A0A087XTT6_POEFO Loading...

SEC23 interacting protein

AlphaFold DB , UniProt , Accession A0A087XTT6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 957 aa.

						>A0A087XTT6_POEFO|A0A087XTT6
MADRKNNNVPNSSANLLFSAAPEFNFNLPFMPVSQATGPAVLSGEEDSTDVGEEDSFLGQTSGAAPASSSTFNYFSSPATTSDPFASIGQLPCPPSAMSAAAGPISVPHSISMAPTPPPPSVGSQINSPPQVFGGAVYQSPVGRHTPPPTAMTPPPPLMQPQAHNPYRHTPSSSRASPYIPAPEILPPTHMPPQIPYSVSAPPQMFPPSGPTFTTPPPSHLQAAPPPPPTATAGAVVPAGPMMPYNYNVYEPVQPHWFYCKQVESKSVWFPLSIIDSLQLEETFNSVQPDPENVIVRTDGGRYDVQLYDRMRSAVYWEEEPTEVRRCTWFYKGDKDSRFVPYSEEFSEKLEAEYKKAVSTNQWHRRLEFPSGETIVMHNPKVIVQFQPSSNPDEWGTTQDGQTRPRVVKRGVDDDHDEVPDGELPTVDHLVFMVHGIGPVCDLRFRSMIECVDDFRSVSLKLLHSHFKKSLDEHAISRVEFLPVQWHTALHGDATGVDRRIKKITLPSTGRLRHFTNETLLDVLFYNSPTYCQTIMDTVAQEINRLYALFMKRNPDYRGGISVAGHSLGSLILFDLLSNQKTVSAAPLLPAAPAANGEVSAPAAEEPSREEEEDQEEFEDLAAVLKHLGLSEYKSTLDQEKMDIESLLMCTMEDLKDMGIPLGPRKKITKFVKERVSRQAGRQQRKAEAKEESLAAVPQPAGSATTKPPVGSTVSSVHVNYNYFEVGTGQVSVIYHSLDFEPVNFFALGSPIGMFLTVRGLEKIDEAYQLPTCKGFFNIYHPLDPVAYRIEPMIVPDLDLKPVLIPHYKGRKRLHLELKESLSRMGSDLKHGFMSSLRSAWQTLNEFARAHTSSALQAELAIVANQIEEEEQHVHDEHKVAESAELQRDDEPQVKIGMLNGGNRIDFVLQEKPIESFNEYLFALQSHLCYWQSEDTALLLLKEIYKTVGIHPEPLAH
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	32.1	Very low	244 Å²	244	153.5 Å²	153.5	100%	1.202	81%	0.813	S	S	*	*				0	162.2	0	-78	-171.6	175.4	0	0	108.4
2	A	30	Very low	31.7	Very low	99 Å²	99	151.2 Å²	151.2	82%	0.818	82%	0.819	S	S	*	*			trans	73.4	118.6	-177.5	0	0	0	0	0	116
3	D	37.4	Very low	31.4	Very low	150 Å²	150	146.8 Å²	146.8	80%	0.802	81%	0.806	S	S	*	*			trans	-69.3	-173.1	166.4	-46.1	-105.5	0	0	0	110.9
4	R	34.1	Very low	31.3	Very low	213 Å²	213	142.6 Å²	142.6	80%	0.804	80%	0.8	S	S	*	*			cis	-179.3	135.2	40.2	-146.2	167.6	-165.2	-164.5	6.8	113.1
5	K	37.7	Very low	31.1	Very low	173 Å²	173	143.4 Å²	143.4	75%	0.752	80%	0.802	S	S	*	*			trans	60.7	157.7	144.6	-77.5	-164.9	167.5	-166.8	0	119.5
6	N	33.9	Very low	30.8	Very low	115 Å²	115	145.2 Å²	145.2	62%	0.615	81%	0.809	S	S	*	*			cis	-157.5	179.4	-3.7	-136.2	50.1	0	0	0	111.9
7	N	28.4	Very low	30.5	Very low	128 Å²	128	144.7 Å²	144.7	68%	0.684	80%	0.803	S	S	*	*			trans	84.1	89.5	154.7	-69.6	6.2	0	0	0	121.4
8	N	29.6	Very low	30.3	Very low	151 Å²	151	147.2 Å²	147.2	81%	0.807	81%	0.805	S	S	*	*				57	149.6	112	-70.4	14.6	0	0	0	125.1
9	V	29.1	Very low	30	Very low	139 Å²	139	145.6 Å²	145.6	84%	0.842	81%	0.805	S	S	*	*			trans	93	125.4	165.9	-167.9	0	0	0	0	114.4
10	P	32.6	Very low	29.9	Very low	120 Å²	120	143.4 Å²	143.4	78%	0.779	81%	0.807	S	S	*	*			trans	-97.3	157.4	-163.6	37.9	-36.7	0	0	0	115.4
11	N	27.5	Very low	29.8	Very low	156 Å²	156	140.9 Å²	140.9	83%	0.834	81%	0.805	S	S	*	*			trans	-72.6	154.5	166.7	-79	-10.2	0	0	0	112.3
12	S	27.5	Very low	29.6	Very low	126 Å²	126	134.8 Å²	134.8	88%	0.881	78%	0.783	S	S	*	*			trans	-131.9	107.5	159.4	-176.9	0	0	0	0	109
13	S	27.3	Very low	29.6	Very low	94 Å²	94	139.4 Å²	139.4	66%	0.657	79%	0.788	S	S	*	*			trans	-161.8	112.2	176.9	58.4	0	0	0	0	112.2
14	A	29.7	Very low	29	Very low	88 Å²	88	141.6 Å²	141.6	73%	0.727	79%	0.791	S	S	*	*			trans	58.7	144.1	153	0	0	0	0	0	121.4
15	N	28.1	Very low	28.5	Very low	155 Å²	155	138.1 Å²	138.1	83%	0.829	79%	0.788	S	S	*	*			trans	64.8	117.9	156.3	-55.2	-23	0	0	0	119.2
16	L	27	Very low	27.9	Very low	172 Å²	172	138.9 Å²	138.9	90%	0.901	79%	0.791	S	S	*	*				-164.1	144.1	115.1	-104.9	165.4	0	0	0	110.6
17	L	25.6	Very low	27.6	Very low	137 Å²	137	140.2 Å²	140.2	72%	0.717	80%	0.799	S	S	*	*			trans	-140	146.7	176.9	-117.7	178.1	0	0	0	108.4
18	F	26.7	Very low	27.7	Very low	189 Å²	189	141.3 Å²	141.3	83%	0.829	80%	0.804	S	S	*	*			trans	63.6	147.5	179	-57.3	-73	0	0	0	117.7
19	S	25.5	Very low	27.6	Very low	117 Å²	117	140.2 Å²	140.2	82%	0.818	81%	0.805	S	S	*	*			trans	-151.8	144.3	170.3	-175.7	0	0	0	0	109
20	A	26.9	Very low	27.6	Very low	101 Å²	101	143.2 Å²	143.2	84%	0.835	81%	0.807	S	S	*	*			trans	57.8	97.2	170.8	0	0	0	0	0	118.2
21	A	27.6	Very low	27.4	Very low	92 Å²	92	145.8 Å²	145.8	76%	0.76	81%	0.811	S	S	*	*			trans	-122.3	148.5	143.7	0	0	0	0	0	108
22	P	29.4	Very low	27.4	Very low	116 Å²	116	143.5 Å²	143.5	75%	0.753	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-75.3	152.4	179.3	31.4	-34.8	0	0	0	112.2
23	E	29.7	Very low	27.5	Very low	195 Å²	195	143.9 Å²	143.9	91%	0.911	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-78.1	120.8	-175	-60	177.7	150.8	0	0	112.1
24	F	25.2	Very low	27.5	Very low	197 Å²	197	145 Å²	145	86%	0.864	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-101.1	134.2	162.3	-88.8	-91.3	0	0	0	109.7
25	N	23.6	Very low	27.5	Very low	140 Å²	140	149.5 Å²	149.5	75%	0.749	82%	0.815	S	S	*	*			trans	-126.5	107.2	-167.2	-162.2	-9.8	0	0	0	111
26	F	26.1	Very low	27.5	Very low	188 Å²	188	147 Å²	147	83%	0.825	82%	0.815	S	S	*	*			trans	-84.6	113.3	-178.3	-90.8	-89.6	0	0	0	111.8
27	N	26.5	Very low	27.5	Very low	144 Å²	144	146 Å²	146	77%	0.77	82%	0.816	S	S	*	*			trans	-109.2	115.7	162.6	-82.2	-62.5	0	0	0	109.7
28	L	29.7	Very low	27.6	Very low	151 Å²	151	142.4 Å²	142.4	79%	0.791	81%	0.813	S	S	*	*			trans	-95.2	128	172.8	-75.2	167.1	0	0	0	110
29	P	28.1	Very low	27.8	Very low	128 Å²	128	140 Å²	140	83%	0.831	82%	0.816	S	S	*	*			trans	-72.2	136.7	171.9	30.1	-33.2	0	0	0	110.6
30	F	30.4	Very low	27.9	Very low	201 Å²	201	138.8 Å²	138.8	88%	0.882	81%	0.813	S	S	*	*			trans	-113.1	112.8	-174.7	-147.3	-79.7	0	0	0	110
31	M	27.3	Very low	27.8	Very low	175 Å²	175	140 Å²	140	86%	0.862	81%	0.81	S	S	*	*			trans	-139.3	153.5	171.2	-88.1	-158.7	70.9	0	0	112.3
32	P	27.3	Very low	27.8	Very low	107 Å²	107	143.5 Å²	143.5	70%	0.695	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-90.6	147.7	-158.6	34.7	-36.1	0	0	0	114.4
33	V	29.7	Very low	27.7	Very low	134 Å²	134	144.3 Å²	144.3	81%	0.812	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-85.7	121.5	167.5	-179.7	0	0	0	0	109.5	Q35	V33-Q35 PolarHBondContact O-N 3.06Å
34	S	27.1	Very low	27.5	Very low	117 Å²	117	138.1 Å²	138.1	82%	0.818	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-70	118.7	172.2	-58.2	0	0	0	0	110.8
35	Q	30.2	Very low	27.6	Very low	183 Å²	183	137.6 Å²	137.6	86%	0.855	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-77.1	132.4	173.5	-69.9	-178.2	-22.8	0	0	111.1	V33	V33-Q35 PolarHBondContact O-N 3.06Å
36	A	27.1	Very low	27.8	Very low	102 Å²	102	139.4 Å²	139.4	84%	0.843	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-73	137.6	160.7	0	0	0	0	0	109.2
37	T	28.8	Very low	27.9	Very low	151 Å²	151	138.1 Å²	138.1	93%	0.926	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-88	125.9	-169.1	34.6	0	0	0	0	113.6
38	G	26.5	Very low	27.9	Very low	62 Å²	62	136.2 Å²	136.2	64%	0.639	82%	0.816	S	S	*	*			trans	-133.1	151.3	164.6	0	0	0	0	0	109.3
39	P	30.1	Very low	28.1	Very low	138 Å²	138	135.6 Å²	135.6	90%	0.896	82%	0.819	S	S	*	*			trans	-75.1	141.1	-159.8	28.5	-35.5	0	0	0	114.2
40	A	28.5	Very low	28.2	Very low	92 Å²	92	136.4 Å²	136.4	76%	0.76	82%	0.816	S	S	*	*			trans	-104.1	144.8	176.7	0	0	0	0	0	112.2
41	V	25.9	Very low	28.3	Very low	128 Å²	128	133.7 Å²	133.7	78%	0.776	82%	0.816	S	S	*	*			trans	-139.9	100.7	167.5	-179.1	0	0	0	0	104.2
42	L	25.7	Very low	28.3	Very low	165 Å²	165	128.5 Å²	128.5	86%	0.864	81%	0.807	S	S	*	*				58.3	97.8	94.2	-64.4	176	0	0	0	112.3
43	S	28.4	Very low	28.6	Very low	133 Å²	133	133 Å²	133	93%	0.93	82%	0.819	S	S	*	*			trans	-89.4	135.1	170.1	-42.6	0	0	0	0	110
44	G	25.3	Very low	28.6	Very low	65 Å²	65	135.6 Å²	135.6	67%	0.67	82%	0.822	S	S	*	*			trans	-164.6	132.4	170.2	0	0	0	0	0	110.1
45	E	27.5	Very low	28.7	Very low	185 Å²	185	136.5 Å²	136.5	86%	0.864	82%	0.818	S	S	*	*			trans	62.3	150.4	172.8	-64.2	162.1	-176.7	0	0	114.4
46	E	27.4	Very low	28.9	Very low	178 Å²	178	133.8 Å²	133.8	83%	0.832	82%	0.819	S	S	*	*			cis	-155.3	144.3	-14	-125.5	177	-173.5	0	0	107
47	D	29	Very low	28.9	Very low	162 Å²	162	137.4 Å²	137.4	87%	0.866	82%	0.816	S	S	*	*			trans	-158	150.5	145.9	-150.6	-15.5	0	0	0	110.2
48	S	26.9	Very low	29.1	Very low	103 Å²	103	137.7 Å²	137.7	72%	0.72	81%	0.811	S	S	*	*			trans	-142.8	129.3	-174.7	76.7	0	0	0	0	112.3
49	T	33.4	Very low	29.3	Very low	139 Å²	139	137.9 Å²	137.9	85%	0.853	81%	0.813	S	S	*	*			trans	-127.1	105.5	163.6	57.2	0	0	0	0	109.6
50	D	28.8	Very low	29.3	Very low	144 Å²	144	140.3 Å²	140.3	77%	0.77	81%	0.812	S	S	*	*			trans	-54.3	136.4	176	170.9	34.8	0	0	0	113.8	G52	D50-G52 PolarHBondContact OD1-N 3.18Å
51	V	33.1	Very low	29.3	Very low	145 Å²	145	141.6 Å²	141.6	88%	0.879	81%	0.811	S	S	*	*			trans	-152.9	98.8	139.8	-98.6	0	0	0	0	107.9
52	G	28.2	Very low	29.5	Very low	66 Å²	66	141.5 Å²	141.5	68%	0.68	82%	0.816	S	S	*	*			trans	-77.9	154.3	-179.9	0	0	0	0	0	115.6	D50	D50-G52 PolarHBondContact OD1-N 3.18Å
53	E	32.6	Very low	29.5	Very low	201 Å²	201	137 Å²	137	94%	0.939	81%	0.81	S	S	*	*			trans	-127.3	157.7	158.8	-72.1	-173.1	-150.8	0	0	108.8
54	E	30.4	Very low	29.4	Very low	188 Å²	188	136.2 Å²	136.2	88%	0.879	81%	0.811	S	S	*	*			trans	-114.8	162.6	-150.7	64.9	-157.2	125.3	0	0	116.6
55	D	29.2	Very low	29.4	Very low	137 Å²	137	137.7 Å²	137.7	73%	0.733	82%	0.817	S	S	*	*			trans	67.5	111.5	156.1	-136.4	0.9	0	0	0	121.1
56	S	34.9	Very low	30.2	Very low	125 Å²	125	135 Å²	135	87%	0.874	82%	0.815	S	S	*	*			trans	-168	78.2	138.4	-84.8	0	0	0	0	113.5
57	F	26.3	Very low	30.3	Very low	179 Å²	179	131 Å²	131	79%	0.785	81%	0.813	S	S	*	*			trans	13.7	145	141.9	-144.3	-125.1	0	0	0	122.9
58	L	33.3	Very low	30.4	Very low	156 Å²	156	128.4 Å²	128.4	82%	0.817	81%	0.807	S	S	*	*			trans	79.5	133.1	172	-52.7	171.9	0	0	0	117.6
59	G	29.9	Very low	30.4	Very low	66 Å²	66	129 Å²	129	68%	0.68	81%	0.811	S	S	*	*			cis	150.5	136.1	-13.6	0	0	0	0	0	115.1
60	Q	31.3	Very low	30.2	Very low	189 Å²	189	126.8 Å²	126.8	88%	0.883	80%	0.802	S	S	*	*			trans	66.5	150.2	166.4	-56.2	-178.5	-5.2	0	0	116.9
61	T	28.1	Very low	30.2	Very low	120 Å²	120	125.1 Å²	125.1	74%	0.736	80%	0.797	S	S	*	*			cis	-159.3	164.6	-19.6	20.1	0	0	0	0	109.5
62	S	29.5	Very low	29.9	Very low	125 Å²	125	127.4 Å²	127.4	87%	0.874	80%	0.795	S	S	*	*			trans	-13.7	146.8	159.7	-41.9	0	0	0	0	119.1
63	G	26	Very low	30	Very low	72 Å²	72	130.3 Å²	130.3	74%	0.742	80%	0.795	S	S	*	*			cis	157.4	-152.8	4.8	0	0	0	0	0	112
64	A	25.5	Very low	29.7	Very low	116 Å²	116	129.5 Å²	129.5	96%	0.959	79%	0.785	S	S	*	*			trans	84.9	151.3	176.2	0	0	0	0	0	118.7
65	A	26.2	Very low	29.4	Very low	95 Å²	95	130.1 Å²	130.1	79%	0.785	79%	0.785	S	S	*	*			trans	-115.8	-157.9	-174.1	0	0	0	0	0	109.6
66	P	43.3	Very low	29.4	Very low	129 Å²	129	127 Å²	127	84%	0.838	77%	0.774	S	S	*	*			cis	-142.3	-169.7	16.3	45	-23.6	0	0	0	117.6
67	A	30.2	Very low	29.2	Very low	95 Å²	95	126.8 Å²	126.8	79%	0.785	77%	0.772	S	S	*	*			trans	-64.2	155.5	-173.1	0	0	0	0	0	119.6
68	S	30.8	Very low	29.7	Very low	106 Å²	106	124.2 Å²	124.2	74%	0.741	77%	0.774	S	S	*	*			trans	-165	136.2	132.6	7.1	0	0	0	0	107.6
69	S	27.9	Very low	29.8	Very low	115 Å²	115	121.2 Å²	121.2	80%	0.804	77%	0.772	S	S	*	*				70.1	139.5	55.9	99.9	0	0	0	0	112.5
70	S	29.5	Very low	29.8	Very low	93 Å²	93	125.1 Å²	125.1	65%	0.65	78%	0.783	S	S	*	*			cis	-168.5	169	7.5	-168.4	0	0	0	0	111.8
71	T	28.9	Very low	29.7	Very low	109 Å²	109	122.6 Å²	122.6	67%	0.669	78%	0.78	S	S	*	*			trans	66.8	162.9	152.8	35.3	0	0	0	0	119.3
72	F	26.9	Very low	29.9	Very low	193 Å²	193	122.7 Å²	122.7	85%	0.846	79%	0.786	S	S	*	*			cis	-127.9	168.5	8.6	-129.3	-77.4	0	0	0	113.4
73	N	28.7	Very low	30.2	Very low	128 Å²	128	122.1 Å²	122.1	68%	0.684	77%	0.773	S	S	*	*			trans	-149.9	168.2	-163	-151.6	-10.4	0	0	0	112.4
74	Y	26.9	Very low	30.6	Very low	183 Å²	183	124 Å²	124	72%	0.718	77%	0.772	S	S	*	*			trans	72.7	131.2	162.5	-93.6	-112.2	0	0	0	123.2
75	F	24.1	Very low	31	Very low	202 Å²	202	127.5 Å²	127.5	89%	0.886	77%	0.766	S	S	*	*				174.8	89.3	119.7	-98.8	-76.3	0	0	0	107.2
76	S	28.2	Very low	31.4	Very low	71 Å²	71	126.7 Å²	126.7	50%	0.497	76%	0.759	S	S	.	*				77.6	96.9	70.1	77.3	0	0	0	0	117.3
77	S	31.9	Very low	30.7	Very low	120 Å²	120	125.8 Å²	125.8	84%	0.839	76%	0.756	S	S	*	*			trans	63.4	164.2	149.5	-58.2	0	0	0	0	119.6
78	P	36.8	Very low	30.8	Very low	125 Å²	125	129.6 Å²	129.6	81%	0.812	76%	0.762	S	S	*	*			cis	-126.5	-161.5	4.9	44	-27.5	0	0	0	114.3
79	A	36.1	Very low	30.7	Very low	94 Å²	94	127.6 Å²	127.6	78%	0.777	76%	0.758	S	S	*	*			trans	-94.3	150.6	-179	0	0	0	0	0	114.5
80	T	28.1	Very low	30.8	Very low	148 Å²	148	130.5 Å²	130.5	91%	0.908	76%	0.758	S	S	*	*			trans	-158.6	168.1	159.7	11.3	0	0	0	0	111.4
81	T	31.3	Very low	30.7	Very low	135 Å²	135	133.2 Å²	133.2	83%	0.828	77%	0.765	S	S	*	*			trans	-96.6	144.7	-171.4	53	0	0	0	0	114.6
82	S	30.6	Very low	31	Very low	123 Å²	123	133.2 Å²	133.2	86%	0.86	77%	0.767	S	S	*	*			trans	-167.5	143.9	140.7	41.5	0	0	0	0	113.2
83	D	36.3	Very low	31.5	Very low	112 Å²	112	130.1 Å²	130.1	60%	0.599	77%	0.767	S	S	*	*			trans	-107.8	130.5	169.4	159.1	33.2	0	0	0	108.8	F85 A86	D83-F85 PolarHBondContact OD1-N 3Å; D83-A86 WeakPolarHBondContact OD2-CB 3.31Å
84	P	33.9	Very low	31.7	Very low	113 Å²	113	128.8 Å²	128.8	73%	0.734	77%	0.766	S	S	*	*	S	Bend	trans	-102.4	9.2	179.2	38.9	-33.7	0	0	0	116
85	F	33.5	Very low	32.2	Very low	188 Å²	188	125.8 Å²	125.8	83%	0.825	77%	0.769	S	S	*	*			trans	-123.2	13.2	-178.8	-85.9	-72.4	0	0	0	116.9	D83 S87	D83-F85 PolarHBondContact OD1-N 3Å; F85-S87 PolarHBondContact O-N 3.1Å
86	A	34.6	Very low	32.9	Very low	78 Å²	78	122.1 Å²	122.1	65%	0.645	77%	0.768	S	S	*	*			trans	-72.8	76	169.1	0	0	0	0	0	114.6	D83	D83-A86 WeakPolarHBondContact OD2-CB 3.31Å
87	S	29.9	Very low	32.9	Very low	110 Å²	110	123.8 Å²	123.8	77%	0.769	79%	0.786	S	S	*	*			trans	176.1	118.9	155.5	-79.9	0	0	0	0	107.6	F85	F85-S87 PolarHBondContact O-N 3.1Å
88	I	31.7	Very low	32.7	Very low	176 Å²	176	126.7 Å²	126.7	90%	0.903	79%	0.789	S	S	*	*			cis	-144.6	154.7	45	-66.1	152.5	0	0	0	107.6
89	G	29.8	Very low	32.3	Very low	64 Å²	64	126.7 Å²	126.7	66%	0.66	79%	0.792	S	S	*	*			cis	157.5	67.9	0.6	0	0	0	0	0	113.9
90	Q	29.4	Very low	32	Very low	175 Å²	175	127.1 Å²	127.1	82%	0.818	80%	0.795	S	S	*	*			trans	65.8	122.1	155.9	-64.2	-170.4	-9.8	0	0	122.9
91	L	28.3	Very low	31.9	Very low	151 Å²	151	124.6 Å²	124.6	79%	0.791	79%	0.79	S	S	*	*			trans	64.2	164.5	130.2	-66	168.1	0	0	0	120.7
92	P	33.4	Very low	31.8	Very low	109 Å²	109	123.1 Å²	123.1	71%	0.708	79%	0.791	S	S	*	*			cis	-125.8	172.9	-29.4	36.7	-21.9	0	0	0	113.3
93	C	37.1	Very low	31.6	Very low	127 Å²	127	120.7 Å²	120.7	86%	0.858	79%	0.785	S	S	*	*			trans	-105.5	124.1	164.6	179.6	0	0	0	0	110.6
94	P	33.3	Very low	31.9	Very low	101 Å²	101	120.7 Å²	120.7	66%	0.656	79%	0.791	S	S	*	*			trans	-148.4	-163.7	136.2	40.8	-22.2	0	0	0	111.8
95	P	37.8	Very low	31.6	Very low	120 Å²	120	122.7 Å²	122.7	78%	0.779	79%	0.794	S	S	*	*				-126.2	-176.1	-83.4	40.7	-24.1	0	0	0	113.3
96	S	38.9	Very low	31.3	Very low	125 Å²	125	118.5 Å²	118.5	87%	0.874	79%	0.788	S	S	*	*			trans	-71.7	139	175	-48.9	0	0	0	0	113.9
97	A	27.8	Very low	31.2	Very low	105 Å²	105	120.6 Å²	120.6	87%	0.868	79%	0.793	S	S	*	*			trans	-155.1	161	167.1	0	0	0	0	0	111.9
98	M	28	Very low	31.5	Very low	181 Å²	181	120.6 Å²	120.6	89%	0.892	79%	0.79	S	S	*	*			trans	-114.8	148.3	-176.4	-58	166	62.8	0	0	112.1
99	S	28.8	Very low	31.4	Very low	125 Å²	125	120.4 Å²	120.4	87%	0.874	79%	0.785	S	S	*	*				168.3	163.7	129.9	-79.7	0	0	0	0	115.6
100	A	28.7	Very low	31.6	Very low	103 Å²	103	122.3 Å²	122.3	85%	0.851	79%	0.788	S	S	*	*			trans	-59.1	169.9	177.8	0	0	0	0	0	115.1
101	A	27.8	Very low	31.7	Very low	96 Å²	96	121.6 Å²	121.6	79%	0.793	79%	0.788	S	S	*	*			cis	-148.2	-168	14	0	0	0	0	0	110.1
102	A	28.8	Very low	31.6	Very low	103 Å²	103	120.1 Å²	120.1	85%	0.851	79%	0.791	S	S	*	*			cis	-155.9	-163	11.4	0	0	0	0	0	111.9
103	G	26.1	Very low	31.6	Very low	72 Å²	72	123.4 Å²	123.4	74%	0.742	80%	0.799	S	S	*	*			trans	-91.2	-165.7	174	0	0	0	0	0	114.6
104	P	42.6	Very low	31.5	Very low	112 Å²	112	121.6 Å²	121.6	73%	0.727	79%	0.793	S	S	*	*			cis	-143.5	-178.7	30	44.7	-26.9	0	0	0	117.7
105	I	27.4	Very low	31.7	Very low	156 Å²	156	122.4 Å²	122.4	80%	0.8	80%	0.798	S	S	*	*			trans	63.9	136.6	149.6	-74.6	159.1	0	0	0	118.4
106	S	27.3	Very low	31.7	Very low	100 Å²	100	123.3 Å²	123.3	70%	0.699	80%	0.802	S	S	*	*			cis	-165.9	163.7	-14.4	-90.2	0	0	0	0	109.6
107	V	31.9	Very low	31.9	Very low	121 Å²	121	122.6 Å²	122.6	73%	0.733	79%	0.794	S	S	*	*			trans	-139.1	131.2	-179.5	-163.5	0	0	0	0	113	H109	V107-H109 PolarHBondContact O-ND1 2.86Å
108	P	36.3	Very low	32.9	Very low	110 Å²	110	123.5 Å²	123.5	71%	0.714	79%	0.791	S	S	*	*			trans	-85.4	131	163.4	33.8	-30.4	0	0	0	110.6
109	H	31.1	Very low	33.9	Very low	173 Å²	173	120.7 Å²	120.7	80%	0.801	79%	0.787	S	S	*	*				63.4	133.6	58.2	-70.7	75.1	0	0	0	112.7	V107	V107-H109 PolarHBondContact O-ND1 2.86Å
110	S	33.3	Very low	34.9	Very low	103 Å²	103	120.1 Å²	120.1	72%	0.72	78%	0.78	S	S	*	*			cis	-153.7	178.8	8	-36.1	0	0	0	0	109.7
111	I	31	Very low	35.1	Very low	160 Å²	160	120.5 Å²	120.5	82%	0.821	78%	0.776	S	S	*	*			cis	-148.3	154.3	-1.8	-28	158.3	0	0	0	107.6
112	S	25.7	Very low	35.4	Very low	120 Å²	120	122.9 Å²	122.9	84%	0.839	78%	0.781	S	S	*	*			trans	-157.6	159.1	141.8	-162.2	0	0	0	0	111.3
113	M	33.5	Very low	35.5	Very low	178 Å²	178	121.4 Å²	121.4	88%	0.877	78%	0.775	S	S	*	*			trans	-112.1	154.5	-171.8	-82	-71.9	-151.2	0	0	113.4
114	A	35.4	Very low	35.7	Very low	89 Å²	89	122.9 Å²	122.9	74%	0.736	77%	0.774	S	S	*	*			trans	-95.3	154.9	-176.3	0	0	0	0	0	114.2
115	P	38.7	Very low	35	Very low	119 Å²	119	126 Å²	126	77%	0.773	78%	0.779	S	S	*	*			trans	-95.6	161.1	164.8	37	-32.2	0	0	0	112.7
116	T	35.7	Very low	35.1	Very low	138 Å²	138	125.7 Å²	125.7	85%	0.847	78%	0.778	S	S	*	*			trans	-131.5	-160.8	170.4	60.9	0	0	0	0	110.1
117	P	44.8	Very low	35.1	Very low	111 Å²	111	128.1 Å²	128.1	72%	0.721	78%	0.783	S	S	*	*			trans	-97.5	169.9	-133.6	24	-2.2	0	0	0	115.7
118	P	47.7	Very low	35.2	Very low	124 Å²	124	128 Å²	128	81%	0.805	79%	0.787	S	S	*	*			trans	-78.4	154.5	177.4	31.9	-35.8	0	0	0	114.5
119	P	49.6	Very low	35.4	Very low	122 Å²	122	128.3 Å²	128.3	79%	0.792	79%	0.789	S	S	*	*			trans	-101.2	175.1	-174.6	40	-37.4	0	0	0	115.6
120	P	48.8	Very low	36.1	Very low	112 Å²	112	126.2 Å²	126.2	73%	0.727	79%	0.791	S	S	*	*			trans	-117.8	169.9	-174.2	41.7	-32.6	0	0	0	117.1
121	S	34.2	Very low	36.1	Very low	112 Å²	112	130.3 Å²	130.3	78%	0.783	80%	0.799	S	S	*	*			trans	76	156.7	154.5	83.7	0	0	0	0	118.8
122	V	33.7	Very low	36	Very low	146 Å²	146	129.5 Å²	129.5	89%	0.885	80%	0.801	S	S	*	*			cis	-165.9	153.8	-14.5	123.6	0	0	0	0	111.8
123	G	30.3	Very low	36.2	Very low	72 Å²	72	133.8 Å²	133.8	74%	0.742	81%	0.805	S	S	*	*			trans	107.8	152.4	156.1	0	0	0	0	0	117.7
124	S	30.3	Very low	35.8	Very low	103 Å²	103	128.9 Å²	128.9	72%	0.72	80%	0.8	S	S	*	*			cis	-167.1	135.7	-4	-174.7	0	0	0	0	113.7
125	Q	28.6	Very low	35.4	Very low	177 Å²	177	128.2 Å²	128.2	83%	0.827	80%	0.802	S	S	*	*			trans	62.6	155.9	162.9	-65.4	176.7	13.1	0	0	117.5
126	I	29.1	Very low	34.8	Very low	150 Å²	150	127.4 Å²	127.4	77%	0.769	81%	0.805	S	S	*	*			cis	-145.1	160.6	42.6	-78.1	173.8	0	0	0	113.7
127	N	27.4	Very low	34.4	Very low	150 Å²	150	127.2 Å²	127.2	80%	0.802	80%	0.803	S	S	*	*			trans	-41	156.5	-179.2	-53.1	-28.1	0	0	0	120.9
128	S	33.5	Very low	33.5	Very low	118 Å²	118	131.6 Å²	131.6	83%	0.825	81%	0.807	S	S	*	*			trans	-121.4	144.1	160.4	-47.2	0	0	0	0	112.1
129	P	40	Very low	32.4	Very low	118 Å²	118	133.8 Å²	133.8	77%	0.766	81%	0.807	S	S	*	*			trans	-123.7	179.3	163.9	43.8	-31.7	0	0	0	111.6
130	P	46.9	Very low	31.4	Very low	129 Å²	129	133.1 Å²	133.1	84%	0.838	81%	0.805	S	S	*	*				-129.6	-169.4	-85.1	34.8	-13.8	0	0	0	115.3
131	Q	33.8	Very low	31	Very low	188 Å²	188	133.3 Å²	133.3	88%	0.879	81%	0.806	S	S	*	*			trans	-81.1	168.2	-166.7	-49.7	162.9	-84.8	0	0	116.6
132	V	28.9	Very low	30.8	Very low	143 Å²	143	134.5 Å²	134.5	87%	0.867	81%	0.808	S	S	*	*			trans	-135.5	154.7	149.8	-176.9	0	0	0	0	110.9
133	F	28.4	Very low	30.6	Very low	210 Å²	210	130.6 Å²	130.6	92%	0.921	80%	0.798	S	S	*	*			trans	-57	167.8	-175.4	-81.1	-128.7	0	0	0	116.6
134	G	26.6	Very low	30.5	Very low	75 Å²	75	139 Å²	139	77%	0.773	81%	0.807	S	S	*	*			cis	153	156.3	-5.4	0	0	0	0	0	115.1
135	G	25.7	Very low	30.4	Very low	76 Å²	76	142.4 Å²	142.4	78%	0.784	81%	0.811	S	S	*	*			trans	116.2	109.3	178	0	0	0	0	0	113.1
136	A	27.7	Very low	30.3	Very low	101 Å²	101	140.3 Å²	140.3	84%	0.835	81%	0.811	S	S	*	*				73	129.7	72.2	0	0	0	0	0	112.8
137	V	25.5	Very low	30.4	Very low	134 Å²	134	138.6 Å²	138.6	81%	0.812	81%	0.809	S	S	*	*			cis	-141.4	157.7	31.8	173	0	0	0	0	113.7
138	Y	27.2	Very low	30.8	Very low	203 Å²	203	137.3 Å²	137.3	80%	0.796	81%	0.809	S	S	*	*			trans	-34.5	168.5	164.3	-68.1	-95.1	0	0	0	118
139	Q	23.9	Very low	30.6	Very low	171 Å²	171	137.7 Å²	137.7	80%	0.799	81%	0.809	S	S	*	*			cis	-160.3	149.9	25.6	-150.1	141.7	35.8	0	0	114.7
140	S	29.4	Very low	30.4	Very low	108 Å²	108	139.1 Å²	139.1	76%	0.755	82%	0.816	S	S	*	*			trans	-111.7	173.1	155.2	-37.8	0	0	0	0	108.3
141	P	40.2	Very low	29.6	Very low	115 Å²	115	137.5 Å²	137.5	75%	0.747	81%	0.813	S	S	*	*				-169.4	-176.6	75.8	47.5	-25.3	0	0	0	120
142	V	29.9	Very low	29.8	Very low	138 Å²	138	138 Å²	138	84%	0.836	82%	0.817	S	S	*	*			trans	64.7	138.5	154	-172.7	0	0	0	0	121
143	G	29.3	Very low	30	Very low	64 Å²	64	137.5 Å²	137.5	66%	0.66	82%	0.815	S	S	*	*			trans	-138	172.4	156.2	0	0	0	0	0	112.4
144	R	28.2	Very low	30.1	Very low	248 Å²	248	132.9 Å²	132.9	94%	0.936	81%	0.806	S	S	*	*			trans	-164.1	170.4	171.8	-112.7	173	-174.7	-164.2	0.2	112.7
145	H	28.6	Very low	30.4	Very low	175 Å²	175	134.7 Å²	134.7	81%	0.81	80%	0.804	S	S	*	*			trans	-105.1	172.6	-166.4	-65	-94.9	0	0	0	116
146	T	25.8	Very low	30.7	Very low	133 Å²	133	136.6 Å²	136.6	82%	0.816	80%	0.803	S	S	*	*			trans	79.9	157.2	163.5	74.8	0	0	0	0	117.8
147	P	30.8	Very low	31	Very low	114 Å²	114	137.8 Å²	137.8	74%	0.74	80%	0.802	S	S	*	*			cis	-122.9	179.4	-40.1	37	-22	0	0	0	111.6
148	P	35.9	Very low	31.4	Very low	123 Å²	123	139.6 Å²	139.6	80%	0.799	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-90.7	149.5	-167.7	34.9	-35.5	0	0	0	115.7
149	P	29.2	Very low	31.5	Very low	125 Å²	125	138.3 Å²	138.3	81%	0.812	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-96.2	146.6	165.3	36.2	-31.4	0	0	0	112.8
150	T	36.3	Very low	31.7	Very low	149 Å²	149	138.6 Å²	138.6	91%	0.914	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-84.4	121	174.7	48.3	0	0	0	0	112.6
151	A	30.7	Very low	32.2	Very low	94 Å²	94	139.4 Å²	139.4	78%	0.777	81%	0.814	S	S	*	*			trans	-150.8	147	159.6	0	0	0	0	0	109.3
152	M	38.5	Very low	32.1	Very low	198 Å²	198	142 Å²	142	98%	0.975	82%	0.816	S	S	*	*			trans	-91.7	138	178.6	-60.6	-171.3	79.5	0	0	111.3
153	T	31.3	Very low	32.3	Very low	133 Å²	133	139.3 Å²	139.3	82%	0.816	81%	0.808	S	S	*	*			trans	-123.1	137.1	169.4	-0.9	0	0	0	0	108.3
154	P	32.3	Very low	33	Very low	113 Å²	113	142.1 Å²	142.1	73%	0.734	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-71.2	159.3	-179.2	30.2	-35.7	0	0	0	112.1
155	P	32	Very low	34.3	Very low	114 Å²	114	130.6 Å²	130.6	74%	0.74	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-62.8	155.5	171.8	28.6	-35.5	0	0	0	111.5
156	P	32.9	Very low	35.4	Very low	116 Å²	116	126.5 Å²	126.5	75%	0.753	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-65.9	159.2	-180	28.7	-35.7	0	0	0	112.2
157	P	33.1	Very low	36.8	Very low	126 Å²	126	124.8 Å²	124.8	82%	0.818	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-60.7	151.1	176.9	-21.6	33.7	0	0	0	112.9
158	L	33.4	Very low	37.8	Very low	172 Å²	172	123.3 Å²	123.3	90%	0.901	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-52.7	142.7	170.5	-76.8	146.6	0	0	0	111.5
159	M	30.3	Very low	38.2	Very low	176 Å²	176	122.8 Å²	122.8	87%	0.867	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-54.4	138.8	170.2	-69.6	169.6	64	0	0	110.4
160	Q	28.6	Very low	38.8	Very low	176 Å²	176	119.5 Å²	119.5	82%	0.822	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-63.4	146.3	168.5	-69.7	179.6	-41.6	0	0	109.6	Q162	Q160-Q162 PolarHBondContact O-N 2.94Å
161	P	37.9	Very low	39	Very low	126 Å²	126	117.5 Å²	117.5	82%	0.818	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-60.5	135	173	26.4	-33.6	0	0	0	109.8
162	Q	38	Very low	39.5	Very low	170 Å²	170	117.3 Å²	117.3	79%	0.794	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-56.1	146.7	176.7	-69	162.5	-60.8	0	0	110.8	Q160 H164	Q160-Q162 PolarHBondContact O-N 2.94Å; Q162-H164 PolarHBondContact O-N 2.93Å
163	A	34.8	Very low	39.6	Very low	80 Å²	80	109.1 Å²	109.1	66%	0.661	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-58.1	123.4	174.5	0	0	0	0	0	109.7	N165	A163-N165 PolarHBondContact O-N 2.89Å
164	H	44.1	Very low	40	Very low	124 Å²	124	106.7 Å²	106.7	57%	0.574	61%	0.606	S	S	*	*			trans	-81.4	113.9	-170.1	-161.4	88.2	0	0	0	110.3	Q162 P166 H169	Q162-H164 PolarHBondContact O-N 2.93Å; H164-P166 WeakPolarHBondContact O-CD 3.32Å; H164-H169 AromaticContact NE2-CD2 3.9Å; H164-H169 AromaticContact NE2-NE2 3.85Å
165	N	55.3	Low	40.2	Very low	5 Å²	5	111.3 Å²	111.3	3%	0.027	61%	0.609	C	S	.	*			trans	-59.3	117.2	173.9	178.9	-1.9	0	0	0	109.6	A163 Y167 R168 F284 S286 Y308	A163-N165 PolarHBondContact O-N 2.89Å; N165-Y167 PolarHBondContact O-N 2.88Å; N165-Y167 WeakPolarHBondContact OD1-CD2 3.5Å; N165-Y167 PolarHBondContact OD1-N 2.91Å; N165-R168 VanDerWaalsContact O-CB 3.26Å; N165-R168 WeakPolarHBondContact O-CB 3.36Å; N165-R168 PolarHBondContact O-N 2.95Å; N165-F284 PolarHBondContact ND2-O 2.7Å; N165-S286 PolarHBondContact ND2-O 2.84Å; N165-Y308 PolarHBondContact ND2-OH 2.81Å
166	P	52.8	Low	40.1	Very low	89 Å²	89	110.7 Å²	110.7	58%	0.578	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-68.4	-21.8	-176.4	28.3	-35.4	0	0	0	113.3	H164 R168	H164-P166 WeakPolarHBondContact O-CD 3.32Å; P166-R168 PolarHBondContact O-N 3.08Å
167	Y	53.8	Low	39.9	Very low	98 Å²	98	109.8 Å²	109.8	38%	0.384	61%	0.61	S	S	.	*	G	3₁₀ helix	trans	-78.3	-1.9	179.5	-58.6	-73	0	0	0	113.5	N165 H169 T170 P291	N165-Y167 PolarHBondContact O-N 2.88Å; N165-Y167 WeakPolarHBondContact OD1-CD2 3.5Å; N165-Y167 PolarHBondContact OD1-N 2.91Å; Y167-H169 PolarHBondContact O-N 3.24Å; Y167-H169 VanDerWaalsContact O-N 3.12Å; Y167-T170 PolarHBondContact O-OG1 3.29Å; Y167-P291 HydrophobicContact CD1-CB 4.25Å; Y167-P291 HydrophobicContact CD1-CG 3.95Å; Y167-P291 HydrophobicContact CD2-CB 4.09Å; Y167-P291 HydrophobicContact CD2-CG 4.16Å; Y167-P291 HydrophobicContact CE1-CB 4.49Å; Y167-P291 HydrophobicContact CE1-CG 3.73Å; Y167-P291 HydrophobicContact CE2-CB 4.35Å; Y167-P291 HydrophobicContact CE2-CG 3.95Å; Y167-P291 HydrophobicContact CG-CB 4.05Å; Y167-P291 HydrophobicContact CG-CG 4.17Å
168	R	52.5	Low	40.2	Very low	83 Å²	83	109.1 Å²	109.1	31%	0.313	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-57.7	-23.4	176.6	-171	-178.3	-171.1	113.8	8.6	114.3	N165 P166 N285	N165-R168 VanDerWaalsContact O-CB 3.26Å; N165-R168 WeakPolarHBondContact O-CB 3.36Å; N165-R168 PolarHBondContact O-N 2.95Å; P166-R168 PolarHBondContact O-N 3.08Å; R168-N285 PolarHBondContact NH1-OD1 3.31Å
169	H	44.6	Very low	40.1	Very low	112 Å²	112	111.3 Å²	111.3	52%	0.519	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-130.4	21.2	-166.6	-66.3	-53	0	0	0	114.8	H164 Y167 P171	H164-H169 AromaticContact NE2-CD2 3.9Å; H164-H169 AromaticContact NE2-NE2 3.85Å; Y167-H169 PolarHBondContact O-N 3.24Å; Y167-H169 VanDerWaalsContact O-N 3.12Å; H169-P171 VanDerWaalsContact O-CD 3.27Å; H169-P171 WeakPolarHBondContact O-CD 2.99Å
170	T	42.5	Very low	40.2	Very low	55 Å²	55	110.5 Å²	110.5	34%	0.337	60%	0.601	S	S	.	*			trans	-82.2	110.9	174.5	46.4	0	0	0	0	111.5	Y167 S172 S173	Y167-T170 PolarHBondContact O-OG1 3.29Å; T170-S172 PolarHBondContact O-N 2.84Å; T170-S173 PolarHBondContact O-N 2.76Å
171	P	40.1	Very low	40.3	Very low	107 Å²	107	107.7 Å²	107.7	70%	0.695	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-2.4	-176.2	-17.5	33.2	0	0	0	114.5	H169	H169-P171 VanDerWaalsContact O-CD 3.27Å; H169-P171 WeakPolarHBondContact O-CD 2.99Å
172	S	41.3	Very low	39.8	Very low	91 Å²	91	106.1 Å²	106.1	64%	0.636	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-23	174.8	38.5	0	0	0	0	113.8	T170 S174	T170-S172 PolarHBondContact O-N 2.84Å; S172-S174 VanDerWaalsContact C-N 3.28Å; S172-S174 PolarHBondContact O-N 2.94Å
173	S	40.3	Very low	39.5	Very low	26 Å²	26	103.7 Å²	103.7	18%	0.182	59%	0.594	C	S	.	*	T	Hydrogen-bonded Turn	trans	-63.1	-30	179	166.9	0	0	0	0	113.1	T170 R175 Y308	T170-S173 PolarHBondContact O-N 2.76Å; S173-R175 PolarHBondContact O-N 3.41Å; S173-Y308 WeakPolarHBondContact CB-O 3.38Å; S173-Y308 PolarHBondContact OG-O 3.44Å
174	S	38.9	Very low	39.4	Very low	82 Å²	82	109.3 Å²	109.3	57%	0.573	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	15.4	-172.5	-44.3	0	0	0	0	115.2	S172	S172-S174 VanDerWaalsContact C-N 3.28Å; S172-S174 PolarHBondContact O-N 2.94Å
175	R	36.2	Very low	38.8	Very low	209 Å²	209	111 Å²	111	79%	0.789	62%	0.618	S	S	*	*			trans	-111.7	61.8	-156.8	-153.7	179.1	-172.4	172.8	3.2	116.7	S173 S177	S173-R175 PolarHBondContact O-N 3.41Å; R175-S177 PolarHBondContact O-N 2.74Å
176	A	30.7	Very low	37.6	Very low	102 Å²	102	118.4 Å²	118.4	84%	0.843	66%	0.658	S	S	*	*			trans	-75	83.4	167.4	0	0	0	0	0	112.9
177	S	29.2	Very low	36.6	Very low	96 Å²	96	119.6 Å²	119.6	67%	0.671	67%	0.665	S	S	*	*			trans	-172.5	138.6	154.7	-167.7	0	0	0	0	111.3	R175	R175-S177 PolarHBondContact O-N 2.74Å
178	P	39.2	Very low	35.7	Very low	112 Å²	112	120.8 Å²	120.8	73%	0.727	69%	0.685	S	S	*	*			trans	-88.5	168.7	-168.5	35.5	-37.6	0	0	0	115.9
179	Y	30.9	Very low	34.5	Very low	218 Å²	218	123.8 Å²	123.8	86%	0.855	71%	0.713	S	S	*	*			trans	68.2	105	167.3	-99.2	-91.8	0	0	0	119.3
180	I	32.9	Very low	33.8	Very low	160 Å²	160	127.1 Å²	127.1	82%	0.821	73%	0.728	S	S	*	*			trans	-166.6	135.5	132.3	-97.2	150.3	0	0	0	107.3
181	P	31	Very low	33	Very low	116 Å²	116	132.3 Å²	132.3	75%	0.753	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-75.3	147.3	179.5	30.9	-34.9	0	0	0	112.5
182	A	27.1	Very low	32.8	Very low	94 Å²	94	132.4 Å²	132.4	78%	0.777	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-85.3	148.6	-177.9	0	0	0	0	0	113.3
183	P	32.4	Very low	32.9	Very low	118 Å²	118	134 Å²	134	77%	0.766	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-81.3	147.1	168.7	33.7	-33.6	0	0	0	112
184	E	31.9	Very low	32.3	Very low	198 Å²	198	142 Å²	142	93%	0.925	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-71.2	145.7	179.8	-58.3	177	126.1	0	0	112.8
185	I	32	Very low	31.9	Very low	159 Å²	159	145.6 Å²	145.6	82%	0.815	81%	0.805	S	S	*	*			trans	-133.2	124.9	170.8	-61.1	-178.6	0	0	0	109.6
186	L	29.6	Very low	32	Very low	162 Å²	162	140.3 Å²	140.3	85%	0.848	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-81.6	147.5	173.4	-79.1	162.9	0	0	0	111.6
187	P	31.9	Very low	32	Very low	114 Å²	114	146.3 Å²	146.3	74%	0.74	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-82.3	145.3	-170.1	32.2	-36.1	0	0	0	114.1
188	P	34.4	Very low	32	Very low	123 Å²	123	146.4 Å²	146.4	80%	0.799	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-86.8	154.2	170.2	35.1	-34	0	0	0	112.8
189	T	28.2	Very low	31.4	Very low	146 Å²	146	147.7 Å²	147.7	90%	0.896	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-102.9	158.1	176.2	43.1	0	0	0	0	113.1
190	H	28.5	Very low	31.3	Very low	182 Å²	182	142.6 Å²	142.6	84%	0.843	80%	0.803	S	S	*	*			trans	-98.8	179.9	-170.5	-113.9	-98.1	0	0	0	114.2
191	M	26.7	Very low	31.2	Very low	164 Å²	164	139.3 Å²	139.3	81%	0.808	80%	0.799	S	S	*	*			trans	104.1	160.7	165.5	-54.4	-65.8	-86.6	0	0	115.1
192	P	34.8	Very low	32	Very low	109 Å²	109	139.3 Å²	139.3	71%	0.708	80%	0.8	S	S	*	*				-127.7	178	-95.7	22.6	3.1	0	0	0	114.6
193	P	44.2	Very low	33	Very low	125 Å²	125	139.6 Å²	139.6	81%	0.812	79%	0.793	S	S	*	*			trans	-92.1	153.1	-165.2	35.4	-36.7	0	0	0	116.3
194	Q	26.7	Very low	33	Very low	193 Å²	193	141.1 Å²	141.1	90%	0.902	79%	0.79	S	S	*	*			trans	-144.8	162.2	158.6	-74.4	-158.4	-8.2	0	0	112.4
195	I	32.3	Very low	33	Very low	157 Å²	157	138.8 Å²	138.8	81%	0.805	78%	0.781	S	S	*	*			trans	-132.1	129.9	-176.8	-67.9	167.4	0	0	0	106.5
196	P	38.5	Very low	32.9	Very low	99 Å²	99	141.1 Å²	141.1	64%	0.643	79%	0.786	S	S	*	*				-161.9	153.1	103	38.5	-17.5	0	0	0	119.9
197	Y	28.8	Very low	33.7	Very low	227 Å²	227	138.6 Å²	138.6	89%	0.89	78%	0.779	S	S	*	*			trans	55.2	153.5	141.9	-60.1	-39	0	0	0	121.1
198	S	29.1	Very low	34.8	Very low	98 Å²	98	139.1 Å²	139.1	69%	0.685	78%	0.783	S	S	*	*			cis	-170	-174.6	-5.1	46.6	0	0	0	0	111.4
199	V	28.1	Very low	34.6	Very low	140 Å²	140	139.4 Å²	139.4	85%	0.848	79%	0.788	S	S	*	*			trans	63.7	150.4	170.4	-101.2	0	0	0	0	117.9
200	S	28.8	Very low	34.8	Very low	111 Å²	111	135.8 Å²	135.8	78%	0.776	78%	0.779	S	S	*	*			cis	-151.1	166.4	5.9	51.5	0	0	0	0	114.1
201	A	29.3	Very low	36.2	Very low	90 Å²	90	132.7 Å²	132.7	74%	0.744	78%	0.775	S	S	*	*			trans	-125	-164.2	168.8	0	0	0	0	0	109
202	P	49	Very low	36.4	Very low	117 Å²	117	130.3 Å²	130.3	76%	0.76	77%	0.77	S	S	*	*			cis	-133.4	-136.7	-2.9	44.3	-23.1	0	0	0	110.6
203	P	47.2	Very low	36.3	Very low	100 Å²	100	134.1 Å²	134.1	65%	0.649	78%	0.776	S	S	*	*			cis	-120.4	-160.2	-32.7	34.9	-13.8	0	0	0	111.2
204	Q	32.8	Very low	35.6	Very low	150 Å²	150	134 Å²	134	70%	0.701	77%	0.773	S	S	*	*			cis	-135.5	169.8	-1.5	-63.7	-71.9	10.6	0	0	107.4
205	M	31.3	Very low	35.6	Very low	148 Å²	148	130.6 Å²	130.6	73%	0.729	77%	0.765	S	S	*	*			cis	93.7	94.5	8.7	-147.7	-166	84.4	0	0	119.5
206	F	31.1	Very low	36.2	Very low	208 Å²	208	128.6 Å²	128.6	91%	0.912	76%	0.763	S	S	*	*			trans	-151.2	149.4	148.9	-105.9	-76.6	0	0	0	111.5
207	P	46.4	Very low	36.5	Very low	110 Å²	110	129.3 Å²	129.3	71%	0.714	77%	0.767	S	S	*	*			trans	-127.4	-139.5	-160.7	41.8	-20.1	0	0	0	115.1
208	P	54.8	Low	37.4	Very low	125 Å²	125	124.5 Å²	124.5	81%	0.812	76%	0.764	S	S	*	*				-125.6	-174.8	-123.5	38.3	-16.2	0	0	0	116.5
209	S	31.1	Very low	37.6	Very low	129 Å²	129	124.8 Å²	124.8	90%	0.902	77%	0.766	S	S	*	*			trans	-151.6	166.4	174.4	56.6	0	0	0	0	114.3
210	G	30.6	Very low	37.8	Very low	70 Å²	70	127.3 Å²	127.3	72%	0.722	77%	0.768	S	S	*	*			trans	-138.5	-141.1	-170.9	0	0	0	0	0	115.8
211	P	58.5	Low	37.9	Very low	117 Å²	117	129.5 Å²	129.5	76%	0.76	77%	0.77	S	S	*	*				-124.3	-167.5	-116.1	42.8	-31.8	0	0	0	117.6
212	T	30.5	Very low	38	Very low	113 Å²	113	134.4 Å²	134.4	69%	0.693	78%	0.778	S	S	*	*			trans	73.5	138.8	173.3	55.5	0	0	0	0	116.6
213	F	33	Very low	37.1	Very low	189 Å²	189	133.5 Å²	133.5	83%	0.829	78%	0.78	S	S	*	*				-175.8	171.4	63	-99.1	-71.7	0	0	0	109.4
214	T	29.6	Very low	36.6	Very low	122 Å²	122	133.4 Å²	133.4	75%	0.748	79%	0.788	S	S	*	*			cis	-150.5	-153.2	2.8	-27.2	0	0	0	0	111.3
215	T	27.8	Very low	36.9	Very low	122 Å²	122	132.1 Å²	132.1	75%	0.748	79%	0.793	S	S	*	*			trans	-132.3	-167.5	172.4	58.3	0	0	0	0	109.5
216	P	43.3	Very low	37.1	Very low	116 Å²	116	130.6 Å²	130.6	75%	0.753	79%	0.794	S	S	*	*			cis	-129.6	-114.8	-6.6	24.7	3.5	0	0	0	117.1
217	P	45.8	Very low	37.5	Very low	113 Å²	113	126.5 Å²	126.5	73%	0.734	79%	0.788	S	S	*	*				-121.8	-160	-115.1	45.1	-26.7	0	0	0	114.3
218	P	47	Very low	37.1	Very low	127 Å²	127	126.9 Å²	126.9	83%	0.825	79%	0.79	S	S	*	*			cis	-136.9	-160.8	3.1	44.8	-24	0	0	0	117
219	S	34	Very low	36.3	Very low	104 Å²	104	127 Å²	127	73%	0.727	79%	0.791	S	S	*	*			trans	-114.8	167	-164	55.5	0	0	0	0	116.1
220	H	31.5	Very low	36.5	Very low	192 Å²	192	128 Å²	128	89%	0.889	79%	0.792	S	S	*	*			trans	-144.9	166.9	158.5	-119.7	-96.4	0	0	0	113.1
221	L	32.3	Very low	36.5	Very low	157 Å²	157	128.8 Å²	128.8	82%	0.822	79%	0.792	S	S	*	*			trans	-121.5	179.5	-167.4	-79.1	164.6	0	0	0	113.7
222	Q	30.7	Very low	35.2	Very low	194 Å²	194	130 Å²	130	91%	0.907	80%	0.797	S	S	*	*			trans	82.9	146.3	174.5	-66.9	-179.3	-37.4	0	0	116.3
223	A	30.6	Very low	35.7	Very low	98 Å²	98	129.8 Å²	129.8	81%	0.81	81%	0.807	S	S	*	*			cis	-157.4	177.2	-10.3	0	0	0	0	0	110.7
224	A	36.7	Very low	35.6	Very low	97 Å²	97	124 Å²	124	80%	0.802	80%	0.801	S	S	*	*			trans	-118	145.9	-177.7	0	0	0	0	0	113.9
225	P	37.7	Very low	35.8	Very low	124 Å²	124	122.9 Å²	122.9	81%	0.805	80%	0.804	S	S	*	*			trans	-126.1	-163.1	161.5	45.3	-31.7	0	0	0	111
226	P	36.9	Very low	36	Very low	116 Å²	116	123.5 Å²	123.5	75%	0.753	81%	0.807	S	S	*	*				-114.9	170.9	-107.7	25.9	-3.7	0	0	0	115.3
227	P	39.3	Very low	35.8	Very low	121 Å²	121	123.8 Å²	123.8	79%	0.786	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-84.7	153.6	-177.4	34.1	-36.3	0	0	0	114.6
228	P	38.4	Very low	35.2	Very low	118 Å²	118	123.6 Å²	123.6	77%	0.766	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-78.1	161.4	166.3	33.9	-34.7	0	0	0	112.4
229	P	36.8	Very low	34.6	Very low	129 Å²	129	122 Å²	122	84%	0.838	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-82.9	152.1	-169.9	33	-36.7	0	0	0	114.7
230	T	34.8	Very low	34.9	Very low	148 Å²	148	119.5 Å²	119.5	91%	0.908	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-83.5	130.6	169	44.1	0	0	0	0	112.2
231	A	31	Very low	35.1	Very low	88 Å²	88	116.2 Å²	116.2	73%	0.727	79%	0.789	S	S	*	*			trans	-144.8	122.9	166.1	0	0	0	0	0	111.6
232	T	30.6	Very low	35.2	Very low	142 Å²	142	117.1 Å²	117.1	87%	0.871	79%	0.791	S	S	*	*			trans	49.5	120.9	161.4	48.4	0	0	0	0	119.8
233	A	42.2	Very low	35.6	Very low	108 Å²	108	115 Å²	115	89%	0.893	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-73.6	133.2	173	0	0	0	0	0	112.9
234	G	31.4	Very low	36	Very low	69 Å²	69	115.7 Å²	115.7	71%	0.711	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-95.3	158.6	157	0	0	0	0	0	110.6
235	A	33.3	Very low	36.2	Very low	97 Å²	97	119.9 Å²	119.9	80%	0.802	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-65.1	136.2	-172	0	0	0	0	0	113.3	V237	A235-V237 PolarHBondContact O-N 3.47Å
236	V	31.7	Very low	36.5	Very low	136 Å²	136	119.4 Å²	119.4	82%	0.824	77%	0.766	S	S	*	*			trans	-72	97.8	166.6	178.7	0	0	0	0	108.4
237	V	39	Very low	37.3	Very low	122 Å²	122	122.3 Å²	122.3	74%	0.739	76%	0.764	S	S	*	*			trans	-74.7	124	156.8	-178.7	0	0	0	0	106.5	A235 A239	A235-V237 PolarHBondContact O-N 3.47Å; V237-A239 PolarHBondContact O-N 3.46Å; V237-A239 VanDerWaalsContact O-N 3.1Å
238	P	33.2	Very low	38.2	Very low	109 Å²	109	120.8 Å²	120.8	71%	0.708	75%	0.749	S	S	*	*			trans	-61.4	117.3	170.4	-19.2	31.9	0	0	0	108.4	G240	P238-G240 PolarHBondContact O-N 3.44Å
239	A	34.2	Very low	40.3	Very low	92 Å²	92	118.9 Å²	118.9	76%	0.76	74%	0.735	S	S	*	*			trans	-60.8	110.2	162.9	0	0	0	0	0	107	V237	V237-A239 PolarHBondContact O-N 3.46Å; V237-A239 VanDerWaalsContact O-N 3.1Å
240	G	41.1	Very low	42.7	Very low	52 Å²	52	115.4 Å²	115.4	54%	0.536	71%	0.705	S	S	.	*			trans	-52.7	144.6	164.9	0	0	0	0	0	108.5	P238 M242	P238-G240 PolarHBondContact O-N 3.44Å; G240-M242 PolarHBondContact O-N 2.66Å
241	P	35.8	Very low	45.3	Very low	123 Å²	123	115.2 Å²	115.2	80%	0.799	69%	0.694	S	S	*	*			trans	-54.7	115.3	-173.4	22.9	-33.4	0	0	0	109.1	M243	P241-M243 VanDerWaalsContact C-N 3.34Å; P241-M243 PolarHBondContact O-N 3.09Å
242	M	34.7	Very low	48	Very low	176 Å²	176	115.8 Å²	115.8	87%	0.867	69%	0.691	S	S	*	*			trans	-64.7	101.7	174.9	-69.6	-163.5	78.9	0	0	107.1	G240 P244	G240-M242 PolarHBondContact O-N 2.66Å; M242-P244 VanDerWaalsContact O-CD 3.31Å; M242-P244 WeakPolarHBondContact O-CD 3.4Å; M242-P244 VanDerWaalsContact O-N 3.13Å
243	M	38.4	Very low	50.8	Low	151 Å²	151	110.2 Å²	110.2	74%	0.744	66%	0.656	S	S	*	*			trans	-54.8	118.6	171.1	-65.6	-69.2	-96.5	0	0	106.7	P241 Y245	P241-M243 VanDerWaalsContact C-N 3.34Å; P241-M243 PolarHBondContact O-N 3.09Å; M243-Y245 PolarHBondContact O-N 2.89Å
244	P	38.2	Very low	53.1	Low	111 Å²	111	111.6 Å²	111.6	72%	0.721	64%	0.644	S	S	*	*			trans	-68.3	100.4	175.9	27.3	-31.8	0	0	0	107.1	M242 N246	M242-P244 VanDerWaalsContact O-CD 3.31Å; M242-P244 WeakPolarHBondContact O-CD 3.4Å; M242-P244 VanDerWaalsContact O-N 3.13Å; P244-N246 PolarHBondContact O-N 3.01Å
245	Y	40.7	Very low	56	Low	185 Å²	185	109.1 Å²	109.1	73%	0.725	62%	0.615	S	S	*	*			trans	-56.1	108.9	172.1	-81.7	-85.4	0	0	0	108	M243 Y247	M243-Y245 PolarHBondContact O-N 2.89Å; Y245-Y247 HydrophobicContact CG-CE2 4.22Å; Y245-Y247 VanDerWaalsContact O-CD2 3.32Å; Y245-Y247 WeakPolarHBondContact O-CD2 3.31Å; Y245-Y247 PolarHBondContact O-N 3.05Å
246	N	45.5	Very low	58.9	Low	115 Å²	115	105.3 Å²	105.3	62%	0.615	58%	0.581	S	S	*	*			trans	-87.7	54.7	-158.9	-151.3	10	0	0	0	110.8	P244 N248 V249	P244-N246 PolarHBondContact O-N 3.01Å; N246-N248 PolarHBondContact O-N 2.63Å; N246-V249 HydrophobicContact CB-CG2 4.05Å; N246-V249 WeakPolarHBondContact ND2-CG2 3.5Å; N246-V249 WeakPolarHBondContact O-CG2 3.14Å; N246-V249 PolarHBondContact O-N 3.42Å
247	Y	52.3	Low	61.9	Low	177 Å²	177	98.9 Å²	98.9	69%	0.694	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-2.1	-173.3	-72	-69.7	0	0	0	115.8	Y245	Y245-Y247 HydrophobicContact CG-CE2 4.22Å; Y245-Y247 VanDerWaalsContact O-CD2 3.32Å; Y245-Y247 WeakPolarHBondContact O-CD2 3.31Å; Y245-Y247 PolarHBondContact O-N 3.05Å
248	N	59.8	Low	64.5	Low	88 Å²	88	93.9 Å²	93.9	47%	0.471	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	1.5	176.4	-61.1	-26.6	0	0	0	113.1	N246	N246-N248 PolarHBondContact O-N 2.63Å
249	V	81.3	Confident	67.3	Low	79 Å²	79	91 Å²	91	48%	0.479	49%	0.486	S	S	.	.			trans	-77.2	124.7	170.4	179.7	0	0	0	0	108.5	N246 E251	N246-V249 HydrophobicContact CB-CG2 4.05Å; N246-V249 WeakPolarHBondContact ND2-CG2 3.5Å; N246-V249 WeakPolarHBondContact O-CG2 3.14Å; N246-V249 PolarHBondContact O-N 3.42Å; V249-E251 HydrophobicContact CG1-CG 4.47Å
250	Y	87.8	Confident	70.1	Confident	56 Å²	56	87.3 Å²	87.3	22%	0.22	46%	0.455	C	S	.	.			trans	-79.2	120.5	170.5	165.5	-89.4	0	0	0	109.8	P252 E351 Y354 K355	Y250-P252 HydrophobicContact CE1-CB 4.45Å; Y250-P252 HydrophobicContact CE1-CG 4.04Å; Y250-E351 WeakPolarHBondContact CE2-OE1 3.41Å; Y250-E351 PolarHBondContact OH-OE1 3.37Å; Y250-Y354 HydrophobicContact CD2-CD1 4.49Å; Y250-Y354 HydrophobicContact CE2-CD1 4.4Å; Y250-K355 HydrophobicContact CD1-CD 4.23Å; Y250-K355 HydrophobicContact CD1-CG 4.1Å; Y250-K355 HydrophobicContact CD2-CB 3.74Å; Y250-K355 HydrophobicContact CD2-CD 4.36Å; Y250-K355 HydrophobicContact CD2-CG 3.63Å; Y250-K355 HydrophobicContact CE1-CD 3.82Å; Y250-K355 HydrophobicContact CE1-CG 4.1Å; Y250-K355 HydrophobicContact CE2-CB 3.46Å; Y250-K355 VanDerWaalsContact CE2-CB 3.46Å; Y250-K355 HydrophobicContact CE2-CD 3.9Å; Y250-K355 HydrophobicContact CE2-CG 3.56Å; Y250-K355 HydrophobicContact CG-CB 4.48Å; Y250-K355 HydrophobicContact CG-CD 4.48Å; Y250-K355 HydrophobicContact CG-CG 3.87Å
251	E	88.8	Confident	72.3	Confident	143 Å²	143	87.6 Å²	87.6	67%	0.668	44%	0.441	S	S	*	.			trans	-106.1	127.4	171.9	-67	175.3	165.9	0	0	108.7	V249 V253 R410	V249-E251 HydrophobicContact CG1-CG 4.47Å; E251-V253 PolarHBondContact O-N 2.87Å; E251-R410 PolarHBondContact O-NH1 3.03Å; E251-R410 PolarHBondContact O-NH2 2.97Å
252	P	88	Confident	74.5	Confident	101 Å²	101	88.2 Å²	88.2	66%	0.656	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-58	135.8	176.7	-21.9	32.3	0	0	0	111.9	Y250	Y250-P252 HydrophobicContact CE1-CB 4.45Å; Y250-P252 HydrophobicContact CE1-CG 4.04Å
253	V	90.8	Very high	76.6	Confident	24 Å²	24	82.6 Å²	82.6	15%	0.145	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-73.5	132.4	170.2	51.9	0	0	0	0	109.9	E251 T328 E351 R410	E251-V253 PolarHBondContact O-N 2.87Å; V253-T328 HydrophobicContact CG1-CG2 3.79Å; V253-T328 HydrophobicContact CG2-CG2 4.11Å; V253-E351 HydrophobicContact CG1-CG 4.25Å; V253-R410 HydrophobicContact CB-CG 4.26Å; V253-R410 HydrophobicContact CG2-CG 4.26Å; V253-R410 VanDerWaalsContact N-NH2 3.18Å
254	Q	89.9	Confident	78.5	Confident	137 Å²	137	82.6 Å²	82.6	64%	0.64	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-73.7	126.8	169.7	-176.5	165.2	-18.7	0	0	109.4
255	P	92.1	Very high	80.3	Confident	17 Å²	17	82.4 Å²	82.4	11%	0.11	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-69	147.8	172	-13.8	28.8	0	0	0	111.1	R326 C327 T328	P255-R326 HydrophobicContact CB-CG 3.95Å; P255-R326 VanDerWaalsContact CG-NH2 3.3Å; P255-C327 WeakPolarHBondContact CA-O 3.49Å; P255-T328 HydrophobicContact CB-CG2 3.83Å; P255-T328 HydrophobicContact CG-CG2 3.9Å
256	H	93.6	Very high	82.3	Confident	18 Å²	18	79.2 Å²	79.2	8%	0.083	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	144.2	167.8	-171.1	86.2	0	0	0	109.5	F258 P271 L272 S277 C327 V412	H256-F258 HydrophobicContact CB-CE2 3.97Å; H256-F258 AromaticContact CD2-CD2 3.99Å; H256-F258 AromaticContact CD2-CE2 3.47Å; H256-F258 VanDerWaalsContact CD2-CE2 3.47Å; H256-F258 WeakPolarHBondContact CD2-CE2 3.42Å; H256-F258 AromaticContact CD2-CZ 3.7Å; H256-F258 WeakPolarHBondContact O-CD2 3.48Å; H256-P271 WeakPolarHBondContact NE2-CB 3.25Å; H256-L272 PolarHBondContact CE1-O 3.22Å; H256-L272 PolarHBondContact NE2-O 3.44Å; H256-S277 WeakPolarHBondContact CA-OG 3.48Å; H256-S277 PolarHBondContact ND1-OG 3.3Å; H256-C327 PolarHBondContact N-O 3.43Å; H256-C327 PolarHBondContact O-N 3.03Å; H256-V412 HydrophobicContact CB-CG2 3.68Å
257	W	94.2	Very high	84.1	Confident	0 Å²	0	78 Å²	78	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	133.9	-175.4	-69.4	73.7	0	0	0	110.9	L272 S277 L280 E281 F284 L307 V324 R325 R326	W257-L272 HydrophobicContact CB-CD1 3.9Å; W257-L272 WeakPolarHBondContact O-CB 3.43Å; W257-L272 PolarHBondContact O-N 2.98Å; W257-S277 PolarHBondContact N-OG 3.07Å; W257-L280 HydrophobicContact CB-CD1 3.84Å; W257-L280 HydrophobicContact CD2-CB 3.86Å; W257-L280 HydrophobicContact CD2-CD1 4.02Å; W257-L280 HydrophobicContact CD2-CG 4.47Å; W257-L280 HydrophobicContact CE3-CB 4.48Å; W257-L280 HydrophobicContact CE3-CD1 4.2Å; W257-L280 HydrophobicContact CG-CB 3.96Å; W257-L280 HydrophobicContact CG-CD1 3.9Å; W257-L280 HydrophobicContact CZ2-CB 4.28Å; W257-E281 PolarHBondContact NE1-OE2 2.99Å; W257-F284 HydrophobicContact CH2-CD2 4.39Å; W257-F284 HydrophobicContact CH2-CG 4.42Å; W257-F284 HydrophobicContact CZ2-CB 3.95Å; W257-F284 HydrophobicContact CZ2-CD1 4.43Å; W257-F284 HydrophobicContact CZ2-CD2 4.46Å; W257-F284 HydrophobicContact CZ2-CG 4.04Å; W257-L307 HydrophobicContact CH2-CD1 3.47Å; W257-L307 VanDerWaalsContact CH2-CD1 3.47Å; W257-L307 HydrophobicContact CZ2-CD1 4.02Å; W257-L307 HydrophobicContact CZ3-CD1 4Å; W257-V324 HydrophobicContact CE3-CG1 4.01Å; W257-R325 WeakPolarHBondContact CA-O 3.4Å; W257-R326 HydrophobicContact CD2-CB 3.75Å; W257-R326 HydrophobicContact CD2-CG 4.17Å; W257-R326 HydrophobicContact CE3-CB 3.9Å; W257-R326 HydrophobicContact CG-CB 4.43Å; W257-R326 HydrophobicContact CH2-CB 3.94Å; W257-R326 HydrophobicContact CH2-CG 4.47Å; W257-R326 HydrophobicContact CZ2-CB 3.78Å; W257-R326 HydrophobicContact CZ2-CG 3.84Å; W257-R326 HydrophobicContact CZ3-CB 3.99Å
