicContact CG2-CD 4.34Å; D382-K386 WeakPolarHBondContact O-CB 3.46Å; D382-K386 PolarHBondContact O-N 2.84Å; L383-K386 PolarHBondContact O-N 2.79Å; K386-I388 VanDerWaalsContact C-N 3.31Å; K386-I388 PolarHBondContact O-N 3.29Å; K386-S389 CarbonylContact O-C 3.58Å; K386-S389 PolarHBondContact O-N 3.4Å; K386-S389 VanDerWaalsContact O-N 3.1Å; K386-A390 WeakPolarHBondContact O-CB 3.29Å; K386-A390 PolarHBondContact O-N 3.38Å; K386-E398 WeakPolarHBondContact CE-OE2 3.33Å; K386-E398 IonicContact NZ-OE2 3.15Å; K386-E398 PolarHBondContact NZ-OE2 2.86Å
387	Y	80.4	Confident	71.8	Confident	37 Å²	37	58.5 Å²	58.5	15%	0.145	31%	0.313	C	S	.	.	H	α-helix	trans	-54.5	-45.3	-179.9	176.3	-93.9	0	0	0	112.5	L383 L384 P402 F435 H530	L383-Y387 WeakPolarHBondContact O-CB 3.4Å; L383-Y387 PolarHBondContact O-N 2.76Å; L384-Y387 WeakPolarHBondContact O-CB 3.08Å; L384-Y387 PolarHBondContact O-N 2.81Å; Y387-P402 HydrophobicContact CD1-CB 4.34Å; Y387-P402 HydrophobicContact CD1-CG 3.71Å; Y387-P402 HydrophobicContact CD2-CG 4.06Å; Y387-P402 HydrophobicContact CE1-CB 4.43Å; Y387-P402 HydrophobicContact CE1-CG 3.42Å; Y387-P402 VanDerWaalsContact CE1-CG 3.42Å; Y387-P402 HydrophobicContact CE2-CG 3.8Å; Y387-P402 HydrophobicContact CG-CG 4.03Å; Y387-P402 VanDerWaalsContact CZ-CG 3.47Å; Y387-F435 AromaticContact CD1-CE2 3.59Å; Y387-F435 HydrophobicContact CD1-CE2 3.59Å; Y387-F435 AromaticContact CD1-CZ 3.83Å; Y387-F435 HydrophobicContact CD1-CZ 3.83Å; Y387-F435 HydrophobicContact CE1-CD2 4.29Å; Y387-F435 AromaticContact CE1-CE2 3.6Å; Y387-F435 HydrophobicContact CE1-CE2 3.6Å; Y387-F435 HydrophobicContact CE1-CZ 4.31Å; Y387-H530 AromaticContact CE2-CE1 3.95Å; Y387-H530 AromaticContact CE2-ND1 3.37Å; Y387-H530 WeakPolarHBondContact CE2-ND1 3.4Å; Y387-H530 AromaticContact CZ-ND1 3.65Å; Y387-H530 WeakPolarHBondContact OH-CA 3.47Å; Y387-H530 PolarHBondContact OH-ND1 3.29Å
388	I	78.4	Confident	70.4	Confident	17 Å²	17	55.3 Å²	55.3	9%	0.087	31%	0.305	C	S	.	.	H	α-helix	trans	-69.9	-41.7	176	-58.2	173.1	0	0	0	111.7	L384 K386 A390 N432 F435 W436	L384-I388 WeakPolarHBondContact O-CG1 3.26Å; L384-I388 PolarHBondContact O-N 2.85Å; L384-I388 VanDerWaalsContact O-N 3.15Å; K386-I388 VanDerWaalsContact C-N 3.31Å; K386-I388 PolarHBondContact O-N 3.29Å; I388-A390 PolarHBondContact O-N 2.86Å; I388-N432 HydrophobicContact CD1-CB 4.4Å; I388-N432 HydrophobicContact CG2-CB 3.96Å; I388-N432 VanDerWaalsContact CG2-CG 3.48Å; I388-N432 WeakPolarHBondContact CG2-ND2 3.42Å; I388-F435 HydrophobicContact CD1-CD1 3.39Å; I388-F435 HydrophobicContact CD1-CE1 3.52Å; I388-F435 HydrophobicContact CD1-CG 4.18Å; I388-F435 HydrophobicContact CD1-CZ 4.35Å; I388-F435 HydrophobicContact CG1-CD1 3.85Å; I388-F435 HydrophobicContact CG1-CE1 3.76Å; I388-F435 HydrophobicContact CG1-CG 4.3Å; I388-F435 HydrophobicContact CG1-CZ 4.1Å; I388-W436 HydrophobicContact CD1-CD2 4.03Å; I388-W436 HydrophobicContact CD1-CH2 3.83Å; I388-W436 HydrophobicContact CD1-CZ2 3.24Å; I388-W436 HydrophobicContact CD1-CZ3 4.41Å
389	S	70.8	Confident	69.3	Low	23 Å²	23	60.9 Å²	60.9	16%	0.161	33%	0.326	C	S	.	.	H	α-helix	trans	-75.6	-6	-178.5	-52.5	0	0	0	0	113.6	K366 A385 K386 E391 D392	K366-S389 PolarHBondContact NZ-OG 3.44Å; A385-S389 VanDerWaalsContact O-CB 3.25Å; A385-S389 WeakPolarHBondContact O-CB 3.31Å; A385-S389 PolarHBondContact O-N 3.37Å; A385-S389 PolarHBondContact O-OG 2.72Å; K386-S389 CarbonylContact O-C 3.58Å; K386-S389 PolarHBondContact O-N 3.4Å; K386-S389 VanDerWaalsContact O-N 3.1Å; S389-E391 PolarHBondContact O-N 2.91Å; S389-D392 PolarHBondContact O-N 3.32Å; S389-D392 VanDerWaalsContact O-N 3.14Å
390	A	57.4	Low	68.4	Low	21 Å²	21	62.3 Å²	62.3	17%	0.174	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	16.7	-178.3	0	0	0	0	0	114	K386 I388 D392 K537	K386-A390 WeakPolarHBondContact O-CB 3.29Å; K386-A390 PolarHBondContact O-N 3.38Å; I388-A390 PolarHBondContact O-N 2.86Å; A390-D392 VanDerWaalsContact C-N 3.31Å; A390-K537 WeakPolarHBondContact O-CE 3.3Å; A390-K537 PolarHBondContact O-NZ 3.5Å
391	E	55.3	Low	68.1	Low	118 Å²	118	63.3 Å²	63.3	55%	0.551	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-27.9	159.2	-67.2	-174	173.8	0	0	111.7	S389 K540	S389-E391 PolarHBondContact O-N 2.91Å; E391-K540 PolarHBondContact O-NZ 2.59Å
392	D	52.8	Low	67.7	Low	146 Å²	146	63.1 Å²	63.1	78%	0.781	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	-22.8	-167.7	-64.2	-37.9	0	0	0	115.7	S389 A390	S389-D392 PolarHBondContact O-N 3.32Å; S389-D392 VanDerWaalsContact O-N 3.14Å; A390-D392 VanDerWaalsContact C-N 3.31Å
393	D	49.3	Very low	67.4	Low	76 Å²	76	65.2 Å²	65.2	41%	0.406	34%	0.342	S	S	.	.	S	Bend	trans	-118.1	127.3	-174.9	-99	-40.4	0	0	0	112.1	K370	K370-D393 WeakPolarHBondContact CE-OD2 3.18Å; K370-D393 IonicContact NZ-OD1 3.93Å; K370-D393 PolarHBondContact NZ-OD1 3.1Å; K370-D393 IonicContact NZ-OD2 3.52Å; K370-D393 PolarHBondContact NZ-OD2 3.4Å
394	D	48.5	Very low	67.3	Low	124 Å²	124	65.3 Å²	65.3	66%	0.663	34%	0.344	S	S	*	.			trans	40.4	135.6	165.9	-61.9	-36.4	0	0	0	120.8	A396	D394-A396 PolarHBondContact O-N 3.22Å
395	L	47.6	Very low	67.2	Low	96 Å²	96	66.8 Å²	66.8	50%	0.503	35%	0.351	S	S	.	.	S	Bend	trans	-66.5	-4.8	176.9	-104.1	69.5	0	0	0	115	V397 L541 E544	L395-V397 PolarHBondContact O-N 3.11Å; L395-L541 HydrophobicContact CD2-CB 4.36Å; L395-L541 HydrophobicContact CD2-CD1 3.94Å; L395-L541 HydrophobicContact CD2-CG 4.12Å; L395-E544 WeakPolarHBondContact CD1-OE2 3.45Å; L395-E544 VanDerWaalsContact CD2-OE2 3.23Å; L395-E544 WeakPolarHBondContact CD2-OE2 3.28Å
396	A	52.8	Low	67.2	Low	83 Å²	83	67 Å²	67	69%	0.686	35%	0.351	S	S	*	.			trans	-73.4	83.8	-179.6	0	0	0	0	0	112	D394 E398	D394-A396 PolarHBondContact O-N 3.22Å; A396-E398 PolarHBondContact O-N 3.09Å
397	V	51.4	Low	67.4	Low	61 Å²	61	68.8 Å²	68.8	37%	0.37	37%	0.365	S	S	.	.			trans	-74.1	112.6	-178.9	177.9	0	0	0	0	111.9	L395 M399 L534 K537	L395-V397 PolarHBondContact O-N 3.11Å; V397-M399 HydrophobicContact CG1-CG 4.28Å; V397-M399 PolarHBondContact O-N 3.28Å; V397-L534 HydrophobicContact CG1-CD2 3.95Å; V397-K537 HydrophobicContact CG2-CD 3.78Å
398	E	57.4	Low	67.5	Low	91 Å²	91	71 Å²	71	43%	0.425	40%	0.399	S	S	.	.			trans	-71.6	114.7	155.5	-77.1	172.4	114	0	0	109.1	K386 A396 H400	K386-E398 WeakPolarHBondContact CE-OE2 3.33Å; K386-E398 IonicContact NZ-OE2 3.15Å; K386-E398 PolarHBondContact NZ-OE2 2.86Å; A396-E398 PolarHBondContact O-N 3.09Å; E398-H400 PolarHBondContact O-N 2.95Å
399	M	62	Low	67.9	Low	155 Å²	155	71.8 Å²	71.8	76%	0.764	40%	0.403	S	S	*	.			trans	-76.2	26.3	-174.7	-62.9	178.1	61.4	0	0	114.2	V397	V397-M399 HydrophobicContact CG1-CG 4.28Å; V397-M399 PolarHBondContact O-N 3.28Å
400	H	68.8	Low	68.8	Low	103 Å²	103	74 Å²	74	48%	0.477	42%	0.416	S	S	.	.			trans	-91	123.4	-174.2	-69.7	-60.7	0	0	0	111.5	E398 F405 H530	E398-H400 PolarHBondContact O-N 2.95Å; H400-F405 HydrophobicContact CB-CE1 3.68Å; H400-F405 HydrophobicContact CB-CZ 3.66Å; H400-H530 PolarHBondContact O-CE1 2.97Å; H400-H530 VanDerWaalsContact O-CE1 3.32Å
401	E	79.7	Confident	70.3	Confident	52 Å²	52	74.1 Å²	74.1	24%	0.243	41%	0.414	C	S	.	.			trans	-63	135.9	172.6	-61.5	-173.1	138	0	0	109.2	Y403 T404 R527	E401-Y403 HydrophobicContact CB-CD1 4.1Å; E401-Y403 HydrophobicContact CB-CE1 3.66Å; E401-Y403 HydrophobicContact CG-CE1 4.4Å; E401-Y403 PolarHBondContact O-N 3.49Å; E401-Y403 WeakPolarHBondContact OE2-CE1 3.49Å; E401-Y403 PolarHBondContact OE2-OH 3.47Å; E401-T404 HydrophobicContact CB-CG2 4.15Å; E401-T404 WeakPolarHBondContact O-CB 3.42Å; E401-T404 WeakPolarHBondContact O-CG2 3.48Å; E401-T404 PolarHBondContact O-N 2.79Å; E401-T404 PolarHBondContact O-OG1 2.87Å; E401-R527 WeakPolarHBondContact OE1-CD 3.39Å; E401-R527 WeakPolarHBondContact OE1-CG 3.35Å
402	P	81.1	Confident	72	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-58.2	-29	-164.3	-30.5	36.8	0	0	0	116.2	L384 Y387 T404 F405 F435 M439	L384-P402 HydrophobicContact CD2-CB 4.21Å; Y387-P402 HydrophobicContact CD1-CB 4.34Å; Y387-P402 HydrophobicContact CD1-CG 3.71Å; Y387-P402 HydrophobicContact CD2-CG 4.06Å; Y387-P402 HydrophobicContact CE1-CB 4.43Å; Y387-P402 HydrophobicContact CE1-CG 3.42Å; Y387-P402 VanDerWaalsContact CE1-CG 3.42Å; Y387-P402 HydrophobicContact CE2-CG 3.8Å; Y387-P402 HydrophobicContact CG-CG 4.03Å; Y387-P402 VanDerWaalsContact CZ-CG 3.47Å; P402-T404 VanDerWaalsContact C-N 3.27Å; P402-T404 PolarHBondContact O-N 3.24Å; P402-F405 VanDerWaalsContact O-CD2 3.27Å; P402-F405 WeakPolarHBondContact O-CD2 3.22Å; P402-F435 HydrophobicContact CB-CE2 3.78Å; P402-F435 HydrophobicContact CB-CZ 3.88Å; P402-F435 HydrophobicContact CG-CE2 3.88Å; P402-F435 HydrophobicContact CG-CZ 4.39Å; P402-M439 HydrophobicContact CB-CE 3.8Å
403	Y	82.1	Confident	73.7	Confident	47 Å²	47	69.1 Å²	69.1	18%	0.184	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-80.4	-4.4	178.9	70.4	-83.5	0	0	0	113.3	E401 R527	E401-Y403 HydrophobicContact CB-CD1 4.1Å; E401-Y403 HydrophobicContact CB-CE1 3.66Å; E401-Y403 HydrophobicContact CG-CE1 4.4Å; E401-Y403 PolarHBondContact O-N 3.49Å; E401-Y403 WeakPolarHBondContact OE2-CE1 3.49Å; E401-Y403 PolarHBondContact OE2-OH 3.47Å; Y403-R527 HydrophobicContact CE1-CG 3.76Å
404	T	84.4	Confident	75.6	Confident	39 Å²	39	65.6 Å²	65.6	24%	0.239	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-77.2	-22.3	174.9	62.4	0	0	0	0	112.7	E401 P402 L406 N407	E401-T404 HydrophobicContact CB-CG2 4.15Å; E401-T404 WeakPolarHBondContact O-CB 3.42Å; E401-T404 WeakPolarHBondContact O-CG2 3.48Å; E401-T404 PolarHBondContact O-N 2.79Å; E401-T404 PolarHBondContact O-OG1 2.87Å; P402-T404 VanDerWaalsContact C-N 3.27Å; P402-T404 PolarHBondContact O-N 3.24Å; T404-L406 PolarHBondContact O-N 3.48Å; T404-L406 VanDerWaalsContact O-N 3.17Å; T404-N407 WeakPolarHBondContact O-CB 3.45Å; T404-N407 PolarHBondContact O-N 2.85Å; T404-N407 VanDerWaalsContact O-N 3.11Å; T404-N407 PolarHBondContact O-ND2 3.3Å; T404-N407 VanDerWaalsContact O-ND2 3.17Å
405	F	83.5	Confident	77.7	Confident	32 Å²	32	63.1 Å²	63.1	14%	0.14	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-67.5	-7.6	173.1	-55.3	-53.2	0	0	0	114	L383 L384 H400 P402 L409	L383-F405 HydrophobicContact CB-CD1 4.24Å; L383-F405 HydrophobicContact CB-CD2 4.23Å; L383-F405 HydrophobicContact CB-CE1 4.33Å; L383-F405 HydrophobicContact CB-CE2 4.33Å; L383-F405 HydrophobicContact CB-CG 4.19Å; L383-F405 HydrophobicContact CB-CZ 4.38Å; L383-F405 HydrophobicContact CD1-CD1 3.73Å; L383-F405 HydrophobicContact CD1-CE1 4.11Å; L383-F405 HydrophobicContact CD1-CG 4.24Å; L384-F405 HydrophobicContact CD2-CD2 4.05Å; L384-F405 HydrophobicContact CG-CD2 4.43Å; H400-F405 HydrophobicContact CB-CE1 3.68Å; H400-F405 HydrophobicContact CB-CZ 3.66Å; P402-F405 VanDerWaalsContact O-CD2 3.27Å; P402-F405 WeakPolarHBondContact O-CD2 3.22Å; F405-L409 VanDerWaalsContact O-CD1 3.3Å; F405-L409 WeakPolarHBondContact O-CD1 3.29Å
406	L	85.6	Confident	79.8	Confident	7 Å²	7	62.6 Å²	62.6	4%	0.037	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-88.4	-9.8	173.9	-81.3	166.2	0	0	0	112.4	L384 T404 G408 M414 L417 M439 I442	L384-L406 HydrophobicContact CD1-CD2 4.45Å; T404-L406 PolarHBondContact O-N 3.48Å; T404-L406 VanDerWaalsContact O-N 3.17Å; L406-G408 PolarHBondContact O-N 3Å; L406-M414 HydrophobicContact CB-CE 4.09Å; L406-M414 HydrophobicContact CB-SD 4.28Å; L406-M414 HydrophobicContact CD1-CE 4.27Å; L406-M414 HydrophobicContact CG-CE 3.93Å; L406-M414 HydrophobicContact CG-SD 4.03Å; L406-L417 HydrophobicContact CD2-CD2 3.94Å; L406-L417 HydrophobicContact CG-CD2 4.45Å; L406-M439 HydrophobicContact CD1-SD 3.92Å; L406-M439 HydrophobicContact CD2-SD 3.76Å; L406-I442 HydrophobicContact CD1-CB 4.44Å; L406-I442 HydrophobicContact CD1-CG2 3.8Å
407	N	85.8	Confident	81.7	Confident	116 Å²	116	58.8 Å²	58.8	62%	0.62	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	119.4	-177	-67.9	-35	0	0	0	111.2	T404	T404-N407 WeakPolarHBondContact O-CB 3.45Å; T404-N407 PolarHBondContact O-N 2.85Å; T404-N407 VanDerWaalsContact O-N 3.11Å; T404-N407 PolarHBondContact O-ND2 3.3Å; T404-N407 VanDerWaalsContact O-ND2 3.17Å
408	G	81.9	Confident	83.6	Confident	85 Å²	85	57 Å²	57	88%	0.876	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.7	0.9	173.4	0	0	0	0	0	115.8	L406	L406-G408 PolarHBondContact O-N 3Å
409	L	87.6	Confident	85.2	Confident	32 Å²	32	59 Å²	59	17%	0.168	32%	0.324	C	S	.	.			trans	-69.1	152.3	172.3	-82	57.1	0	0	0	111.4	P380 F405 D413 M414 L417	P380-L409 HydrophobicContact CB-CD2 3.87Å; P380-L409 HydrophobicContact CG-CD1 4.24Å; P380-L409 HydrophobicContact CG-CD2 3.53Å; P380-L409 HydrophobicContact CG-CG 4Å; F405-L409 VanDerWaalsContact O-CD1 3.3Å; F405-L409 WeakPolarHBondContact O-CD1 3.29Å; L409-D413 HydrophobicContact CB-CB 4.12Å; L409-D413 HydrophobicContact CD2-CB 4.44Å; L409-D413 HydrophobicContact CG-CB 4.16Å; L409-M414 HydrophobicContact CB-CG 3.78Å; L409-M414 HydrophobicContact CB-SD 3.85Å; L409-M414 HydrophobicContact CD2-CG 4.18Å; L409-M414 HydrophobicContact CD2-SD 3.43Å; L409-M414 WeakPolarHBondContact CD2-SD 3.49Å; L409-M414 HydrophobicContact CG-SD 4.31Å; L409-L417 HydrophobicContact CD2-CD2 4.39Å
410	T	89.4	Confident	86.6	Confident	69 Å²	69	53.9 Å²	53.9	42%	0.423	30%	0.299	S	S	.	.			trans	-79.6	166.1	170.7	71	0	0	0	0	111.6	T412 D413 M414	T410-T412 PolarHBondContact O-N 2.8Å; T410-T412 PolarHBondContact OG1-OG1 3.29Å; T410-D413 VanDerWaalsContact CB-OD2 3.26Å; T410-D413 WeakPolarHBondContact CB-OD2 3.38Å; T410-D413 WeakPolarHBondContact CG2-OD2 3.48Å; T410-D413 PolarHBondContact N-OD2 2.79Å; T410-D413 PolarHBondContact O-N 2.78Å; T410-D413 PolarHBondContact OG1-N 3.47Å; T410-D413 PolarHBondContact OG1-OD2 2.95Å; T410-M414 VanDerWaalsContact O-CG 3.23Å; T410-M414 WeakPolarHBondContact O-CG 3.4Å; T410-M414 PolarHBondContact O-N 3.36Å; T410-M414 VanDerWaalsContact O-N 3.11Å
411	V	89.4	Confident	87.6	Confident	24 Å²	24	49 Å²	49	15%	0.145	28%	0.277	C	S	.	.	H	α-helix	trans	-56.7	-38.8	174.7	178.1	0	0	0	0	111.4	M414 E415 L450 R451	V411-M414 PolarHBondContact O-N 3.34Å; V411-E415 VanDerWaalsContact CG1-OE1 3.23Å; V411-E415 WeakPolarHBondContact CG1-OE1 3.5Å; V411-E415 WeakPolarHBondContact O-CG 3.4Å; V411-E415 PolarHBondContact O-N 3.37Å; V411-L450 HydrophobicContact CG2-CB 3.63Å; V411-L450 HydrophobicContact CG2-CD1 4.04Å; V411-L450 HydrophobicContact CG2-CG 4.45Å; V411-R451 HydrophobicContact CG1-CG 4.31Å
412	T	90.1	Very high	88	Confident	88 Å²	88	51.4 Å²	51.4	54%	0.54	29%	0.287	S	S	.	.	H	α-helix	trans	-68.6	-41.8	176.6	36.5	0	0	0	0	112.9	T410 M414 E415 D416	T410-T412 PolarHBondContact O-N 2.8Å; T410-T412 PolarHBondContact OG1-OG1 3.29Å; T412-M414 PolarHBondContact O-N 3.26Å; T412-E415 PolarHBondContact O-N 2.94Å; T412-D416 WeakPolarHBondContact O-CB 3.25Å; T412-D416 PolarHBondContact O-N 3.47Å
413	D	90.1	Very high	88.2	Confident	72 Å²	72	55.2 Å²	55.2	39%	0.385	31%	0.31	S	S	.	.	H	α-helix	trans	-64.4	-31.4	178	-51.2	-49.7	0	0	0	111.8	L409 T410 L417	L409-D413 HydrophobicContact CB-CB 4.12Å; L409-D413 HydrophobicContact CD2-CB 4.44Å; L409-D413 HydrophobicContact CG-CB 4.16Å; T410-D413 VanDerWaalsContact CB-OD2 3.26Å; T410-D413 WeakPolarHBondContact CB-OD2 3.38Å; T410-D413 WeakPolarHBondContact CG2-OD2 3.48Å; T410-D413 PolarHBondContact N-OD2 2.79Å; T410-D413 PolarHBondContact O-N 2.78Å; T410-D413 PolarHBondContact OG1-N 3.47Å; T410-D413 PolarHBondContact OG1-OD2 2.95Å; D413-L417 VanDerWaalsContact O-CB 3.25Å; D413-L417 WeakPolarHBondContact O-CB 3.46Å; D413-L417 PolarHBondContact O-N 2.86Å
414	M	89.2	Confident	88.3	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-76.6	-33.2	176.9	-64.9	-75.2	-87.4	0	0	112.2	L406 L409 T410 V411 T412 L417 L418 T443 E446 I447	L406-M414 HydrophobicContact CB-CE 4.09Å; L406-M414 HydrophobicContact CB-SD 4.28Å; L406-M414 HydrophobicContact CD1-CE 4.27Å; L406-M414 HydrophobicContact CG-CE 3.93Å; L406-M414 HydrophobicContact CG-SD 4.03Å; L409-M414 HydrophobicContact CB-CG 3.78Å; L409-M414 HydrophobicContact CB-SD 3.85Å; L409-M414 HydrophobicContact CD2-CG 4.18Å; L409-M414 HydrophobicContact CD2-SD 3.43Å; L409-M414 WeakPolarHBondContact CD2-SD 3.49Å; L409-M414 HydrophobicContact CG-SD 4.31Å; T410-M414 VanDerWaalsContact O-CG 3.23Å; T410-M414 WeakPolarHBondContact O-CG 3.4Å; T410-M414 PolarHBondContact O-N 3.36Å; T410-M414 VanDerWaalsContact O-N 3.11Å; V411-M414 PolarHBondContact O-N 3.34Å; T412-M414 PolarHBondContact O-N 3.26Å; M414-L417 HydrophobicContact SD-CD2 4.46Å; M414-L418 WeakPolarHBondContact O-CG 3.44Å; M414-L418 PolarHBondContact O-N 2.83Å; M414-L418 VanDerWaalsContact O-N 3.07Å; M414-T443 HydrophobicContact CB-CG2 4.16Å; M414-T443 HydrophobicContact CE-CG2 3.78Å; M414-T443 HydrophobicContact SD-CG2 4.01Å; M414-E446 HydrophobicContact CE-CB 3.56Å; M414-E446 HydrophobicContact CE-CG 4.05Å; M414-I447 HydrophobicContact CB-CD1 3.79Å; M414-I447 HydrophobicContact CB-CG1 3.46Å; M414-I447 VanDerWaalsContact CB-CG1 3.46Å; M414-I447 HydrophobicContact CG-CG1 4.4Å
415	E	91.6	Very high	88.3	Confident	72 Å²	72	54.8 Å²	54.8	34%	0.336	31%	0.307	S	S	.	.	H	α-helix	trans	-69.2	-46.7	172	-74.9	170.7	-162.2	0	0	111	V411 T412 L417 L418 E419 I447 R451	V411-E415 VanDerWaalsContact CG1-OE1 3.23Å; V411-E415 WeakPolarHBondContact CG1-OE1 3.5Å; V411-E415 WeakPolarHBondContact O-CG 3.4Å; V411-E415 PolarHBondContact O-N 3.37Å; T412-E415 PolarHBondContact O-N 2.94Å; E415-L417 VanDerWaalsContact C-N 3.31Å; E415-L417 PolarHBondContact O-N 3.29Å; E415-L418 WeakPolarHBondContact O-CB 3.36Å; E415-L418 PolarHBondContact O-N 2.86Å; E415-L418 VanDerWaalsContact O-N 3.1Å; E415-E419 PolarHBondContact O-N 2.86Å; E415-I447 HydrophobicContact CG-CD1 4.17Å; E415-R451 IonicContact OE1-CZ 3.57Å; E415-R451 IonicContact OE1-NE 2.66Å; E415-R451 IonicContact OE1-NH2 3.76Å; E415-R451 PolarHBondContact OE1-NH2 3.08Å
416	D	91.6	Very high	88.3	Confident	85 Å²	85	60.9 Å²	60.9	46%	0.455	34%	0.336	S	S	.	.	H	α-helix	trans	-52.1	-47.8	168.8	-98.4	40.7	0	0	0	111.2	K379 T412 L418 E419 D420	K379-D416 IonicContact NZ-OD2 2.72Å; K379-D416 PolarHBondContact NZ-OD2 2.84Å; T412-D416 WeakPolarHBondContact O-CB 3.25Å; T412-D416 PolarHBondContact O-N 3.47Å; D416-L418 VanDerWaalsContact C-N 3.3Å; D416-L418 PolarHBondContact O-N 2.88Å; D416-E419 PolarHBondContact O-N 3.15Å; D416-D420 PolarHBondContact O-N 3.28Å
417	L	92.1	Very high	87.9	Confident	3 Å²	3	62 Å²	62	2%	0.016	34%	0.342	C	S	.	.	H	α-helix	trans	-61.3	-36.8	178.6	178.2	59.7	0	0	0	112.1	P380 I381 L384 L406 L409 D413 M414 E415 E419 I421 T443	P380-L417 HydrophobicContact CB-CD1 4.36Å; P380-L417 HydrophobicContact CB-CD2 4.18Å; I381-L417 HydrophobicContact CB-CD1 3.87Å; I381-L417 HydrophobicContact CD1-CD1 4.08Å; L384-L417 HydrophobicContact CD1-CD1 3.98Å; L384-L417 HydrophobicContact CD1-CD2 4.29Å; L406-L417 HydrophobicContact CD2-CD2 3.94Å; L406-L417 HydrophobicContact CG-CD2 4.45Å; L409-L417 HydrophobicContact CD2-CD2 4.39Å; D413-L417 VanDerWaalsContact O-CB 3.25Å; D413-L417 WeakPolarHBondContact O-CB 3.46Å; D413-L417 PolarHBondContact O-N 2.86Å; M414-L417 HydrophobicContact SD-CD2 4.46Å; E415-L417 VanDerWaalsContact C-N 3.31Å; E415-L417 PolarHBondContact O-N 3.29Å; L417-E419 VanDerWaalsContact C-N 3.26Å; L417-E419 PolarHBondContact O-N 2.82Å; L417-I421 HydrophobicContact CD1-CD1 3.93Å; L417-I421 HydrophobicContact CD1-CG1 3.97Å; L417-I421 HydrophobicContact CG-CD1 3.82Å; L417-I421 HydrophobicContact CG-CG1 4.32Å; L417-I421 WeakPolarHBondContact O-CB 3.48Å; L417-I421 WeakPolarHBondContact O-CG1 3.22Å; L417-I421 PolarHBondContact O-N 2.72Å; L417-T443 HydrophobicContact CD2-CG2 4.29Å
418	L	92.1	Very high	87.3	Confident	23 Å²	23	57.7 Å²	57.7	12%	0.12	32%	0.318	C	S	.	.	H	α-helix	trans	-69	-20.4	173.6	-76.7	-176.9	0	0	0	113.3	M414 E415 D416 K422 T440 T443 E444 I447	M414-L418 WeakPolarHBondContact O-CG 3.44Å; M414-L418 PolarHBondContact O-N 2.83Å; M414-L418 VanDerWaalsContact O-N 3.07Å; E415-L418 WeakPolarHBondContact O-CB 3.36Å; E415-L418 PolarHBondContact O-N 2.86Å; E415-L418 VanDerWaalsContact O-N 3.1Å; D416-L418 VanDerWaalsContact C-N 3.3Å; D416-L418 PolarHBondContact O-N 2.88Å; L418-K422 WeakPolarHBondContact O-CD 3.46Å; L418-K422 WeakPolarHBondContact O-CE 3.37Å; L418-K422 VanDerWaalsContact O-CG 3.29Å; L418-K422 WeakPolarHBondContact O-CG 3.47Å; L418-K422 PolarHBondContact O-NZ 2.91Å; L418-T440 HydrophobicContact CD2-CG2 3.95Å; L418-T443 HydrophobicContact CD1-CG2 4.41Å; L418-T443 HydrophobicContact CD2-CG2 3.85Å; L418-T443 HydrophobicContact CG-CG2 3.74Å; L418-E444 HydrophobicContact CD1-CG 3.86Å; L418-E444 HydrophobicContact CD2-CG 4.35Å; L418-I447 HydrophobicContact CD1-CD1 3.52Å; L418-I447 HydrophobicContact CG-CD1 4.2Å
419	E	91.6	Very high	86.6	Confident	133 Å²	133	62 Å²	62	62%	0.621	32%	0.315	S	S	*	.	H	α-helix	trans	-84.8	-46.8	170.9	-58.1	-154.6	151.9	0	0	111.2	E415 D416 L417 I421 K422 V423	E415-E419 PolarHBondContact O-N 2.86Å; D416-E419 PolarHBondContact O-N 3.15Å; L417-E419 VanDerWaalsContact C-N 3.26Å; L417-E419 PolarHBondContact O-N 2.82Å; E419-I421 VanDerWaalsContact C-N 3.29Å; E419-I421 PolarHBondContact O-N 3.26Å; E419-K422 WeakPolarHBondContact O-CB 3.49Å; E419-K422 PolarHBondContact O-N 2.93Å; E419-V423 PolarHBondContact O-N 3.05Å
420	D	90.3	Very high	85.5	Confident	48 Å²	48	62.9 Å²	62.9	26%	0.257	33%	0.331	S	S	.	.	H	α-helix	trans	-54.1	-42.3	174.1	-86.6	-30.6	0	0	0	111.3	K379 I381 D416 K422 V423 Y424	K379-D420 IonicContact NZ-OD2 2.88Å; K379-D420 PolarHBondContact NZ-OD2 3.28Å; I381-D420 HydrophobicContact CB-CB 3.99Å; I381-D420 HydrophobicContact CD1-CB 4.22Å; I381-D420 HydrophobicContact CG1-CB 3.91Å; I381-D420 HydrophobicContact CG2-CB 4.1Å; D416-D420 PolarHBondContact O-N 3.28Å; D420-K422 PolarHBondContact O-N 3.38Å; D420-V423 PolarHBondContact O-N 2.92Å; D420-Y424 WeakPolarHBondContact O-CD2 3.3Å; D420-Y424 PolarHBondContact O-N 3.18Å
421	I	89.9	Confident	84.7	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-62.5	-37.8	176.7	-73.5	169.6	0	0	0	112.8	I381 L417 E419 V423 Y424 M425 W436 M439	I381-I421 HydrophobicContact CD1-CG1 3.87Å; L417-I421 HydrophobicContact CD1-CD1 3.93Å; L417-I421 HydrophobicContact CD1-CG1 3.97Å; L417-I421 HydrophobicContact CG-CD1 3.82Å; L417-I421 HydrophobicContact CG-CG1 4.32Å; L417-I421 WeakPolarHBondContact O-CB 3.48Å; L417-I421 WeakPolarHBondContact O-CG1 3.22Å; L417-I421 PolarHBondContact O-N 2.72Å; E419-I421 VanDerWaalsContact C-N 3.29Å; E419-I421 PolarHBondContact O-N 3.26Å; I421-V423 VanDerWaalsContact C-N 3.33Å; I421-V423 PolarHBondContact O-N 3.44Å; I421-Y424 PolarHBondContact O-N 2.97Å; I421-M425 HydrophobicContact CG2-CG 4.3Å; I421-M425 HydrophobicContact CG2-SD 4.07Å; I421-M425 WeakPolarHBondContact O-CG 3.46Å; I421-M425 PolarHBondContact O-N 3.11Å; I421-W436 HydrophobicContact CB-CE3 4.34Å; I421-W436 HydrophobicContact CD1-CE3 4.44Å; I421-W436 HydrophobicContact CG1-CE3 3.85Å; I421-W436 HydrophobicContact CG1-CZ3 3.84Å; I421-W436 HydrophobicContact CG2-CB 4.16Å; I421-W436 HydrophobicContact CG2-CD2 4.35Å; I421-W436 HydrophobicContact CG2-CE3 3.86Å; I421-M439 HydrophobicContact CD1-CB 4.36Å; I421-M439 HydrophobicContact CD1-CG 3.82Å
422	K	88.4	Confident	84.4	Confident	104 Å²	104	68.1 Å²	68.1	45%	0.452	35%	0.347	S	S	.	.	H	α-helix	trans	-63.5	-41.5	-179.4	-67.6	168.9	-165.3	111.1	0	111	L418 E419 D420 Y424 M425 E426	L418-K422 WeakPolarHBondContact O-CD 3.46Å; L418-K422 WeakPolarHBondContact O-CE 3.37Å; L418-K422 VanDerWaalsContact O-CG 3.29Å; L418-K422 WeakPolarHBondContact O-CG 3.47Å; L418-K422 PolarHBondContact O-NZ 2.91Å; E419-K422 WeakPolarHBondContact O-CB 3.49Å; E419-K422 PolarHBondContact O-N 2.93Å; D420-K422 PolarHBondContact O-N 3.38Å; K422-Y424 VanDerWaalsContact C-N 3.32Å; K422-Y424 PolarHBondContact O-N 2.79Å; K422-M425 WeakPolarHBondContact O-CB 3.48Å; K422-M425 PolarHBondContact O-N 2.99Å; K422-M425 VanDerWaalsContact O-N 3.11Å; K422-E426 WeakPolarHBondContact O-CG 3.31Å; K422-E426 PolarHBondContact O-N 3.4Å
423	V	86.2	Confident	84.1	Confident	80 Å²	80	65 Å²	65	49%	0.485	33%	0.328	S	S	.	.	H	α-helix	trans	-60.2	-42.8	176.8	179.9	0	0	0	0	110.8	E419 D420 I421 E426 L427	E419-V423 PolarHBondContact O-N 3.05Å; D420-V423 PolarHBondContact O-N 2.92Å; I421-V423 VanDerWaalsContact C-N 3.33Å; I421-V423 PolarHBondContact O-N 3.44Å; V423-E426 PolarHBondContact O-N 3.27Å; V423-L427 HydrophobicContact CG1-CD1 3.74Å; V423-L427 HydrophobicContact CG1-CG 4.46Å; V423-L427 WeakPolarHBondContact O-CB 3.25Å; V423-L427 VanDerWaalsContact O-CG 3.22Å; V423-L427 WeakPolarHBondContact O-CG 3.34Å; V423-L427 PolarHBondContact O-N 3.46Å; V423-L427 VanDerWaalsContact O-N 3.1Å
424	Y	83.9	Confident	83.9	Confident	16 Å²	16	65.8 Å²	65.8	6%	0.063	33%	0.333	C	S	.	.	H	α-helix	trans	-66.5	-38.6	173.5	-82.1	-87.2	0	0	0	112.8	L362 I381 A385 D420 I421 K422 E426 L427 E428 W436	L362-Y424 HydrophobicContact CD1-CD1 4.09Å; L362-Y424 HydrophobicContact CD1-CE1 4.02Å; I381-Y424 HydrophobicContact CD1-CD2 3.8Å; I381-Y424 HydrophobicContact CD1-CE2 4.07Å; I381-Y424 HydrophobicContact CG1-CD2 3.82Å; I381-Y424 HydrophobicContact CG1-CE2 3.57Å; A385-Y424 HydrophobicContact CB-CE1 3.93Å; D420-Y424 WeakPolarHBondContact O-CD2 3.3Å; D420-Y424 PolarHBondContact O-N 3.18Å; I421-Y424 PolarHBondContact O-N 2.97Å; K422-Y424 VanDerWaalsContact C-N 3.32Å; K422-Y424 PolarHBondContact O-N 2.79Å; Y424-E426 VanDerWaalsContact C-N 3.31Å; Y424-E426 PolarHBondContact O-N 2.8Å; Y424-L427 PolarHBondContact O-N 3.31Å; Y424-E428 VanDerWaalsContact O-CB 3.28Å; Y424-E428 WeakPolarHBondContact O-CB 3.31Å; Y424-E428 PolarHBondContact O-N 3.04Å; Y424-W436 HydrophobicContact CD1-CZ2 4Å; Y424-W436 HydrophobicContact CG-CH2 4.25Å; Y424-W436 AromaticContact CG-CZ2 3.82Å; Y424-W436 HydrophobicContact CG-CZ2 3.82Å
425	M	84.4	Confident	83.9	Confident	60 Å²	60	66.3 Å²	66.3	30%	0.296	34%	0.335	S	S	.	.	H	α-helix	trans	-62.4	-35	175.8	-76.2	-179.6	57.5	0	0	113.6	I421 K422 V433 W436 R437	I421-M425 HydrophobicContact CG2-CG 4.3Å; I421-M425 HydrophobicContact CG2-SD 4.07Å; I421-M425 WeakPolarHBondContact O-CG 3.46Å; I421-M425 PolarHBondContact O-N 3.11Å; K422-M425 WeakPolarHBondContact O-CB 3.48Å; K422-M425 PolarHBondContact O-N 2.99Å; K422-M425 VanDerWaalsContact O-N 3.11Å; M425-V433 HydrophobicContact CE-CG1 4.31Å; M425-W436 HydrophobicContact CG-CB 3.38Å; M425-W436 HydrophobicContact CG-CG 3.86Å; M425-W436 HydrophobicContact SD-CB 3.79Å; M425-R437 HydrophobicContact CE-CG 4.17Å
426	E	83.1	Confident	83.9	Confident	160 Å²	160	62.9 Å²	62.9	75%	0.748	32%	0.319	S	S	*	.	H	α-helix	trans	-74.7	-40	177	-71.1	174.9	178.6	0	0	111.7	K422 V423 Y424	K422-E426 WeakPolarHBondContact O-CG 3.31Å; K422-E426 PolarHBondContact O-N 3.4Å; V423-E426 PolarHBondContact O-N 3.27Å; Y424-E426 VanDerWaalsContact C-N 3.31Å; Y424-E426 PolarHBondContact O-N 2.8Å
427	L	77.6	Confident	83.8	Confident	32 Å²	32	65 Å²	65	17%	0.168	32%	0.321	C	S	.	.	H	α-helix	trans	-80.8	-29.1	-175.6	-66.2	173.4	0	0	0	114.9	D358 L362 V423 Y424 Q429	D358-L427 HydrophobicContact CB-CD2 3.78Å; L362-L427 HydrophobicContact CB-CB 4.25Å; L362-L427 HydrophobicContact CB-CD1 4.09Å; L362-L427 HydrophobicContact CD1-CB 4Å; L362-L427 HydrophobicContact CD1-CD1 4.26Å; L362-L427 HydrophobicContact CD2-CB 4.26Å; L362-L427 HydrophobicContact CG-CB 4.39Å; V423-L427 HydrophobicContact CG1-CD1 3.74Å; V423-L427 HydrophobicContact CG1-CG 4.46Å; V423-L427 WeakPolarHBondContact O-CB 3.25Å; V423-L427 VanDerWaalsContact O-CG 3.22Å; V423-L427 WeakPolarHBondContact O-CG 3.34Å; V423-L427 PolarHBondContact O-N 3.46Å; V423-L427 VanDerWaalsContact O-N 3.1Å; Y424-L427 PolarHBondContact O-N 3.31Å; L427-Q429 VanDerWaalsContact C-N 3.31Å; L427-Q429 PolarHBondContact O-N 3.28Å
428	E	73.5	Confident	83.8	Confident	25 Å²	25	65.2 Å²	65.2	12%	0.117	32%	0.321	C	S	.	.	S	Bend	trans	-87	18.5	-166.4	-146.4	-171.2	163.2	0	0	115.9	Y424 G430 K431 N432 W436	Y424-E428 VanDerWaalsContact O-CB 3.28Å; Y424-E428 WeakPolarHBondContact O-CB 3.31Å; Y424-E428 PolarHBondContact O-N 3.04Å; E428-G430 PolarHBondContact O-N 3.23Å; E428-K431 PolarHBondContact O-N 2.88Å; E428-N432 PolarHBondContact OE1-ND2 3.07Å; E428-W436 PolarHBondContact OE2-NE1 2.83Å
429	Q	66.1	Low	83.8	Confident	176 Å²	176	64.1 Å²	64.1	82%	0.822	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	36.7	168.9	-58.5	-173	-0.5	0	0	115.7	L427 K431	L427-Q429 VanDerWaalsContact C-N 3.31Å; L427-Q429 PolarHBondContact O-N 3.28Å; Q429-K431 PolarHBondContact O-N 3.04Å
430	G	65.4	Low	83.8	Confident	49 Å²	49	59.1 Å²	59.1	51%	0.505	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	-24.1	171.3	0	0	0	0	0	116.8	E428 N432 V433	E428-G430 PolarHBondContact O-N 3.23Å; G430-N432 PolarHBondContact O-N 2.78Å; G430-V433 PolarHBondContact O-N 3.3Å
431	K	72.7	Confident	84	Confident	179 Å²	179	58.4 Å²	58.4	78%	0.778	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-45.9	-168.1	-69.5	-174.2	178.5	-177.1	0	114.2	E428 Q429	E428-K431 PolarHBondContact O-N 2.88Å; Q429-K431 PolarHBondContact O-N 3.04Å
432	N	81.5	Confident	84.1	Confident	24 Å²	24	58.5 Å²	58.5	13%	0.128	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	17.6	-174	-68.6	-55.7	0	0	0	113.6	I388 E428 G430 D434 F435 W436	I388-N432 HydrophobicContact CD1-CB 4.4Å; I388-N432 HydrophobicContact CG2-CB 3.96Å; I388-N432 VanDerWaalsContact CG2-CG 3.48Å; I388-N432 WeakPolarHBondContact CG2-ND2 3.42Å; E428-N432 PolarHBondContact OE1-ND2 3.07Å; G430-N432 PolarHBondContact O-N 2.78Å; N432-D434 VanDerWaalsContact C-N 3.25Å; N432-D434 PolarHBondContact O-N 2.8Å; N432-F435 WeakPolarHBondContact O-CB 3.31Å; N432-F435 PolarHBondContact O-N 3.41Å; N432-W436 PolarHBondContact O-N 3.01Å
433	V	84.8	Confident	84.2	Confident	22 Å²	22	53.5 Å²	53.5	13%	0.133	27%	0.271	C	S	.	.	H	α-helix	trans	-60	-32	-174.6	169.4	0	0	0	0	113.1	M425 G430 W436 R437	M425-V433 HydrophobicContact CE-CG1 4.31Å; G430-V433 PolarHBondContact O-N 3.3Å; V433-W436 PolarHBondContact O-N 2.89Å; V433-R437 HydrophobicContact CG1-CG 4.37Å; V433-R437 WeakPolarHBondContact O-CB 3.18Å; V433-R437 WeakPolarHBondContact O-CG 3.14Å; V433-R437 PolarHBondContact O-N 3.15Å
434	D	87	Confident	84.5	Confident	90 Å²	90	54.1 Å²	54.1	48%	0.481	27%	0.268	S	S	.	.	H	α-helix	trans	-72.8	-29.8	177.5	-67.1	-32	0	0	0	113.4	N432 R437 D438	N432-D434 VanDerWaalsContact C-N 3.25Å; N432-D434 PolarHBondContact O-N 2.8Å; D434-R437 IonicContact OD1-CZ 3.41Å; D434-R437 VanDerWaalsContact OD1-CZ 3.28Å; D434-R437 IonicContact OD1-NE 3.56Å; D434-R437 PolarHBondContact OD1-NE 2.83Å; D434-R437 IonicContact OD1-NH2 2.65Å; D434-R437 PolarHBondContact OD1-NH2 3.23Å; D434-D438 WeakPolarHBondContact O-CB 3.26Å; D434-D438 PolarHBondContact O-N 3.21Å