258	F	93.8	Very high	85.9	Confident	18 Å²	18	70.3 Å²	70.3	8%	0.079	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	155.2	-178.2	-67.8	-104.9	0	0	0	110.2	H256 W269 F270 P271 V324 R325 C327 F330 P341 V412	H256-F258 HydrophobicContact CB-CE2 3.97Å; H256-F258 AromaticContact CD2-CD2 3.99Å; H256-F258 AromaticContact CD2-CE2 3.47Å; H256-F258 VanDerWaalsContact CD2-CE2 3.47Å; H256-F258 WeakPolarHBondContact CD2-CE2 3.42Å; H256-F258 AromaticContact CD2-CZ 3.7Å; H256-F258 WeakPolarHBondContact O-CD2 3.48Å; F258-W269 HydrophobicContact CB-CE3 3.79Å; F258-W269 HydrophobicContact CB-CZ3 4.32Å; F258-F270 CarbonylContact C-O 3.56Å; F258-F270 WeakPolarHBondContact CA-O 3.27Å; F258-F270 WeakPolarHBondContact CB-O 3.43Å; F258-F270 WeakPolarHBondContact CD1-O 3.33Å; F258-P271 HydrophobicContact CD1-CB 4.11Å; F258-P271 HydrophobicContact CE1-CB 3.8Å; F258-P271 HydrophobicContact CZ-CB 4.35Å; F258-V324 CarbonylContact O-C 3.56Å; F258-V324 VanDerWaalsContact O-CA 3.28Å; F258-V324 WeakPolarHBondContact O-CA 3.38Å; F258-V324 VanDerWaalsContact O-CG1 3.28Å; F258-V324 WeakPolarHBondContact O-CG1 3.47Å; F258-R325 PolarHBondContact N-O 3.14Å; F258-R325 PolarHBondContact O-N 2.88Å; F258-C327 HydrophobicContact CD2-CB 4.05Å; F258-C327 HydrophobicContact CE2-CB 4.27Å; F258-F330 HydrophobicContact CD2-CE1 4.13Å; F258-F330 HydrophobicContact CD2-CZ 4.45Å; F258-F330 HydrophobicContact CE1-CE1 4.02Å; F258-F330 AromaticContact CE2-CE1 3.38Å; F258-F330 HydrophobicContact CE2-CE1 3.38Å; F258-F330 AromaticContact CE2-CZ 3.43Å; F258-F330 HydrophobicContact CE2-CZ 3.43Å; F258-F330 VanDerWaalsContact CE2-CZ 3.43Å; F258-F330 HydrophobicContact CZ-CD1 4.44Å; F258-F330 AromaticContact CZ-CE1 3.33Å; F258-F330 HydrophobicContact CZ-CE1 3.33Å; F258-F330 AromaticContact CZ-CZ 3.56Å; F258-F330 HydrophobicContact CZ-CZ 3.56Å; F258-P341 HydrophobicContact CB-CG 4.33Å; F258-P341 HydrophobicContact CG-CG 4.35Å; F258-V412 HydrophobicContact CE2-CG2 4.46Å; F258-V412 HydrophobicContact CZ-CG2 4.13Å
259	Y	93.6	Very high	87.3	Confident	47 Å²	47	67.7 Å²	67.7	18%	0.184	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	152.7	171.7	69.7	-76.1	0	0	0	111.7	W269 F270 P271 L272 E323	Y259-W269 WeakPolarHBondContact O-CA 3.23Å; Y259-F270 HydrophobicContact CD1-CB 3.98Å; Y259-F270 WeakPolarHBondContact CD1-O 3.2Å; Y259-F270 HydrophobicContact CE1-CB 3.43Å; Y259-F270 VanDerWaalsContact CE1-CB 3.43Å; Y259-F270 HydrophobicContact CE1-CG 4.49Å; Y259-F270 HydrophobicContact CE2-CB 4.19Å; Y259-F270 HydrophobicContact CE2-CD2 4.41Å; Y259-F270 PolarHBondContact N-O 3.33Å; Y259-F270 PolarHBondContact O-N 3.34Å; Y259-P271 WeakPolarHBondContact CE1-O 3.39Å; Y259-L272 HydrophobicContact CD1-CD2 3.47Å; Y259-L272 VanDerWaalsContact CD1-CD2 3.47Å; Y259-L272 HydrophobicContact CD1-CG 4.02Å; Y259-L272 HydrophobicContact CE1-CD2 4.02Å; Y259-L272 HydrophobicContact CG-CD2 4.21Å; Y259-E323 CarbonylContact C-O 3.48Å; Y259-E323 WeakPolarHBondContact CA-O 3.46Å
260	C	91.8	Very high	87.7	Confident	16 Å²	16	67.1 Å²	67.1	11%	0.108	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	110.9	-176	-173	0	0	0	0	110.9	V268 W269 T322 E323	C260-V268 WeakPolarHBondContact CA-O 3.29Å; C260-W269 HydrophobicContact CB-CD2 4.02Å; C260-W269 HydrophobicContact CB-CE3 3.97Å; C260-W269 HydrophobicContact CB-CH2 3.61Å; C260-W269 HydrophobicContact CB-CZ2 3.61Å; C260-W269 HydrophobicContact CB-CZ3 3.79Å; C260-T322 VanDerWaalsContact O-CB 3.23Å; C260-T322 WeakPolarHBondContact O-CB 3.46Å; C260-T322 WeakPolarHBondContact O-CG2 3.28Å; C260-E323 HydrophobicContact CB-CB 4.07Å; C260-E323 PolarHBondContact N-O 3.16Å
261	K	87.1	Confident	87.9	Confident	57 Å²	57	66 Å²	66	25%	0.248	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	136.2	171.3	-175.6	168.7	175.4	175	0	109.7	V263 V268 F270 E450	K261-V263 HydrophobicContact CG-CG2 4.23Å; K261-V268 PolarHBondContact N-O 2.67Å; K261-V268 PolarHBondContact O-N 3.43Å; K261-F270 HydrophobicContact CB-CD2 4.24Å; K261-F270 HydrophobicContact CB-CE2 4.07Å; K261-E450 IonicContact NZ-OE1 3.99Å; K261-E450 PolarHBondContact NZ-OE1 3.05Å
262	Q	83.3	Confident	88.1	Confident	136 Å²	136	59.3 Å²	59.3	64%	0.636	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.3	125.2	173.5	-161.3	-176.4	102.9	0	0	109.6	K266	Q262-K266 WeakPolarHBondContact CA-O 3.37Å
263	V	78.3	Confident	88.3	Confident	59 Å²	59	54.9 Å²	54.9	36%	0.358	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	123	-178.9	-175.4	0	0	0	0	108.2	K261 S265 K266 V268	K261-V263 HydrophobicContact CG-CG2 4.23Å; V263-S265 VanDerWaalsContact C-N 3.27Å; V263-S265 PolarHBondContact O-N 3.11Å; V263-K266 PolarHBondContact N-O 3.15Å; V263-K266 WeakPolarHBondContact O-CB 3.38Å; V263-K266 PolarHBondContact O-N 3.17Å; V263-V268 HydrophobicContact CB-CG2 3.97Å; V263-V268 HydrophobicContact CG2-CB 4.29Å; V263-V268 HydrophobicContact CG2-CG2 4.15Å
264	E	77.9	Confident	88.4	Confident	150 Å²	150	56.9 Å²	56.9	70%	0.701	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	45	-173.5	-57.3	178.9	168.2	0	0	113.1	K266	E264-K266 HydrophobicContact CB-CD 4.46Å; E264-K266 PolarHBondContact O-N 3.05Å; E264-K266 VanDerWaalsContact O-N 3.13Å; E264-K266 IonicContact OE2-NZ 3.55Å; E264-K266 PolarHBondContact OE2-NZ 3.49Å
265	S	75.9	Confident	88.5	Confident	108 Å²	108	53.3 Å²	53.3	76%	0.755	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	18	-174.8	-49.4	0	0	0	0	115.3	V263	V263-S265 VanDerWaalsContact C-N 3.27Å; V263-S265 PolarHBondContact O-N 3.11Å
266	K	82.4	Confident	88.7	Confident	118 Å²	118	52.9 Å²	52.9	51%	0.513	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	137.3	175.9	-57.5	149.1	-159.7	160	0	109.7	Q262 V263 E264 V268	Q262-K266 WeakPolarHBondContact CA-O 3.37Å; V263-K266 PolarHBondContact N-O 3.15Å; V263-K266 WeakPolarHBondContact O-CB 3.38Å; V263-K266 PolarHBondContact O-N 3.17Å; E264-K266 HydrophobicContact CB-CD 4.46Å; E264-K266 PolarHBondContact O-N 3.05Å; E264-K266 VanDerWaalsContact O-N 3.13Å; E264-K266 IonicContact OE2-NZ 3.55Å; E264-K266 PolarHBondContact OE2-NZ 3.49Å; K266-V268 PolarHBondContact O-N 2.88Å
267	S	84.8	Confident	88.7	Confident	89 Å²	89	52.2 Å²	52.2	62%	0.622	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	117	170.8	-57.8	0	0	0	0	110.4
268	V	88.3	Confident	88.7	Confident	16 Å²	16	56.4 Å²	56.4	10%	0.097	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128	178.4	-179.6	0	0	0	0	109.4	C260 K261 V263 K266 F270	C260-V268 WeakPolarHBondContact CA-O 3.29Å; K261-V268 PolarHBondContact N-O 2.67Å; K261-V268 PolarHBondContact O-N 3.43Å; V263-V268 HydrophobicContact CB-CG2 3.97Å; V263-V268 HydrophobicContact CG2-CB 4.29Å; V263-V268 HydrophobicContact CG2-CG2 4.15Å; K266-V268 PolarHBondContact O-N 2.88Å; V268-F270 HydrophobicContact CB-CE2 3.87Å; V268-F270 HydrophobicContact CB-CZ 4.47Å; V268-F270 HydrophobicContact CG1-CD2 4.04Å; V268-F270 HydrophobicContact CG1-CE1 4.45Å; V268-F270 HydrophobicContact CG1-CE2 3.38Å; V268-F270 HydrophobicContact CG1-CZ 3.63Å
269	W	89	Confident	88.7	Confident	33 Å²	33	59.5 Å²	59.5	13%	0.125	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	133.2	178.9	-70.2	88.9	0	0	0	111.2	F258 Y259 C260 E323 R325 P341	F258-W269 HydrophobicContact CB-CE3 3.79Å; F258-W269 HydrophobicContact CB-CZ3 4.32Å; Y259-W269 WeakPolarHBondContact O-CA 3.23Å; C260-W269 HydrophobicContact CB-CD2 4.02Å; C260-W269 HydrophobicContact CB-CE3 3.97Å; C260-W269 HydrophobicContact CB-CH2 3.61Å; C260-W269 HydrophobicContact CB-CZ2 3.61Å; C260-W269 HydrophobicContact CB-CZ3 3.79Å; W269-E323 HydrophobicContact CH2-CB 4.12Å; W269-E323 VanDerWaalsContact CH2-CD 3.46Å; W269-E323 HydrophobicContact CH2-CG 4.03Å; W269-E323 WeakPolarHBondContact CH2-OE1 3.32Å; W269-R325 HydrophobicContact CE3-CB 4.47Å; W269-R325 HydrophobicContact CH2-CB 3.68Å; W269-R325 VanDerWaalsContact CZ2-NH2 3.29Å; W269-R325 HydrophobicContact CZ3-CB 3.5Å; W269-P341 HydrophobicContact CB-CG 3.82Å; W269-P341 HydrophobicContact CD2-CG 3.49Å; W269-P341 VanDerWaalsContact CD2-CG 3.49Å; W269-P341 HydrophobicContact CE3-CG 3.74Å; W269-P341 HydrophobicContact CG-CG 3.52Å
270	F	89.8	Confident	88.7	Confident	67 Å²	67	57.3 Å²	57.3	29%	0.294	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	140.4	177.4	-67.5	-89.3	0	0	0	109.3	F258 Y259 K261 V268	F258-F270 CarbonylContact C-O 3.56Å; F258-F270 WeakPolarHBondContact CA-O 3.27Å; F258-F270 WeakPolarHBondContact CB-O 3.43Å; F258-F270 WeakPolarHBondContact CD1-O 3.33Å; Y259-F270 HydrophobicContact CD1-CB 3.98Å; Y259-F270 WeakPolarHBondContact CD1-O 3.2Å; Y259-F270 HydrophobicContact CE1-CB 3.43Å; Y259-F270 VanDerWaalsContact CE1-CB 3.43Å; Y259-F270 HydrophobicContact CE1-CG 4.49Å; Y259-F270 HydrophobicContact CE2-CB 4.19Å; Y259-F270 HydrophobicContact CE2-CD2 4.41Å; Y259-F270 PolarHBondContact N-O 3.33Å; Y259-F270 PolarHBondContact O-N 3.34Å; K261-F270 HydrophobicContact CB-CD2 4.24Å; K261-F270 HydrophobicContact CB-CE2 4.07Å; V268-F270 HydrophobicContact CB-CE2 3.87Å; V268-F270 HydrophobicContact CB-CZ 4.47Å; V268-F270 HydrophobicContact CG1-CD2 4.04Å; V268-F270 HydrophobicContact CG1-CE1 4.45Å; V268-F270 HydrophobicContact CG1-CE2 3.38Å; V268-F270 HydrophobicContact CG1-CZ 3.63Å
271	P	91.9	Very high	88.9	Confident	33 Å²	33	57.8 Å²	57.8	21%	0.214	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	145.2	171.1	29.8	-34	0	0	0	109.9	H256 F258 Y259 V419	H256-P271 WeakPolarHBondContact NE2-CB 3.25Å; F258-P271 HydrophobicContact CD1-CB 4.11Å; F258-P271 HydrophobicContact CE1-CB 3.8Å; F258-P271 HydrophobicContact CZ-CB 4.35Å; Y259-P271 WeakPolarHBondContact CE1-O 3.39Å; P271-V419 HydrophobicContact CB-CG1 4.29Å; P271-V419 HydrophobicContact CB-CG2 3.98Å; P271-V419 HydrophobicContact CG-CG2 4.19Å
272	L	93.5	Very high	89.1	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.01	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-73.9	173.2	159.7	-68.1	175.3	0	0	0	109.2	H256 W257 Y259 D276 L280 V324	H256-L272 PolarHBondContact CE1-O 3.22Å; H256-L272 PolarHBondContact NE2-O 3.44Å; W257-L272 HydrophobicContact CB-CD1 3.9Å; W257-L272 WeakPolarHBondContact O-CB 3.43Å; W257-L272 PolarHBondContact O-N 2.98Å; Y259-L272 HydrophobicContact CD1-CD2 3.47Å; Y259-L272 VanDerWaalsContact CD1-CD2 3.47Å; Y259-L272 HydrophobicContact CD1-CG 4.02Å; Y259-L272 HydrophobicContact CE1-CD2 4.02Å; Y259-L272 HydrophobicContact CG-CD2 4.21Å; L272-D276 HydrophobicContact CB-CB 4.14Å; L272-L280 HydrophobicContact CD1-CD1 3.28Å; L272-V324 HydrophobicContact CD1-CG1 4.02Å
273	S	93.1	Very high	89.6	Confident	7 Å²	7	57 Å²	57	5%	0.049	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-69.4	162.2	176.1	75.6	0	0	0	0	112.4	I275 D276 S277 P420 G422	S273-I275 VanDerWaalsContact C-N 3.27Å; S273-I275 PolarHBondContact O-N 2.97Å; S273-D276 WeakPolarHBondContact CB-OD2 3.38Å; S273-D276 PolarHBondContact O-N 3.23Å; S273-D276 WeakPolarHBondContact OG-CB 3.48Å; S273-D276 PolarHBondContact OG-N 2.71Å; S273-D276 PolarHBondContact OG-OD2 2.89Å; S273-S277 WeakPolarHBondContact O-CB 3.44Å; S273-S277 PolarHBondContact O-N 2.84Å; S273-P420 CarbonylContact C-O 3.54Å; S273-P420 WeakPolarHBondContact CA-O 3.45Å; S273-P420 WeakPolarHBondContact CB-O 3.5Å; S273-G422 WeakPolarHBondContact OG-CA 3.45Å
274	I	92.2	Very high	90.1	Very high	66 Å²	66	54.8 Å²	54.8	34%	0.338	29%	0.286	S	S	.	.	H	α-helix	trans	-57.1	-44.8	173.8	-57.6	179.3	0	0	0	109.7	L278 V419 P420 D421	I274-L278 HydrophobicContact CG2-CD1 3.88Å; I274-L278 HydrophobicContact CG2-CG 4.43Å; I274-L278 WeakPolarHBondContact O-CB 3.49Å; I274-L278 WeakPolarHBondContact O-CG 3.38Å; I274-L278 PolarHBondContact O-N 3Å; I274-V419 HydrophobicContact CG1-CG1 3.72Å; I274-P420 PolarHBondContact N-O 2.75Å; I274-D421 PolarHBondContact N-O 2.79Å
275	I	92.7	Very high	90.6	Very high	62 Å²	62	50.1 Å²	50.1	32%	0.318	27%	0.266	S	S	.	.	H	α-helix	trans	-60.4	-52.9	176.4	-68.5	167.8	0	0	0	111.4	S273 S277 L278 Q279 D421	S273-I275 VanDerWaalsContact C-N 3.27Å; S273-I275 PolarHBondContact O-N 2.97Å; I275-S277 PolarHBondContact O-N 3.47Å; I275-L278 PolarHBondContact O-N 3.43Å; I275-Q279 PolarHBondContact O-N 3.45Å; I275-D421 WeakPolarHBondContact CG1-O 3.08Å; I275-D421 PolarHBondContact N-O 2.96Å
276	D	95.1	Very high	91.1	Very high	9 Å²	9	46.9 Å²	46.9	5%	0.048	24%	0.243	C	C	.	.	H	α-helix	trans	-61.6	-44.5	-178.4	-64.1	-53	0	0	0	111.3	L272 S273 L278 Q279 L280 T298 D299	L272-D276 HydrophobicContact CB-CB 4.14Å; S273-D276 WeakPolarHBondContact CB-OD2 3.38Å; S273-D276 PolarHBondContact O-N 3.23Å; S273-D276 WeakPolarHBondContact OG-CB 3.48Å; S273-D276 PolarHBondContact OG-N 2.71Å; S273-D276 PolarHBondContact OG-OD2 2.89Å; D276-L278 PolarHBondContact O-N 2.78Å; D276-Q279 PolarHBondContact O-N 2.95Å; D276-L280 WeakPolarHBondContact O-CB 3.45Å; D276-L280 VanDerWaalsContact O-CG 3.29Å; D276-L280 WeakPolarHBondContact O-CG 3.46Å; D276-L280 PolarHBondContact O-N 3.4Å; D276-T298 HydrophobicContact CB-CG2 4.01Å; D276-T298 WeakPolarHBondContact OD1-CA 3.48Å; D276-T298 WeakPolarHBondContact OD1-CB 3.44Å; D276-D299 PolarHBondContact OD1-N 2.8Å; D276-D299 PolarHBondContact OD2-N 2.78Å
277	S	94.8	Very high	91	Very high	4 Å²	4	45.9 Å²	45.9	3%	0.028	25%	0.247	C	C	.	.	H	α-helix	trans	-67.2	-33.5	180	-179.7	0	0	0	0	112.6	H256 W257 S273 I275 E281	H256-S277 WeakPolarHBondContact CA-OG 3.48Å; H256-S277 PolarHBondContact ND1-OG 3.3Å; W257-S277 PolarHBondContact N-OG 3.07Å; S273-S277 WeakPolarHBondContact O-CB 3.44Å; S273-S277 PolarHBondContact O-N 2.84Å; I275-S277 PolarHBondContact O-N 3.47Å; S277-E281 WeakPolarHBondContact O-CB 3.21Å; S277-E281 PolarHBondContact O-N 2.85Å; S277-E281 VanDerWaalsContact O-N 3.11Å
278	L	93.4	Very high	90.7	Very high	87 Å²	87	44.2 Å²	44.2	46%	0.455	23%	0.229	S	C	.	.	H	α-helix	trans	-69.5	-44.7	173.1	-76.9	170.8	0	0	0	111	I274 I275 D276 L280 E281 E282	I274-L278 HydrophobicContact CG2-CD1 3.88Å; I274-L278 HydrophobicContact CG2-CG 4.43Å; I274-L278 WeakPolarHBondContact O-CB 3.49Å; I274-L278 WeakPolarHBondContact O-CG 3.38Å; I274-L278 PolarHBondContact O-N 3Å; I275-L278 PolarHBondContact O-N 3.43Å; D276-L278 PolarHBondContact O-N 2.78Å; L278-L280 PolarHBondContact O-N 3.12Å; L278-E281 PolarHBondContact O-N 3.48Å; L278-E282 WeakPolarHBondContact O-CB 3.22Å; L278-E282 PolarHBondContact O-N 2.68Å
279	Q	94.1	Very high	89.9	Confident	84 Å²	84	49.5 Å²	49.5	39%	0.393	26%	0.264	S	S	.	.	H	α-helix	trans	-64.1	-39.8	178.5	-173.5	176.2	-15.1	0	0	112.2	I275 D276 T283 V296	I275-Q279 PolarHBondContact O-N 3.45Å; D276-Q279 PolarHBondContact O-N 2.95Å; Q279-T283 WeakPolarHBondContact O-CB 3.49Å; Q279-T283 PolarHBondContact O-N 2.81Å; Q279-T283 PolarHBondContact O-OG1 2.92Å; Q279-V296 HydrophobicContact CG-CG1 4.01Å
280	L	94.4	Very high	89.3	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.7	-46.9	171.9	-75.5	166.4	0	0	0	112	W257 L272 D276 L278 T283 F284 V296 T298 V305 L307	W257-L280 HydrophobicContact CB-CD1 3.84Å; W257-L280 HydrophobicContact CD2-CB 3.86Å; W257-L280 HydrophobicContact CD2-CD1 4.02Å; W257-L280 HydrophobicContact CD2-CG 4.47Å; W257-L280 HydrophobicContact CE3-CB 4.48Å; W257-L280 HydrophobicContact CE3-CD1 4.2Å; W257-L280 HydrophobicContact CG-CB 3.96Å; W257-L280 HydrophobicContact CG-CD1 3.9Å; W257-L280 HydrophobicContact CZ2-CB 4.28Å; L272-L280 HydrophobicContact CD1-CD1 3.28Å; D276-L280 WeakPolarHBondContact O-CB 3.45Å; D276-L280 VanDerWaalsContact O-CG 3.29Å; D276-L280 WeakPolarHBondContact O-CG 3.46Å; D276-L280 PolarHBondContact O-N 3.4Å; L278-L280 PolarHBondContact O-N 3.12Å; L280-T283 PolarHBondContact O-N 3.29Å; L280-F284 VanDerWaalsContact O-CB 3.22Å; L280-F284 WeakPolarHBondContact O-CB 3.4Å; L280-F284 PolarHBondContact O-N 3.29Å; L280-V296 HydrophobicContact CD2-CB 3.65Å; L280-V296 HydrophobicContact CD2-CG1 3.76Å; L280-V296 HydrophobicContact CD2-CG2 3.99Å; L280-V296 HydrophobicContact CG-CB 4.5Å; L280-V296 HydrophobicContact CG-CG1 4.08Å; L280-T298 HydrophobicContact CD1-CG2 4.17Å; L280-T298 HydrophobicContact CG-CG2 4.4Å; L280-V305 HydrophobicContact CD2-CB 4.07Å; L280-V305 HydrophobicContact CD2-CG1 3.81Å; L280-L307 HydrophobicContact CD2-CD1 3.68Å
281	E	94.1	Very high	88.3	Confident	27 Å²	27	49 Å²	49	13%	0.126	27%	0.267	C	S	.	.	H	α-helix	trans	-68.8	-38.1	-179	-170.7	61.9	-161.7	0	0	112.6	W257 S277 L278 F284 N285 R326	W257-E281 PolarHBondContact NE1-OE2 2.99Å; S277-E281 WeakPolarHBondContact O-CB 3.21Å; S277-E281 PolarHBondContact O-N 2.85Å; S277-E281 VanDerWaalsContact O-N 3.11Å; L278-E281 PolarHBondContact O-N 3.48Å; E281-F284 PolarHBondContact O-N 2.64Å; E281-N285 VanDerWaalsContact CD-ND2 3.3Å; E281-N285 PolarHBondContact O-N 3.15Å; E281-N285 PolarHBondContact O-ND2 2.89Å; E281-N285 PolarHBondContact OE1-ND2 2.79Å; E281-R326 IonicContact OE1-CZ 3.35Å; E281-R326 IonicContact OE1-NE 3.77Å; E281-R326 PolarHBondContact OE1-NE 3.39Å; E281-R326 IonicContact OE1-NH2 3.74Å; E281-R326 PolarHBondContact OE1-NH2 3.13Å; E281-R326 WeakPolarHBondContact OE2-CD 3.34Å; E281-R326 IonicContact OE2-CZ 2.74Å; E281-R326 IonicContact OE2-NE 3.01Å; E281-R326 PolarHBondContact OE2-NE 3.11Å; E281-R326 IonicContact OE2-NH2 3.01Å
282	E	93.3	Very high	87.3	Confident	152 Å²	152	55 Å²	55	71%	0.71	29%	0.292	S	S	*	.	H	α-helix	trans	-63.2	-48.6	173.1	-178.3	171.2	-152.4	0	0	110.7	L278 F284 N285 S286	L278-E282 WeakPolarHBondContact O-CB 3.22Å; L278-E282 PolarHBondContact O-N 2.68Å; E282-F284 VanDerWaalsContact C-N 3.3Å; E282-F284 PolarHBondContact O-N 2.73Å; E282-N285 PolarHBondContact O-N 3.09Å; E282-S286 WeakPolarHBondContact O-CB 3.34Å; E282-S286 PolarHBondContact O-N 3.02Å
283	T	92.4	Very high	86.6	Confident	24 Å²	24	60.2 Å²	60.2	15%	0.147	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-40.4	178.7	-51.5	0	0	0	0	111.2	Q279 L280 S286 V294 V296 L307	Q279-T283 WeakPolarHBondContact O-CB 3.49Å; Q279-T283 PolarHBondContact O-N 2.81Å; Q279-T283 PolarHBondContact O-OG1 2.92Å; L280-T283 PolarHBondContact O-N 3.29Å; T283-S286 PolarHBondContact O-N 3.41Å; T283-S286 PolarHBondContact O-OG 3.21Å; T283-V294 HydrophobicContact CG2-CG1 3.63Å; T283-V296 HydrophobicContact CG2-CG2 3.76Å; T283-L307 HydrophobicContact CG2-CD2 3.74Å
284	F	89.6	Confident	86.5	Confident	12 Å²	12	60.6 Å²	60.6	5%	0.053	32%	0.322	C	S	.	.	H	α-helix	trans	-67.2	-39.1	178.9	-179.1	-109.3	0	0	0	113.5	N165 W257 L280 E281 E282 L307 Y308	N165-F284 PolarHBondContact ND2-O 2.7Å; W257-F284 HydrophobicContact CH2-CD2 4.39Å; W257-F284 HydrophobicContact CH2-CG 4.42Å; W257-F284 HydrophobicContact CZ2-CB 3.95Å; W257-F284 HydrophobicContact CZ2-CD1 4.43Å; W257-F284 HydrophobicContact CZ2-CD2 4.46Å; W257-F284 HydrophobicContact CZ2-CG 4.04Å; L280-F284 VanDerWaalsContact O-CB 3.22Å; L280-F284 WeakPolarHBondContact O-CB 3.4Å; L280-F284 PolarHBondContact O-N 3.29Å; E281-F284 PolarHBondContact O-N 2.64Å; E282-F284 VanDerWaalsContact C-N 3.3Å; E282-F284 PolarHBondContact O-N 2.73Å; F284-L307 HydrophobicContact CB-CD1 4.42Å; F284-L307 HydrophobicContact CB-CD2 4.2Å; F284-Y308 HydrophobicContact CD2-CE1 4.47Å; F284-Y308 HydrophobicContact CE2-CE1 4.41Å
285	N	88.5	Confident	86.6	Confident	53 Å²	53	61.7 Å²	61.7	28%	0.283	33%	0.328	S	S	.	.	H	α-helix	trans	-80.3	-18.4	176.8	-71.6	-81.3	0	0	0	113.3	R168 E281 E282	R168-N285 PolarHBondContact NH1-OD1 3.31Å; E281-N285 VanDerWaalsContact CD-ND2 3.3Å; E281-N285 PolarHBondContact O-N 3.15Å; E281-N285 PolarHBondContact O-ND2 2.89Å; E281-N285 PolarHBondContact OE1-ND2 2.79Å; E282-N285 PolarHBondContact O-N 3.09Å
286	S	86.9	Confident	86.6	Confident	39 Å²	39	59 Å²	59	27%	0.273	31%	0.314	S	S	.	.	S	Bend	trans	-69.8	158.8	175.1	77.5	0	0	0	0	113.1	N165 E282 T283 Q288	N165-S286 PolarHBondContact ND2-O 2.84Å; E282-S286 WeakPolarHBondContact O-CB 3.34Å; E282-S286 PolarHBondContact O-N 3.02Å; T283-S286 PolarHBondContact O-N 3.41Å; T283-S286 PolarHBondContact O-OG 3.21Å; S286-Q288 PolarHBondContact O-N 3.37Å; S286-Q288 PolarHBondContact OG-NE2 2.99Å
287	V	78.8	Confident	86.6	Confident	98 Å²	98	63.3 Å²	63.3	59%	0.594	33%	0.33	S	S	*	.			trans	-87.2	103.3	174.6	180	0	0	0	0	109
288	Q	79.9	Confident	86.6	Confident	53 Å²	53	63.1 Å²	63.1	25%	0.248	33%	0.329	C	S	.	.			trans	-88	140.7	-179.3	-69.3	-66.3	-30.1	0	0	111.7	S286 V294	S286-Q288 PolarHBondContact O-N 3.37Å; S286-Q288 PolarHBondContact OG-NE2 2.99Å; Q288-V294 HydrophobicContact CB-CG2 3.74Å; Q288-V294 HydrophobicContact CG-CG1 4.28Å; Q288-V294 HydrophobicContact CG-CG2 3.83Å
289	P	70.1	Confident	86.5	Confident	128 Å²	128	60.3 Å²	60.3	83%	0.831	31%	0.314	S	S	*	.	S	Bend	trans	-79.4	-26.2	-173.3	31.6	-35.3	0	0	0	113.8
290	D	76.4	Confident	86.3	Confident	72 Å²	72	57 Å²	57	39%	0.385	30%	0.303	S	S	.	.			trans	-139.4	103	173.1	175.1	4	0	0	0	107.3	E292 N293 V294	D290-E292 PolarHBondContact OD1-N 3.23Å; D290-N293 PolarHBondContact OD2-ND2 2.74Å; D290-V294 WeakPolarHBondContact O-CG2 3.37Å
291	P	70.1	Confident	86.2	Confident	17 Å²	17	57.6 Å²	57.6	11%	0.11	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-71.9	-27.7	-175.2	30.8	-36.5	0	0	0	113	Y167 N293 Y308	Y167-P291 HydrophobicContact CD1-CB 4.25Å; Y167-P291 HydrophobicContact CD1-CG 3.95Å; Y167-P291 HydrophobicContact CD2-CB 4.09Å; Y167-P291 HydrophobicContact CD2-CG 4.16Å; Y167-P291 HydrophobicContact CE1-CB 4.49Å; Y167-P291 HydrophobicContact CE1-CG 3.73Å; Y167-P291 HydrophobicContact CE2-CB 4.35Å; Y167-P291 HydrophobicContact CE2-CG 3.95Å; Y167-P291 HydrophobicContact CG-CB 4.05Å; Y167-P291 HydrophobicContact CG-CG 4.17Å; P291-N293 VanDerWaalsContact C-N 3.25Å; P291-N293 PolarHBondContact O-N 2.77Å; P291-Y308 HydrophobicContact CB-CD2 4.18Å; P291-Y308 HydrophobicContact CB-CE1 4.48Å; P291-Y308 HydrophobicContact CB-CE2 4.07Å; P291-Y308 HydrophobicContact CB-CG 4.42Å; P291-Y308 WeakPolarHBondContact O-CD2 3.16Å
292	E	69.8	Low	86.2	Confident	158 Å²	158	56.7 Å²	56.7	74%	0.738	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-75.6	-16.7	-173.8	-65.3	-179	-178.1	0	0	111.9	D290	D290-E292 PolarHBondContact OD1-N 3.23Å
293	N	79.4	Confident	86.3	Confident	113 Å²	113	50.1 Å²	50.1	60%	0.604	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-114.4	17.1	178.7	-68.1	-72.3	0	0	0	114.4	D290 P291 I295	D290-N293 PolarHBondContact OD2-ND2 2.74Å; P291-N293 VanDerWaalsContact C-N 3.25Å; P291-N293 PolarHBondContact O-N 2.77Å; N293-I295 PolarHBondContact O-N 2.79Å; N293-I295 VanDerWaalsContact O-N 3.07Å
294	V	90.9	Very high	86.4	Confident	14 Å²	14	50.1 Å²	50.1	9%	0.085	27%	0.272	C	S	.	.			trans	-76.2	100.2	179.1	-174.7	0	0	0	0	111	T283 Q288 D290 L307 Y308	T283-V294 HydrophobicContact CG2-CG1 3.63Å; Q288-V294 HydrophobicContact CB-CG2 3.74Å; Q288-V294 HydrophobicContact CG-CG1 4.28Å; Q288-V294 HydrophobicContact CG-CG2 3.83Å; D290-V294 WeakPolarHBondContact O-CG2 3.37Å; V294-L307 HydrophobicContact CB-CB 4.23Å; V294-L307 HydrophobicContact CG1-CB 4.05Å; V294-L307 HydrophobicContact CG1-CD2 3.75Å; V294-L307 WeakPolarHBondContact O-CB 3.44Å; V294-L307 PolarHBondContact O-N 3.2Å; V294-Y308 HydrophobicContact CB-CD2 4.08Å; V294-Y308 HydrophobicContact CB-CE2 3.98Å; V294-Y308 HydrophobicContact CG1-CE2 4.47Å; V294-Y308 HydrophobicContact CG2-CD2 4.23Å; V294-Y308 HydrophobicContact CG2-CE2 3.84Å
295	I	93.3	Very high	86.7	Confident	90 Å²	90	49.6 Å²	49.6	46%	0.462	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	123.2	173.7	-61.7	174.2	0	0	0	109.7	N293 D304 V305 Q306	N293-I295 PolarHBondContact O-N 2.79Å; N293-I295 VanDerWaalsContact O-N 3.07Å; I295-D304 HydrophobicContact CG2-CB 3.56Å; I295-V305 WeakPolarHBondContact CA-O 3.48Å; I295-Q306 HydrophobicContact CG1-CG 4.42Å
296	V	94.1	Very high	87	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.024	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	128.6	169.7	180	0	0	0	0	108.7	Q279 L280 T283 T298 V305 L307	Q279-V296 HydrophobicContact CG-CG1 4.01Å; L280-V296 HydrophobicContact CD2-CB 3.65Å; L280-V296 HydrophobicContact CD2-CG1 3.76Å; L280-V296 HydrophobicContact CD2-CG2 3.99Å; L280-V296 HydrophobicContact CG-CB 4.5Å; L280-V296 HydrophobicContact CG-CG1 4.08Å; T283-V296 HydrophobicContact CG2-CG2 3.76Å; V296-T298 HydrophobicContact CG1-CG2 4.45Å; V296-V305 PolarHBondContact N-O 3.32Å; V296-V305 PolarHBondContact O-N 3.27Å; V296-L307 HydrophobicContact CG2-CD2 4.4Å
297	R	94.1	Very high	87.2	Confident	101 Å²	101	48.7 Å²	48.7	38%	0.381	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.8	175.5	-60.5	-171.9	-179.7	179.8	1.4	109.2	R553	R297-R553 PolarHBondContact NH1-O 3.43Å; R297-R553 PolarHBondContact NH2-O 3.09Å
298	T	94.3	Very high	87.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	169.3	176.3	65.8	0	0	0	0	112.3	D276 L280 V296 G301 R302 Y303 V305	D276-T298 HydrophobicContact CB-CG2 4.01Å; D276-T298 WeakPolarHBondContact OD1-CA 3.48Å; D276-T298 WeakPolarHBondContact OD1-CB 3.44Å; L280-T298 HydrophobicContact CD1-CG2 4.17Å; L280-T298 HydrophobicContact CG-CG2 4.4Å; V296-T298 HydrophobicContact CG1-CG2 4.45Å; T298-G301 CarbonylContact O-C 3.53Å; T298-G301 VanDerWaalsContact O-CA 3.27Å; T298-G301 WeakPolarHBondContact O-CA 3.21Å; T298-G301 PolarHBondContact O-N 3.37Å; T298-R302 PolarHBondContact O-N 3.16Å; T298-Y303 PolarHBondContact N-O 3.18Å; T298-Y303 PolarHBondContact O-N 3.07Å; T298-V305 HydrophobicContact CG2-CB 4.47Å; T298-V305 HydrophobicContact CG2-CG2 3.64Å
299	D	91.9	Very high	88	Confident	28 Å²	28	46.5 Å²	46.5	15%	0.15	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	57.8	55.6	174	-47.3	-119.1	0	0	0	110.9	D276 G301 R302 Y303 R312	D276-D299 PolarHBondContact OD1-N 2.8Å; D276-D299 PolarHBondContact OD2-N 2.78Å; D299-G301 PolarHBondContact O-N 3.32Å; D299-G301 VanDerWaalsContact O-N 3.09Å; D299-R302 WeakPolarHBondContact O-CB 3.47Å; D299-R302 WeakPolarHBondContact O-CG 3.3Å; D299-R302 PolarHBondContact O-N 3.38Å; D299-R302 PolarHBondContact O-NE 3.44Å; D299-R302 PolarHBondContact O-NH1 2.99Å; D299-R302 PolarHBondContact O-NH2 2.82Å; D299-Y303 HydrophobicContact CB-CD2 3.92Å; D299-R312 IonicContact OD1-CZ 3.28Å; D299-R312 VanDerWaalsContact OD1-CZ 3.29Å; D299-R312 IonicContact OD1-NH1 3.85Å; D299-R312 PolarHBondContact OD1-NH1 2.99Å; D299-R312 IonicContact OD1-NH2 2.86Å; D299-R312 PolarHBondContact OD1-NH2 2.85Å; D299-R312 IonicContact OD2-CZ 2.73Å; D299-R312 VanDerWaalsContact OD2-CZ 3.23Å; D299-R312 IonicContact OD2-NH1 2.74Å; D299-R312 PolarHBondContact OD2-NH1 2.94Å; D299-R312 IonicContact OD2-NH2 3.18Å; D299-R312 PolarHBondContact OD2-NH2 3.36Å
300	G	89.8	Confident	89	Confident	15 Å²	15	41.4 Å²	41.4	16%	0.155	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	66.3	8.7	-173.6	0	0	0	0	0	114.5	R478	G300-R478 PolarHBondContact O-NH2 3.37Å
301	G	91.9	Very high	89.8	Confident	12 Å²	12	40.3 Å²	40.3	12%	0.124	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	89	17	-175.8	0	0	0	0	0	114.9	T298 D299 R553	T298-G301 CarbonylContact O-C 3.53Å; T298-G301 VanDerWaalsContact O-CA 3.27Å; T298-G301 WeakPolarHBondContact O-CA 3.21Å; T298-G301 PolarHBondContact O-N 3.37Å; D299-G301 PolarHBondContact O-N 3.32Å; D299-G301 VanDerWaalsContact O-N 3.09Å; G301-R553 PolarHBondContact O-NE 3.31Å; G301-R553 PolarHBondContact O-NH2 3.27Å
302	R	94.1	Very high	91	Very high	7 Å²	7	39.9 Å²	39.9	3%	0.026	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-19.1	175.6	-61.2	-177.6	-66.3	-89.9	0.5	113.6	T298 D299 V315 Y316 W317 E423 R456 E480	T298-R302 PolarHBondContact O-N 3.16Å; D299-R302 WeakPolarHBondContact O-CB 3.47Å; D299-R302 WeakPolarHBondContact O-CG 3.3Å; D299-R302 PolarHBondContact O-N 3.38Å; D299-R302 PolarHBondContact O-NE 3.44Å; D299-R302 PolarHBondContact O-NH1 2.99Å; D299-R302 PolarHBondContact O-NH2 2.82Å; R302-V315 VanDerWaalsContact O-CB 3.31Å; R302-V315 WeakPolarHBondContact O-CB 3.16Å; R302-V315 WeakPolarHBondContact O-CG2 3.23Å; R302-V315 PolarHBondContact O-N 2.82Å; R302-Y316 HydrophobicContact CB-CD2 4.16Å; R302-Y316 HydrophobicContact CB-CE2 4.38Å; R302-Y316 HydrophobicContact CG-CD2 4.14Å; R302-Y316 HydrophobicContact CG-CE2 4.13Å; R302-W317 HydrophobicContact CB-CH2 4.11Å; R302-E423 IonicContact CZ-OE1 3.25Å; R302-E423 IonicContact CZ-OE2 2.7Å; R302-E423 IonicContact NH1-OE1 3.02Å; R302-E423 PolarHBondContact NH1-OE1 3.09Å; R302-E423 IonicContact NH1-OE2 3.21Å; R302-E423 PolarHBondContact NH1-OE2 2.89Å; R302-E423 IonicContact NH2-OE1 2.69Å; R302-E423 PolarHBondContact NH2-OE1 2.94Å; R302-E423 IonicContact NH2-OE2 2.93Å; R302-R456 VanDerWaalsContact CD-CZ 3.4Å; R302-E480 IonicContact CZ-OE2 2.66Å; R302-E480 IonicContact NH1-OE1 3.89Å; R302-E480 PolarHBondContact NH1-OE1 2.85Å; R302-E480 IonicContact NH1-OE2 2.66Å; R302-E480 PolarHBondContact NH1-OE2 2.62Å
303	Y	95.2	Very high	92.3	Very high	15 Å²	15	34 Å²	34	6%	0.059	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	151.4	172.7	-72.3	-96.5	0	0	0	110.7	T298 D299 R312 S313 A314 W317 E319	T298-Y303 PolarHBondContact N-O 3.18Å; T298-Y303 PolarHBondContact O-N 3.07Å; D299-Y303 HydrophobicContact CB-CD2 3.92Å; Y303-R312 HydrophobicContact CD1-CG 3.62Å; Y303-R312 HydrophobicContact CE1-CG 4.42Å; Y303-R312 HydrophobicContact CG-CG 4.17Å; Y303-S313 VanDerWaalsContact CA-O 3.31Å; Y303-S313 WeakPolarHBondContact CA-O 3.32Å; Y303-S313 WeakPolarHBondContact CD1-O 3.49Å; Y303-A314 HydrophobicContact CD1-CB 4.11Å; Y303-A314 HydrophobicContact CE1-CB 3.74Å; Y303-W317 HydrophobicContact CE2-CH2 4.25Å; Y303-W317 AromaticContact CE2-CZ2 3.63Å; Y303-W317 HydrophobicContact CE2-CZ2 3.63Å; Y303-W317 AromaticContact CZ-CZ2 3.67Å; Y303-W317 WeakPolarHBondContact OH-CZ2 3.3Å; Y303-E319 WeakPolarHBondContact CE1-OE2 3.29Å; Y303-E319 PolarHBondContact OH-OE2 3.05Å
304	D	95.7	Very high	93	Very high	24 Å²	24	29.6 Å²	29.6	13%	0.128	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.4	173.6	-84	-13.6	0	0	0	108.7	I295 S313 V315 R553	I295-D304 HydrophobicContact CG2-CB 3.56Å; D304-S313 PolarHBondContact N-O 2.97Å; D304-S313 PolarHBondContact O-N 2.98Å; D304-S313 PolarHBondContact O-OG 3.39Å; D304-V315 HydrophobicContact CB-CG2 3.95Å; D304-R553 VanDerWaalsContact CG-NH1 3.32Å; D304-R553 IonicContact OD1-CZ 2.83Å; D304-R553 IonicContact OD1-NH1 3.96Å; D304-R553 PolarHBondContact OD1-NH1 2.88Å; D304-R553 VanDerWaalsContact OD1-NH1 3.14Å; D304-R553 IonicContact OD1-NH2 2.62Å; D304-R553 PolarHBondContact OD1-NH2 3.2Å; D304-R553 IonicContact OD2-CZ 3.6Å; D304-R553 IonicContact OD2-NH1 2.72Å; D304-R553 PolarHBondContact OD2-NH1 3.49Å; D304-R553 IonicContact OD2-NH2 3.81Å
305	V	96.2	Very high	93.2	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	113.3	176.6	178.1	0	0	0	0	109.3	L280 I295 V296 T298 L307 M311 R312 V324	L280-V305 HydrophobicContact CD2-CB 4.07Å; L280-V305 HydrophobicContact CD2-CG1 3.81Å; I295-V305 WeakPolarHBondContact CA-O 3.48Å; V296-V305 PolarHBondContact N-O 3.32Å; V296-V305 PolarHBondContact O-N 3.27Å; T298-V305 HydrophobicContact CG2-CB 4.47Å; T298-V305 HydrophobicContact CG2-CG2 3.64Å; V305-L307 PolarHBondContact O-N 3.48Å; V305-L307 VanDerWaalsContact O-N 3.14Å; V305-M311 CarbonylContact C-O 3.58Å; V305-M311 WeakPolarHBondContact CA-O 3.26Å; V305-R312 HydrophobicContact CG2-CB 4.16Å; V305-R312 HydrophobicContact CG2-CG 4.48Å; V305-V324 HydrophobicContact CG1-CB 4.43Å; V305-V324 HydrophobicContact CG1-CG1 4.43Å; V305-V324 HydrophobicContact CG1-CG2 4.05Å; V305-V324 HydrophobicContact CG2-CG2 4.36Å
306	Q	93.9	Very high	93.3	Very high	73 Å²	73	26 Å²	26	34%	0.341	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	99.4	168	-65.5	173.3	-66.8	0	0	108	I295 Y308 D309 R310 M311	I295-Q306 HydrophobicContact CG1-CG 4.42Å; Q306-Y308 PolarHBondContact O-N 2.81Å; Q306-D309 HydrophobicContact CB-CB 4.04Å; Q306-D309 PolarHBondContact O-N 2.87Å; Q306-R310 PolarHBondContact O-N 3.01Å; Q306-M311 PolarHBondContact N-O 2.69Å; Q306-M311 PolarHBondContact O-N 3.44Å
307	L	90.6	Very high	93.2	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-42.2	-160.6	-176.4	62.9	0	0	0	113	W257 L280 T283 F284 V294 V296 V305 R310	W257-L307 HydrophobicContact CH2-CD1 3.47Å; W257-L307 VanDerWaalsContact CH2-CD1 3.47Å; W257-L307 HydrophobicContact CZ2-CD1 4.02Å; W257-L307 HydrophobicContact CZ3-CD1 4Å; L280-L307 HydrophobicContact CD2-CD1 3.68Å; T283-L307 HydrophobicContact CG2-CD2 3.74Å; F284-L307 HydrophobicContact CB-CD1 4.42Å; F284-L307 HydrophobicContact CB-CD2 4.2Å; V294-L307 HydrophobicContact CB-CB 4.23Å; V294-L307 HydrophobicContact CG1-CB 4.05Å; V294-L307 HydrophobicContact CG1-CD2 3.75Å; V294-L307 WeakPolarHBondContact O-CB 3.44Å; V294-L307 PolarHBondContact O-N 3.2Å; V296-L307 HydrophobicContact CG2-CD2 4.4Å; V305-L307 PolarHBondContact O-N 3.48Å; V305-L307 VanDerWaalsContact O-N 3.14Å; L307-R310 PolarHBondContact O-NH1 2.83Å
308	Y	86.8	Confident	93	Very high	18 Å²	18	30.5 Å²	30.5	7%	0.071	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-25.4	-176.2	-67.7	-91.9	0	0	0	113.5	N165 S173 F284 P291 V294 Q306 R310	N165-Y308 PolarHBondContact ND2-OH 2.81Å; S173-Y308 WeakPolarHBondContact CB-O 3.38Å; S173-Y308 PolarHBondContact OG-O 3.44Å; F284-Y308 HydrophobicContact CD2-CE1 4.47Å; F284-Y308 HydrophobicContact CE2-CE1 4.41Å; P291-Y308 HydrophobicContact CB-CD2 4.18Å; P291-Y308 HydrophobicContact CB-CE1 4.48Å; P291-Y308 HydrophobicContact CB-CE2 4.07Å; P291-Y308 HydrophobicContact CB-CG 4.42Å; P291-Y308 WeakPolarHBondContact O-CD2 3.16Å; V294-Y308 HydrophobicContact CB-CD2 4.08Å; V294-Y308 HydrophobicContact CB-CE2 3.98Å; V294-Y308 HydrophobicContact CG1-CE2 4.47Å; V294-Y308 HydrophobicContact CG2-CD2 4.23Å; V294-Y308 HydrophobicContact CG2-CE2 3.84Å; Q306-Y308 PolarHBondContact O-N 2.81Å; Y308-R310 VanDerWaalsContact C-N 3.25Å
309	D	88.9	Confident	92.7	Very high	86 Å²	86	33.5 Å²	33.5	46%	0.46	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-11.9	171.6	-64.6	-34.1	0	0	0	112.8	Q306 M311	Q306-D309 HydrophobicContact CB-CB 4.04Å; Q306-D309 PolarHBondContact O-N 2.87Å; D309-M311 VanDerWaalsContact C-N 3.27Å; D309-M311 HydrophobicContact CB-CG 4.36Å; D309-M311 PolarHBondContact O-N 3.04Å
310	R	91.8	Very high	92.6	Very high	21 Å²	21	40.1 Å²	40.1	8%	0.079	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	60	34	-178.4	-66.2	-60.8	-162.7	-91.7	-3.7	113.2	Q306 L307 Y308 V324 E344	Q306-R310 PolarHBondContact O-N 3.01Å; L307-R310 PolarHBondContact O-NH1 2.83Å; Y308-R310 VanDerWaalsContact C-N 3.25Å; R310-V324 WeakPolarHBondContact CB-O 3.45Å; R310-V324 WeakPolarHBondContact CD-O 3.18Å; R310-V324 PolarHBondContact O-N 3.41Å; R310-E344 IonicContact CZ-OE1 2.75Å; R310-E344 IonicContact CZ-OE2 3.72Å; R310-E344 IonicContact NE-OE1 3.61Å; R310-E344 PolarHBondContact NE-OE1 2.69Å; R310-E344 IonicContact NE-OE2 2.6Å; R310-E344 IonicContact NH2-OE1 2.61Å; R310-E344 PolarHBondContact NH2-OE1 3.02Å; R310-E344 IonicContact NH2-OE2 3.41Å; R310-E344 PolarHBondContact NH2-OE2 3.17Å
311	M	93.7	Very high	92.8	Very high	50 Å²	50	43.2 Å²	43.2	25%	0.246	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.4	179.3	-63	-55	-61.3	0	0	112.3	V305 Q306 D309 P321 T322	V305-M311 CarbonylContact C-O 3.58Å; V305-M311 WeakPolarHBondContact CA-O 3.26Å; Q306-M311 PolarHBondContact N-O 2.69Å; Q306-M311 PolarHBondContact O-N 3.44Å; D309-M311 VanDerWaalsContact C-N 3.27Å; D309-M311 HydrophobicContact CB-CG 4.36Å; D309-M311 PolarHBondContact O-N 3.04Å; M311-P321 VanDerWaalsContact CE-C 3.49Å; M311-P321 HydrophobicContact CE-CB 3.57Å; M311-P321 WeakPolarHBondContact CE-O 3.25Å; M311-T322 CarbonylContact C-O 3.5Å; M311-T322 WeakPolarHBondContact CA-O 3.3Å
312	R	95.3	Very high	92.9	Very high	7 Å²	7	43.5 Å²	43.5	3%	0.026	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	126.4	171.7	163.6	177.7	171.9	151	2.4	109.1	D299 Y303 V305 P321 T322 V324	D299-R312 IonicContact OD1-CZ 3.28Å; D299-R312 VanDerWaalsContact OD1-CZ 3.29Å; D299-R312 IonicContact OD1-NH1 3.85Å; D299-R312 PolarHBondContact OD1-NH1 2.99Å; D299-R312 IonicContact OD1-NH2 2.86Å; D299-R312 PolarHBondContact OD1-NH2 2.85Å; D299-R312 IonicContact OD2-CZ 2.73Å; D299-R312 VanDerWaalsContact OD2-CZ 3.23Å; D299-R312 IonicContact OD2-NH1 2.74Å; D299-R312 PolarHBondContact OD2-NH1 2.94Å; D299-R312 IonicContact OD2-NH2 3.18Å; D299-R312 PolarHBondContact OD2-NH2 3.36Å; Y303-R312 HydrophobicContact CD1-CG 3.62Å; Y303-R312 HydrophobicContact CE1-CG 4.42Å; Y303-R312 HydrophobicContact CG-CG 4.17Å; V305-R312 HydrophobicContact CG2-CB 4.16Å; V305-R312 HydrophobicContact CG2-CG 4.48Å; R312-P321 CarbonylContact O-C 3.55Å; R312-P321 VanDerWaalsContact O-CA 3.28Å; R312-P321 WeakPolarHBondContact O-CA 3.31Å; R312-T322 WeakPolarHBondContact CB-OG1 3.33Å; R312-T322 PolarHBondContact N-O 2.8Å; R312-T322 PolarHBondContact O-N 2.81Å; R312-T322 PolarHBondContact O-OG1 2.61Å; R312-V324 HydrophobicContact CB-CG2 3.36Å
313	S	95.6	Very high	92.9	Very high	35 Å²	35	46.7 Å²	46.7	25%	0.245	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	143.7	174.8	55.9	0	0	0	0	111.4	Y303 D304	Y303-S313 VanDerWaalsContact CA-O 3.31Å; Y303-S313 WeakPolarHBondContact CA-O 3.32Å; Y303-S313 WeakPolarHBondContact CD1-O 3.49Å; D304-S313 PolarHBondContact N-O 2.97Å; D304-S313 PolarHBondContact O-N 2.98Å; D304-S313 PolarHBondContact O-OG 3.39Å
314	A	95.6	Very high	92.8	Very high	20 Å²	20	46 Å²	46	17%	0.165	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	141.6	170.1	0	0	0	0	0	109.9	Y303 W317 E319	Y303-A314 HydrophobicContact CD1-CB 4.11Å; Y303-A314 HydrophobicContact CE1-CB 3.74Å; A314-W317 HydrophobicContact CB-CD2 4.5Å; A314-W317 HydrophobicContact CB-CG 4.3Å; A314-W317 WeakPolarHBondContact CB-O 3.17Å; A314-E319 HydrophobicContact CB-CB 3.71Å
315	V	95.2	Very high	92.7	Very high	23 Å²	23	46.9 Å²	46.9	14%	0.139	24%	0.235	C	C	.	.	S	Bend	trans	-96.7	-45.4	-177.5	175.4	0	0	0	0	111.6	R302 D304 L549	R302-V315 VanDerWaalsContact O-CB 3.31Å; R302-V315 WeakPolarHBondContact O-CB 3.16Å; R302-V315 WeakPolarHBondContact O-CG2 3.23Å; R302-V315 PolarHBondContact O-N 2.82Å; D304-V315 HydrophobicContact CB-CG2 3.95Å; V315-L549 HydrophobicContact CG1-CD1 4.49Å; V315-L549 HydrophobicContact CG1-CD2 4.09Å; V315-L549 HydrophobicContact CG1-CG 4.37Å; V315-L549 VanDerWaalsContact O-CD2 3.28Å; V315-L549 WeakPolarHBondContact O-CD2 3.4Å
316	Y	94.4	Very high	92.6	Very high	5 Å²	5	48.1 Å²	48.1	2%	0.02	24%	0.24	C	C	.	.	S	Bend	trans	-89.4	-27.4	-170	-67.6	-71.9	0	0	0	113.3	R302 L482 R545 L546 L549 F550	R302-Y316 HydrophobicContact CB-CD2 4.16Å; R302-Y316 HydrophobicContact CB-CE2 4.38Å; R302-Y316 HydrophobicContact CG-CD2 4.14Å; R302-Y316 HydrophobicContact CG-CE2 4.13Å; Y316-L482 HydrophobicContact CD1-CD1 3.83Å; Y316-L482 HydrophobicContact CD1-CD2 4.27Å; Y316-L482 HydrophobicContact CD2-CD2 3.77Å; Y316-L482 HydrophobicContact CE1-CD1 3.92Å; Y316-L482 HydrophobicContact CE2-CD2 4.11Å; Y316-L482 HydrophobicContact CG-CD1 4.26Å; Y316-L482 HydrophobicContact CG-CD2 3.85Å; Y316-R545 PolarHBondContact O-NH2 3.2Å; Y316-L546 HydrophobicContact CD1-CD2 4.08Å; Y316-L546 HydrophobicContact CG-CD2 4.45Å; Y316-L546 VanDerWaalsContact O-CD2 3.23Å; Y316-L546 WeakPolarHBondContact O-CD2 3.34Å; Y316-L549 HydrophobicContact CD1-CD2 3.96Å; Y316-L549 HydrophobicContact CD1-CG 4.21Å; Y316-L549 HydrophobicContact CE1-CB 4.46Å; Y316-L549 HydrophobicContact CE1-CD2 4.3Å; Y316-L549 HydrophobicContact CE1-CG 4.05Å; Y316-F550 HydrophobicContact CE1-CB 4.05Å; Y316-F550 HydrophobicContact CE1-CD2 4.48Å
317	W	92.7	Very high	92.5	Very high	12 Å²	12	44.7 Å²	44.7	5%	0.045	22%	0.224	C	C	.	.	S	Bend	trans	-127.8	165.4	-180	53.5	83.6	0	0	0	110.9	R302 Y303 A314 E319 I449 P483	R302-W317 HydrophobicContact CB-CH2 4.11Å; Y303-W317 HydrophobicContact CE2-CH2 4.25Å; Y303-W317 AromaticContact CE2-CZ2 3.63Å; Y303-W317 HydrophobicContact CE2-CZ2 3.63Å; Y303-W317 AromaticContact CZ-CZ2 3.67Å; Y303-W317 WeakPolarHBondContact OH-CZ2 3.3Å; A314-W317 HydrophobicContact CB-CD2 4.5Å; A314-W317 HydrophobicContact CB-CG 4.3Å; A314-W317 WeakPolarHBondContact CB-O 3.17Å; W317-E319 PolarHBondContact NE1-OE2 2.86Å; W317-I449 HydrophobicContact CB-CD1 4.32Å; W317-I449 HydrophobicContact CD2-CD1 4.08Å; W317-I449 HydrophobicContact CD2-CG1 4.06Å; W317-I449 HydrophobicContact CD2-CG2 4.48Å; W317-I449 HydrophobicContact CG-CD1 3.67Å; W317-I449 HydrophobicContact CG-CG1 4.09Å; W317-I449 HydrophobicContact CH2-CG2 4.22Å; W317-I449 HydrophobicContact CZ2-CG2 3.67Å; W317-P483 HydrophobicContact CE3-CG 3.87Å; W317-P483 HydrophobicContact CZ3-CG 4.14Å
318	E	88.5	Confident	92.6	Very high	189 Å²	189	45.4 Å²	45.4	88%	0.883	23%	0.228	S	C	*	.			trans	-80.3	124.1	174	-61.7	-173.7	166.9	0	0	110
319	E	88.6	Confident	92.9	Very high	63 Å²	63	44.6 Å²	44.6	29%	0.294	23%	0.225	S	C	.	.			trans	-149.7	146.9	176.9	-168.5	172.3	-179	0	0	108.3	Y303 A314 W317	Y303-E319 WeakPolarHBondContact CE1-OE2 3.29Å; Y303-E319 PolarHBondContact OH-OE2 3.05Å; A314-E319 HydrophobicContact CB-CB 3.71Å; W317-E319 PolarHBondContact NE1-OE2 2.86Å
320	E	90.4	Very high	93	Very high	167 Å²	167	40.8 Å²	40.8	78%	0.78	20%	0.204	S	C	*	.			trans	-65.4	132.2	176	-67	-167.1	151.3	0	0	110.7	T322	E320-T322 PolarHBondContact O-N 3.37Å
321	P	93.4	Very high	92.8	Very high	79 Å²	79	42.5 Å²	42.5	51%	0.513	21%	0.211	S	C	.	.			trans	-58.7	133.7	177.4	-27.7	36.6	0	0	0	112.9	M311 R312	M311-P321 VanDerWaalsContact CE-C 3.49Å; M311-P321 HydrophobicContact CE-CB 3.57Å; M311-P321 WeakPolarHBondContact CE-O 3.25Å; R312-P321 CarbonylContact O-C 3.55Å; R312-P321 VanDerWaalsContact O-CA 3.28Å; R312-P321 WeakPolarHBondContact O-CA 3.31Å
322	T	93.8	Very high	92.4	Very high	18 Å²	18	43.8 Å²	43.8	11%	0.11	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	147.2	-172.3	44.9	0	0	0	0	112.3	C260 M311 R312 E320	C260-T322 VanDerWaalsContact O-CB 3.23Å; C260-T322 WeakPolarHBondContact O-CB 3.46Å; C260-T322 WeakPolarHBondContact O-CG2 3.28Å; M311-T322 CarbonylContact C-O 3.5Å; M311-T322 WeakPolarHBondContact CA-O 3.3Å; R312-T322 WeakPolarHBondContact CB-OG1 3.33Å; R312-T322 PolarHBondContact N-O 2.8Å; R312-T322 PolarHBondContact O-N 2.81Å; R312-T322 PolarHBondContact O-OG1 2.61Å; E320-T322 PolarHBondContact O-N 3.37Å
323	E	93.8	Very high	91.6	Very high	74 Å²	74	44.5 Å²	44.5	35%	0.346	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	135.3	175.4	-164.7	-159.1	145.9	0	0	110.2	Y259 C260 W269 R325	Y259-E323 CarbonylContact C-O 3.48Å; Y259-E323 WeakPolarHBondContact CA-O 3.46Å; C260-E323 HydrophobicContact CB-CB 4.07Å; C260-E323 PolarHBondContact N-O 3.16Å; W269-E323 HydrophobicContact CH2-CB 4.12Å; W269-E323 VanDerWaalsContact CH2-CD 3.46Å; W269-E323 HydrophobicContact CH2-CG 4.03Å; W269-E323 WeakPolarHBondContact CH2-OE1 3.32Å; E323-R325 VanDerWaalsContact CD-NH2 3.26Å; E323-R325 IonicContact OE1-CZ 3.34Å; E323-R325 IonicContact OE1-NE 2.84Å; E323-R325 PolarHBondContact OE1-NE 2.85Å; E323-R325 IonicContact OE1-NH2 2.71Å; E323-R325 PolarHBondContact OE1-NH2 2.78Å; E323-R325 IonicContact OE2-CZ 3.82Å; E323-R325 IonicContact OE2-NH2 3.5Å; E323-R325 PolarHBondContact OE2-NH2 2.67Å
324	V	94.9	Very high	90.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	139.1	171.6	-161	0	0	0	0	109.1	W257 F258 L272 V305 R310 R312	W257-V324 HydrophobicContact CE3-CG1 4.01Å; F258-V324 CarbonylContact O-C 3.56Å; F258-V324 VanDerWaalsContact O-CA 3.28Å; F258-V324 WeakPolarHBondContact O-CA 3.38Å; F258-V324 VanDerWaalsContact O-CG1 3.28Å; F258-V324 WeakPolarHBondContact O-CG1 3.47Å; L272-V324 HydrophobicContact CD1-CG1 4.02Å; V305-V324 HydrophobicContact CG1-CB 4.43Å; V305-V324 HydrophobicContact CG1-CG1 4.43Å; V305-V324 HydrophobicContact CG1-CG2 4.05Å; V305-V324 HydrophobicContact CG2-CG2 4.36Å; R310-V324 WeakPolarHBondContact CB-O 3.45Å; R310-V324 WeakPolarHBondContact CD-O 3.18Å; R310-V324 PolarHBondContact O-N 3.41Å; R312-V324 HydrophobicContact CB-CG2 3.36Å
325	R	93.1	Very high	88.9	Confident	43 Å²	43	57.7 Å²	57.7	16%	0.162	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	126.8	-172.3	-170.5	179	-69	177.3	0.5	111.9	W257 F258 W269 E323 P341 Y342 E344	W257-R325 WeakPolarHBondContact CA-O 3.4Å; F258-R325 PolarHBondContact N-O 3.14Å; F258-R325 PolarHBondContact O-N 2.88Å; W269-R325 HydrophobicContact CE3-CB 4.47Å; W269-R325 HydrophobicContact CH2-CB 3.68Å; W269-R325 VanDerWaalsContact CZ2-NH2 3.29Å; W269-R325 HydrophobicContact CZ3-CB 3.5Å; E323-R325 VanDerWaalsContact CD-NH2 3.26Å; E323-R325 IonicContact OE1-CZ 3.34Å; E323-R325 IonicContact OE1-NE 2.84Å; E323-R325 PolarHBondContact OE1-NE 2.85Å; E323-R325 IonicContact OE1-NH2 2.71Å; E323-R325 PolarHBondContact OE1-NH2 2.78Å; E323-R325 IonicContact OE2-CZ 3.82Å; E323-R325 IonicContact OE2-NH2 3.5Å; E323-R325 PolarHBondContact OE2-NH2 2.67Å; R325-P341 PolarHBondContact NH1-O 2.91Å; R325-P341 VanDerWaalsContact NH1-O 3.16Å; R325-Y342 WeakPolarHBondContact CD-O 3.47Å; R325-E344 HydrophobicContact CG-CG 4.04Å