435	F	88.6	Confident	84.8	Confident	11 Å²	11	54.7 Å²	54.7	5%	0.048	27%	0.272	C	S	.	.	H	α-helix	trans	-64.1	-47.3	169	172.2	-82.3	0	0	0	110.4	L384 Y387 I388 P402 N432 R437 D438 M439 L526	L384-F435 HydrophobicContact CD2-CE1 4.37Å; L384-F435 HydrophobicContact CD2-CZ 3.97Å; Y387-F435 AromaticContact CD1-CE2 3.59Å; Y387-F435 HydrophobicContact CD1-CE2 3.59Å; Y387-F435 AromaticContact CD1-CZ 3.83Å; Y387-F435 HydrophobicContact CD1-CZ 3.83Å; Y387-F435 HydrophobicContact CE1-CD2 4.29Å; Y387-F435 AromaticContact CE1-CE2 3.6Å; Y387-F435 HydrophobicContact CE1-CE2 3.6Å; Y387-F435 HydrophobicContact CE1-CZ 4.31Å; I388-F435 HydrophobicContact CD1-CD1 3.39Å; I388-F435 HydrophobicContact CD1-CE1 3.52Å; I388-F435 HydrophobicContact CD1-CG 4.18Å; I388-F435 HydrophobicContact CD1-CZ 4.35Å; I388-F435 HydrophobicContact CG1-CD1 3.85Å; I388-F435 HydrophobicContact CG1-CE1 3.76Å; I388-F435 HydrophobicContact CG1-CG 4.3Å; I388-F435 HydrophobicContact CG1-CZ 4.1Å; P402-F435 HydrophobicContact CB-CE2 3.78Å; P402-F435 HydrophobicContact CB-CZ 3.88Å; P402-F435 HydrophobicContact CG-CE2 3.88Å; P402-F435 HydrophobicContact CG-CZ 4.39Å; N432-F435 WeakPolarHBondContact O-CB 3.31Å; N432-F435 PolarHBondContact O-N 3.41Å; F435-R437 PolarHBondContact O-N 2.77Å; F435-D438 PolarHBondContact O-N 2.79Å; F435-M439 HydrophobicContact CE1-CE 4.44Å; F435-M439 HydrophobicContact CZ-CE 4.02Å; F435-M439 WeakPolarHBondContact O-CB 3.29Å; F435-M439 PolarHBondContact O-N 3.25Å; F435-L526 HydrophobicContact CD2-CD2 3.43Å; F435-L526 VanDerWaalsContact CD2-CD2 3.43Å; F435-L526 HydrophobicContact CE2-CD2 3.79Å; F435-L526 HydrophobicContact CG-CD2 4.16Å
436	W	90.6	Very high	85.1	Confident	1 Å²	1	53.9 Å²	53.9	0%	0.004	27%	0.268	C	S	.	.	H	α-helix	trans	-66.7	-35.5	179.7	-67.2	122.6	0	0	0	112.8	I381 L384 I388 I421 Y424 M425 E428 N432 V433 M439 T440	I381-W436 HydrophobicContact CD1-CH2 3.65Å; I381-W436 HydrophobicContact CD1-CZ3 3.7Å; L384-W436 HydrophobicContact CB-CH2 4.18Å; L384-W436 HydrophobicContact CB-CZ3 4.06Å; I388-W436 HydrophobicContact CD1-CD2 4.03Å; I388-W436 HydrophobicContact CD1-CH2 3.83Å; I388-W436 HydrophobicContact CD1-CZ2 3.24Å; I388-W436 HydrophobicContact CD1-CZ3 4.41Å; I421-W436 HydrophobicContact CB-CE3 4.34Å; I421-W436 HydrophobicContact CD1-CE3 4.44Å; I421-W436 HydrophobicContact CG1-CE3 3.85Å; I421-W436 HydrophobicContact CG1-CZ3 3.84Å; I421-W436 HydrophobicContact CG2-CB 4.16Å; I421-W436 HydrophobicContact CG2-CD2 4.35Å; I421-W436 HydrophobicContact CG2-CE3 3.86Å; Y424-W436 HydrophobicContact CD1-CZ2 4Å; Y424-W436 HydrophobicContact CG-CH2 4.25Å; Y424-W436 AromaticContact CG-CZ2 3.82Å; Y424-W436 HydrophobicContact CG-CZ2 3.82Å; M425-W436 HydrophobicContact CG-CB 3.38Å; M425-W436 HydrophobicContact CG-CG 3.86Å; M425-W436 HydrophobicContact SD-CB 3.79Å; E428-W436 PolarHBondContact OE2-NE1 2.83Å; N432-W436 PolarHBondContact O-N 3.01Å; V433-W436 PolarHBondContact O-N 2.89Å; W436-M439 PolarHBondContact O-N 3.44Å; W436-T440 VanDerWaalsContact O-CB 3.31Å; W436-T440 WeakPolarHBondContact O-CB 3.37Å; W436-T440 PolarHBondContact O-N 2.97Å; W436-T440 PolarHBondContact O-OG1 2.93Å
437	R	91.1	Very high	85.4	Confident	130 Å²	130	46.5 Å²	46.5	49%	0.491	23%	0.233	S	C	.	.	H	α-helix	trans	-63.2	-41.4	171.2	-79.2	-166.1	-86.4	-123.2	4.5	112.4	M425 V433 D434 F435 T440 T441	M425-R437 HydrophobicContact CE-CG 4.17Å; V433-R437 HydrophobicContact CG1-CG 4.37Å; V433-R437 WeakPolarHBondContact O-CB 3.18Å; V433-R437 WeakPolarHBondContact O-CG 3.14Å; V433-R437 PolarHBondContact O-N 3.15Å; D434-R437 IonicContact OD1-CZ 3.41Å; D434-R437 VanDerWaalsContact OD1-CZ 3.28Å; D434-R437 IonicContact OD1-NE 3.56Å; D434-R437 PolarHBondContact OD1-NE 2.83Å; D434-R437 IonicContact OD1-NH2 2.65Å; D434-R437 PolarHBondContact OD1-NH2 3.23Å; F435-R437 PolarHBondContact O-N 2.77Å; R437-T440 PolarHBondContact O-N 3.11Å; R437-T441 WeakPolarHBondContact O-CB 3.31Å; R437-T441 PolarHBondContact O-N 2.73Å; R437-T441 PolarHBondContact O-OG1 3.36Å
438	D	91.3	Very high	85.9	Confident	6 Å²	6	47.3 Å²	47.3	3%	0.032	24%	0.242	C	C	.	.	H	α-helix	trans	-69.4	-40.4	176.9	-78.8	-7.9	0	0	0	111.9	D434 F435 T441 I442 A522 R525 L526	D434-D438 WeakPolarHBondContact O-CB 3.26Å; D434-D438 PolarHBondContact O-N 3.21Å; F435-D438 PolarHBondContact O-N 2.79Å; D438-T441 PolarHBondContact O-N 2.99Å; D438-I442 WeakPolarHBondContact O-CD1 3.28Å; D438-I442 VanDerWaalsContact O-CG1 3.26Å; D438-I442 WeakPolarHBondContact O-CG1 3.4Å; D438-I442 PolarHBondContact O-N 2.93Å; D438-I442 VanDerWaalsContact O-N 3.09Å; D438-A522 HydrophobicContact CB-CB 3.84Å; D438-R525 IonicContact OD1-CZ 3.01Å; D438-R525 IonicContact OD1-NE 2.85Å; D438-R525 PolarHBondContact OD1-NE 3.46Å; D438-R525 IonicContact OD1-NH2 3.44Å; D438-R525 PolarHBondContact OD1-NH2 3.43Å; D438-R525 WeakPolarHBondContact OD2-CB 3.49Å; D438-R525 IonicContact OD2-CZ 2.69Å; D438-R525 IonicContact OD2-NE 3.76Å; D438-R525 PolarHBondContact OD2-NE 3.26Å; D438-R525 IonicContact OD2-NH2 3.86Å; D438-L526 HydrophobicContact CB-CD1 4.23Å; D438-L526 HydrophobicContact CB-CD2 3.98Å; D438-L526 HydrophobicContact CB-CG 3.9Å
439	M	91.3	Very high	86.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.2	-42.9	174	-165.7	54.6	54.2	0	0	112	L384 P402 L406 I421 F435 W436 I442 T443 L526	L384-M439 HydrophobicContact CD1-CG 3.97Å; L384-M439 HydrophobicContact CD1-SD 4.17Å; L384-M439 HydrophobicContact CD2-CE 3.62Å; L384-M439 HydrophobicContact CD2-CG 4.32Å; L384-M439 HydrophobicContact CD2-SD 3.97Å; P402-M439 HydrophobicContact CB-CE 3.8Å; L406-M439 HydrophobicContact CD1-SD 3.92Å; L406-M439 HydrophobicContact CD2-SD 3.76Å; I421-M439 HydrophobicContact CD1-CB 4.36Å; I421-M439 HydrophobicContact CD1-CG 3.82Å; F435-M439 HydrophobicContact CE1-CE 4.44Å; F435-M439 HydrophobicContact CZ-CE 4.02Å; F435-M439 WeakPolarHBondContact O-CB 3.29Å; F435-M439 PolarHBondContact O-N 3.25Å; W436-M439 PolarHBondContact O-N 3.44Å; M439-I442 PolarHBondContact O-N 3.1Å; M439-T443 WeakPolarHBondContact O-CB 3.48Å; M439-T443 PolarHBondContact O-N 3.45Å; M439-T443 PolarHBondContact O-OG1 3.13Å; M439-L526 HydrophobicContact CE-CD1 3.57Å
440	T	93	Very high	87.4	Confident	29 Å²	29	43.3 Å²	43.3	18%	0.178	22%	0.223	C	C	.	.	H	α-helix	trans	-56	-53.1	173	-61.4	0	0	0	0	110.6	L418 W436 R437 I442 T443 E444	L418-T440 HydrophobicContact CD2-CG2 3.95Å; W436-T440 VanDerWaalsContact O-CB 3.31Å; W436-T440 WeakPolarHBondContact O-CB 3.37Å; W436-T440 PolarHBondContact O-N 2.97Å; W436-T440 PolarHBondContact O-OG1 2.93Å; R437-T440 PolarHBondContact O-N 3.11Å; T440-I442 PolarHBondContact O-N 3.28Å; T440-T443 PolarHBondContact O-N 3.17Å; T440-T443 VanDerWaalsContact O-N 3.11Å; T440-E444 HydrophobicContact CG2-CG 4.35Å; T440-E444 WeakPolarHBondContact O-CG 3.36Å; T440-E444 PolarHBondContact O-N 3.38Å
441	T	92.9	Very high	88.4	Confident	33 Å²	33	47 Å²	47	20%	0.202	22%	0.222	C	C	.	.	H	α-helix	trans	-57.2	-37.1	-179	-56.4	0	0	0	0	112.5	R437 D438 D445 V519 A522	R437-T441 WeakPolarHBondContact O-CB 3.31Å; R437-T441 PolarHBondContact O-N 2.73Å; R437-T441 PolarHBondContact O-OG1 3.36Å; D438-T441 PolarHBondContact O-N 2.99Å; T441-D445 PolarHBondContact O-N 2.85Å; T441-V519 HydrophobicContact CG2-CG2 4.21Å; T441-A522 HydrophobicContact CG2-CB 4.31Å
442	I	91.9	Very high	88.8	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-77.4	-39.1	179	-63.8	162.3	0	0	0	111.3	L406 D438 M439 T440 D445 E446 V519 A522 R523 L526	L406-I442 HydrophobicContact CD1-CB 4.44Å; L406-I442 HydrophobicContact CD1-CG2 3.8Å; D438-I442 WeakPolarHBondContact O-CD1 3.28Å; D438-I442 VanDerWaalsContact O-CG1 3.26Å; D438-I442 WeakPolarHBondContact O-CG1 3.4Å; D438-I442 PolarHBondContact O-N 2.93Å; D438-I442 VanDerWaalsContact O-N 3.09Å; M439-I442 PolarHBondContact O-N 3.1Å; T440-I442 PolarHBondContact O-N 3.28Å; I442-D445 PolarHBondContact O-N 3.29Å; I442-E446 WeakPolarHBondContact O-CB 3.47Å; I442-E446 PolarHBondContact O-N 2.9Å; I442-V519 HydrophobicContact CG1-CG1 4.18Å; I442-A522 HydrophobicContact CD1-CB 4.04Å; I442-A522 HydrophobicContact CG1-CB 3.97Å; I442-R523 HydrophobicContact CD1-CB 4.46Å; I442-R523 HydrophobicContact CD1-CG 3.6Å; I442-R523 HydrophobicContact CG1-CG 3.84Å; I442-L526 HydrophobicContact CD1-CD1 3.47Å; I442-L526 VanDerWaalsContact CD1-CD1 3.47Å; I442-L526 HydrophobicContact CD1-CG 4.48Å
443	T	91.5	Very high	88.7	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.4	-43.7	178.5	-52.8	0	0	0	0	110.8	M414 L417 L418 M439 T440 D445 E446 I447	M414-T443 HydrophobicContact CB-CG2 4.16Å; M414-T443 HydrophobicContact CE-CG2 3.78Å; M414-T443 HydrophobicContact SD-CG2 4.01Å; L417-T443 HydrophobicContact CD2-CG2 4.29Å; L418-T443 HydrophobicContact CD1-CG2 4.41Å; L418-T443 HydrophobicContact CD2-CG2 3.85Å; L418-T443 HydrophobicContact CG-CG2 3.74Å; M439-T443 WeakPolarHBondContact O-CB 3.48Å; M439-T443 PolarHBondContact O-N 3.45Å; M439-T443 PolarHBondContact O-OG1 3.13Å; T440-T443 PolarHBondContact O-N 3.17Å; T440-T443 VanDerWaalsContact O-N 3.11Å; T443-D445 PolarHBondContact O-N 2.86Å; T443-E446 PolarHBondContact O-N 3.44Å; T443-I447 HydrophobicContact CG2-CD1 4.14Å; T443-I447 WeakPolarHBondContact O-CB 3.47Å; T443-I447 VanDerWaalsContact O-CG1 3.3Å; T443-I447 WeakPolarHBondContact O-CG1 3.44Å; T443-I447 PolarHBondContact O-N 3.49Å
444	E	92.1	Very high	88.4	Confident	92 Å²	92	55.2 Å²	55.2	43%	0.43	26%	0.262	S	S	.	.	H	α-helix	trans	-59.8	-40.3	174.4	-72.5	179.9	159.6	0	0	113.1	L418 T440 S448	L418-E444 HydrophobicContact CD1-CG 3.86Å; L418-E444 HydrophobicContact CD2-CG 4.35Å; T440-E444 HydrophobicContact CG2-CG 4.35Å; T440-E444 WeakPolarHBondContact O-CG 3.36Å; T440-E444 PolarHBondContact O-N 3.38Å; E444-S448 VanDerWaalsContact O-CB 3.28Å; E444-S448 WeakPolarHBondContact O-CB 3.41Å; E444-S448 PolarHBondContact O-N 3.28Å; E444-S448 PolarHBondContact O-OG 2.95Å
445	D	90.8	Very high	87.8	Confident	29 Å²	29	53.1 Å²	53.1	16%	0.155	26%	0.257	C	S	.	.	H	α-helix	trans	-73.2	-32.6	177	175.9	63.6	0	0	0	113	T441 I442 T443 S448 K449 V519	T441-D445 PolarHBondContact O-N 2.85Å; I442-D445 PolarHBondContact O-N 3.29Å; T443-D445 PolarHBondContact O-N 2.86Å; D445-S448 WeakPolarHBondContact O-CB 3.33Å; D445-S448 PolarHBondContact O-N 2.81Å; D445-K449 PolarHBondContact O-N 3.02Å; D445-K449 PolarHBondContact O-NZ 3.48Å; D445-K449 VanDerWaalsContact O-NZ 3.12Å; D445-K449 IonicContact OD1-NZ 3.83Å; D445-K449 WeakPolarHBondContact OD2-CE 3.14Å; D445-K449 IonicContact OD2-NZ 2.71Å; D445-K449 PolarHBondContact OD2-NZ 3.4Å; D445-V519 HydrophobicContact CB-CB 4.36Å; D445-V519 HydrophobicContact CB-CG1 4.04Å; D445-V519 HydrophobicContact CB-CG2 3.43Å; D445-V519 VanDerWaalsContact CB-CG2 3.43Å; D445-V519 WeakPolarHBondContact OD2-CG1 3.37Å
446	E	89.4	Confident	86.5	Confident	42 Å²	42	57 Å²	57	20%	0.196	29%	0.285	C	S	.	.	H	α-helix	trans	-75.3	-39.6	175.9	-148.3	61.8	-102.6	0	0	111.5	M414 I442 T443 S448 K449 L450 R523	M414-E446 HydrophobicContact CE-CB 3.56Å; M414-E446 HydrophobicContact CE-CG 4.05Å; I442-E446 WeakPolarHBondContact O-CB 3.47Å; I442-E446 PolarHBondContact O-N 2.9Å; T443-E446 PolarHBondContact O-N 3.44Å; E446-S448 VanDerWaalsContact C-N 3.25Å; E446-S448 PolarHBondContact O-N 2.81Å; E446-K449 PolarHBondContact O-N 3.15Å; E446-K449 VanDerWaalsContact O-N 3.14Å; E446-K449 WeakPolarHBondContact OE1-CD 3.32Å; E446-K449 IonicContact OE1-NZ 3.41Å; E446-K449 PolarHBondContact OE1-NZ 3.22Å; E446-K449 IonicContact OE2-NZ 3.69Å; E446-K449 PolarHBondContact OE2-NZ 3Å; E446-L450 WeakPolarHBondContact O-CG 3.47Å; E446-L450 PolarHBondContact O-N 3.36Å; E446-R523 IonicContact OE2-CZ 3.63Å; E446-R523 IonicContact OE2-NH2 2.7Å; E446-R523 PolarHBondContact OE2-NH2 2.81Å
447	I	89.9	Confident	85	Confident	5 Å²	5	60.1 Å²	60.1	3%	0.026	32%	0.319	C	S	.	.	H	α-helix	trans	-54.5	-44.7	164.4	-70.3	165.4	0	0	0	110.4	M414 E415 L418 T443 K449 L450 R451	M414-I447 HydrophobicContact CB-CD1 3.79Å; M414-I447 HydrophobicContact CB-CG1 3.46Å; M414-I447 VanDerWaalsContact CB-CG1 3.46Å; M414-I447 HydrophobicContact CG-CG1 4.4Å; E415-I447 HydrophobicContact CG-CD1 4.17Å; L418-I447 HydrophobicContact CD1-CD1 3.52Å; L418-I447 HydrophobicContact CG-CD1 4.2Å; T443-I447 HydrophobicContact CG2-CD1 4.14Å; T443-I447 WeakPolarHBondContact O-CB 3.47Å; T443-I447 VanDerWaalsContact O-CG1 3.3Å; T443-I447 WeakPolarHBondContact O-CG1 3.44Å; T443-I447 PolarHBondContact O-N 3.49Å; I447-K449 VanDerWaalsContact C-N 3.33Å; I447-K449 PolarHBondContact O-N 2.91Å; I447-L450 PolarHBondContact O-N 3.41Å; I447-R451 HydrophobicContact CG2-CG 4.27Å; I447-R451 WeakPolarHBondContact O-CB 3.38Å; I447-R451 VanDerWaalsContact O-CG 3.32Å; I447-R451 WeakPolarHBondContact O-CG 3.49Å; I447-R451 PolarHBondContact O-N 3.35Å
448	S	88.3	Confident	83.2	Confident	50 Å²	50	63.1 Å²	63.1	35%	0.35	34%	0.335	S	S	.	.	H	α-helix	trans	-65	-33.7	178.8	-63.9	0	0	0	0	112.8	E444 D445 E446 K452	E444-S448 VanDerWaalsContact O-CB 3.28Å; E444-S448 WeakPolarHBondContact O-CB 3.41Å; E444-S448 PolarHBondContact O-N 3.28Å; E444-S448 PolarHBondContact O-OG 2.95Å; D445-S448 WeakPolarHBondContact O-CB 3.33Å; D445-S448 PolarHBondContact O-N 2.81Å; E446-S448 VanDerWaalsContact C-N 3.25Å; E446-S448 PolarHBondContact O-N 2.81Å; S448-K452 WeakPolarHBondContact O-CB 3.44Å; S448-K452 WeakPolarHBondContact O-CD 3.39Å; S448-K452 WeakPolarHBondContact O-CG 3.3Å; S448-K452 PolarHBondContact O-N 3.23Å
449	K	85.2	Confident	81.1	Confident	66 Å²	66	64.9 Å²	64.9	29%	0.287	35%	0.354	S	S	.	.	H	α-helix	trans	-70.6	-46.9	172	-78.7	-173.2	-121	66.1	0	112.1	D445 E446 I447 K452 L453	D445-K449 PolarHBondContact O-N 3.02Å; D445-K449 PolarHBondContact O-NZ 3.48Å; D445-K449 VanDerWaalsContact O-NZ 3.12Å; D445-K449 IonicContact OD1-NZ 3.83Å; D445-K449 WeakPolarHBondContact OD2-CE 3.14Å; D445-K449 IonicContact OD2-NZ 2.71Å; D445-K449 PolarHBondContact OD2-NZ 3.4Å; E446-K449 PolarHBondContact O-N 3.15Å; E446-K449 VanDerWaalsContact O-N 3.14Å; E446-K449 WeakPolarHBondContact OE1-CD 3.32Å; E446-K449 IonicContact OE1-NZ 3.41Å; E446-K449 PolarHBondContact OE1-NZ 3.22Å; E446-K449 IonicContact OE2-NZ 3.69Å; E446-K449 PolarHBondContact OE2-NZ 3Å; I447-K449 VanDerWaalsContact C-N 3.33Å; I447-K449 PolarHBondContact O-N 2.91Å; K449-K452 PolarHBondContact O-N 3.35Å; K449-L453 WeakPolarHBondContact O-CG 3.46Å; K449-L453 PolarHBondContact O-N 2.91Å
450	L	85.7	Confident	79	Confident	50 Å²	50	70.9 Å²	70.9	26%	0.262	39%	0.394	S	S	.	.	H	α-helix	trans	-59.9	-48.3	178.5	-69.2	172.8	0	0	0	111.4	V411 E446 I447 K452 L453 E454	V411-L450 HydrophobicContact CG2-CB 3.63Å; V411-L450 HydrophobicContact CG2-CD1 4.04Å; V411-L450 HydrophobicContact CG2-CG 4.45Å; E446-L450 WeakPolarHBondContact O-CG 3.47Å; E446-L450 PolarHBondContact O-N 3.36Å; I447-L450 PolarHBondContact O-N 3.41Å; L450-K452 VanDerWaalsContact C-N 3.32Å; L450-K452 PolarHBondContact O-N 3.05Å; L450-L453 WeakPolarHBondContact O-CB 3.47Å; L450-L453 PolarHBondContact O-N 2.87Å; L450-L453 VanDerWaalsContact O-N 3.12Å; L450-E454 PolarHBondContact O-N 2.77Å
451	R	86.7	Confident	76.8	Confident	128 Å²	128	73.2 Å²	73.2	48%	0.483	42%	0.423	S	S	.	.	H	α-helix	trans	-60.5	-36.9	174.9	-69.7	173.5	176.2	178.4	-3.6	112.6	V411 E415 I447 A455	V411-R451 HydrophobicContact CG1-CG 4.31Å; E415-R451 IonicContact OE1-CZ 3.57Å; E415-R451 IonicContact OE1-NE 2.66Å; E415-R451 IonicContact OE1-NH2 3.76Å; E415-R451 PolarHBondContact OE1-NH2 3.08Å; I447-R451 HydrophobicContact CG2-CG 4.27Å; I447-R451 WeakPolarHBondContact O-CB 3.38Å; I447-R451 VanDerWaalsContact O-CG 3.32Å; I447-R451 WeakPolarHBondContact O-CG 3.49Å; I447-R451 PolarHBondContact O-N 3.35Å; R451-A455 WeakPolarHBondContact O-CB 3.46Å; R451-A455 PolarHBondContact O-N 3.38Å
452	K	81.9	Confident	74.5	Confident	151 Å²	151	77.6 Å²	77.6	66%	0.657	45%	0.446	S	S	*	.	H	α-helix	trans	-67.9	-38.3	173.3	-77.9	170.9	-177.1	177.6	0	112.5	S448 K449 L450 A455 S456	S448-K452 WeakPolarHBondContact O-CB 3.44Å; S448-K452 WeakPolarHBondContact O-CD 3.39Å; S448-K452 WeakPolarHBondContact O-CG 3.3Å; S448-K452 PolarHBondContact O-N 3.23Å; K449-K452 PolarHBondContact O-N 3.35Å; L450-K452 VanDerWaalsContact C-N 3.32Å; L450-K452 PolarHBondContact O-N 3.05Å; K452-A455 PolarHBondContact O-N 3.44Å; K452-S456 WeakPolarHBondContact O-CB 3.38Å; K452-S456 PolarHBondContact O-N 3.35Å
453	L	79.2	Confident	72.6	Confident	117 Å²	117	88.3 Å²	88.3	61%	0.613	49%	0.486	S	S	*	.	H	α-helix	trans	-63.3	-48.4	174.4	-76.8	160	0	0	0	110.9	K449 L450 A455 S456 G457	K449-L453 WeakPolarHBondContact O-CG 3.46Å; K449-L453 PolarHBondContact O-N 2.91Å; L450-L453 WeakPolarHBondContact O-CB 3.47Å; L450-L453 PolarHBondContact O-N 2.87Å; L450-L453 VanDerWaalsContact O-N 3.12Å; L453-A455 PolarHBondContact O-N 2.99Å; L453-S456 PolarHBondContact O-N 3.4Å; L453-S456 PolarHBondContact O-OG 3.32Å; L453-G457 PolarHBondContact O-N 2.99Å
454	E	78.2	Confident	70.6	Confident	128 Å²	128	99.4 Å²	99.4	60%	0.598	53%	0.528	S	S	*	.	H	α-helix	trans	-58.6	-43.3	174.8	-70.9	-175.9	173.6	0	0	112.9	L450 G457	L450-E454 PolarHBondContact O-N 2.77Å; E454-G457 PolarHBondContact O-N 2.65Å
455	A	74.1	Confident	68.7	Low	47 Å²	47	102.4 Å²	102.4	39%	0.388	55%	0.547	S	S	.	.	H	α-helix	trans	-62.9	-43.3	175.4	0	0	0	0	0	111.8	R451 K452 L453 G457 K458	R451-A455 WeakPolarHBondContact O-CB 3.46Å; R451-A455 PolarHBondContact O-N 3.38Å; K452-A455 PolarHBondContact O-N 3.44Å; L453-A455 PolarHBondContact O-N 2.99Å; A455-G457 PolarHBondContact O-N 3.4Å; A455-K458 WeakPolarHBondContact O-CB 3.44Å; A455-K458 PolarHBondContact O-N 3.18Å
456	S	62.6	Low	67.1	Low	91 Å²	91	104 Å²	104	64%	0.636	57%	0.57	S	S	*	*	H	α-helix	trans	-61.8	-29.1	179.9	79.7	0	0	0	0	113.4	K452 L453 K458	K452-S456 WeakPolarHBondContact O-CB 3.38Å; K452-S456 PolarHBondContact O-N 3.35Å; L453-S456 PolarHBondContact O-N 3.4Å; L453-S456 PolarHBondContact O-OG 3.32Å; S456-K458 PolarHBondContact O-N 3.27Å
457	G	58.3	Low	65.7	Low	68 Å²	68	105 Å²	105	70%	0.701	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-13.5	173.2	0	0	0	0	0	114.5	L453 E454 A455 G459	L453-G457 PolarHBondContact O-N 2.99Å; E454-G457 PolarHBondContact O-N 2.65Å; A455-G457 PolarHBondContact O-N 3.4Å; G457-G459 PolarHBondContact O-N 3.05Å
458	K	52.2	Low	64.7	Low	193 Å²	193	109.8 Å²	109.8	84%	0.839	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	24.2	-167.2	-124.7	159.8	-169.4	161.4	0	115.7	A455 S456	A455-K458 WeakPolarHBondContact O-CB 3.44Å; A455-K458 PolarHBondContact O-N 3.18Å; S456-K458 PolarHBondContact O-N 3.27Å
459	G	48.8	Very low	63.9	Low	42 Å²	42	112.7 Å²	112.7	43%	0.433	62%	0.618	S	S	.	*			trans	102.7	179.3	160.2	0	0	0	0	0	116	G457 G461	G457-G459 PolarHBondContact O-N 3.05Å; G459-G461 PolarHBondContact O-N 3.18Å
460	P	45.8	Very low	63.4	Low	127 Å²	127	111.9 Å²	111.9	83%	0.825	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	10.3	-157.8	-19.5	33.9	0	0	0	117.1
461	G	47.6	Very low	62.9	Low	78 Å²	78	112.1 Å²	112.1	80%	0.804	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-33.7	-171.1	0	0	0	0	0	114.7	G459	G459-G461 PolarHBondContact O-N 3.18Å
462	D	45.3	Very low	62.4	Low	125 Å²	125	107.5 Å²	107.5	67%	0.668	61%	0.614	S	S	*	*			trans	-117	55.3	-157.8	-155.4	19.7	0	0	0	113
463	R	50.9	Low	62.5	Low	225 Å²	225	104.1 Å²	104.1	85%	0.849	61%	0.606	S	S	*	*			trans	-106.5	27.4	-178.3	-76	-175	163.2	-168.2	-6.6	113.4
464	R	50.8	Low	62.7	Low	233 Å²	233	103.4 Å²	103.4	88%	0.879	60%	0.603	S	S	*	*	S	Bend	trans	-105.7	-31	-174.2	-84.5	-173.9	165.4	-178.8	-6	115.9
465	D	50.3	Low	62.9	Low	156 Å²	156	98 Å²	98	83%	0.834	58%	0.579	S	S	*	*	S	Bend	trans	-100.9	11.6	-179.5	-59.2	-17.3	0	0	0	112.9
466	G	57.8	Low	63.3	Low	62 Å²	62	100 Å²	100	64%	0.639	58%	0.58	S	S	*	*			trans	-90.8	108.4	176.7	0	0	0	0	0	112	N468	G466-N468 PolarHBondContact O-N 3.48Å
467	I	61.3	Low	64.4	Low	63 Å²	63	99.9 Å²	99.9	32%	0.323	58%	0.579	S	S	.	*			trans	-53.3	138.9	165.8	-65.8	172.6	0	0	0	108.9	T469 V471 Y509 S512	I467-T469 PolarHBondContact O-N 2.82Å; I467-V471 HydrophobicContact CG2-CB 4Å; I467-V471 HydrophobicContact CG2-CG1 4.01Å; I467-Y509 HydrophobicContact CD1-CD2 3.65Å; I467-Y509 HydrophobicContact CD1-CE2 4.08Å; I467-Y509 HydrophobicContact CG1-CD2 4.14Å; I467-Y509 HydrophobicContact CG2-CE2 4.4Å; I467-S512 WeakPolarHBondContact CD1-OG 3.45Å
468	N	67.8	Low	65.7	Low	105 Å²	105	100.3 Å²	100.3	56%	0.561	57%	0.567	S	S	*	*			trans	-52.5	131.4	177.8	-174.9	-25.2	0	0	0	110.3	G466 A470 V471 S472	G466-N468 PolarHBondContact O-N 3.48Å; N468-A470 PolarHBondContact O-N 3.27Å; N468-A470 VanDerWaalsContact O-N 3.17Å; N468-A470 PolarHBondContact OD1-N 3.32Å; N468-A470 VanDerWaalsContact OD1-N 3.12Å; N468-V471 HydrophobicContact CB-CG2 4.18Å; N468-V471 PolarHBondContact O-N 3.16Å; N468-S472 PolarHBondContact O-N 3.44Å; N468-S472 PolarHBondContact O-OG 2.99Å
469	T	72.1	Confident	67.3	Low	112 Å²	112	91.4 Å²	91.4	69%	0.687	53%	0.529	S	S	*	.	H	α-helix	trans	-58.3	-31.8	-175.7	49.1	0	0	0	0	112.6	I467 S472 T473	I467-T469 PolarHBondContact O-N 2.82Å; T469-S472 WeakPolarHBondContact O-CB 3.32Å; T469-S472 PolarHBondContact O-N 2.95Å; T469-T473 PolarHBondContact O-N 2.8Å; T469-T473 PolarHBondContact O-OG1 2.83Å
470	A	73.3	Confident	69	Low	48 Å²	48	97.6 Å²	97.6	40%	0.397	54%	0.544	S	S	.	.	H	α-helix	trans	-64.9	-46.5	174.5	0	0	0	0	0	112.3	N468 S472 T473 D474	N468-A470 PolarHBondContact O-N 3.27Å; N468-A470 VanDerWaalsContact O-N 3.17Å; N468-A470 PolarHBondContact OD1-N 3.32Å; N468-A470 VanDerWaalsContact OD1-N 3.12Å; A470-S472 PolarHBondContact O-N 3.43Å; A470-T473 WeakPolarHBondContact CA-OG1 3.31Å; A470-T473 PolarHBondContact O-N 2.82Å; A470-T473 VanDerWaalsContact O-N 3.17Å; A470-T473 PolarHBondContact O-OG1 3.4Å; A470-D474 VanDerWaalsContact O-CG 3.26Å; A470-D474 PolarHBondContact O-N 3.07Å
471	V	76.6	Confident	70.7	Confident	55 Å²	55	94.7 Å²	94.7	33%	0.333	54%	0.537	S	S	.	.	H	α-helix	trans	-62.6	-36.7	175	179.1	0	0	0	0	110.2	I467 N468 D474 V475 Y509	I467-V471 HydrophobicContact CG2-CB 4Å; I467-V471 HydrophobicContact CG2-CG1 4.01Å; N468-V471 HydrophobicContact CB-CG2 4.18Å; N468-V471 PolarHBondContact O-N 3.16Å; V471-D474 PolarHBondContact O-N 3.46Å; V471-V475 HydrophobicContact CG1-CG2 4.35Å; V471-V475 VanDerWaalsContact O-CB 3.3Å; V471-V475 WeakPolarHBondContact O-CB 3.43Å; V471-V475 WeakPolarHBondContact O-CG2 3.16Å; V471-V475 PolarHBondContact O-N 2.75Å; V471-Y509 HydrophobicContact CG1-CE2 4.01Å
472	S	76.4	Confident	72.6	Confident	32 Å²	32	93.6 Å²	93.6	22%	0.224	51%	0.51	C	S	.	.	H	α-helix	trans	-64.9	-40.9	175.4	-56.9	0	0	0	0	112.4	N468 T469 A470 Q476	N468-S472 PolarHBondContact O-N 3.44Å; N468-S472 PolarHBondContact O-OG 2.99Å; T469-S472 WeakPolarHBondContact O-CB 3.32Å; T469-S472 PolarHBondContact O-N 2.95Å; A470-S472 PolarHBondContact O-N 3.43Å; S472-Q476 WeakPolarHBondContact O-CB 3.46Å; S472-Q476 VanDerWaalsContact O-CG 3.23Å; S472-Q476 WeakPolarHBondContact O-CG 3.42Å; S472-Q476 PolarHBondContact O-N 3.38Å
473	T	82.1	Confident	74.7	Confident	79 Å²	79	90.1 Å²	90.1	49%	0.485	49%	0.493	S	S	.	.	H	α-helix	trans	-69.1	-38.1	175.6	45.2	0	0	0	0	112.7	T469 A470 Q476 S477	T469-T473 PolarHBondContact O-N 2.8Å; T469-T473 PolarHBondContact O-OG1 2.83Å; A470-T473 WeakPolarHBondContact CA-OG1 3.31Å; A470-T473 PolarHBondContact O-N 2.82Å; A470-T473 VanDerWaalsContact O-N 3.17Å; A470-T473 PolarHBondContact O-OG1 3.4Å; T473-Q476 PolarHBondContact O-N 3.39Å; T473-S477 WeakPolarHBondContact O-CB 3.37Å; T473-S477 PolarHBondContact O-N 3.18Å
474	D	83.4	Confident	76.5	Confident	103 Å²	103	82.1 Å²	82.1	55%	0.551	46%	0.464	S	S	*	.	H	α-helix	trans	-65.4	-44.4	176.5	-64.8	-18.7	0	0	0	110.7	A470 V471 Q476 S477 V478	A470-D474 VanDerWaalsContact O-CG 3.26Å; A470-D474 PolarHBondContact O-N 3.07Å; V471-D474 PolarHBondContact O-N 3.46Å; D474-Q476 PolarHBondContact O-N 3.43Å; D474-S477 WeakPolarHBondContact O-CB 3.36Å; D474-S477 PolarHBondContact O-N 3.2Å; D474-V478 WeakPolarHBondContact O-CB 3.38Å; D474-V478 VanDerWaalsContact O-CG2 3.27Å; D474-V478 WeakPolarHBondContact O-CG2 3.43Å; D474-V478 PolarHBondContact O-N 2.68Å
475	V	83	Confident	78.4	Confident	15 Å²	15	74.6 Å²	74.6	9%	0.091	45%	0.446	C	S	.	.	H	α-helix	trans	-60.4	-43.9	173.5	165.8	0	0	0	0	111.8	V471 S477 V478 F479 L513	V471-V475 HydrophobicContact CG1-CG2 4.35Å; V471-V475 VanDerWaalsContact O-CB 3.3Å; V471-V475 WeakPolarHBondContact O-CB 3.43Å; V471-V475 WeakPolarHBondContact O-CG2 3.16Å; V471-V475 PolarHBondContact O-N 2.75Å; V475-S477 VanDerWaalsContact C-N 3.35Å; V475-S477 PolarHBondContact O-N 2.65Å; V475-V478 PolarHBondContact O-N 3.03Å; V475-F479 HydrophobicContact CG1-CD2 3.84Å; V475-F479 HydrophobicContact CG1-CE2 3.33Å; V475-F479 HydrophobicContact CG1-CZ 3.93Å; V475-F479 WeakPolarHBondContact O-CD2 3.22Å; V475-F479 WeakPolarHBondContact O-CG 3.46Å; V475-F479 PolarHBondContact O-N 2.7Å; V475-L513 HydrophobicContact CB-CD1 4.34Å; V475-L513 HydrophobicContact CG1-CD1 3.42Å; V475-L513 VanDerWaalsContact CG1-CD1 3.42Å; V475-L513 HydrophobicContact CG2-CD1 3.89Å
476	Q	83.7	Confident	80.4	Confident	89 Å²	89	71.8 Å²	71.8	42%	0.416	43%	0.429	S	S	.	.	H	α-helix	trans	-62.6	-40.3	175.2	-75	175.8	13	0	0	112.2	S472 T473 D474 F479 K480	S472-Q476 WeakPolarHBondContact O-CB 3.46Å; S472-Q476 VanDerWaalsContact O-CG 3.23Å; S472-Q476 WeakPolarHBondContact O-CG 3.42Å; S472-Q476 PolarHBondContact O-N 3.38Å; T473-Q476 PolarHBondContact O-N 3.39Å; D474-Q476 PolarHBondContact O-N 3.43Å; Q476-F479 PolarHBondContact O-N 3.3Å; Q476-K480 WeakPolarHBondContact O-CB 3.44Å; Q476-K480 PolarHBondContact O-N 3.43Å
477	S	85.4	Confident	82	Confident	88 Å²	88	68.9 Å²	68.9	62%	0.615	40%	0.398	S	S	*	.	H	α-helix	trans	-61.6	-47	173.9	-169.8	0	0	0	0	110.9	T473 D474 V475 F479 K480	T473-S477 WeakPolarHBondContact O-CB 3.37Å; T473-S477 PolarHBondContact O-N 3.18Å; D474-S477 WeakPolarHBondContact O-CB 3.36Å; D474-S477 PolarHBondContact O-N 3.2Å; V475-S477 VanDerWaalsContact C-N 3.35Å; V475-S477 PolarHBondContact O-N 2.65Å; S477-F479 PolarHBondContact O-N 2.94Å; S477-K480 PolarHBondContact O-N 3.28Å; S477-K480 VanDerWaalsContact O-N 3.17Å
478	V	85.8	Confident	83.4	Confident	76 Å²	76	69.9 Å²	69.9	46%	0.461	40%	0.402	S	S	.	.	H	α-helix	trans	-62.1	-24.5	177.9	167.2	0	0	0	0	113.2	D474 V475 K482	D474-V478 WeakPolarHBondContact O-CB 3.38Å; D474-V478 VanDerWaalsContact O-CG2 3.27Å; D474-V478 WeakPolarHBondContact O-CG2 3.43Å; D474-V478 PolarHBondContact O-N 2.68Å; V475-V478 PolarHBondContact O-N 3.03Å; V478-K482 VanDerWaalsContact O-CD 3.26Å; V478-K482 WeakPolarHBondContact O-CD 3.33Å; V478-K482 WeakPolarHBondContact O-CE 3.49Å; V478-K482 PolarHBondContact O-NZ 3.12Å
479	F	85.9	Confident	84.6	Confident	7 Å²	7	67.9 Å²	67.9	3%	0.031	40%	0.399	C	S	.	.	H	α-helix	trans	-98.9	-15	175.1	-58.1	-31.6	0	0	0	114.5	V475 Q476 S477 L487 L513 Q516 V517 Y520	V475-F479 HydrophobicContact CG1-CD2 3.84Å; V475-F479 HydrophobicContact CG1-CE2 3.33Å; V475-F479 HydrophobicContact CG1-CZ 3.93Å; V475-F479 WeakPolarHBondContact O-CD2 3.22Å; V475-F479 WeakPolarHBondContact O-CG 3.46Å; V475-F479 PolarHBondContact O-N 2.7Å; Q476-F479 PolarHBondContact O-N 3.3Å; S477-F479 PolarHBondContact O-N 2.94Å; F479-L487 HydrophobicContact CB-CD2 4.23Å; F479-L487 HydrophobicContact CD1-CD2 4.01Å; F479-L487 HydrophobicContact CG-CD2 4.34Å; F479-L513 HydrophobicContact CE2-CD1 3.89Å; F479-L513 HydrophobicContact CZ-CD1 3.7Å; F479-L513 HydrophobicContact CZ-CG 4.19Å; F479-Q516 HydrophobicContact CD2-CG 4.25Å; F479-Q516 HydrophobicContact CE2-CB 4.47Å; F479-Q516 HydrophobicContact CE2-CG 4.14Å; F479-V517 HydrophobicContact CD1-CG2 4.44Å; F479-V517 HydrophobicContact CD2-CG2 4.46Å; F479-V517 HydrophobicContact CE1-CG2 3.65Å; F479-V517 HydrophobicContact CE2-CG2 3.66Å; F479-V517 HydrophobicContact CZ-CG2 3.2Å; F479-Y520 HydrophobicContact CB-CD1 3.33Å; F479-Y520 HydrophobicContact CB-CD2 4.4Å; F479-Y520 HydrophobicContact CB-CE1 3.55Å; F479-Y520 HydrophobicContact CB-CG 3.78Å; F479-Y520 HydrophobicContact CD2-CD2 4.22Å; F479-Y520 HydrophobicContact CD2-CE2 4.46Å; F479-Y520 HydrophobicContact CD2-CG 4.27Å; F479-Y520 HydrophobicContact CG-CD1 4.39Å; F479-Y520 HydrophobicContact CG-CG 4.39Å
480	K	83.5	Confident	85.5	Confident	171 Å²	171	65 Å²	65	74%	0.743	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	136.7	177.6	-167.1	174.2	-177.9	-179.3	0	110.2	Q476 S477 K482	Q476-K480 WeakPolarHBondContact O-CB 3.44Å; Q476-K480 PolarHBondContact O-N 3.43Å; S477-K480 PolarHBondContact O-N 3.28Å; S477-K480 VanDerWaalsContact O-N 3.17Å; K480-K482 VanDerWaalsContact C-N 3.26Å; K480-K482 PolarHBondContact O-N 2.81Å
481	G	80.8	Confident	86.3	Confident	66 Å²	66	64.7 Å²	64.7	68%	0.68	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	-7.4	177	0	0	0	0	0	116.6
482	K	88.1	Confident	87.1	Confident	56 Å²	56	67.1 Å²	67.1	24%	0.243	38%	0.38	C	S	.	.			trans	-73.7	147.8	176	-70.8	-173.4	172.1	155.1	0	112.7	V478 K480 Q486 L487 L490	V478-K482 VanDerWaalsContact O-CD 3.26Å; V478-K482 WeakPolarHBondContact O-CD 3.33Å; V478-K482 WeakPolarHBondContact O-CE 3.49Å; V478-K482 PolarHBondContact O-NZ 3.12Å; K480-K482 VanDerWaalsContact C-N 3.26Å; K480-K482 PolarHBondContact O-N 2.81Å; K482-Q486 HydrophobicContact CB-CB 4.22Å; K482-Q486 HydrophobicContact CD-CB 4.47Å; K482-L487 HydrophobicContact CB-CD1 4.39Å; K482-L487 HydrophobicContact CB-CD2 4.07Å; K482-L487 HydrophobicContact CB-CG 3.91Å; K482-L487 HydrophobicContact CD-CD2 4.34Å; K482-L490 HydrophobicContact CD-CD1 3.76Å
483	T	89.7	Confident	87.8	Confident	52 Å²	52	69.7 Å²	69.7	32%	0.319	39%	0.391	S	S	.	.			trans	-74.9	163.1	172.4	64.9	0	0	0	0	111.4	S485 Q486 L487	T483-S485 VanDerWaalsContact C-N 3.31Å; T483-S485 PolarHBondContact O-N 2.96Å; T483-S485 PolarHBondContact OG1-OG 2.81Å; T483-Q486 PolarHBondContact O-N 2.9Å; T483-Q486 VanDerWaalsContact OG1-CG 3.28Å; T483-Q486 WeakPolarHBondContact OG1-CG 3.46Å; T483-Q486 PolarHBondContact OG1-N 2.87Å; T483-L487 WeakPolarHBondContact O-CG 3.13Å; T483-L487 PolarHBondContact O-N 2.64Å
484	Y	88.9	Confident	88.2	Confident	57 Å²	57	66.3 Å²	66.3	22%	0.224	37%	0.37	C	S	.	.	H	α-helix	trans	-55	-44.9	172.7	174.1	-106.2	0	0	0	112.3	Q486 L487 Q488 M521 R525 E528	Y484-Q486 PolarHBondContact O-N 3.13Å; Y484-L487 PolarHBondContact O-N 2.95Å; Y484-Q488 WeakPolarHBondContact O-CB 3.41Å; Y484-Q488 PolarHBondContact O-N 3.26Å; Y484-M521 HydrophobicContact CD2-CB 4.09Å; Y484-M521 HydrophobicContact CD2-CG 4.23Å; Y484-M521 HydrophobicContact CE2-CB 4.08Å; Y484-M521 HydrophobicContact CE2-CG 4.26Å; Y484-M521 HydrophobicContact CE2-SD 4.12Å; Y484-R525 HydrophobicContact CD2-CG 3.4Å; Y484-R525 HydrophobicContact CE2-CG 3.66Å; Y484-R525 HydrophobicContact CG-CG 3.89Å; Y484-R525 PolarHBondContact OH-NH1 3.45Å; Y484-E528 WeakPolarHBondContact CB-OE1 3.48Å; Y484-E528 WeakPolarHBondContact CB-OE2 3.37Å; Y484-E528 PolarHBondContact N-OE1 2.88Å