326	R	93.7	Very high	87.4	Confident	26 Å²	26	59.6 Å²	59.6	10%	0.098	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	109	174.6	180	-174.3	175.2	-89.5	1.4	109.6	P255 W257 E281 E344	P255-R326 HydrophobicContact CB-CG 3.95Å; P255-R326 VanDerWaalsContact CG-NH2 3.3Å; W257-R326 HydrophobicContact CD2-CB 3.75Å; W257-R326 HydrophobicContact CD2-CG 4.17Å; W257-R326 HydrophobicContact CE3-CB 3.9Å; W257-R326 HydrophobicContact CG-CB 4.43Å; W257-R326 HydrophobicContact CH2-CB 3.94Å; W257-R326 HydrophobicContact CH2-CG 4.47Å; W257-R326 HydrophobicContact CZ2-CB 3.78Å; W257-R326 HydrophobicContact CZ2-CG 3.84Å; W257-R326 HydrophobicContact CZ3-CB 3.99Å; E281-R326 IonicContact OE1-CZ 3.35Å; E281-R326 IonicContact OE1-NE 3.77Å; E281-R326 PolarHBondContact OE1-NE 3.39Å; E281-R326 IonicContact OE1-NH2 3.74Å; E281-R326 PolarHBondContact OE1-NH2 3.13Å; E281-R326 WeakPolarHBondContact OE2-CD 3.34Å; E281-R326 IonicContact OE2-CZ 2.74Å; E281-R326 IonicContact OE2-NE 3.01Å; E281-R326 PolarHBondContact OE2-NE 3.11Å; E281-R326 IonicContact OE2-NH2 3.01Å; R326-E344 WeakPolarHBondContact CB-OE1 3.28Å; R326-E344 PolarHBondContact N-OE1 3Å; R326-E344 WeakPolarHBondContact O-CG 3.43Å
327	C	91.1	Very high	86.2	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.007	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	149.7	-169.8	-157.5	0	0	0	0	113.8	P255 H256 F258 W329 F330 P341 Y342	P255-C327 WeakPolarHBondContact CA-O 3.49Å; H256-C327 PolarHBondContact N-O 3.43Å; H256-C327 PolarHBondContact O-N 3.03Å; F258-C327 HydrophobicContact CD2-CB 4.05Å; F258-C327 HydrophobicContact CE2-CB 4.27Å; C327-W329 PolarHBondContact SG-O 2.95Å; C327-F330 HydrophobicContact CB-CE1 4.08Å; C327-F330 HydrophobicContact CB-CZ 4.08Å; C327-P341 HydrophobicContact CB-CB 3.68Å; C327-P341 VanDerWaalsContact SG-CA 3.57Å; C327-P341 WeakPolarHBondContact SG-CB 3.5Å; C327-Y342 PolarHBondContact SG-O 3.35Å
328	T	93.5	Very high	85.4	Confident	17 Å²	17	68.6 Å²	68.6	10%	0.104	34%	0.336	C	S	.	.	S	Bend	trans	-131.9	-5.7	174	50.2	0	0	0	0	113.3	V253 P255 S347 G411	V253-T328 HydrophobicContact CG1-CG2 3.79Å; V253-T328 HydrophobicContact CG2-CG2 4.11Å; P255-T328 HydrophobicContact CB-CG2 3.83Å; P255-T328 HydrophobicContact CG-CG2 3.9Å; T328-S347 WeakPolarHBondContact OG1-CB 3.48Å; T328-G411 PolarHBondContact O-N 3.35Å
329	W	92.8	Very high	85	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	138.4	-175.2	-77.5	89.3	0	0	0	111.6	C327 Y342 L350 E351 Y354 M377 I383 V408 K409 R410	C327-W329 PolarHBondContact SG-O 2.95Å; W329-Y342 HydrophobicContact CB-CD2 3.99Å; W329-Y342 WeakPolarHBondContact O-CB 3.45Å; W329-Y342 WeakPolarHBondContact O-CD2 3.38Å; W329-Y342 PolarHBondContact O-N 2.88Å; W329-L350 HydrophobicContact CB-CD2 4.02Å; W329-L350 HydrophobicContact CD2-CB 4.48Å; W329-L350 HydrophobicContact CD2-CD2 3.48Å; W329-L350 VanDerWaalsContact CD2-CD2 3.48Å; W329-L350 HydrophobicContact CD2-CG 3.79Å; W329-L350 HydrophobicContact CE3-CD2 3.39Å; W329-L350 HydrophobicContact CE3-CG 3.93Å; W329-L350 HydrophobicContact CG-CD2 3.78Å; W329-L350 HydrophobicContact CG-CG 4.25Å; W329-L350 HydrophobicContact CH2-CG 4.32Å; W329-L350 HydrophobicContact CZ2-CG 4.22Å; W329-L350 HydrophobicContact CZ3-CD2 3.99Å; W329-L350 HydrophobicContact CZ3-CG 4.18Å; W329-E351 WeakPolarHBondContact CZ2-OE2 3.49Å; W329-E351 PolarHBondContact NE1-OE2 2.88Å; W329-Y354 AromaticContact CH2-CD2 3.67Å; W329-Y354 HydrophobicContact CH2-CD2 3.67Å; W329-Y354 HydrophobicContact CH2-CE2 4.33Å; W329-Y354 AromaticContact CH2-CG 3.87Å; W329-Y354 HydrophobicContact CH2-CG 3.87Å; W329-Y354 HydrophobicContact CZ2-CD1 4.21Å; W329-Y354 AromaticContact CZ2-CD2 3.98Å; W329-Y354 HydrophobicContact CZ2-CD2 3.98Å; W329-Y354 AromaticContact CZ2-CG 3.66Å; W329-Y354 HydrophobicContact CZ2-CG 3.66Å; W329-M377 HydrophobicContact CH2-CE 4.15Å; W329-I383 HydrophobicContact CH2-CD1 3.56Å; W329-I383 HydrophobicContact CZ3-CD1 3.6Å; W329-I383 HydrophobicContact CZ3-CG2 4.49Å; W329-V408 HydrophobicContact CE3-CG1 3.62Å; W329-V408 HydrophobicContact CZ3-CG1 3.8Å; W329-K409 WeakPolarHBondContact CA-O 3.43Å; W329-R410 HydrophobicContact CD2-CB 4.05Å; W329-R410 HydrophobicContact CD2-CG 4.14Å; W329-R410 HydrophobicContact CE3-CB 3.87Å; W329-R410 HydrophobicContact CE3-CG 4.44Å; W329-R410 HydrophobicContact CH2-CB 3.74Å; W329-R410 HydrophobicContact CH2-CG 4.01Å; W329-R410 HydrophobicContact CZ2-CB 3.88Å; W329-R410 VanDerWaalsContact CZ2-CD 3.46Å; W329-R410 HydrophobicContact CZ2-CG 3.62Å; W329-R410 HydrophobicContact CZ3-CB 3.73Å; W329-R410 HydrophobicContact CZ3-CG 4.4Å
330	F	91.3	Very high	84.9	Confident	6 Å²	6	61 Å²	61	3%	0.026	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	155.2	-171.4	-52.3	-90.4	0	0	0	111.8	F258 C327 F339 V340 P341 V408 K409 G411 V412	F258-F330 HydrophobicContact CD2-CE1 4.13Å; F258-F330 HydrophobicContact CD2-CZ 4.45Å; F258-F330 HydrophobicContact CE1-CE1 4.02Å; F258-F330 AromaticContact CE2-CE1 3.38Å; F258-F330 HydrophobicContact CE2-CE1 3.38Å; F258-F330 AromaticContact CE2-CZ 3.43Å; F258-F330 HydrophobicContact CE2-CZ 3.43Å; F258-F330 VanDerWaalsContact CE2-CZ 3.43Å; F258-F330 HydrophobicContact CZ-CD1 4.44Å; F258-F330 AromaticContact CZ-CE1 3.33Å; F258-F330 HydrophobicContact CZ-CE1 3.33Å; F258-F330 AromaticContact CZ-CZ 3.56Å; F258-F330 HydrophobicContact CZ-CZ 3.56Å; C327-F330 HydrophobicContact CB-CE1 4.08Å; C327-F330 HydrophobicContact CB-CZ 4.08Å; F330-F339 HydrophobicContact CB-CB 3.99Å; F330-F339 HydrophobicContact CB-CD1 4.13Å; F330-F339 HydrophobicContact CB-CG 4.36Å; F330-F339 HydrophobicContact CG-CB 4.44Å; F330-V340 VanDerWaalsContact CA-O 3.3Å; F330-V340 WeakPolarHBondContact CA-O 3.15Å; F330-P341 HydrophobicContact CD1-CB 4.06Å; F330-P341 HydrophobicContact CE1-CB 3.91Å; F330-V408 CarbonylContact O-C 3.54Å; F330-V408 VanDerWaalsContact O-CA 3.31Å; F330-V408 WeakPolarHBondContact O-CA 3.4Å; F330-K409 HydrophobicContact CB-CB 4.45Å; F330-K409 PolarHBondContact N-O 3.03Å; F330-K409 PolarHBondContact O-N 2.83Å; F330-G411 WeakPolarHBondContact CD2-O 3.46Å; F330-G411 VanDerWaalsContact CE2-O 3.26Å; F330-G411 WeakPolarHBondContact CE2-O 3.34Å; F330-V412 HydrophobicContact CE2-CG2 4.19Å; F330-V412 HydrophobicContact CZ-CG2 4.02Å
331	Y	88.4	Confident	84.9	Confident	57 Å²	57	53.1 Å²	53.1	22%	0.224	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	148.4	166.3	65.4	-87.9	0	0	0	111.3	F339 V340 Y342 V407	Y331-F339 CarbonylContact O-C 3.48Å; Y331-F339 WeakPolarHBondContact O-CA 3.39Å; Y331-V340 HydrophobicContact CD1-CB 4.3Å; Y331-V340 HydrophobicContact CD2-CB 4.34Å; Y331-V340 HydrophobicContact CE1-CB 3.85Å; Y331-V340 HydrophobicContact CE1-CG1 3.85Å; Y331-V340 HydrophobicContact CE2-CB 3.9Å; Y331-V340 HydrophobicContact CE2-CG1 4.34Å; Y331-V340 HydrophobicContact CE2-CG2 4.18Å; Y331-V340 PolarHBondContact N-O 2.81Å; Y331-V340 PolarHBondContact O-N 2.95Å; Y331-V340 WeakPolarHBondContact OH-CG1 3.26Å; Y331-Y342 AromaticContact CD1-CD1 3.83Å; Y331-Y342 HydrophobicContact CD1-CD1 3.83Å; Y331-Y342 HydrophobicContact CD1-CD2 4.24Å; Y331-Y342 AromaticContact CD1-CE1 3.54Å; Y331-Y342 HydrophobicContact CD1-CE1 3.54Å; Y331-Y342 AromaticContact CD1-CE2 3.98Å; Y331-Y342 HydrophobicContact CD1-CE2 3.98Å; Y331-Y342 HydrophobicContact CD1-CG 4.18Å; Y331-Y342 AromaticContact CD1-CZ 3.63Å; Y331-Y342 HydrophobicContact CE1-CD1 4.17Å; Y331-Y342 HydrophobicContact CE1-CE1 4.11Å; Y331-Y342 HydrophobicContact CG-CE1 4.35Å; Y331-Y342 HydrophobicContact CG-CE2 4.47Å; Y331-V407 WeakPolarHBondContact CA-O 3.4Å
332	K	85.4	Confident	84.8	Confident	78 Å²	78	49.9 Å²	49.9	34%	0.339	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	135.7	173.9	-168.4	161.5	-173.8	132.9	0	110.8	S337 F339 R406 V407	K332-S337 WeakPolarHBondContact CE-O 3.32Å; K332-S337 PolarHBondContact NZ-O 3.39Å; K332-S337 VanDerWaalsContact NZ-O 3.09Å; K332-F339 HydrophobicContact CB-CD1 4.23Å; K332-F339 HydrophobicContact CB-CE1 4.05Å; K332-R406 WeakPolarHBondContact O-CD 3.47Å; K332-V407 HydrophobicContact CB-CB 4.34Å; K332-V407 PolarHBondContact N-O 3.25Å
333	G	76.5	Confident	84.6	Confident	22 Å²	22	51.8 Å²	51.8	23%	0.227	26%	0.257	C	S	.	.			trans	-67.1	158.1	177.6	0	0	0	0	0	113.9	D336 R338	G333-D336 CarbonylContact C-O 3.56Å; G333-R338 PolarHBondContact N-O 3.4Å
334	D	68.6	Low	84.4	Confident	116 Å²	116	50.3 Å²	50.3	62%	0.62	25%	0.25	S	S	*	.	S	Bend	trans	-73.9	-37.2	-180	-61.8	-32.4	0	0	0	113.1	R406	D334-R406 IonicContact OD1-CZ 2.82Å; D334-R406 IonicContact OD1-NE 2.72Å; D334-R406 PolarHBondContact OD1-NE 2.9Å; D334-R406 IonicContact OD1-NH2 3.77Å; D334-R406 PolarHBondContact OD1-NH2 3.07Å; D334-R406 IonicContact OD2-CZ 2.61Å; D334-R406 IonicContact OD2-NE 2.74Å; D334-R406 IonicContact OD2-NH2 3.67Å; D334-R406 PolarHBondContact OD2-NH2 2.99Å
335	K	67.6	Low	84.1	Confident	215 Å²	215	55 Å²	55	94%	0.935	27%	0.272	S	S	*	.	S	Bend	trans	-111	-11	-173.8	-61.1	-177.3	-178.3	178.8	0	113.2
336	D	62.9	Low	83.9	Confident	63 Å²	63	53.6 Å²	53.6	34%	0.337	27%	0.267	S	S	.	.			trans	-129	137.9	-173	-169.9	-29.6	0	0	0	108.2	G333 R338	G333-D336 CarbonylContact C-O 3.56Å; D336-R338 PolarHBondContact O-N 3.31Å; D336-R338 WeakPolarHBondContact OD1-CB 3.43Å; D336-R338 WeakPolarHBondContact OD1-CG 3.4Å; D336-R338 PolarHBondContact OD1-N 2.91Å; D336-R338 IonicContact OD1-NE 2.87Å; D336-R338 PolarHBondContact OD1-NE 3.16Å; D336-R338 IonicContact OD2-CZ 3.2Å; D336-R338 IonicContact OD2-NE 3.7Å; D336-R338 PolarHBondContact OD2-NE 2.95Å; D336-R338 IonicContact OD2-NH2 3.23Å; D336-R338 PolarHBondContact OD2-NH2 3.05Å
337	S	68.8	Low	83.8	Confident	87 Å²	87	52.5 Å²	52.5	61%	0.608	26%	0.263	S	S	*	.	S	Bend	trans	-73.9	-14.3	-179	63.9	0	0	0	0	114.1	K332	K332-S337 WeakPolarHBondContact CE-O 3.32Å; K332-S337 PolarHBondContact NZ-O 3.39Å; K332-S337 VanDerWaalsContact NZ-O 3.09Å
338	R	75.8	Confident	83.8	Confident	119 Å²	119	56.9 Å²	56.9	45%	0.449	28%	0.284	S	S	.	.	S	Bend	trans	-64.9	151.5	178.9	-70	-177.5	-69.6	177.1	1.8	113.1	G333 D336	G333-R338 PolarHBondContact N-O 3.4Å; D336-R338 PolarHBondContact O-N 3.31Å; D336-R338 WeakPolarHBondContact OD1-CB 3.43Å; D336-R338 WeakPolarHBondContact OD1-CG 3.4Å; D336-R338 PolarHBondContact OD1-N 2.91Å; D336-R338 IonicContact OD1-NE 2.87Å; D336-R338 PolarHBondContact OD1-NE 3.16Å; D336-R338 IonicContact OD2-CZ 3.2Å; D336-R338 IonicContact OD2-NE 3.7Å; D336-R338 PolarHBondContact OD2-NE 2.95Å; D336-R338 IonicContact OD2-NH2 3.23Å; D336-R338 PolarHBondContact OD2-NH2 3.05Å
339	F	80.4	Confident	83.6	Confident	60 Å²	60	60.8 Å²	60.8	26%	0.263	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	142.2	171	-74	-70.2	0	0	0	110.4	F330 Y331 K332 K409	F330-F339 HydrophobicContact CB-CB 3.99Å; F330-F339 HydrophobicContact CB-CD1 4.13Å; F330-F339 HydrophobicContact CB-CG 4.36Å; F330-F339 HydrophobicContact CG-CB 4.44Å; Y331-F339 CarbonylContact O-C 3.48Å; Y331-F339 WeakPolarHBondContact O-CA 3.39Å; K332-F339 HydrophobicContact CB-CD1 4.23Å; K332-F339 HydrophobicContact CB-CE1 4.05Å; F339-K409 HydrophobicContact CD1-CB 4.18Å; F339-K409 HydrophobicContact CD1-CD 4.38Å; F339-K409 HydrophobicContact CD2-CD 4.15Å; F339-K409 HydrophobicContact CE1-CB 3.76Å; F339-K409 HydrophobicContact CE1-CD 4.02Å; F339-K409 HydrophobicContact CE2-CD 3.76Å; F339-K409 HydrophobicContact CG-CD 4.45Å; F339-K409 HydrophobicContact CZ-CB 4.2Å; F339-K409 HydrophobicContact CZ-CD 3.7Å
340	V	86.7	Confident	83.5	Confident	34 Å²	34	60.8 Å²	60.8	21%	0.206	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.1	178.9	-176.1	0	0	0	0	109	F330 Y331 Y342	F330-V340 VanDerWaalsContact CA-O 3.3Å; F330-V340 WeakPolarHBondContact CA-O 3.15Å; Y331-V340 HydrophobicContact CD1-CB 4.3Å; Y331-V340 HydrophobicContact CD2-CB 4.34Å; Y331-V340 HydrophobicContact CE1-CB 3.85Å; Y331-V340 HydrophobicContact CE1-CG1 3.85Å; Y331-V340 HydrophobicContact CE2-CB 3.9Å; Y331-V340 HydrophobicContact CE2-CG1 4.34Å; Y331-V340 HydrophobicContact CE2-CG2 4.18Å; Y331-V340 PolarHBondContact N-O 2.81Å; Y331-V340 PolarHBondContact O-N 2.95Å; Y331-V340 WeakPolarHBondContact OH-CG1 3.26Å; V340-Y342 PolarHBondContact O-N 3.49Å
341	P	90.7	Very high	83.6	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.006	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	127	179.8	26.5	-33.6	0	0	0	112	F258 W269 R325 C327 F330	F258-P341 HydrophobicContact CB-CG 4.33Å; F258-P341 HydrophobicContact CG-CG 4.35Å; W269-P341 HydrophobicContact CB-CG 3.82Å; W269-P341 HydrophobicContact CD2-CG 3.49Å; W269-P341 VanDerWaalsContact CD2-CG 3.49Å; W269-P341 HydrophobicContact CE3-CG 3.74Å; W269-P341 HydrophobicContact CG-CG 3.52Å; R325-P341 PolarHBondContact NH1-O 2.91Å; R325-P341 VanDerWaalsContact NH1-O 3.16Å; C327-P341 HydrophobicContact CB-CB 3.68Å; C327-P341 VanDerWaalsContact SG-CA 3.57Å; C327-P341 WeakPolarHBondContact SG-CB 3.5Å; F330-P341 HydrophobicContact CD1-CB 4.06Å; F330-P341 HydrophobicContact CE1-CB 3.91Å
342	Y	91	Very high	83.8	Confident	11 Å²	11	61.5 Å²	61.5	4%	0.043	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-63	158	165.2	-77.3	-67.6	0	0	0	110.7	R325 C327 W329 Y331 V340 F346 L350 Q385 V408	R325-Y342 WeakPolarHBondContact CD-O 3.47Å; C327-Y342 PolarHBondContact SG-O 3.35Å; W329-Y342 HydrophobicContact CB-CD2 3.99Å; W329-Y342 WeakPolarHBondContact O-CB 3.45Å; W329-Y342 WeakPolarHBondContact O-CD2 3.38Å; W329-Y342 PolarHBondContact O-N 2.88Å; Y331-Y342 AromaticContact CD1-CD1 3.83Å; Y331-Y342 HydrophobicContact CD1-CD1 3.83Å; Y331-Y342 HydrophobicContact CD1-CD2 4.24Å; Y331-Y342 AromaticContact CD1-CE1 3.54Å; Y331-Y342 HydrophobicContact CD1-CE1 3.54Å; Y331-Y342 AromaticContact CD1-CE2 3.98Å; Y331-Y342 HydrophobicContact CD1-CE2 3.98Å; Y331-Y342 HydrophobicContact CD1-CG 4.18Å; Y331-Y342 AromaticContact CD1-CZ 3.63Å; Y331-Y342 HydrophobicContact CE1-CD1 4.17Å; Y331-Y342 HydrophobicContact CE1-CE1 4.11Å; Y331-Y342 HydrophobicContact CG-CE1 4.35Å; Y331-Y342 HydrophobicContact CG-CE2 4.47Å; V340-Y342 PolarHBondContact O-N 3.49Å; Y342-F346 AromaticContact CD1-CD1 3.43Å; Y342-F346 HydrophobicContact CD1-CD1 3.43Å; Y342-F346 VanDerWaalsContact CD1-CD1 3.43Å; Y342-F346 AromaticContact CD1-CE1 3.55Å; Y342-F346 HydrophobicContact CD1-CE1 3.55Å; Y342-F346 HydrophobicContact CD1-CG 4.15Å; Y342-F346 HydrophobicContact CD1-CZ 4.35Å; Y342-F346 HydrophobicContact CD2-CD1 4.11Å; Y342-F346 HydrophobicContact CD2-CE1 4.15Å; Y342-F346 AromaticContact CE1-CD1 3.88Å; Y342-F346 HydrophobicContact CE1-CD1 3.88Å; Y342-F346 AromaticContact CE1-CE1 3.45Å; Y342-F346 HydrophobicContact CE1-CE1 3.45Å; Y342-F346 VanDerWaalsContact CE1-CE1 3.45Å; Y342-F346 HydrophobicContact CE1-CZ 4.01Å; Y342-F346 HydrophobicContact CE2-CD1 4.49Å; Y342-F346 HydrophobicContact CE2-CE1 4.07Å; Y342-F346 AromaticContact CG-CD1 3.56Å; Y342-F346 HydrophobicContact CG-CD1 3.56Å; Y342-F346 AromaticContact CG-CE1 3.91Å; Y342-F346 HydrophobicContact CG-CE1 3.91Å; Y342-F346 HydrophobicContact CG-CG 4.48Å; Y342-F346 AromaticContact CZ-CE1 3.72Å; Y342-L350 HydrophobicContact CE2-CD2 4.44Å; Y342-Q385 PolarHBondContact OH-NE2 3.45Å; Y342-Q385 PolarHBondContact OH-OE1 3.18Å; Y342-V408 HydrophobicContact CE2-CG1 4.21Å; Y342-V408 HydrophobicContact CE2-CG2 4.37Å
343	S	89.8	Confident	84.1	Confident	57 Å²	57	60 Å²	60	40%	0.399	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-61.3	154.9	171	62.8	0	0	0	0	111.1	E345 F346 S347	S343-E345 PolarHBondContact O-N 3.38Å; S343-F346 PolarHBondContact O-N 3.12Å; S343-F346 VanDerWaalsContact O-N 3.14Å; S343-F346 WeakPolarHBondContact OG-CB 3.37Å; S343-S347 WeakPolarHBondContact O-CB 3.22Å; S343-S347 PolarHBondContact O-N 3.44Å; S343-S347 PolarHBondContact O-OG 3.25Å
344	E	89.3	Confident	84.8	Confident	43 Å²	43	60 Å²	60	20%	0.201	30%	0.302	C	S	.	.	H	α-helix	trans	-60.6	-47.3	-174.1	-44	-160.1	-179.6	0	0	110.9	R310 R325 R326 F346 S347 E348	R310-E344 IonicContact CZ-OE1 2.75Å; R310-E344 IonicContact CZ-OE2 3.72Å; R310-E344 IonicContact NE-OE1 3.61Å; R310-E344 PolarHBondContact NE-OE1 2.69Å; R310-E344 IonicContact NE-OE2 2.6Å; R310-E344 IonicContact NH2-OE1 2.61Å; R310-E344 PolarHBondContact NH2-OE1 3.02Å; R310-E344 IonicContact NH2-OE2 3.41Å; R310-E344 PolarHBondContact NH2-OE2 3.17Å; R325-E344 HydrophobicContact CG-CG 4.04Å; R326-E344 WeakPolarHBondContact CB-OE1 3.28Å; R326-E344 PolarHBondContact N-OE1 3Å; R326-E344 WeakPolarHBondContact O-CG 3.43Å; E344-F346 VanDerWaalsContact C-N 3.31Å; E344-F346 PolarHBondContact O-N 3.44Å; E344-S347 WeakPolarHBondContact O-CB 3.42Å; E344-S347 PolarHBondContact O-N 3.33Å; E344-E348 PolarHBondContact O-N 3.06Å
345	E	88.5	Confident	85.9	Confident	98 Å²	98	59.3 Å²	59.3	46%	0.458	29%	0.294	S	S	.	.	H	α-helix	trans	-56.1	-40.1	174.7	-76.6	-165.3	-137.7	0	0	114.2	S343 K349	S343-E345 PolarHBondContact O-N 3.38Å; E345-K349 WeakPolarHBondContact O-CD 3.29Å; E345-K349 WeakPolarHBondContact O-CE 3.41Å; E345-K349 WeakPolarHBondContact O-CG 3.39Å; E345-K349 PolarHBondContact O-N 2.96Å; E345-K349 IonicContact OE2-NZ 2.74Å; E345-K349 PolarHBondContact OE2-NZ 2.79Å
346	F	89.5	Confident	87	Confident	15 Å²	15	53.7 Å²	53.7	7%	0.066	27%	0.269	C	S	.	.	H	α-helix	trans	-71.8	-41.4	-179.9	-171.4	-84.5	0	0	0	110	Y342 S343 E344 E348 K349 L350 F369 I375	Y342-F346 AromaticContact CD1-CD1 3.43Å; Y342-F346 HydrophobicContact CD1-CD1 3.43Å; Y342-F346 VanDerWaalsContact CD1-CD1 3.43Å; Y342-F346 AromaticContact CD1-CE1 3.55Å; Y342-F346 HydrophobicContact CD1-CE1 3.55Å; Y342-F346 HydrophobicContact CD1-CG 4.15Å; Y342-F346 HydrophobicContact CD1-CZ 4.35Å; Y342-F346 HydrophobicContact CD2-CD1 4.11Å; Y342-F346 HydrophobicContact CD2-CE1 4.15Å; Y342-F346 AromaticContact CE1-CD1 3.88Å; Y342-F346 HydrophobicContact CE1-CD1 3.88Å; Y342-F346 AromaticContact CE1-CE1 3.45Å; Y342-F346 HydrophobicContact CE1-CE1 3.45Å; Y342-F346 VanDerWaalsContact CE1-CE1 3.45Å; Y342-F346 HydrophobicContact CE1-CZ 4.01Å; Y342-F346 HydrophobicContact CE2-CD1 4.49Å; Y342-F346 HydrophobicContact CE2-CE1 4.07Å; Y342-F346 AromaticContact CG-CD1 3.56Å; Y342-F346 HydrophobicContact CG-CD1 3.56Å; Y342-F346 AromaticContact CG-CE1 3.91Å; Y342-F346 HydrophobicContact CG-CE1 3.91Å; Y342-F346 HydrophobicContact CG-CG 4.48Å; Y342-F346 AromaticContact CZ-CE1 3.72Å; S343-F346 PolarHBondContact O-N 3.12Å; S343-F346 VanDerWaalsContact O-N 3.14Å; S343-F346 WeakPolarHBondContact OG-CB 3.37Å; E344-F346 VanDerWaalsContact C-N 3.31Å; E344-F346 PolarHBondContact O-N 3.44Å; F346-E348 PolarHBondContact O-N 3.24Å; F346-K349 PolarHBondContact O-N 2.81Å; F346-L350 HydrophobicContact CD1-CD2 4.49Å; F346-L350 HydrophobicContact CE1-CD2 4.1Å; F346-L350 VanDerWaalsContact O-CB 3.25Å; F346-L350 WeakPolarHBondContact O-CB 3.2Å; F346-L350 PolarHBondContact O-N 3.45Å; F346-F369 HydrophobicContact CD2-CD1 4.04Å; F346-F369 HydrophobicContact CD2-CE1 4.49Å; F346-F369 HydrophobicContact CD2-CG 4.33Å; F346-F369 HydrophobicContact CE2-CB 3.84Å; F346-F369 AromaticContact CE2-CD1 3.65Å; F346-F369 HydrophobicContact CE2-CD1 3.65Å; F346-F369 AromaticContact CE2-CD2 3.94Å; F346-F369 HydrophobicContact CE2-CD2 3.94Å; F346-F369 HydrophobicContact CE2-CE1 4.17Å; F346-F369 HydrophobicContact CE2-CE2 4.43Å; F346-F369 AromaticContact CE2-CG 3.52Å; F346-F369 HydrophobicContact CE2-CG 3.52Å; F346-F369 HydrophobicContact CZ-CD1 4.18Å; F346-F369 AromaticContact CZ-CD2 3.91Å; F346-F369 HydrophobicContact CZ-CD2 3.91Å; F346-F369 HydrophobicContact CZ-CE1 4.32Å; F346-F369 HydrophobicContact CZ-CE2 4.07Å; F346-F369 AromaticContact CZ-CG 3.98Å; F346-F369 HydrophobicContact CZ-CG 3.98Å; F346-F369 HydrophobicContact CZ-CZ 4.27Å; F346-I375 HydrophobicContact CE1-CD1 3.64Å; F346-I375 HydrophobicContact CZ-CD1 3.64Å
347	S	91.9	Very high	88.4	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.014	25%	0.254	C	S	.	.	H	α-helix	trans	-60.4	-42.2	175.3	-53.3	0	0	0	0	111.9	T328 S343 E344 L350 E351	T328-S347 WeakPolarHBondContact OG1-CB 3.48Å; S343-S347 WeakPolarHBondContact O-CB 3.22Å; S343-S347 PolarHBondContact O-N 3.44Å; S343-S347 PolarHBondContact O-OG 3.25Å; E344-S347 WeakPolarHBondContact O-CB 3.42Å; E344-S347 PolarHBondContact O-N 3.33Å; S347-L350 PolarHBondContact O-N 3.16Å; S347-E351 WeakPolarHBondContact O-CB 3.36Å; S347-E351 PolarHBondContact O-N 2.96Å
348	E	90.3	Very high	89.4	Confident	93 Å²	93	46.8 Å²	46.8	44%	0.435	23%	0.226	S	C	.	.	H	α-helix	trans	-64.5	-44.8	175.2	-72	-162.9	146.5	0	0	112.7	E344 F346 L350 E351 A352	E344-E348 PolarHBondContact O-N 3.06Å; F346-E348 PolarHBondContact O-N 3.24Å; E348-L350 VanDerWaalsContact C-N 3.33Å; E348-L350 PolarHBondContact O-N 2.73Å; E348-E351 PolarHBondContact O-N 3.21Å; E348-A352 WeakPolarHBondContact O-CB 3.35Å; E348-A352 PolarHBondContact O-N 3.39Å
349	K	89.9	Confident	90	Very high	99 Å²	99	45 Å²	45	43%	0.43	23%	0.232	S	C	.	.	H	α-helix	trans	-64	-39.4	178.1	-67.3	159.3	-161.4	165.9	0	111.1	E345 F346 E353 F369	E345-K349 WeakPolarHBondContact O-CD 3.29Å; E345-K349 WeakPolarHBondContact O-CE 3.41Å; E345-K349 WeakPolarHBondContact O-CG 3.39Å; E345-K349 PolarHBondContact O-N 2.96Å; E345-K349 IonicContact OE2-NZ 2.74Å; E345-K349 PolarHBondContact OE2-NZ 2.79Å; F346-K349 PolarHBondContact O-N 2.81Å; K349-E353 PolarHBondContact O-N 2.96Å; K349-F369 HydrophobicContact CB-CE1 3.99Å
350	L	91.3	Very high	90.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-69.8	-43	177.8	-173.2	58.8	0	0	0	112.1	W329 Y342 F346 S347 E348 A352 E353 Y354 L367 F369 I375 M377 V408	W329-L350 HydrophobicContact CB-CD2 4.02Å; W329-L350 HydrophobicContact CD2-CB 4.48Å; W329-L350 HydrophobicContact CD2-CD2 3.48Å; W329-L350 VanDerWaalsContact CD2-CD2 3.48Å; W329-L350 HydrophobicContact CD2-CG 3.79Å; W329-L350 HydrophobicContact CE3-CD2 3.39Å; W329-L350 HydrophobicContact CE3-CG 3.93Å; W329-L350 HydrophobicContact CG-CD2 3.78Å; W329-L350 HydrophobicContact CG-CG 4.25Å; W329-L350 HydrophobicContact CH2-CG 4.32Å; W329-L350 HydrophobicContact CZ2-CG 4.22Å; W329-L350 HydrophobicContact CZ3-CD2 3.99Å; W329-L350 HydrophobicContact CZ3-CG 4.18Å; Y342-L350 HydrophobicContact CE2-CD2 4.44Å; F346-L350 HydrophobicContact CD1-CD2 4.49Å; F346-L350 HydrophobicContact CE1-CD2 4.1Å; F346-L350 VanDerWaalsContact O-CB 3.25Å; F346-L350 WeakPolarHBondContact O-CB 3.2Å; F346-L350 PolarHBondContact O-N 3.45Å; S347-L350 PolarHBondContact O-N 3.16Å; E348-L350 VanDerWaalsContact C-N 3.33Å; E348-L350 PolarHBondContact O-N 2.73Å; L350-A352 VanDerWaalsContact C-N 3.32Å; L350-A352 PolarHBondContact O-N 3.42Å; L350-E353 PolarHBondContact O-N 3.31Å; L350-Y354 WeakPolarHBondContact O-CB 3.36Å; L350-Y354 PolarHBondContact O-N 3.04Å; L350-L367 HydrophobicContact CD1-CD1 4.24Å; L350-F369 HydrophobicContact CB-CZ 4.44Å; L350-F369 HydrophobicContact CD1-CE2 4.49Å; L350-F369 HydrophobicContact CD1-CZ 4Å; L350-I375 HydrophobicContact CD1-CB 4.49Å; L350-I375 HydrophobicContact CD1-CD1 3.82Å; L350-I375 HydrophobicContact CD1-CG2 4.08Å; L350-I375 HydrophobicContact CD2-CD1 3.88Å; L350-M377 HydrophobicContact CD1-CE 3.37Å; L350-M377 HydrophobicContact CG-CE 4.13Å; L350-V408 HydrophobicContact CD2-CG1 4.21Å
351	E	93	Very high	90.5	Very high	20 Å²	20	47.9 Å²	47.9	9%	0.093	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-36.8	175.5	-175.6	59.2	-163.6	0	0	112.3	Y250 V253 W329 S347 E348 Y354 K355 R410	Y250-E351 WeakPolarHBondContact CE2-OE1 3.41Å; Y250-E351 PolarHBondContact OH-OE1 3.37Å; V253-E351 HydrophobicContact CG1-CG 4.25Å; W329-E351 WeakPolarHBondContact CZ2-OE2 3.49Å; W329-E351 PolarHBondContact NE1-OE2 2.88Å; S347-E351 WeakPolarHBondContact O-CB 3.36Å; S347-E351 PolarHBondContact O-N 2.96Å; E348-E351 PolarHBondContact O-N 3.21Å; E351-Y354 PolarHBondContact O-N 2.66Å; E351-K355 VanDerWaalsContact O-CB 3.25Å; E351-K355 WeakPolarHBondContact O-CB 3.15Å; E351-K355 PolarHBondContact O-N 2.66Å; E351-R410 IonicContact OE1-CZ 3.93Å; E351-R410 IonicContact OE1-NE 3.07Å; E351-R410 PolarHBondContact OE1-NE 3.48Å; E351-R410 IonicContact OE1-NH2 2.67Å; E351-R410 PolarHBondContact OE1-NH2 3.04Å; E351-R410 IonicContact OE2-CZ 2.64Å; E351-R410 IonicContact OE2-NE 3.23Å; E351-R410 PolarHBondContact OE2-NE 2.69Å; E351-R410 IonicContact OE2-NH2 2.76Å
352	A	91.8	Very high	90.3	Very high	59 Å²	59	53.2 Å²	53.2	49%	0.488	28%	0.276	S	S	.	.	H	α-helix	trans	-63.6	-44.4	176.5	0	0	0	0	0	112.7	E348 L350 K356	E348-A352 WeakPolarHBondContact O-CB 3.35Å; E348-A352 PolarHBondContact O-N 3.39Å; L350-A352 VanDerWaalsContact C-N 3.32Å; L350-A352 PolarHBondContact O-N 3.42Å; A352-K356 WeakPolarHBondContact O-CB 3.42Å; A352-K356 PolarHBondContact O-N 3.01Å; A352-K356 VanDerWaalsContact O-N 3.12Å
353	E	91.6	Very high	90.2	Very high	45 Å²	45	54.7 Å²	54.7	21%	0.21	28%	0.282	C	S	.	.	H	α-helix	trans	-73.4	-31.4	174.9	-79.7	-64.4	147.9	0	0	112.9	K349 L350 K356 A357 R365 L367	K349-E353 PolarHBondContact O-N 2.96Å; L350-E353 PolarHBondContact O-N 3.31Å; E353-K356 PolarHBondContact O-N 2.98Å; E353-K356 WeakPolarHBondContact OE1-CD 3.33Å; E353-K356 IonicContact OE1-NZ 2.78Å; E353-K356 PolarHBondContact OE1-NZ 3.3Å; E353-K356 WeakPolarHBondContact OE2-CD 3.22Å; E353-K356 WeakPolarHBondContact OE2-CE 3.43Å; E353-K356 IonicContact OE2-NZ 2.71Å; E353-K356 PolarHBondContact OE2-NZ 3.28Å; E353-A357 WeakPolarHBondContact O-CB 3.2Å; E353-A357 PolarHBondContact O-N 2.95Å; E353-R365 IonicContact OE2-CZ 3.38Å; E353-R365 IonicContact OE2-NH1 3.59Å; E353-R365 PolarHBondContact OE2-NH1 3.19Å; E353-R365 IonicContact OE2-NH2 2.79Å; E353-L367 HydrophobicContact CB-CD1 3.69Å; E353-L367 HydrophobicContact CB-CD2 4.07Å; E353-L367 HydrophobicContact CG-CD1 4.29Å; E353-L367 HydrophobicContact CG-CD2 3.9Å
354	Y	91.9	Very high	90	Very high	22 Å²	22	58.1 Å²	58.1	9%	0.086	29%	0.291	C	S	.	.	H	α-helix	trans	-62.2	-49.7	170.9	178.2	-98.4	0	0	0	111.6	Y250 W329 L350 E351 K356 A357 V358 W363 M377 I383 R410	Y250-Y354 HydrophobicContact CD2-CD1 4.49Å; Y250-Y354 HydrophobicContact CE2-CD1 4.4Å; W329-Y354 AromaticContact CH2-CD2 3.67Å; W329-Y354 HydrophobicContact CH2-CD2 3.67Å; W329-Y354 HydrophobicContact CH2-CE2 4.33Å; W329-Y354 AromaticContact CH2-CG 3.87Å; W329-Y354 HydrophobicContact CH2-CG 3.87Å; W329-Y354 HydrophobicContact CZ2-CD1 4.21Å; W329-Y354 AromaticContact CZ2-CD2 3.98Å; W329-Y354 HydrophobicContact CZ2-CD2 3.98Å; W329-Y354 AromaticContact CZ2-CG 3.66Å; W329-Y354 HydrophobicContact CZ2-CG 3.66Å; L350-Y354 WeakPolarHBondContact O-CB 3.36Å; L350-Y354 PolarHBondContact O-N 3.04Å; E351-Y354 PolarHBondContact O-N 2.66Å; Y354-K356 VanDerWaalsContact C-N 3.26Å; Y354-K356 PolarHBondContact O-N 2.99Å; Y354-A357 WeakPolarHBondContact O-CA 3.31Å; Y354-A357 WeakPolarHBondContact O-CB 3.33Å; Y354-A357 PolarHBondContact O-N 3.29Å; Y354-V358 HydrophobicContact CD1-CG2 4.22Å; Y354-V358 HydrophobicContact CE1-CG2 3.74Å; Y354-V358 HydrophobicContact CE2-CG2 4.13Å; Y354-V358 WeakPolarHBondContact O-CG2 3.42Å; Y354-V358 PolarHBondContact O-N 2.99Å; Y354-W363 HydrophobicContact CD2-CZ3 4.47Å; Y354-W363 HydrophobicContact CE2-CH2 4.1Å; Y354-W363 HydrophobicContact CE2-CZ3 4.32Å; Y354-M377 HydrophobicContact CD2-CE 4.39Å; Y354-M377 HydrophobicContact CD2-SD 4.18Å; Y354-I383 HydrophobicContact CD2-CD1 4.03Å; Y354-I383 HydrophobicContact CE2-CD1 4.12Å; Y354-R410 VanDerWaalsContact CE1-CZ 3.45Å; Y354-R410 VanDerWaalsContact CE1-NE 3.3Å
355	K	92	Very high	89.6	Confident	102 Å²	102	59.4 Å²	59.4	44%	0.443	29%	0.294	S	S	.	.	H	α-helix	trans	-54.9	-42.1	175.2	-177	171.2	-169.1	173.5	0	112.1	Y250 E351 S359	Y250-K355 HydrophobicContact CD1-CD 4.23Å; Y250-K355 HydrophobicContact CD1-CG 4.1Å; Y250-K355 HydrophobicContact CD2-CB 3.74Å; Y250-K355 HydrophobicContact CD2-CD 4.36Å; Y250-K355 HydrophobicContact CD2-CG 3.63Å; Y250-K355 HydrophobicContact CE1-CD 3.82Å; Y250-K355 HydrophobicContact CE1-CG 4.1Å; Y250-K355 HydrophobicContact CE2-CB 3.46Å; Y250-K355 VanDerWaalsContact CE2-CB 3.46Å; Y250-K355 HydrophobicContact CE2-CD 3.9Å; Y250-K355 HydrophobicContact CE2-CG 3.56Å; Y250-K355 HydrophobicContact CG-CB 4.48Å; Y250-K355 HydrophobicContact CG-CD 4.48Å; Y250-K355 HydrophobicContact CG-CG 3.87Å; E351-K355 VanDerWaalsContact O-CB 3.25Å; E351-K355 WeakPolarHBondContact O-CB 3.15Å; E351-K355 PolarHBondContact O-N 2.66Å; K355-S359 VanDerWaalsContact O-CB 3.31Å; K355-S359 WeakPolarHBondContact O-CB 3.47Å; K355-S359 PolarHBondContact O-N 2.89Å; K355-S359 PolarHBondContact O-OG 3.33Å
356	K	90.9	Very high	89.4	Confident	97 Å²	97	62.4 Å²	62.4	42%	0.422	30%	0.301	S	S	.	.	H	α-helix	trans	-67.2	-40.4	174	177.8	174	158.2	-162.3	0	112.3	A352 E353 Y354 S359 T360	A352-K356 WeakPolarHBondContact O-CB 3.42Å; A352-K356 PolarHBondContact O-N 3.01Å; A352-K356 VanDerWaalsContact O-N 3.12Å; E353-K356 PolarHBondContact O-N 2.98Å; E353-K356 WeakPolarHBondContact OE1-CD 3.33Å; E353-K356 IonicContact OE1-NZ 2.78Å; E353-K356 PolarHBondContact OE1-NZ 3.3Å; E353-K356 WeakPolarHBondContact OE2-CD 3.22Å; E353-K356 WeakPolarHBondContact OE2-CE 3.43Å; E353-K356 IonicContact OE2-NZ 2.71Å; E353-K356 PolarHBondContact OE2-NZ 3.28Å; Y354-K356 VanDerWaalsContact C-N 3.26Å; Y354-K356 PolarHBondContact O-N 2.99Å; K356-S359 PolarHBondContact O-OG 2.87Å; K356-T360 WeakPolarHBondContact O-CB 3.4Å; K356-T360 WeakPolarHBondContact O-CG2 3.41Å; K356-T360 PolarHBondContact O-N 3.26Å; K356-T360 VanDerWaalsContact O-N 3.09Å; K356-T360 PolarHBondContact O-OG1 3.3Å
357	A	91	Very high	89.2	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.008	30%	0.303	C	S	.	.	H	α-helix	trans	-63.9	-46.4	176.3	0	0	0	0	0	112.2	E353 Y354 N361 Q362 W363 M377	E353-A357 WeakPolarHBondContact O-CB 3.2Å; E353-A357 PolarHBondContact O-N 2.95Å; Y354-A357 WeakPolarHBondContact O-CA 3.31Å; Y354-A357 WeakPolarHBondContact O-CB 3.33Å; Y354-A357 PolarHBondContact O-N 3.29Å; A357-N361 CarbonylContact O-C 3.45Å; A357-N361 WeakPolarHBondContact O-CA 3.23Å; A357-N361 PolarHBondContact O-N 3.14Å; A357-Q362 PolarHBondContact O-N 3.44Å; A357-W363 HydrophobicContact CB-CD2 4.48Å; A357-W363 HydrophobicContact CB-CE3 4.07Å; A357-W363 HydrophobicContact CB-CH2 4.27Å; A357-W363 HydrophobicContact CB-CZ3 3.97Å; A357-M377 HydrophobicContact CB-SD 4.37Å
358	V	90.2	Very high	88.8	Confident	4 Å²	4	69 Å²	69	2%	0.024	33%	0.333	C	S	.	.	H	α-helix	trans	-62.6	-55.4	175.6	176.3	0	0	0	0	111	Y354 T360 N361 W363	Y354-V358 HydrophobicContact CD1-CG2 4.22Å; Y354-V358 HydrophobicContact CE1-CG2 3.74Å; Y354-V358 HydrophobicContact CE2-CG2 4.13Å; Y354-V358 WeakPolarHBondContact O-CG2 3.42Å; Y354-V358 PolarHBondContact O-N 2.99Å; V358-T360 VanDerWaalsContact C-N 3.28Å; V358-T360 PolarHBondContact O-N 3.49Å; V358-N361 PolarHBondContact O-N 2.91Å; V358-N361 VanDerWaalsContact O-N 3.08Å; V358-W363 HydrophobicContact CG2-CH2 3.62Å; V358-W363 HydrophobicContact CG2-CZ2 3.89Å
359	S	89.4	Confident	88.3	Confident	81 Å²	81	65.7 Å²	65.7	57%	0.566	32%	0.317	S	S	*	.	H	α-helix	trans	-66.7	-23.3	-174.2	56.1	0	0	0	0	115	K355 K356	K355-S359 VanDerWaalsContact O-CB 3.31Å; K355-S359 WeakPolarHBondContact O-CB 3.47Å; K355-S359 PolarHBondContact O-N 2.89Å; K355-S359 PolarHBondContact O-OG 3.33Å; K356-S359 PolarHBondContact O-OG 2.87Å
360	T	88.9	Confident	87.5	Confident	66 Å²	66	67.6 Å²	67.6	41%	0.405	34%	0.339	S	S	.	.	H	α-helix	trans	-100.5	-7.4	173.3	62.7	0	0	0	0	113.5	K356 V358 Q362	K356-T360 WeakPolarHBondContact O-CB 3.4Å; K356-T360 WeakPolarHBondContact O-CG2 3.41Å; K356-T360 PolarHBondContact O-N 3.26Å; K356-T360 VanDerWaalsContact O-N 3.09Å; K356-T360 PolarHBondContact O-OG1 3.3Å; V358-T360 VanDerWaalsContact C-N 3.28Å; V358-T360 PolarHBondContact O-N 3.49Å; T360-Q362 PolarHBondContact O-N 3.48Å; T360-Q362 WeakPolarHBondContact OG1-CB 3.44Å; T360-Q362 PolarHBondContact OG1-N 3.11Å
361	N	87.6	Confident	86.5	Confident	89 Å²	89	70.7 Å²	70.7	48%	0.476	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	31	-166.8	-159.9	20.9	0	0	0	114	A357 V358 W363	A357-N361 CarbonylContact O-C 3.45Å; A357-N361 WeakPolarHBondContact O-CA 3.23Å; A357-N361 PolarHBondContact O-N 3.14Å; V358-N361 PolarHBondContact O-N 2.91Å; V358-N361 VanDerWaalsContact O-N 3.08Å; N361-W363 PolarHBondContact OD1-NE1 3.3Å
362	Q	86.9	Confident	85.6	Confident	114 Å²	114	71.7 Å²	71.7	53%	0.533	38%	0.376	S	S	.	.			trans	-103.2	87.7	-178.2	-65.3	-175.9	14.2	0	0	112.4	A357 T360 R365	A357-Q362 PolarHBondContact O-N 3.44Å; T360-Q362 PolarHBondContact O-N 3.48Å; T360-Q362 WeakPolarHBondContact OG1-CB 3.44Å; T360-Q362 PolarHBondContact OG1-N 3.11Å; Q362-R365 PolarHBondContact O-NE 2.91Å; Q362-R365 PolarHBondContact O-NH2 3.45Å
363	W	89.2	Confident	85.1	Confident	42 Å²	42	70.4 Å²	70.4	16%	0.159	36%	0.36	C	S	.	.			trans	-87.9	-175.1	176.9	-55.5	98.7	0	0	0	112.8	Y354 A357 V358 N361 R365 M377 H378 P380	Y354-W363 HydrophobicContact CD2-CZ3 4.47Å; Y354-W363 HydrophobicContact CE2-CH2 4.1Å; Y354-W363 HydrophobicContact CE2-CZ3 4.32Å; A357-W363 HydrophobicContact CB-CD2 4.48Å; A357-W363 HydrophobicContact CB-CE3 4.07Å; A357-W363 HydrophobicContact CB-CH2 4.27Å; A357-W363 HydrophobicContact CB-CZ3 3.97Å; V358-W363 HydrophobicContact CG2-CH2 3.62Å; V358-W363 HydrophobicContact CG2-CZ2 3.89Å; N361-W363 PolarHBondContact OD1-NE1 3.3Å; W363-R365 PolarHBondContact O-N 3.21Å; W363-M377 HydrophobicContact CE3-CB 4.04Å; W363-M377 HydrophobicContact CZ3-CB 4.24Å; W363-H378 WeakPolarHBondContact CB-O 3.46Å; W363-P380 HydrophobicContact CH2-CB 4.42Å; W363-P380 HydrophobicContact CH2-CG 3.61Å; W363-P380 HydrophobicContact CZ2-CG 3.7Å; W363-P380 HydrophobicContact CZ3-CG 4.49Å
364	H	85.8	Confident	84.9	Confident	129 Å²	129	68.6 Å²	68.6	60%	0.597	35%	0.353	S	S	*	.	S	Bend	trans	61.3	20.3	175.8	-62	73.9	0	0	0	114.9	M377 H378	H364-M377 PolarHBondContact N-O 3.35Å; H364-H378 AromaticContact CD2-CE1 3.85Å; H364-H378 AromaticContact CD2-ND1 3.15Å; H364-H378 PolarHBondContact CD2-ND1 3.47Å; H364-H378 PolarHBondContact CE1-O 3.34Å; H364-H378 PolarHBondContact ND1-O 3.06Å; H364-H378 AromaticContact NE2-CG 3.86Å; H364-H378 AromaticContact NE2-ND1 3.05Å; H364-H378 PolarHBondContact NE2-ND1 3.04Å
365	R	81.1	Confident	84.8	Confident	70 Å²	70	67.6 Å²	67.6	26%	0.264	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-86.2	139.4	172.8	-70.7	-178.1	-72	121.9	1.6	110.6	E353 Q362 W363	E353-R365 IonicContact OE2-CZ 3.38Å; E353-R365 IonicContact OE2-NH1 3.59Å; E353-R365 PolarHBondContact OE2-NH1 3.19Å; E353-R365 IonicContact OE2-NH2 2.79Å; Q362-R365 PolarHBondContact O-NE 2.91Å; Q362-R365 PolarHBondContact O-NH2 3.45Å; W363-R365 PolarHBondContact O-N 3.21Å
366	R	83.1	Confident	84.8	Confident	161 Å²	161	63.8 Å²	63.8	61%	0.608	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	117	171.5	-170.7	178.3	169.3	121.2	7.4	108.1	E368 T374	R366-E368 HydrophobicContact CG-CG 4.14Å; R366-E368 IonicContact CZ-OE1 2.9Å; R366-E368 IonicContact NE-OE1 2.99Å; R366-E368 PolarHBondContact NE-OE1 3.23Å; R366-E368 IonicContact NH2-OE1 3.99Å; R366-E368 PolarHBondContact NH2-OE1 3.02Å; R366-T374 HydrophobicContact CG-CG2 3.46Å; R366-T374 VanDerWaalsContact CG-CG2 3.46Å; R366-T374 PolarHBondContact NH2-OG1 2.74Å
367	L	85.4	Confident	84.8	Confident	20 Å²	20	59.4 Å²	59.4	11%	0.105	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	116.4	176.2	-56.2	-178.7	0	0	0	107.9	L350 E353 F369 T374 I375 M377	L350-L367 HydrophobicContact CD1-CD1 4.24Å; E353-L367 HydrophobicContact CB-CD1 3.69Å; E353-L367 HydrophobicContact CB-CD2 4.07Å; E353-L367 HydrophobicContact CG-CD1 4.29Å; E353-L367 HydrophobicContact CG-CD2 3.9Å; L367-F369 HydrophobicContact CB-CE2 3.77Å; L367-F369 HydrophobicContact CB-CZ 4.28Å; L367-T374 CarbonylContact O-C 3.55Å; L367-T374 WeakPolarHBondContact O-CA 3.42Å; L367-I375 WeakPolarHBondContact CB-O 3.48Å; L367-I375 PolarHBondContact N-O 3.27Å; L367-I375 PolarHBondContact O-N 2.98Å; L367-M377 HydrophobicContact CD1-CE 3.72Å; L367-M377 HydrophobicContact CD1-CG 4.5Å; L367-M377 HydrophobicContact CD1-SD 4.11Å
368	E	83.7	Confident	84.7	Confident	135 Å²	135	62.6 Å²	62.6	63%	0.631	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	124.5	-179.3	-60	-173.2	149.6	0	0	109.1	R366	R366-E368 HydrophobicContact CG-CG 4.14Å; R366-E368 IonicContact CZ-OE1 2.9Å; R366-E368 IonicContact NE-OE1 2.99Å; R366-E368 PolarHBondContact NE-OE1 3.23Å; R366-E368 IonicContact NH2-OE1 3.99Å; R366-E368 PolarHBondContact NH2-OE1 3.02Å
369	F	78.8	Confident	84.5	Confident	24 Å²	24	65.4 Å²	65.4	11%	0.105	34%	0.344	C	S	.	.			trans	-103.7	155.8	-176	-67.9	-93.7	0	0	0	111	F346 K349 L350 L367 S371 G372 E373 I375	F346-F369 HydrophobicContact CD2-CD1 4.04Å; F346-F369 HydrophobicContact CD2-CE1 4.49Å; F346-F369 HydrophobicContact CD2-CG 4.33Å; F346-F369 HydrophobicContact CE2-CB 3.84Å; F346-F369 AromaticContact CE2-CD1 3.65Å; F346-F369 HydrophobicContact CE2-CD1 3.65Å; F346-F369 AromaticContact CE2-CD2 3.94Å; F346-F369 HydrophobicContact CE2-CD2 3.94Å; F346-F369 HydrophobicContact CE2-CE1 4.17Å; F346-F369 HydrophobicContact CE2-CE2 4.43Å; F346-F369 AromaticContact CE2-CG 3.52Å; F346-F369 HydrophobicContact CE2-CG 3.52Å; F346-F369 HydrophobicContact CZ-CD1 4.18Å; F346-F369 AromaticContact CZ-CD2 3.91Å; F346-F369 HydrophobicContact CZ-CD2 3.91Å; F346-F369 HydrophobicContact CZ-CE1 4.32Å; F346-F369 HydrophobicContact CZ-CE2 4.07Å; F346-F369 AromaticContact CZ-CG 3.98Å; F346-F369 HydrophobicContact CZ-CG 3.98Å; F346-F369 HydrophobicContact CZ-CZ 4.27Å; K349-F369 HydrophobicContact CB-CE1 3.99Å; L350-F369 HydrophobicContact CB-CZ 4.44Å; L350-F369 HydrophobicContact CD1-CE2 4.49Å; L350-F369 HydrophobicContact CD1-CZ 4Å; L367-F369 HydrophobicContact CB-CE2 3.77Å; L367-F369 HydrophobicContact CB-CZ 4.28Å; F369-S371 PolarHBondContact O-N 3.4Å; F369-G372 PolarHBondContact O-N 2.89Å; F369-E373 PolarHBondContact N-O 3.34Å; F369-I375 HydrophobicContact CE2-CB 4.15Å; F369-I375 HydrophobicContact CE2-CD1 4.06Å; F369-I375 HydrophobicContact CE2-CG1 4.2Å
370	P	74.3	Confident	84.3	Confident	138 Å²	138	64.1 Å²	64.1	90%	0.896	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-14.9	177.8	-26.3	35.9	0	0	0	115.3	G372	P370-G372 PolarHBondContact O-N 2.56Å
371	S	69.8	Low	84	Confident	65 Å²	65	70.4 Å²	70.4	46%	0.455	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-3.6	170.7	50.8	0	0	0	0	114.2	F369 E373	F369-S371 PolarHBondContact O-N 3.4Å; S371-E373 VanDerWaalsContact CB-OE2 3.28Å; S371-E373 WeakPolarHBondContact CB-OE2 3.36Å; S371-E373 PolarHBondContact O-N 2.86Å; S371-E373 PolarHBondContact OG-OE2 2.99Å
372	G	74.6	Confident	84	Confident	41 Å²	41	69.4 Å²	69.4	42%	0.423	35%	0.353	S	S	.	.	S	Bend	trans	78.4	-4.1	-171.5	0	0	0	0	0	113.8	F369 P370	F369-G372 PolarHBondContact O-N 2.89Å; P370-G372 PolarHBondContact O-N 2.56Å
373	E	81.3	Confident	84.2	Confident	32 Å²	32	64.2 Å²	64.2	15%	0.15	33%	0.329	C	S	.	.			trans	-73.8	140.7	177.6	-63.2	169.2	117.7	0	0	111.2	F369 S371 Q385	F369-E373 PolarHBondContact N-O 3.34Å; S371-E373 VanDerWaalsContact CB-OE2 3.28Å; S371-E373 WeakPolarHBondContact CB-OE2 3.36Å; S371-E373 PolarHBondContact O-N 2.86Å; S371-E373 PolarHBondContact OG-OE2 2.99Å; E373-Q385 PolarHBondContact OE1-NE2 3.29Å
374	T	87.4	Confident	84.3	Confident	8 Å²	8	63.2 Å²	63.2	5%	0.049	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	127.7	176.6	-69.1	0	0	0	0	109.7	R366 L367 V376 Q385 F386	R366-T374 HydrophobicContact CG-CG2 3.46Å; R366-T374 VanDerWaalsContact CG-CG2 3.46Å; R366-T374 PolarHBondContact NH2-OG1 2.74Å; L367-T374 CarbonylContact O-C 3.55Å; L367-T374 WeakPolarHBondContact O-CA 3.42Å; T374-V376 HydrophobicContact CG2-CG2 4.3Å; T374-Q385 CarbonylContact O-C 3.55Å; T374-Q385 WeakPolarHBondContact O-CA 3.46Å; T374-F386 HydrophobicContact CG2-CD2 4.27Å; T374-F386 PolarHBondContact N-O 3.01Å; T374-F386 PolarHBondContact O-N 3.2Å
375	I	90.6	Very high	84.4	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	139.1	170.1	-65.4	178.2	0	0	0	110.2	F346 L350 L367 F369 I383 V384 Q385 V408	F346-I375 HydrophobicContact CE1-CD1 3.64Å; F346-I375 HydrophobicContact CZ-CD1 3.64Å; L350-I375 HydrophobicContact CD1-CB 4.49Å; L350-I375 HydrophobicContact CD1-CD1 3.82Å; L350-I375 HydrophobicContact CD1-CG2 4.08Å; L350-I375 HydrophobicContact CD2-CD1 3.88Å; L367-I375 WeakPolarHBondContact CB-O 3.48Å; L367-I375 PolarHBondContact N-O 3.27Å; L367-I375 PolarHBondContact O-N 2.98Å; F369-I375 HydrophobicContact CE2-CB 4.15Å; F369-I375 HydrophobicContact CE2-CD1 4.06Å; F369-I375 HydrophobicContact CE2-CG1 4.2Å; I375-I383 HydrophobicContact CG2-CG2 3.55Å; I375-V384 CarbonylContact C-O 3.45Å; I375-V384 VanDerWaalsContact CA-O 3.3Å; I375-V384 WeakPolarHBondContact CA-O 3.22Å; I375-Q385 HydrophobicContact CG1-CB 4.05Å; I375-Q385 HydrophobicContact CG1-CG 4.1Å; I375-V408 HydrophobicContact CD1-CG2 4.45Å
376	V	90.3	Very high	84.6	Confident	22 Å²	22	57.2 Å²	57.2	13%	0.133	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	120.3	174.5	-175.7	0	0	0	0	109.3	T374 I383 V384 F386	T374-V376 HydrophobicContact CG2-CG2 4.3Å; V376-I383 WeakPolarHBondContact O-CA 3.48Å; V376-V384 HydrophobicContact CB-CG2 4.1Å; V376-V384 PolarHBondContact N-O 3.18Å; V376-V384 PolarHBondContact O-N 3.31Å; V376-F386 HydrophobicContact CB-CE2 4.44Å; V376-F386 HydrophobicContact CG2-CD2 4.3Å; V376-F386 HydrophobicContact CG2-CE2 3.88Å
377	M	91.1	Very high	84.3	Confident	6 Å²	6	53.1 Å²	53.1	3%	0.03	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	105.8	175.8	-64.3	176.7	178.4	0	0	110	W329 L350 Y354 A357 W363 H364 L367 I383	W329-M377 HydrophobicContact CH2-CE 4.15Å; L350-M377 HydrophobicContact CD1-CE 3.37Å; L350-M377 HydrophobicContact CG-CE 4.13Å; Y354-M377 HydrophobicContact CD2-CE 4.39Å; Y354-M377 HydrophobicContact CD2-SD 4.18Å; A357-M377 HydrophobicContact CB-SD 4.37Å; W363-M377 HydrophobicContact CE3-CB 4.04Å; W363-M377 HydrophobicContact CZ3-CB 4.24Å; H364-M377 PolarHBondContact N-O 3.35Å; L367-M377 HydrophobicContact CD1-CE 3.72Å; L367-M377 HydrophobicContact CD1-CG 4.5Å; L367-M377 HydrophobicContact CD1-SD 4.11Å; M377-I383 HydrophobicContact CB-CG1 4.3Å; M377-I383 HydrophobicContact CG-CD1 4.06Å; M377-I383 HydrophobicContact CG-CG1 4.04Å; M377-I383 HydrophobicContact CG-CG2 3.76Å
378	H	88.6	Confident	83.4	Confident	68 Å²	68	55.6 Å²	55.6	32%	0.315	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-38.4	177.7	-71.9	-86.7	0	0	0	112.6	W363 H364 V382	W363-H378 WeakPolarHBondContact CB-O 3.46Å; H364-H378 AromaticContact CD2-CE1 3.85Å; H364-H378 AromaticContact CD2-ND1 3.15Å; H364-H378 PolarHBondContact CD2-ND1 3.47Å; H364-H378 PolarHBondContact CE1-O 3.34Å; H364-H378 PolarHBondContact ND1-O 3.06Å; H364-H378 AromaticContact NE2-CG 3.86Å; H364-H378 AromaticContact NE2-ND1 3.05Å; H364-H378 PolarHBondContact NE2-ND1 3.04Å; H378-V382 HydrophobicContact CB-CB 4.17Å; H378-V382 HydrophobicContact CB-CG1 4.07Å; H378-V382 WeakPolarHBondContact CB-O 3.17Å; H378-V382 PolarHBondContact N-O 3.47Å
379	N	87.3	Confident	82.2	Confident	62 Å²	62	52.8 Å²	52.8	33%	0.332	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	176.4	175.6	66.3	66	0	0	0	108.7	K381 V382	N379-K381 PolarHBondContact O-N 3.48Å; N379-K381 WeakPolarHBondContact OD1-CA 3.34Å; N379-K381 PolarHBondContact OD1-N 2.88Å; N379-V382 PolarHBondContact N-O 2.96Å; N379-V382 WeakPolarHBondContact ND2-CG2 3.17Å; N379-V382 PolarHBondContact O-N 2.88Å; N379-V382 VanDerWaalsContact O-N 3.15Å; N379-V382 PolarHBondContact OD1-N 2.88Å; N379-V382 VanDerWaalsContact OD1-N 3.16Å
380	P	84.8	Confident	80.8	Confident	55 Å²	55	56.9 Å²	56.9	36%	0.357	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-23.8	-178.4	-29.8	37.1	0	0	0	116.7	W363	W363-P380 HydrophobicContact CH2-CB 4.42Å; W363-P380 HydrophobicContact CH2-CG 3.61Å; W363-P380 HydrophobicContact CZ2-CG 3.7Å; W363-P380 HydrophobicContact CZ3-CG 4.49Å
381	K	83.6	Confident	79.5	Confident	197 Å²	197	57.2 Å²	57.2	86%	0.857	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-5.5	-177.9	-60.5	-164.9	174.2	-159.3	0	114.3	N379	N379-K381 PolarHBondContact O-N 3.48Å; N379-K381 WeakPolarHBondContact OD1-CA 3.34Å; N379-K381 PolarHBondContact OD1-N 2.88Å
382	V	87.3	Confident	78.6	Confident	68 Å²	68	58 Å²	58	41%	0.412	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	93.7	-175.6	-175.9	0	0	0	0	108.9	H378 N379	H378-V382 HydrophobicContact CB-CB 4.17Å; H378-V382 HydrophobicContact CB-CG1 4.07Å; H378-V382 WeakPolarHBondContact CB-O 3.17Å; H378-V382 PolarHBondContact N-O 3.47Å; N379-V382 PolarHBondContact N-O 2.96Å; N379-V382 WeakPolarHBondContact ND2-CG2 3.17Å; N379-V382 PolarHBondContact O-N 2.88Å; N379-V382 VanDerWaalsContact O-N 3.15Å; N379-V382 PolarHBondContact OD1-N 2.88Å; N379-V382 VanDerWaalsContact OD1-N 3.16Å
383	I	90.8	Very high	77.5	Confident	5 Å²	5	58.9 Å²	58.9	3%	0.026	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	132.9	178.5	-52.8	177	0	0	0	107	W329 Y354 I375 V376 M377 V408	W329-I383 HydrophobicContact CH2-CD1 3.56Å; W329-I383 HydrophobicContact CZ3-CD1 3.6Å; W329-I383 HydrophobicContact CZ3-CG2 4.49Å; Y354-I383 HydrophobicContact CD2-CD1 4.03Å; Y354-I383 HydrophobicContact CE2-CD1 4.12Å; I375-I383 HydrophobicContact CG2-CG2 3.55Å; V376-I383 WeakPolarHBondContact O-CA 3.48Å; M377-I383 HydrophobicContact CB-CG1 4.3Å; M377-I383 HydrophobicContact CG-CD1 4.06Å; M377-I383 HydrophobicContact CG-CG1 4.04Å; M377-I383 HydrophobicContact CG-CG2 3.76Å; I383-V408 HydrophobicContact CB-CB 4.15Å; I383-V408 HydrophobicContact CB-CG1 4.4Å; I383-V408 HydrophobicContact CG2-CB 3.87Å; I383-V408 HydrophobicContact CG2-CG1 3.91Å; I383-V408 PolarHBondContact O-N 2.79Å
384	V	90.1	Very high	76	Confident	22 Å²	22	67.3 Å²	67.3	13%	0.133	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	142.9	-174.5	-69.9	0	0	0	0	112.1	I375 V376 F386 P405 R406	I375-V384 CarbonylContact C-O 3.45Å; I375-V384 VanDerWaalsContact CA-O 3.3Å; I375-V384 WeakPolarHBondContact CA-O 3.22Å; V376-V384 HydrophobicContact CB-CG2 4.1Å; V376-V384 PolarHBondContact N-O 3.18Å; V376-V384 PolarHBondContact O-N 3.31Å; V384-F386 HydrophobicContact CG2-CE2 3.82Å; V384-F386 HydrophobicContact CG2-CZ 4.26Å; V384-P405 HydrophobicContact CB-CB 3.92Å; V384-P405 HydrophobicContact CG1-CB 4.2Å; V384-P405 HydrophobicContact CG2-CB 4.42Å; V384-R406 CarbonylContact C-O 3.55Å; V384-R406 VanDerWaalsContact CA-O 3.28Å; V384-R406 WeakPolarHBondContact CA-O 3.25Å
385	Q	88.9	Confident	74.5	Confident	1 Å²	1	77.8 Å²	77.8	1%	0.005	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	134.2	172.5	-176.8	-171.5	56.7	0	0	110.5	Y342 E373 T374 I375 P405 R406 V408	Y342-Q385 PolarHBondContact OH-NE2 3.45Å; Y342-Q385 PolarHBondContact OH-OE1 3.18Å; E373-Q385 PolarHBondContact OE1-NE2 3.29Å; T374-Q385 CarbonylContact O-C 3.55Å; T374-Q385 WeakPolarHBondContact O-CA 3.46Å; I375-Q385 HydrophobicContact CG1-CB 4.05Å; I375-Q385 HydrophobicContact CG1-CG 4.1Å; Q385-P405 CarbonylContact O-C 3.54Å; Q385-P405 VanDerWaalsContact O-CA 3.32Å; Q385-P405 WeakPolarHBondContact O-CA 3.11Å; Q385-R406 HydrophobicContact CB-CB 4.4Å; Q385-R406 PolarHBondContact N-O 2.93Å; Q385-R406 PolarHBondContact O-N 3.01Å; Q385-V408 HydrophobicContact CB-CG2 3.69Å
386	F	85.7	Confident	72.9	Confident	71 Å²	71	80.8 Å²	80.8	31%	0.311	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	123.9	163.7	-56.3	-94.4	0	0	0	108	T374 V376 V384 P405	T374-F386 HydrophobicContact CG2-CD2 4.27Å; T374-F386 PolarHBondContact N-O 3.01Å; T374-F386 PolarHBondContact O-N 3.2Å; V376-F386 HydrophobicContact CB-CE2 4.44Å; V376-F386 HydrophobicContact CG2-CD2 4.3Å; V376-F386 HydrophobicContact CG2-CE2 3.88Å; V384-F386 HydrophobicContact CG2-CE2 3.82Å; V384-F386 HydrophobicContact CG2-CZ 4.26Å; F386-P405 HydrophobicContact CD1-CB 4.13Å; F386-P405 HydrophobicContact CE1-CB 3.71Å; F386-P405 HydrophobicContact CE1-CG 3.95Å; F386-P405 HydrophobicContact CE2-CB 4.48Å; F386-P405 HydrophobicContact CZ-CB 3.91Å; F386-P405 HydrophobicContact CZ-CG 4.3Å
387	Q	76.2	Confident	71	Confident	75 Å²	75	83.6 Å²	83.6	35%	0.35	45%	0.453	S	S	.	.			trans	-80	148.1	172.2	-66.1	-156.7	-63	0	0	110.6	S389 R406	Q387-S389 PolarHBondContact O-N 3.32Å; Q387-R406 VanDerWaalsContact CD-CZ 3.48Å; Q387-R406 VanDerWaalsContact CD-NH1 3.25Å; Q387-R406 VanDerWaalsContact NE2-NH1 3.13Å; Q387-R406 VanDerWaalsContact OE1-CZ 3.25Å
388	P	67.4	Low	68.8	Low	72 Å²	72	87.4 Å²	87.4	47%	0.468	48%	0.476	S	S	.	.			trans	-63.6	134.3	172.7	27.8	-33.7	0	0	0	110	S390	P388-S390 PolarHBondContact O-N 2.62Å
389	S	57.4	Low	66.7	Low	76 Å²	76	91.2 Å²	91.2	53%	0.531	49%	0.494	S	S	.	.			trans	-67.8	116	175.2	49.6	0	0	0	0	110.3	Q387 N391	Q387-S389 PolarHBondContact O-N 3.32Å; S389-N391 PolarHBondContact O-N 2.72Å
390	S	50.1	Low	64.5	Low	111 Å²	111	96.2 Å²	96.2	78%	0.776	52%	0.521	S	S	*	.	S	Bend	trans	-68.7	109.5	178.4	52.3	0	0	0	0	111.1	P388	P388-S390 PolarHBondContact O-N 2.62Å
391	N	46.3	Very low	62.6	Low	144 Å²	144	96.5 Å²	96.5	77%	0.77	53%	0.534	S	S	*	.			trans	56.9	108	176.5	-59.6	-14.5	0	0	0	115.3	S389	S389-N391 PolarHBondContact O-N 2.72Å
392	P	51.3	Low	60.9	Low	82 Å²	82	96.1 Å²	96.1	53%	0.532	54%	0.535	S	S	.	.			trans	-67.3	140.3	160.1	31.1	-32.8	0	0	0	109.7	T398	P392-T398 HydrophobicContact CB-CG2 4.39Å
393	D	50.3	Low	59.5	Low	59 Å²	59	96.1 Å²	96.1	32%	0.316	54%	0.536	S	S	.	.			trans	-49.7	157.4	169.1	-55.3	42.7	0	0	0	111.6	W395 G396 T397 Q399	D393-W395 PolarHBondContact O-N 2.97Å; D393-G396 PolarHBondContact O-N 2.78Å; D393-T397 VanDerWaalsContact CG-O 3.26Å; D393-Q399 PolarHBondContact OD1-N 2.65Å; D393-Q399 PolarHBondContact OD2-NE2 2.8Å
394	E	50.7	Low	58.4	Low	209 Å²	209	106.5 Å²	106.5	98%	0.977	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	-18.3	-178	-166.3	177.6	173.3	0	0	114
395	W	56.6	Low	58	Low	229 Å²	229	108.1 Å²	108.1	87%	0.867	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	6.1	176.5	-151.5	-108.4	0	0	0	115.1	D393 T397	D393-W395 PolarHBondContact O-N 2.97Å; W395-T397 PolarHBondContact O-N 3.28Å
396	G	55.6	Low	57.9	Low	62 Å²	62	109.6 Å²	109.6	64%	0.639	59%	0.591	S	S	*	*	S	Bend	trans	73.1	6.5	178.3	0	0	0	0	0	115.4	D393	D393-G396 PolarHBondContact O-N 2.78Å
397	T	50.4	Low	58	Low	82 Å²	82	110 Å²	110	50%	0.503	60%	0.599	S	S	.	*			trans	-103.6	110.1	175.9	50.5	0	0	0	0	110	D393 W395 Q399	D393-T397 VanDerWaalsContact CG-O 3.26Å; W395-T397 PolarHBondContact O-N 3.28Å; T397-Q399 PolarHBondContact O-N 2.83Å
398	T	46.3	Very low	58.7	Low	85 Å²	85	106.7 Å²	106.7	52%	0.521	58%	0.584	S	S	.	*			trans	-63.2	114.2	171.6	51.8	0	0	0	0	110.2	P392	P392-T398 HydrophobicContact CB-CG2 4.39Å
399	Q	43.9	Very low	59.8	Low	149 Å²	149	104.2 Å²	104.2	70%	0.696	57%	0.566	S	S	*	*			trans	-71.5	152.1	164.4	-70.2	-173.6	88.6	0	0	110.6	D393 T397	D393-Q399 PolarHBondContact OD1-N 2.65Å; D393-Q399 PolarHBondContact OD2-NE2 2.8Å; T397-Q399 PolarHBondContact O-N 2.83Å
400	D	40.6	Very low	61.4	Low	166 Å²	166	103.2 Å²	103.2	89%	0.888	55%	0.551	S	S	*	*	S	Bend	trans	52.6	78.2	177.8	-66	-18.9	0	0	0	118.9
401	G	45.7	Very low	63.2	Low	62 Å²	62	98.3 Å²	98.3	64%	0.639	52%	0.518	S	S	*	.			trans	92.5	137.9	137.9	0	0	0	0	0	117.3	T403	G401-T403 PolarHBondContact O-N 2.86Å; G401-T403 VanDerWaalsContact O-N 3.13Å
402	Q	47.7	Very low	65	Low	188 Å²	188	93.3 Å²	93.3	88%	0.879	49%	0.492	S	S	*	.			trans	-55.2	116.8	164.3	-71.7	-86.5	-74	0	0	109.1	R404	Q402-R404 PolarHBondContact O-N 3.06Å
403	T	56.8	Low	66.1	Low	69 Å²	69	92.8 Å²	92.8	42%	0.423	49%	0.485	S	S	.	.			trans	-57.8	107.5	175.6	42.3	0	0	0	0	108.8	G401 P405	G401-T403 PolarHBondContact O-N 2.86Å; G401-T403 VanDerWaalsContact O-N 3.13Å; T403-P405 WeakPolarHBondContact O-CD 3.48Å
404	R	69.3	Low	66.5	Low	222 Å²	222	97.2 Å²	97.2	84%	0.838	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-61	123.2	-168.5	-174.2	-178.8	-176.4	-175.5	1.9	108.6	Q402 R406	Q402-R404 PolarHBondContact O-N 3.06Å; R404-R406 PolarHBondContact O-N 3.31Å; R404-R406 VanDerWaalsContact O-N 3.1Å
405	P	80.7	Confident	66.8	Low	57 Å²	57	94.6 Å²	94.6	37%	0.37	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-57.4	120.6	-176.9	15.8	-27.8	0	0	0	110.7	V384 Q385 F386 T403	V384-P405 HydrophobicContact CB-CB 3.92Å; V384-P405 HydrophobicContact CG1-CB 4.2Å; V384-P405 HydrophobicContact CG2-CB 4.42Å; Q385-P405 CarbonylContact O-C 3.54Å; Q385-P405 VanDerWaalsContact O-CA 3.32Å; Q385-P405 WeakPolarHBondContact O-CA 3.11Å; F386-P405 HydrophobicContact CD1-CB 4.13Å; F386-P405 HydrophobicContact CE1-CB 3.71Å; F386-P405 HydrophobicContact CE1-CG 3.95Å; F386-P405 HydrophobicContact CE2-CB 4.48Å; F386-P405 HydrophobicContact CZ-CB 3.91Å; F386-P405 HydrophobicContact CZ-CG 4.3Å; T403-P405 WeakPolarHBondContact O-CD 3.48Å
406	R	86.8	Confident	66.9	Low	32 Å²	32	90.9 Å²	90.9	12%	0.121	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	140.5	174.2	-69.8	-177.3	179	157.3	7.2	108.9	K332 D334 V384 Q385 Q387 R404	K332-R406 WeakPolarHBondContact O-CD 3.47Å; D334-R406 IonicContact OD1-CZ 2.82Å; D334-R406 IonicContact OD1-NE 2.72Å; D334-R406 PolarHBondContact OD1-NE 2.9Å; D334-R406 IonicContact OD1-NH2 3.77Å; D334-R406 PolarHBondContact OD1-NH2 3.07Å; D334-R406 IonicContact OD2-CZ 2.61Å; D334-R406 IonicContact OD2-NE 2.74Å; D334-R406 IonicContact OD2-NH2 3.67Å; D334-R406 PolarHBondContact OD2-NH2 2.99Å; V384-R406 CarbonylContact C-O 3.55Å; V384-R406 VanDerWaalsContact CA-O 3.28Å; V384-R406 WeakPolarHBondContact CA-O 3.25Å; Q385-R406 HydrophobicContact CB-CB 4.4Å; Q385-R406 PolarHBondContact N-O 2.93Å; Q385-R406 PolarHBondContact O-N 3.01Å; Q387-R406 VanDerWaalsContact CD-CZ 3.48Å; Q387-R406 VanDerWaalsContact CD-NH1 3.25Å; Q387-R406 VanDerWaalsContact NE2-NH1 3.13Å; Q387-R406 VanDerWaalsContact OE1-CZ 3.25Å; R404-R406 PolarHBondContact O-N 3.31Å; R404-R406 VanDerWaalsContact O-N 3.1Å
407	V	88.4	Confident	67.3	Low	78 Å²	78	89.6 Å²	89.6	47%	0.473	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	130	173	179.6	0	0	0	0	108.6	Y331 K332	Y331-V407 WeakPolarHBondContact CA-O 3.4Å; K332-V407 HydrophobicContact CB-CB 4.34Å; K332-V407 PolarHBondContact N-O 3.25Å
408	V	90.8	Very high	68.5	Low	7 Å²	7	94.9 Å²	94.9	4%	0.042	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	132.4	173.8	172.5	0	0	0	0	108.7	W329 F330 Y342 L350 I375 I383 Q385	W329-V408 HydrophobicContact CE3-CG1 3.62Å; W329-V408 HydrophobicContact CZ3-CG1 3.8Å; F330-V408 CarbonylContact O-C 3.54Å; F330-V408 VanDerWaalsContact O-CA 3.31Å; F330-V408 WeakPolarHBondContact O-CA 3.4Å; Y342-V408 HydrophobicContact CE2-CG1 4.21Å; Y342-V408 HydrophobicContact CE2-CG2 4.37Å; L350-V408 HydrophobicContact CD2-CG1 4.21Å; I375-V408 HydrophobicContact CD1-CG2 4.45Å; I383-V408 HydrophobicContact CB-CB 4.15Å; I383-V408 HydrophobicContact CB-CG1 4.4Å; I383-V408 HydrophobicContact CG2-CB 3.87Å; I383-V408 HydrophobicContact CG2-CG1 3.91Å; I383-V408 PolarHBondContact O-N 2.79Å; Q385-V408 HydrophobicContact CB-CG2 3.69Å
409	K	90	Very high	70.4	Confident	19 Å²	19	92.3 Å²	92.3	8%	0.083	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	146.9	-179.2	169.9	171.3	165.3	166.6	0	110.2	W329 F330 F339 G411 D413 D417	W329-K409 WeakPolarHBondContact CA-O 3.43Å; F330-K409 HydrophobicContact CB-CB 4.45Å; F330-K409 PolarHBondContact N-O 3.03Å; F330-K409 PolarHBondContact O-N 2.83Å; F339-K409 HydrophobicContact CD1-CB 4.18Å; F339-K409 HydrophobicContact CD1-CD 4.38Å; F339-K409 HydrophobicContact CD2-CD 4.15Å; F339-K409 HydrophobicContact CE1-CB 3.76Å; F339-K409 HydrophobicContact CE1-CD 4.02Å; F339-K409 HydrophobicContact CE2-CD 3.76Å; F339-K409 HydrophobicContact CG-CD 4.45Å; F339-K409 HydrophobicContact CZ-CB 4.2Å; F339-K409 HydrophobicContact CZ-CD 3.7Å; K409-G411 WeakPolarHBondContact CE-O 3.02Å; K409-D413 WeakPolarHBondContact CE-OD2 3.43Å; K409-D413 IonicContact NZ-OD2 3.51Å; K409-D413 PolarHBondContact NZ-OD2 3.09Å; K409-D417 VanDerWaalsContact CE-OD2 3.32Å; K409-D417 WeakPolarHBondContact CE-OD2 3.44Å; K409-D417 IonicContact NZ-OD1 3.27Å; K409-D417 PolarHBondContact NZ-OD1 2.94Å; K409-D417 IonicContact NZ-OD2 3.29Å; K409-D417 PolarHBondContact NZ-OD2 2.87Å
410	R	91.3	Very high	72.4	Confident	56 Å²	56	88.6 Å²	88.6	21%	0.211	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	128.6	176.4	-179.2	-177.4	-179.7	-105	11	108.9	E251 V253 W329 E351 Y354	E251-R410 PolarHBondContact O-NH1 3.03Å; E251-R410 PolarHBondContact O-NH2 2.97Å; V253-R410 HydrophobicContact CB-CG 4.26Å; V253-R410 HydrophobicContact CG2-CG 4.26Å; V253-R410 VanDerWaalsContact N-NH2 3.18Å; W329-R410 HydrophobicContact CD2-CB 4.05Å; W329-R410 HydrophobicContact CD2-CG 4.14Å; W329-R410 HydrophobicContact CE3-CB 3.87Å; W329-R410 HydrophobicContact CE3-CG 4.44Å; W329-R410 HydrophobicContact CH2-CB 3.74Å; W329-R410 HydrophobicContact CH2-CG 4.01Å; W329-R410 HydrophobicContact CZ2-CB 3.88Å; W329-R410 VanDerWaalsContact CZ2-CD 3.46Å; W329-R410 HydrophobicContact CZ2-CG 3.62Å; W329-R410 HydrophobicContact CZ3-CB 3.73Å; W329-R410 HydrophobicContact CZ3-CG 4.4Å; E351-R410 IonicContact OE1-CZ 3.93Å; E351-R410 IonicContact OE1-NE 3.07Å; E351-R410 PolarHBondContact OE1-NE 3.48Å; E351-R410 IonicContact OE1-NH2 2.67Å; E351-R410 PolarHBondContact OE1-NH2 3.04Å; E351-R410 IonicContact OE2-CZ 2.64Å; E351-R410 IonicContact OE2-NE 3.23Å; E351-R410 PolarHBondContact OE2-NE 2.69Å; E351-R410 IonicContact OE2-NH2 2.76Å; Y354-R410 VanDerWaalsContact CE1-CZ 3.45Å; Y354-R410 VanDerWaalsContact CE1-NE 3.3Å
411	G	88	Confident	74.5	Confident	8 Å²	8	86.6 Å²	86.6	8%	0.082	45%	0.453	C	S	.	.	S	Bend	trans	70	177.9	-175.8	0	0	0	0	0	113.5	T328 F330 K409	T328-G411 PolarHBondContact O-N 3.35Å; F330-G411 WeakPolarHBondContact CD2-O 3.46Å; F330-G411 VanDerWaalsContact CE2-O 3.26Å; F330-G411 WeakPolarHBondContact CE2-O 3.34Å; K409-G411 WeakPolarHBondContact CE-O 3.02Å
412	V	84.5	Confident	76.4	Confident	38 Å²	38	84.8 Å²	84.8	23%	0.23	44%	0.435	C	S	.	.			trans	-95	143.9	168.5	178.6	0	0	0	0	107.2	H256 F258 F330 D417 V419	H256-V412 HydrophobicContact CB-CG2 3.68Å; F258-V412 HydrophobicContact CE2-CG2 4.46Å; F258-V412 HydrophobicContact CZ-CG2 4.13Å; F330-V412 HydrophobicContact CE2-CG2 4.19Å; F330-V412 HydrophobicContact CZ-CG2 4.02Å; V412-D417 VanDerWaalsContact CA-OD2 3.29Å; V412-D417 WeakPolarHBondContact CA-OD2 3.39Å; V412-D417 HydrophobicContact CG1-CB 3.87Å; V412-D417 VanDerWaalsContact CG1-OD2 3.3Å; V412-D417 WeakPolarHBondContact CG1-OD2 3.44Å; V412-V419 HydrophobicContact CG1-CG2 3.81Å
413	D	72.9	Confident	78.3	Confident	72 Å²	72	77.1 Å²	77.1	39%	0.385	40%	0.399	S	S	.	.			trans	-110.3	115.1	174.8	-62.9	-46.8	0	0	0	108.7	K409 D415 H416 D417	K409-D413 WeakPolarHBondContact CE-OD2 3.43Å; K409-D413 IonicContact NZ-OD2 3.51Å; K409-D413 PolarHBondContact NZ-OD2 3.09Å; D413-D415 PolarHBondContact O-N 3.3Å; D413-D415 VanDerWaalsContact O-N 3.09Å; D413-H416 HydrophobicContact CB-CB 4.09Å; D413-H416 PolarHBondContact O-N 2.9Å; D413-D417 PolarHBondContact N-OD2 3.3Å; D413-D417 PolarHBondContact O-N 3Å
414	D	60.7	Low	79.5	Confident	152 Å²	152	77.5 Å²	77.5	81%	0.813	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-29.5	-176.9	-53.8	-23.8	0	0	0	113.7
415	D	56.4	Low	80	Confident	154 Å²	154	71.6 Å²	71.6	82%	0.824	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-11.1	178.7	-75.4	-46.2	0	0	0	114.2	D413	D413-D415 PolarHBondContact O-N 3.3Å; D413-D415 VanDerWaalsContact O-N 3.09Å
416	H	57.6	Low	80.4	Confident	150 Å²	150	72.9 Å²	72.9	69%	0.694	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137	-22.3	-164.4	-71.2	-10.5	0	0	0	116.4	D413	D413-H416 HydrophobicContact CB-CB 4.09Å; D413-H416 PolarHBondContact O-N 2.9Å
417	D	65.5	Low	80.8	Confident	35 Å²	35	72.4 Å²	72.4	19%	0.187	40%	0.395	C	S	.	.	S	Bend	trans	-105.7	121.5	173.7	-48.7	-47.9	0	0	0	108.8	K409 V412 D413 V419	K409-D417 VanDerWaalsContact CE-OD2 3.32Å; K409-D417 WeakPolarHBondContact CE-OD2 3.44Å; K409-D417 IonicContact NZ-OD1 3.27Å; K409-D417 PolarHBondContact NZ-OD1 2.94Å; K409-D417 IonicContact NZ-OD2 3.29Å; K409-D417 PolarHBondContact NZ-OD2 2.87Å; V412-D417 VanDerWaalsContact CA-OD2 3.29Å; V412-D417 WeakPolarHBondContact CA-OD2 3.39Å; V412-D417 HydrophobicContact CG1-CB 3.87Å; V412-D417 VanDerWaalsContact CG1-OD2 3.3Å; V412-D417 WeakPolarHBondContact CG1-OD2 3.44Å; D413-D417 PolarHBondContact N-OD2 3.3Å; D413-D417 PolarHBondContact O-N 3Å; D417-V419 VanDerWaalsContact C-N 3.25Å; D417-V419 HydrophobicContact CB-CG2 4.32Å; D417-V419 PolarHBondContact O-N 3.34Å
418	E	75.4	Confident	81.2	Confident	193 Å²	193	70.9 Å²	70.9	90%	0.902	39%	0.385	S	S	*	.			trans	-73.7	72.9	-176.5	-64	-178.6	161.7	0	0	111.9
419	V	85.1	Confident	81.5	Confident	32 Å²	32	70.8 Å²	70.8	19%	0.194	38%	0.384	C	S	.	.			trans	-87.2	129.5	177.2	-177.9	0	0	0	0	110.4	P271 I274 V412 D417	P271-V419 HydrophobicContact CB-CG1 4.29Å; P271-V419 HydrophobicContact CB-CG2 3.98Å; P271-V419 HydrophobicContact CG-CG2 4.19Å; I274-V419 HydrophobicContact CG1-CG1 3.72Å; V412-V419 HydrophobicContact CG1-CG2 3.81Å; D417-V419 VanDerWaalsContact C-N 3.25Å; D417-V419 HydrophobicContact CB-CG2 4.32Å; D417-V419 PolarHBondContact O-N 3.34Å
420	P	86.5	Confident	81.8	Confident	70 Å²	70	69.9 Å²	69.9	46%	0.455	38%	0.38	S	S	.	.			trans	-69.8	140.7	174	-17.5	31.3	0	0	0	112.5	S273 I274 G422	S273-P420 CarbonylContact C-O 3.54Å; S273-P420 WeakPolarHBondContact CA-O 3.45Å; S273-P420 WeakPolarHBondContact CB-O 3.5Å; I274-P420 PolarHBondContact N-O 2.75Å; P420-G422 PolarHBondContact O-N 3.39Å
421	D	85.5	Confident	82.2	Confident	124 Å²	124	67.2 Å²	67.2	66%	0.663	37%	0.37	S	S	*	.			trans	-57.6	-49.6	173.3	-63.1	-62.1	0	0	0	111.8	I274 I275	I274-D421 PolarHBondContact N-O 2.79Å; I275-D421 WeakPolarHBondContact CG1-O 3.08Å; I275-D421 PolarHBondContact N-O 2.96Å
422	G	84.8	Confident	82.7	Confident	25 Å²	25	66.9 Å²	66.9	26%	0.258	37%	0.366	S	S	.	.			trans	127.7	-166.3	174.8	0	0	0	0	0	114	S273 P420	S273-G422 WeakPolarHBondContact OG-CA 3.45Å; P420-G422 PolarHBondContact O-N 3.39Å
423	E	87.2	Confident	83.3	Confident	26 Å²	26	65.1 Å²	65.1	12%	0.121	36%	0.356	C	S	.	.			trans	-124	140.6	178.1	-77.6	-179.8	-124.9	0	0	110.9	R302 L460 R478	R302-E423 IonicContact CZ-OE1 3.25Å; R302-E423 IonicContact CZ-OE2 2.7Å; R302-E423 IonicContact NH1-OE1 3.02Å; R302-E423 PolarHBondContact NH1-OE1 3.09Å; R302-E423 IonicContact NH1-OE2 3.21Å; R302-E423 PolarHBondContact NH1-OE2 2.89Å; R302-E423 IonicContact NH2-OE1 2.69Å; R302-E423 PolarHBondContact NH2-OE1 2.94Å; R302-E423 IonicContact NH2-OE2 2.93Å; E423-L460 HydrophobicContact CG-CD1 3.51Å; E423-L460 HydrophobicContact CG-CD2 4.04Å; E423-L460 HydrophobicContact CG-CG 4.44Å; E423-R478 IonicContact OE2-CZ 2.64Å; E423-R478 IonicContact OE2-NE 3.4Å; E423-R478 PolarHBondContact OE2-NE 3.16Å; E423-R478 IonicContact OE2-NH1 2.7Å; E423-R478 PolarHBondContact OE2-NH1 3.2Å
424	L	81.7	Confident	84.2	Confident	78 Å²	78	61.7 Å²	61.7	41%	0.408	34%	0.337	S	S	.	.			trans	-67	142.3	171.7	-64.6	177.3	0	0	0	110.5	T426 L471 S477 R478	L424-T426 VanDerWaalsContact C-N 3.26Å; L424-T426 PolarHBondContact O-N 2.79Å; L424-L471 HydrophobicContact CD1-CD1 4.31Å; L424-S477 VanDerWaalsContact CB-OG 3.32Å; L424-S477 WeakPolarHBondContact CB-OG 3.27Å; L424-R478 WeakPolarHBondContact O-CD 3.48Å; L424-R478 PolarHBondContact O-NE 3.14Å
425	P	80.6	Confident	85.5	Confident	97 Å²	97	54.8 Å²	54.8	63%	0.63	30%	0.3	S	S	*	.	S	Bend	trans	-71.7	-20.8	-177.7	29.1	-35.9	0	0	0	113.2
426	T	89.5	Confident	86.3	Confident	85 Å²	85	47.5 Å²	47.5	52%	0.521	26%	0.261	S	S	.	.			trans	-76.4	136.7	177	34.1	0	0	0	0	111.7	L424 S477 R478	L424-T426 VanDerWaalsContact C-N 3.26Å; L424-T426 PolarHBondContact O-N 2.79Å; T426-S477 WeakPolarHBondContact O-CB 3.38Å; T426-S477 PolarHBondContact O-OG 2.92Å; T426-S477 WeakPolarHBondContact OG1-CB 3.43Å; T426-S477 PolarHBondContact OG1-OG 3.49Å; T426-R478 WeakPolarHBondContact O-CG 3.46Å
427	V	95.1	Very high	86.7	Confident	21 Å²	21	41.8 Å²	41.8	13%	0.127	24%	0.235	C	C	.	.			trans	-124.2	130.8	179.6	-178.7	0	0	0	0	109.1	H429 E480 F550 Y557	V427-H429 VanDerWaalsContact CG1-O 3.23Å; V427-H429 WeakPolarHBondContact CG1-O 3.35Å; V427-E480 HydrophobicContact CG1-CB 3.65Å; V427-E480 HydrophobicContact CG2-CB 4.14Å; V427-F550 HydrophobicContact CB-CZ 4.21Å; V427-F550 HydrophobicContact CG1-CZ 4.1Å; V427-F550 HydrophobicContact CG2-CZ 4.39Å; V427-Y557 HydrophobicContact CB-CD2 4.46Å; V427-Y557 HydrophobicContact CB-CE2 4.15Å; V427-Y557 HydrophobicContact CG1-CE2 3.98Å; V427-Y557 VanDerWaalsContact O-CE2 3.31Å; V427-Y557 WeakPolarHBondContact O-CE2 3.3Å
428	D	95.2	Very high	86.2	Confident	47 Å²	47	40.2 Å²	40.2	25%	0.251	23%	0.227	S	C	.	.	S	Bend	trans	-94.6	-29.4	-178.1	-41.5	-53.8	0	0	0	112.5	S477 R478 G559 G560 Y945	D428-S477 VanDerWaalsContact CG-N 3.34Å; D428-S477 WeakPolarHBondContact OD1-CB 3.21Å; D428-S477 PolarHBondContact OD1-N 3.31Å; D428-S477 WeakPolarHBondContact OD2-CA 3.27Å; D428-S477 PolarHBondContact OD2-N 3.33Å; D428-R478 PolarHBondContact N-O 2.85Å; D428-R478 PolarHBondContact OD2-N 2.98Å; D428-G559 WeakPolarHBondContact O-CA 3.37Å; D428-G560 PolarHBondContact O-N 3.41Å; D428-Y945 HydrophobicContact CB-CE1 4.07Å; D428-Y945 PolarHBondContact OD2-OH 2.98Å
429	H	97.2	Very high	85.1	Confident	5 Å²	5	33.8 Å²	33.8	2%	0.023	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	146.3	-177.2	-159.5	101.4	0	0	0	110.7	V427 V479 E480 Y557 G560 S562 I944	V427-H429 VanDerWaalsContact CG1-O 3.23Å; V427-H429 WeakPolarHBondContact CG1-O 3.35Å; H429-V479 HydrophobicContact CB-CG1 4.27Å; H429-V479 HydrophobicContact CB-CG2 4.18Å; H429-V479 WeakPolarHBondContact O-CA 3.33Å; H429-E480 PolarHBondContact O-N 3.4Å; H429-Y557 VanDerWaalsContact C-OH 3.23Å; H429-Y557 WeakPolarHBondContact CA-OH 3.39Å; H429-G560 WeakPolarHBondContact CA-O 3.31Å; H429-G560 WeakPolarHBondContact ND1-CA 3.43Å; H429-G560 PolarHBondContact ND1-O 3.31Å; H429-S562 PolarHBondContact CE1-OG 2.69Å; H429-S562 WeakPolarHBondContact NE2-CB 3.14Å; H429-S562 PolarHBondContact NE2-N 3.1Å; H429-S562 PolarHBondContact NE2-OG 2.9Å; H429-I944 HydrophobicContact CB-CG2 3.63Å
430	L	98.1	Very high	83.6	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	133.3	-179	-180	62.7	0	0	0	110.5	F432 E480 L482 F550 Y557 G560 I561 S562	L430-F432 HydrophobicContact CD2-CE1 4.18Å; L430-F432 HydrophobicContact CD2-CE2 3.85Å; L430-F432 HydrophobicContact CD2-CZ 3.47Å; L430-F432 VanDerWaalsContact CD2-CZ 3.47Å; L430-F432 HydrophobicContact CG-CE2 4.23Å; L430-F432 HydrophobicContact CG-CZ 4.09Å; L430-E480 CarbonylContact C-O 3.19Å; L430-E480 HydrophobicContact CD1-CB 4.06Å; L430-E480 HydrophobicContact CD1-CG 4.05Å; L430-L482 HydrophobicContact CD1-CD1 3.93Å; L430-L482 HydrophobicContact CD1-CG 3.96Å; L430-F550 HydrophobicContact CD1-CD2 3.99Å; L430-F550 HydrophobicContact CD1-CE2 3.88Å; L430-F550 HydrophobicContact CD1-CG 4.46Å; L430-F550 HydrophobicContact CD1-CZ 4.26Å; L430-F550 HydrophobicContact CD2-CB 4.34Å; L430-F550 HydrophobicContact CD2-CD1 3.7Å; L430-F550 HydrophobicContact CD2-CD2 4.19Å; L430-F550 HydrophobicContact CD2-CE1 3.97Å; L430-F550 HydrophobicContact CD2-CE2 4.43Å; L430-F550 HydrophobicContact CD2-CG 3.82Å; L430-F550 HydrophobicContact CD2-CZ 4.33Å; L430-Y557 PolarHBondContact N-OH 3.42Å; L430-G560 PolarHBondContact N-O 3.19Å; L430-I561 HydrophobicContact CB-CG1 4.47Å; L430-I561 HydrophobicContact CB-CG2 4.44Å; L430-I561 CarbonylContact O-C 3.54Å; L430-I561 WeakPolarHBondContact O-CA 3.42Å; L430-S562 PolarHBondContact O-N 2.92Å
431	V	98.5	Very high	82	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	115.5	178.5	-173.9	0	0	0	0	110.2	M433 V479 E480 F481 L482 S562 A564 I944	V431-M433 HydrophobicContact CG1-CG 4.21Å; V431-V479 HydrophobicContact CG2-CG1 3.64Å; V431-E480 PolarHBondContact N-O 2.84Å; V431-F481 HydrophobicContact CB-CD1 3.64Å; V431-F481 HydrophobicContact CB-CE1 3.96Å; V431-F481 HydrophobicContact CB-CG 4.42Å; V431-F481 HydrophobicContact CG1-CD1 4Å; V431-F481 HydrophobicContact CG1-CE1 4.27Å; V431-F481 HydrophobicContact CG2-CD1 4.02Å; V431-F481 HydrophobicContact CG2-CE1 3.82Å; V431-F481 CarbonylContact O-C 3.55Å; V431-F481 WeakPolarHBondContact O-CA 3.37Å; V431-L482 PolarHBondContact O-N 3Å; V431-S562 WeakPolarHBondContact CA-O 3.42Å; V431-A564 HydrophobicContact CG1-CB 3.85Å; V431-I944 HydrophobicContact CG2-CD1 3.84Å
432	F	98.4	Very high	80.5	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	116.3	168.8	-62.7	-71.7	0	0	0	109.5	L430 L482 V484 I543 L546 Y547 I561 S562 V563 A564 F740	L430-F432 HydrophobicContact CD2-CE1 4.18Å; L430-F432 HydrophobicContact CD2-CE2 3.85Å; L430-F432 HydrophobicContact CD2-CZ 3.47Å; L430-F432 VanDerWaalsContact CD2-CZ 3.47Å; L430-F432 HydrophobicContact CG-CE2 4.23Å; L430-F432 HydrophobicContact CG-CZ 4.09Å; F432-L482 HydrophobicContact CD1-CB 4.13Å; F432-L482 HydrophobicContact CE1-CB 4.36Å; F432-L482 HydrophobicContact CE1-CD1 4.01Å; F432-V484 HydrophobicContact CB-CG2 3.88Å; F432-V484 HydrophobicContact CD1-CG2 4.37Å; F432-I543 HydrophobicContact CD2-CG2 4.14Å; F432-I543 HydrophobicContact CE2-CG2 4.44Å; F432-I543 HydrophobicContact CG-CG2 4.28Å; F432-L546 HydrophobicContact CD1-CB 4.2Å; F432-L546 HydrophobicContact CD1-CD1 4.4Å; F432-L546 HydrophobicContact CE1-CB 3.64Å; F432-Y547 HydrophobicContact CZ-CD2 4.49Å; F432-I561 HydrophobicContact CD2-CG2 3.98Å; F432-I561 HydrophobicContact CE2-CG2 3.66Å; F432-S562 PolarHBondContact N-O 3.46Å; F432-V563 HydrophobicContact CB-CG1 4.34Å; F432-V563 CarbonylContact O-C 3.6Å; F432-V563 WeakPolarHBondContact O-CA 3.45Å; F432-A564 PolarHBondContact O-N 2.95Å; F432-F740 HydrophobicContact CD2-CE1 4.14Å; F432-F740 HydrophobicContact CD2-CE2 4.16Å; F432-F740 AromaticContact CD2-CZ 3.47Å; F432-F740 HydrophobicContact CD2-CZ 3.47Å; F432-F740 VanDerWaalsContact CD2-CZ 3.47Å; F432-F740 AromaticContact CE2-CE1 3.62Å; F432-F740 HydrophobicContact CE2-CE1 3.62Å; F432-F740 HydrophobicContact CE2-CE2 4.12Å; F432-F740 AromaticContact CE2-CZ 3.38Å; F432-F740 HydrophobicContact CE2-CZ 3.38Å; F432-F740 HydrophobicContact CZ-CE1 4.43Å
433	M	96.6	Very high	79	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	125.1	178.3	-54.4	-165.9	83.6	0	0	109	V431 M448 V452 F455 F481 L482 V484 A564 W931	V431-M433 HydrophobicContact CG1-CG 4.21Å; M433-M448 HydrophobicContact CB-CE 4.31Å; M433-M448 WeakPolarHBondContact O-CE 3.48Å; M433-V452 HydrophobicContact CB-CG2 4.35Å; M433-V452 HydrophobicContact SD-CG1 4.05Å; M433-V452 HydrophobicContact SD-CG2 3.87Å; M433-F455 HydrophobicContact CE-CD1 4.19Å; M433-F455 HydrophobicContact CE-CE1 4.3Å; M433-F455 HydrophobicContact CE-CG 4.41Å; M433-F455 HydrophobicContact SD-CD1 4.35Å; M433-F481 HydrophobicContact CG-CB 4.35Å; M433-F481 HydrophobicContact CG-CD1 4.28Å; M433-F481 HydrophobicContact SD-CB 3.91Å; M433-F481 HydrophobicContact SD-CD1 3.76Å; M433-F481 HydrophobicContact SD-CG 4.21Å; M433-L482 PolarHBondContact N-O 2.9Å; M433-V484 WeakPolarHBondContact O-CB 3.5Å; M433-V484 WeakPolarHBondContact O-CG2 3.38Å; M433-V484 PolarHBondContact O-N 3.41Å; M433-A564 CarbonylContact C-O 3.55Å; M433-A564 VanDerWaalsContact CA-O 3.29Å; M433-A564 WeakPolarHBondContact CA-O 3.34Å; M433-A564 HydrophobicContact CE-CB 4.25Å; M433-A564 HydrophobicContact CG-CB 4.31Å; M433-W931 HydrophobicContact CE-CE3 4.21Å; M433-W931 HydrophobicContact CE-CZ3 3.63Å; M433-W931 HydrophobicContact SD-CZ3 4.11Å
434	V	93.7	Very high	77.5	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	114.6	177.3	-178	0	0	0	0	108.6	V484 V539 I543 A564 H566 L573	V434-V484 HydrophobicContact CG2-CB 3.89Å; V434-V484 HydrophobicContact CG2-CG1 4.12Å; V434-V484 HydrophobicContact CG2-CG2 3.97Å; V434-V539 HydrophobicContact CG1-CG1 4.24Å; V434-V539 HydrophobicContact CG2-CG1 4.23Å; V434-I543 HydrophobicContact CG2-CD1 4.16Å; V434-A564 PolarHBondContact N-O 2.82Å; V434-H566 PolarHBondContact O-N 3.36Å; V434-L573 HydrophobicContact CB-CD1 3.98Å; V434-L573 HydrophobicContact CB-CG 4.22Å; V434-L573 HydrophobicContact CG2-CD1 3.76Å; V434-L573 HydrophobicContact CG2-CD2 3.9Å; V434-L573 HydrophobicContact CG2-CG 3.85Å
435	H	86.4	Confident	76.5	Confident	7 Å²	7	40.3 Å²	40.3	3%	0.032	21%	0.209	C	C	.	.			trans	-71.6	151.5	172.2	74.3	121.6	0	0	0	110.3	G438 M448 V484 W486	H435-G438 PolarHBondContact CE1-O 2.86Å; H435-G438 PolarHBondContact ND1-O 2.93Å; H435-M448 HydrophobicContact CB-CE 3.73Å; H435-M448 HydrophobicContact CB-CG 4.09Å; H435-M448 HydrophobicContact CB-SD 3.76Å; H435-M448 PolarHBondContact CD2-SD 3.4Å; H435-V484 PolarHBondContact CD2-O 2.89Å; H435-W486 AromaticContact CD2-CD1 3.72Å; H435-W486 AromaticContact CD2-NE1 3.69Å; H435-W486 AromaticContact NE2-CD1 3.6Å; H435-W486 AromaticContact NE2-NE1 3.67Å; H435-W486 PolarHBondContact O-NE1 2.8Å
436	G	73.4	Confident	76.1	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.184	C	C	.	.			trans	-89.1	-39.9	-177.8	0	0	0	0	0	115.2	W486 H566 L568	G436-W486 VanDerWaalsContact O-CZ2 3.31Å; G436-W486 WeakPolarHBondContact O-CZ2 3.32Å; G436-H566 WeakPolarHBondContact CA-O 3.2Å; G436-H566 PolarHBondContact N-O 2.9Å; G436-L568 WeakPolarHBondContact O-CB 3.38Å; G436-L568 WeakPolarHBondContact O-CD2 3.49Å
437	I	65.5	Low	75.8	Confident	31 Å²	31	35.2 Å²	35.2	16%	0.159	17%	0.173	C	C	.	.	S	Bend	trans	-150.1	130.7	-159.1	-67.5	-176.7	0	0	0	109.7	T519 D522 V523 L568	I437-T519 HydrophobicContact CG2-CG2 3.53Å; I437-T519 WeakPolarHBondContact CG2-O 3.17Å; I437-D522 HydrophobicContact CG1-CB 4.43Å; I437-D522 HydrophobicContact CG2-CB 4.42Å; I437-V523 HydrophobicContact CD1-CG2 3.61Å; I437-V523 HydrophobicContact CG1-CG2 4.32Å; I437-L568 HydrophobicContact CD1-CB 4.28Å; I437-L568 HydrophobicContact CG1-CB 3.86Å; I437-L568 HydrophobicContact CG1-CD2 4.29Å
438	G	56.3	Low	75.3	Confident	2 Å²	2	34.4 Å²	34.4	2%	0.021	17%	0.168	C	C	.	.	S	Bend	trans	72	171	170.7	0	0	0	0	0	115.4	H435 V440 E518 D522	H435-G438 PolarHBondContact CE1-O 2.86Å; H435-G438 PolarHBondContact ND1-O 2.93Å; G438-V440 PolarHBondContact O-N 3.31Å; G438-E518 WeakPolarHBondContact CA-O 3.2Å; G438-E518 PolarHBondContact N-O 2.84Å; G438-D522 PolarHBondContact N-OD2 3.48Å
439	P	51.8	Low	75	Confident	58 Å²	58	33 Å²	33	38%	0.377	16%	0.161	S	C	.	.	S	Bend	trans	-77.2	-9.2	171.9	33.6	-32.2	0	0	0	112.1	H487	P439-H487 WeakPolarHBondContact CD-NE2 3.26Å
440	V	53.9	Low	74.6	Confident	49 Å²	49	35.4 Å²	35.4	30%	0.297	17%	0.172	S	C	.	.	B	Isolated β-bridge	trans	-110.8	131.1	-173.1	159.6	0	0	0	0	110.1	G438 D442 F445 R446	G438-V440 PolarHBondContact O-N 3.31Å; V440-D442 VanDerWaalsContact CG1-O 3.26Å; V440-D442 WeakPolarHBondContact CG1-O 3.43Å; V440-F445 HydrophobicContact CG1-CB 4.45Å; V440-F445 HydrophobicContact CG1-CD1 4.17Å; V440-F445 HydrophobicContact CG2-CB 4.12Å; V440-F445 HydrophobicContact CG2-CD1 4.27Å; V440-R446 WeakPolarHBondContact CA-O 3.49Å
441	C	53.2	Low	74.1	Confident	3 Å²	3	35.4 Å²	35.4	2%	0.02	17%	0.172	C	C	.	.			trans	-112	-0	-177.4	-72.7	0	0	0	0	114.7	R446 C451 W931	C441-R446 PolarHBondContact N-O 2.98Å; C441-C451 HydrophobicContact CB-CB 3.89Å; C441-C451 VanDerWaalsContact CB-SG 3.58Å; C441-W931 VanDerWaalsContact O-CD1 3.29Å; C441-W931 PolarHBondContact O-NE1 3.16Å
442	D	54.6	Low	73.8	Confident	14 Å²	14	35.4 Å²	35.4	8%	0.075	17%	0.172	C	C	.	.	S	Bend	trans	-148.1	173	177	80	-4.5	0	0	0	114.8	V440 R444 F445 R446	V440-D442 VanDerWaalsContact CG1-O 3.26Å; V440-D442 WeakPolarHBondContact CG1-O 3.43Å; D442-R444 PolarHBondContact O-N 3.44Å; D442-R444 VanDerWaalsContact O-N 3.1Å; D442-R444 VanDerWaalsContact OD1-CA 3.32Å; D442-R444 WeakPolarHBondContact OD1-CA 3.16Å; D442-R444 WeakPolarHBondContact OD1-CB 3.43Å; D442-R444 PolarHBondContact OD1-N 3.25Å; D442-F445 PolarHBondContact O-N 3.05Å; D442-F445 PolarHBondContact OD1-N 3.23Å; D442-R446 PolarHBondContact OD1-N 2.86Å; D442-R446 IonicContact OD1-NE 3.39Å; D442-R446 IonicContact OD2-CZ 3.65Å; D442-R446 VanDerWaalsContact OD2-CZ 3.23Å; D442-R446 IonicContact OD2-NE 3.52Å; D442-R446 PolarHBondContact OD2-NE 3Å; D442-R446 IonicContact OD2-NH2 2.68Å; D442-R446 PolarHBondContact OD2-NH2 3.37Å
443	L	53	Low	73.5	Confident	87 Å²	87	37.7 Å²	37.7	46%	0.455	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-8.8	175.9	-72.2	-179.4	0	0	0	114.6	L924 Q925 L928	L443-L924 HydrophobicContact CD2-CD2 3.95Å; L443-L924 HydrophobicContact CD2-CG 3.99Å; L443-Q925 HydrophobicContact CD1-CB 3.78Å; L443-Q925 HydrophobicContact CD1-CG 3.84Å; L443-L928 HydrophobicContact CD2-CD1 3.76Å; L443-L928 HydrophobicContact CG-CD1 3.86Å
444	R	54.7	Low	73.2	Confident	175 Å²	175	39.5 Å²	39.5	66%	0.66	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.3	3.1	-179.2	-52.6	179.7	66.8	-169.1	-0	111.9	D442 R446	D442-R444 PolarHBondContact O-N 3.44Å; D442-R444 VanDerWaalsContact O-N 3.1Å; D442-R444 VanDerWaalsContact OD1-CA 3.32Å; D442-R444 WeakPolarHBondContact OD1-CA 3.16Å; D442-R444 WeakPolarHBondContact OD1-CB 3.43Å; D442-R444 PolarHBondContact OD1-N 3.25Å; R444-R446 VanDerWaalsContact C-N 3.28Å; R444-R446 HydrophobicContact CB-CG 4.15Å; R444-R446 PolarHBondContact O-N 3.38Å
445	F	61.5	Low	73.2	Confident	164 Å²	164	39.6 Å²	39.6	72%	0.719	19%	0.194	S	C	*	.			trans	61.9	32	-175.5	-55.8	-86.5	0	0	0	113.5	V440 D442	V440-F445 HydrophobicContact CG1-CB 4.45Å; V440-F445 HydrophobicContact CG1-CD1 4.17Å; V440-F445 HydrophobicContact CG2-CB 4.12Å; V440-F445 HydrophobicContact CG2-CD1 4.27Å; D442-F445 PolarHBondContact O-N 3.05Å; D442-F445 PolarHBondContact OD1-N 3.23Å
446	R	72.6	Confident	73.6	Confident	32 Å²	32	39.5 Å²	39.5	12%	0.121	19%	0.194	C	C	.	.			trans	-83.8	154.3	176	-69.2	-170.8	-60.9	154.7	5.1	112.9	V440 C441 D442 R444 E450 D454	V440-R446 WeakPolarHBondContact CA-O 3.49Å; C441-R446 PolarHBondContact N-O 2.98Å; D442-R446 PolarHBondContact OD1-N 2.86Å; D442-R446 IonicContact OD1-NE 3.39Å; D442-R446 IonicContact OD2-CZ 3.65Å; D442-R446 VanDerWaalsContact OD2-CZ 3.23Å; D442-R446 IonicContact OD2-NE 3.52Å; D442-R446 PolarHBondContact OD2-NE 3Å; D442-R446 IonicContact OD2-NH2 2.68Å; D442-R446 PolarHBondContact OD2-NH2 3.37Å; R444-R446 VanDerWaalsContact C-N 3.28Å; R444-R446 HydrophobicContact CB-CG 4.15Å; R444-R446 PolarHBondContact O-N 3.38Å; R446-E450 HydrophobicContact CB-CB 4.25Å; R446-E450 WeakPolarHBondContact CB-OE2 3.39Å; R446-E450 WeakPolarHBondContact CD-OE2 3.08Å; R446-E450 WeakPolarHBondContact CG-OE2 3.49Å; R446-D454 IonicContact CZ-OD2 3.82Å; R446-D454 VanDerWaalsContact CZ-OD2 3.25Å; R446-D454 VanDerWaalsContact NH1-CG 3.25Å; R446-D454 IonicContact NH1-OD1 3.45Å; R446-D454 PolarHBondContact NH1-OD1 3.46Å; R446-D454 IonicContact NH1-OD2 3.66Å; R446-D454 PolarHBondContact NH1-OD2 2.91Å; R446-D454 IonicContact NH2-OD2 3.68Å; R446-D454 PolarHBondContact NH2-OD2 3.34Å
447	S	81.8	Confident	74.5	Confident	42 Å²	42	42 Å²	42	29%	0.294	21%	0.211	S	C	.	.	B	Isolated β-bridge	trans	-72	162.6	178.4	77.7	0	0	0	0	112.2	I449 E450 C451	S447-I449 PolarHBondContact O-N 2.68Å; S447-I449 PolarHBondContact OG-N 3Å; S447-E450 PolarHBondContact O-N 2.91Å; S447-C451 PolarHBondContact O-N 3.32Å
448	M	84.9	Confident	75.8	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.02	21%	0.211	C	C	.	.	H	α-helix	trans	-55.4	-37.4	174.4	-171.8	-172.7	-172.5	0	0	113.4	M433 H435 E450 C451 V452 P483 Q485	M433-M448 HydrophobicContact CB-CE 4.31Å; M433-M448 WeakPolarHBondContact O-CE 3.48Å; H435-M448 HydrophobicContact CB-CE 3.73Å; H435-M448 HydrophobicContact CB-CG 4.09Å; H435-M448 HydrophobicContact CB-SD 3.76Å; H435-M448 PolarHBondContact CD2-SD 3.4Å; M448-E450 PolarHBondContact O-N 3.35Å; M448-C451 PolarHBondContact O-N 2.86Å; M448-V452 HydrophobicContact CG-CG2 4.44Å; M448-V452 WeakPolarHBondContact O-CG2 3.41Å; M448-V452 PolarHBondContact O-N 2.75Å; M448-P483 HydrophobicContact CE-CB 3.89Å; M448-P483 HydrophobicContact CG-CB 3.97Å; M448-P483 HydrophobicContact SD-CB 3.69Å; M448-Q485 HydrophobicContact SD-CG 4.21Å
449	I	88.8	Confident	77.7	Confident	18 Å²	18	41.7 Å²	41.7	9%	0.092	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-48.7	-179.5	-63.6	153.4	0	0	0	109.5	W317 S447 C451 V452 D453 P483 Q485	W317-I449 HydrophobicContact CB-CD1 4.32Å; W317-I449 HydrophobicContact CD2-CD1 4.08Å; W317-I449 HydrophobicContact CD2-CG1 4.06Å; W317-I449 HydrophobicContact CD2-CG2 4.48Å; W317-I449 HydrophobicContact CG-CD1 3.67Å; W317-I449 HydrophobicContact CG-CG1 4.09Å; W317-I449 HydrophobicContact CH2-CG2 4.22Å; W317-I449 HydrophobicContact CZ2-CG2 3.67Å; S447-I449 PolarHBondContact O-N 2.68Å; S447-I449 PolarHBondContact OG-N 3Å; I449-C451 VanDerWaalsContact C-N 3.32Å; I449-C451 PolarHBondContact O-N 3.25Å; I449-V452 CarbonylContact O-C 3.52Å; I449-V452 PolarHBondContact O-N 3.13Å; I449-V452 VanDerWaalsContact O-N 3.1Å; I449-D453 PolarHBondContact O-N 2.64Å; I449-P483 HydrophobicContact CG1-CG 4.22Å; I449-Q485 VanDerWaalsContact CD1-NE2 3.27Å
450	E	87.9	Confident	79.6	Confident	56 Å²	56	40.3 Å²	40.3	26%	0.262	20%	0.2	S	C	.	.	H	α-helix	trans	-67.2	-31.8	-178.4	-62.5	-176	161.5	0	0	112.6	K261 R446 S447 M448 D454	K261-E450 IonicContact NZ-OE1 3.99Å; K261-E450 PolarHBondContact NZ-OE1 3.05Å; R446-E450 HydrophobicContact CB-CB 4.25Å; R446-E450 WeakPolarHBondContact CB-OE2 3.39Å; R446-E450 WeakPolarHBondContact CD-OE2 3.08Å; R446-E450 WeakPolarHBondContact CG-OE2 3.49Å; S447-E450 PolarHBondContact O-N 2.91Å; M448-E450 PolarHBondContact O-N 3.35Å; E450-D454 PolarHBondContact O-N 2.73Å; E450-D454 VanDerWaalsContact O-N 3.1Å
451	C	88.3	Confident	81.4	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-72.3	-31.3	172.1	-68.9	0	0	0	0	112.9	C441 S447 M448 I449 F455 W931	C441-C451 HydrophobicContact CB-CB 3.89Å; C441-C451 VanDerWaalsContact CB-SG 3.58Å; S447-C451 PolarHBondContact O-N 3.32Å; M448-C451 PolarHBondContact O-N 2.86Å; I449-C451 VanDerWaalsContact C-N 3.32Å; I449-C451 PolarHBondContact O-N 3.25Å; C451-F455 PolarHBondContact O-N 3.01Å; C451-W931 HydrophobicContact CB-CB 4.09Å; C451-W931 HydrophobicContact CB-CD2 3.95Å; C451-W931 HydrophobicContact CB-CE3 4.26Å; C451-W931 HydrophobicContact CB-CG 3.87Å
452	V	93	Very high	83.3	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-77.3	-32	172.7	175.6	0	0	0	0	111.4	M433 M448 I449 F455 R456 F481 P483 W931	M433-V452 HydrophobicContact CB-CG2 4.35Å; M433-V452 HydrophobicContact SD-CG1 4.05Å; M433-V452 HydrophobicContact SD-CG2 3.87Å; M448-V452 HydrophobicContact CG-CG2 4.44Å; M448-V452 WeakPolarHBondContact O-CG2 3.41Å; M448-V452 PolarHBondContact O-N 2.75Å; I449-V452 CarbonylContact O-C 3.52Å; I449-V452 PolarHBondContact O-N 3.13Å; I449-V452 VanDerWaalsContact O-N 3.1Å; V452-F455 PolarHBondContact O-N 3.46Å; V452-R456 HydrophobicContact CG1-CG 4.44Å; V452-R456 WeakPolarHBondContact O-CG 3.48Å; V452-R456 PolarHBondContact O-N 2.95Å; V452-F481 HydrophobicContact CG1-CB 3.86Å; V452-P483 HydrophobicContact CG2-CB 4.17Å; V452-W931 HydrophobicContact CG2-CE3 4.37Å; V452-W931 HydrophobicContact CG2-CZ3 3.84Å
453	D	91.9	Very high	85.1	Confident	47 Å²	47	44.6 Å²	44.6	25%	0.251	21%	0.214	S	C	.	.	H	α-helix	trans	-65.5	-39.2	172	-79.6	-44.8	0	0	0	112.8	I449 F455 R456 S457	I449-D453 PolarHBondContact O-N 2.64Å; D453-F455 VanDerWaalsContact C-N 3.31Å; D453-F455 PolarHBondContact O-N 2.86Å; D453-R456 VanDerWaalsContact CG-NH1 3.32Å; D453-R456 IonicContact OD1-CZ 3.4Å; D453-R456 IonicContact OD1-NH1 2.64Å; D453-R456 PolarHBondContact OD1-NH1 2.68Å; D453-R456 IonicContact OD2-NH1 2.69Å; D453-S457 VanDerWaalsContact O-CB 3.27Å; D453-S457 WeakPolarHBondContact O-CB 3.33Å; D453-S457 PolarHBondContact O-N 3.46Å; D453-S457 PolarHBondContact O-OG 2.82Å
454	D	90.7	Very high	86.8	Confident	41 Å²	41	45.7 Å²	45.7	22%	0.219	22%	0.216	C	C	.	.	H	α-helix	trans	-56.5	-47.5	167.8	-80.9	7.5	0	0	0	110.5	R446 E450 S457 V458 Q932	R446-D454 IonicContact CZ-OD2 3.82Å; R446-D454 VanDerWaalsContact CZ-OD2 3.25Å; R446-D454 VanDerWaalsContact NH1-CG 3.25Å; R446-D454 IonicContact NH1-OD1 3.45Å; R446-D454 PolarHBondContact NH1-OD1 3.46Å; R446-D454 IonicContact NH1-OD2 3.66Å; R446-D454 PolarHBondContact NH1-OD2 2.91Å; R446-D454 IonicContact NH2-OD2 3.68Å; R446-D454 PolarHBondContact NH2-OD2 3.34Å; E450-D454 PolarHBondContact O-N 2.73Å; E450-D454 VanDerWaalsContact O-N 3.1Å; D454-S457 WeakPolarHBondContact O-CB 3.23Å; D454-S457 PolarHBondContact O-N 2.97Å; D454-V458 WeakPolarHBondContact O-CG2 3.31Å; D454-V458 PolarHBondContact O-N 2.96Å; D454-Q932 HydrophobicContact CB-CG 4.31Å; D454-Q932 WeakPolarHBondContact OD2-CG 3.25Å; D454-Q932 PolarHBondContact OD2-NE2 3.4Å
455	F	93.8	Very high	88.4	Confident	1 Å²	1	40 Å²	40	0%	0.004	20%	0.203	C	C	.	.	H	α-helix	trans	-66.2	-42	-178.1	-160.3	-92.4	0	0	0	112.7	M433 C451 V452 D453 V458 S459 F481 T936 A937 L940	M433-F455 HydrophobicContact CE-CD1 4.19Å; M433-F455 HydrophobicContact CE-CE1 4.3Å; M433-F455 HydrophobicContact CE-CG 4.41Å; M433-F455 HydrophobicContact SD-CD1 4.35Å; C451-F455 PolarHBondContact O-N 3.01Å; V452-F455 PolarHBondContact O-N 3.46Å; D453-F455 VanDerWaalsContact C-N 3.31Å; D453-F455 PolarHBondContact O-N 2.86Å; F455-V458 PolarHBondContact O-N 2.73Å; F455-S459 WeakPolarHBondContact O-CB 3.37Å; F455-S459 PolarHBondContact O-N 3.12Å; F455-F481 AromaticContact CD1-CD1 3.96Å; F455-F481 HydrophobicContact CD1-CD1 3.96Å; F455-F481 AromaticContact CD1-CE1 3.88Å; F455-F481 HydrophobicContact CD1-CE1 3.88Å; F455-F481 HydrophobicContact CD1-CE2 4.49Å; F455-F481 HydrophobicContact CD1-CG 4.33Å; F455-F481 HydrophobicContact CD1-CZ 4.15Å; F455-F481 HydrophobicContact CE1-CD1 4.03Å; F455-F481 AromaticContact CE1-CE1 3.53Å; F455-F481 HydrophobicContact CE1-CE1 3.53Å; F455-F481 AromaticContact CE1-CZ 3.86Å; F455-F481 HydrophobicContact CE1-CZ 3.86Å; F455-T936 HydrophobicContact CE2-CG2 4.27Å; F455-T936 HydrophobicContact CZ-CG2 4.49Å; F455-A937 HydrophobicContact CE1-CB 4.25Å; F455-A937 HydrophobicContact CE2-CB 3.93Å; F455-A937 HydrophobicContact CZ-CB 3.76Å; F455-L940 HydrophobicContact CE1-CD2 4.2Å; F455-L940 HydrophobicContact CZ-CD2 4.04Å
456	R	94.7	Very high	89.8	Confident	5 Å²	5	32.6 Å²	32.6	2%	0.019	17%	0.171	C	C	.	.	H	α-helix	trans	-56.4	-49.4	169.7	-71.1	176.3	-172.1	119.1	2.3	110.4	R302 V452 D453 V458 S459 L460 E480 F481	R302-R456 VanDerWaalsContact CD-CZ 3.4Å; V452-R456 HydrophobicContact CG1-CG 4.44Å; V452-R456 WeakPolarHBondContact O-CG 3.48Å; V452-R456 PolarHBondContact O-N 2.95Å; D453-R456 VanDerWaalsContact CG-NH1 3.32Å; D453-R456 IonicContact OD1-CZ 3.4Å; D453-R456 IonicContact OD1-NH1 2.64Å; D453-R456 PolarHBondContact OD1-NH1 2.68Å; D453-R456 IonicContact OD2-NH1 2.69Å; R456-V458 VanDerWaalsContact C-N 3.34Å; R456-V458 PolarHBondContact O-N 3.3Å; R456-S459 WeakPolarHBondContact O-CB 3.31Å; R456-S459 PolarHBondContact O-N 3.3Å; R456-L460 WeakPolarHBondContact O-CD1 3.37Å; R456-L460 VanDerWaalsContact O-CG 3.31Å; R456-L460 WeakPolarHBondContact O-CG 3.32Å; R456-L460 PolarHBondContact O-N 3.49Å; R456-E480 IonicContact CZ-OE1 2.69Å; R456-E480 IonicContact NE-OE1 3.98Å; R456-E480 PolarHBondContact NE-OE1 3.35Å; R456-E480 VanDerWaalsContact NE-OE1 3.07Å; R456-E480 IonicContact NH2-OE1 3.12Å; R456-F481 HydrophobicContact CG-CB 4.24Å; R456-F481 HydrophobicContact CG-CD2 4.17Å; R456-F481 VanDerWaalsContact CZ-O 3.25Å; R456-F481 PolarHBondContact NE-O 2.74Å; R456-F481 VanDerWaalsContact NE-O 3.12Å; R456-F481 PolarHBondContact NH2-O 2.73Å
457	S	92.3	Very high	90.7	Very high	53 Å²	53	31 Å²	31	37%	0.371	17%	0.165	S	C	.	.	H	α-helix	trans	-61.7	-38.6	-178.9	-61.7	0	0	0	0	112.9	D453 D454 K461	D453-S457 VanDerWaalsContact O-CB 3.27Å; D453-S457 WeakPolarHBondContact O-CB 3.33Å; D453-S457 PolarHBondContact O-N 3.46Å; D453-S457 PolarHBondContact O-OG 2.82Å; D454-S457 WeakPolarHBondContact O-CB 3.23Å; D454-S457 PolarHBondContact O-N 2.97Å; S457-K461 VanDerWaalsContact O-CD 3.27Å; S457-K461 WeakPolarHBondContact O-CD 3.42Å; S457-K461 VanDerWaalsContact O-CG 3.23Å; S457-K461 WeakPolarHBondContact O-CG 3.24Å; S457-K461 PolarHBondContact O-N 3.34Å
458	V	93.2	Very high	91.1	Very high	24 Å²	24	33.7 Å²	33.7	15%	0.145	17%	0.171	C	C	.	.	H	α-helix	trans	-69.6	-45.1	173.7	169.4	0	0	0	0	110.6	D454 F455 R456 L460 K461 L462 E934 A937	D454-V458 WeakPolarHBondContact O-CG2 3.31Å; D454-V458 PolarHBondContact O-N 2.96Å; F455-V458 PolarHBondContact O-N 2.73Å; R456-V458 VanDerWaalsContact C-N 3.34Å; R456-V458 PolarHBondContact O-N 3.3Å; V458-L460 PolarHBondContact O-N 2.98Å; V458-K461 PolarHBondContact O-N 3.45Å; V458-L462 HydrophobicContact CG1-CD1 3.76Å; V458-L462 HydrophobicContact CG1-CG 4.45Å; V458-L462 VanDerWaalsContact O-CG 3.31Å; V458-L462 WeakPolarHBondContact O-CG 3.32Å; V458-L462 PolarHBondContact O-N 2.84Å; V458-E934 HydrophobicContact CG1-CB 4.16Å; V458-E934 HydrophobicContact CG1-CG 3.96Å; V458-A937 HydrophobicContact CG1-CB 3.78Å
459	S	94.8	Very high	91.3	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.014	19%	0.192	C	C	.	.	H	α-helix	trans	-57.4	-46.1	178.3	-178.5	0	0	0	0	112.8	F455 R456 L462 L463 L941	F455-S459 WeakPolarHBondContact O-CB 3.37Å; F455-S459 PolarHBondContact O-N 3.12Å; R456-S459 WeakPolarHBondContact O-CB 3.31Å; R456-S459 PolarHBondContact O-N 3.3Å; S459-L462 WeakPolarHBondContact O-CB 3.03Å; S459-L462 PolarHBondContact O-N 2.97Å; S459-L463 PolarHBondContact O-N 3.37Å; S459-L941 WeakPolarHBondContact OG-CD2 3.44Å
460	L	92.5	Very high	91.4	Very high	30 Å²	30	38.7 Å²	38.7	16%	0.157	19%	0.194	C	C	.	.	H	α-helix	trans	-63.5	-44.4	176.9	-67	159.8	0	0	0	111.9	E423 R456 V458 L462 L463 H464 R478	E423-L460 HydrophobicContact CG-CD1 3.51Å; E423-L460 HydrophobicContact CG-CD2 4.04Å; E423-L460 HydrophobicContact CG-CG 4.44Å; R456-L460 WeakPolarHBondContact O-CD1 3.37Å; R456-L460 VanDerWaalsContact O-CG 3.31Å; R456-L460 WeakPolarHBondContact O-CG 3.32Å; R456-L460 PolarHBondContact O-N 3.49Å; V458-L460 PolarHBondContact O-N 2.98Å; L460-L462 PolarHBondContact O-N 3.07Å; L460-L463 WeakPolarHBondContact O-CB 3.49Å; L460-L463 PolarHBondContact O-N 2.72Å; L460-L463 VanDerWaalsContact O-N 3.14Å; L460-H464 PolarHBondContact O-CD2 2.79Å; L460-H464 PolarHBondContact O-N 3.39Å; L460-R478 HydrophobicContact CD2-CB 4.05Å
461	K	91.7	Very high	91.5	Very high	148 Å²	148	36.9 Å²	36.9	64%	0.643	19%	0.186	S	C	*	.	H	α-helix	trans	-60.9	-33.7	175.3	-70.9	166.3	-171.6	172	0	112.1	S457 V458 S465	S457-K461 VanDerWaalsContact O-CD 3.27Å; S457-K461 WeakPolarHBondContact O-CD 3.42Å; S457-K461 VanDerWaalsContact O-CG 3.23Å; S457-K461 WeakPolarHBondContact O-CG 3.24Å; S457-K461 PolarHBondContact O-N 3.34Å; V458-K461 PolarHBondContact O-N 3.45Å; K461-S465 WeakPolarHBondContact O-CB 3.34Å; K461-S465 PolarHBondContact O-N 2.86Å; K461-S465 PolarHBondContact O-OG 3.14Å
462	L	92.3	Very high	91.6	Very high	5 Å²	5	41 Å²	41	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-74.3	-35.7	174.7	-69.9	166	0	0	0	112.5	V458 S459 L460 S465 H466 Y808 E934 A937 L938 L941	V458-L462 HydrophobicContact CG1-CD1 3.76Å; V458-L462 HydrophobicContact CG1-CG 4.45Å; V458-L462 VanDerWaalsContact O-CG 3.31Å; V458-L462 WeakPolarHBondContact O-CG 3.32Å; V458-L462 PolarHBondContact O-N 2.84Å; S459-L462 WeakPolarHBondContact O-CB 3.03Å; S459-L462 PolarHBondContact O-N 2.97Å; L460-L462 PolarHBondContact O-N 3.07Å; L462-S465 WeakPolarHBondContact CA-OG 3.43Å; L462-S465 PolarHBondContact O-N 2.68Å; L462-S465 PolarHBondContact O-OG 3.26Å; L462-H466 WeakPolarHBondContact O-CB 3.15Å; L462-H466 PolarHBondContact O-N 3.25Å; L462-Y808 HydrophobicContact CD2-CD2 4.13Å; L462-Y808 HydrophobicContact CD2-CG 4.45Å; L462-E934 HydrophobicContact CD1-CB 4.35Å; L462-E934 WeakPolarHBondContact CD1-O 3.4Å; L462-E934 HydrophobicContact CD2-CB 4.41Å; L462-A937 HydrophobicContact CD1-CB 3.62Å; L462-L938 HydrophobicContact CD1-CB 4Å; L462-L938 HydrophobicContact CD2-CB 4.32Å; L462-L938 HydrophobicContact CD2-CD1 4.47Å; L462-L941 HydrophobicContact CB-CD1 3.77Å; L462-L941 HydrophobicContact CD1-CD1 4.48Å