485	S	90.9	Very high	88.6	Confident	74 Å²	74	63.5 Å²	63.5	52%	0.517	35%	0.354	S	S	.	.	H	α-helix	trans	-61.4	-39.3	179.4	53.2	0	0	0	0	113.4	T483 Q488 A489	T483-S485 VanDerWaalsContact C-N 3.31Å; T483-S485 PolarHBondContact O-N 2.96Å; T483-S485 PolarHBondContact OG1-OG 2.81Å; S485-Q488 PolarHBondContact O-N 2.75Å; S485-A489 PolarHBondContact O-N 3.35Å
486	Q	91.5	Very high	88.9	Confident	98 Å²	98	64.4 Å²	64.4	46%	0.458	37%	0.367	S	S	.	.	H	α-helix	trans	-68.5	-38.7	175.2	-69.9	168.6	3.3	0	0	111.9	K482 T483 Y484 L490	K482-Q486 HydrophobicContact CB-CB 4.22Å; K482-Q486 HydrophobicContact CD-CB 4.47Å; T483-Q486 PolarHBondContact O-N 2.9Å; T483-Q486 VanDerWaalsContact OG1-CG 3.28Å; T483-Q486 WeakPolarHBondContact OG1-CG 3.46Å; T483-Q486 PolarHBondContact OG1-N 2.87Å; Y484-Q486 PolarHBondContact O-N 3.13Å; Q486-L490 WeakPolarHBondContact O-CG 3.29Å; Q486-L490 PolarHBondContact O-N 3.22Å; Q486-L490 VanDerWaalsContact O-N 3.16Å
487	L	91.4	Very high	89.1	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-70.6	-34.7	176.2	-67.8	166.8	0	0	0	112	F479 K482 T483 Y484 L490 H491 Y520 M521 A524	F479-L487 HydrophobicContact CB-CD2 4.23Å; F479-L487 HydrophobicContact CD1-CD2 4.01Å; F479-L487 HydrophobicContact CG-CD2 4.34Å; K482-L487 HydrophobicContact CB-CD1 4.39Å; K482-L487 HydrophobicContact CB-CD2 4.07Å; K482-L487 HydrophobicContact CB-CG 3.91Å; K482-L487 HydrophobicContact CD-CD2 4.34Å; T483-L487 WeakPolarHBondContact O-CG 3.13Å; T483-L487 PolarHBondContact O-N 2.64Å; Y484-L487 PolarHBondContact O-N 2.95Å; L487-L490 HydrophobicContact CD2-CD1 4.5Å; L487-L490 PolarHBondContact O-N 2.89Å; L487-H491 WeakPolarHBondContact O-CB 3.38Å; L487-H491 PolarHBondContact O-N 2.95Å; L487-Y520 WeakPolarHBondContact CD1-O 3.35Å; L487-M521 HydrophobicContact CB-CG 3.58Å; L487-A524 HydrophobicContact CD1-CB 3.82Å
488	Q	92	Very high	89.3	Confident	85 Å²	85	62.7 Å²	62.7	40%	0.397	35%	0.349	S	S	.	.	H	α-helix	trans	-65.2	-41.7	173.5	-171.8	-179.1	9.2	0	0	111.7	Y484 S485 L490 H491 L492 M521	Y484-Q488 WeakPolarHBondContact O-CB 3.41Å; Y484-Q488 PolarHBondContact O-N 3.26Å; S485-Q488 PolarHBondContact O-N 2.75Å; Q488-L490 VanDerWaalsContact C-N 3.3Å; Q488-L490 PolarHBondContact O-N 2.95Å; Q488-H491 WeakPolarHBondContact O-CB 3.4Å; Q488-H491 PolarHBondContact O-N 3.02Å; Q488-L492 WeakPolarHBondContact O-CG 3.14Å; Q488-L492 PolarHBondContact O-N 3.4Å; Q488-M521 HydrophobicContact CB-SD 4.3Å
489	A	92.3	Very high	89.3	Confident	62 Å²	62	68.8 Å²	68.8	51%	0.512	36%	0.363	S	S	.	.	H	α-helix	trans	-62.1	-37.6	172.9	0	0	0	0	0	112.3	S485 N493	S485-A489 PolarHBondContact O-N 3.35Å; A489-N493 WeakPolarHBondContact O-CB 3.29Å; A489-N493 PolarHBondContact O-N 3.2Å
490	L	90.6	Very high	89.4	Confident	53 Å²	53	72.7 Å²	72.7	28%	0.277	40%	0.397	S	S	.	.	H	α-helix	trans	-70.2	-39.6	175	-70.1	164.8	0	0	0	112.4	K482 Q486 L487 Q488 N493 I494	K482-L490 HydrophobicContact CD-CD1 3.76Å; Q486-L490 WeakPolarHBondContact O-CG 3.29Å; Q486-L490 PolarHBondContact O-N 3.22Å; Q486-L490 VanDerWaalsContact O-N 3.16Å; L487-L490 HydrophobicContact CD2-CD1 4.5Å; L487-L490 PolarHBondContact O-N 2.89Å; Q488-L490 VanDerWaalsContact C-N 3.3Å; Q488-L490 PolarHBondContact O-N 2.95Å; L490-N493 PolarHBondContact O-N 3.48Å; L490-I494 WeakPolarHBondContact O-CD1 3.5Å; L490-I494 VanDerWaalsContact O-CG1 3.29Å; L490-I494 WeakPolarHBondContact O-CG1 3.43Å; L490-I494 PolarHBondContact O-N 3.31Å
491	H	91.3	Very high	89.1	Confident	41 Å²	41	67 Å²	67	19%	0.19	39%	0.386	C	S	.	.	H	α-helix	trans	-57.6	-50.8	173.6	-179.2	-82.8	0	0	0	111	L487 Q488 N493 I494 E495 L514 V517 R518 M521	L487-H491 WeakPolarHBondContact O-CB 3.38Å; L487-H491 PolarHBondContact O-N 2.95Å; Q488-H491 WeakPolarHBondContact O-CB 3.4Å; Q488-H491 PolarHBondContact O-N 3.02Å; H491-N493 VanDerWaalsContact C-N 3.31Å; H491-N493 PolarHBondContact O-N 3Å; H491-I494 PolarHBondContact O-N 3.01Å; H491-I494 VanDerWaalsContact O-N 3.14Å; H491-E495 IonicContact CE1-OE1 3.01Å; H491-E495 PolarHBondContact CE1-OE1 3.46Å; H491-E495 IonicContact CE1-OE2 2.66Å; H491-E495 PolarHBondContact CE1-OE2 2.81Å; H491-E495 IonicContact ND1-OE1 2.7Å; H491-E495 IonicContact ND1-OE2 3.08Å; H491-E495 IonicContact NE2-OE1 3.97Å; H491-E495 PolarHBondContact O-N 3.46Å; H491-L514 VanDerWaalsContact CD2-CD1 3.41Å; H491-L514 WeakPolarHBondContact CD2-CD1 3.29Å; H491-V517 HydrophobicContact CB-CG1 3.78Å; H491-R518 WeakPolarHBondContact NE2-CD 3.33Å; H491-R518 WeakPolarHBondContact NE2-CG 3.24Å; H491-R518 PolarHBondContact NE2-NE 3.01Å; H491-M521 HydrophobicContact CB-CE 4.11Å; H491-M521 HydrophobicContact CB-SD 4.1Å; H491-M521 WeakPolarHBondContact CD2-CE 3.3Å
492	L	93.2	Very high	88.9	Confident	106 Å²	106	66 Å²	66	56%	0.555	38%	0.377	S	S	*	.	H	α-helix	trans	-62.5	-34.7	176	-68.1	172.9	0	0	0	112.8	Q488 G496	Q488-L492 WeakPolarHBondContact O-CG 3.14Å; Q488-L492 PolarHBondContact O-N 3.4Å; L492-G496 PolarHBondContact O-N 2.87Å
493	N	91.5	Very high	88.2	Confident	85 Å²	85	69.1 Å²	69.1	46%	0.455	41%	0.406	S	S	.	.	H	α-helix	trans	-67.4	-38.1	174.6	-165.8	-94.7	0	0	0	112.4	A489 L490 H491 K497	A489-N493 WeakPolarHBondContact O-CB 3.29Å; A489-N493 PolarHBondContact O-N 3.2Å; L490-N493 PolarHBondContact O-N 3.48Å; H491-N493 VanDerWaalsContact C-N 3.31Å; H491-N493 PolarHBondContact O-N 3Å; N493-K497 WeakPolarHBondContact O-CG 3.4Å; N493-K497 PolarHBondContact O-N 3.12Å; N493-K497 VanDerWaalsContact OD1-CE 3.3Å; N493-K497 WeakPolarHBondContact OD1-CE 3.36Å; N493-K497 PolarHBondContact OD1-NZ 3.44Å
494	I	89.3	Confident	87.5	Confident	8 Å²	8	74.1 Å²	74.1	4%	0.041	43%	0.43	C	S	.	.	H	α-helix	trans	-71.3	-48.2	177.1	-69.2	161.6	0	0	0	110.6	L490 H491 G496 K497 I498 W510 L513 L514 V517	L490-I494 WeakPolarHBondContact O-CD1 3.5Å; L490-I494 VanDerWaalsContact O-CG1 3.29Å; L490-I494 WeakPolarHBondContact O-CG1 3.43Å; L490-I494 PolarHBondContact O-N 3.31Å; H491-I494 PolarHBondContact O-N 3.01Å; H491-I494 VanDerWaalsContact O-N 3.14Å; I494-G496 VanDerWaalsContact C-N 3.25Å; I494-G496 PolarHBondContact O-N 3.39Å; I494-K497 PolarHBondContact O-N 3.01Å; I494-K497 VanDerWaalsContact O-N 3.09Å; I494-I498 HydrophobicContact CG2-CD1 3.84Å; I494-I498 HydrophobicContact CG2-CG1 4.48Å; I494-I498 WeakPolarHBondContact O-CG1 3.47Å; I494-I498 PolarHBondContact O-N 3.11Å; I494-W510 HydrophobicContact CB-CE3 4.49Å; I494-W510 HydrophobicContact CG1-CE3 4.03Å; I494-W510 HydrophobicContact CG1-CZ3 4.01Å; I494-W510 HydrophobicContact CG2-CE3 4.03Å; I494-L513 HydrophobicContact CD1-CD2 3.81Å; I494-L513 HydrophobicContact CD1-CG 4.06Å; I494-L513 HydrophobicContact CG1-CD2 4.27Å; I494-L514 HydrophobicContact CB-CD1 4.46Å; I494-L514 HydrophobicContact CG2-CB 3.93Å; I494-L514 HydrophobicContact CG2-CD1 4.05Å; I494-L514 HydrophobicContact CG2-CG 4.5Å; I494-V517 HydrophobicContact CD1-CG2 3.79Å
495	E	91.3	Very high	87.1	Confident	44 Å²	44	74.1 Å²	74.1	21%	0.206	43%	0.434	C	S	.	.	H	α-helix	trans	-61.6	-35.5	174.8	-68.6	-167.5	156.4	0	0	111.7	H491 R499 L514 R518	H491-E495 IonicContact CE1-OE1 3.01Å; H491-E495 PolarHBondContact CE1-OE1 3.46Å; H491-E495 IonicContact CE1-OE2 2.66Å; H491-E495 PolarHBondContact CE1-OE2 2.81Å; H491-E495 IonicContact ND1-OE1 2.7Å; H491-E495 IonicContact ND1-OE2 3.08Å; H491-E495 IonicContact NE2-OE1 3.97Å; H491-E495 PolarHBondContact O-N 3.46Å; E495-R499 WeakPolarHBondContact O-CB 3.43Å; E495-R499 PolarHBondContact O-N 3.48Å; E495-L514 HydrophobicContact CG-CD1 3.64Å; E495-L514 HydrophobicContact CG-CD2 3.84Å; E495-L514 HydrophobicContact CG-CG 4.42Å; E495-R518 IonicContact OE1-NH2 3.62Å; E495-R518 PolarHBondContact OE1-NH2 3.36Å; E495-R518 VanDerWaalsContact OE1-NH2 3.14Å
496	G	90.9	Very high	86.7	Confident	35 Å²	35	75.5 Å²	75.5	36%	0.361	44%	0.435	S	S	.	.	H	α-helix	trans	-61.1	-43.7	171	0	0	0	0	0	113.1	L492 I494 R499 A500	L492-G496 PolarHBondContact O-N 2.87Å; I494-G496 VanDerWaalsContact C-N 3.25Å; I494-G496 PolarHBondContact O-N 3.39Å; G496-R499 PolarHBondContact O-N 2.86Å; G496-A500 VanDerWaalsContact O-CB 3.24Å; G496-A500 WeakPolarHBondContact O-CB 3.27Å; G496-A500 PolarHBondContact O-N 2.87Å
497	K	87.6	Confident	86.3	Confident	90 Å²	90	75.5 Å²	75.5	39%	0.391	44%	0.438	S	S	.	.	H	α-helix	trans	-67.2	-43.5	176.4	-79	164.9	173.9	159	0	112.9	N493 I494 R499 G501 W510	N493-K497 WeakPolarHBondContact O-CG 3.4Å; N493-K497 PolarHBondContact O-N 3.12Å; N493-K497 VanDerWaalsContact OD1-CE 3.3Å; N493-K497 WeakPolarHBondContact OD1-CE 3.36Å; N493-K497 PolarHBondContact OD1-NZ 3.44Å; I494-K497 PolarHBondContact O-N 3.01Å; I494-K497 VanDerWaalsContact O-N 3.09Å; K497-R499 VanDerWaalsContact C-N 3.32Å; K497-R499 PolarHBondContact O-N 3.42Å; K497-G501 PolarHBondContact O-N 3.4Å; K497-W510 HydrophobicContact CD-CH2 4.01Å; K497-W510 HydrophobicContact CD-CZ2 4.4Å; K497-W510 HydrophobicContact CD-CZ3 4.17Å
498	I	88.1	Confident	85.9	Confident	51 Å²	51	77.4 Å²	77.4	26%	0.262	46%	0.457	S	S	.	.	H	α-helix	trans	-60.6	-44.5	175	-65.4	165.3	0	0	0	110	I494 W510 L514	I494-I498 HydrophobicContact CG2-CD1 3.84Å; I494-I498 HydrophobicContact CG2-CG1 4.48Å; I494-I498 WeakPolarHBondContact O-CG1 3.47Å; I494-I498 PolarHBondContact O-N 3.11Å; I498-W510 HydrophobicContact CD1-CB 3.94Å; I498-W510 HydrophobicContact CG1-CB 3.67Å; I498-L514 HydrophobicContact CD1-CB 4.47Å; I498-L514 HydrophobicContact CD1-CD2 3.99Å
499	R	87.4	Confident	85.5	Confident	204 Å²	204	76.1 Å²	76.1	77%	0.77	45%	0.449	S	S	*	.	H	α-helix	trans	-72.6	-35.3	-178.9	-168.3	-174.6	-54.4	-176.7	4.8	113.9	E495 G496 K497 G501	E495-R499 WeakPolarHBondContact O-CB 3.43Å; E495-R499 PolarHBondContact O-N 3.48Å; G496-R499 PolarHBondContact O-N 2.86Å; K497-R499 VanDerWaalsContact C-N 3.32Å; K497-R499 PolarHBondContact O-N 3.42Å; R499-G501 VanDerWaalsContact C-N 3.33Å
500	A	86.8	Confident	85.2	Confident	88 Å²	88	75.6 Å²	75.6	73%	0.727	43%	0.434	S	S	*	.	H	α-helix	trans	-65.5	-39.5	176.1	0	0	0	0	0	111.4	G496	G496-A500 VanDerWaalsContact O-CB 3.24Å; G496-A500 WeakPolarHBondContact O-CB 3.27Å; G496-A500 PolarHBondContact O-N 2.87Å
501	G	77.6	Confident	85	Confident	51 Å²	51	78.5 Å²	78.5	53%	0.526	45%	0.446	S	S	.	.			trans	73.7	153.4	176.4	0	0	0	0	0	114	K497 R499	K497-G501 PolarHBondContact O-N 3.4Å; R499-G501 VanDerWaalsContact C-N 3.33Å
502	G	76.8	Confident	84.6	Confident	47 Å²	47	78.8 Å²	78.8	49%	0.485	45%	0.453	S	S	.	.			trans	-163.5	140.5	172.8	0	0	0	0	0	109.8	N504 L505	G502-N504 PolarHBondContact O-N 3.2Å; G502-L505 WeakPolarHBondContact O-CB 3.41Å; G502-L505 PolarHBondContact O-N 3.45Å
503	S	73.2	Confident	84.4	Confident	121 Å²	121	74.4 Å²	74.4	85%	0.846	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.1	-174.1	59.5	0	0	0	0	114.4
504	N	75.3	Confident	84.3	Confident	156 Å²	156	71 Å²	71	83%	0.834	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	12.1	-175.4	-53	1.2	0	0	0	111.6	G502	G502-N504 PolarHBondContact O-N 3.2Å
505	L	80.3	Confident	84.2	Confident	57 Å²	57	74.2 Å²	74.2	30%	0.298	43%	0.426	S	S	.	.			trans	-90.5	120.4	-177.4	-158	80.5	0	0	0	110	G502 I507	G502-L505 WeakPolarHBondContact O-CB 3.41Å; G502-L505 PolarHBondContact O-N 3.45Å; L505-I507 PolarHBondContact O-N 2.89Å
506	D	82	Confident	84.1	Confident	103 Å²	103	74.2 Å²	74.2	55%	0.551	43%	0.426	S	S	*	.			trans	-72.6	96.1	175.6	-178	-8.6	0	0	0	110.6	G508 Y509 W510	D506-G508 VanDerWaalsContact C-N 3.28Å; D506-G508 PolarHBondContact O-N 3.07Å; D506-G508 PolarHBondContact OD1-N 3.1Å; D506-Y509 VanDerWaalsContact CG-CB 3.49Å; D506-Y509 PolarHBondContact O-N 3.36Å; D506-Y509 PolarHBondContact OD1-N 3.19Å; D506-Y509 WeakPolarHBondContact OD2-CB 3.41Å; D506-W510 PolarHBondContact O-N 2.92Å; D506-W510 VanDerWaalsContact O-N 3.11Å
507	I	83.1	Confident	84.1	Confident	99 Å²	99	72.5 Å²	72.5	51%	0.508	41%	0.409	S	S	.	.	H	α-helix	trans	-59.4	-39.6	180	-61.3	173.4	0	0	0	110.9	L505 Y509 W510 E511	L505-I507 PolarHBondContact O-N 2.89Å; I507-Y509 PolarHBondContact O-N 2.79Å; I507-W510 PolarHBondContact O-N 2.91Å; I507-E511 HydrophobicContact CG2-CG 4.01Å; I507-E511 WeakPolarHBondContact O-CB 3.45Å; I507-E511 VanDerWaalsContact O-CG 3.32Å; I507-E511 WeakPolarHBondContact O-CG 3.24Å; I507-E511 PolarHBondContact O-N 2.91Å
508	G	82.6	Confident	84.2	Confident	40 Å²	40	72.6 Å²	72.6	41%	0.412	41%	0.407	S	S	.	.	H	α-helix	trans	-67.2	-37	-179.5	0	0	0	0	0	112.7	D506 S512	D506-G508 VanDerWaalsContact C-N 3.28Å; D506-G508 PolarHBondContact O-N 3.07Å; D506-G508 PolarHBondContact OD1-N 3.1Å; G508-S512 WeakPolarHBondContact O-CB 3.48Å; G508-S512 PolarHBondContact O-N 2.86Å; G508-S512 PolarHBondContact O-OG 3.05Å
509	Y	84.3	Confident	84.4	Confident	58 Å²	58	70.2 Å²	70.2	23%	0.227	40%	0.395	C	S	.	.	H	α-helix	trans	-60.8	-50	168.9	173.9	-95.8	0	0	0	111.6	I467 V471 D506 I507 E511 S512 L513	I467-Y509 HydrophobicContact CD1-CD2 3.65Å; I467-Y509 HydrophobicContact CD1-CE2 4.08Å; I467-Y509 HydrophobicContact CG1-CD2 4.14Å; I467-Y509 HydrophobicContact CG2-CE2 4.4Å; V471-Y509 HydrophobicContact CG1-CE2 4.01Å; D506-Y509 VanDerWaalsContact CG-CB 3.49Å; D506-Y509 PolarHBondContact O-N 3.36Å; D506-Y509 PolarHBondContact OD1-N 3.19Å; D506-Y509 WeakPolarHBondContact OD2-CB 3.41Å; I507-Y509 PolarHBondContact O-N 2.79Å; Y509-E511 PolarHBondContact O-N 3.47Å; Y509-S512 PolarHBondContact O-N 3.02Å; Y509-S512 PolarHBondContact O-OG 3.14Å; Y509-L513 HydrophobicContact CE1-CD2 4.08Å; Y509-L513 VanDerWaalsContact O-CB 3.25Å; Y509-L513 WeakPolarHBondContact O-CB 3.35Å; Y509-L513 PolarHBondContact O-N 2.59Å
510	W	85.6	Confident	84.5	Confident	51 Å²	51	62.6 Å²	62.6	19%	0.193	37%	0.366	C	S	.	.	H	α-helix	trans	-70.1	-32.2	-178.2	-68.3	104.8	0	0	0	113.4	I494 K497 I498 D506 I507 L513 L514	I494-W510 HydrophobicContact CB-CE3 4.49Å; I494-W510 HydrophobicContact CG1-CE3 4.03Å; I494-W510 HydrophobicContact CG1-CZ3 4.01Å; I494-W510 HydrophobicContact CG2-CE3 4.03Å; K497-W510 HydrophobicContact CD-CH2 4.01Å; K497-W510 HydrophobicContact CD-CZ2 4.4Å; K497-W510 HydrophobicContact CD-CZ3 4.17Å; I498-W510 HydrophobicContact CD1-CB 3.94Å; I498-W510 HydrophobicContact CG1-CB 3.67Å; D506-W510 PolarHBondContact O-N 2.92Å; D506-W510 VanDerWaalsContact O-N 3.11Å; I507-W510 PolarHBondContact O-N 2.91Å; W510-L513 HydrophobicContact CE3-CD2 3.63Å; W510-L513 HydrophobicContact CZ3-CD2 3.62Å; W510-L514 VanDerWaalsContact O-CB 3.22Å; W510-L514 WeakPolarHBondContact O-CB 3.36Å; W510-L514 PolarHBondContact O-N 2.55Å
511	E	86.5	Confident	84.7	Confident	114 Å²	114	59.2 Å²	59.2	53%	0.533	34%	0.335	S	S	.	.	H	α-helix	trans	-67.6	-44.4	173.7	-76.3	178.3	165.2	0	0	112	I507 Y509 L514 Q515	I507-E511 HydrophobicContact CG2-CG 4.01Å; I507-E511 WeakPolarHBondContact O-CB 3.45Å; I507-E511 VanDerWaalsContact O-CG 3.32Å; I507-E511 WeakPolarHBondContact O-CG 3.24Å; I507-E511 PolarHBondContact O-N 2.91Å; Y509-E511 PolarHBondContact O-N 3.47Å; E511-L514 WeakPolarHBondContact O-CB 3.49Å; E511-L514 PolarHBondContact O-N 2.86Å; E511-Q515 PolarHBondContact O-N 3.35Å
512	S	84.3	Confident	85.3	Confident	47 Å²	47	56.8 Å²	56.8	33%	0.329	31%	0.311	S	S	.	.	H	α-helix	trans	-68.6	-36.2	175.6	57.5	0	0	0	0	112.3	I467 G508 Y509 Q515 Q516	I467-S512 WeakPolarHBondContact CD1-OG 3.45Å; G508-S512 WeakPolarHBondContact O-CB 3.48Å; G508-S512 PolarHBondContact O-N 2.86Å; G508-S512 PolarHBondContact O-OG 3.05Å; Y509-S512 PolarHBondContact O-N 3.02Å; Y509-S512 PolarHBondContact O-OG 3.14Å; S512-Q515 PolarHBondContact O-N 2.92Å; S512-Q516 PolarHBondContact O-N 2.76Å
513	L	88	Confident	86	Confident	13 Å²	13	56.9 Å²	56.9	7%	0.068	30%	0.297	C	S	.	.	H	α-helix	trans	-63.3	-41.5	170.6	-169.7	72	0	0	0	111.6	V475 F479 I494 Y509 W510 Q516 V517	V475-L513 HydrophobicContact CB-CD1 4.34Å; V475-L513 HydrophobicContact CG1-CD1 3.42Å; V475-L513 VanDerWaalsContact CG1-CD1 3.42Å; V475-L513 HydrophobicContact CG2-CD1 3.89Å; F479-L513 HydrophobicContact CE2-CD1 3.89Å; F479-L513 HydrophobicContact CZ-CD1 3.7Å; F479-L513 HydrophobicContact CZ-CG 4.19Å; I494-L513 HydrophobicContact CD1-CD2 3.81Å; I494-L513 HydrophobicContact CD1-CG 4.06Å; I494-L513 HydrophobicContact CG1-CD2 4.27Å; Y509-L513 HydrophobicContact CE1-CD2 4.08Å; Y509-L513 VanDerWaalsContact O-CB 3.25Å; Y509-L513 WeakPolarHBondContact O-CB 3.35Å; Y509-L513 PolarHBondContact O-N 2.59Å; W510-L513 HydrophobicContact CE3-CD2 3.63Å; W510-L513 HydrophobicContact CZ3-CD2 3.62Å; L513-Q516 PolarHBondContact O-N 2.95Å; L513-V517 WeakPolarHBondContact O-CG2 3.37Å; L513-V517 PolarHBondContact O-N 2.82Å
514	L	88.8	Confident	86.7	Confident	14 Å²	14	51.2 Å²	51.2	7%	0.073	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-41.8	176	-177.9	63.4	0	0	0	111.5	H491 I494 E495 I498 W510 E511 V517 R518	H491-L514 VanDerWaalsContact CD2-CD1 3.41Å; H491-L514 WeakPolarHBondContact CD2-CD1 3.29Å; I494-L514 HydrophobicContact CB-CD1 4.46Å; I494-L514 HydrophobicContact CG2-CB 3.93Å; I494-L514 HydrophobicContact CG2-CD1 4.05Å; I494-L514 HydrophobicContact CG2-CG 4.5Å; E495-L514 HydrophobicContact CG-CD1 3.64Å; E495-L514 HydrophobicContact CG-CD2 3.84Å; E495-L514 HydrophobicContact CG-CG 4.42Å; I498-L514 HydrophobicContact CD1-CB 4.47Å; I498-L514 HydrophobicContact CD1-CD2 3.99Å; W510-L514 VanDerWaalsContact O-CB 3.22Å; W510-L514 WeakPolarHBondContact O-CB 3.36Å; W510-L514 PolarHBondContact O-N 2.55Å; E511-L514 WeakPolarHBondContact O-CB 3.49Å; E511-L514 PolarHBondContact O-N 2.86Å; L514-V517 PolarHBondContact O-N 3.13Å; L514-R518 WeakPolarHBondContact O-CG 3.5Å; L514-R518 PolarHBondContact O-N 2.68Å
515	Q	88.8	Confident	87.4	Confident	76 Å²	76	48 Å²	48	36%	0.355	23%	0.233	S	C	.	.	H	α-helix	trans	-64.5	-42.8	174.1	-172.6	62.3	11.6	0	0	111.5	E511 S512 V517 R518 V519	E511-Q515 PolarHBondContact O-N 3.35Å; S512-Q515 PolarHBondContact O-N 2.92Å; Q515-V517 VanDerWaalsContact C-N 3.34Å; Q515-V517 PolarHBondContact O-N 3.09Å; Q515-R518 WeakPolarHBondContact O-CB 3.25Å; Q515-R518 PolarHBondContact O-N 3.14Å; Q515-V519 WeakPolarHBondContact O-CG2 3.17Å; Q515-V519 PolarHBondContact O-N 2.93Å; Q515-V519 VanDerWaalsContact O-N 3.13Å
516	Q	87.7	Confident	87.8	Confident	43 Å²	43	45.5 Å²	45.5	20%	0.201	22%	0.22	C	C	.	.	H	α-helix	trans	-61.6	-40.8	174.6	-170.3	174.9	-3.5	0	0	111.7	F479 S512 L513 R518 V519 Y520	F479-Q516 HydrophobicContact CD2-CG 4.25Å; F479-Q516 HydrophobicContact CE2-CB 4.47Å; F479-Q516 HydrophobicContact CE2-CG 4.14Å; S512-Q516 PolarHBondContact O-N 2.76Å; L513-Q516 PolarHBondContact O-N 2.95Å; Q516-R518 VanDerWaalsContact C-N 3.35Å; Q516-R518 PolarHBondContact O-N 2.91Å; Q516-V519 PolarHBondContact O-N 2.92Å; Q516-Y520 HydrophobicContact CG-CD2 3.99Å; Q516-Y520 HydrophobicContact CG-CE2 4Å; Q516-Y520 WeakPolarHBondContact O-CD2 3.38Å; Q516-Y520 PolarHBondContact O-N 3.06Å
517	V	90.6	Very high	88.1	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-39.7	174	171	0	0	0	0	111.7	F479 H491 I494 L513 L514 Q515 V519 Y520 M521	F479-V517 HydrophobicContact CD1-CG2 4.44Å; F479-V517 HydrophobicContact CD2-CG2 4.46Å; F479-V517 HydrophobicContact CE1-CG2 3.65Å; F479-V517 HydrophobicContact CE2-CG2 3.66Å; F479-V517 HydrophobicContact CZ-CG2 3.2Å; H491-V517 HydrophobicContact CB-CG1 3.78Å; I494-V517 HydrophobicContact CD1-CG2 3.79Å; L513-V517 WeakPolarHBondContact O-CG2 3.37Å; L513-V517 PolarHBondContact O-N 2.82Å; L514-V517 PolarHBondContact O-N 3.13Å; Q515-V517 VanDerWaalsContact C-N 3.34Å; Q515-V517 PolarHBondContact O-N 3.09Å; V517-V519 VanDerWaalsContact C-N 3.33Å; V517-V519 PolarHBondContact O-N 3.23Å; V517-Y520 PolarHBondContact O-N 2.66Å; V517-M521 HydrophobicContact CG1-CE 4.4Å; V517-M521 HydrophobicContact CG1-CG 4.3Å; V517-M521 HydrophobicContact CG1-SD 4.46Å; V517-M521 WeakPolarHBondContact O-CB 3.39Å; V517-M521 WeakPolarHBondContact O-CG 3.18Å; V517-M521 PolarHBondContact O-N 3.39Å
518	R	91.1	Very high	88.4	Confident	92 Å²	92	41.8 Å²	41.8	35%	0.347	19%	0.194	S	C	.	.	H	α-helix	trans	-60.1	-42.4	175.7	-70.7	165.1	-176	-173	-6.5	111.9	H491 E495 L514 Q515 Q516 M521 A522	H491-R518 WeakPolarHBondContact NE2-CD 3.33Å; H491-R518 WeakPolarHBondContact NE2-CG 3.24Å; H491-R518 PolarHBondContact NE2-NE 3.01Å; E495-R518 IonicContact OE1-NH2 3.62Å; E495-R518 PolarHBondContact OE1-NH2 3.36Å; E495-R518 VanDerWaalsContact OE1-NH2 3.14Å; L514-R518 WeakPolarHBondContact O-CG 3.5Å; L514-R518 PolarHBondContact O-N 2.68Å; Q515-R518 WeakPolarHBondContact O-CB 3.25Å; Q515-R518 PolarHBondContact O-N 3.14Å; Q516-R518 VanDerWaalsContact C-N 3.35Å; Q516-R518 PolarHBondContact O-N 2.91Å; R518-M521 HydrophobicContact CG-CE 4.12Å; R518-M521 PolarHBondContact O-N 2.89Å; R518-A522 PolarHBondContact O-N 2.84Å
519	V	91	Very high	88.5	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-67.7	-41.5	175.7	-178.5	0	0	0	0	111.5	T441 I442 D445 Q515 Q516 V517 M521 A522 R523	T441-V519 HydrophobicContact CG2-CG2 4.21Å; I442-V519 HydrophobicContact CG1-CG1 4.18Å; D445-V519 HydrophobicContact CB-CB 4.36Å; D445-V519 HydrophobicContact CB-CG1 4.04Å; D445-V519 HydrophobicContact CB-CG2 3.43Å; D445-V519 VanDerWaalsContact CB-CG2 3.43Å; D445-V519 WeakPolarHBondContact OD2-CG1 3.37Å; Q515-V519 WeakPolarHBondContact O-CG2 3.17Å; Q515-V519 PolarHBondContact O-N 2.93Å; Q515-V519 VanDerWaalsContact O-N 3.13Å; Q516-V519 PolarHBondContact O-N 2.92Å; V517-V519 VanDerWaalsContact C-N 3.33Å; V517-V519 PolarHBondContact O-N 3.23Å; V519-M521 VanDerWaalsContact C-N 3.32Å; V519-M521 PolarHBondContact O-N 3.11Å; V519-A522 PolarHBondContact O-N 3.32Å; V519-R523 HydrophobicContact CG1-CG 4.48Å; V519-R523 WeakPolarHBondContact O-CG 3.41Å; V519-R523 PolarHBondContact O-N 2.83Å
520	Y	90.1	Very high	88.6	Confident	44 Å²	44	43.2 Å²	43.2	17%	0.173	19%	0.188	C	C	.	.	H	α-helix	trans	-67.2	-31.8	175.8	-89.5	-104.6	0	0	0	112.5	F479 L487 Q516 V517 R523 A524	F479-Y520 HydrophobicContact CB-CD1 3.33Å; F479-Y520 HydrophobicContact CB-CD2 4.4Å; F479-Y520 HydrophobicContact CB-CE1 3.55Å; F479-Y520 HydrophobicContact CB-CG 3.78Å; F479-Y520 HydrophobicContact CD2-CD2 4.22Å; F479-Y520 HydrophobicContact CD2-CE2 4.46Å; F479-Y520 HydrophobicContact CD2-CG 4.27Å; F479-Y520 HydrophobicContact CG-CD1 4.39Å; F479-Y520 HydrophobicContact CG-CG 4.39Å; L487-Y520 WeakPolarHBondContact CD1-O 3.35Å; Q516-Y520 HydrophobicContact CG-CD2 3.99Å; Q516-Y520 HydrophobicContact CG-CE2 4Å; Q516-Y520 WeakPolarHBondContact O-CD2 3.38Å; Q516-Y520 PolarHBondContact O-N 3.06Å; V517-Y520 PolarHBondContact O-N 2.66Å; Y520-R523 CarbonylContact O-C 3.58Å; Y520-A524 WeakPolarHBondContact O-CB 3.41Å; Y520-A524 PolarHBondContact O-N 2.97Å
521	M	90.8	Very high	88.6	Confident	16 Å²	16	45.6 Å²	45.6	8%	0.079	20%	0.201	C	C	.	.	H	α-helix	trans	-65.3	-45.7	170.1	-76.5	-168.5	-55.7	0	0	111.7	Y484 L487 Q488 H491 V517 R518 V519 A524 R525	Y484-M521 HydrophobicContact CD2-CB 4.09Å; Y484-M521 HydrophobicContact CD2-CG 4.23Å; Y484-M521 HydrophobicContact CE2-CB 4.08Å; Y484-M521 HydrophobicContact CE2-CG 4.26Å; Y484-M521 HydrophobicContact CE2-SD 4.12Å; L487-M521 HydrophobicContact CB-CG 3.58Å; Q488-M521 HydrophobicContact CB-SD 4.3Å; H491-M521 HydrophobicContact CB-CE 4.11Å; H491-M521 HydrophobicContact CB-SD 4.1Å; H491-M521 WeakPolarHBondContact CD2-CE 3.3Å; V517-M521 HydrophobicContact CG1-CE 4.4Å; V517-M521 HydrophobicContact CG1-CG 4.3Å; V517-M521 HydrophobicContact CG1-SD 4.46Å; V517-M521 WeakPolarHBondContact O-CB 3.39Å; V517-M521 WeakPolarHBondContact O-CG 3.18Å; V517-M521 PolarHBondContact O-N 3.39Å; R518-M521 HydrophobicContact CG-CE 4.12Å; R518-M521 PolarHBondContact O-N 2.89Å; V519-M521 VanDerWaalsContact C-N 3.32Å; V519-M521 PolarHBondContact O-N 3.11Å; M521-A524 WeakPolarHBondContact O-CB 3.37Å; M521-A524 PolarHBondContact O-N 3.3Å; M521-A524 VanDerWaalsContact O-N 3.08Å; M521-R525 PolarHBondContact O-N 2.96Å
522	A	91.3	Very high	88.5	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-59.9	-46	173.4	0	0	0	0	0	111.5	D438 T441 I442 R518 V519 A524 R525 L526	D438-A522 HydrophobicContact CB-CB 3.84Å; T441-A522 HydrophobicContact CG2-CB 4.31Å; I442-A522 HydrophobicContact CD1-CB 4.04Å; I442-A522 HydrophobicContact CG1-CB 3.97Å; R518-A522 PolarHBondContact O-N 2.84Å; V519-A522 PolarHBondContact O-N 3.32Å; A522-A524 PolarHBondContact O-N 2.59Å; A522-R525 PolarHBondContact O-N 3.17Å; A522-L526 WeakPolarHBondContact O-CG 3.23Å; A522-L526 PolarHBondContact O-N 3.36Å
523	R	89.8	Confident	88.4	Confident	49 Å²	49	42.7 Å²	42.7	19%	0.185	19%	0.186	C	C	.	.	H	α-helix	trans	-63.6	-25.2	173.4	-69.1	-178.1	-173.1	-154.6	-1.5	112.8	I442 E446 V519 Y520 R527	I442-R523 HydrophobicContact CD1-CB 4.46Å; I442-R523 HydrophobicContact CD1-CG 3.6Å; I442-R523 HydrophobicContact CG1-CG 3.84Å; E446-R523 IonicContact OE2-CZ 3.63Å; E446-R523 IonicContact OE2-NH2 2.7Å; E446-R523 PolarHBondContact OE2-NH2 2.81Å; V519-R523 HydrophobicContact CG1-CG 4.48Å; V519-R523 WeakPolarHBondContact O-CG 3.41Å; V519-R523 PolarHBondContact O-N 2.83Å; Y520-R523 CarbonylContact O-C 3.58Å; R523-R527 VanDerWaalsContact O-CG 3.25Å; R523-R527 WeakPolarHBondContact O-CG 3.34Å; R523-R527 PolarHBondContact O-NE 3.05Å
524	A	89.6	Confident	88.1	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-77.2	-50.1	172.8	0	0	0	0	0	111.4	L487 Y520 M521 A522 L526 R527 E528	L487-A524 HydrophobicContact CD1-CB 3.82Å; Y520-A524 WeakPolarHBondContact O-CB 3.41Å; Y520-A524 PolarHBondContact O-N 2.97Å; M521-A524 WeakPolarHBondContact O-CB 3.37Å; M521-A524 PolarHBondContact O-N 3.3Å; M521-A524 VanDerWaalsContact O-N 3.08Å; A522-A524 PolarHBondContact O-N 2.59Å; A524-L526 VanDerWaalsContact C-N 3.34Å; A524-L526 PolarHBondContact O-N 3.19Å; A524-R527 PolarHBondContact O-N 3.22Å; A524-E528 WeakPolarHBondContact O-CG 3.36Å; A524-E528 PolarHBondContact O-N 3.08Å
525	R	89.9	Confident	88	Confident	90 Å²	90	51.6 Å²	51.6	34%	0.34	22%	0.222	S	C	.	.	H	α-helix	trans	-57.2	-43	177	-73	-162.3	-67.7	-132.7	3.7	112.8	D438 Y484 M521 A522 R527 E528 R529	D438-R525 IonicContact OD1-CZ 3.01Å; D438-R525 IonicContact OD1-NE 2.85Å; D438-R525 PolarHBondContact OD1-NE 3.46Å; D438-R525 IonicContact OD1-NH2 3.44Å; D438-R525 PolarHBondContact OD1-NH2 3.43Å; D438-R525 WeakPolarHBondContact OD2-CB 3.49Å; D438-R525 IonicContact OD2-CZ 2.69Å; D438-R525 IonicContact OD2-NE 3.76Å; D438-R525 PolarHBondContact OD2-NE 3.26Å; D438-R525 IonicContact OD2-NH2 3.86Å; Y484-R525 HydrophobicContact CD2-CG 3.4Å; Y484-R525 HydrophobicContact CE2-CG 3.66Å; Y484-R525 HydrophobicContact CG-CG 3.89Å; Y484-R525 PolarHBondContact OH-NH1 3.45Å; M521-R525 PolarHBondContact O-N 2.96Å; A522-R525 PolarHBondContact O-N 3.17Å; R525-R527 VanDerWaalsContact C-N 3.33Å; R525-R527 PolarHBondContact O-N 3.37Å; R525-E528 PolarHBondContact O-N 3.01Å; R525-R529 VanDerWaalsContact O-CB 3.3Å; R525-R529 WeakPolarHBondContact O-CB 3.33Å; R525-R529 VanDerWaalsContact O-CG 3.31Å; R525-R529 WeakPolarHBondContact O-CG 3.28Å; R525-R529 PolarHBondContact O-N 2.84Å
526	L	88.8	Confident	87.7	Confident	3 Å²	3	53.4 Å²	53.4	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-34.3	175.7	-69.5	-177	0	0	0	112.9	F435 D438 M439 I442 A522 A524 H530	F435-L526 HydrophobicContact CD2-CD2 3.43Å; F435-L526 VanDerWaalsContact CD2-CD2 3.43Å; F435-L526 HydrophobicContact CE2-CD2 3.79Å; F435-L526 HydrophobicContact CG-CD2 4.16Å; D438-L526 HydrophobicContact CB-CD1 4.23Å; D438-L526 HydrophobicContact CB-CD2 3.98Å; D438-L526 HydrophobicContact CB-CG 3.9Å; M439-L526 HydrophobicContact CE-CD1 3.57Å; I442-L526 HydrophobicContact CD1-CD1 3.47Å; I442-L526 VanDerWaalsContact CD1-CD1 3.47Å; I442-L526 HydrophobicContact CD1-CG 4.48Å; A522-L526 WeakPolarHBondContact O-CG 3.23Å; A522-L526 PolarHBondContact O-N 3.36Å; A524-L526 VanDerWaalsContact C-N 3.34Å; A524-L526 PolarHBondContact O-N 3.19Å; L526-H530 WeakPolarHBondContact O-CB 3.37Å; L526-H530 PolarHBondContact O-N 2.85Å
527	R	87.8	Confident	87.2	Confident	57 Å²	57	53.7 Å²	53.7	22%	0.215	23%	0.231	C	C	.	.	H	α-helix	trans	-73.7	-40.8	175.9	-74.4	-177.5	-69.5	131.2	8.2	112.3	E401 Y403 R523 A524 R525 H530 Q531	E401-R527 WeakPolarHBondContact OE1-CD 3.39Å; E401-R527 WeakPolarHBondContact OE1-CG 3.35Å; Y403-R527 HydrophobicContact CE1-CG 3.76Å; R523-R527 VanDerWaalsContact O-CG 3.25Å; R523-R527 WeakPolarHBondContact O-CG 3.34Å; R523-R527 PolarHBondContact O-NE 3.05Å; A524-R527 PolarHBondContact O-N 3.22Å; R525-R527 VanDerWaalsContact C-N 3.33Å; R525-R527 PolarHBondContact O-N 3.37Å; R527-H530 PolarHBondContact O-N 2.86Å; R527-Q531 WeakPolarHBondContact O-CG 3.34Å; R527-Q531 PolarHBondContact O-N 3.34Å
528	E	88.7	Confident	86.8	Confident	67 Å²	67	58.3 Å²	58.3	31%	0.313	26%	0.256	S	S	.	.	H	α-helix	trans	-62.9	-49	174.2	-70.5	167.5	-173	0	0	110.1	Y484 A524 R525 H530 Q531 D532	Y484-E528 WeakPolarHBondContact CB-OE1 3.48Å; Y484-E528 WeakPolarHBondContact CB-OE2 3.37Å; Y484-E528 PolarHBondContact N-OE1 2.88Å; A524-E528 WeakPolarHBondContact O-CG 3.36Å; A524-E528 PolarHBondContact O-N 3.08Å; R525-E528 PolarHBondContact O-N 3.01Å; E528-H530 VanDerWaalsContact C-N 3.31Å; E528-H530 PolarHBondContact O-N 3.47Å; E528-Q531 PolarHBondContact O-N 3.24Å; E528-D532 PolarHBondContact O-N 2.67Å
529	R	85.3	Confident	86.3	Confident	118 Å²	118	59.4 Å²	59.4	45%	0.445	26%	0.263	S	S	.	.	H	α-helix	trans	-58	-38.2	171.4	-74.3	-74.9	-69.8	-107.7	3.6	112.8	R525 D532 V533	R525-R529 VanDerWaalsContact O-CB 3.3Å; R525-R529 WeakPolarHBondContact O-CB 3.33Å; R525-R529 VanDerWaalsContact O-CG 3.31Å; R525-R529 WeakPolarHBondContact O-CG 3.28Å; R525-R529 PolarHBondContact O-N 2.84Å; R529-D532 PolarHBondContact O-N 2.74Å; R529-V533 WeakPolarHBondContact O-CG2 3.46Å; R529-V533 PolarHBondContact O-N 2.76Å
530	H	85.8	Confident	85.9	Confident	11 Å²	11	64 Å²	64	5%	0.051	28%	0.283	C	S	.	.	H	α-helix	trans	-67.8	-42.6	177.1	-174.4	76.9	0	0	0	112.2	Y387 H400 L526 R527 E528 D532 V533 L534	Y387-H530 AromaticContact CE2-CE1 3.95Å; Y387-H530 AromaticContact CE2-ND1 3.37Å; Y387-H530 WeakPolarHBondContact CE2-ND1 3.4Å; Y387-H530 AromaticContact CZ-ND1 3.65Å; Y387-H530 WeakPolarHBondContact OH-CA 3.47Å; Y387-H530 PolarHBondContact OH-ND1 3.29Å; H400-H530 PolarHBondContact O-CE1 2.97Å; H400-H530 VanDerWaalsContact O-CE1 3.32Å; L526-H530 WeakPolarHBondContact O-CB 3.37Å; L526-H530 PolarHBondContact O-N 2.85Å; R527-H530 PolarHBondContact O-N 2.86Å; E528-H530 VanDerWaalsContact C-N 3.31Å; E528-H530 PolarHBondContact O-N 3.47Å; H530-D532 VanDerWaalsContact C-N 3.3Å; H530-D532 PolarHBondContact O-N 3.31Å; H530-V533 PolarHBondContact O-N 3.39Å; H530-L534 WeakPolarHBondContact O-CB 3.36Å; H530-L534 VanDerWaalsContact O-CG 3.31Å; H530-L534 WeakPolarHBondContact O-CG 3.42Å; H530-L534 PolarHBondContact O-N 2.82Å
531	Q	85.9	Confident	85.3	Confident	100 Å²	100	64.8 Å²	64.8	47%	0.467	29%	0.29	S	S	.	.	H	α-helix	trans	-61.4	-38.6	172.8	-71.7	178.3	7.7	0	0	111.9	R527 E528 L534 R535	R527-Q531 WeakPolarHBondContact O-CG 3.34Å; R527-Q531 PolarHBondContact O-N 3.34Å; E528-Q531 PolarHBondContact O-N 3.24Å; Q531-L534 PolarHBondContact O-N 2.96Å; Q531-R535 WeakPolarHBondContact O-CB 3.33Å; Q531-R535 WeakPolarHBondContact O-CD 3.48Å; Q531-R535 WeakPolarHBondContact O-CG 3.49Å; Q531-R535 PolarHBondContact O-N 2.95Å
532	D	84.9	Confident	84.8	Confident	66 Å²	66	68.5 Å²	68.5	35%	0.353	31%	0.306	S	S	.	.	H	α-helix	trans	-71.4	-38.7	177	-70.6	-28.5	0	0	0	113.2	E528 R529 H530 R535 Q536	E528-D532 PolarHBondContact O-N 2.67Å; R529-D532 PolarHBondContact O-N 2.74Å; H530-D532 VanDerWaalsContact C-N 3.3Å; H530-D532 PolarHBondContact O-N 3.31Å; D532-R535 PolarHBondContact O-N 3.12Å; D532-R535 WeakPolarHBondContact OD1-CD 3.3Å; D532-R535 IonicContact OD1-CZ 2.64Å; D532-R535 IonicContact OD1-NE 3.85Å; D532-R535 IonicContact OD1-NH1 2.81Å; D532-R535 PolarHBondContact OD1-NH1 2.97Å; D532-Q536 WeakPolarHBondContact O-CB 3.27Å; D532-Q536 VanDerWaalsContact O-CG 3.29Å; D532-Q536 WeakPolarHBondContact O-CG 3.45Å; D532-Q536 PolarHBondContact O-N 3.3Å
533	V	82.3	Confident	84.2	Confident	35 Å²	35	74.9 Å²	74.9	21%	0.212	34%	0.335	C	S	.	.	H	α-helix	trans	-62.2	-42.7	170.7	169	0	0	0	0	110.9	R529 H530 Q536 K537	R529-V533 WeakPolarHBondContact O-CG2 3.46Å; R529-V533 PolarHBondContact O-N 2.76Å; H530-V533 PolarHBondContact O-N 3.39Å; V533-Q536 PolarHBondContact O-N 2.78Å; V533-K537 WeakPolarHBondContact O-CB 3.32Å; V533-K537 WeakPolarHBondContact O-CG 3.24Å; V533-K537 PolarHBondContact O-N 2.89Å
534	L	82.2	Confident	83.5	Confident	59 Å²	59	78.2 Å²	78.2	31%	0.309	35%	0.353	S	S	.	.	H	α-helix	trans	-63.2	-41.7	174.5	-72.4	175.2	0	0	0	112.1	V397 H530 Q531 K537 L538	V397-L534 HydrophobicContact CG1-CD2 3.95Å; H530-L534 WeakPolarHBondContact O-CB 3.36Å; H530-L534 VanDerWaalsContact O-CG 3.31Å; H530-L534 WeakPolarHBondContact O-CG 3.42Å; H530-L534 PolarHBondContact O-N 2.82Å; Q531-L534 PolarHBondContact O-N 2.96Å; L534-K537 PolarHBondContact O-N 2.93Å; L534-L538 WeakPolarHBondContact O-CB 3.36Å; L534-L538 PolarHBondContact O-N 3.49Å
535	R	85	Confident	82.9	Confident	154 Å²	154	84.5 Å²	84.5	58%	0.581	38%	0.382	S	S	*	.	H	α-helix	trans	-60.7	-45.2	174	-75.3	161.7	174.8	164.1	-1.1	111.8	Q531 D532 L538 F539	Q531-R535 WeakPolarHBondContact O-CB 3.33Å; Q531-R535 WeakPolarHBondContact O-CD 3.48Å; Q531-R535 WeakPolarHBondContact O-CG 3.49Å; Q531-R535 PolarHBondContact O-N 2.95Å; D532-R535 PolarHBondContact O-N 3.12Å; D532-R535 WeakPolarHBondContact OD1-CD 3.3Å; D532-R535 IonicContact OD1-CZ 2.64Å; D532-R535 IonicContact OD1-NE 3.85Å; D532-R535 IonicContact OD1-NH1 2.81Å; D532-R535 PolarHBondContact OD1-NH1 2.97Å; R535-L538 PolarHBondContact O-N 3.46Å; R535-F539 WeakPolarHBondContact O-CB 3.41Å; R535-F539 PolarHBondContact O-N 3.18Å
536	Q	83	Confident	81.6	Confident	115 Å²	115	83.1 Å²	83.1	54%	0.537	40%	0.395	S	S	.	.	H	α-helix	trans	-66	-41.7	178.3	-72.4	174.6	9.7	0	0	112.1	D532 V533 F539 K540	D532-Q536 WeakPolarHBondContact O-CB 3.27Å; D532-Q536 VanDerWaalsContact O-CG 3.29Å; D532-Q536 WeakPolarHBondContact O-CG 3.45Å; D532-Q536 PolarHBondContact O-N 3.3Å; V533-Q536 PolarHBondContact O-N 2.78Å; Q536-F539 PolarHBondContact O-N 3.03Å; Q536-K540 PolarHBondContact O-N 2.8Å
537	K	77.4	Confident	80.1	Confident	48 Å²	48	87 Å²	87	21%	0.209	42%	0.419	C	S	.	.	H	α-helix	trans	-65.6	-41.2	174	-73.9	-166.4	174.4	-133.7	0	112.2	A390 V397 V533 L534 F539 K540 L541	A390-K537 WeakPolarHBondContact O-CE 3.3Å; A390-K537 PolarHBondContact O-NZ 3.5Å; V397-K537 HydrophobicContact CG2-CD 3.78Å; V533-K537 WeakPolarHBondContact O-CB 3.32Å; V533-K537 WeakPolarHBondContact O-CG 3.24Å; V533-K537 PolarHBondContact O-N 2.89Å; L534-K537 PolarHBondContact O-N 2.93Å; K537-F539 VanDerWaalsContact C-N 3.29Å; K537-F539 PolarHBondContact O-N 2.86Å; K537-K540 PolarHBondContact O-N 3.38Å; K537-L541 VanDerWaalsContact O-CB 3.23Å; K537-L541 WeakPolarHBondContact O-CB 3.5Å; K537-L541 PolarHBondContact O-N 3.45Å
538	L	81.3	Confident	78	Confident	98 Å²	98	93.1 Å²	93.1	51%	0.513	45%	0.45	S	S	.	.	H	α-helix	trans	-64.5	-33.5	174.5	-174	151.8	0	0	0	111.8	L534 R535 K542	L534-L538 WeakPolarHBondContact O-CB 3.36Å; L534-L538 PolarHBondContact O-N 3.49Å; R535-L538 PolarHBondContact O-N 3.46Å; L538-K542 HydrophobicContact CD2-CD 3.99Å; L538-K542 HydrophobicContact CD2-CG 4.47Å; L538-K542 WeakPolarHBondContact O-CB 3.44Å; L538-K542 WeakPolarHBondContact O-CG 3.39Å; L538-K542 PolarHBondContact O-N 2.97Å
539	F	82.2	Confident	76	Confident	114 Å²	114	93.3 Å²	93.3	50%	0.5	46%	0.459	S	S	.	.	H	α-helix	trans	-68.3	-49.6	172.1	-178.4	-93.1	0	0	0	112.2	R535 Q536 K537 L541 K542 Q543	R535-F539 WeakPolarHBondContact O-CB 3.41Å; R535-F539 PolarHBondContact O-N 3.18Å; Q536-F539 PolarHBondContact O-N 3.03Å; K537-F539 VanDerWaalsContact C-N 3.29Å; K537-F539 PolarHBondContact O-N 2.86Å; F539-L541 VanDerWaalsContact C-N 3.31Å; F539-L541 PolarHBondContact O-N 3.31Å; F539-K542 PolarHBondContact O-N 2.89Å; F539-Q543 WeakPolarHBondContact O-CB 3.33Å; F539-Q543 PolarHBondContact O-N 2.7Å
540	K	81.4	Confident	74.1	Confident	97 Å²	97	95.7 Å²	95.7	42%	0.422	48%	0.475	S	S	.	.	H	α-helix	trans	-53.8	-48.3	172.9	-74.5	-172.6	177.8	-172.9	0	111.2	E391 Q536 K537 K542 Q543 E544	E391-K540 PolarHBondContact O-NZ 2.59Å; Q536-K540 PolarHBondContact O-N 2.8Å; K537-K540 PolarHBondContact O-N 3.38Å; K540-K542 PolarHBondContact O-N 2.92Å; K540-Q543 WeakPolarHBondContact O-CB 3.3Å; K540-Q543 PolarHBondContact O-N 2.89Å; K540-Q543 VanDerWaalsContact O-N 3.11Å; K540-E544 WeakPolarHBondContact O-CG 3.29Å; K540-E544 PolarHBondContact O-N 3.47Å
541	L	78.5	Confident	72.3	Confident	61 Å²	61	100.9 Å²	100.9	32%	0.319	51%	0.51	S	S	.	.	H	α-helix	trans	-63.6	-37.7	-179.2	-175.9	152.3	0	0	0	112.7	L395 K537 F539 Q545	L395-L541 HydrophobicContact CD2-CB 4.36Å; L395-L541 HydrophobicContact CD2-CD1 3.94Å; L395-L541 HydrophobicContact CD2-CG 4.12Å; K537-L541 VanDerWaalsContact O-CB 3.23Å; K537-L541 WeakPolarHBondContact O-CB 3.5Å; K537-L541 PolarHBondContact O-N 3.45Å; F539-L541 VanDerWaalsContact C-N 3.31Å; F539-L541 PolarHBondContact O-N 3.31Å; L541-Q545 WeakPolarHBondContact O-CB 3.39Å; L541-Q545 VanDerWaalsContact O-CG 3.24Å; L541-Q545 WeakPolarHBondContact O-CG 3.43Å; L541-Q545 PolarHBondContact O-N 3.29Å
542	K	80.4	Confident	70.3	Confident	95 Å²	95	103.4 Å²	103.4	41%	0.413	53%	0.525	S	S	.	.	H	α-helix	trans	-65.9	-40	171.1	-80.5	-177.4	173.3	-172.9	0	112.8	L538 F539 K540 Q545 G546 V547	L538-K542 HydrophobicContact CD2-CD 3.99Å; L538-K542 HydrophobicContact CD2-CG 4.47Å; L538-K542 WeakPolarHBondContact O-CB 3.44Å; L538-K542 WeakPolarHBondContact O-CG 3.39Å; L538-K542 PolarHBondContact O-N 2.97Å; F539-K542 PolarHBondContact O-N 2.89Å; K540-K542 PolarHBondContact O-N 2.92Å; K542-Q545 CarbonylContact O-C 3.59Å; K542-Q545 PolarHBondContact O-N 2.84Å; K542-G546 PolarHBondContact O-N 3.06Å; K542-V547 PolarHBondContact O-N 3.02Å; K542-V547 VanDerWaalsContact O-N 3.13Å
543	Q	78.8	Confident	67.8	Low	135 Å²	135	108.9 Å²	108.9	63%	0.631	55%	0.547	S	S	*	.	H	α-helix	trans	-64.9	-42.2	177.3	-174.2	178.1	11.9	0	0	111.4	F539 K540 G546	F539-Q543 WeakPolarHBondContact O-CB 3.33Å; F539-Q543 PolarHBondContact O-N 2.7Å; K540-Q543 WeakPolarHBondContact O-CB 3.3Å; K540-Q543 PolarHBondContact O-N 2.89Å; K540-Q543 VanDerWaalsContact O-N 3.11Å; Q543-G546 PolarHBondContact O-N 2.9Å
544	E	74.3	Confident	65.8	Low	119 Å²	119	112.9 Å²	112.9	56%	0.556	57%	0.573	S	S	*	*	H	α-helix	trans	-67.6	-33.4	175	-72	165.3	-157.5	0	0	112.5	L395 K540 G546	L395-E544 WeakPolarHBondContact CD1-OE2 3.45Å; L395-E544 VanDerWaalsContact CD2-OE2 3.23Å; L395-E544 WeakPolarHBondContact CD2-OE2 3.28Å; K540-E544 WeakPolarHBondContact O-CG 3.29Å; K540-E544 PolarHBondContact O-N 3.47Å; E544-G546 PolarHBondContact O-N 2.94Å
545	Q	76.8	Confident	63.6	Low	133 Å²	133	117.4 Å²	117.4	62%	0.621	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	3.3	173.2	-71.8	177.1	-6.9	0	0	113.9	L541 K542 V547	L541-Q545 WeakPolarHBondContact O-CB 3.39Å; L541-Q545 VanDerWaalsContact O-CG 3.24Å; L541-Q545 WeakPolarHBondContact O-CG 3.43Å; L541-Q545 PolarHBondContact O-N 3.29Å; K542-Q545 CarbonylContact O-C 3.59Å; K542-Q545 PolarHBondContact O-N 2.84Å; Q545-V547 HydrophobicContact CB-CG2 4.36Å; Q545-V547 PolarHBondContact O-N 3.02Å
546	G	62.5	Low	61.5	Low	60 Å²	60	116.9 Å²	116.9	62%	0.619	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.1	12.4	176.7	0	0	0	0	0	115.1	K542 Q543 E544 E548	K542-G546 PolarHBondContact O-N 3.06Å; Q543-G546 PolarHBondContact O-N 2.9Å; E544-G546 PolarHBondContact O-N 2.94Å; G546-E548 PolarHBondContact O-N 3.48Å; G546-E548 VanDerWaalsContact O-N 3.16Å
547	V	57.1	Low	59.3	Low	84 Å²	84	118.9 Å²	118.9	51%	0.509	61%	0.61	S	S	.	*			trans	-81.5	97.4	178.9	-177.9	0	0	0	0	108.6	K542 Q545 S549	K542-V547 PolarHBondContact O-N 3.02Å; K542-V547 VanDerWaalsContact O-N 3.13Å; Q545-V547 HydrophobicContact CB-CG2 4.36Å; Q545-V547 PolarHBondContact O-N 3.02Å; V547-S549 PolarHBondContact O-N 3.48Å
548	E	44.9	Very low	57.3	Low	186 Å²	186	125 Å²	125	87%	0.869	64%	0.64	S	S	*	*			trans	-54.7	111.3	172.1	-70.3	-163.8	140.4	0	0	109.8	G546 E550	G546-E548 PolarHBondContact O-N 3.48Å; G546-E548 VanDerWaalsContact O-N 3.16Å; E548-E550 PolarHBondContact O-N 3.31Å
549	S	46	Very low	54.9	Low	71 Å²	71	126.9 Å²	126.9	50%	0.497	65%	0.646	S	S	.	*			trans	-80.7	89.5	-178.8	63.8	0	0	0	0	110.1	V547	V547-S549 PolarHBondContact O-N 3.48Å
550	E	45.9	Very low	52.7	Low	168 Å²	168	127.8 Å²	127.8	79%	0.785	66%	0.663	S	S	*	*			trans	-52.8	137.7	159.3	-73	-159.8	144.4	0	0	109.5	E548 L552	E548-E550 PolarHBondContact O-N 3.31Å; E550-L552 PolarHBondContact O-N 2.85Å
551	P	46.7	Very low	50	Low	120 Å²	120	132.9 Å²	132.9	78%	0.779	68%	0.68	S	S	*	*			trans	-72.6	92	179.5	29.5	-33.8	0	0	0	109.9	F553	P551-F553 PolarHBondContact O-N 3.35Å
552	L	43.9	Very low	47.6	Very low	153 Å²	153	135 Å²	135	80%	0.801	70%	0.699	S	S	*	*	S	Bend	trans	-69.4	39.5	-176.7	-162.1	74.5	0	0	0	114.5	E550	E550-L552 PolarHBondContact O-N 2.85Å
553	F	34.1	Very low	45.3	Very low	182 Å²	182	136 Å²	136	80%	0.798	71%	0.705	S	S	*	*			trans	-154.1	104	163.3	-79.5	-64.7	0	0	0	109.9	P551 I555	P551-F553 PolarHBondContact O-N 3.35Å; F553-I555 PolarHBondContact O-N 3.38Å
554	P	40.5	Very low	42.8	Very low	119 Å²	119	136.9 Å²	136.9	77%	0.773	71%	0.71	S	S	*	*			trans	-63.5	114.6	163.4	-17.3	31.2	0	0	0	108.9	I556	P554-I556 PolarHBondContact O-N 2.79Å
555	I	35.5	Very low	40.6	Very low	153 Å²	153	137.7 Å²	137.7	79%	0.785	72%	0.718	S	S	*	*			trans	-72.6	98.5	170.5	-62.7	178.3	0	0	0	107.3	F553 K557	F553-I555 PolarHBondContact O-N 3.38Å; I555-K557 PolarHBondContact O-N 2.84Å
556	I	40.1	Very low	38.4	Very low	143 Å²	143	140.9 Å²	140.9	73%	0.733	73%	0.733	S	S	*	*			trans	-66.3	99.3	166.1	-60.3	176.8	0	0	0	107	P554 E558	P554-I556 PolarHBondContact O-N 2.79Å; I556-E558 HydrophobicContact CG2-CG 4.05Å; I556-E558 PolarHBondContact O-N 2.82Å
557	K	37.9	Very low	36.6	Very low	157 Å²	157	144.6 Å²	144.6	68%	0.683	74%	0.738	S	S	*	*			trans	-76.1	90.4	163	-93	-170.9	152.1	-148.5	0	108.7	I555 E559	I555-K557 PolarHBondContact O-N 2.84Å; K557-E559 WeakPolarHBondContact CE-OE1 3.23Å; K557-E559 IonicContact NZ-OE1 3.2Å; K557-E559 PolarHBondContact NZ-OE1 3.01Å; K557-E559 PolarHBondContact O-N 3.35Å
558	E	34.8	Very low	35.2	Very low	177 Å²	177	148.9 Å²	148.9	83%	0.827	75%	0.753	S	S	*	*			trans	-73.7	101.3	154.4	-78.4	176.1	173.1	0	0	107.9	I556	I556-E558 HydrophobicContact CG2-CG 4.05Å; I556-E558 PolarHBondContact O-N 2.82Å
559	E	29.9	Very low	34.3	Very low	138 Å²	138	146.2 Å²	146.2	65%	0.645	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-92.2	130.5	164.9	-71.4	-175.8	-178.7	0	0	108.7	K557	K557-E559 WeakPolarHBondContact CE-OE1 3.23Å; K557-E559 IonicContact NZ-OE1 3.2Å; K557-E559 PolarHBondContact NZ-OE1 3.01Å; K557-E559 PolarHBondContact O-N 3.35Å
560	P	35.9	Very low	33.5	Very low	132 Å²	132	151.5 Å²	151.5	86%	0.857	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-73.8	153.8	-174.2	30.1	-35.3	0	0	0	112.4
561	R	25.8	Very low	32.5	Very low	205 Å²	205	148.9 Å²	148.9	77%	0.774	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-93.2	130.5	-169.4	168.3	-179.9	164.8	166.6	-0	113.1	E563	R561-E563 HydrophobicContact CG-CG 4.23Å; R561-E563 IonicContact CZ-OE1 2.86Å; R561-E563 IonicContact NE-OE1 3.71Å; R561-E563 PolarHBondContact NE-OE1 2.96Å; R561-E563 IonicContact NH2-OE1 2.76Å; R561-E563 PolarHBondContact NH2-OE1 2.71Å
562	S	28.9	Very low	31.5	Very low	104 Å²	104	154.3 Å²	154.3	73%	0.727	75%	0.75	S	S	*	*			trans	-158	117.4	152.6	54.1	0	0	0	0	106.1
563	E	30.2	Very low	30.6	Very low	116 Å²	116	154 Å²	154	54%	0.542	75%	0.745	S	S	.	*				59	121.5	59.2	-57.7	178.3	178.2	0	0	111.3	R561	R561-E563 HydrophobicContact CG-CG 4.23Å; R561-E563 IonicContact CZ-OE1 2.86Å; R561-E563 IonicContact NE-OE1 3.71Å; R561-E563 PolarHBondContact NE-OE1 2.96Å; R561-E563 IonicContact NH2-OE1 2.76Å; R561-E563 PolarHBondContact NH2-OE1 2.71Å
564	E	28.2	Very low	30.1	Very low	155 Å²	155	154.6 Å²	154.6	72%	0.724	74%	0.742	S	S	*	*			cis	-158.2	-178.5	-14.2	-134.3	149.5	-143.2	0	0	107.9
565	D	26.6	Very low	29.3	Very low	135 Å²	135	155.4 Å²	155.4	72%	0.722	75%	0.745	S	S	*	*			trans	49.2	109.8	163.5	-51.1	-20.7	0	0	0	120.4
566	E	30.3	Very low	28.8	Very low	201 Å²	201	153 Å²	153	94%	0.939	75%	0.748	S	S	*	*				-157.9	137.9	104.7	-115	179	-167.6	0	0	111.3
567	D	26.3	Very low	28.1	Very low	137 Å²	137	155.1 Å²	155.1	73%	0.733	75%	0.754	S	S	*	*			trans	-79.9	163.3	-166.6	-79.2	-66.1	0	0	0	115.4
568	E	26	Very low	27.6	Very low	175 Å²	175	155.6 Å²	155.6	82%	0.818	76%	0.759	S	S	*	*			trans	52	145.1	142.7	-69	-171.6	158.2	0	0	120.3
569	E	27.7	Very low	27.3	Very low	129 Å²	129	152.5 Å²	152.5	60%	0.603	76%	0.757	S	S	*	*			cis	-154.7	169.2	44.9	-138.6	-158.9	162.2	0	0	113.6
570	R	28.3	Very low	27.1	Very low	182 Å²	182	149.2 Å²	149.2	69%	0.687	76%	0.76	S	S	*	*			trans	69.6	86.3	154	-75.2	173.3	-165	-72	-24.9	120.4
571	T	25.9	Very low	26.7	Very low	114 Å²	114	151.1 Å²	151.1	70%	0.699	76%	0.762	S	S	*	*				58.7	118.8	115.2	55.7	0	0	0	0	120.6
572	R	24.1	Very low	26.7	Very low	233 Å²	233	146.4 Å²	146.4	88%	0.879	76%	0.76	S	S	*	*				22	120.4	110.3	-57	173.9	178.5	163.8	-0.4	114.3
573	E	24.7	Very low	26.6	Very low	148 Å²	148	146.1 Å²	146.1	69%	0.692	76%	0.764	S	S	*	*				-161.9	164.3	64.2	-104.2	-156.5	117.8	0	0	114.1
574	R	25.3	Very low	26.4	Very low	194 Å²	194	145.8 Å²	145.8	73%	0.732	78%	0.775	S	S	*	*			trans	60	93.5	147.6	-70.3	167.2	-175.7	-96.9	-6.1	120.5
575	T	22.2	Very low	26.5	Very low	136 Å²	136	143.1 Å²	143.1	83%	0.834	77%	0.773	S	S	*	*				37.4	102.2	116.9	58.6	0	0	0	0	118.9
576	A	25.7	Very low	26.5	Very low	103 Å²	103	142 Å²	142	85%	0.851	78%	0.776	S	S	*	*			trans	-152	148	146.5	0	0	0	0	0	112.3
577	E	26.4	Very low	26.4	Very low	186 Å²	186	143.2 Å²	143.2	87%	0.869	77%	0.772	S	S	*	*			trans	-68.2	174	167.7	-52.6	166.4	134.6	0	0	110.6
578	E	27	Very low	26.3	Very low	168 Å²	168	146.8 Å²	146.8	79%	0.785	78%	0.775	S	S	*	*			cis	-158.1	166.2	7.3	-149.9	-152.7	135.3	0	0	110.9
579	S	27.4	Very low	26.3	Very low	111 Å²	111	145 Å²	145	78%	0.776	77%	0.771	S	S	*	*			trans	66.7	141.1	163.3	77.6	0	0	0	0	117.7
580	G	26.3	Very low	26.2	Very low	69 Å²	69	146.3 Å²	146.3	71%	0.711	78%	0.775	S	S	*	*			cis	163.6	161	-1.2	0	0	0	0	0	109.1
581	L	28.4	Very low	26	Very low	173 Å²	173	143.6 Å²	143.6	91%	0.906	77%	0.774	S	S	*	*			cis	-145.5	-166.4	3.5	-61.3	173.7	0	0	0	106.7
582	S	25.9	Very low	25.9	Very low	105 Å²	105	147.1 Å²	147.1	73%	0.734	77%	0.774	S	S	*	*			cis	-157.5	157.4	9.7	67.2	0	0	0	0	113.4
583	A	26.5	Very low	26	Very low	98 Å²	98	142.1 Å²	142.1	81%	0.81	76%	0.761	S	S	*	*			trans	63.5	103.8	148.6	0	0	0	0	0	120.5
584	S	26.3	Very low	26.1	Very low	110 Å²	110	141.5 Å²	141.5	77%	0.769	76%	0.76	S	S	*	*				-161.3	162.9	119.1	72.5	0	0	0	0	112.6
585	S	30.3	Very low	26.4	Very low	98 Å²	98	138.7 Å²	138.7	69%	0.685	76%	0.755	S	S	*	*			trans	64.1	119.3	151.8	-55.9	0	0	0	0	122
586	S	26	Very low	26.6	Very low	111 Å²	111	139.2 Å²	139.2	78%	0.776	75%	0.748	S	S	*	*				-146.1	127.2	128.4	-79.2	0	0	0	0	107.6
587	R	27	Very low	26.7	Very low	227 Å²	227	141 Å²	141	86%	0.857	74%	0.743	S	S	*	*				64.8	144.3	60.2	-65.8	177.7	174.8	-174.2	-0.2	111.9
588	R	25	Very low	26.8	Very low	212 Å²	212	139.1 Å²	139.1	80%	0.8	73%	0.734	S	S	*	*			cis	173.8	141.2	-14.6	172.4	-166.5	-178	-172.1	3.4	104.8
589	N	26.6	Very low	26.7	Very low	138 Å²	138	139 Å²	139	74%	0.738	73%	0.734	S	S	*	*			trans	146.6	160.7	150.3	-81.8	-8.9	0	0	0	112.7
590	K	24.9	Very low	26.8	Very low	157 Å²	157	136.9 Å²	136.9	68%	0.683	73%	0.73	S	S	*	*			cis	-178.2	150.7	-32.5	-157.3	-159.2	170.9	-164.2	0	107.6
591	N	24	Very low	27.3	Very low	124 Å²	124	139.6 Å²	139.6	66%	0.663	74%	0.735	S	S	*	*			trans	66.6	163.8	174.5	-64.6	22.1	0	0	0	113.2
592	R	24.7	Very low	27.2	Very low	189 Å²	189	134.3 Å²	134.3	71%	0.713	72%	0.722	S	S	*	*			cis	-157.7	147.9	15.3	-149.6	-176.6	164	-166.3	-24.9	110.5
593	E	26.2	Very low	27.6	Very low	128 Å²	128	135 Å²	135	60%	0.598	72%	0.724	S	S	*	*			trans	41.1	148.1	141.7	-79.7	153.6	-119.7	0	0	121.5
594	M	26.7	Very low	27.6	Very low	135 Å²	135	135.2 Å²	135.2	67%	0.665	72%	0.72	S	S	*	*			cis	-170.6	163.4	-3.2	-140	165.9	137.5	0	0	108.5
595	E	30.3	Very low	27.4	Very low	134 Å²	134	136.5 Å²	136.5	63%	0.626	72%	0.723	S	S	*	*			trans	59.1	153.8	161.9	-49.8	-36.6	46.6	0	0	118.3
596	E	28.2	Very low	27.1	Very low	148 Å²	148	136.2 Å²	136.2	69%	0.692	72%	0.721	S	S	*	*			cis	-156	143.4	-6.5	-121.4	160.7	-171.2	0	0	107.8
597	D	26.5	Very low	27	Very low	140 Å²	140	136.7 Å²	136.7	75%	0.749	72%	0.719	S	S	*	*			trans	49.8	147.4	131.7	-63.6	13.9	0	0	0	122.3
598	E	27.9	Very low	26.9	Very low	146 Å²	146	130.8 Å²	130.8	68%	0.682	72%	0.719	S	S	*	*			cis	-159.8	166.8	-1.9	-118.7	-76.9	77.3	0	0	111
599	E	26.2	Very low	26.8	Very low	166 Å²	166	124.8 Å²	124.8	78%	0.776	72%	0.723	S	S	*	*			trans	20.1	154.9	162.5	-88.8	-169	173.3	0	0	125.2
600	G	28.7	Very low	26.8	Very low	67 Å²	67	121.3 Å²	121.3	69%	0.691	72%	0.72	S	S	*	*			trans	-91.3	-127.9	164.2	0	0	0	0	0	111.6
601	P	36.7	Very low	26.9	Very low	126 Å²	126	122.3 Å²	122.3	82%	0.818	73%	0.727	S	S	*	*			cis	-117	-177.8	-5.9	40.8	-28.4	0	0	0	113.2
602	G	26.6	Very low	27	Very low	62 Å²	62	122.2 Å²	122.2	64%	0.639	73%	0.726	S	S	*	*			trans	-73.1	174.5	160	0	0	0	0	0	112.1
603	P	35.3	Very low	27.3	Very low	120 Å²	120	121.1 Å²	121.1	78%	0.779	73%	0.73	S	S	*	*				-150.3	158	71	39.9	-22	0	0	0	118.3
604	S	24.8	Very low	27.4	Very low	102 Å²	102	123.3 Å²	123.3	71%	0.713	74%	0.74	S	S	*	*			trans	25.1	151.8	133.7	-46.7	0	0	0	0	124.4
605	T	23.3	Very low	27.5	Very low	136 Å²	136	120.7 Å²	120.7	83%	0.834	75%	0.747	S	S	*	*			trans	73.9	158.6	160	78.4	0	0	0	0	117.5
606	S	24.3	Very low	27.3	Very low	92 Å²	92	118 Å²	118	64%	0.643	76%	0.755	S	S	*	*			cis	-169.5	176.1	-38.1	59.8	0	0	0	0	109.3
607	T	23.3	Very low	27.4	Very low	122 Å²	122	119 Å²	119	75%	0.748	76%	0.76	S	S	*	*			trans	55.1	100.9	150	48.6	0	0	0	0	120.5
608	A	23.9	Very low	27.6	Very low	103 Å²	103	120.4 Å²	120.4	85%	0.851	76%	0.76	S	S	*	*				65.4	137.7	114.1	0	0	0	0	0	122.4
609	G	24.3	Very low	27.6	Very low	85 Å²	85	121.2 Å²	121.2	88%	0.876	77%	0.768	S	S	*	*			trans	92.2	135.4	171.3	0	0	0	0	0	113.1
610	G	25.3	Very low	27.8	Very low	66 Å²	66	122.2 Å²	122.2	68%	0.68	77%	0.773	S	S	*	*			cis	146.4	157.6	-2	0	0	0	0	0	110.7
611	Q	27.5	Very low	27.9	Very low	177 Å²	177	122.4 Å²	122.4	83%	0.827	78%	0.776	S	S	*	*			trans	68.7	153.5	175.8	-55.7	-170.9	-98.9	0	0	115.3
612	D	26.9	Very low	27.6	Very low	122 Å²	122	126.3 Å²	126.3	65%	0.652	78%	0.779	S	S	*	*			cis	-170.2	161.9	-19.9	-100	-16.9	0	0	0	108.6
613	E	31.1	Very low	27.7	Very low	167 Å²	167	131.4 Å²	131.4	78%	0.78	79%	0.792	S	S	*	*			trans	61.2	161.7	157.8	-66.2	-60.8	-170.4	0	0	119
614	E	27.5	Very low	27.5	Very low	173 Å²	173	134.9 Å²	134.9	81%	0.808	80%	0.798	S	S	*	*			cis	-156.7	147.4	-20.6	177.1	176.4	-154.4	0	0	108.2
615	G	28.1	Very low	28	Very low	80 Å²	80	139.5 Å²	139.5	83%	0.825	81%	0.808	S	S	*	*			trans	73	157.9	162.8	0	0	0	0	0	118.5
616	G	27.1	Very low	28.3	Very low	77 Å²	77	136.6 Å²	136.6	79%	0.794	81%	0.806	S	S	*	*			cis	131.9	87.9	-15.7	0	0	0	0	0	116.2
617	E	30.3	Very low	29.1	Very low	171 Å²	171	143.1 Å²	143.1	80%	0.799	82%	0.823	S	S	*	*			trans	-165.3	-178.7	135.8	-108.3	-152.7	126	0	0	112.8
618	K	30.8	Very low	29.5	Very low	169 Å²	169	140.6 Å²	140.6	74%	0.735	82%	0.821	S	S	*	*			trans	-105.8	158.8	-168.5	-18.5	92.6	179.1	161.9	0	113.1
619	D	28	Very low	30.4	Very low	162 Å²	162	145.6 Å²	145.6	87%	0.866	83%	0.826	S	S	*	*				-155.3	167.3	118	-153.2	3.1	0	0	0	111.4
620	E	31	Very low	30.7	Very low	187 Å²	187	146.2 Å²	146.2	87%	0.874	82%	0.824	S	S	*	*			trans	-98.9	146.4	-178.5	-61.4	-174.8	152.9	0	0	113.7
621	G	29.8	Very low	31.1	Very low	72 Å²	72	147.5 Å²	147.5	74%	0.742	83%	0.828	S	S	*	*			trans	130.7	129.5	135.2	0	0	0	0	0	119.6
622	K	30.9	Very low	31.7	Very low	207 Å²	207	148.2 Å²	148.2	90%	0.9	83%	0.831	S	S	*	*			trans	76.4	99.7	159.5	-60.9	-179.1	178.9	175.8	0	118.3
623	D	28.9	Very low	32.4	Very low	169 Å²	169	146.8 Å²	146.8	90%	0.904	84%	0.836	S	S	*	*			trans	-69.1	135.6	157.2	-41.3	-92.2	0	0	0	111.9
624	E	30.7	Very low	33.3	Very low	193 Å²	193	145 Å²	145	90%	0.902	84%	0.837	S	S	*	*			trans	-141	167	150.3	-157.8	168.7	-125.1	0	0	108.8	G626	E624-G626 PolarHBondContact O-N 2.64Å
625	E	34.6	Very low	34.5	Very low	199 Å²	199	142.3 Å²	142.3	93%	0.93	83%	0.827	S	S	*	*			trans	-54.5	126.9	-154.3	-56.5	-171.9	131.4	0	0	117
626	G	29.9	Very low	36.6	Very low	76 Å²	76	141.8 Å²	141.8	78%	0.784	81%	0.808	S	S	*	*			trans	-142.6	101.1	167.8	0	0	0	0	0	112.4	E624 G628	E624-G626 PolarHBondContact O-N 2.64Å; G626-G628 PolarHBondContact O-N 2.91Å
627	K	41.8	Very low	38.3	Very low	229 Å²	229	145.8 Å²	145.8	100%	0.996	81%	0.806	S	S	*	*			trans	-76.2	107.3	170.4	-88	-174.5	174.1	179.7	0	110.6
628	G	30.1	Very low	40.2	Very low	69 Å²	69	144.9 Å²	144.9	71%	0.711	80%	0.802	S	S	*	*			trans	-122.5	153.2	164.2	0	0	0	0	0	110.9	G626 A630	G626-G628 PolarHBondContact O-N 2.91Å; G628-A630 PolarHBondContact O-N 2.82Å
629	E	42.9	Very low	42.5	Very low	207 Å²	207	140.2 Å²	140.2	97%	0.967	79%	0.785	S	S	*	*			trans	-74.1	111.5	177.5	-70.6	167.1	109.2	0	0	110.5
630	A	31.7	Very low	44.8	Very low	99 Å²	99	136.9 Å²	136.9	82%	0.818	77%	0.766	S	S	*	*			trans	-82.5	114.2	163.2	0	0	0	0	0	108.3	G628	G628-A630 PolarHBondContact O-N 2.82Å
631	A	34.6	Very low	47.1	Very low	93 Å²	93	131.6 Å²	131.6	77%	0.769	74%	0.744	S	S	*	*			trans	-62.1	143.5	173.6	0	0	0	0	0	110.6	A633	A631-A633 PolarHBondContact O-N 3.2Å
632	E	40	Very low	49.6	Very low	191 Å²	191	134.6 Å²	134.6	89%	0.893	74%	0.738	S	S	*	*			trans	-63.2	108.7	171.5	-71.7	-172.5	124.7	0	0	109.3	V634	E632-V634 PolarHBondContact O-N 2.89Å
633	A	41.7	Very low	51.9	Low	92 Å²	92	130.1 Å²	130.1	76%	0.76	72%	0.721	S	S	*	*			trans	-65.8	102.6	169.8	0	0	0	0	0	108.5	A631 L635	A631-A633 PolarHBondContact O-N 3.2Å; A633-L635 PolarHBondContact O-N 3.33Å
634	V	48.9	Very low	54	Low	131 Å²	131	125.1 Å²	125.1	79%	0.794	70%	0.699	S	S	*	*			trans	-65.1	102.5	173.9	179.3	0	0	0	0	107.8	E632 T636	E632-V634 PolarHBondContact O-N 2.89Å; V634-T636 PolarHBondContact O-N 3.32Å
635	L	53.6	Low	56.3	Low	116 Å²	116	121.2 Å²	121.2	61%	0.607	68%	0.68	S	S	*	*			trans	-51.8	125.4	175.1	-72.3	167.6	0	0	0	109.6	A633 D639	A633-L635 PolarHBondContact O-N 3.33Å; L635-D639 HydrophobicContact CD2-CB 4.09Å
636	T	70.5	Confident	58.4	Low	69 Å²	69	114.7 Å²	114.7	42%	0.423	66%	0.661	S	S	.	*			trans	-78.2	164.8	-179.6	69.9	0	0	0	0	110.8	V634 E638 D639 L640	V634-T636 PolarHBondContact O-N 3.32Å; T636-E638 PolarHBondContact O-N 3.48Å; T636-E638 PolarHBondContact OG1-N 2.79Å; T636-D639 WeakPolarHBondContact CB-OD2 3.25Å; T636-D639 PolarHBondContact N-OD2 2.95Å; T636-D639 PolarHBondContact O-N 2.68Å; T636-D639 VanDerWaalsContact OG1-CG 3.24Å; T636-D639 PolarHBondContact OG1-N 3.26Å; T636-D639 PolarHBondContact OG1-OD2 3.36Å; T636-L640 PolarHBondContact O-N 2.97Å
637	E	62.6	Low	60.5	Low	160 Å²	160	116.9 Å²	116.9	75%	0.748	65%	0.65	S	S	*	*	H	α-helix	trans	-62	-30.5	174.6	-166.7	168	-178.8	0	0	111.4	I641	E637-I641 HydrophobicContact CG-CD1 4.18Å; E637-I641 WeakPolarHBondContact O-CB 3.4Å; E637-I641 WeakPolarHBondContact O-CD1 3.24Å; E637-I641 WeakPolarHBondContact O-CG1 3.28Å; E637-I641 PolarHBondContact O-N 3.13Å
638	E	71.1	Confident	61.9	Low	152 Å²	152	114 Å²	114	71%	0.71	63%	0.634	S	S	*	*	H	α-helix	trans	-71.1	-37.5	176	-61.3	-169.7	130	0	0	112.6	T636 L640 I641 Q642	T636-E638 PolarHBondContact O-N 3.48Å; T636-E638 PolarHBondContact OG1-N 2.79Å; E638-L640 PolarHBondContact O-N 3.34Å; E638-I641 PolarHBondContact O-N 3.48Å; E638-Q642 PolarHBondContact O-N 2.91Å
639	D	78.9	Confident	63.8	Low	72 Å²	72	117 Å²	117	39%	0.385	64%	0.635	S	S	.	*	H	α-helix	trans	-61.3	-44.4	174.5	-62.6	-59.1	0	0	0	111.4	L635 T636 I641 Q642 Q643	L635-D639 HydrophobicContact CD2-CB 4.09Å; T636-D639 WeakPolarHBondContact CB-OD2 3.25Å; T636-D639 PolarHBondContact N-OD2 2.95Å; T636-D639 PolarHBondContact O-N 2.68Å; T636-D639 VanDerWaalsContact OG1-CG 3.24Å; T636-D639 PolarHBondContact OG1-N 3.26Å; T636-D639 PolarHBondContact OG1-OD2 3.36Å; D639-I641 VanDerWaalsContact C-N 3.35Å; D639-Q642 PolarHBondContact O-N 2.88Å; D639-Q643 WeakPolarHBondContact O-CB 3.22Å; D639-Q643 PolarHBondContact O-N 2.74Å
640	L	75.7	Confident	65.4	Low	91 Å²	91	109.7 Å²	109.7	48%	0.476	61%	0.606	S	S	.	*	H	α-helix	trans	-66.2	-37.5	177.4	-67.3	171.4	0	0	0	111.7	T636 E638 S644	T636-L640 PolarHBondContact O-N 2.97Å; E638-L640 PolarHBondContact O-N 3.34Å; L640-S644 WeakPolarHBondContact O-CB 3.37Å; L640-S644 PolarHBondContact O-N 2.72Å
641	I	80.3	Confident	66.7	Low	77 Å²	77	107.7 Å²	107.7	40%	0.395	60%	0.595	S	S	.	*	H	α-helix	trans	-65.8	-47.6	174.5	-72.1	165.1	0	0	0	110.5	E637 E638 D639 Q643 S644 Q645	E637-I641 HydrophobicContact CG-CD1 4.18Å; E637-I641 WeakPolarHBondContact O-CB 3.4Å; E637-I641 WeakPolarHBondContact O-CD1 3.24Å; E637-I641 WeakPolarHBondContact O-CG1 3.28Å; E637-I641 PolarHBondContact O-N 3.13Å; E638-I641 PolarHBondContact O-N 3.48Å; D639-I641 VanDerWaalsContact C-N 3.35Å; I641-Q643 VanDerWaalsContact C-N 3.35Å; I641-Q643 PolarHBondContact O-N 2.73Å; I641-S644 PolarHBondContact O-N 3.31Å; I641-S644 PolarHBondContact O-OG 3.32Å; I641-Q645 WeakPolarHBondContact O-CG 3.32Å; I641-Q645 PolarHBondContact O-N 2.98Å
642	Q	82	Confident	67.9	Low	134 Å²	134	112.9 Å²	112.9	63%	0.626	60%	0.595	S	S	*	*	H	α-helix	trans	-62.1	-40.3	176.6	-74.3	-169.4	10.2	0	0	112.3	E638 D639 S644 Q645 A646	E638-Q642 PolarHBondContact O-N 2.91Å; D639-Q642 PolarHBondContact O-N 2.88Å; Q642-S644 VanDerWaalsContact C-N 3.34Å; Q642-S644 PolarHBondContact O-N 2.95Å; Q642-Q645 PolarHBondContact O-N 3.16Å; Q642-A646 WeakPolarHBondContact O-CB 3.31Å; Q642-A646 PolarHBondContact O-N 2.93Å
643	Q	79	Confident	68.9	Low	114 Å²	114	113.8 Å²	113.8	53%	0.533	59%	0.591	S	S	.	*	H	α-helix	trans	-60.1	-44.2	173.9	-175	166.6	68.9	0	0	111.4	D639 I641 Q645 A646 E647	D639-Q643 WeakPolarHBondContact O-CB 3.22Å; D639-Q643 PolarHBondContact O-N 2.74Å; I641-Q643 VanDerWaalsContact C-N 3.35Å; I641-Q643 PolarHBondContact O-N 2.73Å; Q643-Q645 VanDerWaalsContact C-N 3.34Å; Q643-Q645 PolarHBondContact O-N 3.41Å; Q643-A646 PolarHBondContact O-N 3.35Å; Q643-E647 WeakPolarHBondContact O-CG 3.45Å; Q643-E647 PolarHBondContact O-N 2.87Å
644	S	74	Confident	69.6	Low	64 Å²	64	113.6 Å²	113.6	45%	0.448	59%	0.585	S	S	.	*	H	α-helix	trans	-65.3	-33.8	176.7	78.2	0	0	0	0	113.6	L640 I641 Q642 Y648	L640-S644 WeakPolarHBondContact O-CB 3.37Å; L640-S644 PolarHBondContact O-N 2.72Å; I641-S644 PolarHBondContact O-N 3.31Å; I641-S644 PolarHBondContact O-OG 3.32Å; Q642-S644 VanDerWaalsContact C-N 3.34Å; Q642-S644 PolarHBondContact O-N 2.95Å; S644-Y648 WeakPolarHBondContact O-CB 3.31Å; S644-Y648 PolarHBondContact O-N 2.81Å
645	Q	78.3	Confident	70.3	Confident	110 Å²	110	113.5 Å²	113.5	51%	0.514	59%	0.587	S	S	.	*	H	α-helix	trans	-71.4	-43.5	175.8	-71.2	173.9	7	0	0	111.3	I641 Q642 Q643 E647 Y648 D649	I641-Q645 WeakPolarHBondContact O-CG 3.32Å; I641-Q645 PolarHBondContact O-N 2.98Å; Q642-Q645 PolarHBondContact O-N 3.16Å; Q643-Q645 VanDerWaalsContact C-N 3.34Å; Q643-Q645 PolarHBondContact O-N 3.41Å; Q645-E647 VanDerWaalsContact C-N 3.32Å; Q645-E647 PolarHBondContact O-N 2.85Å; Q645-Y648 WeakPolarHBondContact O-CB 3.37Å; Q645-Y648 PolarHBondContact O-N 2.79Å; Q645-D649 PolarHBondContact O-N 2.98Å
646	A	78.1	Confident	70.8	Confident	63 Å²	63	113.5 Å²	113.5	52%	0.521	59%	0.592	S	S	.	*	H	α-helix	trans	-63.1	-36.6	174.2	0	0	0	0	0	112.5	Q642 Q643 S650	Q642-A646 WeakPolarHBondContact O-CB 3.31Å; Q642-A646 PolarHBondContact O-N 2.93Å; Q643-A646 PolarHBondContact O-N 3.35Å; A646-S650 WeakPolarHBondContact O-CB 3.23Å; A646-S650 PolarHBondContact O-N 3.18Å
647	E	75.1	Confident	70.5	Confident	121 Å²	121	117.8 Å²	117.8	57%	0.565	61%	0.611	S	S	*	*	H	α-helix	trans	-66.8	-41.6	172.8	-75.9	-173.3	175.3	0	0	112.3	Q643 Q645 S650 G651	Q643-E647 WeakPolarHBondContact O-CG 3.45Å; Q643-E647 PolarHBondContact O-N 2.87Å; Q645-E647 VanDerWaalsContact C-N 3.32Å; Q645-E647 PolarHBondContact O-N 2.85Å; E647-S650 PolarHBondContact O-N 2.87Å; E647-S650 PolarHBondContact O-OG 3.04Å; E647-G651 PolarHBondContact O-N 3.33Å
648	Y	71.3	Confident	71.1	Confident	168 Å²	168	114.5 Å²	114.5	66%	0.659	60%	0.598	S	S	*	*	H	α-helix	trans	-60.7	-50.2	175	-179.1	-93.2	0	0	0	112	S644 Q645 S650 G651	S644-Y648 WeakPolarHBondContact O-CB 3.31Å; S644-Y648 PolarHBondContact O-N 2.81Å; Q645-Y648 WeakPolarHBondContact O-CB 3.37Å; Q645-Y648 PolarHBondContact O-N 2.79Å; Y648-S650 PolarHBondContact O-N 3.17Å; Y648-G651 WeakPolarHBondContact O-CA 3.46Å; Y648-G651 PolarHBondContact O-N 3.1Å
649	D	70.4	Confident	71.1	Confident	134 Å²	134	110.6 Å²	110.6	72%	0.717	59%	0.585	S	S	*	*	H	α-helix	trans	-65.3	-26.4	177.2	-73	-14.3	0	0	0	112.1	Q645 G651	Q645-D649 PolarHBondContact O-N 2.98Å; D649-G651 PolarHBondContact O-N 2.99Å
650	S	75.1	Confident	70.3	Confident	53 Å²	53	114 Å²	114	37%	0.371	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.9	-2.6	170.3	85.7	0	0	0	0	114.4	A646 E647 Y648 R652	A646-S650 WeakPolarHBondContact O-CB 3.23Å; A646-S650 PolarHBondContact O-N 3.18Å; E647-S650 PolarHBondContact O-N 2.87Å; E647-S650 PolarHBondContact O-OG 3.04Å; Y648-S650 PolarHBondContact O-N 3.17Å; S650-R652 PolarHBondContact O-N 3.29Å; S650-R652 PolarHBondContact OG-NE 3.23Å