463	L	91.8	Very high	91.5	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-58.7	-51.7	171.3	-79.2	171	0	0	0	111.7	S459 L460 S465 F467 K468 I476 R478 L941 Y945	S459-L463 PolarHBondContact O-N 3.37Å; L460-L463 WeakPolarHBondContact O-CB 3.49Å; L460-L463 PolarHBondContact O-N 2.72Å; L460-L463 VanDerWaalsContact O-N 3.14Å; L463-S465 PolarHBondContact O-N 3.22Å; L463-S465 VanDerWaalsContact O-N 3.16Å; L463-F467 HydrophobicContact CD2-CB 4.24Å; L463-F467 HydrophobicContact CD2-CD2 4.02Å; L463-F467 HydrophobicContact CD2-CG 4.27Å; L463-F467 CarbonylContact O-C 3.54Å; L463-F467 WeakPolarHBondContact O-CA 3.27Å; L463-F467 PolarHBondContact O-N 3.39Å; L463-K468 PolarHBondContact O-N 3.14Å; L463-I476 HydrophobicContact CD2-CD1 3.71Å; L463-R478 HydrophobicContact CD1-CB 4.18Å; L463-L941 HydrophobicContact CD2-CD2 4.38Å; L463-L941 HydrophobicContact CG-CD1 4.3Å; L463-L941 HydrophobicContact CG-CD2 4.37Å; L463-Y945 HydrophobicContact CD2-CE2 3.64Å
464	H	89.3	Confident	91.3	Very high	110 Å²	110	52.3 Å²	52.3	51%	0.509	26%	0.259	S	S	.	.	H	α-helix	trans	-64.4	-16.9	179	-72.6	-72.9	0	0	0	114.8	L460 L471	L460-H464 PolarHBondContact O-CD2 2.79Å; L460-H464 PolarHBondContact O-N 3.39Å; H464-L471 WeakPolarHBondContact ND1-CD2 3.4Å
465	S	89.4	Confident	91.3	Very high	55 Å²	55	53.2 Å²	53.2	39%	0.385	27%	0.273	S	S	.	.	H	α-helix	trans	-112.1	-24.8	-176.8	54	0	0	0	0	115.1	K461 L462 L463	K461-S465 WeakPolarHBondContact O-CB 3.34Å; K461-S465 PolarHBondContact O-N 2.86Å; K461-S465 PolarHBondContact O-OG 3.14Å; L462-S465 WeakPolarHBondContact CA-OG 3.43Å; L462-S465 PolarHBondContact O-N 2.68Å; L462-S465 PolarHBondContact O-OG 3.26Å; L463-S465 PolarHBondContact O-N 3.22Å; L463-S465 VanDerWaalsContact O-N 3.16Å
466	H	89.9	Confident	91.2	Very high	9 Å²	9	53.5 Å²	53.5	4%	0.042	27%	0.274	C	S	.	.	H	α-helix	trans	-114.9	-16.5	-179.5	-72.5	-75.6	0	0	0	114.8	L462 Y808 L938 P952 E953	L462-H466 WeakPolarHBondContact O-CB 3.15Å; L462-H466 PolarHBondContact O-N 3.25Å; H466-Y808 PolarHBondContact CE1-O 3.42Å; H466-Y808 PolarHBondContact NE2-O 3.43Å; H466-L938 HydrophobicContact CB-CD1 3.97Å; H466-P952 HydrophobicContact CB-CB 4.16Å; H466-P952 CarbonylContact O-C 3.54Å; H466-P952 WeakPolarHBondContact O-CA 3.28Å; H466-E953 PolarHBondContact O-N 3.25Å
467	F	91.6	Very high	91.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.276	C	S	.	.	S	Bend	trans	-127.8	23.6	179.7	-60	-96.5	0	0	0	111.4	L463 K469 S470 L471 I476 L938 L941 Y945 I950 P952 E953	L463-F467 HydrophobicContact CD2-CB 4.24Å; L463-F467 HydrophobicContact CD2-CD2 4.02Å; L463-F467 HydrophobicContact CD2-CG 4.27Å; L463-F467 CarbonylContact O-C 3.54Å; L463-F467 WeakPolarHBondContact O-CA 3.27Å; L463-F467 PolarHBondContact O-N 3.39Å; F467-K469 VanDerWaalsContact C-N 3.32Å; F467-K469 PolarHBondContact O-N 2.96Å; F467-S470 WeakPolarHBondContact O-CB 3.33Å; F467-S470 PolarHBondContact O-N 3.39Å; F467-L471 PolarHBondContact O-N 3.1Å; F467-I476 HydrophobicContact CB-CD1 3.56Å; F467-I476 HydrophobicContact CD1-CD1 4.39Å; F467-I476 HydrophobicContact CG-CD1 4.17Å; F467-L938 HydrophobicContact CE2-CD1 4.12Å; F467-L941 HydrophobicContact CE2-CB 4.03Å; F467-L941 HydrophobicContact CZ-CB 4.3Å; F467-Y945 HydrophobicContact CE1-CD2 4.13Å; F467-Y945 HydrophobicContact CE1-CG 4.46Å; F467-Y945 HydrophobicContact CZ-CD2 4.22Å; F467-I950 HydrophobicContact CD1-CG2 4.11Å; F467-I950 HydrophobicContact CE1-CG2 4.46Å; F467-P952 HydrophobicContact CD1-CB 4.49Å; F467-P952 HydrophobicContact CE1-CB 4.02Å; F467-P952 HydrophobicContact CE2-CB 4.18Å; F467-P952 HydrophobicContact CZ-CB 3.86Å; F467-P952 HydrophobicContact CZ-CG 4.42Å; F467-E953 VanDerWaalsContact C-OE1 3.28Å
468	K	90.2	Very high	91.2	Very high	98 Å²	98	51.3 Å²	51.3	43%	0.426	26%	0.259	S	S	.	.	H	α-helix	trans	-52	-46.2	-171	177.2	161.2	175.1	49.6	0	112.6	L463 S470 L471 D472 E953	L463-K468 PolarHBondContact O-N 3.14Å; K468-S470 VanDerWaalsContact C-N 3.35Å; K468-S470 PolarHBondContact O-N 3.4Å; K468-L471 PolarHBondContact O-N 2.91Å; K468-D472 VanDerWaalsContact CE-OD2 3.27Å; K468-D472 WeakPolarHBondContact CE-OD2 3.31Å; K468-D472 WeakPolarHBondContact CG-OD2 3.48Å; K468-D472 IonicContact NZ-OD1 3.96Å; K468-D472 PolarHBondContact NZ-OD1 2.74Å; K468-D472 IonicContact NZ-OD2 3.9Å; K468-D472 PolarHBondContact NZ-OD2 2.92Å; K468-D472 WeakPolarHBondContact O-CB 3.2Å; K468-D472 PolarHBondContact O-N 2.89Å; K468-E953 PolarHBondContact N-OE1 3.12Å
469	K	89.8	Confident	91.3	Very high	107 Å²	107	50.4 Å²	50.4	47%	0.465	25%	0.254	S	S	.	.	H	α-helix	trans	-60.9	-44.3	178.1	-171.8	-164.9	177.7	-107	0	111.5	F467 L471 D472 E473 E953	F467-K469 VanDerWaalsContact C-N 3.32Å; F467-K469 PolarHBondContact O-N 2.96Å; K469-L471 VanDerWaalsContact C-N 3.28Å; K469-L471 PolarHBondContact O-N 3.18Å; K469-D472 PolarHBondContact O-N 2.86Å; K469-E473 VanDerWaalsContact CE-CD 3.45Å; K469-E473 WeakPolarHBondContact CE-OE1 3.44Å; K469-E473 WeakPolarHBondContact CE-OE2 3.47Å; K469-E473 HydrophobicContact CG-CG 4.35Å; K469-E473 IonicContact NZ-OE1 3.14Å; K469-E473 PolarHBondContact NZ-OE1 2.79Å; K469-E473 IonicContact NZ-OE2 2.89Å; K469-E473 PolarHBondContact NZ-OE2 3.42Å; K469-E473 VanDerWaalsContact O-CB 3.23Å; K469-E473 WeakPolarHBondContact O-CB 3.41Å; K469-E473 VanDerWaalsContact O-CG 3.29Å; K469-E473 WeakPolarHBondContact O-CG 3.38Å; K469-E473 PolarHBondContact O-N 2.93Å; K469-E953 VanDerWaalsContact CB-OE1 3.32Å; K469-E953 WeakPolarHBondContact CB-OE1 3.5Å; K469-E953 PolarHBondContact N-OE1 3.44Å
470	S	91.1	Very high	91.4	Very high	19 Å²	19	50.5 Å²	50.5	13%	0.133	25%	0.254	C	S	.	.	H	α-helix	trans	-67.1	-32.7	-179.1	-55.2	0	0	0	0	111.8	F467 K468 H474 A475 I476	F467-S470 WeakPolarHBondContact O-CB 3.33Å; F467-S470 PolarHBondContact O-N 3.39Å; K468-S470 VanDerWaalsContact C-N 3.35Å; K468-S470 PolarHBondContact O-N 3.4Å; S470-H474 PolarHBondContact O-N 2.68Å; S470-A475 PolarHBondContact O-N 2.87Å; S470-I476 PolarHBondContact O-N 2.71Å
471	L	89.7	Confident	91.7	Very high	18 Å²	18	49.1 Å²	49.1	9%	0.094	25%	0.247	C	C	.	.	H	α-helix	trans	-75	-46.3	175.6	-172.7	63.4	0	0	0	111.7	L424 H464 F467 K468 K469 E473 H474 I476	L424-L471 HydrophobicContact CD1-CD1 4.31Å; H464-L471 WeakPolarHBondContact ND1-CD2 3.4Å; F467-L471 PolarHBondContact O-N 3.1Å; K468-L471 PolarHBondContact O-N 2.91Å; K469-L471 VanDerWaalsContact C-N 3.28Å; K469-L471 PolarHBondContact O-N 3.18Å; L471-E473 VanDerWaalsContact C-N 3.33Å; L471-E473 PolarHBondContact O-N 2.87Å; L471-H474 WeakPolarHBondContact O-CA 3.49Å; L471-H474 PolarHBondContact O-N 3.01Å; L471-I476 HydrophobicContact CB-CG1 4.32Å; L471-I476 HydrophobicContact CD1-CG1 4.46Å
472	D	89.5	Confident	91.9	Very high	87 Å²	87	42 Å²	42	47%	0.465	22%	0.216	S	C	.	.	H	α-helix	trans	-62.2	-38.3	175	-68.7	-10	0	0	0	111.3	K468 K469 H474	K468-D472 VanDerWaalsContact CE-OD2 3.27Å; K468-D472 WeakPolarHBondContact CE-OD2 3.31Å; K468-D472 WeakPolarHBondContact CG-OD2 3.48Å; K468-D472 IonicContact NZ-OD1 3.96Å; K468-D472 PolarHBondContact NZ-OD1 2.74Å; K468-D472 IonicContact NZ-OD2 3.9Å; K468-D472 PolarHBondContact NZ-OD2 2.92Å; K468-D472 WeakPolarHBondContact O-CB 3.2Å; K468-D472 PolarHBondContact O-N 2.89Å; K469-D472 PolarHBondContact O-N 2.86Å; D472-H474 PolarHBondContact O-N 2.7Å; D472-H474 PolarHBondContact O-ND1 3.23Å
473	E	91.6	Very high	92.1	Very high	116 Å²	116	41.9 Å²	41.9	54%	0.542	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-0.3	173	-70.2	179.9	157.4	0	0	113.4	K469 L471 A475	K469-E473 VanDerWaalsContact CE-CD 3.45Å; K469-E473 WeakPolarHBondContact CE-OE1 3.44Å; K469-E473 WeakPolarHBondContact CE-OE2 3.47Å; K469-E473 HydrophobicContact CG-CG 4.35Å; K469-E473 IonicContact NZ-OE1 3.14Å; K469-E473 PolarHBondContact NZ-OE1 2.79Å; K469-E473 IonicContact NZ-OE2 2.89Å; K469-E473 PolarHBondContact NZ-OE2 3.42Å; K469-E473 VanDerWaalsContact O-CB 3.23Å; K469-E473 WeakPolarHBondContact O-CB 3.41Å; K469-E473 VanDerWaalsContact O-CG 3.29Å; K469-E473 WeakPolarHBondContact O-CG 3.38Å; K469-E473 PolarHBondContact O-N 2.93Å; L471-E473 VanDerWaalsContact C-N 3.33Å; L471-E473 PolarHBondContact O-N 2.87Å; E473-A475 PolarHBondContact O-N 2.9Å
474	H	88.7	Confident	92.2	Very high	168 Å²	168	41.8 Å²	41.8	78%	0.778	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.1	28.3	-178.7	-60.4	52.8	0	0	0	113.9	S470 L471 D472	S470-H474 PolarHBondContact O-N 2.68Å; L471-H474 WeakPolarHBondContact O-CA 3.49Å; L471-H474 PolarHBondContact O-N 3.01Å; D472-H474 PolarHBondContact O-N 2.7Å; D472-H474 PolarHBondContact O-ND1 3.23Å
475	A	89.9	Confident	92	Very high	60 Å²	60	39.1 Å²	39.1	50%	0.496	20%	0.203	S	C	.	.	S	Bend	trans	-84	-17.5	175.1	0	0	0	0	0	112.9	S470 E473 I950	S470-A475 PolarHBondContact O-N 2.87Å; E473-A475 PolarHBondContact O-N 2.9Å; A475-I950 HydrophobicContact CB-CD1 4.42Å
476	I	92.3	Very high	91.8	Very high	8 Å²	8	36.6 Å²	36.6	4%	0.041	19%	0.185	C	C	.	.			trans	-138.6	166.4	168.9	66.2	175.8	0	0	0	109.5	L463 F467 S470 L471 Y945 I950	L463-I476 HydrophobicContact CD2-CD1 3.71Å; F467-I476 HydrophobicContact CB-CD1 3.56Å; F467-I476 HydrophobicContact CD1-CD1 4.39Å; F467-I476 HydrophobicContact CG-CD1 4.17Å; S470-I476 PolarHBondContact O-N 2.71Å; L471-I476 HydrophobicContact CB-CG1 4.32Å; L471-I476 HydrophobicContact CD1-CG1 4.46Å; I476-Y945 HydrophobicContact CB-CD1 4.5Å; I476-Y945 HydrophobicContact CB-CE1 3.83Å; I476-Y945 HydrophobicContact CD1-CE1 4.39Å; I476-Y945 HydrophobicContact CD1-CE2 4.37Å; I476-Y945 HydrophobicContact CG2-CD1 3.68Å; I476-Y945 HydrophobicContact CG2-CE1 3.47Å; I476-Y945 VanDerWaalsContact CG2-CE1 3.47Å; I476-I950 HydrophobicContact CG2-CD1 3.47Å; I476-I950 VanDerWaalsContact CG2-CD1 3.47Å; I476-I950 HydrophobicContact CG2-CG2 4.4Å
477	S	91.9	Very high	91.2	Very high	9 Å²	9	36.6 Å²	36.6	6%	0.063	18%	0.184	C	C	.	.			trans	-130.3	-75.2	178.6	179.5	0	0	0	0	111.1	L424 T426 D428	L424-S477 VanDerWaalsContact CB-OG 3.32Å; L424-S477 WeakPolarHBondContact CB-OG 3.27Å; T426-S477 WeakPolarHBondContact O-CB 3.38Å; T426-S477 PolarHBondContact O-OG 2.92Å; T426-S477 WeakPolarHBondContact OG1-CB 3.43Å; T426-S477 PolarHBondContact OG1-OG 3.49Å; D428-S477 VanDerWaalsContact CG-N 3.34Å; D428-S477 WeakPolarHBondContact OD1-CB 3.21Å; D428-S477 PolarHBondContact OD1-N 3.31Å; D428-S477 WeakPolarHBondContact OD2-CA 3.27Å; D428-S477 PolarHBondContact OD2-N 3.33Å
478	R	93.8	Very high	90.3	Very high	3 Å²	3	41.1 Å²	41.1	1%	0.011	21%	0.212	C	C	.	.			trans	-164.7	158.1	178.3	70.9	-171.1	-172	84.9	9.3	112.6	G300 E423 L424 T426 D428 L460 L463 E480	G300-R478 PolarHBondContact O-NH2 3.37Å; E423-R478 IonicContact OE2-CZ 2.64Å; E423-R478 IonicContact OE2-NE 3.4Å; E423-R478 PolarHBondContact OE2-NE 3.16Å; E423-R478 IonicContact OE2-NH1 2.7Å; E423-R478 PolarHBondContact OE2-NH1 3.2Å; L424-R478 WeakPolarHBondContact O-CD 3.48Å; L424-R478 PolarHBondContact O-NE 3.14Å; T426-R478 WeakPolarHBondContact O-CG 3.46Å; D428-R478 PolarHBondContact N-O 2.85Å; D428-R478 PolarHBondContact OD2-N 2.98Å; L460-R478 HydrophobicContact CD2-CB 4.05Å; L463-R478 HydrophobicContact CD1-CB 4.18Å; R478-E480 IonicContact CZ-OE2 3.29Å; R478-E480 VanDerWaalsContact CZ-OE2 3.28Å; R478-E480 VanDerWaalsContact NH1-CD 3.35Å; R478-E480 IonicContact NH1-OE1 2.73Å; R478-E480 IonicContact NH1-OE2 3.85Å; R478-E480 PolarHBondContact NH1-OE2 2.7Å; R478-E480 IonicContact NH2-OE2 3.72Å; R478-E480 PolarHBondContact NH2-OE2 2.69Å
479	V	96.4	Very high	89.3	Confident	5 Å²	5	38.9 Å²	38.9	3%	0.03	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	129.5	164.7	-178	0	0	0	0	108.7	H429 V431 F481 L941 I944 Y945	H429-V479 HydrophobicContact CB-CG1 4.27Å; H429-V479 HydrophobicContact CB-CG2 4.18Å; H429-V479 WeakPolarHBondContact O-CA 3.33Å; V431-V479 HydrophobicContact CG2-CG1 3.64Å; V479-F481 HydrophobicContact CB-CE2 3.75Å; V479-F481 HydrophobicContact CB-CZ 3.93Å; V479-F481 HydrophobicContact CG1-CD2 4.27Å; V479-F481 HydrophobicContact CG1-CE1 4.06Å; V479-F481 HydrophobicContact CG1-CE2 3.62Å; V479-F481 HydrophobicContact CG1-CZ 3.5Å; V479-F481 VanDerWaalsContact CG1-CZ 3.5Å; V479-F481 WeakPolarHBondContact O-CD2 3.21Å; V479-F481 WeakPolarHBondContact O-CE2 3.38Å; V479-L941 HydrophobicContact CB-CD2 4.36Å; V479-L941 HydrophobicContact CG2-CD2 3.73Å; V479-I944 HydrophobicContact CG1-CD1 3.99Å; V479-I944 HydrophobicContact CG2-CD1 4.3Å; V479-I944 HydrophobicContact CG2-CG2 4.07Å; V479-Y945 HydrophobicContact CG2-CE2 3.96Å
480	E	97.1	Very high	88.2	Confident	3 Å²	3	34 Å²	34	1%	0.014	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	140.6	170.7	-178.3	59.1	-92.4	0	0	110.3	R302 V427 H429 L430 V431 R456 R478 L482 F550	R302-E480 IonicContact CZ-OE2 2.66Å; R302-E480 IonicContact NH1-OE1 3.89Å; R302-E480 PolarHBondContact NH1-OE1 2.85Å; R302-E480 IonicContact NH1-OE2 2.66Å; R302-E480 PolarHBondContact NH1-OE2 2.62Å; V427-E480 HydrophobicContact CG1-CB 3.65Å; V427-E480 HydrophobicContact CG2-CB 4.14Å; H429-E480 PolarHBondContact O-N 3.4Å; L430-E480 CarbonylContact C-O 3.19Å; L430-E480 HydrophobicContact CD1-CB 4.06Å; L430-E480 HydrophobicContact CD1-CG 4.05Å; V431-E480 PolarHBondContact N-O 2.84Å; R456-E480 IonicContact CZ-OE1 2.69Å; R456-E480 IonicContact NE-OE1 3.98Å; R456-E480 PolarHBondContact NE-OE1 3.35Å; R456-E480 VanDerWaalsContact NE-OE1 3.07Å; R456-E480 IonicContact NH2-OE1 3.12Å; R478-E480 IonicContact CZ-OE2 3.29Å; R478-E480 VanDerWaalsContact CZ-OE2 3.28Å; R478-E480 VanDerWaalsContact NH1-CD 3.35Å; R478-E480 IonicContact NH1-OE1 2.73Å; R478-E480 IonicContact NH1-OE2 3.85Å; R478-E480 PolarHBondContact NH1-OE2 2.7Å; R478-E480 IonicContact NH2-OE2 3.72Å; R478-E480 PolarHBondContact NH2-OE2 2.69Å; E480-L482 HydrophobicContact CG-CD2 4.09Å; E480-L482 HydrophobicContact CG-CG 4.27Å; E480-F550 HydrophobicContact CB-CE2 4.45Å; E480-F550 HydrophobicContact CG-CE2 4.3Å
481	F	97.5	Very high	87	Confident	1 Å²	1	34 Å²	34	0%	0.004	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	120.3	179.5	-61.3	-94.1	0	0	0	107.9	V431 M433 V452 F455 R456 V479 L940	V431-F481 HydrophobicContact CB-CD1 3.64Å; V431-F481 HydrophobicContact CB-CE1 3.96Å; V431-F481 HydrophobicContact CB-CG 4.42Å; V431-F481 HydrophobicContact CG1-CD1 4Å; V431-F481 HydrophobicContact CG1-CE1 4.27Å; V431-F481 HydrophobicContact CG2-CD1 4.02Å; V431-F481 HydrophobicContact CG2-CE1 3.82Å; V431-F481 CarbonylContact O-C 3.55Å; V431-F481 WeakPolarHBondContact O-CA 3.37Å; M433-F481 HydrophobicContact CG-CB 4.35Å; M433-F481 HydrophobicContact CG-CD1 4.28Å; M433-F481 HydrophobicContact SD-CB 3.91Å; M433-F481 HydrophobicContact SD-CD1 3.76Å; M433-F481 HydrophobicContact SD-CG 4.21Å; V452-F481 HydrophobicContact CG1-CB 3.86Å; F455-F481 AromaticContact CD1-CD1 3.96Å; F455-F481 HydrophobicContact CD1-CD1 3.96Å; F455-F481 AromaticContact CD1-CE1 3.88Å; F455-F481 HydrophobicContact CD1-CE1 3.88Å; F455-F481 HydrophobicContact CD1-CE2 4.49Å; F455-F481 HydrophobicContact CD1-CG 4.33Å; F455-F481 HydrophobicContact CD1-CZ 4.15Å; F455-F481 HydrophobicContact CE1-CD1 4.03Å; F455-F481 AromaticContact CE1-CE1 3.53Å; F455-F481 HydrophobicContact CE1-CE1 3.53Å; F455-F481 AromaticContact CE1-CZ 3.86Å; F455-F481 HydrophobicContact CE1-CZ 3.86Å; R456-F481 HydrophobicContact CG-CB 4.24Å; R456-F481 HydrophobicContact CG-CD2 4.17Å; R456-F481 VanDerWaalsContact CZ-O 3.25Å; R456-F481 PolarHBondContact NE-O 2.74Å; R456-F481 VanDerWaalsContact NE-O 3.12Å; R456-F481 PolarHBondContact NH2-O 2.73Å; V479-F481 HydrophobicContact CB-CE2 3.75Å; V479-F481 HydrophobicContact CB-CZ 3.93Å; V479-F481 HydrophobicContact CG1-CD2 4.27Å; V479-F481 HydrophobicContact CG1-CE1 4.06Å; V479-F481 HydrophobicContact CG1-CE2 3.62Å; V479-F481 HydrophobicContact CG1-CZ 3.5Å; V479-F481 VanDerWaalsContact CG1-CZ 3.5Å; V479-F481 WeakPolarHBondContact O-CD2 3.21Å; V479-F481 WeakPolarHBondContact O-CE2 3.38Å; F481-L940 HydrophobicContact CE1-CD2 4.46Å
482	L	97.3	Very high	85.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	126.4	179.1	-66.1	-176.5	0	0	0	110.8	Y316 L430 V431 F432 M433 E480 F550	Y316-L482 HydrophobicContact CD1-CD1 3.83Å; Y316-L482 HydrophobicContact CD1-CD2 4.27Å; Y316-L482 HydrophobicContact CD2-CD2 3.77Å; Y316-L482 HydrophobicContact CE1-CD1 3.92Å; Y316-L482 HydrophobicContact CE2-CD2 4.11Å; Y316-L482 HydrophobicContact CG-CD1 4.26Å; Y316-L482 HydrophobicContact CG-CD2 3.85Å; L430-L482 HydrophobicContact CD1-CD1 3.93Å; L430-L482 HydrophobicContact CD1-CG 3.96Å; V431-L482 PolarHBondContact O-N 3Å; F432-L482 HydrophobicContact CD1-CB 4.13Å; F432-L482 HydrophobicContact CE1-CB 4.36Å; F432-L482 HydrophobicContact CE1-CD1 4.01Å; M433-L482 PolarHBondContact N-O 2.9Å; E480-L482 HydrophobicContact CG-CD2 4.09Å; E480-L482 HydrophobicContact CG-CG 4.27Å; L482-F550 HydrophobicContact CD1-CB 4.5Å; L482-F550 HydrophobicContact CD1-CD2 4.27Å
483	P	95	Very high	84.3	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.013	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	129.4	174.6	29.6	-33.5	0	0	0	110.8	W317 M448 I449 V452	W317-P483 HydrophobicContact CE3-CG 3.87Å; W317-P483 HydrophobicContact CZ3-CG 4.14Å; M448-P483 HydrophobicContact CE-CB 3.89Å; M448-P483 HydrophobicContact CG-CB 3.97Å; M448-P483 HydrophobicContact SD-CB 3.69Å; I449-P483 HydrophobicContact CG1-CG 4.22Å; V452-P483 HydrophobicContact CG2-CB 4.17Å
484	V	93.4	Very high	82.6	Confident	0 Å²	0	37 Å²	37	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	98.8	172.2	-179	0	0	0	0	107.7	F432 M433 V434 H435 V539 E542 I543 L546	F432-V484 HydrophobicContact CB-CG2 3.88Å; F432-V484 HydrophobicContact CD1-CG2 4.37Å; M433-V484 WeakPolarHBondContact O-CB 3.5Å; M433-V484 WeakPolarHBondContact O-CG2 3.38Å; M433-V484 PolarHBondContact O-N 3.41Å; V434-V484 HydrophobicContact CG2-CB 3.89Å; V434-V484 HydrophobicContact CG2-CG1 4.12Å; V434-V484 HydrophobicContact CG2-CG2 3.97Å; H435-V484 PolarHBondContact CD2-O 2.89Å; V484-V539 HydrophobicContact CG1-CG1 4.36Å; V484-E542 HydrophobicContact CG1-CB 4.12Å; V484-E542 HydrophobicContact CG1-CG 3.75Å; V484-I543 HydrophobicContact CB-CG1 4.44Å; V484-I543 HydrophobicContact CG1-CD1 4.5Å; V484-I543 HydrophobicContact CG1-CG1 3.85Å; V484-I543 HydrophobicContact CG2-CG1 3.69Å; V484-L546 HydrophobicContact CB-CD1 4.49Å; V484-L546 HydrophobicContact CG2-CD1 3.99Å
485	Q	86.8	Confident	81.6	Confident	54 Å²	54	31.1 Å²	31.1	25%	0.252	21%	0.206	S	C	.	.			trans	-87.9	123.9	178.9	-66.5	-174.8	-16.5	0	0	110.5	M448 I449	M448-Q485 HydrophobicContact SD-CG 4.21Å; I449-Q485 VanDerWaalsContact CD1-NE2 3.27Å
486	W	85.1	Confident	80.7	Confident	2 Å²	2	28.6 Å²	28.6	1%	0.008	19%	0.186	C	C	.	.			trans	-131.3	-27.8	180	65.5	-93.3	0	0	0	114	H435 G436 T488 A489 L490 D522 I535 T538 V539 I572	H435-W486 AromaticContact CD2-CD1 3.72Å; H435-W486 AromaticContact CD2-NE1 3.69Å; H435-W486 AromaticContact NE2-CD1 3.6Å; H435-W486 AromaticContact NE2-NE1 3.67Å; H435-W486 PolarHBondContact O-NE1 2.8Å; G436-W486 VanDerWaalsContact O-CZ2 3.31Å; G436-W486 WeakPolarHBondContact O-CZ2 3.32Å; W486-T488 VanDerWaalsContact C-N 3.26Å; W486-T488 PolarHBondContact O-N 2.91Å; W486-A489 WeakPolarHBondContact O-CB 3.44Å; W486-A489 PolarHBondContact O-N 3.4Å; W486-L490 HydrophobicContact CZ3-CD2 4.04Å; W486-D522 HydrophobicContact CH2-CB 4.36Å; W486-I535 HydrophobicContact CD2-CG2 4.3Å; W486-I535 HydrophobicContact CE3-CB 4.48Å; W486-I535 HydrophobicContact CE3-CG1 4.12Å; W486-I535 HydrophobicContact CE3-CG2 3.91Å; W486-I535 HydrophobicContact CH2-CD1 4.4Å; W486-I535 HydrophobicContact CH2-CG1 4.47Å; W486-I535 HydrophobicContact CH2-CG2 4.17Å; W486-I535 HydrophobicContact CZ2-CG2 4.5Å; W486-I535 HydrophobicContact CZ3-CB 4.4Å; W486-I535 HydrophobicContact CZ3-CD1 4.03Å; W486-I535 HydrophobicContact CZ3-CG1 3.71Å; W486-I535 HydrophobicContact CZ3-CG2 3.88Å; W486-T538 HydrophobicContact CB-CG2 3.7Å; W486-V539 HydrophobicContact CB-CG2 3.53Å; W486-V539 HydrophobicContact CD2-CG2 4.08Å; W486-V539 HydrophobicContact CG-CG2 3.4Å; W486-I572 HydrophobicContact CH2-CD1 4.35Å; W486-I572 HydrophobicContact CZ2-CD1 3.71Å
487	H	77	Confident	79.9	Confident	8 Å²	8	28.4 Å²	28.4	4%	0.037	19%	0.185	C	C	.	.	H	α-helix	trans	-54.4	-39.8	-177.2	174.5	97.2	0	0	0	112.7	P439 A489 L490 H491 D522	P439-H487 WeakPolarHBondContact CD-NE2 3.26Å; H487-A489 VanDerWaalsContact C-N 3.25Å; H487-A489 PolarHBondContact O-N 2.76Å; H487-L490 PolarHBondContact O-N 3.35Å; H487-H491 AromaticContact CD2-CD2 3.9Å; H487-H491 AromaticContact CD2-CG 3.95Å; H487-H491 AromaticContact CE1-CD2 3.14Å; H487-H491 PolarHBondContact CE1-CD2 3.37Å; H487-H491 AromaticContact CE1-CE1 3.52Å; H487-H491 AromaticContact CE1-CG 3.39Å; H487-H491 AromaticContact CE1-ND1 3.62Å; H487-H491 AromaticContact CE1-NE2 3.28Å; H487-H491 PolarHBondContact CE1-NE2 3.26Å; H487-H491 VanDerWaalsContact CE1-NE2 3.28Å; H487-H491 AromaticContact CG-CD2 3.79Å; H487-H491 AromaticContact ND1-CD2 3.34Å; H487-H491 PolarHBondContact ND1-CD2 2.85Å; H487-H491 VanDerWaalsContact ND1-CD2 3.34Å; H487-H491 AromaticContact ND1-CG 4Å; H487-H491 AromaticContact ND1-NE2 3.57Å; H487-H491 AromaticContact NE2-CD2 3.52Å; H487-H491 AromaticContact NE2-CG 3.35Å; H487-H491 AromaticContact NE2-ND1 3.78Å; H487-H491 PolarHBondContact O-CD2 2.84Å; H487-H491 PolarHBondContact O-N 2.71Å; H487-D522 IonicContact CE1-OD1 2.75Å; H487-D522 IonicContact CE1-OD2 3.16Å; H487-D522 IonicContact CG-OD2 3.49Å; H487-D522 IonicContact ND1-OD1 3.01Å; H487-D522 IonicContact ND1-OD2 2.8Å; H487-D522 PolarHBondContact ND1-OD2 3.43Å
488	T	72.5	Confident	79.1	Confident	96 Å²	96	30.2 Å²	30.2	59%	0.589	19%	0.194	S	C	*	.	H	α-helix	trans	-58.2	-31.7	177.9	-43.7	0	0	0	0	113.6	W486 L490 G492	W486-T488 VanDerWaalsContact C-N 3.26Å; W486-T488 PolarHBondContact O-N 2.91Å; T488-L490 VanDerWaalsContact C-N 3.3Å; T488-L490 PolarHBondContact O-N 3.49Å; T488-G492 WeakPolarHBondContact O-CA 3.28Å; T488-G492 PolarHBondContact O-N 2.7Å
489	A	69.2	Low	78.3	Confident	51 Å²	51	38 Å²	38	42%	0.421	22%	0.223	S	C	.	.	H	α-helix	trans	-71.3	-26.3	177.9	0	0	0	0	0	112.9	W486 H487 T495 T538	W486-A489 WeakPolarHBondContact O-CB 3.44Å; W486-A489 PolarHBondContact O-N 3.4Å; H487-A489 VanDerWaalsContact C-N 3.25Å; H487-A489 PolarHBondContact O-N 2.76Å; A489-T495 WeakPolarHBondContact O-CG2 3.19Å; A489-T538 HydrophobicContact CB-CG2 3.71Å
490	L	66.1	Low	77.5	Confident	4 Å²	4	43.9 Å²	43.9	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-89	-41.5	178.2	-179.8	64.8	0	0	0	111.8	W486 H487 T488 T495 F525 Y531 I535	W486-L490 HydrophobicContact CZ3-CD2 4.04Å; H487-L490 PolarHBondContact O-N 3.35Å; T488-L490 VanDerWaalsContact C-N 3.3Å; T488-L490 PolarHBondContact O-N 3.49Å; L490-T495 WeakPolarHBondContact O-CB 3.37Å; L490-T495 WeakPolarHBondContact O-CG2 3.35Å; L490-T495 PolarHBondContact O-OG1 3.13Å; L490-F525 HydrophobicContact CD2-CB 4Å; L490-F525 HydrophobicContact CD2-CD2 3.53Å; L490-F525 HydrophobicContact CD2-CE2 4.19Å; L490-F525 HydrophobicContact CD2-CG 3.99Å; L490-F525 HydrophobicContact CG-CD2 4.25Å; L490-F525 HydrophobicContact CG-CE2 4.49Å; L490-Y531 HydrophobicContact CD1-CD1 3.56Å; L490-Y531 HydrophobicContact CD1-CE1 4.34Å; L490-Y531 HydrophobicContact CD1-CG 4.15Å; L490-I535 HydrophobicContact CD2-CD1 3.88Å; L490-I535 HydrophobicContact CD2-CG1 3.93Å
491	H	65.5	Low	76.7	Confident	20 Å²	20	44.8 Å²	44.8	9%	0.093	25%	0.249	C	C	.	.	H	α-helix	trans	-93.6	-16.2	-172.8	-74.5	-98.4	0	0	0	114.7	H487 D498 D522 F525	H487-H491 AromaticContact CD2-CD2 3.9Å; H487-H491 AromaticContact CD2-CG 3.95Å; H487-H491 AromaticContact CE1-CD2 3.14Å; H487-H491 PolarHBondContact CE1-CD2 3.37Å; H487-H491 AromaticContact CE1-CE1 3.52Å; H487-H491 AromaticContact CE1-CG 3.39Å; H487-H491 AromaticContact CE1-ND1 3.62Å; H487-H491 AromaticContact CE1-NE2 3.28Å; H487-H491 PolarHBondContact CE1-NE2 3.26Å; H487-H491 VanDerWaalsContact CE1-NE2 3.28Å; H487-H491 AromaticContact CG-CD2 3.79Å; H487-H491 AromaticContact ND1-CD2 3.34Å; H487-H491 PolarHBondContact ND1-CD2 2.85Å; H487-H491 VanDerWaalsContact ND1-CD2 3.34Å; H487-H491 AromaticContact ND1-CG 4Å; H487-H491 AromaticContact ND1-NE2 3.57Å; H487-H491 AromaticContact NE2-CD2 3.52Å; H487-H491 AromaticContact NE2-CG 3.35Å; H487-H491 AromaticContact NE2-ND1 3.78Å; H487-H491 PolarHBondContact O-CD2 2.84Å; H487-H491 PolarHBondContact O-N 2.71Å; H491-D498 IonicContact CE1-OD1 3.65Å; H491-D498 IonicContact CE1-OD2 3.4Å; H491-D498 IonicContact CG-OD1 3.23Å; H491-D498 IonicContact CG-OD2 3.76Å; H491-D498 VanDerWaalsContact ND1-CG 3.29Å; H491-D498 IonicContact ND1-OD1 3.83Å; H491-D498 PolarHBondContact ND1-OD1 3.24Å; H491-D498 VanDerWaalsContact ND1-OD1 3.07Å; H491-D498 IonicContact ND1-OD2 3.55Å; H491-D498 PolarHBondContact ND1-OD2 2.78Å; H491-D522 IonicContact CE1-OD1 3.72Å; H491-D522 IonicContact NE2-OD1 3.92Å; H491-F525 AromaticContact CE1-CE2 3.64Å; H491-F525 AromaticContact NE2-CD2 3.9Å; H491-F525 AromaticContact NE2-CE2 3.56Å
492	G	63.8	Low	75.9	Confident	25 Å²	25	53 Å²	53	26%	0.258	29%	0.285	S	S	.	.	S	Bend	trans	-58.9	152.5	177.2	0	0	0	0	0	113.6	T488 A494 T495	T488-G492 WeakPolarHBondContact O-CA 3.28Å; T488-G492 PolarHBondContact O-N 2.7Å; G492-A494 PolarHBondContact O-N 3.06Å; G492-T495 PolarHBondContact O-N 3.27Å; G492-T495 VanDerWaalsContact O-N 3.07Å; G492-T495 PolarHBondContact O-OG1 3.26Å
493	D	59.6	Low	75.3	Confident	150 Å²	150	61 Å²	61	80%	0.802	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-25.2	-175.7	-89	-52.4	0	0	0	114.4	T495 G496	D493-T495 VanDerWaalsContact C-N 3.34Å; D493-T495 PolarHBondContact O-N 3.4Å; D493-G496 PolarHBondContact O-N 3.43Å; D493-G496 VanDerWaalsContact O-N 3.08Å
494	A	56.5	Low	74.7	Confident	109 Å²	109	67.5 Å²	67.5	90%	0.901	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-39.4	176.7	0	0	0	0	0	114	G492 G496	G492-A494 PolarHBondContact O-N 3.06Å; A494-G496 VanDerWaalsContact C-N 3.34Å
495	T	67.8	Low	74.2	Confident	44 Å²	44	69.5 Å²	69.5	27%	0.27	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-24.1	177.9	75.8	0	0	0	0	111.6	A489 L490 G492 D493 V497 R500	A489-T495 WeakPolarHBondContact O-CG2 3.19Å; L490-T495 WeakPolarHBondContact O-CB 3.37Å; L490-T495 WeakPolarHBondContact O-CG2 3.35Å; L490-T495 PolarHBondContact O-OG1 3.13Å; G492-T495 PolarHBondContact O-N 3.27Å; G492-T495 VanDerWaalsContact O-N 3.07Å; G492-T495 PolarHBondContact O-OG1 3.26Å; D493-T495 VanDerWaalsContact C-N 3.34Å; D493-T495 PolarHBondContact O-N 3.4Å; T495-V497 PolarHBondContact O-N 2.91Å; T495-V497 WeakPolarHBondContact OG1-CB 3.47Å; T495-V497 VanDerWaalsContact OG1-CG2 3.24Å; T495-V497 WeakPolarHBondContact OG1-CG2 3.4Å; T495-V497 PolarHBondContact OG1-N 3.17Å; T495-R500 PolarHBondContact O-NH1 2.84Å; T495-R500 PolarHBondContact O-NH2 3.45Å
496	G	70.9	Confident	74.1	Confident	7 Å²	7	71.6 Å²	71.6	7%	0.072	38%	0.378	C	S	.	.			trans	56.1	16	-172.7	0	0	0	0	0	114	D493 A494 R500	D493-G496 PolarHBondContact O-N 3.43Å; D493-G496 VanDerWaalsContact O-N 3.08Å; A494-G496 VanDerWaalsContact C-N 3.34Å; G496-R500 WeakPolarHBondContact O-CG 3.41Å; G496-R500 PolarHBondContact O-N 3.49Å; G496-R500 PolarHBondContact O-NH1 2.82Å
497	V	74.7	Confident	73.9	Confident	4 Å²	4	77.7 Å²	77.7	2%	0.024	42%	0.418	C	S	.	.	H	α-helix	trans	-64.8	-49.4	-176.2	173	0	0	0	0	109.8	T495 R499 R500 I501 F525 Y531	T495-V497 PolarHBondContact O-N 2.91Å; T495-V497 WeakPolarHBondContact OG1-CB 3.47Å; T495-V497 VanDerWaalsContact OG1-CG2 3.24Å; T495-V497 WeakPolarHBondContact OG1-CG2 3.4Å; T495-V497 PolarHBondContact OG1-N 3.17Å; V497-R499 VanDerWaalsContact C-N 3.3Å; V497-R499 PolarHBondContact O-N 3.15Å; V497-R500 CarbonylContact O-C 3.52Å; V497-R500 WeakPolarHBondContact O-CA 3.28Å; V497-R500 VanDerWaalsContact O-CB 3.29Å; V497-R500 WeakPolarHBondContact O-CB 3.48Å; V497-R500 PolarHBondContact O-N 3.02Å; V497-I501 HydrophobicContact CG1-CD1 3.67Å; V497-I501 PolarHBondContact O-N 2.96Å; V497-F525 HydrophobicContact CG1-CE1 3.79Å; V497-F525 HydrophobicContact CG1-CE2 4.41Å; V497-F525 HydrophobicContact CG1-CZ 3.38Å; V497-Y531 HydrophobicContact CG2-CE1 3.73Å
498	D	74.3	Confident	74	Confident	46 Å²	46	80.5 Å²	80.5	25%	0.246	44%	0.438	C	S	.	.	H	α-helix	trans	-66.2	-34.9	-178.7	-72.9	19.1	0	0	0	112	H491 R500 I501 K502	H491-D498 IonicContact CE1-OD1 3.65Å; H491-D498 IonicContact CE1-OD2 3.4Å; H491-D498 IonicContact CG-OD1 3.23Å; H491-D498 IonicContact CG-OD2 3.76Å; H491-D498 VanDerWaalsContact ND1-CG 3.29Å; H491-D498 IonicContact ND1-OD1 3.83Å; H491-D498 PolarHBondContact ND1-OD1 3.24Å; H491-D498 VanDerWaalsContact ND1-OD1 3.07Å; H491-D498 IonicContact ND1-OD2 3.55Å; H491-D498 PolarHBondContact ND1-OD2 2.78Å; D498-R500 PolarHBondContact O-N 3.41Å; D498-I501 PolarHBondContact O-N 3.04Å; D498-K502 WeakPolarHBondContact O-CB 3.28Å; D498-K502 PolarHBondContact O-N 3.21Å
499	R	78.3	Confident	74.2	Confident	166 Å²	166	80.2 Å²	80.2	63%	0.626	44%	0.436	S	S	*	.	H	α-helix	trans	-65	-21.5	171	-163.1	179.7	67.2	164.9	-3	113.1	V497 K503	V497-R499 VanDerWaalsContact C-N 3.3Å; V497-R499 PolarHBondContact O-N 3.15Å; R499-K503 WeakPolarHBondContact O-CD 3.23Å; R499-K503 VanDerWaalsContact O-CG 3.29Å; R499-K503 WeakPolarHBondContact O-CG 3.25Å
500	R	78.8	Confident	74.2	Confident	130 Å²	130	79.7 Å²	79.7	49%	0.491	44%	0.436	S	S	.	.	H	α-helix	trans	-83.2	-45.1	169.7	-64.5	-178.1	-67.1	-90.6	14.6	110.7	T495 G496 V497 D498 K503 I504	T495-R500 PolarHBondContact O-NH1 2.84Å; T495-R500 PolarHBondContact O-NH2 3.45Å; G496-R500 WeakPolarHBondContact O-CG 3.41Å; G496-R500 PolarHBondContact O-N 3.49Å; G496-R500 PolarHBondContact O-NH1 2.82Å; V497-R500 CarbonylContact O-C 3.52Å; V497-R500 WeakPolarHBondContact O-CA 3.28Å; V497-R500 VanDerWaalsContact O-CB 3.29Å; V497-R500 WeakPolarHBondContact O-CB 3.48Å; V497-R500 PolarHBondContact O-N 3.02Å; D498-R500 PolarHBondContact O-N 3.41Å; R500-K503 WeakPolarHBondContact O-CB 3.4Å; R500-K503 PolarHBondContact O-N 3.49Å; R500-I504 PolarHBondContact O-N 2.85Å
501	I	80.4	Confident	74.2	Confident	21 Å²	21	91 Å²	91	11%	0.108	48%	0.478	C	S	.	.	H	α-helix	trans	-62.1	-47.2	179.1	-70.5	164.7	0	0	0	111.6	V497 D498 K503 I504 T505 N517 L521 F525	V497-I501 HydrophobicContact CG1-CD1 3.67Å; V497-I501 PolarHBondContact O-N 2.96Å; D498-I501 PolarHBondContact O-N 3.04Å; I501-K503 PolarHBondContact O-N 2.65Å; I501-K503 VanDerWaalsContact O-N 3.16Å; I501-I504 CarbonylContact O-C 3.59Å; I501-I504 VanDerWaalsContact O-CG1 3.22Å; I501-I504 WeakPolarHBondContact O-CG1 3.11Å; I501-I504 PolarHBondContact O-N 3.07Å; I501-T505 WeakPolarHBondContact O-CB 3.25Å; I501-T505 PolarHBondContact O-N 3.2Å; I501-T505 PolarHBondContact O-OG1 2.87Å; I501-N517 HydrophobicContact CG2-CB 4.39Å; I501-L521 HydrophobicContact CD1-CD1 3.79Å; I501-L521 HydrophobicContact CD1-CD2 3.86Å; I501-L521 HydrophobicContact CD1-CG 4.45Å; I501-L521 HydrophobicContact CG1-CD1 4.35Å; I501-L521 HydrophobicContact CG2-CD1 3.76Å; I501-F525 HydrophobicContact CD1-CE1 4.37Å; I501-F525 HydrophobicContact CD1-CZ 3.63Å
502	K	80.6	Confident	74.1	Confident	174 Å²	174	95.2 Å²	95.2	76%	0.757	50%	0.501	S	S	*	.	H	α-helix	trans	-59.7	-25.5	176.4	-167.8	169.4	-174.4	169.3	0	113.2	D498	D498-K502 WeakPolarHBondContact O-CB 3.28Å; D498-K502 PolarHBondContact O-N 3.21Å
503	K	84.5	Confident	74.6	Confident	168 Å²	168	97.8 Å²	97.8	73%	0.73	50%	0.503	S	S	*	.	H	α-helix	trans	-80.8	-26.1	174.4	-75	179.5	179.8	-168.4	0	114.2	R499 R500 I501	R499-K503 WeakPolarHBondContact O-CD 3.23Å; R499-K503 VanDerWaalsContact O-CG 3.29Å; R499-K503 WeakPolarHBondContact O-CG 3.25Å; R500-K503 WeakPolarHBondContact O-CB 3.4Å; R500-K503 PolarHBondContact O-N 3.49Å; I501-K503 PolarHBondContact O-N 2.65Å; I501-K503 VanDerWaalsContact O-N 3.16Å
504	I	84.1	Confident	75	Confident	138 Å²	138	96 Å²	96	71%	0.708	49%	0.489	S	S	*	.	H	α-helix	trans	-97.2	-10.7	174.9	62.8	171.3	0	0	0	112.8	R500 I501 L506	R500-I504 PolarHBondContact O-N 2.85Å; I501-I504 CarbonylContact O-C 3.59Å; I501-I504 VanDerWaalsContact O-CG1 3.22Å; I501-I504 WeakPolarHBondContact O-CG1 3.11Å; I501-I504 PolarHBondContact O-N 3.07Å; I504-L506 PolarHBondContact O-N 3.02Å
505	T	81.6	Confident	75.4	Confident	42 Å²	42	95.1 Å²	95.1	26%	0.258	47%	0.466	S	S	.	.	S	Bend	trans	-68	115.3	175	-62.7	0	0	0	0	109.7	I501 R513 N517	I501-T505 WeakPolarHBondContact O-CB 3.25Å; I501-T505 PolarHBondContact O-N 3.2Å; I501-T505 PolarHBondContact O-OG1 2.87Å; T505-R513 HydrophobicContact CG2-CB 3.94Å; T505-N517 PolarHBondContact OG1-ND2 3.13Å
506	L	84.3	Confident	75.4	Confident	98 Å²	98	95.4 Å²	95.4	51%	0.513	47%	0.467	S	S	.	.			trans	-64.7	145.6	177.2	-61.9	174.2	0	0	0	111	I504 S508 R513	I504-L506 PolarHBondContact O-N 3.02Å; L506-S508 VanDerWaalsContact C-N 3.26Å; L506-S508 PolarHBondContact O-N 2.82Å; L506-R513 WeakPolarHBondContact O-CD 3.48Å
507	P	80.9	Confident	75.3	Confident	130 Å²	130	96.6 Å²	96.6	84%	0.844	47%	0.472	S	S	*	.	S	Bend	trans	-73.3	-16.3	-179.2	29.4	-35.9	0	0	0	113.6
508	S	80.3	Confident	74.8	Confident	67 Å²	67	99 Å²	99	47%	0.469	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	145.3	173.7	54.9	0	0	0	0	111.3	L506 G510 R513	L506-S508 VanDerWaalsContact C-N 3.26Å; L506-S508 PolarHBondContact O-N 2.82Å; S508-G510 PolarHBondContact O-N 3.41Å; S508-R513 WeakPolarHBondContact O-CD 3.49Å; S508-R513 PolarHBondContact O-NE 2.71Å
509	T	75.5	Confident	74.2	Confident	90 Å²	90	98.7 Å²	98.7	55%	0.552	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	33.2	-178.6	59.1	0	0	0	0	115.1	R511 L512 R513	T509-R511 VanDerWaalsContact C-N 3.32Å; T509-R511 PolarHBondContact O-N 2.83Å; T509-L512 WeakPolarHBondContact O-CB 3.06Å; T509-L512 PolarHBondContact O-N 3.48Å; T509-R513 PolarHBondContact O-N 3Å
510	G	69.8	Low	73.6	Confident	40 Å²	40	95.5 Å²	95.5	41%	0.412	48%	0.478	S	S	.	.	H	α-helix	trans	-48.2	-38.2	-171	0	0	0	0	0	116.9	S508 R513 H514	S508-G510 PolarHBondContact O-N 3.41Å; G510-R513 PolarHBondContact O-N 2.94Å; G510-H514 WeakPolarHBondContact O-CB 3.43Å; G510-H514 PolarHBondContact O-N 2.85Å
511	R	65.4	Low	73.1	Confident	241 Å²	241	90.6 Å²	90.6	91%	0.909	46%	0.461	S	S	*	.	H	α-helix	trans	-62.7	-45.5	174.9	-72.5	-174.3	178.6	179.1	-1.1	112.7	T509 R513 F515	T509-R511 VanDerWaalsContact C-N 3.32Å; T509-R511 PolarHBondContact O-N 2.83Å; R511-R513 VanDerWaalsContact C-N 3.35Å; R511-F515 PolarHBondContact O-N 2.91Å; R511-F515 VanDerWaalsContact O-N 3.16Å
512	L	65.2	Low	72.7	Confident	109 Å²	109	89.6 Å²	89.6	57%	0.571	46%	0.456	S	S	*	.	H	α-helix	trans	-67	-38.9	177.5	179.6	62.6	0	0	0	110.8	T509 F515 T516	T509-L512 WeakPolarHBondContact O-CB 3.06Å; T509-L512 PolarHBondContact O-N 3.48Å; L512-F515 PolarHBondContact O-N 3.36Å; L512-T516 PolarHBondContact O-N 3Å; L512-T516 PolarHBondContact O-OG1 2.97Å
513	R	73.1	Confident	72.6	Confident	79 Å²	79	82.7 Å²	82.7	30%	0.298	43%	0.428	S	S	.	.	H	α-helix	trans	-70.1	-36.7	177.9	-67.6	-173.7	-175.6	-80.2	-5	113.6	T505 L506 S508 T509 G510 R511 T516 N517	T505-R513 HydrophobicContact CG2-CB 3.94Å; L506-R513 WeakPolarHBondContact O-CD 3.48Å; S508-R513 WeakPolarHBondContact O-CD 3.49Å; S508-R513 PolarHBondContact O-NE 2.71Å; T509-R513 PolarHBondContact O-N 3Å; G510-R513 PolarHBondContact O-N 2.94Å; R511-R513 VanDerWaalsContact C-N 3.35Å; R513-T516 PolarHBondContact O-N 2.83Å; R513-N517 WeakPolarHBondContact O-CB 3.14Å; R513-N517 PolarHBondContact O-N 2.82Å; R513-N517 PolarHBondContact O-OD1 3.37Å
514	H	67.6	Low	72.1	Confident	112 Å²	112	79.5 Å²	79.5	52%	0.519	42%	0.419	S	S	.	.	H	α-helix	trans	-59.5	-52	171	-178	27.3	0	0	0	109.3	G510 T516 N517 E518	G510-H514 WeakPolarHBondContact O-CB 3.43Å; G510-H514 PolarHBondContact O-N 2.85Å; H514-T516 VanDerWaalsContact C-N 3.33Å; H514-T516 PolarHBondContact O-N 3.14Å; H514-N517 CarbonylContact O-C 3.58Å; H514-N517 WeakPolarHBondContact O-CA 3.29Å; H514-N517 WeakPolarHBondContact O-CB 3.14Å; H514-N517 PolarHBondContact O-N 2.9Å; H514-E518 VanDerWaalsContact CE1-CG 3.47Å; H514-E518 WeakPolarHBondContact CE1-CG 3.43Å; H514-E518 IonicContact CE1-OE1 3.53Å; H514-E518 PolarHBondContact CE1-OE1 3.38Å; H514-E518 IonicContact CE1-OE2 2.8Å; H514-E518 VanDerWaalsContact ND1-CD 3.3Å; H514-E518 WeakPolarHBondContact ND1-CG 3.25Å; H514-E518 IonicContact ND1-OE1 3.07Å; H514-E518 PolarHBondContact ND1-OE1 3.07Å; H514-E518 WeakPolarHBondContact O-CG 3.41Å; H514-E518 PolarHBondContact O-N 2.83Å
515	F	66.4	Low	71.8	Confident	91 Å²	91	73.5 Å²	73.5	40%	0.399	39%	0.387	S	S	.	.	H	α-helix	trans	-54.4	-44	171.7	179	-100.5	0	0	0	112.8	R511 L512 N517 E518 T519 L924	R511-F515 PolarHBondContact O-N 2.91Å; R511-F515 VanDerWaalsContact O-N 3.16Å; L512-F515 PolarHBondContact O-N 3.36Å; F515-N517 VanDerWaalsContact C-N 3.28Å; F515-N517 PolarHBondContact O-N 3.37Å; F515-E518 PolarHBondContact O-N 2.89Å; F515-T519 HydrophobicContact CE1-CG2 4.41Å; F515-T519 HydrophobicContact CE2-CG2 3.97Å; F515-T519 HydrophobicContact CZ-CG2 3.85Å; F515-T519 WeakPolarHBondContact O-CA 3.38Å; F515-T519 WeakPolarHBondContact O-CB 3.35Å; F515-T519 PolarHBondContact O-N 3.17Å; F515-T519 PolarHBondContact O-OG1 3.18Å; F515-T519 VanDerWaalsContact O-OG1 3.09Å; F515-L924 HydrophobicContact CZ-CD1 4.28Å; F515-L924 HydrophobicContact CZ-CD2 4.46Å
516	T	66.9	Low	71.9	Confident	50 Å²	50	71.8 Å²	71.8	31%	0.307	38%	0.376	S	S	.	.	I	π-helix	trans	-59.6	-37.2	174.4	-51.5	0	0	0	0	112.6	L512 R513 H514 L520 L521	L512-T516 PolarHBondContact O-N 3Å; L512-T516 PolarHBondContact O-OG1 2.97Å; R513-T516 PolarHBondContact O-N 2.83Å; H514-T516 VanDerWaalsContact C-N 3.33Å; H514-T516 PolarHBondContact O-N 3.14Å; T516-L520 HydrophobicContact CG2-CB 3.93Å; T516-L520 HydrophobicContact CG2-CD2 4.03Å; T516-L520 WeakPolarHBondContact O-CB 3.41Å; T516-L520 PolarHBondContact O-N 3.09Å; T516-L521 PolarHBondContact O-N 2.89Å
517	N	68.3	Low	71.6	Confident	33 Å²	33	71.5 Å²	71.5	18%	0.176	38%	0.375	C	S	.	.	I	π-helix	trans	-76.7	-39.8	-178.9	-68.6	-6	0	0	0	113.4	I501 T505 R513 H514 F515 T519 L521	I501-N517 HydrophobicContact CG2-CB 4.39Å; T505-N517 PolarHBondContact OG1-ND2 3.13Å; R513-N517 WeakPolarHBondContact O-CB 3.14Å; R513-N517 PolarHBondContact O-N 2.82Å; R513-N517 PolarHBondContact O-OD1 3.37Å; H514-N517 CarbonylContact O-C 3.58Å; H514-N517 WeakPolarHBondContact O-CA 3.29Å; H514-N517 WeakPolarHBondContact O-CB 3.14Å; H514-N517 PolarHBondContact O-N 2.9Å; F515-N517 VanDerWaalsContact C-N 3.28Å; F515-N517 PolarHBondContact O-N 3.37Å; N517-T519 VanDerWaalsContact C-N 3.32Å; N517-L521 HydrophobicContact CB-CD1 4.28Å; N517-L521 WeakPolarHBondContact O-CB 3.17Å
518	E	63.9	Low	71.5	Confident	54 Å²	54	67 Å²	67	25%	0.252	35%	0.347	S	S	.	.	I	π-helix	trans	-80.6	-11.2	175.2	-41.4	-52.8	115.7	0	0	112.9	G438 H514 F515	G438-E518 WeakPolarHBondContact CA-O 3.2Å; G438-E518 PolarHBondContact N-O 2.84Å; H514-E518 VanDerWaalsContact CE1-CG 3.47Å; H514-E518 WeakPolarHBondContact CE1-CG 3.43Å; H514-E518 IonicContact CE1-OE1 3.53Å; H514-E518 PolarHBondContact CE1-OE1 3.38Å; H514-E518 IonicContact CE1-OE2 2.8Å; H514-E518 VanDerWaalsContact ND1-CD 3.3Å; H514-E518 WeakPolarHBondContact ND1-CG 3.25Å; H514-E518 IonicContact ND1-OE1 3.07Å; H514-E518 PolarHBondContact ND1-OE1 3.07Å; H514-E518 WeakPolarHBondContact O-CG 3.41Å; H514-E518 PolarHBondContact O-N 2.83Å; F515-E518 PolarHBondContact O-N 2.89Å
519	T	61.5	Low	71.1	Confident	40 Å²	40	65.6 Å²	65.6	25%	0.245	34%	0.337	C	S	.	.	I	π-helix	trans	-128.2	-53.3	-167.7	-49.8	0	0	0	0	114.8	I437 F515 N517 L521	I437-T519 HydrophobicContact CG2-CG2 3.53Å; I437-T519 WeakPolarHBondContact CG2-O 3.17Å; F515-T519 HydrophobicContact CE1-CG2 4.41Å; F515-T519 HydrophobicContact CE2-CG2 3.97Å; F515-T519 HydrophobicContact CZ-CG2 3.85Å; F515-T519 WeakPolarHBondContact O-CA 3.38Å; F515-T519 WeakPolarHBondContact O-CB 3.35Å; F515-T519 PolarHBondContact O-N 3.17Å; F515-T519 PolarHBondContact O-OG1 3.18Å; F515-T519 VanDerWaalsContact O-OG1 3.09Å; N517-T519 VanDerWaalsContact C-N 3.32Å; T519-L521 VanDerWaalsContact C-N 3.34Å
520	L	66.3	Low	70.9	Confident	98 Å²	98	65.7 Å²	65.7	51%	0.513	34%	0.337	S	S	.	.	I	π-helix	trans	-79	-23.9	-178.3	-171.3	59.9	0	0	0	112.1	T516 V523 L524	T516-L520 HydrophobicContact CG2-CB 3.93Å; T516-L520 HydrophobicContact CG2-CD2 4.03Å; T516-L520 WeakPolarHBondContact O-CB 3.41Å; T516-L520 PolarHBondContact O-N 3.09Å; L520-V523 PolarHBondContact O-N 2.94Å; L520-L524 PolarHBondContact O-N 2.8Å
521	L	69.4	Low	71.4	Confident	27 Å²	27	66.5 Å²	66.5	14%	0.141	33%	0.328	C	S	.	.	H	α-helix	trans	-74.3	-34.3	-171.9	-115.8	156.6	0	0	0	113.3	I501 T516 N517 T519 V523 L524 F525	I501-L521 HydrophobicContact CD1-CD1 3.79Å; I501-L521 HydrophobicContact CD1-CD2 3.86Å; I501-L521 HydrophobicContact CD1-CG 4.45Å; I501-L521 HydrophobicContact CG1-CD1 4.35Å; I501-L521 HydrophobicContact CG2-CD1 3.76Å; T516-L521 PolarHBondContact O-N 2.89Å; N517-L521 HydrophobicContact CB-CD1 4.28Å; N517-L521 WeakPolarHBondContact O-CB 3.17Å; T519-L521 VanDerWaalsContact C-N 3.34Å; L521-V523 VanDerWaalsContact C-N 3.26Å; L521-V523 PolarHBondContact O-N 2.95Å; L521-L524 HydrophobicContact CG-CD1 4.48Å; L521-L524 CarbonylContact O-C 3.58Å; L521-L524 WeakPolarHBondContact O-CA 3.39Å; L521-L524 WeakPolarHBondContact O-CB 3.33Å; L521-L524 PolarHBondContact O-N 3.14Å; L521-F525 HydrophobicContact CB-CE2 4.27Å; L521-F525 HydrophobicContact CD2-CD1 4.3Å; L521-F525 HydrophobicContact CD2-CD2 4.36Å; L521-F525 HydrophobicContact CD2-CE1 3.77Å; L521-F525 HydrophobicContact CD2-CE2 3.84Å; L521-F525 HydrophobicContact CD2-CZ 3.53Å; L521-F525 VanDerWaalsContact O-CD2 3.24Å; L521-F525 WeakPolarHBondContact O-CD2 3.02Å; L521-F525 WeakPolarHBondContact O-CG 3.35Å; L521-F525 PolarHBondContact O-N 3.03Å
522	D	72.1	Confident	72.4	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-54	-41.9	171.4	-61.9	41.9	0	0	0	111.7	I437 G438 W486 H487 H491 F525 Y526 L568	I437-D522 HydrophobicContact CG1-CB 4.43Å; I437-D522 HydrophobicContact CG2-CB 4.42Å; G438-D522 PolarHBondContact N-OD2 3.48Å; W486-D522 HydrophobicContact CH2-CB 4.36Å; H487-D522 IonicContact CE1-OD1 2.75Å; H487-D522 IonicContact CE1-OD2 3.16Å; H487-D522 IonicContact CG-OD2 3.49Å; H487-D522 IonicContact ND1-OD1 3.01Å; H487-D522 IonicContact ND1-OD2 2.8Å; H487-D522 PolarHBondContact ND1-OD2 3.43Å; H491-D522 IonicContact CE1-OD1 3.72Å; H491-D522 IonicContact NE2-OD1 3.92Å; D522-F525 PolarHBondContact O-N 3.32Å; D522-Y526 PolarHBondContact O-N 3.23Å; D522-L568 HydrophobicContact CB-CD2 4.16Å
523	V	76.5	Confident	73.4	Confident	29 Å²	29	52.5 Å²	52.5	18%	0.176	27%	0.271	C	S	.	.	H	α-helix	trans	-67	-39.5	175.8	-174.8	0	0	0	0	111.2	I437 L520 L521 F525 Y526 N527 L568 F755	I437-V523 HydrophobicContact CD1-CG2 3.61Å; I437-V523 HydrophobicContact CG1-CG2 4.32Å; L520-V523 PolarHBondContact O-N 2.94Å; L521-V523 VanDerWaalsContact C-N 3.26Å; L521-V523 PolarHBondContact O-N 2.95Å; V523-F525 VanDerWaalsContact C-N 3.34Å; V523-Y526 PolarHBondContact O-N 3.27Å; V523-N527 PolarHBondContact O-N 3.29Å; V523-N527 VanDerWaalsContact O-N 3.13Å; V523-N527 PolarHBondContact O-ND2 2.63Å; V523-L568 HydrophobicContact CG2-CD2 4.18Å; V523-F755 HydrophobicContact CG1-CZ 3.87Å
524	L	76	Confident	74.1	Confident	102 Å²	102	51.5 Å²	51.5	53%	0.534	27%	0.274	S	S	.	.	H	α-helix	trans	-69.3	-31.9	175.6	-62.9	174.4	0	0	0	112.1	L520 L521 S528	L520-L524 PolarHBondContact O-N 2.8Å; L521-L524 HydrophobicContact CG-CD1 4.48Å; L521-L524 CarbonylContact O-C 3.58Å; L521-L524 WeakPolarHBondContact O-CA 3.39Å; L521-L524 WeakPolarHBondContact O-CB 3.33Å; L521-L524 PolarHBondContact O-N 3.14Å; L524-S528 WeakPolarHBondContact O-CB 3.18Å; L524-S528 PolarHBondContact O-N 3.46Å
525	F	77.4	Confident	75.1	Confident	11 Å²	11	46.2 Å²	46.2	5%	0.048	25%	0.249	C	C	.	.	H	α-helix	trans	-70.6	-42	172.8	-67.6	-44.1	0	0	0	112.2	L490 H491 V497 I501 L521 D522 V523 N527 S528 Y531 C532 I535	L490-F525 HydrophobicContact CD2-CB 4Å; L490-F525 HydrophobicContact CD2-CD2 3.53Å; L490-F525 HydrophobicContact CD2-CE2 4.19Å; L490-F525 HydrophobicContact CD2-CG 3.99Å; L490-F525 HydrophobicContact CG-CD2 4.25Å; L490-F525 HydrophobicContact CG-CE2 4.49Å; H491-F525 AromaticContact CE1-CE2 3.64Å; H491-F525 AromaticContact NE2-CD2 3.9Å; H491-F525 AromaticContact NE2-CE2 3.56Å; V497-F525 HydrophobicContact CG1-CE1 3.79Å; V497-F525 HydrophobicContact CG1-CE2 4.41Å; V497-F525 HydrophobicContact CG1-CZ 3.38Å; I501-F525 HydrophobicContact CD1-CE1 4.37Å; I501-F525 HydrophobicContact CD1-CZ 3.63Å; L521-F525 HydrophobicContact CB-CE2 4.27Å; L521-F525 HydrophobicContact CD2-CD1 4.3Å; L521-F525 HydrophobicContact CD2-CD2 4.36Å; L521-F525 HydrophobicContact CD2-CE1 3.77Å; L521-F525 HydrophobicContact CD2-CE2 3.84Å; L521-F525 HydrophobicContact CD2-CZ 3.53Å; L521-F525 VanDerWaalsContact O-CD2 3.24Å; L521-F525 WeakPolarHBondContact O-CD2 3.02Å; L521-F525 WeakPolarHBondContact O-CG 3.35Å; L521-F525 PolarHBondContact O-N 3.03Å; D522-F525 PolarHBondContact O-N 3.32Å; V523-F525 VanDerWaalsContact C-N 3.34Å; F525-N527 VanDerWaalsContact C-N 3.26Å; F525-N527 PolarHBondContact O-N 2.81Å; F525-S528 WeakPolarHBondContact O-CA 3.44Å; F525-S528 WeakPolarHBondContact O-CB 3.37Å; F525-S528 PolarHBondContact O-N 3.39Å; F525-S528 VanDerWaalsContact O-O 3.13Å; F525-Y531 HydrophobicContact CB-CD2 4.5Å; F525-Y531 HydrophobicContact CB-CG 4.37Å; F525-Y531 HydrophobicContact CD1-CD1 4.49Å; F525-Y531 AromaticContact CD1-CD2 3.46Å; F525-Y531 HydrophobicContact CD1-CD2 3.46Å; F525-Y531 VanDerWaalsContact CD1-CD2 3.46Å; F525-Y531 AromaticContact CD1-CE2 3.78Å; F525-Y531 HydrophobicContact CD1-CE2 3.78Å; F525-Y531 AromaticContact CD1-CG 3.85Å; F525-Y531 HydrophobicContact CD1-CG 3.85Å; F525-Y531 HydrophobicContact CE1-CD2 4.07Å; F525-Y531 AromaticContact CE1-CE2 3.91Å; F525-Y531 HydrophobicContact CE1-CE2 3.91Å; F525-Y531 HydrophobicContact CG-CD2 4.35Å; F525-Y531 HydrophobicContact CG-CG 4.38Å; F525-C532 PolarHBondContact O-N 3.29Å; F525-I535 HydrophobicContact CB-CD1 4.05Å