651	G	60.3	Low	69.8	Low	57 Å²	57	115.2 Å²	115.2	59%	0.588	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.4	9.7	169.6	0	0	0	0	0	116.3	E647 Y648 D649 Y653	E647-G651 PolarHBondContact O-N 3.33Å; Y648-G651 WeakPolarHBondContact O-CA 3.46Å; Y648-G651 PolarHBondContact O-N 3.1Å; D649-G651 PolarHBondContact O-N 2.99Å; G651-Y653 PolarHBondContact O-N 2.9Å
652	R	59	Low	69.5	Low	202 Å²	202	117 Å²	117	76%	0.762	63%	0.625	S	S	*	*			trans	-83.5	30.9	-170.3	-57.4	-178.4	-144.9	-131.7	5.5	114.8	S650 S654	S650-R652 PolarHBondContact O-N 3.29Å; S650-R652 PolarHBondContact OG-NE 3.23Å; R652-S654 PolarHBondContact O-N 2.98Å
653	Y	60.3	Low	69	Low	209 Å²	209	113.1 Å²	113.1	82%	0.82	61%	0.608	S	S	*	*			trans	-72.8	-6.2	-172.7	-164.8	-104.5	0	0	0	114.8	G651	G651-Y653 PolarHBondContact O-N 2.9Å
654	S	57	Low	68.6	Low	88 Å²	88	112 Å²	112	62%	0.615	61%	0.611	S	S	*	*	S	Bend	trans	-133.2	146.8	174.1	58.3	0	0	0	0	111.3	R652 T656	R652-S654 PolarHBondContact O-N 2.98Å; S654-T656 PolarHBondContact O-N 3.1Å
655	P	64.1	Low	67.8	Low	129 Å²	129	118 Å²	118	84%	0.838	64%	0.637	S	S	*	*			trans	-56.3	127.4	173.5	-24.5	34	0	0	0	111	L657	P655-L657 PolarHBondContact O-N 3.2Å
656	T	63.8	Low	66.9	Low	116 Å²	116	120.7 Å²	120.7	71%	0.712	66%	0.655	S	S	*	*			trans	-57	126.4	173.3	48.7	0	0	0	0	109.9	S654 L658	S654-T656 PolarHBondContact O-N 3.1Å; T656-L658 PolarHBondContact O-N 3.26Å
657	L	63.3	Low	66.5	Low	160 Å²	160	120.8 Å²	120.8	84%	0.838	65%	0.649	S	S	*	*			trans	-69.4	94.5	178.8	-169.7	157.4	0	0	0	109.3	P655 T659	P655-L657 PolarHBondContact O-N 3.2Å; L657-T659 PolarHBondContact O-N 3.44Å
658	L	75.3	Confident	65.9	Low	90 Å²	90	122.4 Å²	122.4	47%	0.471	66%	0.656	S	S	.	*			trans	-65.6	130.6	176.6	-59.8	179.9	0	0	0	110.1	T656 E662 L663	T656-L658 PolarHBondContact O-N 3.26Å; L658-E662 HydrophobicContact CB-CB 4.4Å; L658-E662 HydrophobicContact CD2-CB 4.29Å; L658-L663 HydrophobicContact CB-CD2 4.26Å; L658-L663 HydrophobicContact CD1-CD2 4.06Å
659	T	71.7	Confident	65.7	Low	71 Å²	71	118.1 Å²	118.1	44%	0.436	65%	0.648	S	S	.	*			trans	-75.3	162.7	170.2	67	0	0	0	0	110.8	L657 S661 E662 L663	L657-T659 PolarHBondContact O-N 3.44Å; T659-S661 PolarHBondContact O-N 3.06Å; T659-E662 VanDerWaalsContact CB-OE2 3.29Å; T659-E662 WeakPolarHBondContact CB-OE2 3.44Å; T659-E662 WeakPolarHBondContact CG2-OE2 3.35Å; T659-E662 PolarHBondContact N-OE2 3.04Å; T659-E662 PolarHBondContact O-N 3.41Å; T659-E662 VanDerWaalsContact OG1-CD 3.32Å; T659-E662 PolarHBondContact OG1-OE2 3.32Å; T659-L663 PolarHBondContact O-N 3.14Å
660	L	61.5	Low	65.9	Low	142 Å²	142	115.1 Å²	115.1	74%	0.743	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-18.1	177.6	-79.7	163.5	0	0	0	114.2	L663 T669	L660-L663 HydrophobicContact CD2-CD1 4.34Å; L660-T669 HydrophobicContact CD2-CG2 4.02Å
661	S	65.9	Low	66.1	Low	117 Å²	117	115.5 Å²	115.5	82%	0.818	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-15	177.8	-54.7	0	0	0	0	113.9	T659	T659-S661 PolarHBondContact O-N 3.06Å
662	E	73.6	Confident	66.9	Low	116 Å²	116	117.5 Å²	117.5	54%	0.542	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.8	-10.1	-178.4	-67.6	161.4	131.5	0	0	112.3	L658 T659	L658-E662 HydrophobicContact CB-CB 4.4Å; L658-E662 HydrophobicContact CD2-CB 4.29Å; T659-E662 VanDerWaalsContact CB-OE2 3.29Å; T659-E662 WeakPolarHBondContact CB-OE2 3.44Å; T659-E662 WeakPolarHBondContact CG2-OE2 3.35Å; T659-E662 PolarHBondContact N-OE2 3.04Å; T659-E662 PolarHBondContact O-N 3.41Å; T659-E662 VanDerWaalsContact OG1-CD 3.32Å; T659-E662 PolarHBondContact OG1-OE2 3.32Å
663	L	71.4	Confident	67.9	Low	51 Å²	51	114.3 Å²	114.3	27%	0.267	63%	0.628	S	S	.	*	S	Bend	trans	-70	131.7	168.9	-64.6	175.6	0	0	0	110	L658 T659 L660 T667 T669	L658-L663 HydrophobicContact CB-CD2 4.26Å; L658-L663 HydrophobicContact CD1-CD2 4.06Å; T659-L663 PolarHBondContact O-N 3.14Å; L660-L663 HydrophobicContact CD2-CD1 4.34Å; L663-T667 HydrophobicContact CD2-CG2 4.39Å; L663-T669 HydrophobicContact CD1-CG2 3.54Å
664	P	71.1	Confident	68.4	Low	90 Å²	90	109.3 Å²	109.3	58%	0.584	61%	0.612	S	S	*	*			trans	-52.7	146.4	171.3	-27.5	33.8	0	0	0	112.5	D666 T667	P664-D666 PolarHBondContact O-N 2.9Å; P664-T667 VanDerWaalsContact CD-OG1 3.31Å; P664-T667 WeakPolarHBondContact CD-OG1 3.18Å; P664-T667 VanDerWaalsContact O-CB 3.29Å; P664-T667 WeakPolarHBondContact O-CB 3.41Å; P664-T667 PolarHBondContact O-N 2.88Å; P664-T667 PolarHBondContact O-OG1 2.84Å
665	L	56.9	Low	69.3	Low	190 Å²	190	109 Å²	109	100%	0.995	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-15.8	-173.5	-79.1	76.8	0	0	0	114.9
666	D	60	Low	70	Confident	167 Å²	167	104.9 Å²	104.9	89%	0.893	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	5	178.2	-144.4	26.7	0	0	0	112.6	P664 H668	P664-D666 PolarHBondContact O-N 2.9Å; D666-H668 PolarHBondContact O-N 2.87Å
667	T	68.9	Low	70.8	Confident	65 Å²	65	104.8 Å²	104.8	40%	0.399	57%	0.572	S	S	.	*			trans	-82.8	109	-176.6	-38.8	0	0	0	0	111	L663 P664 T669	L663-T667 HydrophobicContact CD2-CG2 4.39Å; P664-T667 VanDerWaalsContact CD-OG1 3.31Å; P664-T667 WeakPolarHBondContact CD-OG1 3.18Å; P664-T667 VanDerWaalsContact O-CB 3.29Å; P664-T667 WeakPolarHBondContact O-CB 3.41Å; P664-T667 PolarHBondContact O-N 2.88Å; P664-T667 PolarHBondContact O-OG1 2.84Å; T667-T669 PolarHBondContact O-N 3.26Å
668	H	63.3	Low	71.4	Confident	155 Å²	155	103.5 Å²	103.5	72%	0.718	56%	0.556	S	S	*	*			trans	-77	89.3	-176.4	-168.3	77.3	0	0	0	112.3	D666 I670	D666-H668 PolarHBondContact O-N 2.87Å; H668-I670 PolarHBondContact O-N 3.14Å
669	T	66	Low	71.4	Confident	79 Å²	79	102.9 Å²	102.9	49%	0.485	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-66.2	124.2	173.2	54.3	0	0	0	0	111.2	L660 L663 T667	L660-T669 HydrophobicContact CD2-CG2 4.02Å; L663-T669 HydrophobicContact CD1-CG2 3.54Å; T667-T669 PolarHBondContact O-N 3.26Å
670	I	74.7	Confident	71.9	Confident	70 Å²	70	105.6 Å²	105.6	36%	0.359	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-101.5	129.6	175.2	-59	164.9	0	0	0	108.1	H668 E674 D675	H668-I670 PolarHBondContact O-N 3.14Å; I670-E674 HydrophobicContact CG2-CB 3.88Å; I670-D675 HydrophobicContact CG2-CB 4.02Å
671	T	79.8	Confident	72.5	Confident	62 Å²	62	102.9 Å²	102.9	38%	0.38	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-74.2	152.8	175.7	60.2	0	0	0	0	111.7	E673 E674 D675	T671-E673 PolarHBondContact O-N 2.77Å; T671-E674 WeakPolarHBondContact CB-OE2 3.42Å; T671-E674 WeakPolarHBondContact CG2-OE2 3.45Å; T671-E674 PolarHBondContact N-OE2 3.11Å; T671-E674 PolarHBondContact O-N 3.48Å; T671-E674 VanDerWaalsContact O-N 3.08Å; T671-E674 WeakPolarHBondContact OG1-CB 3.35Å; T671-E674 WeakPolarHBondContact OG1-CG 3.44Å; T671-E674 PolarHBondContact OG1-N 2.83Å; T671-E674 PolarHBondContact OG1-OE2 3.37Å; T671-D675 PolarHBondContact O-N 3.2Å
672	P	76.7	Confident	72.6	Confident	98 Å²	98	98.9 Å²	98.9	64%	0.636	52%	0.52	S	S	*	.	H	α-helix	trans	-61.9	-28.3	179.4	23.6	-31.4	0	0	0	112.7	A676	P672-A676 WeakPolarHBondContact O-CB 3.38Å; P672-A676 PolarHBondContact O-N 3.35Å
673	E	80.4	Confident	72.7	Confident	136 Å²	136	100.5 Å²	100.5	64%	0.636	52%	0.521	S	S	*	.	H	α-helix	trans	-67.7	-42.3	172.3	-65.1	73.2	-161.5	0	0	112.3	T671 H677	T671-E673 PolarHBondContact O-N 2.77Å; E673-H677 WeakPolarHBondContact O-CB 3.27Å; E673-H677 PolarHBondContact O-N 3.48Å
674	E	71.6	Confident	72.7	Confident	103 Å²	103	106.8 Å²	106.8	48%	0.481	54%	0.541	S	S	.	.	H	α-helix	trans	-67.6	-40.2	177.1	-75.1	167.8	131.6	0	0	112.3	I670 T671 H677 R678	I670-E674 HydrophobicContact CG2-CB 3.88Å; T671-E674 WeakPolarHBondContact CB-OE2 3.42Å; T671-E674 WeakPolarHBondContact CG2-OE2 3.45Å; T671-E674 PolarHBondContact N-OE2 3.11Å; T671-E674 PolarHBondContact O-N 3.48Å; T671-E674 VanDerWaalsContact O-N 3.08Å; T671-E674 WeakPolarHBondContact OG1-CB 3.35Å; T671-E674 WeakPolarHBondContact OG1-CG 3.44Å; T671-E674 PolarHBondContact OG1-N 2.83Å; T671-E674 PolarHBondContact OG1-OE2 3.37Å; E674-H677 PolarHBondContact O-N 3.18Å; E674-R678 VanDerWaalsContact O-CB 3.31Å; E674-R678 WeakPolarHBondContact O-CB 3.29Å; E674-R678 PolarHBondContact O-N 3.34Å
675	D	75.4	Confident	71.9	Confident	82 Å²	82	106.1 Å²	106.1	44%	0.439	53%	0.53	S	S	.	.	H	α-helix	trans	-68.7	-41.6	175.5	-167.1	60.6	0	0	0	111.5	I670 T671 H677 R678 L679	I670-D675 HydrophobicContact CG2-CB 4.02Å; T671-D675 PolarHBondContact O-N 3.2Å; D675-H677 VanDerWaalsContact C-N 3.28Å; D675-H677 PolarHBondContact O-N 2.88Å; D675-R678 WeakPolarHBondContact O-CB 3.39Å; D675-R678 PolarHBondContact O-N 3.34Å; D675-L679 VanDerWaalsContact O-CB 3.26Å; D675-L679 WeakPolarHBondContact O-CB 3.31Å; D675-L679 PolarHBondContact O-N 2.88Å
676	A	78.1	Confident	72.1	Confident	43 Å²	43	101 Å²	101	36%	0.355	50%	0.503	S	S	.	.	H	α-helix	trans	-59.5	-38.4	172.1	0	0	0	0	0	112.3	P672 Q680	P672-A676 WeakPolarHBondContact O-CB 3.38Å; P672-A676 PolarHBondContact O-N 3.35Å; A676-Q680 WeakPolarHBondContact O-CG 3.48Å; A676-Q680 PolarHBondContact O-N 2.97Å
677	H	81	Confident	72.1	Confident	114 Å²	114	101.1 Å²	101.1	53%	0.528	50%	0.498	S	S	.	.	H	α-helix	trans	-70.7	-41.2	175.9	-169.3	-114.3	0	0	0	112.1	E673 E674 D675 L679 Q680 L681	E673-H677 WeakPolarHBondContact O-CB 3.27Å; E673-H677 PolarHBondContact O-N 3.48Å; E674-H677 PolarHBondContact O-N 3.18Å; D675-H677 VanDerWaalsContact C-N 3.28Å; D675-H677 PolarHBondContact O-N 2.88Å; H677-L679 VanDerWaalsContact C-N 3.34Å; H677-L679 PolarHBondContact O-N 2.86Å; H677-Q680 PolarHBondContact O-N 3.4Å; H677-L681 WeakPolarHBondContact O-CG 3.48Å; H677-L681 PolarHBondContact O-N 2.9Å
678	R	76.8	Confident	71.6	Confident	133 Å²	133	103.9 Å²	103.9	50%	0.502	52%	0.515	S	S	.	.	H	α-helix	trans	-58.7	-44.3	172.4	-175.2	-177.6	-67	-168.7	1.5	111.4	E674 D675 L681 A682	E674-R678 VanDerWaalsContact O-CB 3.31Å; E674-R678 WeakPolarHBondContact O-CB 3.29Å; E674-R678 PolarHBondContact O-N 3.34Å; D675-R678 WeakPolarHBondContact O-CB 3.39Å; D675-R678 PolarHBondContact O-N 3.34Å; R678-L681 PolarHBondContact O-N 3.49Å; R678-A682 PolarHBondContact O-N 3.37Å
679	L	75.2	Confident	70.9	Confident	77 Å²	77	101.3 Å²	101.3	40%	0.403	51%	0.51	S	S	.	.	H	α-helix	trans	-63.8	-39.9	176.2	-177.3	65.4	0	0	0	112.4	D675 H677 R683	D675-L679 VanDerWaalsContact O-CB 3.26Å; D675-L679 WeakPolarHBondContact O-CB 3.31Å; D675-L679 PolarHBondContact O-N 2.88Å; H677-L679 VanDerWaalsContact C-N 3.34Å; H677-L679 PolarHBondContact O-N 2.86Å; L679-R683 WeakPolarHBondContact O-CB 3.28Å; L679-R683 VanDerWaalsContact O-CG 3.23Å; L679-R683 WeakPolarHBondContact O-CG 3.4Å; L679-R683 PolarHBondContact O-N 2.66Å
680	Q	80.6	Confident	69.9	Low	127 Å²	127	100.6 Å²	100.6	59%	0.593	52%	0.519	S	S	*	.	H	α-helix	trans	-65.8	-40.6	174.2	-76	-177.1	31	0	0	112.3	A676 H677 R684	A676-Q680 WeakPolarHBondContact O-CG 3.48Å; A676-Q680 PolarHBondContact O-N 2.97Å; H677-Q680 PolarHBondContact O-N 3.4Å; Q680-R684 WeakPolarHBondContact O-CB 3.46Å; Q680-R684 PolarHBondContact O-N 2.82Å
681	L	75.7	Confident	68.4	Low	85 Å²	85	101.5 Å²	101.5	45%	0.445	53%	0.525	S	S	.	.	H	α-helix	trans	-62.8	-48.9	176	-72	167.6	0	0	0	111.6	H677 R678 R683 R684 Q685	H677-L681 WeakPolarHBondContact O-CG 3.48Å; H677-L681 PolarHBondContact O-N 2.9Å; R678-L681 PolarHBondContact O-N 3.49Å; L681-R683 PolarHBondContact O-N 2.83Å; L681-R684 PolarHBondContact O-N 2.89Å; L681-R684 VanDerWaalsContact O-N 3.11Å; L681-Q685 PolarHBondContact O-N 3.09Å
682	A	67.9	Low	66.8	Low	33 Å²	33	100.8 Å²	100.8	27%	0.273	53%	0.525	S	S	.	.	H	α-helix	trans	-60.1	-44	177.5	0	0	0	0	0	112.4	R678 R684 Q685 L686	R678-A682 PolarHBondContact O-N 3.37Å; A682-R684 VanDerWaalsContact C-N 3.3Å; A682-R684 PolarHBondContact O-N 3.17Å; A682-Q685 PolarHBondContact O-N 3.25Å; A682-L686 WeakPolarHBondContact O-CB 3.49Å; A682-L686 PolarHBondContact O-N 3.01Å
683	R	75.9	Confident	65.4	Low	150 Å²	150	99.9 Å²	99.9	57%	0.566	52%	0.521	S	S	*	.	H	α-helix	trans	-60.8	-37.6	174.3	-75.2	171	175.7	176.2	-0.3	112.4	L679 L681 Q687	L679-R683 WeakPolarHBondContact O-CB 3.28Å; L679-R683 VanDerWaalsContact O-CG 3.23Å; L679-R683 WeakPolarHBondContact O-CG 3.4Å; L679-R683 PolarHBondContact O-N 2.66Å; L681-R683 PolarHBondContact O-N 2.83Å; R683-Q687 WeakPolarHBondContact O-CG 3.42Å; R683-Q687 PolarHBondContact O-N 3.07Å
684	R	71.6	Confident	63.8	Low	183 Å²	183	98 Å²	98	69%	0.691	51%	0.512	S	S	*	.	H	α-helix	trans	-73.5	-32.6	178.4	-171.1	175.8	-177.6	174.8	1.1	112.7	Q680 L681 A682 V688	Q680-R684 WeakPolarHBondContact O-CB 3.46Å; Q680-R684 PolarHBondContact O-N 2.82Å; L681-R684 PolarHBondContact O-N 2.89Å; L681-R684 VanDerWaalsContact O-N 3.11Å; A682-R684 VanDerWaalsContact C-N 3.3Å; A682-R684 PolarHBondContact O-N 3.17Å; R684-V688 WeakPolarHBondContact O-CG2 3.26Å
685	Q	53.8	Low	63.1	Low	76 Å²	76	95.2 Å²	95.2	36%	0.355	50%	0.504	S	S	.	.	H	α-helix	trans	-67.3	-50.6	170.7	-75.7	173.1	-73.6	0	0	110.6	L681 A682 Q687 V688 T689 E694	L681-Q685 PolarHBondContact O-N 3.09Å; A682-Q685 PolarHBondContact O-N 3.25Å; Q685-Q687 PolarHBondContact O-N 3.34Å; Q685-Q687 VanDerWaalsContact O-N 3.12Å; Q685-V688 WeakPolarHBondContact O-CA 3.36Å; Q685-V688 PolarHBondContact O-N 2.88Å; Q685-T689 PolarHBondContact O-N 3.16Å; Q685-T689 PolarHBondContact O-OG1 2.88Å; Q685-E694 PolarHBondContact NE2-OE2 3.42Å
686	L	60.2	Low	62.1	Low	82 Å²	82	95.4 Å²	95.4	43%	0.429	52%	0.517	S	S	.	.	H	α-helix	trans	-50.4	-41.1	178.1	-178.4	66.9	0	0	0	113.1	A682 V688 G690 A692	A682-L686 WeakPolarHBondContact O-CB 3.49Å; A682-L686 PolarHBondContact O-N 3.01Å; L686-V688 PolarHBondContact O-N 3.35Å; L686-G690 WeakPolarHBondContact O-CA 3.24Å; L686-G690 PolarHBondContact O-N 2.93Å; L686-A692 HydrophobicContact CB-CB 4.14Å; L686-A692 HydrophobicContact CD1-CB 4.16Å
687	Q	61.2	Low	61	Low	170 Å²	170	96.5 Å²	96.5	79%	0.794	52%	0.515	S	S	*	.	H	α-helix	trans	-66.6	-16.2	176.8	-74.9	178.9	-8.8	0	0	115	R683 Q685	R683-Q687 WeakPolarHBondContact O-CG 3.42Å; R683-Q687 PolarHBondContact O-N 3.07Å; Q685-Q687 PolarHBondContact O-N 3.34Å; Q685-Q687 VanDerWaalsContact O-N 3.12Å
688	V	58	Low	60	Low	123 Å²	123	95 Å²	95	75%	0.745	51%	0.51	S	S	*	.	H	α-helix	trans	-108.1	-36.8	-177.4	176.5	0	0	0	0	111.9	R684 Q685 L686	R684-V688 WeakPolarHBondContact O-CG2 3.26Å; Q685-V688 WeakPolarHBondContact O-CA 3.36Å; Q685-V688 PolarHBondContact O-N 2.88Å; L686-V688 PolarHBondContact O-N 3.35Å
689	T	48.3	Very low	59.3	Low	101 Å²	101	90.6 Å²	90.6	62%	0.62	50%	0.502	S	S	*	.	H	α-helix	trans	-106.5	-16.7	-175.2	41.6	0	0	0	0	114.9	Q685 D691	Q685-T689 PolarHBondContact O-N 3.16Å; Q685-T689 PolarHBondContact O-OG1 2.88Å; T689-D691 PolarHBondContact O-N 3.02Å; T689-D691 PolarHBondContact OG1-O 3.47Å
690	G	45.9	Very low	58.7	Low	65 Å²	65	88.6 Å²	88.6	67%	0.67	49%	0.491	S	S	*	.	S	Bend	trans	78.1	-5.3	-173.2	0	0	0	0	0	114.7	L686	L686-G690 WeakPolarHBondContact O-CA 3.24Å; L686-G690 PolarHBondContact O-N 2.93Å
691	D	43.2	Very low	58	Low	89 Å²	89	84.9 Å²	84.9	48%	0.476	48%	0.476	S	S	.	.			trans	-129.5	140.8	173.5	-170.4	-18	0	0	0	108.8	T689 S693	T689-D691 PolarHBondContact O-N 3.02Å; T689-D691 PolarHBondContact OG1-O 3.47Å; D691-S693 PolarHBondContact OD1-N 2.7Å; D691-S693 PolarHBondContact OD1-OG 3.11Å
692	A	44.9	Very low	57.7	Low	46 Å²	46	86.8 Å²	86.8	38%	0.38	48%	0.478	S	S	.	.	S	Bend	trans	-90.3	-13.4	177.7	0	0	0	0	0	113.2	L686	L686-A692 HydrophobicContact CB-CB 4.14Å; L686-A692 HydrophobicContact CD1-CB 4.16Å
693	S	48.5	Very low	57.6	Low	80 Å²	80	93.4 Å²	93.4	56%	0.559	50%	0.496	S	S	*	.			trans	-106.8	72	-171.4	63.1	0	0	0	0	112.5	D691 S695	D691-S693 PolarHBondContact OD1-N 2.7Å; D691-S693 PolarHBondContact OD1-OG 3.11Å; S693-S695 PolarHBondContact O-N 3.12Å
694	E	46.9	Very low	57	Low	97 Å²	97	86.9 Å²	86.9	45%	0.453	47%	0.474	S	S	.	.			trans	-70.7	76.2	161.7	-174.6	160.4	-122.8	0	0	109.9	Q685 A699 R702	Q685-E694 PolarHBondContact NE2-OE2 3.42Å; E694-A699 HydrophobicContact CG-CB 4.47Å; E694-R702 IonicContact OE1-CZ 2.71Å; E694-R702 IonicContact OE1-NH1 2.69Å; E694-R702 PolarHBondContact OE1-NH1 2.91Å; E694-R702 IonicContact OE1-NH2 3.28Å; E694-R702 PolarHBondContact OE1-NH2 2.67Å
695	S	55.6	Low	56.8	Low	43 Å²	43	84.5 Å²	84.5	30%	0.301	47%	0.468	S	S	.	.			trans	-54.4	143.4	172.4	178.4	0	0	0	0	109.6	S693 E697 D698 A699	S693-S695 PolarHBondContact O-N 3.12Å; S695-E697 PolarHBondContact O-N 2.95Å; S695-E697 WeakPolarHBondContact OG-CB 3.47Å; S695-E697 VanDerWaalsContact OG-CG 3.27Å; S695-E697 WeakPolarHBondContact OG-CG 3.4Å; S695-E697 PolarHBondContact OG-N 3.06Å; S695-E697 PolarHBondContact OG-OE2 2.83Å; S695-D698 PolarHBondContact O-N 3.04Å; S695-A699 PolarHBondContact O-N 3.07Å
696	A	54.2	Low	57.2	Low	86 Å²	86	86.8 Å²	86.8	71%	0.711	48%	0.479	S	S	*	.	H	α-helix	trans	-55.2	-26.2	173.2	0	0	0	0	0	111.9	F700	A696-F700 WeakPolarHBondContact O-CB 3.18Å; A696-F700 PolarHBondContact O-N 2.9Å
697	E	56.3	Low	57.2	Low	67 Å²	67	86 Å²	86	31%	0.313	49%	0.491	S	S	.	.	H	α-helix	trans	-63.1	-43.2	172.6	-54.4	170.8	117.5	0	0	112.5	S695 F700 V701 R738	S695-E697 PolarHBondContact O-N 2.95Å; S695-E697 WeakPolarHBondContact OG-CB 3.47Å; S695-E697 VanDerWaalsContact OG-CG 3.27Å; S695-E697 WeakPolarHBondContact OG-CG 3.4Å; S695-E697 PolarHBondContact OG-N 3.06Å; S695-E697 PolarHBondContact OG-OE2 2.83Å; E697-F700 CarbonylContact O-C 3.41Å; E697-F700 PolarHBondContact O-N 3.19Å; E697-V701 WeakPolarHBondContact O-CG2 3.4Å; E697-V701 PolarHBondContact O-N 3.12Å; E697-R738 IonicContact OE1-CZ 2.7Å; E697-R738 IonicContact OE1-NE 2.67Å; E697-R738 IonicContact OE1-NH1 2.86Å; E697-R738 PolarHBondContact OE1-NH1 3.31Å; E697-R738 IonicContact OE2-NH1 2.71Å; E697-R738 PolarHBondContact OE2-NH1 2.82Å
698	D	60	Low	57.2	Low	82 Å²	82	82.4 Å²	82.4	44%	0.439	48%	0.475	S	S	.	.	H	α-helix	trans	-78	-40.8	-174.6	-161	74.4	0	0	0	111.4	S695 F700 V701 R702	S695-D698 PolarHBondContact O-N 3.04Å; D698-F700 PolarHBondContact O-N 3.21Å; D698-V701 PolarHBondContact O-N 3.29Å; D698-R702 WeakPolarHBondContact O-CB 3.49Å; D698-R702 PolarHBondContact O-N 2.78Å; D698-R702 IonicContact OD2-CZ 2.64Å; D698-R702 IonicContact OD2-NH2 3.47Å; D698-R702 PolarHBondContact OD2-NH2 3.07Å
699	A	61.5	Low	57.5	Low	40 Å²	40	78.3 Å²	78.3	33%	0.331	46%	0.458	S	S	.	.	H	α-helix	trans	-56.7	-36.3	166.6	0	0	0	0	0	111.8	E694 S695 R703	E694-A699 HydrophobicContact CG-CB 4.47Å; S695-A699 PolarHBondContact O-N 3.07Å; A699-R703 WeakPolarHBondContact O-CB 3.47Å; A699-R703 PolarHBondContact O-N 3.04Å; A699-R703 VanDerWaalsContact O-N 3.13Å
700	F	62.8	Low	58.4	Low	36 Å²	36	81.1 Å²	81.1	16%	0.158	47%	0.469	C	S	.	.	H	α-helix	trans	-73	-45.9	173.3	-177.8	-83.7	0	0	0	113.1	A696 E697 D698 R702 R703 A704 N773 F775 I838	A696-F700 WeakPolarHBondContact O-CB 3.18Å; A696-F700 PolarHBondContact O-N 2.9Å; E697-F700 CarbonylContact O-C 3.41Å; E697-F700 PolarHBondContact O-N 3.19Å; D698-F700 PolarHBondContact O-N 3.21Å; F700-R702 PolarHBondContact O-N 3.34Å; F700-R703 CarbonylContact O-C 3.6Å; F700-R703 WeakPolarHBondContact O-CA 3.41Å; F700-R703 PolarHBondContact O-N 2.86Å; F700-A704 HydrophobicContact CD1-CB 4.08Å; F700-A704 HydrophobicContact CE1-CB 3.59Å; F700-A704 HydrophobicContact CZ-CB 4.04Å; F700-A704 WeakPolarHBondContact O-CB 3.03Å; F700-A704 PolarHBondContact O-N 3.43Å; F700-N773 HydrophobicContact CZ-CB 4.47Å; F700-F775 HydrophobicContact CB-CE1 4.32Å; F700-F775 HydrophobicContact CD1-CD1 4.39Å; F700-F775 AromaticContact CD1-CE1 3.24Å; F700-F775 HydrophobicContact CD1-CE1 3.24Å; F700-F775 HydrophobicContact CD1-CE2 4.25Å; F700-F775 AromaticContact CD1-CZ 3.18Å; F700-F775 HydrophobicContact CD1-CZ 3.18Å; F700-F775 AromaticContact CE1-CE1 3.72Å; F700-F775 HydrophobicContact CE1-CE1 3.72Å; F700-F775 AromaticContact CE1-CE2 3.96Å; F700-F775 HydrophobicContact CE1-CE2 3.96Å; F700-F775 AromaticContact CE1-CZ 3.31Å; F700-F775 HydrophobicContact CE1-CZ 3.31Å; F700-F775 AromaticContact CG-CE1 3.94Å; F700-F775 HydrophobicContact CG-CE1 3.94Å; F700-F775 HydrophobicContact CG-CZ 4.28Å; F700-I838 HydrophobicContact CD1-CD1 4.29Å; F700-I838 HydrophobicContact CD2-CD1 3.3Å; F700-I838 HydrophobicContact CE1-CD1 4.31Å; F700-I838 HydrophobicContact CE2-CD1 3.35Å; F700-I838 HydrophobicContact CE2-CG2 4.21Å; F700-I838 HydrophobicContact CG-CD1 3.8Å; F700-I838 HydrophobicContact CZ-CD1 3.88Å; F700-I838 HydrophobicContact CZ-CG2 3.93Å
701	V	65.2	Low	59.8	Low	49 Å²	49	81.2 Å²	81.2	30%	0.297	45%	0.454	S	S	.	.	H	α-helix	trans	-56	-39.2	177.3	167.6	0	0	0	0	109.9	E697 D698 A704 K705 F775	E697-V701 WeakPolarHBondContact O-CG2 3.4Å; E697-V701 PolarHBondContact O-N 3.12Å; D698-V701 PolarHBondContact O-N 3.29Å; V701-A704 PolarHBondContact O-N 2.9Å; V701-K705 WeakPolarHBondContact O-CB 3.33Å; V701-K705 PolarHBondContact O-N 3.07Å; V701-F775 HydrophobicContact CG2-CZ 4.48Å
702	R	69.6	Low	61.6	Low	124 Å²	124	78.5 Å²	78.5	47%	0.468	44%	0.439	S	S	.	.	H	α-helix	trans	-60.4	-47.2	171.9	-147.8	176.1	-51.9	136.2	7.5	112.6	E694 D698 F700 K705 E706	E694-R702 IonicContact OE1-CZ 2.71Å; E694-R702 IonicContact OE1-NH1 2.69Å; E694-R702 PolarHBondContact OE1-NH1 2.91Å; E694-R702 IonicContact OE1-NH2 3.28Å; E694-R702 PolarHBondContact OE1-NH2 2.67Å; D698-R702 WeakPolarHBondContact O-CB 3.49Å; D698-R702 PolarHBondContact O-N 2.78Å; D698-R702 IonicContact OD2-CZ 2.64Å; D698-R702 IonicContact OD2-NH2 3.47Å; D698-R702 PolarHBondContact OD2-NH2 3.07Å; F700-R702 PolarHBondContact O-N 3.34Å; R702-K705 CarbonylContact O-C 3.43Å; R702-K705 PolarHBondContact O-N 3.31Å; R702-E706 PolarHBondContact O-N 2.83Å
703	R	65.9	Low	63.4	Low	173 Å²	173	78.5 Å²	78.5	65%	0.653	44%	0.439	S	S	*	.	H	α-helix	trans	-70.1	-26.2	176.8	178.9	152.2	-74.3	148.3	1.5	114.6	A699 F700 E706	A699-R703 WeakPolarHBondContact O-CB 3.47Å; A699-R703 PolarHBondContact O-N 3.04Å; A699-R703 VanDerWaalsContact O-N 3.13Å; F700-R703 CarbonylContact O-C 3.6Å; F700-R703 WeakPolarHBondContact O-CA 3.41Å; F700-R703 PolarHBondContact O-N 2.86Å; R703-E706 IonicContact NE-OE2 4Å; R703-E706 VanDerWaalsContact O-CB 3.31Å; R703-E706 WeakPolarHBondContact O-CB 3.5Å
704	A	63.8	Low	65	Low	13 Å²	13	80.9 Å²	80.9	11%	0.107	44%	0.441	C	S	.	.	H	α-helix	trans	-82.9	-25.3	174.9	0	0	0	0	0	112.2	F700 V701 F740 R742	F700-A704 HydrophobicContact CD1-CB 4.08Å; F700-A704 HydrophobicContact CE1-CB 3.59Å; F700-A704 HydrophobicContact CZ-CB 4.04Å; F700-A704 WeakPolarHBondContact O-CB 3.03Å; F700-A704 PolarHBondContact O-N 3.43Å; V701-A704 PolarHBondContact O-N 2.9Å; A704-F740 HydrophobicContact CB-CD1 3.57Å; A704-F740 HydrophobicContact CB-CE1 3.96Å; A704-F740 HydrophobicContact CB-CG 4.36Å; A704-F740 WeakPolarHBondContact O-CE1 3.05Å; A704-R742 PolarHBondContact O-NH1 3.45Å
705	K	67.4	Low	66.5	Low	132 Å²	132	77.8 Å²	77.8	57%	0.574	43%	0.426	S	S	*	.	H	α-helix	trans	-81.6	-23.7	169.3	-169.7	173.7	-176.2	175.3	0	112.4	V701 R702 M708 F740	V701-K705 WeakPolarHBondContact O-CB 3.33Å; V701-K705 PolarHBondContact O-N 3.07Å; R702-K705 CarbonylContact O-C 3.43Å; R702-K705 PolarHBondContact O-N 3.31Å; K705-M708 WeakPolarHBondContact O-CB 3.39Å; K705-M708 PolarHBondContact O-N 3.31Å; K705-F740 HydrophobicContact CB-CZ 4.37Å
706	E	61.9	Low	67.5	Low	125 Å²	125	79.4 Å²	79.4	58%	0.584	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	136.2	168.2	-158.3	168.2	-161.4	0	0	109.9	R702 R703 M708 R742	R702-E706 PolarHBondContact O-N 2.83Å; R703-E706 IonicContact NE-OE2 4Å; R703-E706 VanDerWaalsContact O-CB 3.31Å; R703-E706 WeakPolarHBondContact O-CB 3.5Å; E706-M708 VanDerWaalsContact C-N 3.34Å; E706-M708 PolarHBondContact O-N 3.01Å; E706-R742 PolarHBondContact O-NH1 3.44Å
707	G	60.3	Low	68.5	Low	65 Å²	65	79.4 Å²	79.4	67%	0.67	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	26.8	-175.8	0	0	0	0	0	115.7	G709 R742	G707-G709 PolarHBondContact O-N 2.85Å; G707-R742 PolarHBondContact O-NH2 2.85Å
708	M	61.8	Low	69.5	Low	94 Å²	94	80 Å²	80	46%	0.463	43%	0.431	S	S	.	.			trans	-77.4	101	168.8	-161.9	175.8	90.7	0	0	110.7	K705 E706	K705-M708 WeakPolarHBondContact O-CB 3.39Å; K705-M708 PolarHBondContact O-N 3.31Å; E706-M708 VanDerWaalsContact C-N 3.34Å; E706-M708 PolarHBondContact O-N 3.01Å
709	G	62.8	Low	70.5	Confident	38 Å²	38	78.1 Å²	78.1	39%	0.392	42%	0.421	S	S	.	.			trans	-89.9	170.2	176.6	0	0	0	0	0	113.6	G707 D711 E712	G707-G709 PolarHBondContact O-N 2.85Å; G709-D711 PolarHBondContact O-N 2.83Å; G709-E712 PolarHBondContact O-N 3.16Å
710	N	67.6	Low	71.1	Confident	160 Å²	160	81.2 Å²	81.2	86%	0.856	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-7.2	-173.1	-61.1	2	0	0	0	116.1	K765	N710-K765 PolarHBondContact O-NZ 3.33Å
711	D	75.7	Confident	71.4	Confident	67 Å²	67	81.7 Å²	81.7	36%	0.358	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	8.4	179.8	-63.4	-50.8	0	0	0	112.6	G709 H744 T745 K765	G709-D711 PolarHBondContact O-N 2.83Å; D711-H744 CarbonylContact O-C 3.59Å; D711-H744 WeakPolarHBondContact O-CA 3.5Å; D711-H744 PolarHBondContact O-ND1 2.9Å; D711-T745 WeakPolarHBondContact CB-O 3.24Å; D711-T745 PolarHBondContact O-N 2.81Å; D711-K765 IonicContact OD1-NZ 3.39Å; D711-K765 PolarHBondContact OD1-NZ 2.83Å
712	E	81.6	Confident	70.6	Confident	32 Å²	32	84.4 Å²	84.4	15%	0.15	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	117.2	175.8	-69.1	-174.7	-133	0	0	111.6	G709 R742 V743 H744 K771	G709-E712 PolarHBondContact O-N 3.16Å; E712-R742 VanDerWaalsContact CD-NH2 3.29Å; E712-R742 IonicContact OE1-NH2 3.2Å; E712-R742 IonicContact OE2-CZ 2.82Å; E712-R742 VanDerWaalsContact OE2-CZ 3.23Å; E712-R742 IonicContact OE2-NE 3.1Å; E712-R742 PolarHBondContact OE2-NE 2.83Å; E712-R742 IonicContact OE2-NH2 2.65Å; E712-R742 PolarHBondContact OE2-NH2 2.86Å; E712-V743 WeakPolarHBondContact CA-O 3.37Å; E712-H744 HydrophobicContact CG-CB 4.32Å; E712-H744 WeakPolarHBondContact CG-ND1 3.43Å; E712-K771 IonicContact OE1-NZ 3.65Å; E712-K771 PolarHBondContact OE1-NZ 2.93Å; E712-K771 WeakPolarHBondContact OE2-CD 3.17Å; E712-K771 WeakPolarHBondContact OE2-CE 3.31Å; E712-K771 IonicContact OE2-NZ 3.66Å; E712-K771 PolarHBondContact OE2-NZ 2.85Å
713	A	81.1	Confident	69.9	Low	46 Å²	46	82.6 Å²	82.6	38%	0.38	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	150.8	178.1	0	0	0	0	0	111	R742 V743	A713-R742 CarbonylContact O-C 3.58Å; A713-R742 VanDerWaalsContact O-CA 3.29Å; A713-R742 WeakPolarHBondContact O-CA 3.18Å; A713-V743 PolarHBondContact N-O 2.92Å; A713-V743 PolarHBondContact O-N 3.34Å
714	Q	82.7	Confident	69.6	Low	129 Å²	129	79.2 Å²	79.2	60%	0.603	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	146	170.8	-175.6	173.5	-12.4	0	0	110.6	F740	Q714-F740 HydrophobicContact CG-CE2 4.3Å
715	F	79.8	Confident	69.4	Low	33 Å²	33	87.6 Å²	87.6	15%	0.145	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	136	-177.2	173.7	-100.1	0	0	0	111.7	V717 N741 V743 Y770 F815 K816	F715-V717 HydrophobicContact CD2-CB 4.49Å; F715-V717 HydrophobicContact CD2-CG2 4.16Å; F715-V717 HydrophobicContact CE2-CB 3.66Å; F715-V717 HydrophobicContact CE2-CG2 3.65Å; F715-V717 HydrophobicContact CZ-CB 3.74Å; F715-V717 HydrophobicContact CZ-CG2 4.26Å; F715-N741 HydrophobicContact CD1-CB 4.39Å; F715-N741 PolarHBondContact N-O 2.96Å; F715-N741 WeakPolarHBondContact O-CB 3.35Å; F715-V743 HydrophobicContact CB-CB 4.3Å; F715-V743 HydrophobicContact CB-CG2 3.39Å; F715-V743 HydrophobicContact CD1-CG2 4.02Å; F715-V743 HydrophobicContact CD2-CG2 3.8Å; F715-V743 HydrophobicContact CG-CG2 3.47Å; F715-V743 VanDerWaalsContact CG-CG2 3.47Å; F715-Y770 HydrophobicContact CE1-CE1 4.23Å; F715-Y770 HydrophobicContact CZ-CE1 4.35Å; F715-F815 HydrophobicContact CE1-CB 4.17Å; F715-F815 HydrophobicContact CE1-CD1 4.02Å; F715-F815 HydrophobicContact CE1-CG 4.43Å; F715-K816 WeakPolarHBondContact CZ-O 3.29Å
716	S	74.5	Confident	69.8	Low	77 Å²	77	83 Å²	83	54%	0.538	49%	0.493	S	S	.	.			trans	-150.4	31.1	-173.8	59.8	0	0	0	0	112.8	E718	S716-E718 PolarHBondContact O-N 3.23Å; S716-E718 VanDerWaalsContact O-N 3.13Å
717	V	75.6	Confident	70.1	Confident	85 Å²	85	85.5 Å²	85.5	52%	0.515	51%	0.509	S	S	.	.			trans	-85.5	83.6	177	-172.2	0	0	0	0	109.4	F715	F715-V717 HydrophobicContact CD2-CB 4.49Å; F715-V717 HydrophobicContact CD2-CG2 4.16Å; F715-V717 HydrophobicContact CE2-CB 3.66Å; F715-V717 HydrophobicContact CE2-CG2 3.65Å; F715-V717 HydrophobicContact CZ-CB 3.74Å; F715-V717 HydrophobicContact CZ-CG2 4.26Å
718	E	77.5	Confident	70.8	Confident	80 Å²	80	84.4 Å²	84.4	37%	0.374	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	153.8	168.5	-70.8	174.4	-118.7	0	0	111.5	S716 F739 A814 F815	S716-E718 PolarHBondContact O-N 3.23Å; S716-E718 VanDerWaalsContact O-N 3.13Å; E718-F739 HydrophobicContact CG-CE1 4.04Å; E718-F739 HydrophobicContact CG-CZ 3.87Å; E718-F739 VanDerWaalsContact OE1-CE1 3.29Å; E718-F739 WeakPolarHBondContact OE1-CE1 3.4Å; E718-F739 VanDerWaalsContact OE1-CZ 3.26Å; E718-F739 WeakPolarHBondContact OE1-CZ 3.29Å; E718-A814 CarbonylContact C-O 3.5Å; E718-A814 VanDerWaalsContact CA-O 3.3Å; E718-A814 WeakPolarHBondContact CA-O 3.47Å; E718-F815 HydrophobicContact CG-CD1 4.27Å; E718-F815 HydrophobicContact CG-CE1 3.72Å; E718-F815 HydrophobicContact CG-CZ 4.3Å
719	I	81	Confident	71.3	Confident	42 Å²	42	81.5 Å²	81.5	22%	0.215	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131	161.7	-67.9	172.4	0	0	0	106.8	V721 I801 A814 K816	I719-V721 PolarHBondContact O-N 2.97Å; I719-V721 VanDerWaalsContact O-N 3.15Å; I719-I801 HydrophobicContact CD1-CB 4.35Å; I719-I801 HydrophobicContact CD1-CD1 4.04Å; I719-I801 HydrophobicContact CD1-CG1 3.73Å; I719-I801 HydrophobicContact CD1-CG2 4.05Å; I719-A814 HydrophobicContact CB-CB 4.45Å; I719-A814 PolarHBondContact N-O 3.45Å; I719-K816 HydrophobicContact CD1-CB 3.76Å; I719-K816 HydrophobicContact CD1-CD 4.3Å; I719-K816 HydrophobicContact CD1-CG 4.12Å; I719-K816 HydrophobicContact CG1-CB 4.19Å
720	P	75	Confident	71.6	Confident	106 Å²	106	87.2 Å²	87.2	69%	0.688	50%	0.497	S	S	*	.			trans	-66.4	113.8	177.3	26.9	-33.7	0	0	0	111	S722	P720-S722 PolarHBondContact O-N 3.47Å; P720-S722 VanDerWaalsContact O-N 3.14Å
721	V	68.9	Low	71.6	Confident	46 Å²	46	87.9 Å²	87.9	28%	0.279	49%	0.492	S	S	.	.			trans	-86.1	63.6	171.5	-168.4	0	0	0	0	108.9	I719 D812 A814	I719-V721 PolarHBondContact O-N 2.97Å; I719-V721 VanDerWaalsContact O-N 3.15Å; V721-D812 HydrophobicContact CG1-CB 4.11Å; V721-A814 HydrophobicContact CG2-CB 3.44Å; V721-A814 VanDerWaalsContact CG2-CB 3.44Å
722	S	47.6	Very low	71.6	Confident	106 Å²	106	89.9 Å²	89.9	74%	0.741	50%	0.496	S	S	*	.			trans	-73.9	152.4	-176.6	48.1	0	0	0	0	113	P720	P720-S722 PolarHBondContact O-N 3.47Å; P720-S722 VanDerWaalsContact O-N 3.14Å
723	G	55.2	Low	71.4	Confident	85 Å²	85	98.8 Å²	98.8	88%	0.876	53%	0.528	S	S	*	.			trans	97.3	1.1	162.3	0	0	0	0	0	118	M725	G723-M725 PolarHBondContact O-N 2.71Å
724	K	60.2	Low	71.5	Confident	103 Å²	103	99 Å²	99	45%	0.448	53%	0.526	S	S	.	.			trans	-86	108.7	170.3	-70.2	-173.4	-176.5	-179.9	0	111	Y726 D812	K724-Y726 HydrophobicContact CB-CE1 4.37Å; K724-Y726 WeakPolarHBondContact O-CD2 3.41Å; K724-Y726 PolarHBondContact O-N 3.28Å; K724-D812 IonicContact NZ-OD2 3.8Å; K724-D812 PolarHBondContact NZ-OD2 2.99Å