526	Y	82.2	Confident	76.2	Confident	6 Å²	6	41.9 Å²	41.9	2%	0.024	23%	0.23	C	C	.	.	H	α-helix	trans	-66.4	-29.6	176.8	-166.5	-108.2	0	0	0	112.9	D522 V523 S528 C532 I535 M536 L568 L571 I572 D575	D522-Y526 PolarHBondContact O-N 3.23Å; V523-Y526 PolarHBondContact O-N 3.27Å; Y526-S528 VanDerWaalsContact C-N 3.28Å; Y526-C532 WeakPolarHBondContact O-CB 3.42Å; Y526-C532 PolarHBondContact O-SG 3.12Å; Y526-C532 VanDerWaalsContact O-SG 3.33Å; Y526-I535 HydrophobicContact CD2-CB 4.37Å; Y526-I535 HydrophobicContact CD2-CD1 4.18Å; Y526-I535 HydrophobicContact CD2-CG2 4.01Å; Y526-I535 HydrophobicContact CE2-CG2 4.37Å; Y526-M536 HydrophobicContact CE2-CE 3.84Å; Y526-M536 WeakPolarHBondContact OH-CE 3.31Å; Y526-L568 HydrophobicContact CD1-CD1 3.85Å; Y526-L568 HydrophobicContact CG-CD1 4.07Å; Y526-L571 HydrophobicContact CD1-CD2 3.81Å; Y526-L571 HydrophobicContact CD1-CG 4.48Å; Y526-L571 HydrophobicContact CE1-CD2 3.64Å; Y526-L571 HydrophobicContact CE1-CG 3.87Å; Y526-I572 HydrophobicContact CD2-CD1 4.47Å; Y526-I572 HydrophobicContact CD2-CG1 3.95Å; Y526-I572 HydrophobicContact CE2-CG1 3.68Å; Y526-I572 HydrophobicContact CG-CG1 4.5Å; Y526-D575 WeakPolarHBondContact CE1-OD2 3.35Å; Y526-D575 WeakPolarHBondContact OH-CB 3.5Å; Y526-D575 PolarHBondContact OH-OD2 3.07Å
527	N	78.8	Confident	77.4	Confident	92 Å²	92	41.1 Å²	41.1	49%	0.492	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-8.2	168.9	-76	-76.5	0	0	0	114.1	V523 F525 F755	V523-N527 PolarHBondContact O-N 3.29Å; V523-N527 VanDerWaalsContact O-N 3.13Å; V523-N527 PolarHBondContact O-ND2 2.63Å; F525-N527 VanDerWaalsContact C-N 3.26Å; F525-N527 PolarHBondContact O-N 2.81Å; N527-F755 WeakPolarHBondContact ND2-CE1 3.33Å
528	S	79.2	Confident	78.5	Confident	35 Å²	35	41.1 Å²	41.1	25%	0.245	23%	0.226	C	C	.	.	S	Bend	trans	-96.5	119.9	-178.1	-176.7	0	0	0	0	110.8	L524 F525 Y526 T530 Y531 C532	L524-S528 WeakPolarHBondContact O-CB 3.18Å; L524-S528 PolarHBondContact O-N 3.46Å; F525-S528 WeakPolarHBondContact O-CA 3.44Å; F525-S528 WeakPolarHBondContact O-CB 3.37Å; F525-S528 PolarHBondContact O-N 3.39Å; F525-S528 VanDerWaalsContact O-O 3.13Å; Y526-S528 VanDerWaalsContact C-N 3.28Å; S528-T530 PolarHBondContact O-N 3.29Å; S528-Y531 PolarHBondContact O-N 2.79Å; S528-C532 WeakPolarHBondContact O-CB 3.32Å; S528-C532 PolarHBondContact O-N 2.81Å
529	P	70.9	Confident	79.9	Confident	39 Å²	39	38.6 Å²	38.6	25%	0.253	21%	0.214	S	C	.	.	H	α-helix	trans	-44.4	-42	-179.3	-37.4	39.7	0	0	0	116.2	V731	P529-V731 HydrophobicContact CB-CB 3.72Å; P529-V731 HydrophobicContact CB-CG1 4.16Å; P529-V731 HydrophobicContact CB-CG2 3.58Å; P529-V731 HydrophobicContact CG-CB 4Å; P529-V731 HydrophobicContact CG-CG2 3.57Å
530	T	72.2	Confident	81.5	Confident	91 Å²	91	36.7 Å²	36.7	56%	0.558	20%	0.202	S	C	*	.	H	α-helix	trans	-70.5	-35	-175.9	-48.7	0	0	0	0	112.9	S528 T534	S528-T530 PolarHBondContact O-N 3.29Å; T530-T534 PolarHBondContact O-OG1 3.01Å
531	Y	80.6	Confident	82.9	Confident	58 Å²	58	37.3 Å²	37.3	23%	0.227	20%	0.203	C	C	.	.	H	α-helix	trans	-98.5	-27.8	-175.1	-56.8	-71.8	0	0	0	112.1	L490 V497 F525 S528 Q533 T534 I535	L490-Y531 HydrophobicContact CD1-CD1 3.56Å; L490-Y531 HydrophobicContact CD1-CE1 4.34Å; L490-Y531 HydrophobicContact CD1-CG 4.15Å; V497-Y531 HydrophobicContact CG2-CE1 3.73Å; F525-Y531 HydrophobicContact CB-CD2 4.5Å; F525-Y531 HydrophobicContact CB-CG 4.37Å; F525-Y531 HydrophobicContact CD1-CD1 4.49Å; F525-Y531 AromaticContact CD1-CD2 3.46Å; F525-Y531 HydrophobicContact CD1-CD2 3.46Å; F525-Y531 VanDerWaalsContact CD1-CD2 3.46Å; F525-Y531 AromaticContact CD1-CE2 3.78Å; F525-Y531 HydrophobicContact CD1-CE2 3.78Å; F525-Y531 AromaticContact CD1-CG 3.85Å; F525-Y531 HydrophobicContact CD1-CG 3.85Å; F525-Y531 HydrophobicContact CE1-CD2 4.07Å; F525-Y531 AromaticContact CE1-CE2 3.91Å; F525-Y531 HydrophobicContact CE1-CE2 3.91Å; F525-Y531 HydrophobicContact CG-CD2 4.35Å; F525-Y531 HydrophobicContact CG-CG 4.38Å; S528-Y531 PolarHBondContact O-N 2.79Å; Y531-Q533 VanDerWaalsContact C-N 3.3Å; Y531-Q533 PolarHBondContact O-N 3.27Å; Y531-T534 PolarHBondContact O-N 3.01Å; Y531-T534 VanDerWaalsContact O-N 3.15Å; Y531-I535 VanDerWaalsContact O-CG1 3.25Å; Y531-I535 WeakPolarHBondContact O-CG1 3.42Å; Y531-I535 PolarHBondContact O-N 3.35Å
532	C	85.7	Confident	84.1	Confident	12 Å²	12	37.5 Å²	37.5	8%	0.081	20%	0.203	C	C	.	.	H	α-helix	trans	-53.3	-45.7	173.6	-171	0	0	0	0	112	F525 Y526 S528 I535 M536	F525-C532 PolarHBondContact O-N 3.29Å; Y526-C532 WeakPolarHBondContact O-CB 3.42Å; Y526-C532 PolarHBondContact O-SG 3.12Å; Y526-C532 VanDerWaalsContact O-SG 3.33Å; S528-C532 WeakPolarHBondContact O-CB 3.32Å; S528-C532 PolarHBondContact O-N 2.81Å; C532-I535 PolarHBondContact O-N 2.64Å; C532-M536 WeakPolarHBondContact O-CB 3.27Å; C532-M536 PolarHBondContact O-N 2.81Å
533	Q	87.2	Confident	85.3	Confident	43 Å²	43	37.5 Å²	37.5	20%	0.201	20%	0.203	C	C	.	.	H	α-helix	trans	-60.3	-50.4	175	-172.2	62.9	57.5	0	0	111.7	Y531 I535 M536 D537 I734	Y531-Q533 VanDerWaalsContact C-N 3.3Å; Y531-Q533 PolarHBondContact O-N 3.27Å; Q533-I535 VanDerWaalsContact C-N 3.32Å; Q533-I535 PolarHBondContact O-N 2.74Å; Q533-M536 PolarHBondContact O-N 3.33Å; Q533-D537 WeakPolarHBondContact CG-OD2 3.38Å; Q533-D537 PolarHBondContact NE2-OD1 2.71Å; Q533-D537 PolarHBondContact NE2-OD2 3.01Å; Q533-D537 WeakPolarHBondContact O-CB 3.28Å; Q533-D537 VanDerWaalsContact O-CG 3.24Å; Q533-D537 PolarHBondContact O-N 2.75Å; Q533-I734 PolarHBondContact NE2-O 2.98Å
534	T	86.9	Confident	86.3	Confident	58 Å²	58	37.2 Å²	37.2	36%	0.356	20%	0.2	S	C	.	.	H	α-helix	trans	-58.7	-41.5	178.7	-50.3	0	0	0	0	112.6	T530 Y531 T538	T530-T534 PolarHBondContact O-OG1 3.01Å; Y531-T534 PolarHBondContact O-N 3.01Å; Y531-T534 VanDerWaalsContact O-N 3.15Å; T534-T538 VanDerWaalsContact O-CB 3.26Å; T534-T538 WeakPolarHBondContact O-CB 3.41Å; T534-T538 PolarHBondContact O-N 2.87Å; T534-T538 PolarHBondContact O-OG1 2.83Å
535	I	88.4	Confident	87.3	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-49.1	177.3	-66.9	164.5	0	0	0	110	W486 L490 F525 Y526 Y531 C532 Q533 T538 V539 I572	W486-I535 HydrophobicContact CD2-CG2 4.3Å; W486-I535 HydrophobicContact CE3-CB 4.48Å; W486-I535 HydrophobicContact CE3-CG1 4.12Å; W486-I535 HydrophobicContact CE3-CG2 3.91Å; W486-I535 HydrophobicContact CH2-CD1 4.4Å; W486-I535 HydrophobicContact CH2-CG1 4.47Å; W486-I535 HydrophobicContact CH2-CG2 4.17Å; W486-I535 HydrophobicContact CZ2-CG2 4.5Å; W486-I535 HydrophobicContact CZ3-CB 4.4Å; W486-I535 HydrophobicContact CZ3-CD1 4.03Å; W486-I535 HydrophobicContact CZ3-CG1 3.71Å; W486-I535 HydrophobicContact CZ3-CG2 3.88Å; L490-I535 HydrophobicContact CD2-CD1 3.88Å; L490-I535 HydrophobicContact CD2-CG1 3.93Å; F525-I535 HydrophobicContact CB-CD1 4.05Å; Y526-I535 HydrophobicContact CD2-CB 4.37Å; Y526-I535 HydrophobicContact CD2-CD1 4.18Å; Y526-I535 HydrophobicContact CD2-CG2 4.01Å; Y526-I535 HydrophobicContact CE2-CG2 4.37Å; Y531-I535 VanDerWaalsContact O-CG1 3.25Å; Y531-I535 WeakPolarHBondContact O-CG1 3.42Å; Y531-I535 PolarHBondContact O-N 3.35Å; C532-I535 PolarHBondContact O-N 2.64Å; Q533-I535 VanDerWaalsContact C-N 3.32Å; Q533-I535 PolarHBondContact O-N 2.74Å; I535-T538 PolarHBondContact O-N 2.81Å; I535-V539 WeakPolarHBondContact O-CG2 3.42Å; I535-V539 PolarHBondContact O-N 3.25Å; I535-I572 HydrophobicContact CG2-CD1 3.7Å; I535-I572 HydrophobicContact CG2-CG1 4.26Å
536	M	90.8	Very high	88.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.8	-43	-178.1	-169	55.1	53.6	0	0	112.2	Y526 C532 Q533 A540 I572 D575 L576 V733 Y735	Y526-M536 HydrophobicContact CE2-CE 3.84Å; Y526-M536 WeakPolarHBondContact OH-CE 3.31Å; C532-M536 WeakPolarHBondContact O-CB 3.27Å; C532-M536 PolarHBondContact O-N 2.81Å; Q533-M536 PolarHBondContact O-N 3.33Å; M536-A540 WeakPolarHBondContact O-CB 3.44Å; M536-A540 PolarHBondContact O-N 3.02Å; M536-I572 HydrophobicContact CE-CB 4.48Å; M536-I572 HydrophobicContact CE-CG2 3.87Å; M536-I572 HydrophobicContact SD-CG2 4.47Å; M536-D575 HydrophobicContact CE-CB 4.29Å; M536-L576 HydrophobicContact SD-CB 3.71Å; M536-L576 HydrophobicContact SD-CD1 3.8Å; M536-L576 HydrophobicContact SD-CG 4.2Å; M536-V733 HydrophobicContact CB-CG1 4.19Å; M536-V733 HydrophobicContact CG-CG1 4.07Å; M536-Y735 HydrophobicContact CE-CD1 4.39Å; M536-Y735 HydrophobicContact CE-CE1 3.93Å; M536-Y735 HydrophobicContact CG-CD1 3.67Å; M536-Y735 HydrophobicContact CG-CE1 3.93Å; M536-Y735 HydrophobicContact SD-CD1 3.74Å; M536-Y735 HydrophobicContact SD-CE1 3.9Å
537	D	90.7	Very high	89.1	Confident	35 Å²	35	38.9 Å²	38.9	19%	0.187	20%	0.199	C	C	.	.	H	α-helix	trans	-63.9	-45.5	175.9	-70.3	-20.4	0	0	0	111.4	Q533 Q541 H736	Q533-D537 WeakPolarHBondContact CG-OD2 3.38Å; Q533-D537 PolarHBondContact NE2-OD1 2.71Å; Q533-D537 PolarHBondContact NE2-OD2 3.01Å; Q533-D537 WeakPolarHBondContact O-CB 3.28Å; Q533-D537 VanDerWaalsContact O-CG 3.24Å; Q533-D537 PolarHBondContact O-N 2.75Å; D537-Q541 WeakPolarHBondContact O-CB 3.28Å; D537-Q541 WeakPolarHBondContact O-CG 3.42Å; D537-Q541 PolarHBondContact O-N 2.81Å; D537-H736 IonicContact OD1-CE1 3.85Å; D537-H736 PolarHBondContact OD1-CE1 3.49Å; D537-H736 IonicContact OD1-ND1 2.7Å; D537-H736 PolarHBondContact OD1-ND1 2.83Å
538	T	91.6	Very high	90	Very high	33 Å²	33	37.1 Å²	37.1	20%	0.202	20%	0.198	C	C	.	.	H	α-helix	trans	-60.5	-49.8	178.2	-58.8	0	0	0	0	110.9	W486 A489 T534 I535 Q541 E542	W486-T538 HydrophobicContact CB-CG2 3.7Å; A489-T538 HydrophobicContact CB-CG2 3.71Å; T534-T538 VanDerWaalsContact O-CB 3.26Å; T534-T538 WeakPolarHBondContact O-CB 3.41Å; T534-T538 PolarHBondContact O-N 2.87Å; T534-T538 PolarHBondContact O-OG1 2.83Å; I535-T538 PolarHBondContact O-N 2.81Å; T538-Q541 PolarHBondContact O-N 3.28Å; T538-E542 WeakPolarHBondContact O-CB 3.35Å; T538-E542 PolarHBondContact O-N 3.49Å
539	V	93.8	Very high	90.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65.5	-43.2	-177.4	170.6	0	0	0	0	111.6	V434 V484 W486 I535 I543 I572	V434-V539 HydrophobicContact CG1-CG1 4.24Å; V434-V539 HydrophobicContact CG2-CG1 4.23Å; V484-V539 HydrophobicContact CG1-CG1 4.36Å; W486-V539 HydrophobicContact CB-CG2 3.53Å; W486-V539 HydrophobicContact CD2-CG2 4.08Å; W486-V539 HydrophobicContact CG-CG2 3.4Å; I535-V539 WeakPolarHBondContact O-CG2 3.42Å; I535-V539 PolarHBondContact O-N 3.25Å; V539-I543 HydrophobicContact CG1-CD1 3.78Å; V539-I543 WeakPolarHBondContact O-CB 3.47Å; V539-I543 WeakPolarHBondContact O-CD1 3.46Å; V539-I543 WeakPolarHBondContact O-CG1 3.28Å; V539-I543 PolarHBondContact O-N 3.1Å; V539-I572 HydrophobicContact CB-CG2 4.11Å; V539-I572 HydrophobicContact CG1-CG2 3.86Å; V539-I572 HydrophobicContact CG2-CG2 4.1Å
540	A	95.3	Very high	92.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67.4	-43.6	178.1	0	0	0	0	0	112.4	M536 N544 L576 H736	M536-A540 WeakPolarHBondContact O-CB 3.44Å; M536-A540 PolarHBondContact O-N 3.02Å; A540-N544 PolarHBondContact O-N 2.9Å; A540-N544 VanDerWaalsContact O-N 3.09Å; A540-L576 HydrophobicContact CB-CD1 4.03Å; A540-L576 HydrophobicContact CB-CD2 4.17Å; A540-H736 HydrophobicContact CB-CB 3.79Å
541	Q	94.8	Very high	93.3	Very high	112 Å²	112	33.6 Å²	33.6	52%	0.523	17%	0.169	S	C	.	.	H	α-helix	trans	-66.9	-38.2	177.9	-69.4	170.8	26.6	0	0	111.9	D537 T538 N544 R545	D537-Q541 WeakPolarHBondContact O-CB 3.28Å; D537-Q541 WeakPolarHBondContact O-CG 3.42Å; D537-Q541 PolarHBondContact O-N 2.81Å; T538-Q541 PolarHBondContact O-N 3.28Å; Q541-N544 PolarHBondContact O-N 2.99Å; Q541-R545 WeakPolarHBondContact O-CB 3.36Å; Q541-R545 PolarHBondContact O-N 2.83Å
542	E	95.2	Very high	94	Very high	31 Å²	31	39.1 Å²	39.1	15%	0.145	19%	0.194	C	C	.	.	H	α-helix	trans	-68.5	-42.5	177.6	178.2	61.9	-176.6	0	0	112	V484 T538 N544 R545 L546	V484-E542 HydrophobicContact CG1-CB 4.12Å; V484-E542 HydrophobicContact CG1-CG 3.75Å; T538-E542 WeakPolarHBondContact O-CB 3.35Å; T538-E542 PolarHBondContact O-N 3.49Å; E542-N544 VanDerWaalsContact C-N 3.35Å; E542-N544 PolarHBondContact O-N 2.7Å; E542-R545 VanDerWaalsContact CD-NH2 3.28Å; E542-R545 PolarHBondContact O-N 2.87Å; E542-R545 IonicContact OE1-CZ 3.9Å; E542-R545 IonicContact OE1-NE 3.81Å; E542-R545 IonicContact OE1-NH2 2.68Å; E542-R545 PolarHBondContact OE1-NH2 3.25Å; E542-R545 IonicContact OE2-CZ 3.79Å; E542-R545 IonicContact OE2-NE 3.59Å; E542-R545 PolarHBondContact OE2-NE 3.18Å; E542-R545 IonicContact OE2-NH2 2.79Å; E542-R545 PolarHBondContact OE2-NH2 3.19Å; E542-R545 VanDerWaalsContact OE2-NH2 3.12Å; E542-L546 HydrophobicContact CG-CD1 3.95Å; E542-L546 HydrophobicContact CG-CG 4.42Å; E542-L546 WeakPolarHBondContact O-CB 3.38Å; E542-L546 VanDerWaalsContact O-CG 3.24Å; E542-L546 WeakPolarHBondContact O-CG 3.5Å; E542-L546 PolarHBondContact O-N 3.21Å
543	I	97.4	Very high	94.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57.9	-47.7	172.8	-72.1	166.2	0	0	0	110.6	F432 V434 V484 V539 L546 Y547 L573 L576 L738 F740	F432-I543 HydrophobicContact CD2-CG2 4.14Å; F432-I543 HydrophobicContact CE2-CG2 4.44Å; F432-I543 HydrophobicContact CG-CG2 4.28Å; V434-I543 HydrophobicContact CG2-CD1 4.16Å; V484-I543 HydrophobicContact CB-CG1 4.44Å; V484-I543 HydrophobicContact CG1-CD1 4.5Å; V484-I543 HydrophobicContact CG1-CG1 3.85Å; V484-I543 HydrophobicContact CG2-CG1 3.69Å; V539-I543 HydrophobicContact CG1-CD1 3.78Å; V539-I543 WeakPolarHBondContact O-CB 3.47Å; V539-I543 WeakPolarHBondContact O-CD1 3.46Å; V539-I543 WeakPolarHBondContact O-CG1 3.28Å; V539-I543 PolarHBondContact O-N 3.1Å; I543-L546 PolarHBondContact O-N 2.82Å; I543-Y547 VanDerWaalsContact O-CB 3.32Å; I543-Y547 WeakPolarHBondContact O-CB 3.46Å; I543-Y547 PolarHBondContact O-N 2.85Å; I543-L573 HydrophobicContact CD1-CD2 4Å; I543-L576 HydrophobicContact CD1-CD2 4.41Å; I543-L738 HydrophobicContact CB-CD2 4.17Å; I543-L738 HydrophobicContact CG2-CD2 3.69Å; I543-F740 HydrophobicContact CG2-CE1 3.61Å; I543-F740 HydrophobicContact CG2-CZ 3.55Å
544	N	97.7	Very high	94.8	Very high	22 Å²	22	39.5 Å²	39.5	12%	0.118	20%	0.195	C	C	.	.	H	α-helix	trans	-66.8	-37.5	178.4	-74.8	-0.4	0	0	0	112.3	A540 Q541 E542 Y547 A548 S737 L738 D739	A540-N544 PolarHBondContact O-N 2.9Å; A540-N544 VanDerWaalsContact O-N 3.09Å; Q541-N544 PolarHBondContact O-N 2.99Å; E542-N544 VanDerWaalsContact C-N 3.35Å; E542-N544 PolarHBondContact O-N 2.7Å; N544-Y547 PolarHBondContact O-N 3.27Å; N544-A548 VanDerWaalsContact O-CB 3.31Å; N544-A548 WeakPolarHBondContact O-CB 3.32Å; N544-A548 PolarHBondContact O-N 2.74Å; N544-S737 PolarHBondContact ND2-O 2.96Å; N544-L738 WeakPolarHBondContact OD1-CA 3.36Å; N544-D739 WeakPolarHBondContact CB-OD2 3.44Å; N544-D739 VanDerWaalsContact CG-OD2 3.26Å; N544-D739 PolarHBondContact ND2-OD2 2.93Å; N544-D739 PolarHBondContact OD1-N 3.14Å
545	R	97.1	Very high	95.2	Very high	105 Å²	105	40.7 Å²	40.7	40%	0.396	20%	0.203	S	C	.	.	H	α-helix	trans	-61.3	-48.9	174	-172.9	-168.5	69.7	84	2.7	111.4	Y316 Q541 E542 A548 L549	Y316-R545 PolarHBondContact O-NH2 3.2Å; Q541-R545 WeakPolarHBondContact O-CB 3.36Å; Q541-R545 PolarHBondContact O-N 2.83Å; E542-R545 VanDerWaalsContact CD-NH2 3.28Å; E542-R545 PolarHBondContact O-N 2.87Å; E542-R545 IonicContact OE1-CZ 3.9Å; E542-R545 IonicContact OE1-NE 3.81Å; E542-R545 IonicContact OE1-NH2 2.68Å; E542-R545 PolarHBondContact OE1-NH2 3.25Å; E542-R545 IonicContact OE2-CZ 3.79Å; E542-R545 IonicContact OE2-NE 3.59Å; E542-R545 PolarHBondContact OE2-NE 3.18Å; E542-R545 IonicContact OE2-NH2 2.79Å; E542-R545 PolarHBondContact OE2-NH2 3.19Å; E542-R545 VanDerWaalsContact OE2-NH2 3.12Å; R545-A548 PolarHBondContact O-N 3.02Å; R545-L549 VanDerWaalsContact O-CB 3.28Å; R545-L549 WeakPolarHBondContact O-CB 3.29Å; R545-L549 PolarHBondContact O-N 2.89Å
546	L	97.9	Very high	95.4	Very high	1 Å²	1	47 Å²	47	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-63.4	-41.8	178.7	-70.2	167.9	0	0	0	111.3	Y316 F432 V484 E542 I543 L549 F550	Y316-L546 HydrophobicContact CD1-CD2 4.08Å; Y316-L546 HydrophobicContact CG-CD2 4.45Å; Y316-L546 VanDerWaalsContact O-CD2 3.23Å; Y316-L546 WeakPolarHBondContact O-CD2 3.34Å; F432-L546 HydrophobicContact CD1-CB 4.2Å; F432-L546 HydrophobicContact CD1-CD1 4.4Å; F432-L546 HydrophobicContact CE1-CB 3.64Å; V484-L546 HydrophobicContact CB-CD1 4.49Å; V484-L546 HydrophobicContact CG2-CD1 3.99Å; E542-L546 HydrophobicContact CG-CD1 3.95Å; E542-L546 HydrophobicContact CG-CG 4.42Å; E542-L546 WeakPolarHBondContact O-CB 3.38Å; E542-L546 VanDerWaalsContact O-CG 3.24Å; E542-L546 WeakPolarHBondContact O-CG 3.5Å; E542-L546 PolarHBondContact O-N 3.21Å; I543-L546 PolarHBondContact O-N 2.82Å; L546-L549 PolarHBondContact O-N 3.06Å; L546-F550 VanDerWaalsContact O-CB 3.31Å; L546-F550 WeakPolarHBondContact O-CB 3.21Å; L546-F550 PolarHBondContact O-N 3.12Å
547	Y	98	Very high	95.7	Very high	49 Å²	49	48 Å²	48	19%	0.192	24%	0.241	C	C	.	.	H	α-helix	trans	-61.7	-52.1	174.2	171.7	-117.2	0	0	0	112.5	F432 I543 N544 L549 F550 M551 I561 D739 F740	F432-Y547 HydrophobicContact CZ-CD2 4.49Å; I543-Y547 VanDerWaalsContact O-CB 3.32Å; I543-Y547 WeakPolarHBondContact O-CB 3.46Å; I543-Y547 PolarHBondContact O-N 2.85Å; N544-Y547 PolarHBondContact O-N 3.27Å; Y547-L549 VanDerWaalsContact C-N 3.27Å; Y547-L549 PolarHBondContact O-N 2.93Å; Y547-F550 PolarHBondContact O-N 2.69Å; Y547-M551 HydrophobicContact CD2-CG 3.74Å; Y547-M551 HydrophobicContact CD2-SD 4.47Å; Y547-M551 HydrophobicContact CE2-CG 3.35Å; Y547-M551 HydrophobicContact CE2-SD 3.85Å; Y547-M551 HydrophobicContact CG-CG 4.46Å; Y547-M551 WeakPolarHBondContact O-CG 3.23Å; Y547-M551 PolarHBondContact O-N 2.75Å; Y547-I561 HydrophobicContact CD2-CD1 3.89Å; Y547-I561 HydrophobicContact CE2-CD1 3.43Å; Y547-I561 VanDerWaalsContact CE2-CD1 3.43Å; Y547-D739 HydrophobicContact CD1-CB 3.69Å; Y547-D739 HydrophobicContact CE1-CB 3.64Å; Y547-D739 VanDerWaalsContact CE1-O 3.27Å; Y547-D739 WeakPolarHBondContact CE1-O 2.96Å; Y547-F740 AromaticContact CD1-CD1 3.75Å; Y547-F740 HydrophobicContact CD1-CD1 3.75Å; Y547-F740 HydrophobicContact CD1-CE1 4.41Å; Y547-F740 AromaticContact CD2-CD1 3.89Å; Y547-F740 HydrophobicContact CD2-CD1 3.89Å; Y547-F740 HydrophobicContact CD2-CE1 4.4Å; Y547-F740 HydrophobicContact CE1-CB 4.26Å; Y547-F740 HydrophobicContact CE1-CD1 4.03Å; Y547-F740 HydrophobicContact CE2-CB 4.25Å; Y547-F740 HydrophobicContact CE2-CD1 4.2Å; Y547-F740 HydrophobicContact CE2-CG 4.46Å; Y547-F740 AromaticContact CG-CD1 3.63Å; Y547-F740 HydrophobicContact CG-CD1 3.63Å; Y547-F740 HydrophobicContact CG-CE1 4.01Å
548	A	97.9	Very high	95.7	Very high	55 Å²	55	55.2 Å²	55.2	46%	0.455	27%	0.266	S	S	.	.	H	α-helix	trans	-59.5	-38.5	178.3	0	0	0	0	0	111.9	N544 R545 K552	N544-A548 VanDerWaalsContact O-CB 3.31Å; N544-A548 WeakPolarHBondContact O-CB 3.32Å; N544-A548 PolarHBondContact O-N 2.74Å; R545-A548 PolarHBondContact O-N 3.02Å; A548-K552 WeakPolarHBondContact O-CB 3.46Å; A548-K552 PolarHBondContact O-N 3.36Å
549	L	97.3	Very high	95.8	Very high	40 Å²	40	54.9 Å²	54.9	21%	0.209	27%	0.269	C	S	.	.	H	α-helix	trans	-68.7	-42.2	175.9	-177.5	56.6	0	0	0	112.6	V315 Y316 R545 L546 Y547 K552 R553	V315-L549 HydrophobicContact CG1-CD1 4.49Å; V315-L549 HydrophobicContact CG1-CD2 4.09Å; V315-L549 HydrophobicContact CG1-CG 4.37Å; V315-L549 VanDerWaalsContact O-CD2 3.28Å; V315-L549 WeakPolarHBondContact O-CD2 3.4Å; Y316-L549 HydrophobicContact CD1-CD2 3.96Å; Y316-L549 HydrophobicContact CD1-CG 4.21Å; Y316-L549 HydrophobicContact CE1-CB 4.46Å; Y316-L549 HydrophobicContact CE1-CD2 4.3Å; Y316-L549 HydrophobicContact CE1-CG 4.05Å; R545-L549 VanDerWaalsContact O-CB 3.28Å; R545-L549 WeakPolarHBondContact O-CB 3.29Å; R545-L549 PolarHBondContact O-N 2.89Å; L546-L549 PolarHBondContact O-N 3.06Å; Y547-L549 VanDerWaalsContact C-N 3.27Å; Y547-L549 PolarHBondContact O-N 2.93Å; L549-K552 PolarHBondContact O-N 3.19Å; L549-R553 WeakPolarHBondContact O-CG 3.42Å; L549-R553 PolarHBondContact O-N 3.43Å; L549-R553 VanDerWaalsContact O-N 3.09Å
550	F	97.4	Very high	95.9	Very high	2 Å²	2	56 Å²	56	1%	0.009	28%	0.281	C	S	.	.	H	α-helix	trans	-62.4	-49.5	175.4	-179.6	-86.8	0	0	0	111	Y316 V427 L430 E480 L482 L546 Y547 K552 R553 N554 Y557	Y316-F550 HydrophobicContact CE1-CB 4.05Å; Y316-F550 HydrophobicContact CE1-CD2 4.48Å; V427-F550 HydrophobicContact CB-CZ 4.21Å; V427-F550 HydrophobicContact CG1-CZ 4.1Å; V427-F550 HydrophobicContact CG2-CZ 4.39Å; L430-F550 HydrophobicContact CD1-CD2 3.99Å; L430-F550 HydrophobicContact CD1-CE2 3.88Å; L430-F550 HydrophobicContact CD1-CG 4.46Å; L430-F550 HydrophobicContact CD1-CZ 4.26Å; L430-F550 HydrophobicContact CD2-CB 4.34Å; L430-F550 HydrophobicContact CD2-CD1 3.7Å; L430-F550 HydrophobicContact CD2-CD2 4.19Å; L430-F550 HydrophobicContact CD2-CE1 3.97Å; L430-F550 HydrophobicContact CD2-CE2 4.43Å; L430-F550 HydrophobicContact CD2-CG 3.82Å; L430-F550 HydrophobicContact CD2-CZ 4.33Å; E480-F550 HydrophobicContact CB-CE2 4.45Å; E480-F550 HydrophobicContact CG-CE2 4.3Å; L482-F550 HydrophobicContact CD1-CB 4.5Å; L482-F550 HydrophobicContact CD1-CD2 4.27Å; L546-F550 VanDerWaalsContact O-CB 3.31Å; L546-F550 WeakPolarHBondContact O-CB 3.21Å; L546-F550 PolarHBondContact O-N 3.12Å; Y547-F550 PolarHBondContact O-N 2.69Å; F550-K552 VanDerWaalsContact C-N 3.33Å; F550-K552 PolarHBondContact O-N 3.41Å; F550-R553 PolarHBondContact O-N 2.6Å; F550-R553 VanDerWaalsContact O-N 3.08Å; F550-N554 WeakPolarHBondContact CD2-ND2 3.35Å; F550-N554 HydrophobicContact CE1-CB 4.23Å; F550-N554 WeakPolarHBondContact CE2-ND2 3.36Å; F550-N554 HydrophobicContact CZ-CB 4.49Å; F550-N554 VanDerWaalsContact CZ-ND2 3.33Å; F550-N554 WeakPolarHBondContact CZ-ND2 3.45Å; F550-N554 WeakPolarHBondContact O-CB 3.44Å; F550-N554 PolarHBondContact O-N 2.61Å; F550-Y557 AromaticContact CE1-CD1 3.88Å; F550-Y557 HydrophobicContact CE1-CD1 3.88Å; F550-Y557 AromaticContact CE1-CD2 3.73Å; F550-Y557 HydrophobicContact CE1-CD2 3.73Å; F550-Y557 HydrophobicContact CE1-CE1 4.11Å; F550-Y557 AromaticContact CE1-CE2 3.96Å; F550-Y557 HydrophobicContact CE1-CE2 3.96Å; F550-Y557 AromaticContact CE1-CG 3.67Å; F550-Y557 HydrophobicContact CE1-CG 3.67Å; F550-Y557 AromaticContact CZ-CD2 3.98Å; F550-Y557 HydrophobicContact CZ-CD2 3.98Å; F550-Y557 HydrophobicContact CZ-CE2 4.02Å; F550-Y557 HydrophobicContact CZ-CG 4.38Å
551	M	97.1	Very high	96	Very high	49 Å²	49	56.9 Å²	56.9	24%	0.241	29%	0.285	C	S	.	.	H	α-helix	trans	-64.1	-36.4	178.5	-66.2	-55.2	-65.7	0	0	112.4	Y547 R553 N554 P555 Y557	Y547-M551 HydrophobicContact CD2-CG 3.74Å; Y547-M551 HydrophobicContact CD2-SD 4.47Å; Y547-M551 HydrophobicContact CE2-CG 3.35Å; Y547-M551 HydrophobicContact CE2-SD 3.85Å; Y547-M551 HydrophobicContact CG-CG 4.46Å; Y547-M551 WeakPolarHBondContact O-CG 3.23Å; Y547-M551 PolarHBondContact O-N 2.75Å; M551-R553 VanDerWaalsContact C-N 3.29Å; M551-R553 PolarHBondContact O-N 3.35Å; M551-N554 CarbonylContact O-C 3.47Å; M551-N554 PolarHBondContact O-N 2.99Å; M551-P555 WeakPolarHBondContact O-CA 3.33Å; M551-Y557 HydrophobicContact CE-CD1 4.32Å; M551-Y557 HydrophobicContact SD-CD1 3.73Å; M551-Y557 HydrophobicContact SD-CG 4.37Å
552	K	96.3	Very high	96.2	Very high	174 Å²	174	51.5 Å²	51.5	76%	0.757	26%	0.26	S	S	*	.	H	α-helix	trans	-62.4	-34.5	172.4	-178.8	-176.4	177.1	-173.1	0	112.5	A548 L549 F550	A548-K552 WeakPolarHBondContact O-CB 3.46Å; A548-K552 PolarHBondContact O-N 3.36Å; L549-K552 PolarHBondContact O-N 3.19Å; F550-K552 VanDerWaalsContact C-N 3.33Å; F550-K552 PolarHBondContact O-N 3.41Å
553	R	93.9	Very high	96.3	Very high	27 Å²	27	50 Å²	50	10%	0.102	25%	0.253	C	S	.	.	H	α-helix	trans	-84	-28.5	178.7	-72.5	176	68.2	88.3	-9.7	113	R297 G301 D304 L549 F550 M551 P555	R297-R553 PolarHBondContact NH1-O 3.43Å; R297-R553 PolarHBondContact NH2-O 3.09Å; G301-R553 PolarHBondContact O-NE 3.31Å; G301-R553 PolarHBondContact O-NH2 3.27Å; D304-R553 VanDerWaalsContact CG-NH1 3.32Å; D304-R553 IonicContact OD1-CZ 2.83Å; D304-R553 IonicContact OD1-NH1 3.96Å; D304-R553 PolarHBondContact OD1-NH1 2.88Å; D304-R553 VanDerWaalsContact OD1-NH1 3.14Å; D304-R553 IonicContact OD1-NH2 2.62Å; D304-R553 PolarHBondContact OD1-NH2 3.2Å; D304-R553 IonicContact OD2-CZ 3.6Å; D304-R553 IonicContact OD2-NH1 2.72Å; D304-R553 PolarHBondContact OD2-NH1 3.49Å; D304-R553 IonicContact OD2-NH2 3.81Å; L549-R553 WeakPolarHBondContact O-CG 3.42Å; L549-R553 PolarHBondContact O-N 3.43Å; L549-R553 VanDerWaalsContact O-N 3.09Å; F550-R553 PolarHBondContact O-N 2.6Å; F550-R553 VanDerWaalsContact O-N 3.08Å; M551-R553 VanDerWaalsContact C-N 3.29Å; M551-R553 PolarHBondContact O-N 3.35Å; R553-P555 VanDerWaalsContact C-CD 3.48Å; R553-P555 WeakPolarHBondContact O-CD 3.42Å
554	N	95.1	Very high	96.4	Very high	36 Å²	36	50.1 Å²	50.1	19%	0.193	25%	0.254	C	S	.	.			trans	-124.5	65	-174.5	-56.7	-37.1	0	0	0	110.8	F550 M551 D556 Y557	F550-N554 WeakPolarHBondContact CD2-ND2 3.35Å; F550-N554 HydrophobicContact CE1-CB 4.23Å; F550-N554 WeakPolarHBondContact CE2-ND2 3.36Å; F550-N554 HydrophobicContact CZ-CB 4.49Å; F550-N554 VanDerWaalsContact CZ-ND2 3.33Å; F550-N554 WeakPolarHBondContact CZ-ND2 3.45Å; F550-N554 WeakPolarHBondContact O-CB 3.44Å; F550-N554 PolarHBondContact O-N 2.61Å; M551-N554 CarbonylContact O-C 3.47Å; M551-N554 PolarHBondContact O-N 2.99Å; N554-D556 PolarHBondContact O-N 3.44Å; N554-D556 VanDerWaalsContact O-N 3.15Å; N554-Y557 WeakPolarHBondContact O-CB 3.28Å; N554-Y557 PolarHBondContact O-N 3.27Å
555	P	94.8	Very high	96.3	Very high	82 Å²	82	49.1 Å²	49.1	53%	0.532	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-23	-171.6	27	-36.7	0	0	0	114.1	M551 R553 Y557 R558	M551-P555 WeakPolarHBondContact O-CA 3.33Å; R553-P555 VanDerWaalsContact C-CD 3.48Å; R553-P555 WeakPolarHBondContact O-CD 3.42Å; P555-Y557 VanDerWaalsContact C-N 3.34Å; P555-R558 PolarHBondContact O-NH1 2.87Å; P555-R558 PolarHBondContact O-NH2 3.08Å
556	D	93.8	Very high	96.1	Very high	134 Å²	134	44.5 Å²	44.5	72%	0.717	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	2.6	177.6	-61.5	-58.9	0	0	0	113.6	N554 R558	N554-D556 PolarHBondContact O-N 3.44Å; N554-D556 VanDerWaalsContact O-N 3.15Å; D556-R558 PolarHBondContact O-N 3.18Å
557	Y	96.1	Very high	95.7	Very high	21 Å²	21	44.5 Å²	44.5	8%	0.082	23%	0.231	C	C	.	.			trans	-63.7	125.8	178.1	-176.3	-100.2	0	0	0	112.5	V427 H429 L430 F550 M551 N554 P555 G559 G560 I561	V427-Y557 HydrophobicContact CB-CD2 4.46Å; V427-Y557 HydrophobicContact CB-CE2 4.15Å; V427-Y557 HydrophobicContact CG1-CE2 3.98Å; V427-Y557 VanDerWaalsContact O-CE2 3.31Å; V427-Y557 WeakPolarHBondContact O-CE2 3.3Å; H429-Y557 VanDerWaalsContact C-OH 3.23Å; H429-Y557 WeakPolarHBondContact CA-OH 3.39Å; L430-Y557 PolarHBondContact N-OH 3.42Å; F550-Y557 AromaticContact CE1-CD1 3.88Å; F550-Y557 HydrophobicContact CE1-CD1 3.88Å; F550-Y557 AromaticContact CE1-CD2 3.73Å; F550-Y557 HydrophobicContact CE1-CD2 3.73Å; F550-Y557 HydrophobicContact CE1-CE1 4.11Å; F550-Y557 AromaticContact CE1-CE2 3.96Å; F550-Y557 HydrophobicContact CE1-CE2 3.96Å; F550-Y557 AromaticContact CE1-CG 3.67Å; F550-Y557 HydrophobicContact CE1-CG 3.67Å; F550-Y557 AromaticContact CZ-CD2 3.98Å; F550-Y557 HydrophobicContact CZ-CD2 3.98Å; F550-Y557 HydrophobicContact CZ-CE2 4.02Å; F550-Y557 HydrophobicContact CZ-CG 4.38Å; M551-Y557 HydrophobicContact CE-CD1 4.32Å; M551-Y557 HydrophobicContact SD-CD1 3.73Å; M551-Y557 HydrophobicContact SD-CG 4.37Å; N554-Y557 WeakPolarHBondContact O-CB 3.28Å; N554-Y557 PolarHBondContact O-N 3.27Å; P555-Y557 VanDerWaalsContact C-N 3.34Å; Y557-G559 VanDerWaalsContact CE1-O 3.29Å; Y557-G559 WeakPolarHBondContact CE1-O 3.29Å; Y557-G559 VanDerWaalsContact CZ-CA 3.44Å; Y557-G559 WeakPolarHBondContact OH-CA 3.2Å; Y557-G560 PolarHBondContact OH-O 3.09Å; Y557-I561 HydrophobicContact CE1-CG1 4.29Å
558	R	91.8	Very high	95.2	Very high	187 Å²	187	42.2 Å²	42.2	71%	0.706	22%	0.223	S	C	*	.			trans	-129.5	15	175.7	-52.7	-64	172.5	-99.5	-7.7	112.5	P555 D556	P555-R558 PolarHBondContact O-NH1 2.87Å; P555-R558 PolarHBondContact O-NH2 3.08Å; D556-R558 PolarHBondContact O-N 3.18Å
559	G	93.8	Very high	95	Very high	26 Å²	26	39.6 Å²	39.6	27%	0.268	20%	0.201	S	C	.	.			trans	-73.4	167.7	-177.9	0	0	0	0	0	113.5	D428 Y557	D428-G559 WeakPolarHBondContact O-CA 3.37Å; Y557-G559 VanDerWaalsContact CE1-O 3.29Å; Y557-G559 WeakPolarHBondContact CE1-O 3.29Å; Y557-G559 VanDerWaalsContact CZ-CA 3.44Å; Y557-G559 WeakPolarHBondContact OH-CA 3.2Å
560	G	95.2	Very high	94.9	Very high	24 Å²	24	37.7 Å²	37.7	25%	0.247	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	161	173.9	0	0	0	0	0	112.1	D428 H429 L430 Y557	D428-G560 PolarHBondContact O-N 3.41Å; H429-G560 WeakPolarHBondContact CA-O 3.31Å; H429-G560 WeakPolarHBondContact ND1-CA 3.43Å; H429-G560 PolarHBondContact ND1-O 3.31Å; L430-G560 PolarHBondContact N-O 3.19Å; Y557-G560 PolarHBondContact OH-O 3.09Å
561	I	97.8	Very high	94.7	Very high	17 Å²	17	37.6 Å²	37.6	9%	0.087	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	139.7	174.9	-51.3	176.1	0	0	0	107.9	L430 F432 Y547 Y557 F740 P742 V743	L430-I561 HydrophobicContact CB-CG1 4.47Å; L430-I561 HydrophobicContact CB-CG2 4.44Å; L430-I561 CarbonylContact O-C 3.54Å; L430-I561 WeakPolarHBondContact O-CA 3.42Å; F432-I561 HydrophobicContact CD2-CG2 3.98Å; F432-I561 HydrophobicContact CE2-CG2 3.66Å; Y547-I561 HydrophobicContact CD2-CD1 3.89Å; Y547-I561 HydrophobicContact CE2-CD1 3.43Å; Y547-I561 VanDerWaalsContact CE2-CD1 3.43Å; Y557-I561 HydrophobicContact CE1-CG1 4.29Å; I561-F740 HydrophobicContact CB-CD2 3.91Å; I561-F740 HydrophobicContact CB-CE2 4.2Å; I561-F740 HydrophobicContact CD1-CB 3.94Å; I561-F740 HydrophobicContact CD1-CD2 4.11Å; I561-F740 HydrophobicContact CD1-CG 3.96Å; I561-F740 HydrophobicContact CG2-CD2 3.54Å; I561-F740 HydrophobicContact CG2-CE2 3.36Å; I561-F740 HydrophobicContact CG2-CG 4.28Å; I561-F740 HydrophobicContact CG2-CZ 4Å; I561-P742 CarbonylContact O-C 3.55Å; I561-P742 WeakPolarHBondContact O-CA 3.33Å; I561-V743 PolarHBondContact O-N 3.48Å
562	S	98.4	Very high	94.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	166.7	177	-69.2	0	0	0	0	110.7	H429 L430 V431 F432 N744	H429-S562 PolarHBondContact CE1-OG 2.69Å; H429-S562 WeakPolarHBondContact NE2-CB 3.14Å; H429-S562 PolarHBondContact NE2-N 3.1Å; H429-S562 PolarHBondContact NE2-OG 2.9Å; L430-S562 PolarHBondContact O-N 2.92Å; V431-S562 WeakPolarHBondContact CA-O 3.42Å; F432-S562 PolarHBondContact N-O 3.46Å; S562-N744 VanDerWaalsContact CA-O 3.31Å; S562-N744 WeakPolarHBondContact CA-O 3.28Å; S562-N744 WeakPolarHBondContact CB-O 3.45Å; S562-N744 PolarHBondContact OG-N 3.06Å; S562-N744 PolarHBondContact OG-O 2.96Å
563	V	98.5	Very high	94.5	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	147	171.5	-59.3	0	0	0	0	110.3	F432 L573 L577 F740 P742 N744 F745 F746	F432-V563 HydrophobicContact CB-CG1 4.34Å; F432-V563 CarbonylContact O-C 3.6Å; F432-V563 WeakPolarHBondContact O-CA 3.45Å; V563-L573 HydrophobicContact CB-CD1 3.91Å; V563-L573 HydrophobicContact CB-CD2 4.06Å; V563-L573 HydrophobicContact CG1-CD2 4.35Å; V563-L573 HydrophobicContact CG2-CD1 4.02Å; V563-L573 HydrophobicContact CG2-CD2 4.11Å; V563-L577 HydrophobicContact CG2-CD1 3.87Å; V563-F740 HydrophobicContact CG1-CE2 4.46Å; V563-P742 HydrophobicContact CG1-CB 4.44Å; V563-P742 HydrophobicContact CG1-CG 4.29Å; V563-N744 PolarHBondContact N-O 3.28Å; V563-F745 HydrophobicContact CG2-CB 3.95Å; V563-F745 HydrophobicContact CG2-CD2 3.75Å; V563-F745 HydrophobicContact CG2-CG 4.01Å; V563-F745 WeakPolarHBondContact O-CA 3.4Å; V563-F746 PolarHBondContact O-N 2.78Å
564	A	98.2	Very high	94.6	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.008	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	123.8	175.6	0	0	0	0	0	109.5	V431 F432 M433 V434 F746	V431-A564 HydrophobicContact CG1-CB 3.85Å; F432-A564 PolarHBondContact O-N 2.95Å; M433-A564 CarbonylContact C-O 3.55Å; M433-A564 VanDerWaalsContact CA-O 3.29Å; M433-A564 WeakPolarHBondContact CA-O 3.34Å; M433-A564 HydrophobicContact CE-CB 4.25Å; M433-A564 HydrophobicContact CG-CB 4.31Å; V434-A564 PolarHBondContact N-O 2.82Å; A564-F746 CarbonylContact C-O 3.54Å; A564-F746 VanDerWaalsContact CA-O 3.23Å; A564-F746 WeakPolarHBondContact CA-O 3.49Å; A564-F746 HydrophobicContact CB-CB 4.23Å
565	G	95.7	Very high	94.6	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.01	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	144.2	173.6	0	0	0	0	0	110.5	S570 F746 L748	G565-S570 VanDerWaalsContact C-OG 3.22Å; G565-S570 PolarHBondContact O-OG 3.41Å; G565-S570 VanDerWaalsContact O-OG 3.1Å; G565-F746 PolarHBondContact N-O 2.9Å; G565-L748 VanDerWaalsContact O-CB 3.3Å; G565-L748 WeakPolarHBondContact O-CB 3.16Å; G565-L748 WeakPolarHBondContact O-CG 3.49Å; G565-L748 PolarHBondContact O-N 3.35Å
566	H	92.7	Very high	94.6	Very high	8 Å²	8	20.9 Å²	20.9	4%	0.037	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.3	163.1	171.7	-105.5	0	0	0	109.6	V434 G436 L568 G569 L748 H927 Y930 W931	V434-H566 PolarHBondContact O-N 3.36Å; G436-H566 WeakPolarHBondContact CA-O 3.2Å; G436-H566 PolarHBondContact N-O 2.9Å; H566-L568 PolarHBondContact O-N 2.9Å; H566-G569 WeakPolarHBondContact O-CA 3.5Å; H566-G569 PolarHBondContact O-N 3.27Å; H566-L748 CarbonylContact C-O 3.51Å; H566-L748 WeakPolarHBondContact CA-O 3.27Å; H566-H927 AromaticContact CE1-NE2 3.77Å; H566-H927 AromaticContact NE2-NE2 3.85Å; H566-H927 PolarHBondContact NE2-O 2.91Å; H566-Y930 AromaticContact CD2-CD2 3.73Å; H566-Y930 AromaticContact NE2-CD2 3.85Å; H566-W931 HydrophobicContact CB-CH2 4.02Å; H566-W931 HydrophobicContact CB-CZ2 3.54Å; H566-W931 AromaticContact CG-CZ2 3.71Å; H566-W931 AromaticContact ND1-CZ2 3.87Å
567	S	89.2	Confident	94.7	Very high	1 Å²	1	14.5 Å²	14.5	1%	0.007	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	-132.3	176.9	-166.5	0	0	0	0	111.6	G569 S570 L748 G749 P751 H927	S567-G569 PolarHBondContact O-N 3.29Å; S567-G569 VanDerWaalsContact O-N 3.08Å; S567-S570 WeakPolarHBondContact O-CB 3.43Å; S567-S570 PolarHBondContact O-N 3.17Å; S567-S570 PolarHBondContact O-OG 3.42Å; S567-L748 PolarHBondContact N-O 3.39Å; S567-G749 WeakPolarHBondContact CA-O 3.45Å; S567-P751 VanDerWaalsContact O-CD 3.27Å; S567-P751 WeakPolarHBondContact O-CD 3.26Å; S567-H927 VanDerWaalsContact CB-CE1 3.49Å; S567-H927 WeakPolarHBondContact CB-CE1 3.41Å; S567-H927 VanDerWaalsContact CB-NE2 3.27Å; S567-H927 WeakPolarHBondContact CB-NE2 3.31Å; S567-H927 PolarHBondContact OG-CE1 3.05Å; S567-H927 VanDerWaalsContact OG-CE1 3.26Å; S567-H927 PolarHBondContact OG-NE2 3.24Å
568	L	88.6	Confident	94.6	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.01	8%	0.078	C	C	.	.	H	α-helix	trans	-51.5	-26.4	173.3	178.5	66.3	0	0	0	114	G436 I437 D522 V523 Y526 H566 S570 L571 I572	G436-L568 WeakPolarHBondContact O-CB 3.38Å; G436-L568 WeakPolarHBondContact O-CD2 3.49Å; I437-L568 HydrophobicContact CD1-CB 4.28Å; I437-L568 HydrophobicContact CG1-CB 3.86Å; I437-L568 HydrophobicContact CG1-CD2 4.29Å; D522-L568 HydrophobicContact CB-CD2 4.16Å; V523-L568 HydrophobicContact CG2-CD2 4.18Å; Y526-L568 HydrophobicContact CD1-CD1 3.85Å; Y526-L568 HydrophobicContact CG-CD1 4.07Å; H566-L568 PolarHBondContact O-N 2.9Å; L568-S570 PolarHBondContact O-N 2.96Å; L568-L571 HydrophobicContact CD1-CB 4.34Å; L568-L571 HydrophobicContact CD1-CD2 3.97Å; L568-L571 WeakPolarHBondContact O-CA 3.36Å; L568-L571 WeakPolarHBondContact O-CB 3.15Å; L568-L571 PolarHBondContact O-N 3.46Å; L568-I572 HydrophobicContact CG-CD1 4.09Å; L568-I572 HydrophobicContact CG-CG1 4.43Å; L568-I572 WeakPolarHBondContact O-CG1 3.31Å; L568-I572 PolarHBondContact O-N 3.33Å
569	G	92.8	Very high	94.7	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-65.2	-27.1	176.8	0	0	0	0	0	112.3	H566 S567 L573	H566-G569 WeakPolarHBondContact O-CA 3.5Å; H566-G569 PolarHBondContact O-N 3.27Å; S567-G569 PolarHBondContact O-N 3.29Å; S567-G569 VanDerWaalsContact O-N 3.08Å; G569-L573 WeakPolarHBondContact O-CB 3.37Å; G569-L573 WeakPolarHBondContact O-CG 3.37Å; G569-L573 PolarHBondContact O-N 2.75Å
570	S	95.3	Very high	94.7	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-66.7	-41.1	168.8	-53.5	0	0	0	0	111.8	G565 S567 L568 F574 F745 L748 S750	G565-S570 VanDerWaalsContact C-OG 3.22Å; G565-S570 PolarHBondContact O-OG 3.41Å; G565-S570 VanDerWaalsContact O-OG 3.1Å; S567-S570 WeakPolarHBondContact O-CB 3.43Å; S567-S570 PolarHBondContact O-N 3.17Å; S567-S570 PolarHBondContact O-OG 3.42Å; L568-S570 PolarHBondContact O-N 2.96Å; S570-F574 VanDerWaalsContact O-CB 3.3Å; S570-F574 WeakPolarHBondContact O-CB 3.34Å; S570-F574 PolarHBondContact O-N 3.48Å; S570-F745 WeakPolarHBondContact O-CZ 3.22Å; S570-L748 PolarHBondContact OG-N 2.89Å; S570-S750 VanDerWaalsContact CB-OG 3.28Å; S570-S750 WeakPolarHBondContact CB-OG 3.47Å
571	L	93.2	Very high	94.3	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-68.3	-43.1	177.1	-179.3	67.4	0	0	0	111.5	Y526 L568 L573 F574 D575 I752 F755	Y526-L571 HydrophobicContact CD1-CD2 3.81Å; Y526-L571 HydrophobicContact CD1-CG 4.48Å; Y526-L571 HydrophobicContact CE1-CD2 3.64Å; Y526-L571 HydrophobicContact CE1-CG 3.87Å; L568-L571 HydrophobicContact CD1-CB 4.34Å; L568-L571 HydrophobicContact CD1-CD2 3.97Å; L568-L571 WeakPolarHBondContact O-CA 3.36Å; L568-L571 WeakPolarHBondContact O-CB 3.15Å; L568-L571 PolarHBondContact O-N 3.46Å; L571-L573 PolarHBondContact O-N 2.88Å; L571-F574 PolarHBondContact O-N 2.72Å; L571-D575 WeakPolarHBondContact O-CB 3.31Å; L571-D575 PolarHBondContact O-N 2.81Å; L571-I752 HydrophobicContact CD1-CG1 4.42Å; L571-F755 HydrophobicContact CD1-CB 3.68Å; L571-F755 HydrophobicContact CD1-CG 4.13Å; L571-F755 HydrophobicContact CD2-CB 3.92Å; L571-F755 HydrophobicContact CD2-CD1 3.49Å; L571-F755 VanDerWaalsContact CD2-CD1 3.49Å; L571-F755 HydrophobicContact CD2-CD2 3.65Å; L571-F755 HydrophobicContact CD2-CE1 3.83Å; L571-F755 HydrophobicContact CD2-CE2 3.98Å; L571-F755 HydrophobicContact CD2-CG 3.38Å; L571-F755 HydrophobicContact CD2-CZ 4.06Å; L571-F755 HydrophobicContact CG-CB 4.46Å; L571-F755 HydrophobicContact CG-CG 4.39Å
572	I	93.4	Very high	93	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-56.9	-50	175.2	-67.8	165.2	0	0	0	110.2	W486 Y526 I535 M536 V539 L568 D575 L576	W486-I572 HydrophobicContact CH2-CD1 4.35Å; W486-I572 HydrophobicContact CZ2-CD1 3.71Å; Y526-I572 HydrophobicContact CD2-CD1 4.47Å; Y526-I572 HydrophobicContact CD2-CG1 3.95Å; Y526-I572 HydrophobicContact CE2-CG1 3.68Å; Y526-I572 HydrophobicContact CG-CG1 4.5Å; I535-I572 HydrophobicContact CG2-CD1 3.7Å; I535-I572 HydrophobicContact CG2-CG1 4.26Å; M536-I572 HydrophobicContact CE-CB 4.48Å; M536-I572 HydrophobicContact CE-CG2 3.87Å; M536-I572 HydrophobicContact SD-CG2 4.47Å; V539-I572 HydrophobicContact CB-CG2 4.11Å; V539-I572 HydrophobicContact CG1-CG2 3.86Å; V539-I572 HydrophobicContact CG2-CG2 4.1Å; L568-I572 HydrophobicContact CG-CD1 4.09Å; L568-I572 HydrophobicContact CG-CG1 4.43Å; L568-I572 WeakPolarHBondContact O-CG1 3.31Å; L568-I572 PolarHBondContact O-N 3.33Å; I572-D575 PolarHBondContact O-N 2.97Å; I572-L576 VanDerWaalsContact O-CB 3.27Å; I572-L576 WeakPolarHBondContact O-CB 3.49Å; I572-L576 PolarHBondContact O-N 2.98Å
573	L	96.9	Very high	91.1	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-65.2	-38.5	176.7	-77.7	174.4	0	0	0	112.9	V434 I543 V563 G569 L571 L576 L577 F745	V434-L573 HydrophobicContact CB-CD1 3.98Å; V434-L573 HydrophobicContact CB-CG 4.22Å; V434-L573 HydrophobicContact CG2-CD1 3.76Å; V434-L573 HydrophobicContact CG2-CD2 3.9Å; V434-L573 HydrophobicContact CG2-CG 3.85Å; I543-L573 HydrophobicContact CD1-CD2 4Å; V563-L573 HydrophobicContact CB-CD1 3.91Å; V563-L573 HydrophobicContact CB-CD2 4.06Å; V563-L573 HydrophobicContact CG1-CD2 4.35Å; V563-L573 HydrophobicContact CG2-CD1 4.02Å; V563-L573 HydrophobicContact CG2-CD2 4.11Å; G569-L573 WeakPolarHBondContact O-CB 3.37Å; G569-L573 WeakPolarHBondContact O-CG 3.37Å; G569-L573 PolarHBondContact O-N 2.75Å; L571-L573 PolarHBondContact O-N 2.88Å; L573-L576 PolarHBondContact O-N 3.01Å; L573-L577 VanDerWaalsContact O-CB 3.3Å; L573-L577 WeakPolarHBondContact O-CB 3.39Å; L573-L577 VanDerWaalsContact O-CG 3.23Å; L573-L577 WeakPolarHBondContact O-CG 3.49Å; L573-L577 PolarHBondContact O-N 2.87Å; L573-F745 HydrophobicContact CB-CD2 4.4Å; L573-F745 HydrophobicContact CB-CE1 4.27Å; L573-F745 HydrophobicContact CB-CE2 3.71Å; L573-F745 HydrophobicContact CB-CZ 3.65Å; L573-F745 HydrophobicContact CD1-CD2 4.26Å; L573-F745 HydrophobicContact CD1-CE2 3.82Å; L573-F745 HydrophobicContact CG-CE2 4.46Å
574	F	96.1	Very high	88.4	Confident	9 Å²	9	28.5 Å²	28.5	4%	0.039	16%	0.161	C	C	.	.	H	α-helix	trans	-63.3	-45.9	177.4	-172.9	-87.2	0	0	0	111.7	S570 L571 S578 F745 I752 L756 Y768 L770 F776	S570-F574 VanDerWaalsContact O-CB 3.3Å; S570-F574 WeakPolarHBondContact O-CB 3.34Å; S570-F574 PolarHBondContact O-N 3.48Å; L571-F574 PolarHBondContact O-N 2.72Å; F574-S578 WeakPolarHBondContact CE1-OG 3.29Å; F574-S578 VanDerWaalsContact O-CB 3.22Å; F574-S578 WeakPolarHBondContact O-CB 3.23Å; F574-S578 PolarHBondContact O-N 2.91Å; F574-S578 PolarHBondContact O-OG 3.36Å; F574-F745 HydrophobicContact CB-CE1 3.93Å; F574-F745 HydrophobicContact CB-CZ 4.42Å; F574-F745 HydrophobicContact CD2-CE1 4.18Å; F574-I752 HydrophobicContact CB-CD1 3.69Å; F574-I752 HydrophobicContact CB-CG1 4.01Å; F574-I752 HydrophobicContact CD1-CG2 4.21Å; F574-I752 HydrophobicContact CD2-CD1 3.93Å; F574-I752 HydrophobicContact CD2-CG2 4.07Å; F574-I752 HydrophobicContact CE1-CG2 4.45Å; F574-I752 HydrophobicContact CE2-CG2 4.3Å; F574-I752 HydrophobicContact CG-CD1 4.01Å; F574-I752 HydrophobicContact CG-CG1 4.31Å; F574-I752 HydrophobicContact CG-CG2 4.02Å; F574-I752 HydrophobicContact CZ-CG2 4.49Å; F574-L756 HydrophobicContact CE1-CD1 4Å; F574-L756 HydrophobicContact CE1-CD2 3.99Å; F574-L756 HydrophobicContact CZ-CD1 4.07Å; F574-Y768 HydrophobicContact CZ-CE1 4.39Å; F574-L770 HydrophobicContact CE2-CD2 4.36Å; F574-F776 HydrophobicContact CD2-CE2 4.17Å; F574-F776 HydrophobicContact CD2-CZ 4.29Å; F574-F776 HydrophobicContact CE2-CZ 4.43Å
575	D	94.4	Very high	85.4	Confident	8 Å²	8	32.7 Å²	32.7	4%	0.043	20%	0.196	C	C	.	.	H	α-helix	trans	-64.6	-43.3	177	-70.5	-21.6	0	0	0	111	Y526 M536 L571 I572 N579 Y735 R759	Y526-D575 WeakPolarHBondContact CE1-OD2 3.35Å; Y526-D575 WeakPolarHBondContact OH-CB 3.5Å; Y526-D575 PolarHBondContact OH-OD2 3.07Å; M536-D575 HydrophobicContact CE-CB 4.29Å; L571-D575 WeakPolarHBondContact O-CB 3.31Å; L571-D575 PolarHBondContact O-N 2.81Å; I572-D575 PolarHBondContact O-N 2.97Å; D575-N579 PolarHBondContact O-N 2.83Å; D575-N579 PolarHBondContact O-ND2 2.82Å; D575-Y735 HydrophobicContact CB-CE1 3.97Å; D575-R759 IonicContact OD1-CZ 2.7Å; D575-R759 IonicContact OD1-NH1 2.71Å; D575-R759 PolarHBondContact OD1-NH1 3.48Å; D575-R759 IonicContact OD1-NH2 2.85Å; D575-R759 IonicContact OD2-CZ 3.2Å; D575-R759 IonicContact OD2-NH1 3.58Å; D575-R759 PolarHBondContact OD2-NH1 2.9Å; D575-R759 IonicContact OD2-NH2 3.35Å; D575-R759 PolarHBondContact OD2-NH2 3.24Å
576	L	95.4	Very high	82.3	Confident	0 Å²	0	36 Å²	36	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61	-48.2	176.8	-177.3	58.4	0	0	0	112.1	M536 A540 I543 I572 L573 N579 Q580 Y735 H736 L738	M536-L576 HydrophobicContact SD-CB 3.71Å; M536-L576 HydrophobicContact SD-CD1 3.8Å; M536-L576 HydrophobicContact SD-CG 4.2Å; A540-L576 HydrophobicContact CB-CD1 4.03Å; A540-L576 HydrophobicContact CB-CD2 4.17Å; I543-L576 HydrophobicContact CD1-CD2 4.41Å; I572-L576 VanDerWaalsContact O-CB 3.27Å; I572-L576 WeakPolarHBondContact O-CB 3.49Å; I572-L576 PolarHBondContact O-N 2.98Å; L573-L576 PolarHBondContact O-N 3.01Å; L576-N579 PolarHBondContact O-N 2.82Å; L576-Q580 WeakPolarHBondContact O-CG 3.37Å; L576-Q580 PolarHBondContact O-N 2.82Å; L576-Q580 PolarHBondContact O-NE2 2.87Å; L576-Y735 HydrophobicContact CD1-CD1 4.44Å; L576-H736 WeakPolarHBondContact CD1-O 3.38Å; L576-L738 HydrophobicContact CD2-CD2 4.11Å
577	L	95.9	Very high	79.5	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-69.9	-38.3	-178.6	-69.1	-177.2	0	0	0	112.6	V563 L573 N579 Q580 L738 P742 F745 L770 C773	V563-L577 HydrophobicContact CG2-CD1 3.87Å; L573-L577 VanDerWaalsContact O-CB 3.3Å; L573-L577 WeakPolarHBondContact O-CB 3.39Å; L573-L577 VanDerWaalsContact O-CG 3.23Å; L573-L577 WeakPolarHBondContact O-CG 3.49Å; L573-L577 PolarHBondContact O-N 2.87Å; L577-N579 PolarHBondContact O-N 3.01Å; L577-Q580 HydrophobicContact CD2-CG 4.35Å; L577-Q580 PolarHBondContact O-N 3.33Å; L577-L738 HydrophobicContact CD2-CD1 3.89Å; L577-P742 HydrophobicContact CD2-CG 3.86Å; L577-F745 HydrophobicContact CD1-CB 3.84Å; L577-F745 HydrophobicContact CD1-CD1 3.7Å; L577-F745 HydrophobicContact CD1-CE1 4.47Å; L577-F745 HydrophobicContact CD1-CG 3.83Å; L577-L770 HydrophobicContact CB-CD1 4.25Å; L577-L770 HydrophobicContact CB-CD2 4.2Å; L577-L770 HydrophobicContact CD1-CD1 4.19Å; L577-C773 HydrophobicContact CD1-CB 4.16Å
578	S	94.1	Very high	76.8	Confident	25 Å²	25	49.5 Å²	49.5	18%	0.175	30%	0.301	C	S	.	.	H	α-helix	trans	-63	-24.3	178.2	-62	0	0	0	0	113	F574 Y768 L770	F574-S578 WeakPolarHBondContact CE1-OG 3.29Å; F574-S578 VanDerWaalsContact O-CB 3.22Å; F574-S578 WeakPolarHBondContact O-CB 3.23Å; F574-S578 PolarHBondContact O-N 2.91Å; F574-S578 PolarHBondContact O-OG 3.36Å; S578-Y768 VanDerWaalsContact CB-OH 3.25Å; S578-Y768 WeakPolarHBondContact CB-OH 3.38Å; S578-Y768 PolarHBondContact OG-OH 2.98Å; S578-L770 WeakPolarHBondContact OG-CD2 3.26Å
579	N	93.6	Very high	74.4	Confident	75 Å²	75	57.3 Å²	57.3	40%	0.401	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	8.9	-179.4	-70.8	-85.7	0	0	0	113.9	D575 L576 L577 Y735	D575-N579 PolarHBondContact O-N 2.83Å; D575-N579 PolarHBondContact O-ND2 2.82Å; L576-N579 PolarHBondContact O-N 2.82Å; L577-N579 PolarHBondContact O-N 3.01Å; N579-Y735 HydrophobicContact CB-CD1 4.06Å; N579-Y735 HydrophobicContact CB-CD2 3.42Å; N579-Y735 VanDerWaalsContact CB-CD2 3.42Å; N579-Y735 HydrophobicContact CB-CE2 4.04Å; N579-Y735 HydrophobicContact CB-CG 3.43Å; N579-Y735 VanDerWaalsContact CB-CG 3.43Å; N579-Y735 VanDerWaalsContact CG-CE2 3.46Å; N579-Y735 WeakPolarHBondContact ND2-CE2 3.44Å
580	Q	93.1	Very high	71.7	Confident	11 Å²	11	63.1 Å²	63.1	5%	0.051	38%	0.38	C	S	.	.			trans	-68.9	157.8	173.8	-63.8	-59.5	-60.2	0	0	111.8	L576 L577 H736 S737 P771 T772	L576-Q580 WeakPolarHBondContact O-CG 3.37Å; L576-Q580 PolarHBondContact O-N 2.82Å; L576-Q580 PolarHBondContact O-NE2 2.87Å; L577-Q580 HydrophobicContact CD2-CG 4.35Å; L577-Q580 PolarHBondContact O-N 3.33Å; Q580-H736 PolarHBondContact NE2-O 2.69Å; Q580-S737 VanDerWaalsContact OE1-CA 3.28Å; Q580-P771 HydrophobicContact CB-CB 4.48Å; Q580-P771 VanDerWaalsContact O-CB 3.24Å; Q580-P771 WeakPolarHBondContact O-CB 3.44Å; Q580-P771 WeakPolarHBondContact O-CG 3.39Å; Q580-T772 HydrophobicContact CB-CG2 3.81Å; Q580-T772 WeakPolarHBondContact CB-OG1 3.3Å
581	K	86.1	Confident	68.6	Low	166 Å²	166	67.9 Å²	67.9	72%	0.722	42%	0.419	S	S	*	.			trans	-115.8	123.5	176.2	-63.5	173.4	-174.8	171.2	0	108.5	V583	K581-V583 PolarHBondContact O-N 3.35Å
582	T	70.7	Confident	65.8	Low	71 Å²	71	72.7 Å²	72.7	44%	0.436	46%	0.459	S	S	.	.			trans	-58.7	131.1	175.1	-44.2	0	0	0	0	109.8	S584 P771	T582-S584 PolarHBondContact O-N 2.85Å; T582-P771 PolarHBondContact OG1-O 2.93Å
583	V	58.2	Low	62.8	Low	104 Å²	104	78.7 Å²	78.7	63%	0.63	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-65.8	-11.8	-168.8	-175.2	0	0	0	0	113.5	K581 A585 A586	K581-V583 PolarHBondContact O-N 3.35Å; V583-A585 PolarHBondContact O-N 2.82Å; V583-A586 PolarHBondContact O-N 3.37Å
584	S	42.6	Very low	59.6	Low	116 Å²	116	83.6 Å²	83.6	81%	0.811	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-63.9	5.6	-179.8	-167	0	0	0	0	116.4	T582	T582-S584 PolarHBondContact O-N 2.85Å
585	A	35.6	Very low	56.4	Low	90 Å²	90	87.2 Å²	87.2	74%	0.744	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-102.1	7.7	176.8	0	0	0	0	0	114.3	V583	V583-A585 PolarHBondContact O-N 2.82Å
586	A	29.8	Very low	53.3	Low	69 Å²	69	95.1 Å²	95.1	57%	0.57	61%	0.612	S	S	*	*	S	Bend	trans	-76.9	126.1	171.7	0	0	0	0	0	111.4	V583 L588	V583-A586 PolarHBondContact O-N 3.37Å; A586-L588 PolarHBondContact O-N 3.37Å
587	P	34.4	Very low	50.1	Low	123 Å²	123	99 Å²	99	80%	0.799	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-62.7	123.4	176	-23.5	34.6	0	0	0	112.1	L589	P587-L589 PolarHBondContact O-N 2.86Å
588	L	32.7	Very low	46.7	Very low	171 Å²	171	108 Å²	108	90%	0.895	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-68.5	117.6	178.4	-71.5	169.7	0	0	0	111	A586	A586-L588 PolarHBondContact O-N 3.37Å
589	L	37.5	Very low	43.6	Very low	165 Å²	165	112.4 Å²	112.4	86%	0.864	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-65.3	129.5	172.3	-65.7	174.6	0	0	0	110.4	P587	P587-L589 PolarHBondContact O-N 2.86Å
590	P	36.7	Very low	40.3	Very low	123 Å²	123	114.4 Å²	114.4	80%	0.799	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-66.1	140.9	179.4	-22.3	33.7	0	0	0	113.2
591	A	30.9	Very low	37	Very low	100 Å²	100	118.3 Å²	118.3	83%	0.826	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-73.7	146	176.6	0	0	0	0	0	112.6
592	A	33.4	Very low	34.3	Very low	101 Å²	101	116.2 Å²	116.2	84%	0.835	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-80.3	135.5	-177.5	0	0	0	0	0	113.5
593	P	31.4	Very low	32	Very low	125 Å²	125	117.3 Å²	117.3	81%	0.812	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-91.6	159	166	35.6	-32.6	0	0	0	112.5
594	A	28.3	Very low	30.5	Very low	104 Å²	104	116.5 Å²	116.5	86%	0.86	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-82.4	162.2	179.9	0	0	0	0	0	113.7
595	A	30.4	Very low	29.7	Very low	85 Å²	85	119.9 Å²	119.9	70%	0.702	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-82.5	151.8	-168.1	0	0	0	0	0	115.8
596	N	29.4	Very low	29	Very low	174 Å²	174	124.5 Å²	124.5	93%	0.93	81%	0.807	S	S	*	*				173.6	142.5	126.9	-87	-31.4	0	0	0	111.7
597	G	27.7	Very low	29	Very low	82 Å²	82	126.9 Å²	126.9	85%	0.845	82%	0.817	S	S	*	*			trans	127.2	146.5	173.7	0	0	0	0	0	113.6
598	E	24.7	Very low	28.6	Very low	187 Å²	187	125.2 Å²	125.2	87%	0.874	81%	0.808	S	S	*	*			trans	-139.2	154.3	-162.1	-150.2	-173.2	-176.8	0	0	114.3
599	V	29.1	Very low	28.3	Very low	118 Å²	118	128.7 Å²	128.7	72%	0.715	81%	0.81	S	S	*	*			trans	65.1	103.1	166.5	-155.5	0	0	0	0	118.6
600	S	22.7	Very low	28	Very low	117 Å²	117	128.4 Å²	128.4	82%	0.818	80%	0.804	S	S	*	*				164.5	127.9	118.6	-71.6	0	0	0	0	113.1
601	A	24.3	Very low	27.7	Very low	93 Å²	93	132 Å²	132	77%	0.769	81%	0.81	S	S	*	*			trans	-83	165.7	161.9	0	0	0	0	0	109.5
602	P	29.2	Very low	27.7	Very low	122 Å²	122	136 Å²	136	79%	0.792	81%	0.811	S	S	*	*			cis	-148	174.8	28.7	44.5	-25.1	0	0	0	119.3
603	A	24.2	Very low	27.8	Very low	94 Å²	94	139.8 Å²	139.8	78%	0.777	81%	0.812	S	S	*	*			trans	74.5	132.1	143.7	0	0	0	0	0	122.6
604	A	26.1	Very low	27.9	Very low	88 Å²	88	141 Å²	141	73%	0.727	81%	0.812	S	S	*	*			trans	83.5	132.9	143.2	0	0	0	0	0	121.5
605	E	24.8	Very low	28.6	Very low	186 Å²	186	142.9 Å²	142.9	87%	0.869	80%	0.802	S	S	*	*			trans	64.6	90.6	146.2	-69.1	164.2	-152	0	0	119.4
606	E	22.4	Very low	29.6	Very low	187 Å²	187	144.2 Å²	144.2	87%	0.874	79%	0.794	S	S	*	*			trans	-79	142.9	142.3	-69.5	-166.7	164.5	0	0	110.4
607	P	28.8	Very low	31.1	Very low	119 Å²	119	141.8 Å²	141.8	77%	0.773	78%	0.777	S	S	*	*			trans	-102.5	105.5	156.4	33.2	-23.9	0	0	0	110.1
608	S	25.7	Very low	33.2	Very low	88 Å²	88	139.7 Å²	139.7	62%	0.615	75%	0.745	S	S	*	*			trans	-61	147.1	162.8	49.3	0	0	0	0	110.1
609	R	27.6	Very low	35.3	Very low	245 Å²	245	140.1 Å²	140.1	93%	0.925	75%	0.747	S	S	*	*			trans	-112.3	95.8	163.1	-81.6	-173.6	172.1	175	-2.9	108.2
610	E	29.8	Very low	37.7	Very low	159 Å²	159	138.1 Å²	138.1	74%	0.743	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-74.8	144.8	163.4	-68.4	164	-155.2	0	0	108.3
611	E	31.1	Very low	40.6	Very low	199 Å²	199	133.2 Å²	133.2	93%	0.93	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-87.3	116	169.4	-66	-172.4	150	0	0	107.6
612	E	29.8	Very low	43.4	Very low	182 Å²	182	130.2 Å²	130.2	85%	0.85	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-75.9	125.2	-172.5	-62.7	-179.7	123.1	0	0	111.6	D614	E612-D614 PolarHBondContact O-N 3.34Å
613	E	36.2	Very low	46.1	Very low	181 Å²	181	126 Å²	126	85%	0.846	65%	0.648	S	S	*	*			trans	-73.2	114.6	160.3	-72.9	-168.4	149.5	0	0	109.1	Q615	E613-Q615 PolarHBondContact O-N 2.81Å
614	D	33	Very low	49	Very low	151 Å²	151	121.6 Å²	121.6	81%	0.807	61%	0.611	S	S	*	*			trans	-51.9	107	-176.4	-84.7	-52.1	0	0	0	113.4	E612 E616	E612-D614 PolarHBondContact O-N 3.34Å; D614-E616 PolarHBondContact O-N 3.23Å; D614-E616 VanDerWaalsContact O-N 3.16Å
615	Q	43.5	Very low	51.8	Low	143 Å²	143	117.4 Å²	117.4	67%	0.668	58%	0.576	S	S	*	*			trans	-85.6	75	172.9	-74.4	-176.8	77	0	0	111	E613 E617 R682	E613-Q615 PolarHBondContact O-N 2.81Å; Q615-E617 PolarHBondContact O-N 2.76Å; Q615-R682 VanDerWaalsContact OE1-NH2 3.08Å
616	E	51.6	Low	54.8	Low	114 Å²	114	116.1 Å²	116.1	53%	0.533	57%	0.568	S	S	.	*			trans	-63.6	92.4	166.5	-75.1	-159.4	144.3	0	0	110.6	D614 F618 H627 R675	D614-E616 PolarHBondContact O-N 3.23Å; D614-E616 VanDerWaalsContact O-N 3.16Å; E616-F618 HydrophobicContact CB-CE1 4.41Å; E616-F618 HydrophobicContact CB-CZ 4.38Å; E616-F618 VanDerWaalsContact OE2-CZ 3.31Å; E616-F618 WeakPolarHBondContact OE2-CZ 3.33Å; E616-H627 IonicContact OE2-CE1 3.61Å; E616-H627 IonicContact OE2-ND1 2.71Å; E616-R675 PolarHBondContact O-NH2 2.76Å
617	E	59.9	Low	57.8	Low	122 Å²	122	112.5 Å²	112.5	57%	0.57	55%	0.551	S	S	*	*			trans	-90.1	116.1	158.1	-68.3	-168.1	167.1	0	0	108.4	Q615 E619 R682	Q615-E617 PolarHBondContact O-N 2.76Å; E617-E619 PolarHBondContact O-N 2.81Å; E617-R682 IonicContact OE1-CZ 2.68Å; E617-R682 IonicContact OE1-NH1 2.67Å; E617-R682 PolarHBondContact OE1-NH1 2.92Å; E617-R682 IonicContact OE1-NH2 2.76Å
618	F	72.4	Confident	60.6	Low	39 Å²	39	108.2 Å²	108.2	17%	0.171	52%	0.521	C	S	.	.			trans	-77.4	115.7	-179.1	-62.8	-61.9	0	0	0	110.2	E616 D620 A623 V624 H627 I644 F671	E616-F618 HydrophobicContact CB-CE1 4.41Å; E616-F618 HydrophobicContact CB-CZ 4.38Å; E616-F618 VanDerWaalsContact OE2-CZ 3.31Å; E616-F618 WeakPolarHBondContact OE2-CZ 3.33Å; F618-D620 VanDerWaalsContact C-N 3.34Å; F618-D620 PolarHBondContact O-N 2.92Å; F618-A623 HydrophobicContact CB-CB 4.38Å; F618-A623 HydrophobicContact CD1-CB 4.12Å; F618-V624 HydrophobicContact CB-CG2 3.66Å; F618-V624 HydrophobicContact CD2-CG2 3.89Å; F618-V624 HydrophobicContact CG-CG2 3.9Å; F618-H627 HydrophobicContact CE1-CB 4.23Å; F618-H627 AromaticContact CE1-ND1 3.96Å; F618-H627 HydrophobicContact CZ-CB 4.16Å; F618-H627 AromaticContact CZ-CE1 3.99Å; F618-H627 AromaticContact CZ-CG 3.81Å; F618-H627 AromaticContact CZ-ND1 3.52Å; F618-I644 WeakPolarHBondContact O-CD1 3.47Å; F618-F671 HydrophobicContact CD2-CE2 4.13Å; F618-F671 AromaticContact CD2-CZ 3.91Å; F618-F671 HydrophobicContact CD2-CZ 3.91Å; F618-F671 AromaticContact CE2-CE2 3.75Å; F618-F671 HydrophobicContact CE2-CE2 3.75Å; F618-F671 HydrophobicContact CE2-CZ 4.03Å
619	E	68.5	Low	63.5	Low	196 Å²	196	106 Å²	106	92%	0.916	51%	0.512	S	S	*	.			trans	-64.8	-33.5	-177.2	-59.6	-175	144.9	0	0	113.5	E617	E617-E619 PolarHBondContact O-N 2.81Å
620	D	80.4	Confident	66.5	Low	76 Å²	76	94.5 Å²	94.5	41%	0.406	47%	0.469	S	S	.	.	S	Bend	trans	-142.7	166.5	-176.2	97.2	-34.4	0	0	0	114.1	F618 A622 A623 V624	F618-D620 VanDerWaalsContact C-N 3.34Å; F618-D620 PolarHBondContact O-N 2.92Å; D620-A622 VanDerWaalsContact C-N 3.25Å; D620-A622 VanDerWaalsContact CG-N 3.32Å; D620-A622 PolarHBondContact O-N 2.8Å; D620-A622 WeakPolarHBondContact OD1-CA 3.28Å; D620-A622 WeakPolarHBondContact OD1-CB 3.44Å; D620-A622 PolarHBondContact OD1-N 2.88Å; D620-A622 VanDerWaalsContact OD1-N 3.1Å; D620-A622 WeakPolarHBondContact OD2-CB 3.34Å; D620-A622 PolarHBondContact OD2-N 2.8Å; D620-A623 PolarHBondContact O-N 3.49Å; D620-A623 WeakPolarHBondContact OD1-CB 3.33Å; D620-A623 PolarHBondContact OD1-N 2.94Å; D620-V624 PolarHBondContact O-N 3.27Å
621	L	84.4	Confident	69.4	Low	14 Å²	14	89.9 Å²	89.9	7%	0.073	45%	0.454	C	S	.	.	H	α-helix	trans	-65.9	-26.4	178.4	-179.1	60.7	0	0	0	112.4	V624 L625 L637 M642 L647	L621-V624 PolarHBondContact O-N 3.49Å; L621-L625 HydrophobicContact CD1-CD1 4.2Å; L621-L625 HydrophobicContact CD1-CG 4.14Å; L621-L625 HydrophobicContact CG-CD1 3.91Å; L621-L625 HydrophobicContact CG-CG 4.32Å; L621-L625 WeakPolarHBondContact O-CB 3.4Å; L621-L625 VanDerWaalsContact O-CG 3.29Å; L621-L625 WeakPolarHBondContact O-CG 3.36Å; L621-L625 PolarHBondContact O-N 3.39Å; L621-L637 HydrophobicContact CD2-CB 3.99Å; L621-M642 VanDerWaalsContact CD2-O 3.3Å; L621-M642 WeakPolarHBondContact CD2-O 3.41Å; L621-L647 HydrophobicContact CD1-CD2 3.8Å
622	A	82.8	Confident	72.1	Confident	30 Å²	30	86.1 Å²	86.1	25%	0.248	44%	0.437	C	S	.	.	H	α-helix	trans	-67.4	-40.3	176.7	0	0	0	0	0	111.7	D620 L625 K626 K634	D620-A622 VanDerWaalsContact C-N 3.25Å; D620-A622 VanDerWaalsContact CG-N 3.32Å; D620-A622 PolarHBondContact O-N 2.8Å; D620-A622 WeakPolarHBondContact OD1-CA 3.28Å; D620-A622 WeakPolarHBondContact OD1-CB 3.44Å; D620-A622 PolarHBondContact OD1-N 2.88Å; D620-A622 VanDerWaalsContact OD1-N 3.1Å; D620-A622 WeakPolarHBondContact OD2-CB 3.34Å; D620-A622 PolarHBondContact OD2-N 2.8Å; A622-L625 PolarHBondContact O-N 3.1Å; A622-K626 WeakPolarHBondContact O-CB 3.16Å; A622-K626 PolarHBondContact O-N 2.96Å; A622-K634 HydrophobicContact CB-CD 4.14Å
623	A	84.3	Confident	75	Confident	34 Å²	34	79.7 Å²	79.7	28%	0.281	41%	0.405	S	S	.	.	H	α-helix	trans	-61.6	-46.7	174.5	0	0	0	0	0	111.4	F618 D620 L625 K626 H627	F618-A623 HydrophobicContact CB-CB 4.38Å; F618-A623 HydrophobicContact CD1-CB 4.12Å; D620-A623 PolarHBondContact O-N 3.49Å; D620-A623 WeakPolarHBondContact OD1-CB 3.33Å; D620-A623 PolarHBondContact OD1-N 2.94Å; A623-L625 PolarHBondContact O-N 3.24Å; A623-K626 PolarHBondContact O-N 3.39Å; A623-H627 WeakPolarHBondContact O-CB 3.3Å; A623-H627 PolarHBondContact O-N 2.59Å
624	V	85.8	Confident	77.4	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.006	38%	0.379	C	S	.	.	H	α-helix	trans	-57	-51.3	175	174.1	0	0	0	0	111.5	F618 D620 L621 K626 H627 L628 L647 F671	F618-V624 HydrophobicContact CB-CG2 3.66Å; F618-V624 HydrophobicContact CD2-CG2 3.89Å; F618-V624 HydrophobicContact CG-CG2 3.9Å; D620-V624 PolarHBondContact O-N 3.27Å; L621-V624 PolarHBondContact O-N 3.49Å; V624-K626 VanDerWaalsContact C-N 3.32Å; V624-K626 PolarHBondContact O-N 3.34Å; V624-H627 PolarHBondContact O-N 3.42Å; V624-L628 HydrophobicContact CG1-CD1 4.11Å; V624-L628 WeakPolarHBondContact O-CG 3.23Å; V624-L628 PolarHBondContact O-N 2.92Å; V624-L647 HydrophobicContact CG1-CD2 4.07Å; V624-F671 HydrophobicContact CB-CZ 4.35Å; V624-F671 HydrophobicContact CG1-CD1 4.03Å; V624-F671 HydrophobicContact CG1-CE1 3.48Å; V624-F671 VanDerWaalsContact CG1-CE1 3.48Å; V624-F671 HydrophobicContact CG1-CE2 4.24Å; V624-F671 HydrophobicContact CG1-CZ 3.59Å; V624-F671 HydrophobicContact CG2-CE1 4.28Å; V624-F671 HydrophobicContact CG2-CZ 3.93Å
625	L	86.1	Confident	79.9	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-67.7	-31.8	-179	-67.3	169.5	0	0	0	112.6	L621 A622 A623 G629 L630 S631 K634 L637	L621-L625 HydrophobicContact CD1-CD1 4.2Å; L621-L625 HydrophobicContact CD1-CG 4.14Å; L621-L625 HydrophobicContact CG-CD1 3.91Å; L621-L625 HydrophobicContact CG-CG 4.32Å; L621-L625 WeakPolarHBondContact O-CB 3.4Å; L621-L625 VanDerWaalsContact O-CG 3.29Å; L621-L625 WeakPolarHBondContact O-CG 3.36Å; L621-L625 PolarHBondContact O-N 3.39Å; A622-L625 PolarHBondContact O-N 3.1Å; A623-L625 PolarHBondContact O-N 3.24Å; L625-G629 PolarHBondContact O-N 3.49Å; L625-L630 HydrophobicContact CD2-CB 4.18Å; L625-L630 CarbonylContact O-C 3.54Å; L625-L630 PolarHBondContact O-N 3.19Å; L625-S631 PolarHBondContact O-N 2.68Å; L625-K634 HydrophobicContact CD1-CB 3.83Å; L625-K634 HydrophobicContact CD1-CG 4.03Å; L625-L637 HydrophobicContact CD1-CD1 3.57Å; L625-L637 HydrophobicContact CD2-CD1 3.6Å; L625-L637 HydrophobicContact CG-CD1 4.16Å
626	K	86.3	Confident	82	Confident	158 Å²	158	66.6 Å²	66.6	69%	0.687	35%	0.351	S	S	*	.	H	α-helix	trans	-67.7	-46	173.4	-176	-174.5	175.6	-166.7	0	111.6	A622 A623 V624 L628 G629 S631	A622-K626 WeakPolarHBondContact O-CB 3.16Å; A622-K626 PolarHBondContact O-N 2.96Å; A623-K626 PolarHBondContact O-N 3.39Å; V624-K626 VanDerWaalsContact C-N 3.32Å; V624-K626 PolarHBondContact O-N 3.34Å; K626-L628 VanDerWaalsContact C-N 3.33Å; K626-L628 PolarHBondContact O-N 2.59Å; K626-G629 PolarHBondContact O-N 2.83Å; K626-G629 VanDerWaalsContact O-N 3.07Å; K626-S631 WeakPolarHBondContact CA-OG 3.4Å
627	H	86.7	Confident	83.7	Confident	112 Å²	112	61.1 Å²	61.1	52%	0.519	33%	0.325	S	S	.	.	H	α-helix	trans	-59.7	-42.6	175.6	179.5	107.9	0	0	0	111.3	E616 F618 A623 V624 G629	E616-H627 IonicContact OE2-CE1 3.61Å; E616-H627 IonicContact OE2-ND1 2.71Å; F618-H627 HydrophobicContact CE1-CB 4.23Å; F618-H627 AromaticContact CE1-ND1 3.96Å; F618-H627 HydrophobicContact CZ-CB 4.16Å; F618-H627 AromaticContact CZ-CE1 3.99Å; F618-H627 AromaticContact CZ-CG 3.81Å; F618-H627 AromaticContact CZ-ND1 3.52Å; A623-H627 WeakPolarHBondContact O-CB 3.3Å; A623-H627 PolarHBondContact O-N 2.59Å; V624-H627 PolarHBondContact O-N 3.42Å; H627-G629 PolarHBondContact O-N 3.21Å
628	L	86.1	Confident	84.9	Confident	28 Å²	28	58.9 Å²	58.9	15%	0.147	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-8.8	176.6	-64	176.4	0	0	0	114.1	V624 K626 L630 K667 I668 F671	V624-L628 HydrophobicContact CG1-CD1 4.11Å; V624-L628 WeakPolarHBondContact O-CG 3.23Å; V624-L628 PolarHBondContact O-N 2.92Å; K626-L628 VanDerWaalsContact C-N 3.33Å; K626-L628 PolarHBondContact O-N 2.59Å; L628-L630 HydrophobicContact CB-CB 4.43Å; L628-L630 HydrophobicContact CB-CD1 4.1Å; L628-L630 HydrophobicContact CB-CG 4.19Å; L628-K667 WeakPolarHBondContact O-CD 3.42Å; L628-K667 WeakPolarHBondContact O-CE 3.27Å; L628-K667 PolarHBondContact O-NZ 2.96Å; L628-I668 HydrophobicContact CD1-CG1 4.42Å; L628-F671 HydrophobicContact CD1-CB 3.95Å; L628-F671 HydrophobicContact CD1-CD1 4.44Å; L628-F671 HydrophobicContact CD1-CD2 4.37Å; L628-F671 HydrophobicContact CD1-CG 4.01Å; L628-F671 HydrophobicContact CD2-CB 3.94Å; L628-F671 HydrophobicContact CD2-CD2 3.98Å; L628-F671 HydrophobicContact CD2-CG 4.2Å; L628-F671 HydrophobicContact CG-CD2 4.4Å
629	G	87.2	Confident	85.6	Confident	42 Å²	42	64 Å²	64	43%	0.433	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	57.8	-172	0	0	0	0	0	111.3	L625 K626 H627 K667	L625-G629 PolarHBondContact O-N 3.49Å; K626-G629 PolarHBondContact O-N 2.83Å; K626-G629 VanDerWaalsContact O-N 3.07Å; H627-G629 PolarHBondContact O-N 3.21Å; G629-K667 PolarHBondContact O-NZ 3.49Å
630	L	91.4	Very high	86.5	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.016	33%	0.325	C	S	.	.			trans	-145	21.2	-176.1	-69.9	-176.6	0	0	0	112.8	L625 L628 E632 Y633 P664 K667 I668	L625-L630 HydrophobicContact CD2-CB 4.18Å; L625-L630 CarbonylContact O-C 3.54Å; L625-L630 PolarHBondContact O-N 3.19Å; L628-L630 HydrophobicContact CB-CB 4.43Å; L628-L630 HydrophobicContact CB-CD1 4.1Å; L628-L630 HydrophobicContact CB-CG 4.19Å; L630-E632 VanDerWaalsContact CA-OE2 3.28Å; L630-E632 WeakPolarHBondContact CA-OE2 3.41Å; L630-E632 PolarHBondContact O-N 2.91Å; L630-E632 VanDerWaalsContact O-N 3.08Å; L630-Y633 HydrophobicContact CB-CD2 4.21Å; L630-Y633 HydrophobicContact CD2-CD2 3.98Å; L630-Y633 HydrophobicContact CD2-CE2 3.96Å; L630-Y633 PolarHBondContact O-N 3.03Å; L630-P664 HydrophobicContact CD1-CB 4.17Å; L630-P664 HydrophobicContact CD2-CB 3.59Å; L630-P664 HydrophobicContact CD2-CG 3.76Å; L630-K667 HydrophobicContact CD1-CB 3.95Å; L630-K667 HydrophobicContact CD1-CD 3.91Å; L630-K667 HydrophobicContact CD2-CD 4Å; L630-K667 HydrophobicContact CG-CD 3.9Å; L630-I668 HydrophobicContact CD1-CD1 4.13Å; L630-I668 HydrophobicContact CD1-CG1 3.77Å
631	S	89.8	Confident	86.7	Confident	62 Å²	62	65.4 Å²	65.4	43%	0.434	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-57.9	-23.7	-176.2	-56.6	0	0	0	0	114	L625 K626 Y633 K634	L625-S631 PolarHBondContact O-N 2.68Å; K626-S631 WeakPolarHBondContact CA-OG 3.4Å; S631-Y633 PolarHBondContact O-N 3.24Å; S631-K634 VanDerWaalsContact O-CB 3.31Å; S631-K634 WeakPolarHBondContact O-CB 3.38Å; S631-K634 PolarHBondContact O-N 3.31Å; S631-K634 VanDerWaalsContact O-N 3.16Å
632	E	88.6	Confident	86.6	Confident	121 Å²	121	66 Å²	66	57%	0.565	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-61.5	-26.5	174.9	68.1	-81.1	-166.5	0	0	113.5	L630 K634	L630-E632 VanDerWaalsContact CA-OE2 3.28Å; L630-E632 WeakPolarHBondContact CA-OE2 3.41Å; L630-E632 PolarHBondContact O-N 2.91Å; L630-E632 VanDerWaalsContact O-N 3.08Å; E632-K634 VanDerWaalsContact C-N 3.34Å
633	Y	89.4	Confident	86.8	Confident	47 Å²	47	68.7 Å²	68.7	18%	0.184	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-85.2	-3.2	177.5	-63.7	-74.7	0	0	0	113.8	L630 S631 S635 T636 L637 I660 P661 P664	L630-Y633 HydrophobicContact CB-CD2 4.21Å; L630-Y633 HydrophobicContact CD2-CD2 3.98Å; L630-Y633 HydrophobicContact CD2-CE2 3.96Å; L630-Y633 PolarHBondContact O-N 3.03Å; S631-Y633 PolarHBondContact O-N 3.24Å; Y633-S635 VanDerWaalsContact C-N 3.3Å; Y633-S635 PolarHBondContact O-N 3.17Å; Y633-T636 WeakPolarHBondContact O-CB 3.33Å; Y633-T636 PolarHBondContact O-N 2.75Å; Y633-L637 PolarHBondContact O-N 3.11Å; Y633-L637 VanDerWaalsContact O-N 3.14Å; Y633-I660 HydrophobicContact CD1-CG1 4.19Å; Y633-I660 HydrophobicContact CD1-CG2 4.15Å; Y633-I660 HydrophobicContact CE1-CG2 4.13Å; Y633-P661 WeakPolarHBondContact OH-CD 3.31Å; Y633-P664 HydrophobicContact CD2-CB 4.27Å; Y633-P664 HydrophobicContact CD2-CG 4.47Å; Y633-P664 HydrophobicContact CE2-CB 3.8Å; Y633-P664 HydrophobicContact CE2-CG 3.55Å
634	K	87.1	Confident	86.7	Confident	67 Å²	67	69.4 Å²	69.4	29%	0.291	36%	0.355	S	S	.	.	H	α-helix	trans	-55.9	-44.5	-179.1	-166.9	-163.4	-177.3	-57.2	0	111.7	A622 L625 S631 E632 T636 L637 D638	A622-K634 HydrophobicContact CB-CD 4.14Å; L625-K634 HydrophobicContact CD1-CB 3.83Å; L625-K634 HydrophobicContact CD1-CG 4.03Å; S631-K634 VanDerWaalsContact O-CB 3.31Å; S631-K634 WeakPolarHBondContact O-CB 3.38Å; S631-K634 PolarHBondContact O-N 3.31Å; S631-K634 VanDerWaalsContact O-N 3.16Å; E632-K634 VanDerWaalsContact C-N 3.34Å; K634-T636 PolarHBondContact O-N 3.23Å; K634-L637 PolarHBondContact O-N 3.16Å; K634-D638 IonicContact NZ-OD1 2.58Å; K634-D638 PolarHBondContact NZ-OD1 3.21Å; K634-D638 IonicContact NZ-OD2 3.37Å; K634-D638 PolarHBondContact NZ-OD2 3.32Å; K634-D638 WeakPolarHBondContact O-CB 3.33Å; K634-D638 PolarHBondContact O-N 2.85Å
635	S	85	Confident	86.5	Confident	85 Å²	85	76.7 Å²	76.7	59%	0.594	39%	0.388	S	S	*	.	H	α-helix	trans	-64.5	-27	-179.6	-170	0	0	0	0	113.5	Y633 Q639	Y633-S635 VanDerWaalsContact C-N 3.3Å; Y633-S635 PolarHBondContact O-N 3.17Å; S635-Q639 VanDerWaalsContact O-CB 3.28Å; S635-Q639 WeakPolarHBondContact O-CB 3.3Å; S635-Q639 PolarHBondContact O-N 3.24Å
636	T	88	Confident	86.4	Confident	47 Å²	47	79.2 Å²	79.2	29%	0.288	41%	0.406	S	S	.	.	H	α-helix	trans	-75.5	-42.6	176.2	-50.2	0	0	0	0	110.8	Y633 K634 Q639 E640 M658	Y633-T636 WeakPolarHBondContact O-CB 3.33Å; Y633-T636 PolarHBondContact O-N 2.75Å; K634-T636 PolarHBondContact O-N 3.23Å; T636-Q639 PolarHBondContact O-N 3.1Å; T636-E640 PolarHBondContact O-N 2.83Å; T636-M658 HydrophobicContact CG2-CB 4.42Å; T636-M658 HydrophobicContact CG2-CE 4.1Å
637	L	87.4	Confident	86.3	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-71.5	-38.3	179	-64.4	158.9	0	0	0	111.7	L621 L625 Y633 K634 Q639 K641 M642 L647 M658 I660	L621-L637 HydrophobicContact CD2-CB 3.99Å; L625-L637 HydrophobicContact CD1-CD1 3.57Å; L625-L637 HydrophobicContact CD2-CD1 3.6Å; L625-L637 HydrophobicContact CG-CD1 4.16Å; Y633-L637 PolarHBondContact O-N 3.11Å; Y633-L637 VanDerWaalsContact O-N 3.14Å; K634-L637 PolarHBondContact O-N 3.16Å; L637-Q639 VanDerWaalsContact C-N 3.3Å; L637-Q639 PolarHBondContact O-N 2.88Å; L637-K641 PolarHBondContact O-N 3.04Å; L637-K641 VanDerWaalsContact O-N 3.12Å; L637-M642 HydrophobicContact CB-CB 4.45Å; L637-M642 HydrophobicContact CD2-CB 4.44Å; L637-M642 HydrophobicContact CD2-CE 4.17Å; L637-M642 HydrophobicContact CD2-CG 4.47Å; L637-M642 HydrophobicContact CD2-SD 3.44Å; L637-M642 WeakPolarHBondContact CD2-SD 3.38Å; L637-M642 PolarHBondContact O-N 3.23Å; L637-L647 HydrophobicContact CD2-CD1 4.47Å; L637-M658 HydrophobicContact CD2-CE 3.72Å; L637-M658 HydrophobicContact CD2-SD 4.4Å; L637-M658 HydrophobicContact CG-CE 4.31Å; L637-I660 HydrophobicContact CD2-CD1 4.39Å
638	D	86.1	Confident	86.1	Confident	75 Å²	75	67.6 Å²	67.6	40%	0.401	36%	0.355	S	S	.	.	H	α-helix	trans	-60.2	-38.2	170.9	-70.4	-17.3	0	0	0	111.7	K634 K641	K634-D638 IonicContact NZ-OD1 2.58Å; K634-D638 PolarHBondContact NZ-OD1 3.21Å; K634-D638 IonicContact NZ-OD2 3.37Å; K634-D638 PolarHBondContact NZ-OD2 3.32Å; K634-D638 WeakPolarHBondContact O-CB 3.33Å; K634-D638 PolarHBondContact O-N 2.85Å; D638-K641 WeakPolarHBondContact O-CA 3.24Å; D638-K641 PolarHBondContact O-N 3.2Å; D638-K641 VanDerWaalsContact O-N 3.12Å
639	Q	87.1	Confident	85.9	Confident	146 Å²	146	73.5 Å²	73.5	68%	0.682	38%	0.384	S	S	*	.	H	α-helix	trans	-70.2	-39	-177.1	-179.2	168.4	-14.5	0	0	112.4	S635 T636 L637 K641	S635-Q639 VanDerWaalsContact O-CB 3.28Å; S635-Q639 WeakPolarHBondContact O-CB 3.3Å; S635-Q639 PolarHBondContact O-N 3.24Å; T636-Q639 PolarHBondContact O-N 3.1Å; L637-Q639 VanDerWaalsContact C-N 3.3Å; L637-Q639 PolarHBondContact O-N 2.88Å; Q639-K641 PolarHBondContact O-N 2.88Å
640	E	85.9	Confident	85.6	Confident	122 Å²	122	72.5 Å²	72.5	57%	0.57	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	5.5	169.9	-59.2	-51.7	140.4	0	0	113.3	T636 M642 M658	T636-E640 PolarHBondContact O-N 2.83Å; E640-M642 VanDerWaalsContact C-N 3.31Å; E640-M642 PolarHBondContact O-N 2.93Å; E640-M658 HydrophobicContact CB-CE 3.79Å; E640-M658 HydrophobicContact CG-CE 3.6Å; E640-M658 HydrophobicContact CG-CG 4.22Å; E640-M658 HydrophobicContact CG-SD 4.35Å
641	K	84.8	Confident	85.1	Confident	179 Å²	179	75.8 Å²	75.8	78%	0.778	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	33.6	178	-51.3	177.9	-176.3	173.4	0	114.7	L637 D638 Q639	L637-K641 PolarHBondContact O-N 3.04Å; L637-K641 VanDerWaalsContact O-N 3.12Å; D638-K641 WeakPolarHBondContact O-CA 3.24Å; D638-K641 PolarHBondContact O-N 3.2Å; D638-K641 VanDerWaalsContact O-N 3.12Å; Q639-K641 PolarHBondContact O-N 2.88Å
642	M	84	Confident	84.6	Confident	27 Å²	27	76.6 Å²	76.6	13%	0.133	39%	0.388	C	S	.	.			trans	-71.1	133.5	176.5	-69.1	-174.3	65.6	0	0	111.6	L621 L637 E640 L647 C650 M658	L621-M642 VanDerWaalsContact CD2-O 3.3Å; L621-M642 WeakPolarHBondContact CD2-O 3.41Å; L637-M642 HydrophobicContact CB-CB 4.45Å; L637-M642 HydrophobicContact CD2-CB 4.44Å; L637-M642 HydrophobicContact CD2-CE 4.17Å; L637-M642 HydrophobicContact CD2-CG 4.47Å; L637-M642 HydrophobicContact CD2-SD 3.44Å; L637-M642 WeakPolarHBondContact CD2-SD 3.38Å; L637-M642 PolarHBondContact O-N 3.23Å; E640-M642 VanDerWaalsContact C-N 3.31Å; E640-M642 PolarHBondContact O-N 2.93Å; M642-L647 HydrophobicContact CE-CB 4.18Å; M642-L647 HydrophobicContact CE-CD1 3.73Å; M642-C650 HydrophobicContact CE-CB 3.75Å; M642-M658 HydrophobicContact SD-CE 3.81Å; M642-M658 HydrophobicContact SD-SD 3.57Å
643	D	85.3	Confident	84.3	Confident	86 Å²	86	75.5 Å²	75.5	46%	0.46	38%	0.383	S	S	.	.			trans	-106.5	-176.1	165.7	58.7	24.7	0	0	0	111	E645 S646 L647	D643-E645 PolarHBondContact OD1-N 3.19Å; D643-S646 WeakPolarHBondContact OD1-CB 3.45Å; D643-S646 PolarHBondContact OD1-N 3.34Å; D643-S646 PolarHBondContact OD1-OG 3.13Å; D643-L647 WeakPolarHBondContact O-CB 3.27Å; D643-L647 PolarHBondContact O-N 3.04Å
644	I	82.9	Confident	84.2	Confident	50 Å²	50	77.1 Å²	77.1	26%	0.256	40%	0.395	S	S	.	.	H	α-helix	trans	-65.4	-38.8	-177.5	-57.1	179.1	0	0	0	111.3	F618 L647 L648	F618-I644 WeakPolarHBondContact O-CD1 3.47Å; I644-L647 WeakPolarHBondContact O-CB 3.3Å; I644-L647 PolarHBondContact O-N 3.29Å; I644-L648 HydrophobicContact CG2-CD1 4.46Å; I644-L648 WeakPolarHBondContact O-CG 3.33Å; I644-L648 PolarHBondContact O-N 3.27Å
645	E	81.9	Confident	84.2	Confident	153 Å²	153	73.9 Å²	73.9	72%	0.715	38%	0.381	S	S	*	.	H	α-helix	trans	-70.6	-41.3	-179.2	-167.7	166.4	-172.7	0	0	110.9	D643 L647 L648 M649	D643-E645 PolarHBondContact OD1-N 3.19Å; E645-L647 VanDerWaalsContact C-N 3.32Å; E645-L647 PolarHBondContact O-N 3.42Å; E645-L648 PolarHBondContact O-N 3.35Å; E645-M649 PolarHBondContact O-N 2.96Å
646	S	84.1	Confident	84.1	Confident	54 Å²	54	74.2 Å²	74.2	38%	0.378	37%	0.372	S	S	.	.	H	α-helix	trans	-61.3	-38.8	171.1	-55.1	0	0	0	0	112.2	D643 M649 C650	D643-S646 WeakPolarHBondContact OD1-CB 3.45Å; D643-S646 PolarHBondContact OD1-N 3.34Å; D643-S646 PolarHBondContact OD1-OG 3.13Å; S646-M649 PolarHBondContact O-N 3.49Å; S646-C650 WeakPolarHBondContact O-CB 3.26Å; S646-C650 PolarHBondContact O-N 3.39Å
647	L	83.7	Confident	84.1	Confident	1 Å²	1	78.2 Å²	78.2	1%	0.005	39%	0.391	C	S	.	.	H	α-helix	trans	-64	-39	175.3	-170.6	74.4	0	0	0	111.8	L621 V624 L637 M642 D643 I644 E645 M649 C650 I668 V672	L621-L647 HydrophobicContact CD1-CD2 3.8Å; V624-L647 HydrophobicContact CG1-CD2 4.07Å; L637-L647 HydrophobicContact CD2-CD1 4.47Å; M642-L647 HydrophobicContact CE-CB 4.18Å; M642-L647 HydrophobicContact CE-CD1 3.73Å; D643-L647 WeakPolarHBondContact O-CB 3.27Å; D643-L647 PolarHBondContact O-N 3.04Å; I644-L647 WeakPolarHBondContact O-CB 3.3Å; I644-L647 PolarHBondContact O-N 3.29Å; E645-L647 VanDerWaalsContact C-N 3.32Å; E645-L647 PolarHBondContact O-N 3.42Å; L647-M649 PolarHBondContact O-N 2.66Å; L647-C650 WeakPolarHBondContact O-CB 3.46Å; L647-C650 PolarHBondContact O-N 3.44Å; L647-I668 HydrophobicContact CD1-CG2 3.76Å; L647-I668 HydrophobicContact CG-CG2 4.27Å; L647-V672 HydrophobicContact CG-CG2 4.46Å; L647-V672 VanDerWaalsContact O-CG2 3.25Å; L647-V672 WeakPolarHBondContact O-CG2 3.28Å
648	L	83.4	Confident	84	Confident	24 Å²	24	80 Å²	80	13%	0.126	40%	0.4	C	S	.	.	H	α-helix	trans	-68	-21.5	176.9	-68.6	172.2	0	0	0	113.4	I644 E645 V672 R675 V676	I644-L648 HydrophobicContact CG2-CD1 4.46Å; I644-L648 WeakPolarHBondContact O-CG 3.33Å; I644-L648 PolarHBondContact O-N 3.27Å; E645-L648 PolarHBondContact O-N 3.35Å; L648-V672 HydrophobicContact CD2-CG1 4.42Å; L648-V672 HydrophobicContact CD2-CG2 4.39Å; L648-V672 WeakPolarHBondContact O-CG1 3.44Å; L648-R675 HydrophobicContact CD2-CB 3.5Å; L648-R675 HydrophobicContact CD2-CG 4.29Å; L648-V676 HydrophobicContact CB-CG2 4.49Å; L648-V676 HydrophobicContact CD2-CG2 4.32Å
649	M	80.5	Confident	83.8	Confident	153 Å²	153	79.3 Å²	79.3	75%	0.754	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-2.3	175.5	-62.4	-60	-66.6	0	0	113.6	E645 S646 L647	E645-M649 PolarHBondContact O-N 2.96Å; S646-M649 PolarHBondContact O-N 3.49Å; L647-M649 PolarHBondContact O-N 2.66Å
650	C	81	Confident	83.9	Confident	20 Å²	20	72.5 Å²	72.5	14%	0.135	38%	0.379	C	S	.	.			trans	-81.9	130.7	-170.8	-168.1	0	0	0	0	112.9	M642 S646 L647 L655	M642-C650 HydrophobicContact CE-CB 3.75Å; S646-C650 WeakPolarHBondContact O-CB 3.26Å; S646-C650 PolarHBondContact O-N 3.39Å; L647-C650 WeakPolarHBondContact O-CB 3.46Å; L647-C650 PolarHBondContact O-N 3.44Å; C650-L655 VanDerWaalsContact SG-CD2 3.54Å
651	T	81.4	Confident	83.9	Confident	73 Å²	73	69.9 Å²	69.9	45%	0.448	37%	0.372	S	S	.	.			trans	-88.9	166.8	179.9	79.4	0	0	0	0	112.7	E653 D654 L655	T651-E653 PolarHBondContact O-N 3.37Å; T651-E653 PolarHBondContact OG1-N 3.05Å; T651-D654 WeakPolarHBondContact CA-OD2 3.32Å; T651-D654 WeakPolarHBondContact CB-OD2 3.32Å; T651-D654 WeakPolarHBondContact CG2-OD2 3.4Å; T651-D654 PolarHBondContact N-OD2 3.36Å; T651-D654 PolarHBondContact O-N 3.47Å; T651-D654 VanDerWaalsContact OG1-CG 3.25Å; T651-D654 PolarHBondContact OG1-N 3.3Å; T651-D654 PolarHBondContact OG1-OD2 3.03Å; T651-L655 WeakPolarHBondContact O-CG 3.46Å; T651-L655 PolarHBondContact O-N 3.09Å
652	M	79.6	Confident	83.4	Confident	78 Å²	78	65.9 Å²	65.9	38%	0.384	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-16.9	177.9	-159.8	-176.5	-61.8	0	0	113.4	R665 T669	M652-R665 HydrophobicContact CG-CB 4.45Å; M652-R665 PolarHBondContact O-NH1 2.87Å; M652-T669 HydrophobicContact CE-CG2 4.08Å
653	E	81.3	Confident	83.3	Confident	98 Å²	98	66.9 Å²	66.9	46%	0.458	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-36.6	177.8	-157.1	73.9	168.4	0	0	111.3	T651 L655 K656 D657	T651-E653 PolarHBondContact O-N 3.37Å; T651-E653 PolarHBondContact OG1-N 3.05Å; E653-L655 PolarHBondContact O-N 3.19Å; E653-K656 VanDerWaalsContact CD-NZ 3.28Å; E653-K656 HydrophobicContact CG-CD 4.49Å; E653-K656 WeakPolarHBondContact O-CA 3.42Å; E653-K656 WeakPolarHBondContact O-CB 3.18Å; E653-K656 PolarHBondContact O-N 3.14Å; E653-K656 IonicContact OE1-NZ 3.37Å; E653-K656 PolarHBondContact OE1-NZ 3.35Å; E653-K656 WeakPolarHBondContact OE2-CD 3.45Å; E653-K656 IonicContact OE2-NZ 3.69Å; E653-K656 PolarHBondContact OE2-NZ 3.45Å; E653-D657 PolarHBondContact O-N 3.41Å; E653-D657 VanDerWaalsContact O-N 3.08Å
654	D	86.9	Confident	83.5	Confident	81 Å²	81	63.8 Å²	63.8	43%	0.433	36%	0.36	S	S	.	.	H	α-helix	trans	-59.5	-48.3	173.5	-52.4	-57	0	0	0	110.8	T651 K656 D657 M658	T651-D654 WeakPolarHBondContact CA-OD2 3.32Å; T651-D654 WeakPolarHBondContact CB-OD2 3.32Å; T651-D654 WeakPolarHBondContact CG2-OD2 3.4Å; T651-D654 PolarHBondContact N-OD2 3.36Å; T651-D654 PolarHBondContact O-N 3.47Å; T651-D654 VanDerWaalsContact OG1-CG 3.25Å; T651-D654 PolarHBondContact OG1-N 3.3Å; T651-D654 PolarHBondContact OG1-OD2 3.03Å; D654-K656 PolarHBondContact O-N 3.38Å; D654-K656 VanDerWaalsContact O-N 3.13Å; D654-D657 PolarHBondContact O-N 3.15Å; D654-M658 WeakPolarHBondContact O-CG 3.33Å; D654-M658 PolarHBondContact O-N 3.3Å; D654-M658 VanDerWaalsContact O-N 3.09Å
655	L	87.8	Confident	83.8	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-60.3	-25.1	175	-60.8	171.8	0	0	0	112.8	C650 T651 E653 I660 R665 I668	C650-L655 VanDerWaalsContact SG-CD2 3.54Å; T651-L655 WeakPolarHBondContact O-CG 3.46Å; T651-L655 PolarHBondContact O-N 3.09Å; E653-L655 PolarHBondContact O-N 3.19Å; L655-I660 HydrophobicContact CB-CD1 4.33Å; L655-I660 HydrophobicContact CD2-CD1 3.94Å; L655-I660 WeakPolarHBondContact O-CB 3.39Å; L655-I660 WeakPolarHBondContact O-CG1 3.49Å; L655-I660 PolarHBondContact O-N 3.36Å; L655-R665 VanDerWaalsContact CB-CD 3.47Å; L655-R665 HydrophobicContact CB-CG 3.66Å; L655-R665 HydrophobicContact CD1-CB 4.42Å; L655-R665 HydrophobicContact CD1-CG 4.21Å; L655-I668 HydrophobicContact CD1-CB 4.04Å; L655-I668 HydrophobicContact CD1-CD1 4.36Å; L655-I668 HydrophobicContact CD1-CG2 3.8Å; L655-I668 HydrophobicContact CD2-CD1 4.33Å; L655-I668 HydrophobicContact CD2-CG2 4.5Å
656	K	83.3	Confident	83.8	Confident	92 Å²	92	61.7 Å²	61.7	40%	0.4	35%	0.346	S	S	.	.	H	α-helix	trans	-76.6	-40.9	-179.6	179.5	-168.1	158	-163.6	0	110.6	E653 D654 M658 G659	E653-K656 VanDerWaalsContact CD-NZ 3.28Å; E653-K656 HydrophobicContact CG-CD 4.49Å; E653-K656 WeakPolarHBondContact O-CA 3.42Å; E653-K656 WeakPolarHBondContact O-CB 3.18Å; E653-K656 PolarHBondContact O-N 3.14Å; E653-K656 IonicContact OE1-NZ 3.37Å; E653-K656 PolarHBondContact OE1-NZ 3.35Å; E653-K656 WeakPolarHBondContact OE2-CD 3.45Å; E653-K656 IonicContact OE2-NZ 3.69Å; E653-K656 PolarHBondContact OE2-NZ 3.45Å; D654-K656 PolarHBondContact O-N 3.38Å; D654-K656 VanDerWaalsContact O-N 3.13Å; K656-M658 VanDerWaalsContact C-N 3.28Å; K656-G659 WeakPolarHBondContact O-CA 3.42Å; K656-G659 PolarHBondContact O-N 3.37Å
657	D	88.2	Confident	83.9	Confident	130 Å²	130	63.7 Å²	63.7	70%	0.695	35%	0.348	S	S	*	.	H	α-helix	trans	-72.4	-27	178.6	-70.6	-2.9	0	0	0	111	E653 D654 G659	E653-D657 PolarHBondContact O-N 3.41Å; E653-D657 VanDerWaalsContact O-N 3.08Å; D654-D657 PolarHBondContact O-N 3.15Å; D657-G659 PolarHBondContact O-N 2.99Å; D657-G659 VanDerWaalsContact O-N 3.14Å
658	M	85.8	Confident	84	Confident	38 Å²	38	63.7 Å²	63.7	19%	0.187	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	2.6	162	-63	-178.8	69.5	0	0	114.5	T636 L637 E640 M642 D654 K656 I660	T636-M658 HydrophobicContact CG2-CB 4.42Å; T636-M658 HydrophobicContact CG2-CE 4.1Å; L637-M658 HydrophobicContact CD2-CE 3.72Å; L637-M658 HydrophobicContact CD2-SD 4.4Å; L637-M658 HydrophobicContact CG-CE 4.31Å; E640-M658 HydrophobicContact CB-CE 3.79Å; E640-M658 HydrophobicContact CG-CE 3.6Å; E640-M658 HydrophobicContact CG-CG 4.22Å; E640-M658 HydrophobicContact CG-SD 4.35Å; M642-M658 HydrophobicContact SD-CE 3.81Å; M642-M658 HydrophobicContact SD-SD 3.57Å; D654-M658 WeakPolarHBondContact O-CG 3.33Å; D654-M658 PolarHBondContact O-N 3.3Å; D654-M658 VanDerWaalsContact O-N 3.09Å; K656-M658 VanDerWaalsContact C-N 3.28Å; M658-I660 VanDerWaalsContact C-N 3.33Å; M658-I660 HydrophobicContact CB-CD1 4.29Å; M658-I660 HydrophobicContact CB-CG1 4.19Å; M658-I660 PolarHBondContact O-N 2.89Å
659	G	81.5	Confident	84	Confident	60 Å²	60	64.9 Å²	64.9	62%	0.619	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	9.7	177.3	0	0	0	0	0	115.5	K656 D657	K656-G659 WeakPolarHBondContact O-CA 3.42Å; K656-G659 PolarHBondContact O-N 3.37Å; D657-G659 PolarHBondContact O-N 2.99Å; D657-G659 VanDerWaalsContact O-N 3.14Å
660	I	89.3	Confident	84.2	Confident	4 Å²	4	64.5 Å²	64.5	2%	0.021	35%	0.351	C	S	.	.			trans	-75.5	128.8	-173.7	-55.1	175.7	0	0	0	110.4	Y633 L637 L655 M658 P664 R665	Y633-I660 HydrophobicContact CD1-CG1 4.19Å; Y633-I660 HydrophobicContact CD1-CG2 4.15Å; Y633-I660 HydrophobicContact CE1-CG2 4.13Å; L637-I660 HydrophobicContact CD2-CD1 4.39Å; L655-I660 HydrophobicContact CB-CD1 4.33Å; L655-I660 HydrophobicContact CD2-CD1 3.94Å; L655-I660 WeakPolarHBondContact O-CB 3.39Å; L655-I660 WeakPolarHBondContact O-CG1 3.49Å; L655-I660 PolarHBondContact O-N 3.36Å; M658-I660 VanDerWaalsContact C-N 3.33Å; M658-I660 HydrophobicContact CB-CD1 4.29Å; M658-I660 HydrophobicContact CB-CG1 4.19Å; M658-I660 PolarHBondContact O-N 2.89Å; I660-P664 HydrophobicContact CG2-CB 3.65Å; I660-R665 HydrophobicContact CB-CG 3.93Å; I660-R665 HydrophobicContact CG2-CG 3.82Å; I660-R665 WeakPolarHBondContact O-CD 3.47Å; I660-R665 PolarHBondContact O-NE 2.83Å
661	P	85.1	Confident	84.5	Confident	66 Å²	66	64.4 Å²	64.4	43%	0.429	35%	0.348	S	S	.	.			trans	-62.6	156.4	179.2	-24.2	35	0	0	0	114	Y633 G663 P664 R665	Y633-P661 WeakPolarHBondContact OH-CD 3.31Å; P661-G663 VanDerWaalsContact C-N 3.29Å; P661-G663 PolarHBondContact O-N 3.38Å; P661-G663 VanDerWaalsContact O-N 3.17Å; P661-P664 WeakPolarHBondContact O-CD 3.38Å; P661-R665 WeakPolarHBondContact O-CG 3.42Å; P661-R665 PolarHBondContact O-N 3.32Å; P661-R665 VanDerWaalsContact O-N 3.08Å
662	L	74.4	Confident	84.6	Confident	96 Å²	96	61.7 Å²	61.7	50%	0.503	33%	0.331	S	S	.	.	H	α-helix	trans	-58.1	-34	-171.6	-174.3	64.8	0	0	0	114.4	K666	L662-K666 PolarHBondContact O-N 3.1Å
663	G	81.8	Confident	84.7	Confident	47 Å²	47	64.2 Å²	64.2	49%	0.485	34%	0.34	S	S	.	.	H	α-helix	trans	-64.5	-61.1	178.4	0	0	0	0	0	112.9	P661 R665 K666 K667	P661-G663 VanDerWaalsContact C-N 3.29Å; P661-G663 PolarHBondContact O-N 3.38Å; P661-G663 VanDerWaalsContact O-N 3.17Å; G663-R665 VanDerWaalsContact C-N 3.28Å; G663-R665 PolarHBondContact O-N 3.13Å; G663-K666 PolarHBondContact O-N 2.98Å; G663-K666 VanDerWaalsContact O-N 3.14Å; G663-K667 PolarHBondContact O-N 3.29Å; G663-K667 VanDerWaalsContact O-N 3.17Å
664	P	89.3	Confident	84.6	Confident	21 Å²	21	64.2 Å²	64.2	14%	0.136	34%	0.34	C	S	.	.	H	α-helix	trans	-49.1	-43	169.5	-32.6	37.6	0	0	0	114.2	L630 Y633 I660 P661 K666 K667 I668	L630-P664 HydrophobicContact CD1-CB 4.17Å; L630-P664 HydrophobicContact CD2-CB 3.59Å; L630-P664 HydrophobicContact CD2-CG 3.76Å; Y633-P664 HydrophobicContact CD2-CB 4.27Å; Y633-P664 HydrophobicContact CD2-CG 4.47Å; Y633-P664 HydrophobicContact CE2-CB 3.8Å; Y633-P664 HydrophobicContact CE2-CG 3.55Å; I660-P664 HydrophobicContact CG2-CB 3.65Å; P661-P664 WeakPolarHBondContact O-CD 3.38Å; P664-K666 PolarHBondContact O-N 3.04Å; P664-K667 WeakPolarHBondContact O-CB 3.38Å; P664-K667 PolarHBondContact O-N 3.46Å; P664-I668 WeakPolarHBondContact O-CG1 3.37Å; P664-I668 PolarHBondContact O-N 3.37Å
665	R	89.4	Confident	84.2	Confident	30 Å²	30	62.9 Å²	62.9	11%	0.113	33%	0.329	C	S	.	.	H	α-helix	trans	-57.9	-47.9	175.8	-71.8	-164.1	-80.2	132.3	-3.8	112.7	M652 L655 I660 P661 G663 K667 I668 T669	M652-R665 HydrophobicContact CG-CB 4.45Å; M652-R665 PolarHBondContact O-NH1 2.87Å; L655-R665 VanDerWaalsContact CB-CD 3.47Å; L655-R665 HydrophobicContact CB-CG 3.66Å; L655-R665 HydrophobicContact CD1-CB 4.42Å; L655-R665 HydrophobicContact CD1-CG 4.21Å; I660-R665 HydrophobicContact CB-CG 3.93Å; I660-R665 HydrophobicContact CG2-CG 3.82Å; I660-R665 WeakPolarHBondContact O-CD 3.47Å; I660-R665 PolarHBondContact O-NE 2.83Å; P661-R665 WeakPolarHBondContact O-CG 3.42Å; P661-R665 PolarHBondContact O-N 3.32Å; P661-R665 VanDerWaalsContact O-N 3.08Å; G663-R665 VanDerWaalsContact C-N 3.28Å; G663-R665 PolarHBondContact O-N 3.13Å; R665-K667 VanDerWaalsContact C-N 3.32Å; R665-K667 PolarHBondContact O-N 3.36Å; R665-I668 PolarHBondContact O-N 3.39Å; R665-T669 PolarHBondContact O-N 3.37Å; R665-T669 PolarHBondContact O-OG1 2.75Å; R665-T669 VanDerWaalsContact O-OG1 3.05Å
666	K	81.7	Confident	83.7	Confident	129 Å²	129	66 Å²	66	56%	0.561	35%	0.348	S	S	*	.	H	α-helix	trans	-60.9	-37	176.9	-76	-170	175.5	-167	0	113.2	L662 G663 P664 K670	L662-K666 PolarHBondContact O-N 3.1Å; G663-K666 PolarHBondContact O-N 2.98Å; G663-K666 VanDerWaalsContact O-N 3.14Å; P664-K666 PolarHBondContact O-N 3.04Å; K666-K670 PolarHBondContact O-N 3.28Å
667	K	86.9	Confident	83.3	Confident	97 Å²	97	65.3 Å²	65.3	42%	0.422	35%	0.354	S	S	.	.	H	α-helix	trans	-60.6	-50	173.3	-75.8	-177.4	172.2	-171.8	0	111.4	L628 G629 L630 G663 P664 R665 K670 F671	L628-K667 WeakPolarHBondContact O-CD 3.42Å; L628-K667 WeakPolarHBondContact O-CE 3.27Å; L628-K667 PolarHBondContact O-NZ 2.96Å; G629-K667 PolarHBondContact O-NZ 3.49Å; L630-K667 HydrophobicContact CD1-CB 3.95Å; L630-K667 HydrophobicContact CD1-CD 3.91Å; L630-K667 HydrophobicContact CD2-CD 4Å; L630-K667 HydrophobicContact CG-CD 3.9Å; G663-K667 PolarHBondContact O-N 3.29Å; G663-K667 VanDerWaalsContact O-N 3.17Å; P664-K667 WeakPolarHBondContact O-CB 3.38Å; P664-K667 PolarHBondContact O-N 3.46Å; R665-K667 VanDerWaalsContact C-N 3.32Å; R665-K667 PolarHBondContact O-N 3.36Å; K667-K670 PolarHBondContact O-N 3.15Å; K667-F671 PolarHBondContact O-N 3.48Å; K667-F671 VanDerWaalsContact O-N 3.12Å
668	I	86.4	Confident	82.7	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-61.7	-48.4	179.8	-64.5	168.4	0	0	0	110.3	L628 L630 L647 L655 P664 R665 K670 F671 V672	L628-I668 HydrophobicContact CD1-CG1 4.42Å; L630-I668 HydrophobicContact CD1-CD1 4.13Å; L630-I668 HydrophobicContact CD1-CG1 3.77Å; L647-I668 HydrophobicContact CD1-CG2 3.76Å; L647-I668 HydrophobicContact CG-CG2 4.27Å; L655-I668 HydrophobicContact CD1-CB 4.04Å; L655-I668 HydrophobicContact CD1-CD1 4.36Å; L655-I668 HydrophobicContact CD1-CG2 3.8Å; L655-I668 HydrophobicContact CD2-CD1 4.33Å; L655-I668 HydrophobicContact CD2-CG2 4.5Å; P664-I668 WeakPolarHBondContact O-CG1 3.37Å; P664-I668 PolarHBondContact O-N 3.37Å; R665-I668 PolarHBondContact O-N 3.39Å; I668-K670 VanDerWaalsContact C-N 3.3Å; I668-K670 PolarHBondContact O-N 3.15Å; I668-F671 WeakPolarHBondContact O-CB 3.31Å; I668-F671 PolarHBondContact O-N 3.21Å; I668-F671 VanDerWaalsContact O-N 3.16Å; I668-V672 HydrophobicContact CG2-CG2 4.27Å; I668-V672 WeakPolarHBondContact O-CG2 3.34Å; I668-V672 PolarHBondContact O-N 3.34Å
669	T	83.2	Confident	81.8	Confident	48 Å²	48	69.6 Å²	69.6	29%	0.294	36%	0.363	S	S	.	.	H	α-helix	trans	-60.4	-36	178.5	-51.7	0	0	0	0	112.8	M652 R665 K673	M652-T669 HydrophobicContact CE-CG2 4.08Å; R665-T669 PolarHBondContact O-N 3.37Å; R665-T669 PolarHBondContact O-OG1 2.75Å; R665-T669 VanDerWaalsContact O-OG1 3.05Å; T669-K673 WeakPolarHBondContact O-CB 3.3Å; T669-K673 PolarHBondContact O-N 3.47Å; T669-K673 VanDerWaalsContact O-N 3.07Å
670	K	83.9	Confident	81.2	Confident	146 Å²	146	69.4 Å²	69.4	64%	0.635	36%	0.356	S	S	*	.	H	α-helix	trans	-63	-50.8	173.4	-176.5	-176.4	173.3	-174.7	0	111.1	K666 K667 I668 V672 K673 E674	K666-K670 PolarHBondContact O-N 3.28Å; K667-K670 PolarHBondContact O-N 3.15Å; I668-K670 VanDerWaalsContact C-N 3.3Å; I668-K670 PolarHBondContact O-N 3.15Å; K670-V672 VanDerWaalsContact C-N 3.3Å; K670-V672 PolarHBondContact O-N 3.46Å; K670-K673 PolarHBondContact O-N 3.38Å; K670-E674 PolarHBondContact O-N 3.28Å
671	F	86.8	Confident	79.8	Confident	18 Å²	18	70.8 Å²	70.8	8%	0.079	37%	0.371	C	S	.	.	H	α-helix	trans	-57.2	-43.3	179.8	176.9	-95	0	0	0	112.5	F618 V624 L628 K667 I668 E674 R675	F618-F671 HydrophobicContact CD2-CE2 4.13Å; F618-F671 AromaticContact CD2-CZ 3.91Å; F618-F671 HydrophobicContact CD2-CZ 3.91Å; F618-F671 AromaticContact CE2-CE2 3.75Å; F618-F671 HydrophobicContact CE2-CE2 3.75Å; F618-F671 HydrophobicContact CE2-CZ 4.03Å; V624-F671 HydrophobicContact CB-CZ 4.35Å; V624-F671 HydrophobicContact CG1-CD1 4.03Å; V624-F671 HydrophobicContact CG1-CE1 3.48Å; V624-F671 VanDerWaalsContact CG1-CE1 3.48Å; V624-F671 HydrophobicContact CG1-CE2 4.24Å; V624-F671 HydrophobicContact CG1-CZ 3.59Å; V624-F671 HydrophobicContact CG2-CE1 4.28Å; V624-F671 HydrophobicContact CG2-CZ 3.93Å; L628-F671 HydrophobicContact CD1-CB 3.95Å; L628-F671 HydrophobicContact CD1-CD1 4.44Å; L628-F671 HydrophobicContact CD1-CD2 4.37Å; L628-F671 HydrophobicContact CD1-CG 4.01Å; L628-F671 HydrophobicContact CD2-CB 3.94Å; L628-F671 HydrophobicContact CD2-CD2 3.98Å; L628-F671 HydrophobicContact CD2-CG 4.2Å; L628-F671 HydrophobicContact CG-CD2 4.4Å; K667-F671 PolarHBondContact O-N 3.48Å; K667-F671 VanDerWaalsContact O-N 3.12Å; I668-F671 WeakPolarHBondContact O-CB 3.31Å; I668-F671 PolarHBondContact O-N 3.21Å; I668-F671 VanDerWaalsContact O-N 3.16Å; F671-E674 PolarHBondContact O-N 3.27Å; F671-R675 HydrophobicContact CD1-CG 4.43Å; F671-R675 HydrophobicContact CE1-CG 3.95Å; F671-R675 HydrophobicContact CE2-CG 4.26Å; F671-R675 HydrophobicContact CZ-CG 3.86Å; F671-R675 WeakPolarHBondContact O-CB 3.28Å; F671-R675 PolarHBondContact O-N 3.14Å
672	V	84.6	Confident	78.7	Confident	15 Å²	15	74.4 Å²	74.4	9%	0.091	38%	0.376	C	S	.	.	H	α-helix	trans	-62.1	-50.2	176.6	169.8	0	0	0	0	111.3	L647 L648 I668 K670 E674 R675 V676	L647-V672 HydrophobicContact CG-CG2 4.46Å; L647-V672 VanDerWaalsContact O-CG2 3.25Å; L647-V672 WeakPolarHBondContact O-CG2 3.28Å; L648-V672 HydrophobicContact CD2-CG1 4.42Å; L648-V672 HydrophobicContact CD2-CG2 4.39Å; L648-V672 WeakPolarHBondContact O-CG1 3.44Å; I668-V672 HydrophobicContact CG2-CG2 4.27Å; I668-V672 WeakPolarHBondContact O-CG2 3.34Å; I668-V672 PolarHBondContact O-N 3.34Å; K670-V672 VanDerWaalsContact C-N 3.3Å; K670-V672 PolarHBondContact O-N 3.46Å; V672-E674 VanDerWaalsContact C-N 3.26Å; V672-E674 PolarHBondContact O-N 3.13Å; V672-R675 PolarHBondContact O-N 3.08Å; V672-V676 HydrophobicContact CG1-CG2 4.32Å; V672-V676 WeakPolarHBondContact O-CB 3.35Å; V672-V676 WeakPolarHBondContact O-CG2 3.32Å; V672-V676 PolarHBondContact O-N 3.47Å
673	K	80.9	Confident	77.7	Confident	132 Å²	132	76.9 Å²	76.9	57%	0.574	39%	0.385	S	S	*	.	H	α-helix	trans	-53.6	-45.1	176.8	-174.3	-177.6	176.9	-172	0	111	T669 K670 S677 E725	T669-K673 WeakPolarHBondContact O-CB 3.3Å; T669-K673 PolarHBondContact O-N 3.47Å; T669-K673 VanDerWaalsContact O-N 3.07Å; K670-K673 PolarHBondContact O-N 3.38Å; K673-S677 PolarHBondContact O-N 3.19Å; K673-S677 VanDerWaalsContact O-N 3.13Å; K673-S677 PolarHBondContact O-OG 2.87Å; K673-E725 IonicContact NZ-OE1 2.72Å; K673-E725 PolarHBondContact NZ-OE1 3.43Å