725	M	60.2	Low	71.5	Confident	188 Å²	188	98.9 Å²	98.9	93%	0.926	52%	0.52	S	S	*	.			trans	-77	112.8	167.5	-163.5	156.6	72	0	0	108.8	G723	G723-M725 PolarHBondContact O-N 2.71Å
726	Y	74	Confident	71.9	Confident	37 Å²	37	103.5 Å²	103.5	15%	0.145	54%	0.539	C	S	.	.			trans	-84.1	122	-174.6	-62.8	-79.3	0	0	0	111	K724 W728 A729 E811 D812	K724-Y726 HydrophobicContact CB-CE1 4.37Å; K724-Y726 WeakPolarHBondContact O-CD2 3.41Å; K724-Y726 PolarHBondContact O-N 3.28Å; Y726-W728 AromaticContact CD1-CE2 3.85Å; Y726-W728 AromaticContact CD1-CZ2 3.75Å; Y726-W728 HydrophobicContact CD1-CZ2 3.75Å; Y726-W728 AromaticContact CD1-NE1 3.62Å; Y726-W728 HydrophobicContact CD2-CZ2 4.14Å; Y726-W728 HydrophobicContact CE1-CZ2 4.25Å; Y726-W728 AromaticContact CG-CE2 3.81Å; Y726-W728 HydrophobicContact CG-CH2 4.41Å; Y726-W728 AromaticContact CG-CZ2 3.69Å; Y726-W728 HydrophobicContact CG-CZ2 3.69Å; Y726-W728 AromaticContact CG-NE1 3.92Å; Y726-W728 PolarHBondContact O-N 3.42Å; Y726-A729 WeakPolarHBondContact O-CB 3.43Å; Y726-A729 PolarHBondContact O-N 2.76Å; Y726-E811 HydrophobicContact CE2-CB 4.42Å; Y726-E811 HydrophobicContact CE2-CG 4.01Å; Y726-D812 PolarHBondContact OH-N 3.06Å; Y726-D812 VanDerWaalsContact OH-N 3.07Å
727	L	68.4	Low	72.5	Confident	176 Å²	176	100 Å²	100	92%	0.921	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	3	177.9	-61.4	174.1	0	0	0	115.5
728	W	75.9	Confident	73.1	Confident	42 Å²	42	102.7 Å²	102.7	16%	0.159	52%	0.516	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-4.6	178.2	54.8	-102.1	0	0	0	113.1	Y726 D730 K731 Y732 P734 P808 P809	Y726-W728 AromaticContact CD1-CE2 3.85Å; Y726-W728 AromaticContact CD1-CZ2 3.75Å; Y726-W728 HydrophobicContact CD1-CZ2 3.75Å; Y726-W728 AromaticContact CD1-NE1 3.62Å; Y726-W728 HydrophobicContact CD2-CZ2 4.14Å; Y726-W728 HydrophobicContact CE1-CZ2 4.25Å; Y726-W728 AromaticContact CG-CE2 3.81Å; Y726-W728 HydrophobicContact CG-CH2 4.41Å; Y726-W728 AromaticContact CG-CZ2 3.69Å; Y726-W728 HydrophobicContact CG-CZ2 3.69Å; Y726-W728 AromaticContact CG-NE1 3.92Å; Y726-W728 PolarHBondContact O-N 3.42Å; W728-D730 PolarHBondContact O-N 3.41Å; W728-K731 PolarHBondContact O-N 2.98Å; W728-Y732 WeakPolarHBondContact CZ3-O 3.34Å; W728-Y732 PolarHBondContact O-N 3.03Å; W728-P734 HydrophobicContact CH2-CB 3.94Å; W728-P734 HydrophobicContact CH2-CG 4.12Å; W728-P734 HydrophobicContact CZ3-CB 4.05Å; W728-P734 HydrophobicContact CZ3-CG 3.86Å; W728-P808 HydrophobicContact CB-CG 4.22Å; W728-P808 HydrophobicContact CD2-CB 3.85Å; W728-P808 HydrophobicContact CD2-CG 3.93Å; W728-P808 HydrophobicContact CE3-CB 4.13Å; W728-P808 HydrophobicContact CG-CB 4.06Å; W728-P808 HydrophobicContact CG-CG 3.69Å; W728-P809 VanDerWaalsContact CH2-O 3.22Å; W728-P809 WeakPolarHBondContact CH2-O 3.47Å; W728-P809 HydrophobicContact CZ3-CB 4.34Å
729	A	71.8	Confident	73.6	Confident	33 Å²	33	101.1 Å²	101.1	27%	0.273	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-34	-175.1	0	0	0	0	0	112.8	Y726 K731 Y732 P734	Y726-A729 WeakPolarHBondContact O-CB 3.43Å; Y726-A729 PolarHBondContact O-N 2.76Å; A729-K731 PolarHBondContact O-N 3Å; A729-Y732 WeakPolarHBondContact CA-O 3.47Å; A729-Y732 CarbonylContact O-C 3.52Å; A729-Y732 VanDerWaalsContact O-O 3.11Å; A729-P734 HydrophobicContact CB-CG 3.82Å
730	D	68.6	Low	73.9	Confident	158 Å²	158	99.8 Å²	99.8	85%	0.845	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-25.6	178.5	-42.7	-41.2	0	0	0	112.4	W728	W728-D730 PolarHBondContact O-N 3.41Å
731	K	68.6	Low	74.6	Confident	174 Å²	174	94.9 Å²	94.9	76%	0.757	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-30.6	179.7	-61.7	-172.5	179.9	-175.4	0	112.7	W728 A729	W728-K731 PolarHBondContact O-N 2.98Å; A729-K731 PolarHBondContact O-N 3Å
732	Y	76.5	Confident	75.6	Confident	109 Å²	109	93.6 Å²	93.6	43%	0.427	46%	0.459	S	S	.	.	S	Bend	trans	-140	120.6	179.6	-51.9	-74.4	0	0	0	110.6	W728 A729 P734 I780 P808	W728-Y732 WeakPolarHBondContact CZ3-O 3.34Å; W728-Y732 PolarHBondContact O-N 3.03Å; A729-Y732 WeakPolarHBondContact CA-O 3.47Å; A729-Y732 CarbonylContact O-C 3.52Å; A729-Y732 VanDerWaalsContact O-O 3.11Å; Y732-P734 VanDerWaalsContact O-CD 3.27Å; Y732-P734 WeakPolarHBondContact O-CD 3.44Å; Y732-P734 VanDerWaalsContact O-N 3.15Å; Y732-I780 HydrophobicContact CD1-CD1 3.68Å; Y732-I780 HydrophobicContact CD2-CD1 3.78Å; Y732-I780 HydrophobicContact CE1-CD1 3.63Å; Y732-I780 HydrophobicContact CE2-CD1 3.72Å; Y732-I780 HydrophobicContact CG-CD1 3.75Å; Y732-P808 HydrophobicContact CD2-CB 4.34Å
733	R	76.6	Confident	77.6	Confident	220 Å²	220	89.1 Å²	89.1	83%	0.83	43%	0.427	S	S	*	.			trans	-53.2	118.7	175.1	-67	-175.2	-179	-179.5	0.7	110.2
734	P	82.8	Confident	79.2	Confident	51 Å²	51	86.8 Å²	86.8	33%	0.331	39%	0.393	S	S	.	.			trans	-57.3	140.3	177.8	-26.6	35.8	0	0	0	112.7	W728 A729 Y732 E811	W728-P734 HydrophobicContact CH2-CB 3.94Å; W728-P734 HydrophobicContact CH2-CG 4.12Å; W728-P734 HydrophobicContact CZ3-CB 4.05Å; W728-P734 HydrophobicContact CZ3-CG 3.86Å; A729-P734 HydrophobicContact CB-CG 3.82Å; Y732-P734 VanDerWaalsContact O-CD 3.27Å; Y732-P734 WeakPolarHBondContact O-CD 3.44Å; Y732-P734 VanDerWaalsContact O-N 3.15Å; P734-E811 HydrophobicContact CB-CG 4.06Å
735	R	83.6	Confident	80.6	Confident	126 Å²	126	83.6 Å²	83.6	48%	0.475	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-130.8	141.6	178.8	-64.1	-178.2	-179	-165.6	-4.3	110.4	D778 P809 Y810 E811	R735-D778 IonicContact CZ-OD2 3.31Å; R735-D778 IonicContact NH1-OD2 2.84Å; R735-D778 PolarHBondContact NH1-OD2 3.29Å; R735-P809 PolarHBondContact N-O 2.91Å; R735-Y810 HydrophobicContact CB-CD1 4.06Å; R735-Y810 HydrophobicContact CB-CE1 4.1Å; R735-Y810 CarbonylContact O-C 3.58Å; R735-Y810 VanDerWaalsContact O-CA 3.29Å; R735-Y810 WeakPolarHBondContact O-CA 3.33Å; R735-Y810 WeakPolarHBondContact O-CD1 3.31Å; R735-E811 PolarHBondContact O-N 3.17Å
736	K	87.2	Confident	81.9	Confident	129 Å²	129	74.9 Å²	74.9	56%	0.561	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-80.2	130.4	165.4	-70.5	-172.1	175.2	-172	0	110.2	E811	K736-E811 WeakPolarHBondContact CE-OE2 3.26Å; K736-E811 HydrophobicContact CG-CB 4.42Å; K736-E811 WeakPolarHBondContact CG-OE2 3.5Å
737	P	88.2	Confident	82.5	Confident	4 Å²	4	76.5 Å²	76.5	3%	0.026	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-67.3	137.9	174.6	28.9	-35.3	0	0	0	110.6	I774 F775 Y776 Y810 I813	P737-I774 HydrophobicContact CB-CG2 3.92Å; P737-I774 HydrophobicContact CG-CG2 4.14Å; P737-F775 VanDerWaalsContact CB-O 3.23Å; P737-F775 WeakPolarHBondContact CB-O 3.49Å; P737-Y776 HydrophobicContact CB-CD1 3.66Å; P737-Y776 HydrophobicContact CB-CE1 3.36Å; P737-Y776 HydrophobicContact CG-CD1 4.34Å; P737-Y776 HydrophobicContact CG-CE1 3.57Å; P737-Y810 HydrophobicContact CB-CD1 3.81Å; P737-Y810 HydrophobicContact CB-CE1 4.23Å; P737-Y810 HydrophobicContact CB-CG 4.39Å; P737-Y810 HydrophobicContact CG-CD1 4.44Å; P737-I813 HydrophobicContact CG-CD1 3.96Å; P737-I813 HydrophobicContact CG-CG1 4.11Å; P737-I813 HydrophobicContact CG-CG2 3.81Å
738	R	86.9	Confident	83.2	Confident	141 Å²	141	70.4 Å²	70.4	53%	0.532	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	153.9	173	-58.1	176.8	75.7	166.3	3	108.8	E697 F775	E697-R738 IonicContact OE1-CZ 2.7Å; E697-R738 IonicContact OE1-NE 2.67Å; E697-R738 IonicContact OE1-NH1 2.86Å; E697-R738 PolarHBondContact OE1-NH1 3.31Å; E697-R738 IonicContact OE2-NH1 2.71Å; E697-R738 PolarHBondContact OE2-NH1 2.82Å; R738-F775 HydrophobicContact CB-CB 4.18Å; R738-F775 HydrophobicContact CB-CD2 4.37Å; R738-F775 HydrophobicContact CB-CG 4.37Å; R738-F775 WeakPolarHBondContact O-CB 3.47Å; R738-F775 VanDerWaalsContact O-CD2 3.25Å; R738-F775 WeakPolarHBondContact O-CD2 3.44Å; R738-F775 PolarHBondContact O-N 2.94Å
739	F	88.6	Confident	83.5	Confident	48 Å²	48	73.2 Å²	73.2	21%	0.211	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	158.7	175.6	62	-96.8	0	0	0	112.8	E718 N741 N773 I774 I813 F815	E718-F739 HydrophobicContact CG-CE1 4.04Å; E718-F739 HydrophobicContact CG-CZ 3.87Å; E718-F739 VanDerWaalsContact OE1-CE1 3.29Å; E718-F739 WeakPolarHBondContact OE1-CE1 3.4Å; E718-F739 VanDerWaalsContact OE1-CZ 3.26Å; E718-F739 WeakPolarHBondContact OE1-CZ 3.29Å; F739-N741 WeakPolarHBondContact CD2-ND2 3.39Å; F739-N773 CarbonylContact C-O 3.44Å; F739-N773 VanDerWaalsContact CA-O 3.25Å; F739-N773 WeakPolarHBondContact CA-O 3.36Å; F739-N773 WeakPolarHBondContact CB-O 3.42Å; F739-I774 HydrophobicContact CB-CB 4.4Å; F739-I774 HydrophobicContact CB-CG1 3.99Å; F739-I774 HydrophobicContact CB-CG2 4.43Å; F739-I813 HydrophobicContact CD1-CD1 3.98Å; F739-F815 AromaticContact CD1-CZ 3.85Å; F739-F815 HydrophobicContact CD1-CZ 3.85Å; F739-F815 HydrophobicContact CD2-CE1 4.15Å; F739-F815 AromaticContact CD2-CZ 3.93Å; F739-F815 HydrophobicContact CD2-CZ 3.93Å; F739-F815 HydrophobicContact CE1-CE1 4.12Å; F739-F815 AromaticContact CE1-CZ 3.84Å; F739-F815 HydrophobicContact CE1-CZ 3.84Å; F739-F815 AromaticContact CE2-CE1 3.73Å; F739-F815 HydrophobicContact CE2-CE1 3.73Å; F739-F815 AromaticContact CE2-CZ 3.93Å; F739-F815 HydrophobicContact CE2-CZ 3.93Å; F739-F815 AromaticContact CG-CZ 3.89Å; F739-F815 HydrophobicContact CG-CZ 3.89Å; F739-F815 AromaticContact CZ-CE1 3.72Å; F739-F815 HydrophobicContact CZ-CE1 3.72Å; F739-F815 AromaticContact CZ-CZ 3.89Å; F739-F815 HydrophobicContact CZ-CZ 3.89Å
740	F	87.3	Confident	84	Confident	14 Å²	14	74.8 Å²	74.8	6%	0.061	33%	0.33	C	S	.	.			trans	-140.3	90.7	173.7	-174.1	-99.1	0	0	0	109.7	A704 K705 Q714 R742 N773 F775	A704-F740 HydrophobicContact CB-CD1 3.57Å; A704-F740 HydrophobicContact CB-CE1 3.96Å; A704-F740 HydrophobicContact CB-CG 4.36Å; A704-F740 WeakPolarHBondContact O-CE1 3.05Å; K705-F740 HydrophobicContact CB-CZ 4.37Å; Q714-F740 HydrophobicContact CG-CE2 4.3Å; F740-R742 HydrophobicContact CE1-CG 4.12Å; F740-N773 PolarHBondContact N-O 3.39Å; F740-N773 WeakPolarHBondContact O-CB 3.33Å; F740-N773 PolarHBondContact O-ND2 3.43Å; F740-F775 HydrophobicContact CB-CE2 4.15Å
741	N	89.2	Confident	84.6	Confident	2 Å²	2	75.3 Å²	75.3	1%	0.011	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	138.7	-173.2	-53.2	-31.7	0	0	0	111	F715 F739 K771 F772 N773 F815	F715-N741 HydrophobicContact CD1-CB 4.39Å; F715-N741 PolarHBondContact N-O 2.96Å; F715-N741 WeakPolarHBondContact O-CB 3.35Å; F739-N741 WeakPolarHBondContact CD2-ND2 3.39Å; N741-K771 CarbonylContact C-O 3.6Å; N741-K771 WeakPolarHBondContact CA-O 3.22Å; N741-F772 HydrophobicContact CB-CD1 4.07Å; N741-F772 HydrophobicContact CB-CE1 4.37Å; N741-F772 VanDerWaalsContact CG-CD1 3.4Å; N741-F772 WeakPolarHBondContact ND2-CD1 3.26Å; N741-F772 VanDerWaalsContact OD1-CA 3.3Å; N741-F772 WeakPolarHBondContact OD1-CA 3.29Å; N741-N773 PolarHBondContact OD1-N 3.11Å; N741-N773 VanDerWaalsContact OD1-N 3.15Å; N741-F815 VanDerWaalsContact ND2-CE1 3.31Å; N741-F815 WeakPolarHBondContact ND2-CE1 3.32Å; N741-F815 WeakPolarHBondContact ND2-CZ 3.48Å
742	R	89.8	Confident	85.3	Confident	19 Å²	19	73.9 Å²	73.9	7%	0.072	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	134.8	175.9	-74.6	156.2	60.9	150.4	-0.6	109.6	A704 E706 G707 E712 A713 F740 K771	A704-R742 PolarHBondContact O-NH1 3.45Å; E706-R742 PolarHBondContact O-NH1 3.44Å; G707-R742 PolarHBondContact O-NH2 2.85Å; E712-R742 VanDerWaalsContact CD-NH2 3.29Å; E712-R742 IonicContact OE1-NH2 3.2Å; E712-R742 IonicContact OE2-CZ 2.82Å; E712-R742 VanDerWaalsContact OE2-CZ 3.23Å; E712-R742 IonicContact OE2-NE 3.1Å; E712-R742 PolarHBondContact OE2-NE 2.83Å; E712-R742 IonicContact OE2-NH2 2.65Å; E712-R742 PolarHBondContact OE2-NH2 2.86Å; A713-R742 CarbonylContact O-C 3.58Å; A713-R742 VanDerWaalsContact O-CA 3.29Å; A713-R742 WeakPolarHBondContact O-CA 3.18Å; F740-R742 HydrophobicContact CE1-CG 4.12Å; R742-K771 HydrophobicContact CB-CB 4.24Å; R742-K771 PolarHBondContact N-O 3.18Å; R742-K771 PolarHBondContact O-N 3.46Å
743	V	90.8	Very high	85.7	Confident	12 Å²	12	70 Å²	70	7%	0.073	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	126.8	171.4	173.2	0	0	0	0	108.5	E712 A713 F715 T745 V767 Y770	E712-V743 WeakPolarHBondContact CA-O 3.37Å; A713-V743 PolarHBondContact N-O 2.92Å; A713-V743 PolarHBondContact O-N 3.34Å; F715-V743 HydrophobicContact CB-CB 4.3Å; F715-V743 HydrophobicContact CB-CG2 3.39Å; F715-V743 HydrophobicContact CD1-CG2 4.02Å; F715-V743 HydrophobicContact CD2-CG2 3.8Å; F715-V743 HydrophobicContact CG-CG2 3.47Å; F715-V743 VanDerWaalsContact CG-CG2 3.47Å; V743-T745 HydrophobicContact CG1-CG2 3.75Å; V743-V767 HydrophobicContact CG1-CB 4.47Å; V743-V767 HydrophobicContact CG1-CG1 3.71Å; V743-V767 HydrophobicContact CG1-CG2 4.06Å; V743-Y770 HydrophobicContact CG2-CD1 3.61Å; V743-Y770 HydrophobicContact CG2-CE1 3.57Å; V743-Y770 HydrophobicContact CG2-CG 4.49Å
744	H	89.1	Confident	86.1	Confident	37 Å²	37	65.1 Å²	65.1	17%	0.171	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	115.4	174.2	-167.8	53.5	0	0	0	109.5	D711 E712 Q768 G769 H844	D711-H744 CarbonylContact O-C 3.59Å; D711-H744 WeakPolarHBondContact O-CA 3.5Å; D711-H744 PolarHBondContact O-ND1 2.9Å; E712-H744 HydrophobicContact CG-CB 4.32Å; E712-H744 WeakPolarHBondContact CG-ND1 3.43Å; H744-Q768 PolarHBondContact O-N 3.12Å; H744-G769 PolarHBondContact N-O 3.03Å; H744-G769 PolarHBondContact O-N 2.8Å; H744-H844 AromaticContact CD2-CE1 3.39Å; H744-H844 PolarHBondContact CD2-CE1 3.31Å; H744-H844 AromaticContact CD2-ND1 3.72Å; H744-H844 AromaticContact CG-CE1 3.86Å
745	T	89.5	Confident	86.3	Confident	35 Å²	35	67.3 Å²	67.3	22%	0.215	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	131.2	-178.8	66	0	0	0	0	110	D711 V743 I766	D711-T745 WeakPolarHBondContact CB-O 3.24Å; D711-T745 PolarHBondContact O-N 2.81Å; V743-T745 HydrophobicContact CG1-CG2 3.75Å; T745-I766 WeakPolarHBondContact CA-O 3.23Å
746	G	86.9	Confident	86.2	Confident	6 Å²	6	66.4 Å²	66.4	6%	0.062	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	158.4	179	0	0	0	0	0	111.6	I766 Q768	G746-I766 PolarHBondContact N-O 3.17Å; G746-I766 VanDerWaalsContact O-CG1 3.23Å; G746-I766 WeakPolarHBondContact O-CG1 3.34Å; G746-I766 PolarHBondContact O-N 3.46Å; G746-I766 VanDerWaalsContact O-O 3.11Å; G746-Q768 PolarHBondContact O-NE2 2.9Å
747	F	85.4	Confident	86.3	Confident	70 Å²	70	63.2 Å²	63.2	31%	0.307	29%	0.287	S	S	.	.			trans	-84.7	156	171.8	44.1	-99.3	0	0	0	111.3	W749 P762 P763 K765 Q768	F747-W749 AromaticContact CD2-NE1 3.78Å; F747-W749 AromaticContact CE2-NE1 3.48Å; F747-P762 HydrophobicContact CD1-CB 4.17Å; F747-P762 HydrophobicContact CE1-CB 3.92Å; F747-P762 HydrophobicContact CE1-CG 4.49Å; F747-P762 HydrophobicContact CZ-CB 4.31Å; F747-P763 HydrophobicContact CB-CB 3.81Å; F747-P763 HydrophobicContact CB-CG 3.97Å; F747-P763 HydrophobicContact CG-CG 4.38Å; F747-K765 HydrophobicContact CD1-CG 4.28Å; F747-Q768 PolarHBondContact O-NE2 2.79Å
748	E	83.4	Confident	86.2	Confident	48 Å²	48	68.8 Å²	68.8	22%	0.224	32%	0.317	C	S	.	.			trans	-114.4	123.5	168.2	177	162.4	-127.4	0	0	109.6	N750 N753 R847	E748-N750 HydrophobicContact CG-CB 4.49Å; E748-N750 PolarHBondContact O-N 3.19Å; E748-N753 PolarHBondContact O-ND2 2.82Å; E748-R847 IonicContact OE1-CZ 3.57Å; E748-R847 IonicContact OE1-NE 2.81Å; E748-R847 PolarHBondContact OE1-NE 3.31Å; E748-R847 IonicContact OE1-NH2 3.87Å; E748-R847 PolarHBondContact OE1-NH2 3.43Å
749	W	82.8	Confident	86	Confident	102 Å²	102	71 Å²	71	39%	0.386	33%	0.331	S	S	.	.			trans	-74.6	65.5	173	-72.7	118	0	0	0	111.4	F747 N753 Q754 Y757 P763	F747-W749 AromaticContact CD2-NE1 3.78Å; F747-W749 AromaticContact CE2-NE1 3.48Å; W749-N753 HydrophobicContact CE3-CB 4.38Å; W749-Q754 HydrophobicContact CB-CG 4.25Å; W749-Q754 HydrophobicContact CE3-CG 3.98Å; W749-Q754 PolarHBondContact O-NE2 3.06Å; W749-Y757 WeakPolarHBondContact CH2-O 3.41Å; W749-Y757 VanDerWaalsContact CZ3-O 3.3Å; W749-Y757 WeakPolarHBondContact CZ3-O 2.84Å; W749-P763 HydrophobicContact CD2-CG 4.48Å; W749-P763 HydrophobicContact CE3-CG 4.05Å; W749-P763 HydrophobicContact CH2-CG 4.04Å; W749-P763 HydrophobicContact CZ2-CG 4.44Å; W749-P763 HydrophobicContact CZ3-CG 3.82Å
750	N	82.6	Confident	85.9	Confident	66 Å²	66	76 Å²	76	35%	0.353	36%	0.36	S	S	.	.			trans	-72.5	167.1	166.8	74.4	44.1	0	0	0	110.5	E748 Y752 N753 Q754	E748-N750 HydrophobicContact CG-CB 4.49Å; E748-N750 PolarHBondContact O-N 3.19Å; N750-Y752 PolarHBondContact O-N 2.7Å; N750-Y752 WeakPolarHBondContact OD1-CA 3.13Å; N750-Y752 WeakPolarHBondContact OD1-CB 3.32Å; N750-Y752 PolarHBondContact OD1-N 3.48Å; N750-N753 PolarHBondContact ND2-ND2 3.06Å; N750-N753 PolarHBondContact O-N 3.41Å; N750-N753 PolarHBondContact OD1-N 2.91Å; N750-Q754 WeakPolarHBondContact O-CG 3.4Å; N750-Q754 PolarHBondContact O-N 2.85Å
751	K	80.3	Confident	85.8	Confident	168 Å²	168	80.3 Å²	80.3	73%	0.73	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-23.9	-174	-174.2	168.5	-179.3	173.6	0	114.5
752	Y	83	Confident	85.6	Confident	145 Å²	145	82.9 Å²	82.9	57%	0.569	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-41.9	175.8	168.6	-93.6	0	0	0	111.3	N750 Q754 T755 H756	N750-Y752 PolarHBondContact O-N 2.7Å; N750-Y752 WeakPolarHBondContact OD1-CA 3.13Å; N750-Y752 WeakPolarHBondContact OD1-CB 3.32Å; N750-Y752 PolarHBondContact OD1-N 3.48Å; Y752-Q754 VanDerWaalsContact C-N 3.29Å; Y752-Q754 PolarHBondContact O-N 3.33Å; Y752-T755 PolarHBondContact O-N 3.04Å; Y752-T755 PolarHBondContact O-OG1 2.78Å; Y752-H756 AromaticContact CD2-CD2 3.61Å; Y752-H756 AromaticContact CD2-NE2 3.77Å; Y752-H756 AromaticContact CE1-CD2 3.99Å; Y752-H756 AromaticContact CE2-CD2 3.27Å; Y752-H756 WeakPolarHBondContact CE2-CD2 3.43Å; Y752-H756 AromaticContact CE2-NE2 3.3Å; Y752-H756 VanDerWaalsContact CE2-NE2 3.3Å; Y752-H756 WeakPolarHBondContact CE2-NE2 3.4Å; Y752-H756 AromaticContact CZ-CD2 3.48Å; Y752-H756 VanDerWaalsContact CZ-CD2 3.48Å; Y752-H756 AromaticContact CZ-NE2 3.88Å; Y752-H756 PolarHBondContact O-CD2 3.37Å; Y752-H756 PolarHBondContact O-N 2.83Å
753	N	86.3	Confident	85.5	Confident	27 Å²	27	82.1 Å²	82.1	14%	0.144	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-63.9	-37.4	175.8	-74	-2.6	0	0	0	111.4	E748 W749 N750 T755 H756 Y757 P763	E748-N753 PolarHBondContact O-ND2 2.82Å; W749-N753 HydrophobicContact CE3-CB 4.38Å; N750-N753 PolarHBondContact ND2-ND2 3.06Å; N750-N753 PolarHBondContact O-N 3.41Å; N750-N753 PolarHBondContact OD1-N 2.91Å; N753-T755 PolarHBondContact O-N 2.98Å; N753-T755 VanDerWaalsContact O-N 3.14Å; N753-H756 PolarHBondContact O-N 3.21Å; N753-Y757 HydrophobicContact CB-CD2 4.19Å; N753-Y757 PolarHBondContact O-N 2.91Å; N753-P763 HydrophobicContact CB-CB 4.33Å; N753-P763 HydrophobicContact CB-CG 3.87Å
754	Q	84.8	Confident	85.4	Confident	118 Å²	118	85.7 Å²	85.7	55%	0.551	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-63.8	-9.1	173	-69.5	174.3	25.9	0	0	114.8	W749 N750 Y752	W749-Q754 HydrophobicContact CB-CG 4.25Å; W749-Q754 HydrophobicContact CE3-CG 3.98Å; W749-Q754 PolarHBondContact O-NE2 3.06Å; N750-Q754 WeakPolarHBondContact O-CG 3.4Å; N750-Q754 PolarHBondContact O-N 2.85Å; Y752-Q754 VanDerWaalsContact C-N 3.29Å; Y752-Q754 PolarHBondContact O-N 3.33Å
755	T	86.3	Confident	85.4	Confident	97 Å²	97	88.5 Å²	88.5	60%	0.595	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-112.7	0.4	177.3	54.7	0	0	0	0	114	Y752 N753	Y752-T755 PolarHBondContact O-N 3.04Å; Y752-T755 PolarHBondContact O-OG1 2.78Å; N753-T755 PolarHBondContact O-N 2.98Å; N753-T755 VanDerWaalsContact O-N 3.14Å
756	H	81.4	Confident	85.3	Confident	107 Å²	107	90.4 Å²	90.4	50%	0.495	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.9	-8.9	-178.1	-69.1	-58.8	0	0	0	114.4	Y752 N753	Y752-H756 AromaticContact CD2-CD2 3.61Å; Y752-H756 AromaticContact CD2-NE2 3.77Å; Y752-H756 AromaticContact CE1-CD2 3.99Å; Y752-H756 AromaticContact CE2-CD2 3.27Å; Y752-H756 WeakPolarHBondContact CE2-CD2 3.43Å; Y752-H756 AromaticContact CE2-NE2 3.3Å; Y752-H756 VanDerWaalsContact CE2-NE2 3.3Å; Y752-H756 WeakPolarHBondContact CE2-NE2 3.4Å; Y752-H756 AromaticContact CZ-CD2 3.48Å; Y752-H756 VanDerWaalsContact CZ-CD2 3.48Å; Y752-H756 AromaticContact CZ-NE2 3.88Å; Y752-H756 PolarHBondContact O-CD2 3.37Å; Y752-H756 PolarHBondContact O-N 2.83Å; N753-H756 PolarHBondContact O-N 3.21Å
757	Y	89.3	Confident	85.5	Confident	62 Å²	62	91.8 Å²	91.8	24%	0.243	45%	0.448	C	S	.	.			trans	-138.3	145.5	-177.6	-60	-73.6	0	0	0	109.9	W749 N753 N761 P763	W749-Y757 WeakPolarHBondContact CH2-O 3.41Å; W749-Y757 VanDerWaalsContact CZ3-O 3.3Å; W749-Y757 WeakPolarHBondContact CZ3-O 2.84Å; N753-Y757 HydrophobicContact CB-CD2 4.19Å; N753-Y757 PolarHBondContact O-N 2.91Å; Y757-N761 WeakPolarHBondContact CA-O 3.46Å; Y757-N761 VanDerWaalsContact CB-O 3.29Å; Y757-N761 WeakPolarHBondContact CB-O 3.4Å; Y757-P763 HydrophobicContact CD1-CB 4.46Å; Y757-P763 HydrophobicContact CD2-CB 3.62Å; Y757-P763 HydrophobicContact CD2-CG 3.73Å; Y757-P763 HydrophobicContact CE2-CB 3.99Å; Y757-P763 HydrophobicContact CG-CB 3.88Å; Y757-P763 HydrophobicContact CG-CG 3.81Å
758	D	85.9	Confident	85.8	Confident	121 Å²	121	90 Å²	90	65%	0.647	44%	0.44	S	S	*	.	B	Isolated β-bridge	trans	-121.6	177.2	-178	-77.2	-57.9	0	0	0	110.3	D760 N761 P762	D758-D760 VanDerWaalsContact C-N 3.28Å; D758-D760 PolarHBondContact O-N 3.5Å; D758-N761 PolarHBondContact N-O 2.83Å; D758-N761 VanDerWaalsContact N-O 3.1Å; D758-N761 CarbonylContact O-C 3.55Å; D758-N761 PolarHBondContact O-N 3.39Å; D758-N761 VanDerWaalsContact O-O 3.13Å; D758-P762 WeakPolarHBondContact O-CA 3.46Å
759	F	84.1	Confident	86.2	Confident	188 Å²	188	87.7 Å²	87.7	83%	0.825	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-38.9	176.8	-175.8	-94.1	0	0	0	112.7
760	D	86.3	Confident	86.7	Confident	153 Å²	153	83.3 Å²	83.3	82%	0.818	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-11.4	-180	-62.8	-36.5	0	0	0	113.5	D758	D758-D760 VanDerWaalsContact C-N 3.28Å; D758-D760 PolarHBondContact O-N 3.5Å
761	N	84.6	Confident	87.2	Confident	103 Å²	103	81.9 Å²	81.9	55%	0.551	40%	0.404	S	S	*	.	B	Isolated β-bridge	trans	-140.9	73.9	175.1	-178.7	44.1	0	0	0	109.6	Y757 D758	Y757-N761 WeakPolarHBondContact CA-O 3.46Å; Y757-N761 VanDerWaalsContact CB-O 3.29Å; Y757-N761 WeakPolarHBondContact CB-O 3.4Å; D758-N761 PolarHBondContact N-O 2.83Å; D758-N761 VanDerWaalsContact N-O 3.1Å; D758-N761 CarbonylContact O-C 3.55Å; D758-N761 PolarHBondContact O-N 3.39Å; D758-N761 VanDerWaalsContact O-O 3.13Å
762	P	86.1	Confident	87.8	Confident	56 Å²	56	73.9 Å²	73.9	36%	0.364	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-72.1	161.3	-172.2	29.2	-36.1	0	0	0	112.6	F747 D758	F747-P762 HydrophobicContact CD1-CB 4.17Å; F747-P762 HydrophobicContact CE1-CB 3.92Å; F747-P762 HydrophobicContact CE1-CG 4.49Å; F747-P762 HydrophobicContact CZ-CB 4.31Å; D758-P762 WeakPolarHBondContact O-CA 3.46Å
763	P	87.8	Confident	88.2	Confident	4 Å²	4	67.3 Å²	67.3	3%	0.026	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-62.8	152.7	-179.6	-14.1	25.3	0	0	0	112	F747 W749 N753 Y757 K765	F747-P763 HydrophobicContact CB-CB 3.81Å; F747-P763 HydrophobicContact CB-CG 3.97Å; F747-P763 HydrophobicContact CG-CG 4.38Å; W749-P763 HydrophobicContact CD2-CG 4.48Å; W749-P763 HydrophobicContact CE3-CG 4.05Å; W749-P763 HydrophobicContact CH2-CG 4.04Å; W749-P763 HydrophobicContact CZ2-CG 4.44Å; W749-P763 HydrophobicContact CZ3-CG 3.82Å; N753-P763 HydrophobicContact CB-CB 4.33Å; N753-P763 HydrophobicContact CB-CG 3.87Å; Y757-P763 HydrophobicContact CD1-CB 4.46Å; Y757-P763 HydrophobicContact CD2-CB 3.62Å; Y757-P763 HydrophobicContact CD2-CG 3.73Å; Y757-P763 HydrophobicContact CE2-CB 3.99Å; Y757-P763 HydrophobicContact CG-CB 3.88Å; Y757-P763 HydrophobicContact CG-CG 3.81Å; P763-K765 PolarHBondContact O-N 3.04Å
764	P	88.1	Confident	88.5	Confident	86 Å²	86	66 Å²	66	56%	0.558	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-51.3	131.9	171.9	-27.5	35	0	0	0	112	I766	P764-I766 PolarHBondContact O-N 3.01Å
765	K	88.9	Confident	88.7	Confident	96 Å²	96	61.1 Å²	61.1	42%	0.417	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-66.9	126.8	176	-65.7	-164.6	-177.5	-161.5	0	109.7	N710 D711 F747 P763	N710-K765 PolarHBondContact O-NZ 3.33Å; D711-K765 IonicContact OD1-NZ 3.39Å; D711-K765 PolarHBondContact OD1-NZ 2.83Å; F747-K765 HydrophobicContact CD1-CG 4.28Å; P763-K765 PolarHBondContact O-N 3.04Å
766	I	88.1	Confident	88.9	Confident	75 Å²	75	56.6 Å²	56.6	39%	0.385	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	158.5	171.6	58.3	168.9	0	0	0	110.1	T745 G746 P764 Q768	T745-I766 WeakPolarHBondContact CA-O 3.23Å; G746-I766 PolarHBondContact N-O 3.17Å; G746-I766 VanDerWaalsContact O-CG1 3.23Å; G746-I766 WeakPolarHBondContact O-CG1 3.34Å; G746-I766 PolarHBondContact O-N 3.46Å; G746-I766 VanDerWaalsContact O-O 3.11Å; P764-I766 PolarHBondContact O-N 3.01Å; I766-Q768 HydrophobicContact CG1-CG 4.41Å; I766-Q768 PolarHBondContact O-N 3.07Å
767	V	91.1	Very high	89.1	Confident	36 Å²	36	54.5 Å²	54.5	22%	0.218	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	122.9	172.4	-174.6	0	0	0	0	109.4	V743 Y770 V818 F845	V743-V767 HydrophobicContact CG1-CB 4.47Å; V743-V767 HydrophobicContact CG1-CG1 3.71Å; V743-V767 HydrophobicContact CG1-CG2 4.06Å; V767-Y770 HydrophobicContact CG1-CD2 4.17Å; V767-Y770 HydrophobicContact CG1-CE2 3.54Å; V767-V818 HydrophobicContact CB-CG2 4.28Å; V767-V818 HydrophobicContact CG2-CG2 4.35Å; V767-F845 HydrophobicContact CG1-CE2 3.99Å
768	Q	90.2	Very high	88.8	Confident	32 Å²	32	55.2 Å²	55.2	15%	0.15	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-12	179.6	-61.8	-166.8	10.7	0	0	113	H744 G746 F747 I766 H844 F845	H744-Q768 PolarHBondContact O-N 3.12Å; G746-Q768 PolarHBondContact O-NE2 2.9Å; F747-Q768 PolarHBondContact O-NE2 2.79Å; I766-Q768 HydrophobicContact CG1-CG 4.41Å; I766-Q768 PolarHBondContact O-N 3.07Å; Q768-H844 CarbonylContact O-C 3.57Å; Q768-H844 WeakPolarHBondContact O-CA 3.5Å; Q768-H844 PolarHBondContact O-ND1 3.4Å; Q768-F845 PolarHBondContact O-N 3.18Å
769	G	92.5	Very high	88.8	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.2	172.1	178.9	0	0	0	0	0	113.4	H744 F843	H744-G769 PolarHBondContact N-O 3.03Å; H744-G769 PolarHBondContact O-N 2.8Å; G769-F843 CarbonylContact C-O 3.51Å; G769-F843 WeakPolarHBondContact CA-O 3.01Å
770	Y	93.7	Very high	88.7	Confident	10 Å²	10	44.3 Å²	44.3	4%	0.039	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	148.3	177.9	-67.7	-105.6	0	0	0	110.1	F715 V743 V767 F772 I817 V818 W842 F843 F845	F715-Y770 HydrophobicContact CE1-CE1 4.23Å; F715-Y770 HydrophobicContact CZ-CE1 4.35Å; V743-Y770 HydrophobicContact CG2-CD1 3.61Å; V743-Y770 HydrophobicContact CG2-CE1 3.57Å; V743-Y770 HydrophobicContact CG2-CG 4.49Å; V767-Y770 HydrophobicContact CG1-CD2 4.17Å; V767-Y770 HydrophobicContact CG1-CE2 3.54Å; Y770-F772 VanDerWaalsContact CB-CE2 3.41Å; Y770-F772 AromaticContact CD1-CE2 3.91Å; Y770-F772 HydrophobicContact CD1-CE2 3.91Å; Y770-F772 AromaticContact CD1-CZ 3.74Å; Y770-F772 HydrophobicContact CD1-CZ 3.74Å; Y770-F772 AromaticContact CG-CE2 3.89Å; Y770-F772 HydrophobicContact CG-CE2 3.89Å; Y770-F772 HydrophobicContact CG-CZ 4.22Å; Y770-I817 HydrophobicContact CD1-CG2 3.96Å; Y770-I817 HydrophobicContact CD2-CB 4.48Å; Y770-I817 HydrophobicContact CE1-CB 4.07Å; Y770-I817 HydrophobicContact CE1-CG2 3.69Å; Y770-I817 HydrophobicContact CE2-CB 3.92Å; Y770-I817 HydrophobicContact CE2-CG2 4.29Å; Y770-I817 HydrophobicContact CG-CG2 4.39Å; Y770-I817 WeakPolarHBondContact OH-CA 3.13Å; Y770-V818 PolarHBondContact OH-N 3.35Å; Y770-V818 VanDerWaalsContact OH-N 3.11Å; Y770-W842 WeakPolarHBondContact O-CA 3.37Å; Y770-F843 AromaticContact CD2-CE2 3.79Å; Y770-F843 HydrophobicContact CD2-CE2 3.79Å; Y770-F843 AromaticContact CD2-CZ 3.85Å; Y770-F843 HydrophobicContact CD2-CZ 3.85Å; Y770-F843 HydrophobicContact CG-CE2 4.36Å; Y770-F843 HydrophobicContact CG-CZ 4.04Å; Y770-F843 PolarHBondContact N-O 3.13Å; Y770-F843 PolarHBondContact O-N 2.96Å; Y770-F845 HydrophobicContact CD2-CE2 4.24Å; Y770-F845 HydrophobicContact CD2-CZ 4.02Å; Y770-F845 AromaticContact CE2-CE2 3.88Å; Y770-F845 HydrophobicContact CE2-CE2 3.88Å; Y770-F845 AromaticContact CE2-CZ 3.73Å; Y770-F845 HydrophobicContact CE2-CZ 3.73Å
771	K	92.8	Very high	88.5	Confident	35 Å²	35	42 Å²	42	15%	0.152	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	97.4	172.7	-60.4	-178.4	-174.6	170.1	0	108.6	E712 N741 R742 W842	E712-K771 IonicContact OE1-NZ 3.65Å; E712-K771 PolarHBondContact OE1-NZ 2.93Å; E712-K771 WeakPolarHBondContact OE2-CD 3.17Å; E712-K771 WeakPolarHBondContact OE2-CE 3.31Å; E712-K771 IonicContact OE2-NZ 3.66Å; E712-K771 PolarHBondContact OE2-NZ 2.85Å; N741-K771 CarbonylContact C-O 3.6Å; N741-K771 WeakPolarHBondContact CA-O 3.22Å; R742-K771 HydrophobicContact CB-CB 4.24Å; R742-K771 PolarHBondContact N-O 3.18Å; R742-K771 PolarHBondContact O-N 3.46Å; K771-W842 HydrophobicContact CB-CB 4.41Å; K771-W842 HydrophobicContact CB-CG 3.94Å; K771-W842 HydrophobicContact CD-CD2 4.34Å; K771-W842 HydrophobicContact CD-CG 4.39Å; K771-W842 HydrophobicContact CG-CB 4Å; K771-W842 HydrophobicContact CG-CD2 4.33Å; K771-W842 HydrophobicContact CG-CG 3.87Å
772	F	93.1	Very high	88.3	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	135	173.5	-65.1	-87.5	0	0	0	110.1	N741 Y770 I774 L802 F804 F815 I817 Q840 L841 F843	N741-F772 HydrophobicContact CB-CD1 4.07Å; N741-F772 HydrophobicContact CB-CE1 4.37Å; N741-F772 VanDerWaalsContact CG-CD1 3.4Å; N741-F772 WeakPolarHBondContact ND2-CD1 3.26Å; N741-F772 VanDerWaalsContact OD1-CA 3.3Å; N741-F772 WeakPolarHBondContact OD1-CA 3.29Å; Y770-F772 VanDerWaalsContact CB-CE2 3.41Å; Y770-F772 AromaticContact CD1-CE2 3.91Å; Y770-F772 HydrophobicContact CD1-CE2 3.91Å; Y770-F772 AromaticContact CD1-CZ 3.74Å; Y770-F772 HydrophobicContact CD1-CZ 3.74Å; Y770-F772 AromaticContact CG-CE2 3.89Å; Y770-F772 HydrophobicContact CG-CE2 3.89Å; Y770-F772 HydrophobicContact CG-CZ 4.22Å; F772-I774 HydrophobicContact CB-CD1 4.42Å; F772-L802 HydrophobicContact CD2-CD2 3.96Å; F772-L802 HydrophobicContact CE2-CD2 3.51Å; F772-L802 HydrophobicContact CZ-CD2 3.9Å; F772-F804 HydrophobicContact CB-CZ 4.05Å; F772-F804 AromaticContact CD1-CE2 3.83Å; F772-F804 HydrophobicContact CD1-CE2 3.83Å; F772-F804 AromaticContact CD1-CZ 3.98Å; F772-F804 HydrophobicContact CD1-CZ 3.98Å; F772-F804 HydrophobicContact CD2-CZ 4.14Å; F772-F804 HydrophobicContact CE1-CE2 4.22Å; F772-F804 HydrophobicContact CG-CE2 4.13Å; F772-F804 AromaticContact CG-CZ 3.78Å; F772-F804 HydrophobicContact CG-CZ 3.78Å; F772-F815 HydrophobicContact CD1-CD2 4.05Å; F772-F815 HydrophobicContact CD1-CE2 4.18Å; F772-F815 HydrophobicContact CE1-CB 3.96Å; F772-F815 HydrophobicContact CE1-CD1 4.33Å; F772-F815 AromaticContact CE1-CD2 3.62Å; F772-F815 HydrophobicContact CE1-CD2 3.62Å; F772-F815 HydrophobicContact CE1-CE2 4.15Å; F772-F815 AromaticContact CE1-CG 3.7Å; F772-F815 HydrophobicContact CE1-CG 3.7Å; F772-F815 HydrophobicContact CZ-CB 4.31Å; F772-I817 HydrophobicContact CE2-CG2 4.25Å; F772-I817 HydrophobicContact CZ-CG2 3.71Å; F772-Q840 WeakPolarHBondContact O-CA 3.19Å; F772-L841 HydrophobicContact CB-CB 4.35Å; F772-L841 PolarHBondContact N-O 3.5Å; F772-L841 PolarHBondContact O-N 2.65Å; F772-F843 HydrophobicContact CD2-CE1 4.08Å; F772-F843 AromaticContact CE2-CE1 3.89Å; F772-F843 HydrophobicContact CE2-CE1 3.89Å; F772-F843 HydrophobicContact CE2-CZ 4.16Å
773	N	91.6	Very high	88	Confident	8 Å²	8	53.7 Å²	53.7	4%	0.043	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	104.5	171.3	-49.7	-81.9	0	0	0	107.1	F700 F739 F740 N741 F839 W842	F700-N773 HydrophobicContact CZ-CB 4.47Å; F739-N773 CarbonylContact C-O 3.44Å; F739-N773 VanDerWaalsContact CA-O 3.25Å; F739-N773 WeakPolarHBondContact CA-O 3.36Å; F739-N773 WeakPolarHBondContact CB-O 3.42Å; F740-N773 PolarHBondContact N-O 3.39Å; F740-N773 WeakPolarHBondContact O-CB 3.33Å; F740-N773 PolarHBondContact O-ND2 3.43Å; N741-N773 PolarHBondContact OD1-N 3.11Å; N741-N773 VanDerWaalsContact OD1-N 3.15Å; N773-F839 CarbonylContact C-O 3.59Å; N773-F839 WeakPolarHBondContact CA-O 3.4Å; N773-W842 PolarHBondContact OD1-NE1 2.65Å
774	I	91.5	Very high	87.9	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	139.3	-171.3	-54.5	162.6	0	0	0	108.4	P737 F739 F772 Y776 F804 I813 I838 F839	P737-I774 HydrophobicContact CB-CG2 3.92Å; P737-I774 HydrophobicContact CG-CG2 4.14Å; F739-I774 HydrophobicContact CB-CB 4.4Å; F739-I774 HydrophobicContact CB-CG1 3.99Å; F739-I774 HydrophobicContact CB-CG2 4.43Å; F772-I774 HydrophobicContact CB-CD1 4.42Å; I774-Y776 HydrophobicContact CB-CE2 3.98Å; I774-Y776 HydrophobicContact CG2-CD2 4.23Å; I774-Y776 HydrophobicContact CG2-CE1 4.28Å; I774-Y776 HydrophobicContact CG2-CE2 3.46Å; I774-Y776 VanDerWaalsContact CG2-CE2 3.46Å; I774-Y776 VanDerWaalsContact CG2-CZ 3.5Å; I774-F804 HydrophobicContact CD1-CB 4.06Å; I774-F804 HydrophobicContact CD1-CD1 3.7Å; I774-F804 HydrophobicContact CD1-CD2 3.34Å; I774-F804 HydrophobicContact CD1-CE1 3.9Å; I774-F804 HydrophobicContact CD1-CE2 3.53Å; I774-F804 HydrophobicContact CD1-CG 3.4Å; I774-F804 VanDerWaalsContact CD1-CG 3.4Å; I774-F804 HydrophobicContact CD1-CZ 3.8Å; I774-I813 HydrophobicContact CD1-CD1 4.12Å; I774-I813 HydrophobicContact CG1-CD1 4.3Å; I774-I813 HydrophobicContact CG2-CD1 3.87Å; I774-I838 WeakPolarHBondContact O-CA 3.25Å; I774-F839 HydrophobicContact CB-CB 4.49Å; I774-F839 HydrophobicContact CD1-CD1 4.45Å; I774-F839 PolarHBondContact N-O 2.59Å; I774-F839 PolarHBondContact O-N 3.42Å
775	F	89.9	Confident	87.8	Confident	15 Å²	15	56 Å²	56	7%	0.066	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.1	-166.4	-59.4	-125.9	0	0	0	109.6	F700 V701 P737 R738 F740 I838	F700-F775 HydrophobicContact CB-CE1 4.32Å; F700-F775 HydrophobicContact CD1-CD1 4.39Å; F700-F775 AromaticContact CD1-CE1 3.24Å; F700-F775 HydrophobicContact CD1-CE1 3.24Å; F700-F775 HydrophobicContact CD1-CE2 4.25Å; F700-F775 AromaticContact CD1-CZ 3.18Å; F700-F775 HydrophobicContact CD1-CZ 3.18Å; F700-F775 AromaticContact CE1-CE1 3.72Å; F700-F775 HydrophobicContact CE1-CE1 3.72Å; F700-F775 AromaticContact CE1-CE2 3.96Å; F700-F775 HydrophobicContact CE1-CE2 3.96Å; F700-F775 AromaticContact CE1-CZ 3.31Å; F700-F775 HydrophobicContact CE1-CZ 3.31Å; F700-F775 AromaticContact CG-CE1 3.94Å; F700-F775 HydrophobicContact CG-CE1 3.94Å; F700-F775 HydrophobicContact CG-CZ 4.28Å; V701-F775 HydrophobicContact CG2-CZ 4.48Å; P737-F775 VanDerWaalsContact CB-O 3.23Å; P737-F775 WeakPolarHBondContact CB-O 3.49Å; R738-F775 HydrophobicContact CB-CB 4.18Å; R738-F775 HydrophobicContact CB-CD2 4.37Å; R738-F775 HydrophobicContact CB-CG 4.37Å; R738-F775 WeakPolarHBondContact O-CB 3.47Å; R738-F775 VanDerWaalsContact O-CD2 3.25Å; R738-F775 WeakPolarHBondContact O-CD2 3.44Å; R738-F775 PolarHBondContact O-N 2.94Å; F740-F775 HydrophobicContact CB-CE2 4.15Å; F775-I838 HydrophobicContact CD1-CD1 4.35Å; F775-I838 HydrophobicContact CD1-CG1 4.44Å
776	Y	89.9	Confident	88	Confident	1 Å²	1	51.7 Å²	51.7	0%	0.004	26%	0.257	C	S	.	.			trans	-129.2	57.4	178.4	-58.1	-76.8	0	0	0	110	P737 I774 D778 L779 P786 A806 Y810 F834 G837 F839	P737-Y776 HydrophobicContact CB-CD1 3.66Å; P737-Y776 HydrophobicContact CB-CE1 3.36Å; P737-Y776 HydrophobicContact CG-CD1 4.34Å; P737-Y776 HydrophobicContact CG-CE1 3.57Å; I774-Y776 HydrophobicContact CB-CE2 3.98Å; I774-Y776 HydrophobicContact CG2-CD2 4.23Å; I774-Y776 HydrophobicContact CG2-CE1 4.28Å; I774-Y776 HydrophobicContact CG2-CE2 3.46Å; I774-Y776 VanDerWaalsContact CG2-CE2 3.46Å; I774-Y776 VanDerWaalsContact CG2-CZ 3.5Å; Y776-D778 PolarHBondContact O-N 3.17Å; Y776-L779 WeakPolarHBondContact O-CB 3.28Å; Y776-L779 PolarHBondContact O-N 2.91Å; Y776-P786 HydrophobicContact CD2-CB 4.24Å; Y776-P786 HydrophobicContact CD2-CG 3.58Å; Y776-P786 HydrophobicContact CE2-CB 3.78Å; Y776-P786 HydrophobicContact CE2-CG 3.66Å; Y776-P786 HydrophobicContact CG-CG 4.27Å; Y776-A806 HydrophobicContact CD1-CB 3.51Å; Y776-A806 HydrophobicContact CD2-CB 4.38Å; Y776-A806 HydrophobicContact CE1-CB 3.26Å; Y776-A806 HydrophobicContact CE2-CB 4.18Å; Y776-A806 HydrophobicContact CG-CB 4.06Å; Y776-Y810 HydrophobicContact CD1-CD1 4.2Å; Y776-Y810 AromaticContact CD1-CD2 3.58Å; Y776-Y810 HydrophobicContact CD1-CD2 3.58Å; Y776-Y810 HydrophobicContact CD1-CE2 4.04Å; Y776-Y810 AromaticContact CD1-CG 3.64Å; Y776-Y810 HydrophobicContact CD1-CG 3.64Å; Y776-Y810 HydrophobicContact CE1-CD2 4.45Å; Y776-Y810 HydrophobicContact CE1-CG 4.13Å; Y776-Y810 HydrophobicContact CG-CD2 4.43Å; Y776-F834 HydrophobicContact CD2-CE2 4.24Å; Y776-G837 CarbonylContact C-O 3.51Å; Y776-G837 WeakPolarHBondContact CA-O 3.28Å; Y776-G837 PolarHBondContact N-O 3.03Å; Y776-F839 HydrophobicContact CD2-CB 4.19Å; Y776-F839 HydrophobicContact CE2-CB 4.02Å
777	P	85.1	Confident	88.1	Confident	64 Å²	64	53.3 Å²	53.3	42%	0.416	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-37.4	-178.4	26.1	-35.5	0	0	0	113.1	L779 Y810	P777-L779 VanDerWaalsContact C-N 3.26Å; P777-L779 PolarHBondContact O-N 3Å; P777-Y810 VanDerWaalsContact CD-OH 3.25Å; P777-Y810 WeakPolarHBondContact CD-OH 3.22Å
778	D	83.8	Confident	88.3	Confident	76 Å²	76	54.9 Å²	54.9	41%	0.406	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	18.2	-176.9	-45.4	-38.2	0	0	0	112.4	R735 Y776 I780 P809 Y810	R735-D778 IonicContact CZ-OD2 3.31Å; R735-D778 IonicContact NH1-OD2 2.84Å; R735-D778 PolarHBondContact NH1-OD2 3.29Å; Y776-D778 PolarHBondContact O-N 3.17Å; D778-I780 PolarHBondContact O-N 3.41Å; D778-P809 HydrophobicContact CB-CG 4.44Å; D778-P809 VanDerWaalsContact O-CD 3.25Å; D778-P809 WeakPolarHBondContact O-CD 3.27Å; D778-Y810 HydrophobicContact CB-CE2 4.22Å; D778-Y810 VanDerWaalsContact CB-OH 3.29Å; D778-Y810 WeakPolarHBondContact CB-OH 3.47Å; D778-Y810 PolarHBondContact N-OH 3.38Å; D778-Y810 PolarHBondContact OD2-OH 2.84Å
779	L	86.1	Confident	88.3	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.021	28%	0.275	C	S	.	.			trans	-65.6	120.3	-177.8	-166.9	68	0	0	0	108.8	Y776 P777 D781 K782 S784 A806 Y810 F834	Y776-L779 WeakPolarHBondContact O-CB 3.28Å; Y776-L779 PolarHBondContact O-N 2.91Å; P777-L779 VanDerWaalsContact C-N 3.26Å; P777-L779 PolarHBondContact O-N 3Å; L779-D781 WeakPolarHBondContact CD2-O 3.36Å; L779-K782 WeakPolarHBondContact O-CG 3.32Å; L779-S784 WeakPolarHBondContact CD2-O 3.47Å; L779-A806 HydrophobicContact CD1-CB 3.98Å; L779-Y810 HydrophobicContact CB-CE2 4.4Å; L779-Y810 HydrophobicContact CD1-CD2 4.02Å; L779-F834 HydrophobicContact CD2-CE1 4.14Å; L779-F834 HydrophobicContact CD2-CZ 3.85Å
780	I	81.9	Confident	88.3	Confident	76 Å²	76	60.4 Å²	60.4	39%	0.39	29%	0.292	S	S	.	.	S	Bend	trans	-62.1	-56.9	-175	-69.6	156.4	0	0	0	109	Y732 D778 K782 P808	Y732-I780 HydrophobicContact CD1-CD1 3.68Å; Y732-I780 HydrophobicContact CD2-CD1 3.78Å; Y732-I780 HydrophobicContact CE1-CD1 3.63Å; Y732-I780 HydrophobicContact CE2-CD1 3.72Å; Y732-I780 HydrophobicContact CG-CD1 3.75Å; D778-I780 PolarHBondContact O-N 3.41Å; I780-K782 PolarHBondContact O-N 2.95Å; I780-P808 HydrophobicContact CD1-CB 4.02Å
781	D	81.8	Confident	88.1	Confident	106 Å²	106	63.6 Å²	63.6	57%	0.567	31%	0.307	S	S	*	.			trans	-80.8	81.7	170.2	-72.9	-49.5	0	0	0	110.8	L779 R783 S784	L779-D781 WeakPolarHBondContact CD2-O 3.36Å; D781-R783 PolarHBondContact O-N 3.13Å; D781-S784 WeakPolarHBondContact O-CA 3.32Å; D781-S784 VanDerWaalsContact O-CB 3.27Å; D781-S784 WeakPolarHBondContact O-CB 3.44Å; D781-S784 PolarHBondContact O-N 2.89Å
782	K	81	Confident	87.9	Confident	163 Å²	163	66.6 Å²	66.6	71%	0.709	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-9.8	173.3	-61.7	180	-178.6	168.7	0	114.1	L779 I780	L779-K782 WeakPolarHBondContact O-CG 3.32Å; I780-K782 PolarHBondContact O-N 2.95Å
783	R	79.9	Confident	87.4	Confident	241 Å²	241	66.9 Å²	66.9	91%	0.909	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-18.1	171.6	-62.2	-174.6	-178.8	-157.2	1.8	113.5	D781 T785	D781-R783 PolarHBondContact O-N 3.13Å; R783-T785 PolarHBondContact O-N 2.94Å
784	S	84.4	Confident	86.9	Confident	52 Å²	52	71.9 Å²	71.9	36%	0.364	37%	0.366	S	S	.	.	S	Bend	trans	-70.6	125.1	171.1	-174.9	0	0	0	0	109.1	L779 D781	L779-S784 WeakPolarHBondContact CD2-O 3.47Å; D781-S784 WeakPolarHBondContact O-CA 3.32Å; D781-S784 VanDerWaalsContact O-CB 3.27Å; D781-S784 WeakPolarHBondContact O-CB 3.44Å; D781-S784 PolarHBondContact O-N 2.89Å
785	T	86.6	Confident	86.3	Confident	87 Å²	87	78 Å²	78	53%	0.534	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-92.8	123.4	175.9	54.8	0	0	0	0	109.7	R783 Q787 F834	R783-T785 PolarHBondContact O-N 2.94Å; T785-Q787 PolarHBondContact O-N 3.43Å; T785-F834 HydrophobicContact CG2-CD1 4.44Å
786	P	92.2	Very high	86	Confident	5 Å²	5	80.3 Å²	80.3	3%	0.032	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-54.1	136.1	174.1	-25.9	34.2	0	0	0	112.1	Y776 H805 A806 F834 F839	Y776-P786 HydrophobicContact CD2-CB 4.24Å; Y776-P786 HydrophobicContact CD2-CG 3.58Å; Y776-P786 HydrophobicContact CE2-CB 3.78Å; Y776-P786 HydrophobicContact CE2-CG 3.66Å; Y776-P786 HydrophobicContact CG-CG 4.27Å; P786-H805 CarbonylContact C-O 3.59Å; P786-H805 VanDerWaalsContact CA-O 3.29Å; P786-H805 WeakPolarHBondContact CA-O 3.23Å; P786-A806 HydrophobicContact CB-CB 4Å; P786-A806 HydrophobicContact CG-CB 3.87Å; P786-F834 HydrophobicContact CG-CD2 3.94Å; P786-F834 HydrophobicContact CG-CE2 3.83Å; P786-F834 HydrophobicContact CG-CG 4.4Å; P786-F834 HydrophobicContact CG-CZ 4.2Å; P786-F839 HydrophobicContact CB-CB 4.44Å; P786-F839 HydrophobicContact CB-CD2 3.84Å; P786-F839 HydrophobicContact CB-CE2 4.37Å; P786-F839 HydrophobicContact CB-CG 4.16Å; P786-F839 HydrophobicContact CG-CB 4.39Å; P786-F839 HydrophobicContact CG-CD2 4.25Å; P786-F839 WeakPolarHBondContact O-CE2 3.44Å
787	Q	91.9	Very high	85.8	Confident	109 Å²	109	88.9 Å²	88.9	51%	0.509	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	161.8	-179.3	-58.9	-173.4	11.2	0	0	110.4	T785 F789 F804 H805	T785-Q787 PolarHBondContact O-N 3.43Å; Q787-F789 HydrophobicContact CB-CE2 4.35Å; Q787-F789 HydrophobicContact CB-CZ 4.28Å; Q787-F804 WeakPolarHBondContact O-CA 3.36Å; Q787-H805 PolarHBondContact N-O 2.66Å; Q787-H805 PolarHBondContact O-N 2.85Å
788	Y	93.6	Very high	85.8	Confident	69 Å²	69	91.1 Å²	91.1	27%	0.271	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	148.9	174.9	73.8	-92.7	0	0	0	111.8	L802 R803 F804 W822 F839 L841	Y788-L802 HydrophobicContact CD2-CD1 3.63Å; Y788-L802 HydrophobicContact CE2-CD1 4.47Å; Y788-L802 HydrophobicContact CG-CD1 4.27Å; Y788-R803 CarbonylContact C-O 3.22Å; Y788-R803 VanDerWaalsContact CA-O 3.22Å; Y788-R803 WeakPolarHBondContact CA-O 3.44Å; Y788-F804 HydrophobicContact CG-CE1 4.43Å; Y788-W822 HydrophobicContact CD2-CH2 4.13Å; Y788-W822 HydrophobicContact CD2-CZ3 4.42Å; Y788-W822 AromaticContact CE2-CH2 3.64Å; Y788-W822 HydrophobicContact CE2-CH2 3.64Å; Y788-W822 AromaticContact CE2-CZ3 3.56Å; Y788-W822 HydrophobicContact CE2-CZ3 3.56Å; Y788-W822 AromaticContact CZ-CZ3 3.81Å; Y788-F839 HydrophobicContact CD1-CZ 4.18Å; Y788-L841 HydrophobicContact CD1-CD2 3.9Å; Y788-L841 HydrophobicContact CD2-CD2 4.17Å; Y788-L841 HydrophobicContact CE1-CD1 4.19Å; Y788-L841 HydrophobicContact CE1-CD2 4.1Å; Y788-L841 HydrophobicContact CE2-CD2 4.37Å; Y788-L841 HydrophobicContact CG-CD2 3.92Å
789	F	92	Very high	86.1	Confident	78 Å²	78	91 Å²	91	34%	0.342	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	131.7	-179.9	-54.3	-80.2	0	0	0	108.8	Q787 L802 R803 H805	Q787-F789 HydrophobicContact CB-CE2 4.35Å; Q787-F789 HydrophobicContact CB-CZ 4.28Å; F789-L802 WeakPolarHBondContact O-CA 3.4Å; F789-R803 PolarHBondContact N-O 3.48Å; F789-R803 PolarHBondContact O-N 3.41Å; F789-H805 HydrophobicContact CE2-CB 3.98Å
790	L	91.3	Very high	86.3	Confident	69 Å²	69	90.8 Å²	90.8	36%	0.361	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	108.7	175.9	179.1	59.4	0	0	0	109.4	L802 I817 W822	L790-L802 HydrophobicContact CB-CD1 4.4Å; L790-L802 HydrophobicContact CD1-CB 4.42Å; L790-I817 HydrophobicContact CD1-CD1 3.82Å; L790-I817 HydrophobicContact CD1-CG1 4.14Å; L790-W822 HydrophobicContact CD2-CZ2 3.92Å
791	E	89.2	Confident	86.8	Confident	77 Å²	77	88.6 Å²	88.6	36%	0.36	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	131.7	-178.7	-71.2	166.9	-178.2	0	0	109.4	C793 G800 I801 R803	E791-C793 PolarHBondContact O-N 2.98Å; E791-G800 CarbonylContact O-C 3.06Å; E791-G800 WeakPolarHBondContact O-CA 3.23Å; E791-I801 PolarHBondContact N-O 3.2Å; E791-I801 PolarHBondContact O-N 2.83Å; E791-R803 IonicContact OE1-CZ 2.87Å; E791-R803 IonicContact OE1-NH1 3.58Å; E791-R803 PolarHBondContact OE1-NH1 3Å; E791-R803 IonicContact OE1-NH2 2.68Å; E791-R803 PolarHBondContact OE1-NH2 3.49Å; E791-R803 IonicContact OE2-CZ 2.86Å; E791-R803 IonicContact OE2-NH1 3.95Å; E791-R803 PolarHBondContact OE2-NH1 2.87Å
792	P	88.8	Confident	87.3	Confident	99 Å²	99	83.6 Å²	83.6	64%	0.643	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.1	136.2	175.4	-23.9	34.6	0	0	0	111.5
793	C	83.9	Confident	87.9	Confident	5 Å²	5	77.7 Å²	77.7	3%	0.034	39%	0.387	C	S	.	.			trans	-72.6	127.9	179.1	-171.3	0	0	0	0	109.9	E791 D795 N796 F799 I801 K816	E791-C793 PolarHBondContact O-N 2.98Å; C793-D795 PolarHBondContact O-N 2.84Å; C793-D795 PolarHBondContact SG-OD2 3.2Å; C793-D795 VanDerWaalsContact SG-OD2 3.39Å; C793-N796 CarbonylContact O-C 3.52Å; C793-N796 PolarHBondContact O-N 2.86Å; C793-F799 HydrophobicContact CB-CB 4.16Å; C793-F799 WeakPolarHBondContact CB-O 3.33Å; C793-F799 PolarHBondContact N-O 3.15Å; C793-I801 HydrophobicContact CB-CG1 4.14Å; C793-K816 VanDerWaalsContact SG-CE 3.56Å; C793-K816 PolarHBondContact SG-NZ 3.28Å; C793-K816 VanDerWaalsContact SG-NZ 3.38Å
794	P	79.8	Confident	88.5	Confident	114 Å²	114	66.2 Å²	66.2	74%	0.74	34%	0.344	S	S	*	.	S	Bend	trans	-64.2	-39.1	-175.5	23.8	-32.8	0	0	0	112.5	N796	P794-N796 PolarHBondContact O-N 3.17Å
795	D	78.6	Confident	88.8	Confident	127 Å²	127	67.2 Å²	67.2	68%	0.679	34%	0.343	S	S	*	.	S	Bend	trans	-68.4	-31.5	-177.7	-16.1	-52	0	0	0	113.3	C793 K816	C793-D795 PolarHBondContact O-N 2.84Å; C793-D795 PolarHBondContact SG-OD2 3.2Å; C793-D795 VanDerWaalsContact SG-OD2 3.39Å; D795-K816 IonicContact OD2-NZ 3.39Å; D795-K816 PolarHBondContact OD2-NZ 2.77Å
796	N	84.6	Confident	88.9	Confident	64 Å²	64	63.2 Å²	63.2	34%	0.342	32%	0.318	S	S	.	.			trans	-156.8	119.8	-175.2	-172.1	-16.6	0	0	0	112.6	C793 P794 D798 F799	C793-N796 CarbonylContact O-C 3.52Å; C793-N796 PolarHBondContact O-N 2.86Å; P794-N796 PolarHBondContact O-N 3.17Å; N796-D798 VanDerWaalsContact C-N 3.26Å; N796-D798 PolarHBondContact O-N 2.86Å; N796-D798 WeakPolarHBondContact OD1-CB 3.42Å; N796-D798 PolarHBondContact OD1-N 2.8Å; N796-F799 HydrophobicContact CB-CD2 4.23Å; N796-F799 PolarHBondContact O-N 3.24Å; N796-F799 VanDerWaalsContact O-N 3.08Å
797	K	85.7	Confident	88.6	Confident	181 Å²	181	63.4 Å²	63.4	79%	0.787	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-23.8	-178.7	-61.7	178.7	-178.7	177.4	0	114.5	F799 N819	K797-F799 PolarHBondContact O-N 2.97Å; K797-N819 WeakPolarHBondContact O-CB 3.34Å; K797-N819 PolarHBondContact O-ND2 3.3Å
798	D	84.9	Confident	88.2	Confident	112 Å²	112	60.1 Å²	60.1	60%	0.599	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-10.7	175.2	-69.9	-33	0	0	0	112.9	N796 N819	N796-D798 VanDerWaalsContact C-N 3.26Å; N796-D798 PolarHBondContact O-N 2.86Å; N796-D798 WeakPolarHBondContact OD1-CB 3.42Å; N796-D798 PolarHBondContact OD1-N 2.8Å; D798-N819 PolarHBondContact O-N 2.69Å
799	F	89.9	Confident	87.8	Confident	72 Å²	72	57.3 Å²	57.3	32%	0.316	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	148.6	179.6	-65	-88.3	0	0	0	112.2	C793 N796 K797 K816 I817 V818	C793-F799 HydrophobicContact CB-CB 4.16Å; C793-F799 WeakPolarHBondContact CB-O 3.33Å; C793-F799 PolarHBondContact N-O 3.15Å; N796-F799 HydrophobicContact CB-CD2 4.23Å; N796-F799 PolarHBondContact O-N 3.24Å; N796-F799 VanDerWaalsContact O-N 3.08Å; K797-F799 PolarHBondContact O-N 2.97Å; F799-K816 HydrophobicContact CB-CG 4.15Å; F799-K816 HydrophobicContact CD1-CG 4.16Å; F799-K816 HydrophobicContact CG-CG 4.41Å; F799-I817 CarbonylContact C-O 3.58Å; F799-I817 VanDerWaalsContact CA-O 3.24Å; F799-I817 WeakPolarHBondContact CA-O 3.45Å; F799-I817 WeakPolarHBondContact CD1-O 3.26Å; F799-V818 HydrophobicContact CE1-CG2 4.2Å
800	G	90.3	Very high	87.7	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	153.3	175.6	0	0	0	0	0	110.3	E791 I817	E791-G800 CarbonylContact O-C 3.06Å; E791-G800 WeakPolarHBondContact O-CA 3.23Å; G800-I817 PolarHBondContact N-O 2.83Å; G800-I817 PolarHBondContact O-N 3.22Å
801	I	91.6	Very high	87.6	Confident	31 Å²	31	53.2 Å²	53.2	16%	0.159	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	111.2	175.6	-55.3	-176.2	0	0	0	106.6	I719 E791 C793 A814	I719-I801 HydrophobicContact CD1-CB 4.35Å; I719-I801 HydrophobicContact CD1-CD1 4.04Å; I719-I801 HydrophobicContact CD1-CG1 3.73Å; I719-I801 HydrophobicContact CD1-CG2 4.05Å; E791-I801 PolarHBondContact N-O 3.2Å; E791-I801 PolarHBondContact O-N 2.83Å; C793-I801 HydrophobicContact CB-CG1 4.14Å; I801-A814 HydrophobicContact CG2-CB 3.82Å
802	L	93.5	Very high	87.6	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	99.8	175.8	-178.3	60.7	0	0	0	108.7	F772 Y788 F789 L790 F804 A814 F815 I817 W822 L841 F843	F772-L802 HydrophobicContact CD2-CD2 3.96Å; F772-L802 HydrophobicContact CE2-CD2 3.51Å; F772-L802 HydrophobicContact CZ-CD2 3.9Å; Y788-L802 HydrophobicContact CD2-CD1 3.63Å; Y788-L802 HydrophobicContact CE2-CD1 4.47Å; Y788-L802 HydrophobicContact CG-CD1 4.27Å; F789-L802 WeakPolarHBondContact O-CA 3.4Å; L790-L802 HydrophobicContact CB-CD1 4.4Å; L790-L802 HydrophobicContact CD1-CB 4.42Å; L802-F804 HydrophobicContact CD1-CZ 4.39Å; L802-F804 HydrophobicContact CD2-CE1 4.4Å; L802-F804 HydrophobicContact CD2-CE2 3.97Å; L802-F804 HydrophobicContact CD2-CZ 3.53Å; L802-F804 HydrophobicContact CG-CE1 4.35Å; L802-F804 HydrophobicContact CG-CE2 3.81Å; L802-F804 HydrophobicContact CG-CZ 3.66Å; L802-A814 VanDerWaalsContact O-CA 3.29Å; L802-A814 WeakPolarHBondContact O-CA 3.43Å; L802-F815 PolarHBondContact N-O 2.85Å; L802-F815 PolarHBondContact O-N 3.1Å; L802-I817 HydrophobicContact CB-CD1 4.13Å; L802-I817 HydrophobicContact CB-CG1 4.27Å; L802-I817 HydrophobicContact CB-CG2 4.24Å; L802-I817 HydrophobicContact CD2-CD1 4.26Å; L802-I817 HydrophobicContact CD2-CG2 4.48Å; L802-W822 HydrophobicContact CD1-CH2 3.91Å; L802-W822 HydrophobicContact CD1-CZ2 4.28Å; L802-W822 HydrophobicContact CD2-CH2 4.2Å; L802-W822 HydrophobicContact CD2-CZ2 4.32Å; L802-L841 HydrophobicContact CD2-CD2 4.2Å; L802-F843 HydrophobicContact CD2-CE1 4.2Å; L802-F843 HydrophobicContact CD2-CZ 4.49Å
803	R	92.4	Very high	87.7	Confident	39 Å²	39	45.5 Å²	45.5	15%	0.147	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	140.2	176.6	-176.4	174.9	65	-111.6	-8.5	110.5	Y788 F789 E791 D812 I813 A814	Y788-R803 CarbonylContact C-O 3.22Å; Y788-R803 VanDerWaalsContact CA-O 3.22Å; Y788-R803 WeakPolarHBondContact CA-O 3.44Å; F789-R803 PolarHBondContact N-O 3.48Å; F789-R803 PolarHBondContact O-N 3.41Å; E791-R803 IonicContact OE1-CZ 2.87Å; E791-R803 IonicContact OE1-NH1 3.58Å; E791-R803 PolarHBondContact OE1-NH1 3Å; E791-R803 IonicContact OE1-NH2 2.68Å; E791-R803 PolarHBondContact OE1-NH2 3.49Å; E791-R803 IonicContact OE2-CZ 2.86Å; E791-R803 IonicContact OE2-NH1 3.95Å; E791-R803 PolarHBondContact OE2-NH1 2.87Å; R803-D812 HydrophobicContact CG-CB 4.27Å; R803-D812 IonicContact NE-OD2 3.92Å; R803-I813 CarbonylContact C-O 3.59Å; R803-I813 WeakPolarHBondContact CA-O 3.41Å; R803-A814 HydrophobicContact CB-CB 4.09Å; R803-A814 HydrophobicContact CG-CB 4.41Å
804	F	93.3	Very high	88.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	138.4	173.3	-61.8	-81.1	0	0	0	110	F772 I774 Q787 Y788 L802 D812 I813 F815 F839 L841	F772-F804 HydrophobicContact CB-CZ 4.05Å; F772-F804 AromaticContact CD1-CE2 3.83Å; F772-F804 HydrophobicContact CD1-CE2 3.83Å; F772-F804 AromaticContact CD1-CZ 3.98Å; F772-F804 HydrophobicContact CD1-CZ 3.98Å; F772-F804 HydrophobicContact CD2-CZ 4.14Å; F772-F804 HydrophobicContact CE1-CE2 4.22Å; F772-F804 HydrophobicContact CG-CE2 4.13Å; F772-F804 AromaticContact CG-CZ 3.78Å; F772-F804 HydrophobicContact CG-CZ 3.78Å; I774-F804 HydrophobicContact CD1-CB 4.06Å; I774-F804 HydrophobicContact CD1-CD1 3.7Å; I774-F804 HydrophobicContact CD1-CD2 3.34Å; I774-F804 HydrophobicContact CD1-CE1 3.9Å; I774-F804 HydrophobicContact CD1-CE2 3.53Å; I774-F804 HydrophobicContact CD1-CG 3.4Å; I774-F804 VanDerWaalsContact CD1-CG 3.4Å; I774-F804 HydrophobicContact CD1-CZ 3.8Å; Q787-F804 WeakPolarHBondContact O-CA 3.36Å; Y788-F804 HydrophobicContact CG-CE1 4.43Å; L802-F804 HydrophobicContact CD1-CZ 4.39Å; L802-F804 HydrophobicContact CD2-CE1 4.4Å; L802-F804 HydrophobicContact CD2-CE2 3.97Å; L802-F804 HydrophobicContact CD2-CZ 3.53Å; L802-F804 HydrophobicContact CG-CE1 4.35Å; L802-F804 HydrophobicContact CG-CE2 3.81Å; L802-F804 HydrophobicContact CG-CZ 3.66Å; F804-D812 WeakPolarHBondContact O-CA 3.47Å; F804-I813 HydrophobicContact CB-CG1 4.13Å; F804-I813 HydrophobicContact CD2-CG1 4.37Å; F804-I813 PolarHBondContact N-O 3.44Å; F804-I813 PolarHBondContact O-N 2.81Å; F804-F815 AromaticContact CD2-CD2 3.98Å; F804-F815 HydrophobicContact CD2-CD2 3.98Å; F804-F815 AromaticContact CD2-CE2 3.97Å; F804-F815 HydrophobicContact CD2-CE2 3.97Å; F804-F815 AromaticContact CE2-CD2 3.71Å; F804-F815 HydrophobicContact CE2-CD2 3.71Å; F804-F815 AromaticContact CE2-CE2 3.94Å; F804-F815 HydrophobicContact CE2-CE2 3.94Å; F804-F839 HydrophobicContact CD1-CD1 4.27Å; F804-F839 AromaticContact CD1-CE1 3.86Å; F804-F839 HydrophobicContact CD1-CE1 3.86Å; F804-F839 HydrophobicContact CE1-CD1 4.28Å; F804-F839 AromaticContact CE1-CE1 3.68Å; F804-F839 HydrophobicContact CE1-CE1 3.68Å; F804-L841 HydrophobicContact CE1-CB 4.48Å; F804-L841 HydrophobicContact CE1-CD2 3.71Å; F804-L841 HydrophobicContact CZ-CD2 4Å
805	H	91.2	Very high	88.7	Confident	73 Å²	73	39.9 Å²	39.9	34%	0.338	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	126.4	-177.6	175.9	72.4	0	0	0	109.6	P786 Q787 F789 D812	P786-H805 CarbonylContact C-O 3.59Å; P786-H805 VanDerWaalsContact CA-O 3.29Å; P786-H805 WeakPolarHBondContact CA-O 3.23Å; Q787-H805 PolarHBondContact N-O 2.66Å; Q787-H805 PolarHBondContact O-N 2.85Å; F789-H805 HydrophobicContact CE2-CB 3.98Å; H805-D812 IonicContact CE1-OD1 2.83Å; H805-D812 IonicContact CG-OD1 2.75Å; H805-D812 IonicContact ND1-OD1 2.64Å; H805-D812 PolarHBondContact ND1-OD1 3Å
806	A	88.8	Confident	89.3	Confident	3 Å²	3	37 Å²	37	3%	0.025	18%	0.18	C	C	.	.			trans	-117.3	-26.8	179.4	0	0	0	0	0	114.5	Y776 L779 P786	Y776-A806 HydrophobicContact CD1-CB 3.51Å; Y776-A806 HydrophobicContact CD2-CB 4.38Å; Y776-A806 HydrophobicContact CE1-CB 3.26Å; Y776-A806 HydrophobicContact CE2-CB 4.18Å; Y776-A806 HydrophobicContact CG-CB 4.06Å; L779-A806 HydrophobicContact CD1-CB 3.98Å; P786-A806 HydrophobicContact CB-CB 4Å; P786-A806 HydrophobicContact CG-CB 3.87Å
807	G	84.5	Confident	89.7	Confident	9 Å²	9	33.9 Å²	33.9	9%	0.093	16%	0.164	C	C	.	.			trans	93.3	-175	-169.5	0	0	0	0	0	113.1	Y810	G807-Y810 PolarHBondContact O-N 3.23Å
808	P	84.1	Confident	90	Very high	40 Å²	40	26.4 Å²	26.4	26%	0.26	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	140.7	-170.8	-19.9	31	0	0	0	112.9	W728 Y732 I780	W728-P808 HydrophobicContact CB-CG 4.22Å; W728-P808 HydrophobicContact CD2-CB 3.85Å; W728-P808 HydrophobicContact CD2-CG 3.93Å; W728-P808 HydrophobicContact CE3-CB 4.13Å; W728-P808 HydrophobicContact CG-CB 4.06Å; W728-P808 HydrophobicContact CG-CG 3.69Å; Y732-P808 HydrophobicContact CD2-CB 4.34Å; I780-P808 HydrophobicContact CD1-CB 4.02Å
809	P	85.8	Confident	90.3	Very high	11 Å²	11	24.1 Å²	24.1	7%	0.071	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	cis	-93.8	20.6	3.7	39.5	-38	0	0	0	113.6	W728 R735 D778	W728-P809 VanDerWaalsContact CH2-O 3.22Å; W728-P809 WeakPolarHBondContact CH2-O 3.47Å; W728-P809 HydrophobicContact CZ3-CB 4.34Å; R735-P809 PolarHBondContact N-O 2.91Å; D778-P809 HydrophobicContact CB-CG 4.44Å; D778-P809 VanDerWaalsContact O-CD 3.25Å; D778-P809 WeakPolarHBondContact O-CD 3.27Å
810	Y	89.3	Confident	90.3	Very high	9 Å²	9	27 Å²	27	4%	0.035	13%	0.13	C	C	.	.	B	Isolated β-bridge	trans	-99.6	136.9	-167.5	-69	-74.3	0	0	0	114.4	R735 P737 Y776 P777 D778 L779 G807	R735-Y810 HydrophobicContact CB-CD1 4.06Å; R735-Y810 HydrophobicContact CB-CE1 4.1Å; R735-Y810 CarbonylContact O-C 3.58Å; R735-Y810 VanDerWaalsContact O-CA 3.29Å; R735-Y810 WeakPolarHBondContact O-CA 3.33Å; R735-Y810 WeakPolarHBondContact O-CD1 3.31Å; P737-Y810 HydrophobicContact CB-CD1 3.81Å; P737-Y810 HydrophobicContact CB-CE1 4.23Å; P737-Y810 HydrophobicContact CB-CG 4.39Å; P737-Y810 HydrophobicContact CG-CD1 4.44Å; Y776-Y810 HydrophobicContact CD1-CD1 4.2Å; Y776-Y810 AromaticContact CD1-CD2 3.58Å; Y776-Y810 HydrophobicContact CD1-CD2 3.58Å; Y776-Y810 HydrophobicContact CD1-CE2 4.04Å; Y776-Y810 AromaticContact CD1-CG 3.64Å; Y776-Y810 HydrophobicContact CD1-CG 3.64Å; Y776-Y810 HydrophobicContact CE1-CD2 4.45Å; Y776-Y810 HydrophobicContact CE1-CG 4.13Å; Y776-Y810 HydrophobicContact CG-CD2 4.43Å; P777-Y810 VanDerWaalsContact CD-OH 3.25Å; P777-Y810 WeakPolarHBondContact CD-OH 3.22Å; D778-Y810 HydrophobicContact CB-CE2 4.22Å; D778-Y810 VanDerWaalsContact CB-OH 3.29Å; D778-Y810 WeakPolarHBondContact CB-OH 3.47Å; D778-Y810 PolarHBondContact N-OH 3.38Å; D778-Y810 PolarHBondContact OD2-OH 2.84Å; L779-Y810 HydrophobicContact CB-CE2 4.4Å; L779-Y810 HydrophobicContact CD1-CD2 4.02Å; G807-Y810 PolarHBondContact O-N 3.23Å
811	E	88.8	Confident	90.3	Very high	52 Å²	52	32 Å²	32	24%	0.243	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-72.6	151.6	173.2	-60.9	-173	161.6	0	0	112.6	Y726 P734 R735 K736 I813	Y726-E811 HydrophobicContact CE2-CB 4.42Å; Y726-E811 HydrophobicContact CE2-CG 4.01Å; P734-E811 HydrophobicContact CB-CG 4.06Å; R735-E811 PolarHBondContact O-N 3.17Å; K736-E811 WeakPolarHBondContact CE-OE2 3.26Å; K736-E811 HydrophobicContact CG-CB 4.42Å; K736-E811 WeakPolarHBondContact CG-OE2 3.5Å; E811-I813 PolarHBondContact O-N 3.01Å
812	D	90.6	Very high	90.4	Very high	9 Å²	9	30.9 Å²	30.9	5%	0.048	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-62.4	126.1	167	-75.4	2.1	0	0	0	110.5	V721 K724 Y726 R803 F804 H805	V721-D812 HydrophobicContact CG1-CB 4.11Å; K724-D812 IonicContact NZ-OD2 3.8Å; K724-D812 PolarHBondContact NZ-OD2 2.99Å; Y726-D812 PolarHBondContact OH-N 3.06Å; Y726-D812 VanDerWaalsContact OH-N 3.07Å; R803-D812 HydrophobicContact CG-CB 4.27Å; R803-D812 IonicContact NE-OD2 3.92Å; F804-D812 WeakPolarHBondContact O-CA 3.47Å; H805-D812 IonicContact CE1-OD1 2.83Å; H805-D812 IonicContact CG-OD1 2.75Å; H805-D812 IonicContact ND1-OD1 2.64Å; H805-D812 PolarHBondContact ND1-OD1 3Å
813	I	90.9	Very high	90.3	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.021	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	146.7	171.5	62.8	164.9	0	0	0	110.7	P737 F739 I774 R803 F804 E811 F815	P737-I813 HydrophobicContact CG-CD1 3.96Å; P737-I813 HydrophobicContact CG-CG1 4.11Å; P737-I813 HydrophobicContact CG-CG2 3.81Å; F739-I813 HydrophobicContact CD1-CD1 3.98Å; I774-I813 HydrophobicContact CD1-CD1 4.12Å; I774-I813 HydrophobicContact CG1-CD1 4.3Å; I774-I813 HydrophobicContact CG2-CD1 3.87Å; R803-I813 CarbonylContact C-O 3.59Å; R803-I813 WeakPolarHBondContact CA-O 3.41Å; F804-I813 HydrophobicContact CB-CG1 4.13Å; F804-I813 HydrophobicContact CD2-CG1 4.37Å; F804-I813 PolarHBondContact N-O 3.44Å; F804-I813 PolarHBondContact O-N 2.81Å; E811-I813 PolarHBondContact O-N 3.01Å; I813-F815 HydrophobicContact CD1-CE2 3.62Å; I813-F815 HydrophobicContact CD1-CZ 3.81Å; I813-F815 HydrophobicContact CG1-CE2 4.15Å
814	A	92	Very high	90	Very high	2 Å²	2	38 Å²	38	2%	0.017	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	150.8	179.1	0	0	0	0	0	112.9	E718 I719 V721 I801 L802 R803	E718-A814 CarbonylContact C-O 3.5Å; E718-A814 VanDerWaalsContact CA-O 3.3Å; E718-A814 WeakPolarHBondContact CA-O 3.47Å; I719-A814 HydrophobicContact CB-CB 4.45Å; I719-A814 PolarHBondContact N-O 3.45Å; V721-A814 HydrophobicContact CG2-CB 3.44Å; V721-A814 VanDerWaalsContact CG2-CB 3.44Å; I801-A814 HydrophobicContact CG2-CB 3.82Å; L802-A814 VanDerWaalsContact O-CA 3.29Å; L802-A814 WeakPolarHBondContact O-CA 3.43Å; R803-A814 HydrophobicContact CB-CB 4.09Å; R803-A814 HydrophobicContact CG-CB 4.41Å
815	F	92.3	Very high	89.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	144.2	-178.7	-61	-86.1	0	0	0	112.3	F715 E718 F739 N741 F772 L802 F804 I813 I817	F715-F815 HydrophobicContact CE1-CB 4.17Å; F715-F815 HydrophobicContact CE1-CD1 4.02Å; F715-F815 HydrophobicContact CE1-CG 4.43Å; E718-F815 HydrophobicContact CG-CD1 4.27Å; E718-F815 HydrophobicContact CG-CE1 3.72Å; E718-F815 HydrophobicContact CG-CZ 4.3Å; F739-F815 AromaticContact CD1-CZ 3.85Å; F739-F815 HydrophobicContact CD1-CZ 3.85Å; F739-F815 HydrophobicContact CD2-CE1 4.15Å; F739-F815 AromaticContact CD2-CZ 3.93Å; F739-F815 HydrophobicContact CD2-CZ 3.93Å; F739-F815 HydrophobicContact CE1-CE1 4.12Å; F739-F815 AromaticContact CE1-CZ 3.84Å; F739-F815 HydrophobicContact CE1-CZ 3.84Å; F739-F815 AromaticContact CE2-CE1 3.73Å; F739-F815 HydrophobicContact CE2-CE1 3.73Å; F739-F815 AromaticContact CE2-CZ 3.93Å; F739-F815 HydrophobicContact CE2-CZ 3.93Å; F739-F815 AromaticContact CG-CZ 3.89Å; F739-F815 HydrophobicContact CG-CZ 3.89Å; F739-F815 AromaticContact CZ-CE1 3.72Å; F739-F815 HydrophobicContact CZ-CE1 3.72Å; F739-F815 AromaticContact CZ-CZ 3.89Å; F739-F815 HydrophobicContact CZ-CZ 3.89Å; N741-F815 VanDerWaalsContact ND2-CE1 3.31Å; N741-F815 WeakPolarHBondContact ND2-CE1 3.32Å; N741-F815 WeakPolarHBondContact ND2-CZ 3.48Å; F772-F815 HydrophobicContact CD1-CD2 4.05Å; F772-F815 HydrophobicContact CD1-CE2 4.18Å; F772-F815 HydrophobicContact CE1-CB 3.96Å; F772-F815 HydrophobicContact CE1-CD1 4.33Å; F772-F815 AromaticContact CE1-CD2 3.62Å; F772-F815 HydrophobicContact CE1-CD2 3.62Å; F772-F815 HydrophobicContact CE1-CE2 4.15Å; F772-F815 AromaticContact CE1-CG 3.7Å; F772-F815 HydrophobicContact CE1-CG 3.7Å; F772-F815 HydrophobicContact CZ-CB 4.31Å; L802-F815 PolarHBondContact N-O 2.85Å; L802-F815 PolarHBondContact O-N 3.1Å; F804-F815 AromaticContact CD2-CD2 3.98Å; F804-F815 HydrophobicContact CD2-CD2 3.98Å; F804-F815 AromaticContact CD2-CE2 3.97Å; F804-F815 HydrophobicContact CD2-CE2 3.97Å; F804-F815 AromaticContact CE2-CD2 3.71Å; F804-F815 HydrophobicContact CE2-CD2 3.71Å; F804-F815 AromaticContact CE2-CE2 3.94Å; F804-F815 HydrophobicContact CE2-CE2 3.94Å; I813-F815 HydrophobicContact CD1-CE2 3.62Å; I813-F815 HydrophobicContact CD1-CZ 3.81Å; I813-F815 HydrophobicContact CG1-CE2 4.15Å; F815-I817 PolarHBondContact O-N 3.48Å
816	K	91.2	Very high	89.3	Confident	65 Å²	65	43.1 Å²	43.1	28%	0.283	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	110.8	172.8	-155.1	159	-172.4	155.6	0	110	F715 I719 C793 D795 F799	F715-K816 WeakPolarHBondContact CZ-O 3.29Å; I719-K816 HydrophobicContact CD1-CB 3.76Å; I719-K816 HydrophobicContact CD1-CD 4.3Å; I719-K816 HydrophobicContact CD1-CG 4.12Å; I719-K816 HydrophobicContact CG1-CB 4.19Å; C793-K816 VanDerWaalsContact SG-CE 3.56Å; C793-K816 PolarHBondContact SG-NZ 3.28Å; C793-K816 VanDerWaalsContact SG-NZ 3.38Å; D795-K816 IonicContact OD2-NZ 3.39Å; D795-K816 PolarHBondContact OD2-NZ 2.77Å; F799-K816 HydrophobicContact CB-CG 4.15Å; F799-K816 HydrophobicContact CD1-CG 4.16Å; F799-K816 HydrophobicContact CG-CG 4.41Å
817	I	92.4	Very high	89.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	161.4	177.6	69.1	161.8	0	0	0	111.7	Y770 F772 L790 F799 G800 L802 F815 W822 F843	Y770-I817 HydrophobicContact CD1-CG2 3.96Å; Y770-I817 HydrophobicContact CD2-CB 4.48Å; Y770-I817 HydrophobicContact CE1-CB 4.07Å; Y770-I817 HydrophobicContact CE1-CG2 3.69Å; Y770-I817 HydrophobicContact CE2-CB 3.92Å; Y770-I817 HydrophobicContact CE2-CG2 4.29Å; Y770-I817 HydrophobicContact CG-CG2 4.39Å; Y770-I817 WeakPolarHBondContact OH-CA 3.13Å; F772-I817 HydrophobicContact CE2-CG2 4.25Å; F772-I817 HydrophobicContact CZ-CG2 3.71Å; L790-I817 HydrophobicContact CD1-CD1 3.82Å; L790-I817 HydrophobicContact CD1-CG1 4.14Å; F799-I817 CarbonylContact C-O 3.58Å; F799-I817 VanDerWaalsContact CA-O 3.24Å; F799-I817 WeakPolarHBondContact CA-O 3.45Å; F799-I817 WeakPolarHBondContact CD1-O 3.26Å; G800-I817 PolarHBondContact N-O 2.83Å; G800-I817 PolarHBondContact O-N 3.22Å; L802-I817 HydrophobicContact CB-CD1 4.13Å; L802-I817 HydrophobicContact CB-CG1 4.27Å; L802-I817 HydrophobicContact CB-CG2 4.24Å; L802-I817 HydrophobicContact CD2-CD1 4.26Å; L802-I817 HydrophobicContact CD2-CG2 4.48Å; F815-I817 PolarHBondContact O-N 3.48Å; I817-W822 HydrophobicContact CD1-CZ2 3.85Å; I817-F843 HydrophobicContact CD1-CZ 3.95Å
818	V	92.1	Very high	88.8	Confident	23 Å²	23	58.9 Å²	58.9	14%	0.139	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	130.6	169	174	0	0	0	0	110	V767 Y770 F799 R820 F845	V767-V818 HydrophobicContact CB-CG2 4.28Å; V767-V818 HydrophobicContact CG2-CG2 4.35Å; Y770-V818 PolarHBondContact OH-N 3.35Å; Y770-V818 VanDerWaalsContact OH-N 3.11Å; F799-V818 HydrophobicContact CE1-CG2 4.2Å; V818-R820 HydrophobicContact CG1-CB 4.42Å; V818-R820 HydrophobicContact CG1-CG 3.85Å; V818-R820 PolarHBondContact O-N 2.93Å; V818-F845 HydrophobicContact CB-CE2 3.96Å; V818-F845 HydrophobicContact CB-CZ 3.9Å; V818-F845 HydrophobicContact CG1-CE2 4.23Å; V818-F845 HydrophobicContact CG1-CZ 4.29Å; V818-F845 WeakPolarHBondContact O-CE1 3.31Å; V818-F845 WeakPolarHBondContact O-CZ 3.11Å
819	N	90.8	Very high	88.8	Confident	65 Å²	65	58.7 Å²	58.7	35%	0.348	27%	0.27	S	S	.	.			trans	-86.1	82.8	-179.9	-172	22	0	0	0	111	K797 D798	K797-N819 WeakPolarHBondContact O-CB 3.34Å; K797-N819 PolarHBondContact O-ND2 3.3Å; D798-N819 PolarHBondContact O-N 2.69Å
820	R	89.8	Confident	89.1	Confident	133 Å²	133	59.1 Å²	59.1	50%	0.502	27%	0.271	S	S	.	.			trans	-132.6	155.2	174.6	-75.9	174.6	-178.4	-174.8	-1.8	109.8	V818 W822 F845	V818-R820 HydrophobicContact CG1-CB 4.42Å; V818-R820 HydrophobicContact CG1-CG 3.85Å; V818-R820 PolarHBondContact O-N 2.93Å; R820-W822 PolarHBondContact O-N 2.85Å; R820-F845 HydrophobicContact CB-CB 4.31Å; R820-F845 HydrophobicContact CB-CD1 3.52Å; R820-F845 HydrophobicContact CB-CD2 4.41Å; R820-F845 HydrophobicContact CB-CE1 3.82Å; R820-F845 HydrophobicContact CB-CG 3.85Å; R820-F845 HydrophobicContact CB-CZ 4.39Å; R820-F845 WeakPolarHBondContact O-CD1 3.45Å; R820-F845 WeakPolarHBondContact O-CE1 3.48Å
821	E	90.8	Very high	89.2	Confident	105 Å²	105	62.8 Å²	62.8	49%	0.491	29%	0.285	S	S	.	.			trans	-61.2	130.7	178.7	-74	-179.3	-103.8	0	0	112.6	F845 K846 Y848	E821-F845 WeakPolarHBondContact O-CA 3.24Å; E821-K846 HydrophobicContact CB-CD 3.84Å; E821-K846 HydrophobicContact CB-CG 4.22Å; E821-K846 PolarHBondContact O-N 2.82Å; E821-K846 IonicContact OE2-NZ 3.38Å; E821-K846 PolarHBondContact OE2-NZ 3.24Å; E821-Y848 PolarHBondContact OE1-OH 3.26Å; E821-Y848 PolarHBondContact OE2-OH 3.31Å
822	W	93.1	Very high	89.3	Confident	6 Å²	6	63 Å²	63	2%	0.023	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	146.3	177.9	-56.6	-0.7	0	0	0	111.2	Y788 L790 L802 I817 R820 Y824 F830 L841 F843 F845 K846	Y788-W822 HydrophobicContact CD2-CH2 4.13Å; Y788-W822 HydrophobicContact CD2-CZ3 4.42Å; Y788-W822 AromaticContact CE2-CH2 3.64Å; Y788-W822 HydrophobicContact CE2-CH2 3.64Å; Y788-W822 AromaticContact CE2-CZ3 3.56Å; Y788-W822 HydrophobicContact CE2-CZ3 3.56Å; Y788-W822 AromaticContact CZ-CZ3 3.81Å; L790-W822 HydrophobicContact CD2-CZ2 3.92Å; L802-W822 HydrophobicContact CD1-CH2 3.91Å; L802-W822 HydrophobicContact CD1-CZ2 4.28Å; L802-W822 HydrophobicContact CD2-CH2 4.2Å; L802-W822 HydrophobicContact CD2-CZ2 4.32Å; I817-W822 HydrophobicContact CD1-CZ2 3.85Å; R820-W822 PolarHBondContact O-N 2.85Å; W822-Y824 HydrophobicContact CB-CE1 4.45Å; W822-Y824 HydrophobicContact CB-CE2 3.98Å; W822-Y824 AromaticContact CE3-CE1 3.98Å; W822-Y824 HydrophobicContact CE3-CE1 3.98Å; W822-Y824 WeakPolarHBondContact O-CD2 3.35Å; W822-F830 HydrophobicContact CE3-CE2 4.45Å; W822-L841 HydrophobicContact CH2-CD2 4.09Å; W822-L841 HydrophobicContact CZ3-CD1 4.25Å; W822-L841 HydrophobicContact CZ3-CD2 4.16Å; W822-F843 HydrophobicContact CB-CB 4.43Å; W822-F843 HydrophobicContact CB-CD2 4.33Å; W822-F843 AromaticContact CD1-CD2 3.65Å; W822-F843 AromaticContact CD1-CE2 3.68Å; W822-F843 HydrophobicContact CD2-CB 4.31Å; W822-F843 HydrophobicContact CD2-CD1 4.05Å; W822-F843 AromaticContact CD2-CD2 3.68Å; W822-F843 HydrophobicContact CD2-CD2 3.68Å; W822-F843 HydrophobicContact CD2-CE1 4.26Å; W822-F843 AromaticContact CD2-CE2 3.92Å; W822-F843 HydrophobicContact CD2-CE2 3.92Å; W822-F843 AromaticContact CD2-CG 3.76Å; W822-F843 HydrophobicContact CD2-CG 3.76Å; W822-F843 HydrophobicContact CD2-CZ 4.2Å; W822-F843 AromaticContact CE2-CD2 3.8Å; W822-F843 AromaticContact CE2-CE1 3.89Å; W822-F843 AromaticContact CE2-CE2 3.5Å; W822-F843 VanDerWaalsContact CE2-CE2 3.5Å; W822-F843 AromaticContact CE2-CZ 3.54Å; W822-F843 HydrophobicContact CE3-CB 4.23Å; W822-F843 AromaticContact CE3-CD1 3.92Å; W822-F843 HydrophobicContact CE3-CD1 3.92Å; W822-F843 HydrophobicContact CE3-CD2 4.32Å; W822-F843 HydrophobicContact CE3-CE1 4.33Å; W822-F843 AromaticContact CE3-CG 3.91Å; W822-F843 HydrophobicContact CE3-CG 3.91Å; W822-F843 HydrophobicContact CG-CB 4.4Å; W822-F843 AromaticContact CG-CD2 3.64Å; W822-F843 HydrophobicContact CG-CD2 3.64Å; W822-F843 HydrophobicContact CG-CE2 4.07Å; W822-F843 HydrophobicContact CG-CG 4.05Å; W822-F843 HydrophobicContact CH2-CD1 4.07Å; W822-F843 AromaticContact CH2-CE1 3.72Å; W822-F843 HydrophobicContact CH2-CE1 3.72Å; W822-F843 HydrophobicContact CH2-CZ 4.11Å; W822-F843 HydrophobicContact CZ2-CD1 4.2Å; W822-F843 AromaticContact CZ2-CE1 3.63Å; W822-F843 HydrophobicContact CZ2-CE1 3.63Å; W822-F843 AromaticContact CZ2-CE2 3.99Å; W822-F843 HydrophobicContact CZ2-CE2 3.99Å; W822-F843 AromaticContact CZ2-CZ 3.51Å; W822-F843 HydrophobicContact CZ2-CZ 3.51Å; W822-F843 AromaticContact CZ3-CD1 3.92Å; W822-F843 HydrophobicContact CZ3-CD1 3.92Å; W822-F843 HydrophobicContact CZ3-CE1 4.07Å; W822-F843 HydrophobicContact CZ3-CG 4.39Å; W822-F843 AromaticContact NE1-CD2 3.78Å; W822-F843 AromaticContact NE1-CE2 3.36Å; W822-F843 AromaticContact NE1-CZ 3.79Å; W822-F845 AromaticContact CD1-CD1 3.89Å; W822-F845 AromaticContact CD1-CE1 3.68Å; W822-F845 AromaticContact NE1-CE1 3.89Å; W822-K846 VanDerWaalsContact O-CE 3.27Å; W822-K846 WeakPolarHBondContact O-CE 3.42Å
823	E	91.5	Very high	89.4	Confident	54 Å²	54	66.6 Å²	66.6	25%	0.252	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	98	170.1	177.6	152.1	-150.9	0	0	110	S825 H828 H844 K846	E823-S825 PolarHBondContact O-N 2.81Å; E823-H828 VanDerWaalsContact CD-ND1 3.29Å; E823-H828 HydrophobicContact CG-CB 4.23Å; E823-H828 IonicContact OE1-CE1 2.7Å; E823-H828 IonicContact OE1-CG 2.68Å; E823-H828 IonicContact OE1-ND1 2.64Å; E823-H828 PolarHBondContact OE1-ND1 3.4Å; E823-H828 IonicContact OE2-ND1 3.17Å; E823-H844 PolarHBondContact N-O 3.05Å; E823-K846 HydrophobicContact CB-CG 4.14Å
824	Y	87.8	Confident	89.3	Confident	134 Å²	134	68.8 Å²	68.8	53%	0.525	32%	0.317	S	S	.	.			trans	-71.1	17.5	178.7	-61.3	-83.2	0	0	0	114.5	W822 H826 F830	W822-Y824 HydrophobicContact CB-CE1 4.45Å; W822-Y824 HydrophobicContact CB-CE2 3.98Å; W822-Y824 AromaticContact CE3-CE1 3.98Å; W822-Y824 HydrophobicContact CE3-CE1 3.98Å; W822-Y824 WeakPolarHBondContact O-CD2 3.35Å; Y824-H826 PolarHBondContact O-N 3.1Å; Y824-F830 HydrophobicContact CD1-CD2 4.15Å; Y824-F830 HydrophobicContact CD1-CE1 4.15Å; Y824-F830 AromaticContact CD1-CE2 3.58Å; Y824-F830 HydrophobicContact CD1-CE2 3.58Å; Y824-F830 AromaticContact CD1-CZ 3.6Å; Y824-F830 HydrophobicContact CD1-CZ 3.6Å; Y824-F830 AromaticContact CE1-CE2 3.98Å; Y824-F830 HydrophobicContact CE1-CE2 3.98Å; Y824-F830 HydrophobicContact CE1-CZ 4.07Å
825	S	87.6	Confident	89.1	Confident	36 Å²	36	71 Å²	71	25%	0.252	34%	0.335	S	S	.	.			trans	-83.9	112.1	-179	177.6	0	0	0	0	110.6	E823 R827 H828 G829 F830	E823-S825 PolarHBondContact O-N 2.81Å; S825-R827 PolarHBondContact O-N 2.67Å; S825-R827 VanDerWaalsContact O-N 3.12Å; S825-R827 PolarHBondContact OG-N 3.11Å; S825-H828 CarbonylContact O-C 3.52Å; S825-H828 WeakPolarHBondContact O-CA 3.49Å; S825-H828 PolarHBondContact O-N 3.34Å; S825-H828 PolarHBondContact OG-ND1 3.18Å; S825-G829 PolarHBondContact O-N 3.05Å; S825-F830 WeakPolarHBondContact O-CB 3.34Å; S825-F830 PolarHBondContact O-N 2.91Å
826	H	82.3	Confident	88.7	Confident	146 Å²	146	78.9 Å²	78.9	68%	0.676	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-55.5	-27.2	171.2	-69.6	95.1	0	0	0	112.9	Y824 H828 G829 F830	Y824-H826 PolarHBondContact O-N 3.1Å; H826-H828 VanDerWaalsContact C-N 3.28Å; H826-H828 PolarHBondContact O-N 3.14Å; H826-G829 PolarHBondContact O-N 3.49Å; H826-F830 PolarHBondContact CD2-O 2.92Å; H826-F830 VanDerWaalsContact CD2-O 3.28Å
827	R	82.8	Confident	88.3	Confident	237 Å²	237	76.6 Å²	76.6	89%	0.894	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-72.7	-18.6	174.3	-66.3	-171.8	178.2	-149.4	0.4	113.6	S825	S825-R827 PolarHBondContact O-N 2.67Å; S825-R827 VanDerWaalsContact O-N 3.12Å; S825-R827 PolarHBondContact OG-N 3.11Å
828	H	80.1	Confident	88.2	Confident	106 Å²	106	77.7 Å²	77.7	49%	0.491	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-110.9	26.8	177.6	-56.4	144.5	0	0	0	111.8	E823 S825 H826 H844	E823-H828 VanDerWaalsContact CD-ND1 3.29Å; E823-H828 HydrophobicContact CG-CB 4.23Å; E823-H828 IonicContact OE1-CE1 2.7Å; E823-H828 IonicContact OE1-CG 2.68Å; E823-H828 IonicContact OE1-ND1 2.64Å; E823-H828 PolarHBondContact OE1-ND1 3.4Å; E823-H828 IonicContact OE2-ND1 3.17Å; S825-H828 CarbonylContact O-C 3.52Å; S825-H828 WeakPolarHBondContact O-CA 3.49Å; S825-H828 PolarHBondContact O-N 3.34Å; S825-H828 PolarHBondContact OG-ND1 3.18Å; H826-H828 VanDerWaalsContact C-N 3.28Å; H826-H828 PolarHBondContact O-N 3.14Å; H828-H844 PolarHBondContact O-CD2 2.9Å; H828-H844 VanDerWaalsContact O-CD2 3.31Å
829	G	82.4	Confident	88.2	Confident	35 Å²	35	76.9 Å²	76.9	36%	0.361	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	5.2	170.1	0	0	0	0	0	115.9	S825 H826 R831	S825-G829 PolarHBondContact O-N 3.05Å; H826-G829 PolarHBondContact O-N 3.49Å; G829-R831 PolarHBondContact O-N 3.24Å
830	F	92.3	Very high	88.3	Confident	21 Å²	21	75.2 Å²	75.2	9%	0.092	36%	0.363	C	S	.	.			trans	-62.3	134.4	172.6	-172.3	-99.3	0	0	0	111.4	W822 Y824 S825 H826 C832 L841 W842 F843	W822-F830 HydrophobicContact CE3-CE2 4.45Å; Y824-F830 HydrophobicContact CD1-CD2 4.15Å; Y824-F830 HydrophobicContact CD1-CE1 4.15Å; Y824-F830 AromaticContact CD1-CE2 3.58Å; Y824-F830 HydrophobicContact CD1-CE2 3.58Å; Y824-F830 AromaticContact CD1-CZ 3.6Å; Y824-F830 HydrophobicContact CD1-CZ 3.6Å; Y824-F830 AromaticContact CE1-CE2 3.98Å; Y824-F830 HydrophobicContact CE1-CE2 3.98Å; Y824-F830 HydrophobicContact CE1-CZ 4.07Å; S825-F830 WeakPolarHBondContact O-CB 3.34Å; S825-F830 PolarHBondContact O-N 2.91Å; H826-F830 PolarHBondContact CD2-O 2.92Å; H826-F830 VanDerWaalsContact CD2-O 3.28Å; F830-C832 HydrophobicContact CE1-CB 4.03Å; F830-C832 HydrophobicContact CZ-CB 3.97Å; F830-L841 HydrophobicContact CE2-CD1 4.32Å; F830-L841 HydrophobicContact CZ-CD1 4.38Å; F830-W842 WeakPolarHBondContact CA-O 3.49Å; F830-W842 WeakPolarHBondContact CD2-O 3.37Å; F830-F843 HydrophobicContact CD2-CB 3.86Å; F830-F843 HydrophobicContact CE2-CB 4.09Å
831	R	91.1	Very high	88.5	Confident	85 Å²	85	68.9 Å²	68.9	32%	0.321	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	131.3	174.1	178	-179	-67.1	-163.3	0.1	109	G829 Q833 L841 W842	G829-R831 PolarHBondContact O-N 3.24Å; R831-Q833 HydrophobicContact CG-CG 3.84Å; R831-L841 CarbonylContact O-C 3.57Å; R831-L841 WeakPolarHBondContact O-CA 3.33Å; R831-W842 HydrophobicContact CB-CB 4.11Å; R831-W842 HydrophobicContact CB-CD2 4.36Å; R831-W842 HydrophobicContact CB-CE3 4.31Å; R831-W842 HydrophobicContact CB-CG 4.31Å; R831-W842 PolarHBondContact N-O 3.02Å; R831-W842 PolarHBondContact O-N 3.38Å
832	C	92.6	Very high	88.6	Confident	58 Å²	58	66.8 Å²	66.8	39%	0.392	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	105.9	165.8	-174.2	0	0	0	0	107.4	F830 Q840 L841	F830-C832 HydrophobicContact CE1-CB 4.03Å; F830-C832 HydrophobicContact CZ-CB 3.97Å; C832-Q840 VanDerWaalsContact CA-O 3.31Å; C832-Q840 WeakPolarHBondContact CA-O 3.09Å; C832-L841 HydrophobicContact CB-CD1 3.99Å
833	Q	91	Very high	88.6	Confident	84 Å²	84	66.5 Å²	66.5	39%	0.393	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	144.7	-177.2	66.6	-175.9	40.2	0	0	111.9	R831 Q840	R831-Q833 HydrophobicContact CG-CG 3.84Å; Q833-Q840 HydrophobicContact CG-CB 4.06Å; Q833-Q840 PolarHBondContact N-O 2.93Å; Q833-Q840 VanDerWaalsContact NE2-OE1 3.16Å; Q833-Q840 PolarHBondContact O-N 3.37Å
834	F	90.6	Very high	88.7	Confident	49 Å²	49	66 Å²	66	22%	0.215	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	124	168.1	-174.9	-125	0	0	0	108.8	Y776 L779 T785 P786 I838 F839	Y776-F834 HydrophobicContact CD2-CE2 4.24Å; L779-F834 HydrophobicContact CD2-CE1 4.14Å; L779-F834 HydrophobicContact CD2-CZ 3.85Å; T785-F834 HydrophobicContact CG2-CD1 4.44Å; P786-F834 HydrophobicContact CG-CD2 3.94Å; P786-F834 HydrophobicContact CG-CE2 3.83Å; P786-F834 HydrophobicContact CG-CG 4.4Å; P786-F834 HydrophobicContact CG-CZ 4.2Å; F834-I838 WeakPolarHBondContact CA-O 3.32Å; F834-F839 HydrophobicContact CB-CD2 4.2Å; F834-F839 HydrophobicContact CD2-CB 3.95Å; F834-F839 HydrophobicContact CD2-CD2 4.4Å
835	A	86.1	Confident	88.9	Confident	48 Å²	48	60.1 Å²	60.1	40%	0.397	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	138.4	178.8	0	0	0	0	0	110.5	G837 I838	A835-G837 PolarHBondContact O-N 3.37Å; A835-I838 PolarHBondContact N-O 2.98Å; A835-I838 WeakPolarHBondContact O-CA 3.5Å; A835-I838 PolarHBondContact O-N 3.18Å
836	N	83.9	Confident	89	Confident	167 Å²	167	62.4 Å²	62.4	89%	0.893	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	37.8	176.6	-55.7	-4.1	0	0	0	114	I838	N836-I838 VanDerWaalsContact C-N 3.29Å; N836-I838 PolarHBondContact O-N 3.49Å
837	G	84.4	Confident	89.1	Confident	16 Å²	16	62 Å²	62	17%	0.165	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	11.6	-175.8	0	0	0	0	0	114.6	Y776 A835	Y776-G837 CarbonylContact C-O 3.51Å; Y776-G837 WeakPolarHBondContact CA-O 3.28Å; Y776-G837 PolarHBondContact N-O 3.03Å; A835-G837 PolarHBondContact O-N 3.37Å
838	I	89.8	Confident	88.8	Confident	24 Å²	24	58 Å²	58	12%	0.123	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	122	-177.6	-52	-176.9	0	0	0	110.3	F700 I774 F775 F834 A835 N836 Q840	F700-I838 HydrophobicContact CD1-CD1 4.29Å; F700-I838 HydrophobicContact CD2-CD1 3.3Å; F700-I838 HydrophobicContact CE1-CD1 4.31Å; F700-I838 HydrophobicContact CE2-CD1 3.35Å; F700-I838 HydrophobicContact CE2-CG2 4.21Å; F700-I838 HydrophobicContact CG-CD1 3.8Å; F700-I838 HydrophobicContact CZ-CD1 3.88Å; F700-I838 HydrophobicContact CZ-CG2 3.93Å; I774-I838 WeakPolarHBondContact O-CA 3.25Å; F775-I838 HydrophobicContact CD1-CD1 4.35Å; F775-I838 HydrophobicContact CD1-CG1 4.44Å; F834-I838 WeakPolarHBondContact CA-O 3.32Å; A835-I838 PolarHBondContact N-O 2.98Å; A835-I838 WeakPolarHBondContact O-CA 3.5Å; A835-I838 PolarHBondContact O-N 3.18Å; N836-I838 VanDerWaalsContact C-N 3.29Å; N836-I838 PolarHBondContact O-N 3.49Å; I838-Q840 HydrophobicContact CG2-CG 4.26Å
839	F	92	Very high	88.6	Confident	6 Å²	6	63.4 Å²	63.4	3%	0.026	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	117.1	175.8	-174.9	-95.4	0	0	0	110.2	N773 I774 Y776 P786 Y788 F804 F834 L841	N773-F839 CarbonylContact C-O 3.59Å; N773-F839 WeakPolarHBondContact CA-O 3.4Å; I774-F839 HydrophobicContact CB-CB 4.49Å; I774-F839 HydrophobicContact CD1-CD1 4.45Å; I774-F839 PolarHBondContact N-O 2.59Å; I774-F839 PolarHBondContact O-N 3.42Å; Y776-F839 HydrophobicContact CD2-CB 4.19Å; Y776-F839 HydrophobicContact CE2-CB 4.02Å; P786-F839 HydrophobicContact CB-CB 4.44Å; P786-F839 HydrophobicContact CB-CD2 3.84Å; P786-F839 HydrophobicContact CB-CE2 4.37Å; P786-F839 HydrophobicContact CB-CG 4.16Å; P786-F839 HydrophobicContact CG-CB 4.39Å; P786-F839 HydrophobicContact CG-CD2 4.25Å; P786-F839 WeakPolarHBondContact O-CE2 3.44Å; Y788-F839 HydrophobicContact CD1-CZ 4.18Å; F804-F839 HydrophobicContact CD1-CD1 4.27Å; F804-F839 AromaticContact CD1-CE1 3.86Å; F804-F839 HydrophobicContact CD1-CE1 3.86Å; F804-F839 HydrophobicContact CE1-CD1 4.28Å; F804-F839 AromaticContact CE1-CE1 3.68Å; F804-F839 HydrophobicContact CE1-CE1 3.68Å; F834-F839 HydrophobicContact CB-CD2 4.2Å; F834-F839 HydrophobicContact CD2-CB 3.95Å; F834-F839 HydrophobicContact CD2-CD2 4.4Å; F839-L841 HydrophobicContact CD1-CB 4.4Å; F839-L841 HydrophobicContact CE1-CB 3.62Å; F839-L841 HydrophobicContact CZ-CB 4.25Å
840	Q	92.6	Very high	88.1	Confident	29 Å²	29	70.5 Å²	70.5	14%	0.136	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	111.1	-179.9	-62.6	-177.8	-2.3	0	0	109.8	F772 C832 Q833 I838	F772-Q840 WeakPolarHBondContact O-CA 3.19Å; C832-Q840 VanDerWaalsContact CA-O 3.31Å; C832-Q840 WeakPolarHBondContact CA-O 3.09Å; Q833-Q840 HydrophobicContact CG-CB 4.06Å; Q833-Q840 PolarHBondContact N-O 2.93Å; Q833-Q840 VanDerWaalsContact NE2-OE1 3.16Å; Q833-Q840 PolarHBondContact O-N 3.37Å; I838-Q840 HydrophobicContact CG2-CG 4.26Å
841	L	93.4	Very high	87.1	Confident	0 Å²	0	80.4 Å²	80.4	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	102.8	171.6	175.1	63.2	0	0	0	109.8	F772 Y788 L802 F804 W822 F830 R831 C832 F839 F843	F772-L841 HydrophobicContact CB-CB 4.35Å; F772-L841 PolarHBondContact N-O 3.5Å; F772-L841 PolarHBondContact O-N 2.65Å; Y788-L841 HydrophobicContact CD1-CD2 3.9Å; Y788-L841 HydrophobicContact CD2-CD2 4.17Å; Y788-L841 HydrophobicContact CE1-CD1 4.19Å; Y788-L841 HydrophobicContact CE1-CD2 4.1Å; Y788-L841 HydrophobicContact CE2-CD2 4.37Å; Y788-L841 HydrophobicContact CG-CD2 3.92Å; L802-L841 HydrophobicContact CD2-CD2 4.2Å; F804-L841 HydrophobicContact CE1-CB 4.48Å; F804-L841 HydrophobicContact CE1-CD2 3.71Å; F804-L841 HydrophobicContact CZ-CD2 4Å; W822-L841 HydrophobicContact CH2-CD2 4.09Å; W822-L841 HydrophobicContact CZ3-CD1 4.25Å; W822-L841 HydrophobicContact CZ3-CD2 4.16Å; F830-L841 HydrophobicContact CE2-CD1 4.32Å; F830-L841 HydrophobicContact CZ-CD1 4.38Å; R831-L841 CarbonylContact O-C 3.57Å; R831-L841 WeakPolarHBondContact O-CA 3.33Å; C832-L841 HydrophobicContact CB-CD1 3.99Å; F839-L841 HydrophobicContact CD1-CB 4.4Å; F839-L841 HydrophobicContact CE1-CB 3.62Å; F839-L841 HydrophobicContact CZ-CB 4.25Å; L841-F843 HydrophobicContact CD1-CD1 4.37Å; L841-F843 HydrophobicContact CD2-CE1 4.44Å; L841-F843 HydrophobicContact CG-CD1 4.11Å; L841-F843 HydrophobicContact CG-CE1 4.39Å
842	W	93.9	Very high	85.7	Confident	62 Å²	62	89.3 Å²	89.3	24%	0.235	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	130.3	179.3	-53.2	-7.1	0	0	0	109.3	Y770 K771 N773 F830 R831	Y770-W842 WeakPolarHBondContact O-CA 3.37Å; K771-W842 HydrophobicContact CB-CB 4.41Å; K771-W842 HydrophobicContact CB-CG 3.94Å; K771-W842 HydrophobicContact CD-CD2 4.34Å; K771-W842 HydrophobicContact CD-CG 4.39Å; K771-W842 HydrophobicContact CG-CB 4Å; K771-W842 HydrophobicContact CG-CD2 4.33Å; K771-W842 HydrophobicContact CG-CG 3.87Å; N773-W842 PolarHBondContact OD1-NE1 2.65Å; F830-W842 WeakPolarHBondContact CA-O 3.49Å; F830-W842 WeakPolarHBondContact CD2-O 3.37Å; R831-W842 HydrophobicContact CB-CB 4.11Å; R831-W842 HydrophobicContact CB-CD2 4.36Å; R831-W842 HydrophobicContact CB-CE3 4.31Å; R831-W842 HydrophobicContact CB-CG 4.31Å; R831-W842 PolarHBondContact N-O 3.02Å; R831-W842 PolarHBondContact O-N 3.38Å
843	F	93.4	Very high	85.3	Confident	0 Å²	0	90.9 Å²	90.9	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	151.1	177.3	61.3	-92.4	0	0	0	111.9	G769 Y770 F772 L802 I817 W822 F830 L841 F845	G769-F843 CarbonylContact C-O 3.51Å; G769-F843 WeakPolarHBondContact CA-O 3.01Å; Y770-F843 AromaticContact CD2-CE2 3.79Å; Y770-F843 HydrophobicContact CD2-CE2 3.79Å; Y770-F843 AromaticContact CD2-CZ 3.85Å; Y770-F843 HydrophobicContact CD2-CZ 3.85Å; Y770-F843 HydrophobicContact CG-CE2 4.36Å; Y770-F843 HydrophobicContact CG-CZ 4.04Å; Y770-F843 PolarHBondContact N-O 3.13Å; Y770-F843 PolarHBondContact O-N 2.96Å; F772-F843 HydrophobicContact CD2-CE1 4.08Å; F772-F843 AromaticContact CE2-CE1 3.89Å; F772-F843 HydrophobicContact CE2-CE1 3.89Å; F772-F843 HydrophobicContact CE2-CZ 4.16Å; L802-F843 HydrophobicContact CD2-CE1 4.2Å; L802-F843 HydrophobicContact CD2-CZ 4.49Å; I817-F843 HydrophobicContact CD1-CZ 3.95Å; W822-F843 HydrophobicContact CB-CB 4.43Å; W822-F843 HydrophobicContact CB-CD2 4.33Å; W822-F843 AromaticContact CD1-CD2 3.65Å; W822-F843 AromaticContact CD1-CE2 3.68Å; W822-F843 HydrophobicContact CD2-CB 4.31Å; W822-F843 HydrophobicContact CD2-CD1 4.05Å; W822-F843 AromaticContact CD2-CD2 3.68Å; W822-F843 HydrophobicContact CD2-CD2 3.68Å; W822-F843 HydrophobicContact CD2-CE1 4.26Å; W822-F843 AromaticContact CD2-CE2 3.92Å; W822-F843 HydrophobicContact CD2-CE2 3.92Å; W822-F843 AromaticContact CD2-CG 3.76Å; W822-F843 HydrophobicContact CD2-CG 3.76Å; W822-F843 HydrophobicContact CD2-CZ 4.2Å; W822-F843 AromaticContact CE2-CD2 3.8Å; W822-F843 AromaticContact CE2-CE1 3.89Å; W822-F843 AromaticContact CE2-CE2 3.5Å; W822-F843 VanDerWaalsContact CE2-CE2 3.5Å; W822-F843 AromaticContact CE2-CZ 3.54Å; W822-F843 HydrophobicContact CE3-CB 4.23Å; W822-F843 AromaticContact CE3-CD1 3.92Å; W822-F843 HydrophobicContact CE3-CD1 3.92Å; W822-F843 HydrophobicContact CE3-CD2 4.32Å; W822-F843 HydrophobicContact CE3-CE1 4.33Å; W822-F843 AromaticContact CE3-CG 3.91Å; W822-F843 HydrophobicContact CE3-CG 3.91Å; W822-F843 HydrophobicContact CG-CB 4.4Å; W822-F843 AromaticContact CG-CD2 3.64Å; W822-F843 HydrophobicContact CG-CD2 3.64Å; W822-F843 HydrophobicContact CG-CE2 4.07Å; W822-F843 HydrophobicContact CG-CG 4.05Å; W822-F843 HydrophobicContact CH2-CD1 4.07Å; W822-F843 AromaticContact CH2-CE1 3.72Å; W822-F843 HydrophobicContact CH2-CE1 3.72Å; W822-F843 HydrophobicContact CH2-CZ 4.11Å; W822-F843 HydrophobicContact CZ2-CD1 4.2Å; W822-F843 AromaticContact CZ2-CE1 3.63Å; W822-F843 HydrophobicContact CZ2-CE1 3.63Å; W822-F843 AromaticContact CZ2-CE2 3.99Å; W822-F843 HydrophobicContact CZ2-CE2 3.99Å; W822-F843 AromaticContact CZ2-CZ 3.51Å; W822-F843 HydrophobicContact CZ2-CZ 3.51Å; W822-F843 AromaticContact CZ3-CD1 3.92Å; W822-F843 HydrophobicContact CZ3-CD1 3.92Å; W822-F843 HydrophobicContact CZ3-CE1 4.07Å; W822-F843 HydrophobicContact CZ3-CG 4.39Å; W822-F843 AromaticContact NE1-CD2 3.78Å; W822-F843 AromaticContact NE1-CE2 3.36Å; W822-F843 AromaticContact NE1-CZ 3.79Å; F830-F843 HydrophobicContact CD2-CB 3.86Å; F830-F843 HydrophobicContact CE2-CB 4.09Å; L841-F843 HydrophobicContact CD1-CD1 4.37Å; L841-F843 HydrophobicContact CD2-CE1 4.44Å; L841-F843 HydrophobicContact CG-CD1 4.11Å; L841-F843 HydrophobicContact CG-CE1 4.39Å; F843-F845 HydrophobicContact CD2-CE1 4.4Å; F843-F845 AromaticContact CE2-CE1 3.87Å; F843-F845 HydrophobicContact CE2-CE1 3.87Å; F843-F845 HydrophobicContact CE2-CZ 4.12Å
844	H	92.3	Very high	85	Confident	42 Å²	42	91.2 Å²	91.2	19%	0.194	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	158.1	167.5	-70.5	-84.7	0	0	0	109.9	H744 Q768 E823 H828	H744-H844 AromaticContact CD2-CE1 3.39Å; H744-H844 PolarHBondContact CD2-CE1 3.31Å; H744-H844 AromaticContact CD2-ND1 3.72Å; H744-H844 AromaticContact CG-CE1 3.86Å; Q768-H844 CarbonylContact O-C 3.57Å; Q768-H844 WeakPolarHBondContact O-CA 3.5Å; Q768-H844 PolarHBondContact O-ND1 3.4Å; E823-H844 PolarHBondContact N-O 3.05Å; H828-H844 PolarHBondContact O-CD2 2.9Å; H828-H844 VanDerWaalsContact O-CD2 3.31Å
845	F	92.2	Very high	84.7	Confident	11 Å²	11	93.6 Å²	93.6	5%	0.048	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	143	174	-64.2	-55.3	0	0	0	111.3	V767 Q768 Y770 V818 R820 E821 W822 F843 R847	V767-F845 HydrophobicContact CG1-CE2 3.99Å; Q768-F845 PolarHBondContact O-N 3.18Å; Y770-F845 HydrophobicContact CD2-CE2 4.24Å; Y770-F845 HydrophobicContact CD2-CZ 4.02Å; Y770-F845 AromaticContact CE2-CE2 3.88Å; Y770-F845 HydrophobicContact CE2-CE2 3.88Å; Y770-F845 AromaticContact CE2-CZ 3.73Å; Y770-F845 HydrophobicContact CE2-CZ 3.73Å; V818-F845 HydrophobicContact CB-CE2 3.96Å; V818-F845 HydrophobicContact CB-CZ 3.9Å; V818-F845 HydrophobicContact CG1-CE2 4.23Å; V818-F845 HydrophobicContact CG1-CZ 4.29Å; V818-F845 WeakPolarHBondContact O-CE1 3.31Å; V818-F845 WeakPolarHBondContact O-CZ 3.11Å; R820-F845 HydrophobicContact CB-CB 4.31Å; R820-F845 HydrophobicContact CB-CD1 3.52Å; R820-F845 HydrophobicContact CB-CD2 4.41Å; R820-F845 HydrophobicContact CB-CE1 3.82Å; R820-F845 HydrophobicContact CB-CG 3.85Å; R820-F845 HydrophobicContact CB-CZ 4.39Å; R820-F845 WeakPolarHBondContact O-CD1 3.45Å; R820-F845 WeakPolarHBondContact O-CE1 3.48Å; E821-F845 WeakPolarHBondContact O-CA 3.24Å; W822-F845 AromaticContact CD1-CD1 3.89Å; W822-F845 AromaticContact CD1-CE1 3.68Å; W822-F845 AromaticContact NE1-CE1 3.89Å; F843-F845 HydrophobicContact CD2-CE1 4.4Å; F843-F845 AromaticContact CE2-CE1 3.87Å; F843-F845 HydrophobicContact CE2-CE1 3.87Å; F843-F845 HydrophobicContact CE2-CZ 4.12Å; F845-R847 PolarHBondContact O-N 3.24Å
846	K	89.9	Confident	84.7	Confident	84 Å²	84	96.2 Å²	96.2	37%	0.365	40%	0.397	S	S	.	.			trans	-57.2	127.3	176	-68.1	-176.8	-173.9	172.3	0	110.7	E821 W822 E823 Y848	E821-K846 HydrophobicContact CB-CD 3.84Å; E821-K846 HydrophobicContact CB-CG 4.22Å; E821-K846 PolarHBondContact O-N 2.82Å; E821-K846 IonicContact OE2-NZ 3.38Å; E821-K846 PolarHBondContact OE2-NZ 3.24Å; W822-K846 VanDerWaalsContact O-CE 3.27Å; W822-K846 WeakPolarHBondContact O-CE 3.42Å; E823-K846 HydrophobicContact CB-CG 4.14Å; K846-Y848 HydrophobicContact CB-CE2 4.34Å; K846-Y848 PolarHBondContact O-N 3.31Å
847	R	83.9	Confident	84.7	Confident	138 Å²	138	91.8 Å²	91.8	52%	0.521	37%	0.366	S	S	.	.			trans	-91.6	99.3	177.2	-70.5	177.1	63.4	177.2	-0.5	111.3	E748 F845 R849	E748-R847 IonicContact OE1-CZ 3.57Å; E748-R847 IonicContact OE1-NE 2.81Å; E748-R847 PolarHBondContact OE1-NE 3.31Å; E748-R847 IonicContact OE1-NH2 3.87Å; E748-R847 PolarHBondContact OE1-NH2 3.43Å; F845-R847 PolarHBondContact O-N 3.24Å; R847-R849 PolarHBondContact O-N 3.43Å
848	Y	77.4	Confident	84.7	Confident	153 Å²	153	96.9 Å²	96.9	60%	0.6	38%	0.379	S	S	*	.			trans	-70.5	94.5	177.7	-71.6	-61.6	0	0	0	112.2	E821 K846 Y850	E821-Y848 PolarHBondContact OE1-OH 3.26Å; E821-Y848 PolarHBondContact OE2-OH 3.31Å; K846-Y848 HydrophobicContact CB-CE2 4.34Å; K846-Y848 PolarHBondContact O-N 3.31Å; Y848-Y850 PolarHBondContact O-N 3.43Å
849	R	74.9	Confident	84.4	Confident	220 Å²	220	102.1 Å²	102.1	83%	0.83	40%	0.397	S	S	*	.			trans	-71.2	91.3	173.8	-67.3	-172.6	-176.9	-176.1	2.5	110.8	R847 R851	R847-R849 PolarHBondContact O-N 3.43Å; R849-R851 PolarHBondContact O-N 2.53Å; R849-R851 VanDerWaalsContact O-N 3.13Å
850	Y	73.4	Confident	83.8	Confident	183 Å²	183	109.5 Å²	109.5	72%	0.718	43%	0.426	S	S	*	.			trans	-57.6	114.3	172	-179.7	-111.1	0	0	0	110.9	Y848 R852	Y848-Y850 PolarHBondContact O-N 3.43Å; Y850-R852 HydrophobicContact CD1-CG 4.32Å; Y850-R852 HydrophobicContact CE1-CG 3.44Å; Y850-R852 VanDerWaalsContact CE1-CG 3.44Å; Y850-R852 PolarHBondContact OH-NE 2.81Å
851	R	70.3	Confident	83	Confident	229 Å²	229	116.2 Å²	116.2	86%	0.864	45%	0.45	S	S	*	.			trans	-96.8	134.9	169	-76.3	176.1	157.2	169.8	-8.2	108.5	R849	R849-R851 PolarHBondContact O-N 2.53Å; R849-R851 VanDerWaalsContact O-N 3.13Å
852	R	61.3	Low	82.1	Confident	272 Å²	272	126.7 Å²	126.7	100%	1.026	49%	0.491	S	S	*	.			trans	-101.7	0	158.5	-71.9	-166.5	174.4	178.6	3.6	108.5	Y850	Y850-R852 HydrophobicContact CD1-CG 4.32Å; Y850-R852 HydrophobicContact CE1-CG 3.44Å; Y850-R852 VanDerWaalsContact CE1-CG 3.44Å; Y850-R852 PolarHBondContact OH-NE 2.81Å

Retrieved 852 of 852 residues in 197.3 ms (Link to these results)

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