674	E	79.9	Confident	76.3	Confident	97 Å²	97	80.4 Å²	80.4	45%	0.453	39%	0.389	S	S	.	.	H	α-helix	trans	-67.8	-45.8	-179.2	-163.4	-179.7	134.9	0	0	113.1	K670 F671 V672 S677 R678	K670-E674 PolarHBondContact O-N 3.28Å; F671-E674 PolarHBondContact O-N 3.27Å; V672-E674 VanDerWaalsContact C-N 3.26Å; V672-E674 PolarHBondContact O-N 3.13Å; E674-S677 PolarHBondContact O-N 2.97Å; E674-R678 WeakPolarHBondContact O-CG 3.23Å; E674-R678 PolarHBondContact O-N 2.94Å; E674-R678 VanDerWaalsContact O-N 3.1Å
675	R	78.4	Confident	74.5	Confident	54 Å²	54	88.8 Å²	88.8	20%	0.204	42%	0.418	C	S	.	.	H	α-helix	trans	-64.5	-41.9	177.3	-83.9	-77.4	179.7	-178.3	-6.3	112.6	E616 L648 F671 V672 R678 Q679	E616-R675 PolarHBondContact O-NH2 2.76Å; L648-R675 HydrophobicContact CD2-CB 3.5Å; L648-R675 HydrophobicContact CD2-CG 4.29Å; F671-R675 HydrophobicContact CD1-CG 4.43Å; F671-R675 HydrophobicContact CE1-CG 3.95Å; F671-R675 HydrophobicContact CE2-CG 4.26Å; F671-R675 HydrophobicContact CZ-CG 3.86Å; F671-R675 WeakPolarHBondContact O-CB 3.28Å; F671-R675 PolarHBondContact O-N 3.14Å; V672-R675 PolarHBondContact O-N 3.08Å; R675-R678 PolarHBondContact O-N 3.47Å; R675-Q679 PolarHBondContact O-N 2.96Å
676	V	77.6	Confident	72.5	Confident	65 Å²	65	95.5 Å²	95.5	39%	0.394	45%	0.448	S	S	.	.	H	α-helix	trans	-65.4	-42.7	178	173	0	0	0	0	111.1	L648 V672 R678 Q679 A680	L648-V676 HydrophobicContact CB-CG2 4.49Å; L648-V676 HydrophobicContact CD2-CG2 4.32Å; V672-V676 HydrophobicContact CG1-CG2 4.32Å; V672-V676 WeakPolarHBondContact O-CB 3.35Å; V672-V676 WeakPolarHBondContact O-CG2 3.32Å; V672-V676 PolarHBondContact O-N 3.47Å; V676-R678 VanDerWaalsContact C-N 3.34Å; V676-R678 PolarHBondContact O-N 2.82Å; V676-Q679 PolarHBondContact O-N 2.96Å; V676-A680 PolarHBondContact O-N 3.12Å
677	S	73.9	Confident	70.9	Confident	77 Å²	77	92.2 Å²	92.2	54%	0.538	45%	0.445	S	S	.	.	H	α-helix	trans	-59.7	-41.5	173.5	-69	0	0	0	0	112.7	K673 E674 A680 G681	K673-S677 PolarHBondContact O-N 3.19Å; K673-S677 VanDerWaalsContact O-N 3.13Å; K673-S677 PolarHBondContact O-OG 2.87Å; E674-S677 PolarHBondContact O-N 2.97Å; S677-A680 PolarHBondContact O-N 2.92Å; S677-G681 PolarHBondContact O-N 3.44Å; S677-G681 VanDerWaalsContact O-N 3.15Å
678	R	75.7	Confident	68.8	Low	152 Å²	152	92 Å²	92	57%	0.574	45%	0.445	S	S	*	.	H	α-helix	trans	-65.2	-36.8	175.6	-71.1	176.6	75.4	164.6	1.5	112.3	E674 R675 V676 R682	E674-R678 WeakPolarHBondContact O-CG 3.23Å; E674-R678 PolarHBondContact O-N 2.94Å; E674-R678 VanDerWaalsContact O-N 3.1Å; R675-R678 PolarHBondContact O-N 3.47Å; V676-R678 VanDerWaalsContact C-N 3.34Å; V676-R678 PolarHBondContact O-N 2.82Å; R678-R682 PolarHBondContact O-N 3.23Å; R678-R682 VanDerWaalsContact O-N 3.16Å
679	Q	68.1	Low	66.7	Low	107 Å²	107	95.2 Å²	95.2	50%	0.5	47%	0.472	S	S	.	.	H	α-helix	trans	-66.7	-43.1	174.3	-76.9	-178.6	-22.3	0	0	112.6	R675 V676 G681 R682 Q683	R675-Q679 PolarHBondContact O-N 2.96Å; V676-Q679 PolarHBondContact O-N 2.96Å; Q679-G681 PolarHBondContact O-N 2.88Å; Q679-R682 PolarHBondContact O-N 3.12Å; Q679-Q683 PolarHBondContact O-N 3.17Å
680	A	67.9	Low	64.8	Low	56 Å²	56	100.3 Å²	100.3	46%	0.463	49%	0.49	S	S	.	.	H	α-helix	trans	-59.3	-47.2	177.3	0	0	0	0	0	111.9	V676 S677 R682 Q683 Q684	V676-A680 PolarHBondContact O-N 3.12Å; S677-A680 PolarHBondContact O-N 2.92Å; A680-R682 VanDerWaalsContact C-N 3.31Å; A680-R682 PolarHBondContact O-N 2.69Å; A680-Q683 PolarHBondContact O-N 3.08Å; A680-Q683 VanDerWaalsContact O-N 3.1Å; A680-Q684 PolarHBondContact O-N 3.43Å
681	G	60.7	Low	62.8	Low	33 Å²	33	100.9 Å²	100.9	34%	0.34	50%	0.495	S	S	.	.	H	α-helix	trans	-61.3	-35.7	175	0	0	0	0	0	113.7	S677 Q679 Q683 Q684 R685	S677-G681 PolarHBondContact O-N 3.44Å; S677-G681 VanDerWaalsContact O-N 3.15Å; Q679-G681 PolarHBondContact O-N 2.88Å; G681-Q683 VanDerWaalsContact C-N 3.3Å; G681-Q683 PolarHBondContact O-N 2.66Å; G681-Q684 PolarHBondContact O-N 3.39Å; G681-R685 PolarHBondContact O-N 2.76Å
682	R	61.8	Low	60.5	Low	142 Å²	142	107.8 Å²	107.8	54%	0.536	53%	0.528	S	S	.	.	H	α-helix	trans	-71.3	-21.9	176	-145.7	-179.5	-161.9	-178.1	10.2	112.6	Q615 E617 R678 Q679 A680	Q615-R682 VanDerWaalsContact OE1-NH2 3.08Å; E617-R682 IonicContact OE1-CZ 2.68Å; E617-R682 IonicContact OE1-NH1 2.67Å; E617-R682 PolarHBondContact OE1-NH1 2.92Å; E617-R682 IonicContact OE1-NH2 2.76Å; R678-R682 PolarHBondContact O-N 3.23Å; R678-R682 VanDerWaalsContact O-N 3.16Å; Q679-R682 PolarHBondContact O-N 3.12Å; A680-R682 VanDerWaalsContact C-N 3.31Å; A680-R682 PolarHBondContact O-N 2.69Å
683	Q	53.3	Low	58.3	Low	147 Å²	147	111.4 Å²	111.4	69%	0.687	55%	0.553	S	S	*	*	H	α-helix	trans	-80.5	-44.1	170.3	-69.8	-175.6	4.5	0	0	111.9	Q679 A680 G681 K686 A687	Q679-Q683 PolarHBondContact O-N 3.17Å; A680-Q683 PolarHBondContact O-N 3.08Å; A680-Q683 VanDerWaalsContact O-N 3.1Å; G681-Q683 VanDerWaalsContact C-N 3.3Å; G681-Q683 PolarHBondContact O-N 2.66Å; Q683-K686 CarbonylContact O-C 3.6Å; Q683-K686 WeakPolarHBondContact O-CA 3.22Å; Q683-K686 WeakPolarHBondContact O-CB 3.43Å; Q683-K686 PolarHBondContact O-N 3.2Å; Q683-A687 PolarHBondContact O-N 3.02Å
684	Q	51.5	Low	56.5	Low	122 Å²	122	112.4 Å²	112.4	57%	0.57	56%	0.564	S	S	*	*	H	α-helix	trans	-62.1	-48.6	-177.8	-178.9	168.5	-16	0	0	112.4	A680 G681 K686 A687 E688	A680-Q684 PolarHBondContact O-N 3.43Å; G681-Q684 PolarHBondContact O-N 3.39Å; Q684-K686 PolarHBondContact O-N 3.01Å; Q684-A687 WeakPolarHBondContact O-CB 3.41Å; Q684-A687 PolarHBondContact O-N 3.3Å; Q684-E688 VanDerWaalsContact CG-OE1 3.23Å; Q684-E688 WeakPolarHBondContact CG-OE1 3.23Å; Q684-E688 PolarHBondContact NE2-OE1 2.8Å; Q684-E688 PolarHBondContact O-N 2.97Å; Q684-E688 VanDerWaalsContact O-N 3.12Å
685	R	52.6	Low	54.6	Low	196 Å²	196	112.2 Å²	112.2	74%	0.74	58%	0.579	S	S	*	*	H	α-helix	trans	-56.5	-24.4	172.9	-69.5	-177.6	-179.2	-177.1	0.6	113.5	G681 E688 A689	G681-R685 PolarHBondContact O-N 2.76Å; R685-E688 WeakPolarHBondContact CA-OE2 3.24Å; R685-A689 WeakPolarHBondContact O-CB 3.42Å; R685-A689 PolarHBondContact O-N 2.98Å
686	K	47.3	Very low	52.4	Low	171 Å²	171	114 Å²	114	74%	0.743	61%	0.605	S	S	*	*	H	α-helix	trans	-87.8	-11.9	180	-141.5	173.9	-170.8	175.9	0	113.4	Q683 Q684	Q683-K686 CarbonylContact O-C 3.6Å; Q683-K686 WeakPolarHBondContact O-CA 3.22Å; Q683-K686 WeakPolarHBondContact O-CB 3.43Å; Q683-K686 PolarHBondContact O-N 3.2Å; Q684-K686 PolarHBondContact O-N 3.01Å
687	A	46.8	Very low	50.3	Low	60 Å²	60	117.6 Å²	117.6	50%	0.496	63%	0.627	S	S	.	*	H	α-helix	trans	-85.2	-49.5	165.3	0	0	0	0	0	110.2	Q683 Q684 A689 K690 E691	Q683-A687 PolarHBondContact O-N 3.02Å; Q684-A687 WeakPolarHBondContact O-CB 3.41Å; Q684-A687 PolarHBondContact O-N 3.3Å; A687-A689 PolarHBondContact O-N 3.05Å; A687-K690 WeakPolarHBondContact O-CA 3.39Å; A687-K690 VanDerWaalsContact O-CB 3.27Å; A687-K690 WeakPolarHBondContact O-CB 3.43Å; A687-K690 PolarHBondContact O-N 3.43Å; A687-E691 PolarHBondContact O-N 2.95Å
688	E	44.6	Very low	48.5	Very low	94 Å²	94	119.6 Å²	119.6	44%	0.439	64%	0.638	S	S	.	*	H	α-helix	trans	-55.3	-52	-179.8	-68.2	157.5	174.4	0	0	111.5	Q684 R685 K690 E691	Q684-E688 VanDerWaalsContact CG-OE1 3.23Å; Q684-E688 WeakPolarHBondContact CG-OE1 3.23Å; Q684-E688 PolarHBondContact NE2-OE1 2.8Å; Q684-E688 PolarHBondContact O-N 2.97Å; Q684-E688 VanDerWaalsContact O-N 3.12Å; R685-E688 WeakPolarHBondContact CA-OE2 3.24Å; E688-K690 PolarHBondContact O-N 2.78Å; E688-E691 PolarHBondContact O-N 2.96Å
689	A	42.3	Very low	46.2	Very low	68 Å²	68	121.4 Å²	121.4	56%	0.562	65%	0.653	S	S	*	*	H	α-helix	trans	-64.6	-5.6	177	0	0	0	0	0	115.1	R685 A687	R685-A689 WeakPolarHBondContact O-CB 3.42Å; R685-A689 PolarHBondContact O-N 2.98Å; A687-A689 PolarHBondContact O-N 3.05Å
690	K	42.3	Very low	44.5	Very low	155 Å²	155	121.4 Å²	121.4	67%	0.674	66%	0.663	S	S	*	*	H	α-helix	trans	-95.8	-23.6	175.5	-158.3	177.3	-178.4	-175.1	0	112.1	A687 E688 S693	A687-K690 WeakPolarHBondContact O-CA 3.39Å; A687-K690 VanDerWaalsContact O-CB 3.27Å; A687-K690 WeakPolarHBondContact O-CB 3.43Å; A687-K690 PolarHBondContact O-N 3.43Å; E688-K690 PolarHBondContact O-N 2.78Å; K690-S693 PolarHBondContact O-OG 3.43Å
691	E	42.1	Very low	42.7	Very low	158 Å²	158	123.8 Å²	123.8	74%	0.738	68%	0.682	S	S	*	*	H	α-helix	trans	-82.9	-38.4	-177.5	-162.2	153.3	-149	0	0	111.7	A687 E688 S693 L694	A687-E691 PolarHBondContact O-N 2.95Å; E688-E691 PolarHBondContact O-N 2.96Å; E691-S693 PolarHBondContact O-N 2.86Å; E691-L694 PolarHBondContact O-N 2.88Å
692	E	38.1	Very low	41.1	Very low	163 Å²	163	126.2 Å²	126.2	76%	0.762	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-58.3	-28.8	172.9	-81.4	-173.3	131.6	0	0	113.8	L694	E692-L694 PolarHBondContact O-N 3.45Å
693	S	38.3	Very low	39.4	Very low	91 Å²	91	125.2 Å²	125.2	64%	0.636	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-69.7	-3.8	-174.2	73.9	0	0	0	0	115.6	K690 E691	K690-S693 PolarHBondContact O-OG 3.43Å; E691-S693 PolarHBondContact O-N 2.86Å
694	L	43.8	Very low	38.1	Very low	153 Å²	153	122.1 Å²	122.1	80%	0.801	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-114.2	-3.1	-173	-76.8	164.2	0	0	0	114.8	E691 E692	E691-L694 PolarHBondContact O-N 2.88Å; E692-L694 PolarHBondContact O-N 3.45Å
695	A	39.2	Very low	37	Very low	92 Å²	92	122.3 Å²	122.3	76%	0.76	73%	0.731	S	S	*	*			trans	-111.1	31.6	-165.9	0	0	0	0	0	115.7
696	A	33.7	Very low	35.7	Very low	91 Å²	91	120.1 Å²	120.1	75%	0.752	74%	0.74	S	S	*	*			trans	-131.6	79.9	-173.9	0	0	0	0	0	114.9
697	V	31.6	Very low	34.7	Very low	141 Å²	141	121.3 Å²	121.3	86%	0.855	75%	0.745	S	S	*	*			trans	-141.2	119.2	165	-176.9	0	0	0	0	110.2
698	P	37.4	Very low	33.7	Very low	119 Å²	119	124.1 Å²	124.1	77%	0.773	76%	0.758	S	S	*	*			trans	-99.2	138.6	-178.6	35.4	-31.9	0	0	0	113.5
699	Q	26.9	Very low	33	Very low	191 Å²	191	125.8 Å²	125.8	89%	0.893	78%	0.777	S	S	*	*			trans	-154.4	163.3	161.4	-87	-130.2	9.4	0	0	112.2
700	P	32.8	Very low	32.3	Very low	107 Å²	107	129.8 Å²	129.8	70%	0.695	79%	0.794	S	S	*	*			trans	-117.3	166	-150.4	41.7	-33.3	0	0	0	117.5
701	A	30.8	Very low	31.6	Very low	105 Å²	105	125.9 Å²	125.9	87%	0.868	80%	0.798	S	S	*	*			trans	42.4	112.7	149.2	0	0	0	0	0	120.4
702	G	25.9	Very low	31	Very low	85 Å²	85	123.9 Å²	123.9	88%	0.876	80%	0.802	S	S	*	*			trans	-161.2	160.9	167.9	0	0	0	0	0	112.1
703	S	25.9	Very low	30.4	Very low	120 Å²	120	122.7 Å²	122.7	84%	0.839	81%	0.806	S	S	*	*			trans	-119.1	157.5	-166.6	61.5	0	0	0	0	115.5
704	A	26.1	Very low	30.1	Very low	83 Å²	83	125.2 Å²	125.2	69%	0.686	82%	0.817	S	S	*	*			trans	92.2	121.4	150.6	0	0	0	0	0	120.8
705	T	27.8	Very low	29.3	Very low	125 Å²	125	123 Å²	123	77%	0.767	82%	0.815	S	S	*	*			trans	47.2	117.5	140	59	0	0	0	0	121.2
706	T	26.8	Very low	28.7	Very low	150 Å²	150	123.7 Å²	123.7	92%	0.92	81%	0.814	S	S	*	*				-169.9	177	116.3	16.5	0	0	0	0	112.8
707	K	25.1	Very low	28.5	Very low	196 Å²	196	125.6 Å²	125.6	85%	0.852	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-75.4	156.4	-173.1	-64	177.9	178.8	-178.5	0	113.4
708	P	26.8	Very low	28.1	Very low	120 Å²	120	126.5 Å²	126.5	78%	0.779	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-74.4	145.2	177	31.1	-36	0	0	0	113.1
709	P	29.5	Very low	27.8	Very low	128 Å²	128	123.7 Å²	123.7	83%	0.831	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-84.3	151.7	167.3	34.7	-33.2	0	0	0	111.8
710	V	27.6	Very low	27.6	Very low	152 Å²	152	120.8 Å²	120.8	92%	0.921	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-96.5	134.5	177.3	173.6	0	0	0	0	110.8
711	G	28.3	Very low	27.4	Very low	74 Å²	74	122.2 Å²	122.2	76%	0.763	77%	0.774	S	S	*	*			trans	98.5	102.6	153	0	0	0	0	0	116.8
712	S	27.9	Very low	27.4	Very low	116 Å²	116	124.1 Å²	124.1	81%	0.811	77%	0.769	S	S	*	*			trans	-137	130	156.3	58.8	0	0	0	0	110.4
713	T	27.4	Very low	27.5	Very low	138 Å²	138	129.9 Å²	129.9	85%	0.847	77%	0.766	S	S	*	*			trans	-45.6	139.7	179	42.1	0	0	0	0	115.2	S715	T713-S715 PolarHBondContact O-N 3.1Å
714	V	30	Very low	27.8	Very low	143 Å²	143	132.9 Å²	132.9	87%	0.867	76%	0.764	S	S	*	*			trans	-59.7	118.5	167.2	178.6	0	0	0	0	109.7
715	S	27.3	Very low	28.2	Very low	108 Å²	108	136.8 Å²	136.8	76%	0.755	77%	0.769	S	S	*	*			trans	-88.5	130.9	164.1	-171.1	0	0	0	0	109.1	T713 V717	T713-S715 PolarHBondContact O-N 3.1Å; S715-V717 PolarHBondContact O-N 3.31Å
716	S	27.9	Very low	28.6	Very low	105 Å²	105	137.8 Å²	137.8	73%	0.734	77%	0.774	S	S	*	*			trans	-74.1	110.1	177.9	53.5	0	0	0	0	110.6	H718	S716-H718 PolarHBondContact O-N 2.89Å
717	V	27.9	Very low	29.1	Very low	132 Å²	132	132.8 Å²	132.8	80%	0.8	75%	0.753	S	S	*	*			trans	-60.1	120.6	172.2	179.4	0	0	0	0	109.2	S715 V719	S715-V717 PolarHBondContact O-N 3.31Å; V717-V719 PolarHBondContact O-N 3.05Å; V717-V719 VanDerWaalsContact O-N 3.1Å
718	H	24.6	Very low	29.7	Very low	159 Å²	159	128 Å²	128	74%	0.736	74%	0.74	S	S	*	*			trans	-82.4	88.2	-174.5	-167.4	-60.8	0	0	0	110.7	S716 N720	S716-H718 PolarHBondContact O-N 2.89Å; H718-N720 PolarHBondContact O-N 3.39Å; H718-N720 VanDerWaalsContact O-N 3.16Å
719	V	30.1	Very low	30.5	Very low	61 Å²	61	125.4 Å²	125.4	37%	0.37	74%	0.735	S	S	.	*			trans	-63.8	114.2	176.9	-178.5	0	0	0	0	110.1	V717 Y721	V717-V719 PolarHBondContact O-N 3.05Å; V717-V719 VanDerWaalsContact O-N 3.1Å; V719-Y721 HydrophobicContact CB-CE2 4.39Å; V719-Y721 HydrophobicContact CG1-CD2 4.41Å; V719-Y721 HydrophobicContact CG1-CE2 4.09Å
720	N	23.9	Very low	31.3	Very low	129 Å²	129	124.4 Å²	124.4	69%	0.69	72%	0.719	S	S	*	*			trans	-84.1	119.2	171.6	-91.5	-17.3	0	0	0	110.3	H718 N722	H718-N720 PolarHBondContact O-N 3.39Å; H718-N720 VanDerWaalsContact O-N 3.16Å; N720-N722 PolarHBondContact O-N 3.38Å
721	Y	28.8	Very low	32.7	Very low	137 Å²	137	119.3 Å²	119.3	54%	0.537	69%	0.688	S	S	.	*			trans	-85.9	100.6	175.7	-72.1	-95.4	0	0	0	110.4	V719 Y723 V731	V719-Y721 HydrophobicContact CB-CE2 4.39Å; V719-Y721 HydrophobicContact CG1-CD2 4.41Å; V719-Y721 HydrophobicContact CG1-CE2 4.09Å; Y721-Y723 WeakPolarHBondContact O-CD2 3.18Å; Y721-Y723 PolarHBondContact O-N 3.23Å; Y721-V731 HydrophobicContact CD1-CG2 4.28Å; Y721-V731 HydrophobicContact CE1-CG2 4.16Å
722	N	29.1	Very low	34.5	Very low	145 Å²	145	120.9 Å²	120.9	78%	0.775	69%	0.688	S	S	*	*			trans	-76	108.3	165.5	-77.1	-15	0	0	0	109.1	N720	N720-N722 PolarHBondContact O-N 3.38Å
723	Y	29.1	Very low	37.1	Very low	206 Å²	206	116.5 Å²	116.5	81%	0.808	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-79.2	123.8	175.5	-79.1	-105.9	0	0	0	110.8	Y721	Y721-Y723 WeakPolarHBondContact O-CD2 3.18Å; Y721-Y723 PolarHBondContact O-N 3.23Å
724	F	31.3	Very low	39.9	Very low	183 Å²	183	115.2 Å²	115.2	80%	0.803	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-85.6	148.7	157	-75.6	-88	0	0	0	110
725	E	34.5	Very low	42.7	Very low	166 Å²	166	110.6 Å²	110.6	78%	0.776	61%	0.61	S	S	*	*	S	Bend	trans	-81.5	120.5	171.7	-77	173.4	-179.4	0	0	108.7	K673	K673-E725 IonicContact NZ-OE1 2.72Å; K673-E725 PolarHBondContact NZ-OE1 3.43Å
726	V	36.2	Very low	45.8	Very low	145 Å²	145	109 Å²	109	88%	0.879	59%	0.59	S	S	*	*	S	Bend	trans	91.8	120.2	-173.2	-173.4	0	0	0	0	115.5
727	G	37.6	Very low	48.9	Very low	46 Å²	46	107 Å²	107	47%	0.474	58%	0.577	S	S	.	*	S	Bend	trans	83	72.3	148	0	0	0	0	0	119.3
728	T	37.5	Very low	52.2	Low	95 Å²	95	101.4 Å²	101.4	58%	0.583	54%	0.542	S	S	*	.			trans	65.1	131.6	172.4	74.2	0	0	0	0	116	Q730	T728-Q730 PolarHBondContact O-N 2.94Å
729	G	43.1	Very low	55.5	Low	65 Å²	65	98.6 Å²	98.6	67%	0.67	53%	0.533	S	S	*	.			trans	-81.8	73.1	-178.5	0	0	0	0	0	113.1	V731	G729-V731 PolarHBondContact O-N 3.46Å
730	Q	48	Very low	58.6	Low	107 Å²	107	96.6 Å²	96.6	50%	0.5	52%	0.519	S	S	.	.			trans	-59.2	125.3	163	-84.3	-172.4	-80.6	0	0	109.1	T728	T728-Q730 PolarHBondContact O-N 2.94Å
731	V	55.3	Low	62.1	Low	45 Å²	45	94.7 Å²	94.7	27%	0.273	51%	0.506	S	S	.	.			trans	-77.2	150	168.8	164.8	0	0	0	0	108.9	P529 Y721 G729 V733	P529-V731 HydrophobicContact CB-CB 3.72Å; P529-V731 HydrophobicContact CB-CG1 4.16Å; P529-V731 HydrophobicContact CB-CG2 3.58Å; P529-V731 HydrophobicContact CG-CB 4Å; P529-V731 HydrophobicContact CG-CG2 3.57Å; Y721-V731 HydrophobicContact CD1-CG2 4.28Å; Y721-V731 HydrophobicContact CE1-CG2 4.16Å; G729-V731 PolarHBondContact O-N 3.46Å; V731-V733 PolarHBondContact O-N 3.26Å
732	S	66.4	Low	65.3	Low	108 Å²	108	88.3 Å²	88.3	76%	0.755	48%	0.481	S	S	*	.			trans	-64.9	87.8	-178.4	178.5	0	0	0	0	111.7
733	V	82.1	Confident	68.5	Low	23 Å²	23	83.7 Å²	83.7	14%	0.139	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-69.1	131.3	172.1	178.8	0	0	0	0	109.6	M536 V731 Y735	M536-V733 HydrophobicContact CB-CG1 4.19Å; M536-V733 HydrophobicContact CG-CG1 4.07Å; V731-V733 PolarHBondContact O-N 3.26Å; V733-Y735 HydrophobicContact CB-CD2 4.48Å; V733-Y735 HydrophobicContact CB-CE2 3.81Å; V733-Y735 HydrophobicContact CG1-CD1 4.26Å; V733-Y735 HydrophobicContact CG1-CD2 4.28Å; V733-Y735 HydrophobicContact CG1-CE1 3.9Å; V733-Y735 HydrophobicContact CG1-CE2 3.91Å; V733-Y735 HydrophobicContact CG1-CG 4.45Å; V733-Y735 WeakPolarHBondContact O-CD2 3.33Å
734	I	86.4	Confident	71.7	Confident	111 Å²	111	74.3 Å²	74.3	57%	0.569	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-87.3	117.1	170.4	-58.9	175.5	0	0	0	107.4	Q533	Q533-I734 PolarHBondContact NE2-O 2.98Å
735	Y	89.8	Confident	74.9	Confident	46 Å²	46	65.6 Å²	65.6	18%	0.18	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-94.5	117.4	176.6	-63.1	-86.1	0	0	0	110	M536 D575 L576 N579 V733	M536-Y735 HydrophobicContact CE-CD1 4.39Å; M536-Y735 HydrophobicContact CE-CE1 3.93Å; M536-Y735 HydrophobicContact CG-CD1 3.67Å; M536-Y735 HydrophobicContact CG-CE1 3.93Å; M536-Y735 HydrophobicContact SD-CD1 3.74Å; M536-Y735 HydrophobicContact SD-CE1 3.9Å; D575-Y735 HydrophobicContact CB-CE1 3.97Å; L576-Y735 HydrophobicContact CD1-CD1 4.44Å; N579-Y735 HydrophobicContact CB-CD1 4.06Å; N579-Y735 HydrophobicContact CB-CD2 3.42Å; N579-Y735 VanDerWaalsContact CB-CD2 3.42Å; N579-Y735 HydrophobicContact CB-CE2 4.04Å; N579-Y735 HydrophobicContact CB-CG 3.43Å; N579-Y735 VanDerWaalsContact CB-CG 3.43Å; N579-Y735 VanDerWaalsContact CG-CE2 3.46Å; N579-Y735 WeakPolarHBondContact ND2-CE2 3.44Å; V733-Y735 HydrophobicContact CB-CD2 4.48Å; V733-Y735 HydrophobicContact CB-CE2 3.81Å; V733-Y735 HydrophobicContact CG1-CD1 4.26Å; V733-Y735 HydrophobicContact CG1-CD2 4.28Å; V733-Y735 HydrophobicContact CG1-CE1 3.9Å; V733-Y735 HydrophobicContact CG1-CE2 3.91Å; V733-Y735 HydrophobicContact CG1-CG 4.45Å; V733-Y735 WeakPolarHBondContact O-CD2 3.33Å
736	H	91.3	Very high	78	Confident	74 Å²	74	57.7 Å²	57.7	34%	0.343	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-71.5	147	173.3	-75.5	89.7	0	0	0	110.8	D537 A540 L576 Q580	D537-H736 IonicContact OD1-CE1 3.85Å; D537-H736 PolarHBondContact OD1-CE1 3.49Å; D537-H736 IonicContact OD1-ND1 2.7Å; D537-H736 PolarHBondContact OD1-ND1 2.83Å; A540-H736 HydrophobicContact CB-CB 3.79Å; L576-H736 WeakPolarHBondContact CD1-O 3.38Å; Q580-H736 PolarHBondContact NE2-O 2.69Å
737	S	94	Very high	80.9	Confident	64 Å²	64	50.8 Å²	50.8	45%	0.448	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-82.5	142.2	179	-56	0	0	0	0	111.5	N544 Q580	N544-S737 PolarHBondContact ND2-O 2.96Å; Q580-S737 VanDerWaalsContact OE1-CA 3.28Å
738	L	96.4	Very high	83.7	Confident	14 Å²	14	48.7 Å²	48.7	7%	0.073	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-77.4	142.1	170.9	-63.7	-177.6	0	0	0	110.3	I543 N544 L576 L577 F740 P742	I543-L738 HydrophobicContact CB-CD2 4.17Å; I543-L738 HydrophobicContact CG2-CD2 3.69Å; N544-L738 WeakPolarHBondContact OD1-CA 3.36Å; L576-L738 HydrophobicContact CD2-CD2 4.11Å; L577-L738 HydrophobicContact CD2-CD1 3.89Å; L738-F740 HydrophobicContact CD1-CE2 4.46Å; L738-F740 HydrophobicContact CD1-CZ 4.3Å; L738-F740 PolarHBondContact O-N 3.21Å; L738-F740 VanDerWaalsContact O-N 3.08Å; L738-P742 HydrophobicContact CD1-CG 4.15Å
739	D	95.6	Very high	86.2	Confident	101 Å²	101	44.2 Å²	44.2	54%	0.54	26%	0.255	S	S	.	.	S	Bend	trans	-76.3	11	179.2	-67	-34.9	0	0	0	113.3	N544 Y547	N544-D739 WeakPolarHBondContact CB-OD2 3.44Å; N544-D739 VanDerWaalsContact CG-OD2 3.26Å; N544-D739 PolarHBondContact ND2-OD2 2.93Å; N544-D739 PolarHBondContact OD1-N 3.14Å; Y547-D739 HydrophobicContact CD1-CB 3.69Å; Y547-D739 HydrophobicContact CE1-CB 3.64Å; Y547-D739 VanDerWaalsContact CE1-O 3.27Å; Y547-D739 WeakPolarHBondContact CE1-O 2.96Å
740	F	95.3	Very high	88.6	Confident	19 Å²	19	41.1 Å²	41.1	8%	0.083	22%	0.223	C	C	.	.	S	Bend	trans	-154.7	158.9	178.8	61.1	-87.2	0	0	0	111.2	F432 I543 Y547 I561 V563 L738 P742	F432-F740 HydrophobicContact CD2-CE1 4.14Å; F432-F740 HydrophobicContact CD2-CE2 4.16Å; F432-F740 AromaticContact CD2-CZ 3.47Å; F432-F740 HydrophobicContact CD2-CZ 3.47Å; F432-F740 VanDerWaalsContact CD2-CZ 3.47Å; F432-F740 AromaticContact CE2-CE1 3.62Å; F432-F740 HydrophobicContact CE2-CE1 3.62Å; F432-F740 HydrophobicContact CE2-CE2 4.12Å; F432-F740 AromaticContact CE2-CZ 3.38Å; F432-F740 HydrophobicContact CE2-CZ 3.38Å; F432-F740 HydrophobicContact CZ-CE1 4.43Å; I543-F740 HydrophobicContact CG2-CE1 3.61Å; I543-F740 HydrophobicContact CG2-CZ 3.55Å; Y547-F740 AromaticContact CD1-CD1 3.75Å; Y547-F740 HydrophobicContact CD1-CD1 3.75Å; Y547-F740 HydrophobicContact CD1-CE1 4.41Å; Y547-F740 AromaticContact CD2-CD1 3.89Å; Y547-F740 HydrophobicContact CD2-CD1 3.89Å; Y547-F740 HydrophobicContact CD2-CE1 4.4Å; Y547-F740 HydrophobicContact CE1-CB 4.26Å; Y547-F740 HydrophobicContact CE1-CD1 4.03Å; Y547-F740 HydrophobicContact CE2-CB 4.25Å; Y547-F740 HydrophobicContact CE2-CD1 4.2Å; Y547-F740 HydrophobicContact CE2-CG 4.46Å; Y547-F740 AromaticContact CG-CD1 3.63Å; Y547-F740 HydrophobicContact CG-CD1 3.63Å; Y547-F740 HydrophobicContact CG-CE1 4.01Å; I561-F740 HydrophobicContact CB-CD2 3.91Å; I561-F740 HydrophobicContact CB-CE2 4.2Å; I561-F740 HydrophobicContact CD1-CB 3.94Å; I561-F740 HydrophobicContact CD1-CD2 4.11Å; I561-F740 HydrophobicContact CD1-CG 3.96Å; I561-F740 HydrophobicContact CG2-CD2 3.54Å; I561-F740 HydrophobicContact CG2-CE2 3.36Å; I561-F740 HydrophobicContact CG2-CG 4.28Å; I561-F740 HydrophobicContact CG2-CZ 4Å; V563-F740 HydrophobicContact CG1-CE2 4.46Å; L738-F740 HydrophobicContact CD1-CE2 4.46Å; L738-F740 HydrophobicContact CD1-CZ 4.3Å; L738-F740 PolarHBondContact O-N 3.21Å; L738-F740 VanDerWaalsContact O-N 3.08Å; F740-P742 HydrophobicContact CD2-CG 4.19Å; F740-P742 HydrophobicContact CE2-CB 4.42Å; F740-P742 HydrophobicContact CE2-CG 3.86Å
741	E	95.4	Very high	90.7	Very high	88 Å²	88	36.2 Å²	36.2	41%	0.411	20%	0.201	S	C	.	.			trans	-97.7	114.2	173.6	-62	-169.5	160.5	0	0	109.9	T772	E741-T772 HydrophobicContact CG-CG2 4.06Å
742	P	96.5	Very high	92.5	Very high	3 Å²	3	34 Å²	34	2%	0.019	19%	0.188	C	C	.	.			trans	-69.6	135.2	-179.7	-15.3	28.2	0	0	0	112.4	I561 V563 L577 L738 F740 T772 C773	I561-P742 CarbonylContact O-C 3.55Å; I561-P742 WeakPolarHBondContact O-CA 3.33Å; V563-P742 HydrophobicContact CG1-CB 4.44Å; V563-P742 HydrophobicContact CG1-CG 4.29Å; L577-P742 HydrophobicContact CD2-CG 3.86Å; L738-P742 HydrophobicContact CD1-CG 4.15Å; F740-P742 HydrophobicContact CD2-CG 4.19Å; F740-P742 HydrophobicContact CE2-CB 4.42Å; F740-P742 HydrophobicContact CE2-CG 3.86Å; P742-T772 WeakPolarHBondContact CD-O 3.2Å; P742-C773 VanDerWaalsContact O-CA 3.29Å; P742-C773 WeakPolarHBondContact O-CA 3.35Å; P742-C773 PolarHBondContact O-SG 2.73Å
743	V	95.9	Very high	93.7	Very high	49 Å²	49	29 Å²	29	30%	0.297	15%	0.153	S	C	.	.	S	Bend	trans	-71.1	-51.3	177	-176.2	0	0	0	0	110.6	I561 K774 G775 T947	I561-V743 PolarHBondContact O-N 3.48Å; V743-K774 PolarHBondContact O-N 3.16Å; V743-G775 PolarHBondContact O-N 3.1Å; V743-T947 HydrophobicContact CG1-CG2 3.97Å
744	N	97.8	Very high	94	Very high	9 Å²	9	31 Å²	31	5%	0.048	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	146.1	179.5	-58.4	-37.1	0	0	0	111.2	S562 V563 F746 G775 F777 E943	S562-N744 VanDerWaalsContact CA-O 3.31Å; S562-N744 WeakPolarHBondContact CA-O 3.28Å; S562-N744 WeakPolarHBondContact CB-O 3.45Å; S562-N744 PolarHBondContact OG-N 3.06Å; S562-N744 PolarHBondContact OG-O 2.96Å; V563-N744 PolarHBondContact N-O 3.28Å; N744-F746 HydrophobicContact CB-CD2 4.42Å; N744-F746 HydrophobicContact CB-CE1 4.4Å; N744-F746 HydrophobicContact CB-CE2 3.73Å; N744-F746 HydrophobicContact CB-CZ 3.72Å; N744-G775 CarbonylContact C-O 3.59Å; N744-G775 WeakPolarHBondContact CA-O 3.42Å; N744-F777 HydrophobicContact CB-CD2 4.42Å; N744-F777 HydrophobicContact CB-CE2 4.06Å; N744-E943 PolarHBondContact ND2-O 3.06Å
745	F	98.3	Very high	94.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	120.2	164.2	172.1	-153.5	0	0	0	109.8	V563 S570 L573 F574 L577 A747 I752 L770 G775 F776 F777	V563-F745 HydrophobicContact CG2-CB 3.95Å; V563-F745 HydrophobicContact CG2-CD2 3.75Å; V563-F745 HydrophobicContact CG2-CG 4.01Å; V563-F745 WeakPolarHBondContact O-CA 3.4Å; S570-F745 WeakPolarHBondContact O-CZ 3.22Å; L573-F745 HydrophobicContact CB-CD2 4.4Å; L573-F745 HydrophobicContact CB-CE1 4.27Å; L573-F745 HydrophobicContact CB-CE2 3.71Å; L573-F745 HydrophobicContact CB-CZ 3.65Å; L573-F745 HydrophobicContact CD1-CD2 4.26Å; L573-F745 HydrophobicContact CD1-CE2 3.82Å; L573-F745 HydrophobicContact CG-CE2 4.46Å; F574-F745 HydrophobicContact CB-CE1 3.93Å; F574-F745 HydrophobicContact CB-CZ 4.42Å; F574-F745 HydrophobicContact CD2-CE1 4.18Å; L577-F745 HydrophobicContact CD1-CB 3.84Å; L577-F745 HydrophobicContact CD1-CD1 3.7Å; L577-F745 HydrophobicContact CD1-CE1 4.47Å; L577-F745 HydrophobicContact CD1-CG 3.83Å; F745-A747 HydrophobicContact CE2-CB 4.14Å; F745-A747 HydrophobicContact CZ-CB 4.01Å; F745-I752 HydrophobicContact CE1-CD1 4.42Å; F745-I752 HydrophobicContact CZ-CD1 4.33Å; F745-L770 HydrophobicContact CD1-CD1 4.19Å; F745-G775 PolarHBondContact N-O 3.24Å; F745-F776 HydrophobicContact CB-CD2 4.34Å; F745-F776 AromaticContact CD1-CD2 3.51Å; F745-F776 HydrophobicContact CD1-CD2 3.51Å; F745-F776 AromaticContact CD1-CE2 3.6Å; F745-F776 HydrophobicContact CD1-CE2 3.6Å; F745-F776 HydrophobicContact CE1-CD2 4Å; F745-F776 AromaticContact CE1-CE2 3.57Å; F745-F776 HydrophobicContact CE1-CE2 3.57Å; F745-F776 HydrophobicContact CG-CD2 4.11Å; F745-F776 HydrophobicContact CG-CE2 4.39Å; F745-F776 HydrophobicContact CZ-CE2 4.32Å; F745-F776 WeakPolarHBondContact O-CA 3.5Å; F745-F777 PolarHBondContact O-N 3.29Å
746	F	98.4	Very high	94.1	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	117.3	174.6	-54.6	-79.7	0	0	0	110.1	V563 A564 G565 N744 F777 I779 L940 E943 I944	V563-F746 PolarHBondContact O-N 2.78Å; A564-F746 CarbonylContact C-O 3.54Å; A564-F746 VanDerWaalsContact CA-O 3.23Å; A564-F746 WeakPolarHBondContact CA-O 3.49Å; A564-F746 HydrophobicContact CB-CB 4.23Å; G565-F746 PolarHBondContact N-O 2.9Å; N744-F746 HydrophobicContact CB-CD2 4.42Å; N744-F746 HydrophobicContact CB-CE1 4.4Å; N744-F746 HydrophobicContact CB-CE2 3.73Å; N744-F746 HydrophobicContact CB-CZ 3.72Å; F746-F777 HydrophobicContact CD1-CB 3.82Å; F746-F777 AromaticContact CD1-CD2 3.78Å; F746-F777 HydrophobicContact CD1-CD2 3.78Å; F746-F777 AromaticContact CD1-CG 3.96Å; F746-F777 HydrophobicContact CD1-CG 3.96Å; F746-F777 HydrophobicContact CE1-CB 4.36Å; F746-F777 AromaticContact CE1-CD2 3.62Å; F746-F777 HydrophobicContact CE1-CD2 3.62Å; F746-F777 HydrophobicContact CE1-CE2 4.06Å; F746-F777 AromaticContact CE1-CG 4Å; F746-F777 HydrophobicContact CE1-CG 4Å; F746-F777 HydrophobicContact CZ-CD2 4.45Å; F746-I779 HydrophobicContact CD1-CD1 4.16Å; F746-L940 HydrophobicContact CB-CD1 4.29Å; F746-L940 HydrophobicContact CB-CD2 4.39Å; F746-L940 HydrophobicContact CB-CG 4.39Å; F746-L940 HydrophobicContact CD1-CD1 3.77Å; F746-L940 HydrophobicContact CD1-CG 3.75Å; F746-L940 HydrophobicContact CD2-CD2 3.93Å; F746-L940 HydrophobicContact CD2-CG 3.84Å; F746-L940 HydrophobicContact CE1-CD1 4.22Å; F746-L940 HydrophobicContact CE1-CG 3.89Å; F746-L940 HydrophobicContact CE2-CD2 4.32Å; F746-L940 HydrophobicContact CE2-CG 3.95Å; F746-L940 HydrophobicContact CG-CD1 3.97Å; F746-L940 HydrophobicContact CG-CD2 4.05Å; F746-L940 HydrophobicContact CG-CG 3.72Å; F746-L940 HydrophobicContact CZ-CB 4.48Å; F746-L940 HydrophobicContact CZ-CG 3.98Å; F746-E943 HydrophobicContact CE1-CB 4.18Å; F746-E943 HydrophobicContact CZ-CB 4.36Å; F746-I944 HydrophobicContact CE2-CD1 4.39Å; F746-I944 HydrophobicContact CE2-CG1 4.33Å; F746-I944 HydrophobicContact CZ-CG1 4.23Å
747	A	97.9	Very high	93.9	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	114.5	177.2	0	0	0	0	0	109.4	F745 I752 F776 F777 I779	F745-A747 HydrophobicContact CE2-CB 4.14Å; F745-A747 HydrophobicContact CZ-CB 4.01Å; A747-I752 HydrophobicContact CB-CD1 4.09Å; A747-F776 HydrophobicContact CB-CE2 4.21Å; A747-F777 PolarHBondContact N-O 2.89Å; A747-I779 PolarHBondContact O-N 3.09Å
748	L	95.7	Very high	93.4	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.01	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	124.4	-174	-48.1	-179.4	0	0	0	110.5	G565 H566 S567 S570 S750 I779 Y930 T936	G565-L748 VanDerWaalsContact O-CB 3.3Å; G565-L748 WeakPolarHBondContact O-CB 3.16Å; G565-L748 WeakPolarHBondContact O-CG 3.49Å; G565-L748 PolarHBondContact O-N 3.35Å; H566-L748 CarbonylContact C-O 3.51Å; H566-L748 WeakPolarHBondContact CA-O 3.27Å; S567-L748 PolarHBondContact N-O 3.39Å; S570-L748 PolarHBondContact OG-N 2.89Å; L748-S750 VanDerWaalsContact C-N 3.34Å; L748-S750 PolarHBondContact O-N 3.04Å; L748-I779 WeakPolarHBondContact CA-O 3.4Å; L748-I779 HydrophobicContact CD2-CB 3.82Å; L748-I779 HydrophobicContact CD2-CD1 3.82Å; L748-I779 HydrophobicContact CD2-CG1 4.39Å; L748-I779 HydrophobicContact CD2-CG2 4.11Å; L748-Y930 HydrophobicContact CB-CD1 4.4Å; L748-Y930 HydrophobicContact CB-CD2 4.45Å; L748-Y930 HydrophobicContact CB-CG 4.16Å; L748-T936 HydrophobicContact CD2-CG2 4.02Å
749	G	91.7	Very high	92.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	57.9	45.6	179.3	0	0	0	0	0	112.8	S567 I779 D784 H927 Y930	S567-G749 WeakPolarHBondContact CA-O 3.45Å; G749-I779 PolarHBondContact N-O 3.08Å; G749-D784 WeakPolarHBondContact CA-OD2 3.45Å; G749-H927 PolarHBondContact O-CE1 3.05Å; G749-Y930 WeakPolarHBondContact CA-OH 3.47Å
750	S	93	Very high	92.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.152	C	C	.	.			trans	-92.2	129.3	-154.6	-179.1	0	0	0	0	114.6	S570 L748 I752 N778 V786 A787 Y788	S570-S750 VanDerWaalsContact CB-OG 3.28Å; S570-S750 WeakPolarHBondContact CB-OG 3.47Å; L748-S750 VanDerWaalsContact C-N 3.34Å; L748-S750 PolarHBondContact O-N 3.04Å; S750-I752 VanDerWaalsContact C-N 3.32Å; S750-I752 PolarHBondContact O-N 2.92Å; S750-I752 WeakPolarHBondContact OG-CD1 3.43Å; S750-I752 WeakPolarHBondContact OG-CG1 3.42Å; S750-I752 PolarHBondContact OG-N 3.02Å; S750-N778 WeakPolarHBondContact CB-OD1 3.4Å; S750-V786 CarbonylContact C-O 3.51Å; S750-A787 WeakPolarHBondContact O-CA 3.18Å; S750-Y788 PolarHBondContact O-N 3.31Å
751	P	92.3	Very high	91.9	Very high	4 Å²	4	28.7 Å²	28.7	3%	0.026	17%	0.166	C	C	.	.			trans	-87	7.7	176.7	36.6	-36.5	0	0	0	114.2	S567 G753 M754 F755 V786	S567-P751 VanDerWaalsContact O-CD 3.27Å; S567-P751 WeakPolarHBondContact O-CD 3.26Å; P751-G753 VanDerWaalsContact C-N 3.34Å; P751-G753 PolarHBondContact O-N 2.9Å; P751-M754 HydrophobicContact CB-CE 4.45Å; P751-M754 PolarHBondContact O-N 3.5Å; P751-M754 VanDerWaalsContact O-N 3.16Å; P751-F755 HydrophobicContact CB-CD2 3.92Å; P751-F755 HydrophobicContact CB-CE2 4.11Å; P751-F755 HydrophobicContact CG-CD2 4.24Å; P751-F755 HydrophobicContact CG-CE2 4.32Å; P751-F755 PolarHBondContact O-N 2.93Å; P751-F755 VanDerWaalsContact O-N 3.09Å; P751-V786 VanDerWaalsContact CA-O 3.24Å; P751-V786 WeakPolarHBondContact CA-O 3.34Å; P751-V786 HydrophobicContact CB-CG1 3.91Å; P751-V786 WeakPolarHBondContact CB-O 3.06Å; P751-V786 HydrophobicContact CG-CG1 4.18Å
752	I	93.3	Very high	91.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-50.5	-49.2	-173	-69.1	162.9	0	0	0	112	L571 F574 F745 A747 S750 M754 F755 L756 F776 I790	L571-I752 HydrophobicContact CD1-CG1 4.42Å; F574-I752 HydrophobicContact CB-CD1 3.69Å; F574-I752 HydrophobicContact CB-CG1 4.01Å; F574-I752 HydrophobicContact CD1-CG2 4.21Å; F574-I752 HydrophobicContact CD2-CD1 3.93Å; F574-I752 HydrophobicContact CD2-CG2 4.07Å; F574-I752 HydrophobicContact CE1-CG2 4.45Å; F574-I752 HydrophobicContact CE2-CG2 4.3Å; F574-I752 HydrophobicContact CG-CD1 4.01Å; F574-I752 HydrophobicContact CG-CG1 4.31Å; F574-I752 HydrophobicContact CG-CG2 4.02Å; F574-I752 HydrophobicContact CZ-CG2 4.49Å; F745-I752 HydrophobicContact CE1-CD1 4.42Å; F745-I752 HydrophobicContact CZ-CD1 4.33Å; A747-I752 HydrophobicContact CB-CD1 4.09Å; S750-I752 VanDerWaalsContact C-N 3.32Å; S750-I752 PolarHBondContact O-N 2.92Å; S750-I752 WeakPolarHBondContact OG-CD1 3.43Å; S750-I752 WeakPolarHBondContact OG-CG1 3.42Å; S750-I752 PolarHBondContact OG-N 3.02Å; I752-M754 VanDerWaalsContact C-N 3.35Å; I752-M754 PolarHBondContact O-N 3.45Å; I752-F755 PolarHBondContact O-N 3.23Å; I752-F755 VanDerWaalsContact O-N 3.11Å; I752-L756 HydrophobicContact CG2-CD1 3.64Å; I752-L756 HydrophobicContact CG2-CG 4.01Å; I752-L756 WeakPolarHBondContact O-CG 3.16Å; I752-L756 PolarHBondContact O-N 3.22Å; I752-F776 HydrophobicContact CD1-CE2 4.36Å; I752-F776 HydrophobicContact CD1-CZ 4.19Å; I752-I790 HydrophobicContact CB-CD1 3.99Å; I752-I790 HydrophobicContact CG2-CD1 3.71Å
753	G	90.6	Very high	91.1	Very high	3 Å²	3	37.3 Å²	37.3	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-60.2	-41.2	-177	0	0	0	0	0	113.4	P751 T757	P751-G753 VanDerWaalsContact C-N 3.34Å; P751-G753 PolarHBondContact O-N 2.9Å; G753-T757 WeakPolarHBondContact O-CB 3.41Å; G753-T757 PolarHBondContact O-N 3.02Å; G753-T757 VanDerWaalsContact O-N 3.1Å; G753-T757 PolarHBondContact O-OG1 2.86Å
754	M	89.4	Confident	90.9	Very high	64 Å²	64	35.4 Å²	35.4	32%	0.315	19%	0.193	S	C	.	.	H	α-helix	trans	-62.6	-47	173.4	-176.1	-167.5	69.1	0	0	111.1	P751 I752 T757 V758 Y788	P751-M754 HydrophobicContact CB-CE 4.45Å; P751-M754 PolarHBondContact O-N 3.5Å; P751-M754 VanDerWaalsContact O-N 3.16Å; I752-M754 VanDerWaalsContact C-N 3.35Å; I752-M754 PolarHBondContact O-N 3.45Å; M754-T757 PolarHBondContact O-N 3.28Å; M754-V758 HydrophobicContact CG-CG2 4.3Å; M754-V758 WeakPolarHBondContact O-CB 3.24Å; M754-V758 VanDerWaalsContact O-CG2 3.29Å; M754-V758 WeakPolarHBondContact O-CG2 3.39Å; M754-V758 PolarHBondContact O-N 3.43Å; M754-Y788 HydrophobicContact CB-CD1 3.89Å; M754-Y788 HydrophobicContact CB-CD2 3.68Å; M754-Y788 HydrophobicContact CB-CE1 3.99Å; M754-Y788 HydrophobicContact CB-CE2 3.79Å; M754-Y788 HydrophobicContact CB-CG 3.74Å; M754-Y788 HydrophobicContact CG-CE1 4.34Å; M754-Y788 HydrophobicContact CG-CE2 4.27Å; M754-Y788 HydrophobicContact SD-CE2 3.94Å
755	F	88.2	Confident	90.6	Very high	15 Å²	15	40.2 Å²	40.2	7%	0.066	22%	0.218	C	C	.	.	H	α-helix	trans	-67.1	-39.7	-177.3	-91.1	-87.8	0	0	0	113.5	V523 N527 L571 P751 I752 V758 R759	V523-F755 HydrophobicContact CG1-CZ 3.87Å; N527-F755 WeakPolarHBondContact ND2-CE1 3.33Å; L571-F755 HydrophobicContact CD1-CB 3.68Å; L571-F755 HydrophobicContact CD1-CG 4.13Å; L571-F755 HydrophobicContact CD2-CB 3.92Å; L571-F755 HydrophobicContact CD2-CD1 3.49Å; L571-F755 VanDerWaalsContact CD2-CD1 3.49Å; L571-F755 HydrophobicContact CD2-CD2 3.65Å; L571-F755 HydrophobicContact CD2-CE1 3.83Å; L571-F755 HydrophobicContact CD2-CE2 3.98Å; L571-F755 HydrophobicContact CD2-CG 3.38Å; L571-F755 HydrophobicContact CD2-CZ 4.06Å; L571-F755 HydrophobicContact CG-CB 4.46Å; L571-F755 HydrophobicContact CG-CG 4.39Å; P751-F755 HydrophobicContact CB-CD2 3.92Å; P751-F755 HydrophobicContact CB-CE2 4.11Å; P751-F755 HydrophobicContact CG-CD2 4.24Å; P751-F755 HydrophobicContact CG-CE2 4.32Å; P751-F755 PolarHBondContact O-N 2.93Å; P751-F755 VanDerWaalsContact O-N 3.09Å; I752-F755 PolarHBondContact O-N 3.23Å; I752-F755 VanDerWaalsContact O-N 3.11Å; F755-V758 PolarHBondContact O-N 2.93Å; F755-R759 WeakPolarHBondContact O-CB 3.25Å; F755-R759 WeakPolarHBondContact O-CD 3.3Å; F755-R759 WeakPolarHBondContact O-CG 3.37Å; F755-R759 PolarHBondContact O-N 3.09Å
756	L	89.1	Confident	90.3	Very high	15 Å²	15	45 Å²	45	8%	0.079	24%	0.24	C	C	.	.	H	α-helix	trans	-62.3	-45.1	173.5	-67.1	179.4	0	0	0	110.8	F574 I752 V758 R759 G760 L761 I764 M793	F574-L756 HydrophobicContact CE1-CD1 4Å; F574-L756 HydrophobicContact CE1-CD2 3.99Å; F574-L756 HydrophobicContact CZ-CD1 4.07Å; I752-L756 HydrophobicContact CG2-CD1 3.64Å; I752-L756 HydrophobicContact CG2-CG 4.01Å; I752-L756 WeakPolarHBondContact O-CG 3.16Å; I752-L756 PolarHBondContact O-N 3.22Å; L756-V758 PolarHBondContact O-N 3.45Å; L756-R759 PolarHBondContact O-N 3.44Å; L756-G760 PolarHBondContact O-N 2.83Å; L756-L761 HydrophobicContact CB-CB 4.29Å; L756-L761 HydrophobicContact CB-CD2 4.12Å; L756-L761 HydrophobicContact CD1-CD2 4.22Å; L756-L761 HydrophobicContact CD2-CD2 4.26Å; L756-L761 HydrophobicContact CG-CD2 4.43Å; L756-L761 WeakPolarHBondContact O-CB 3.32Å; L756-L761 PolarHBondContact O-N 2.87Å; L756-I764 HydrophobicContact CD1-CD1 4.03Å; L756-M793 HydrophobicContact CB-CE 3.88Å; L756-M793 HydrophobicContact CB-SD 4.34Å
757	T	86.8	Confident	90	Very high	82 Å²	82	48.4 Å²	48.4	50%	0.503	27%	0.269	S	S	.	.	H	α-helix	trans	-60.6	-45.9	176	-53.5	0	0	0	0	111.9	G753 M754 R759 G760 M793	G753-T757 WeakPolarHBondContact O-CB 3.41Å; G753-T757 PolarHBondContact O-N 3.02Å; G753-T757 VanDerWaalsContact O-N 3.1Å; G753-T757 PolarHBondContact O-OG1 2.86Å; M754-T757 PolarHBondContact O-N 3.28Å; T757-R759 VanDerWaalsContact C-N 3.32Å; T757-R759 PolarHBondContact O-N 2.7Å; T757-G760 WeakPolarHBondContact O-CA 3.4Å; T757-G760 PolarHBondContact O-N 2.88Å; T757-M793 WeakPolarHBondContact OG1-CE 3.39Å
758	V	84.4	Confident	89.8	Confident	97 Å²	97	52 Å²	52	59%	0.588	28%	0.283	S	S	*	.	H	α-helix	trans	-67.9	-29.2	179.9	169.2	0	0	0	0	112.5	M754 F755 L756 G760	M754-V758 HydrophobicContact CG-CG2 4.3Å; M754-V758 WeakPolarHBondContact O-CB 3.24Å; M754-V758 VanDerWaalsContact O-CG2 3.29Å; M754-V758 WeakPolarHBondContact O-CG2 3.39Å; M754-V758 PolarHBondContact O-N 3.43Å; F755-V758 PolarHBondContact O-N 2.93Å; L756-V758 PolarHBondContact O-N 3.45Å; V758-G760 PolarHBondContact O-N 3.01Å
759	R	85.2	Confident	89.7	Confident	50 Å²	50	55.7 Å²	55.7	19%	0.189	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-0.3	169.7	-69.6	167.7	-178.8	175.9	-3.2	113.4	D575 F755 L756 T757	D575-R759 IonicContact OD1-CZ 2.7Å; D575-R759 IonicContact OD1-NH1 2.71Å; D575-R759 PolarHBondContact OD1-NH1 3.48Å; D575-R759 IonicContact OD1-NH2 2.85Å; D575-R759 IonicContact OD2-CZ 3.2Å; D575-R759 IonicContact OD2-NH1 3.58Å; D575-R759 PolarHBondContact OD2-NH1 2.9Å; D575-R759 IonicContact OD2-NH2 3.35Å; D575-R759 PolarHBondContact OD2-NH2 3.24Å; F755-R759 WeakPolarHBondContact O-CB 3.25Å; F755-R759 WeakPolarHBondContact O-CD 3.3Å; F755-R759 WeakPolarHBondContact O-CG 3.37Å; F755-R759 PolarHBondContact O-N 3.09Å; L756-R759 PolarHBondContact O-N 3.44Å; T757-R759 VanDerWaalsContact C-N 3.32Å; T757-R759 PolarHBondContact O-N 2.7Å
760	G	83.6	Confident	89.8	Confident	52 Å²	52	55.9 Å²	55.9	54%	0.536	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.2	15	176.4	0	0	0	0	0	115.5	L756 T757 V758 E762	L756-G760 PolarHBondContact O-N 2.83Å; T757-G760 WeakPolarHBondContact O-CA 3.4Å; T757-G760 PolarHBondContact O-N 2.88Å; V758-G760 PolarHBondContact O-N 3.01Å; G760-E762 PolarHBondContact O-N 3.02Å
761	L	86.6	Confident	89.8	Confident	69 Å²	69	58.1 Å²	58.1	36%	0.361	32%	0.316	S	S	.	.			trans	-83.8	101.6	174.5	-169.6	70.4	0	0	0	110.6	L756 K763 I764 M793	L756-L761 HydrophobicContact CB-CB 4.29Å; L756-L761 HydrophobicContact CB-CD2 4.12Å; L756-L761 HydrophobicContact CD1-CD2 4.22Å; L756-L761 HydrophobicContact CD2-CD2 4.26Å; L756-L761 HydrophobicContact CG-CD2 4.43Å; L756-L761 WeakPolarHBondContact O-CB 3.32Å; L756-L761 PolarHBondContact O-N 2.87Å; L761-K763 WeakPolarHBondContact CD1-O 3.4Å; L761-I764 HydrophobicContact CD2-CG1 3.77Å; L761-M793 VanDerWaalsContact O-CE 3.26Å; L761-M793 WeakPolarHBondContact O-CE 3.47Å
762	E	84.3	Confident	89.8	Confident	191 Å²	191	58.5 Å²	58.5	89%	0.893	32%	0.318	S	S	*	.			trans	-75	-33.8	180	-62.1	-177.8	168.2	0	0	113.4	G760	G760-E762 PolarHBondContact O-N 3.02Å
763	K	90.6	Very high	89.9	Confident	82 Å²	82	58.6 Å²	58.6	36%	0.357	32%	0.319	S	S	.	.			trans	-144.9	142.8	177.5	-163.5	-169.4	171.6	178	0	110.7	L761 E766 M793 I794 P796	L761-K763 WeakPolarHBondContact CD1-O 3.4Å; K763-E766 IonicContact NZ-OE1 2.83Å; K763-E766 PolarHBondContact NZ-OE1 2.8Å; K763-M793 CarbonylContact C-O 3.34Å; K763-M793 WeakPolarHBondContact CA-O 2.85Å; K763-M793 WeakPolarHBondContact CG-O 3.41Å; K763-I794 WeakPolarHBondContact CE-O 3.22Å; K763-I794 PolarHBondContact NZ-O 2.71Å; K763-P796 HydrophobicContact CD-CG 4.48Å
764	I	91.8	Very high	90	Very high	9 Å²	9	65.3 Å²	65.3	5%	0.046	35%	0.347	C	S	.	.			trans	-88.5	131.3	164.9	-61.4	169.7	0	0	0	107.9	L756 L761 Y768 I790 M793 I794	L756-I764 HydrophobicContact CD1-CD1 4.03Å; L761-I764 HydrophobicContact CD2-CG1 3.77Å; I764-Y768 HydrophobicContact CG2-CD1 3.97Å; I764-Y768 HydrophobicContact CG2-CG 4.3Å; I764-I790 HydrophobicContact CD1-CG2 4Å; I764-M793 HydrophobicContact CD1-CB 3.91Å; I764-M793 HydrophobicContact CD1-SD 4.47Å; I764-M793 HydrophobicContact CG1-CB 4.12Å; I764-M793 PolarHBondContact N-O 3.35Å; I764-I794 HydrophobicContact CB-CG1 3.85Å; I764-I794 HydrophobicContact CD1-CG1 4.21Å; I764-I794 HydrophobicContact CG2-CG1 3.99Å
765	D	91.1	Very high	90.2	Very high	110 Å²	110	62.5 Å²	62.5	59%	0.588	34%	0.335	S	S	*	.			trans	-65.3	138.3	179.1	-166.9	-74	0	0	0	111.7	A767 Y768	D765-A767 PolarHBondContact O-N 3.49Å; D765-A767 WeakPolarHBondContact OD1-CB 3.44Å; D765-A767 PolarHBondContact OD1-N 3Å; D765-Y768 WeakPolarHBondContact O-CB 3.14Å; D765-Y768 PolarHBondContact O-N 2.96Å
766	E	91.9	Very high	90.7	Very high	99 Å²	99	61.8 Å²	61.8	46%	0.463	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-22	-178.3	-72.4	159.5	-127.6	0	0	113.1	K763 I794 G897 M898	K763-E766 IonicContact NZ-OE1 2.83Å; K763-E766 PolarHBondContact NZ-OE1 2.8Å; E766-I794 HydrophobicContact CG-CG2 3.95Å; E766-G897 CarbonylContact O-C 3.48Å; E766-G897 VanDerWaalsContact O-CA 3.3Å; E766-G897 WeakPolarHBondContact O-CA 3.27Å; E766-M898 PolarHBondContact O-N 3.36Å
767	A	92.9	Very high	91.1	Very high	73 Å²	73	61.3 Å²	61.3	60%	0.603	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-4.1	172.7	0	0	0	0	0	113.8	D765	D765-A767 PolarHBondContact O-N 3.49Å; D765-A767 WeakPolarHBondContact OD1-CB 3.44Å; D765-A767 PolarHBondContact OD1-N 3Å
768	Y	93.3	Very high	91.6	Very high	75 Å²	75	57.4 Å²	57.4	29%	0.294	31%	0.305	S	S	.	.			trans	-65	138	179.1	-176.7	-107.5	0	0	0	112.1	F574 S578 I764 D765 L770 M898 L899	F574-Y768 HydrophobicContact CZ-CE1 4.39Å; S578-Y768 VanDerWaalsContact CB-OH 3.25Å; S578-Y768 WeakPolarHBondContact CB-OH 3.38Å; S578-Y768 PolarHBondContact OG-OH 2.98Å; I764-Y768 HydrophobicContact CG2-CD1 3.97Å; I764-Y768 HydrophobicContact CG2-CG 4.3Å; D765-Y768 WeakPolarHBondContact O-CB 3.14Å; D765-Y768 PolarHBondContact O-N 2.96Å; Y768-L770 HydrophobicContact CE1-CD2 4.32Å; Y768-M898 CarbonylContact O-C 3.58Å; Y768-M898 VanDerWaalsContact O-C 3.22Å; Y768-L899 HydrophobicContact CD1-CD1 4.04Å; Y768-L899 HydrophobicContact CE1-CD1 4.03Å; Y768-L899 WeakPolarHBondContact O-CA 3.17Å; Y768-L899 PolarHBondContact O-N 2.85Å
769	Q	93.5	Very high	92.2	Very high	79 Å²	79	52.8 Å²	52.8	37%	0.369	28%	0.277	S	S	.	.			trans	-146.9	148.8	174.6	177.8	165.8	65.3	0	0	109.2	M898	Q769-M898 HydrophobicContact CB-CB 4.39Å; Q769-M898 PolarHBondContact NE2-O 2.72Å
770	L	94.2	Very high	92.7	Very high	4 Å²	4	51.4 Å²	51.4	2%	0.021	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-68.9	126.7	175.7	-63.3	170.6	0	0	0	109.8	F574 L577 S578 F745 Y768 T772 C773 L899	F574-L770 HydrophobicContact CE2-CD2 4.36Å; L577-L770 HydrophobicContact CB-CD1 4.25Å; L577-L770 HydrophobicContact CB-CD2 4.2Å; L577-L770 HydrophobicContact CD1-CD1 4.19Å; S578-L770 WeakPolarHBondContact OG-CD2 3.26Å; F745-L770 HydrophobicContact CD1-CD1 4.19Å; Y768-L770 HydrophobicContact CE1-CD2 4.32Å; L770-T772 PolarHBondContact O-N 2.9Å; L770-C773 HydrophobicContact CB-CB 3.94Å; L770-C773 HydrophobicContact CD1-CB 4.1Å; L770-C773 PolarHBondContact O-N 3.43Å; L770-C773 VanDerWaalsContact O-N 3.12Å; L770-C773 VanDerWaalsContact O-O 3.08Å; L770-L899 HydrophobicContact CD1-CD1 4.31Å; L770-L899 HydrophobicContact CD2-CD1 4.42Å; L770-L899 HydrophobicContact CG-CD1 3.84Å
771	P	93.3	Very high	93.1	Very high	47 Å²	47	49.2 Å²	49.2	31%	0.305	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-23.5	-170.2	-32.3	35.7	0	0	0	117.7	Q580 T582	Q580-P771 HydrophobicContact CB-CB 4.48Å; Q580-P771 VanDerWaalsContact O-CB 3.24Å; Q580-P771 WeakPolarHBondContact O-CB 3.44Å; Q580-P771 WeakPolarHBondContact O-CG 3.39Å; T582-P771 PolarHBondContact OG1-O 2.93Å
772	T	93	Very high	93.2	Very high	12 Å²	12	48.6 Å²	48.6	7%	0.074	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.6	9.5	179.3	56.8	0	0	0	0	113.6	Q580 E741 P742 L770	Q580-T772 HydrophobicContact CB-CG2 3.81Å; Q580-T772 WeakPolarHBondContact CB-OG1 3.3Å; E741-T772 HydrophobicContact CG-CG2 4.06Å; P742-T772 WeakPolarHBondContact CD-O 3.2Å; L770-T772 PolarHBondContact O-N 2.9Å
773	C	95	Very high	93.2	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.014	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-135.6	131.8	-177.6	-170.6	0	0	0	0	112.5	L577 P742 L770 G775	L577-C773 HydrophobicContact CD1-CB 4.16Å; P742-C773 VanDerWaalsContact O-CA 3.29Å; P742-C773 WeakPolarHBondContact O-CA 3.35Å; P742-C773 PolarHBondContact O-SG 2.73Å; L770-C773 HydrophobicContact CB-CB 3.94Å; L770-C773 HydrophobicContact CD1-CB 4.1Å; L770-C773 PolarHBondContact O-N 3.43Å; L770-C773 VanDerWaalsContact O-N 3.12Å; L770-C773 VanDerWaalsContact O-O 3.08Å; C773-G775 PolarHBondContact SG-O 3.36Å
774	K	91.1	Very high	93	Very high	145 Å²	145	37.1 Å²	37.1	63%	0.63	20%	0.196	S	C	*	.			trans	-105.3	-35	-168.3	-67.9	172.9	-174.9	163.3	0	113.6	V743	V743-K774 PolarHBondContact O-N 3.16Å
775	G	95.1	Very high	92.6	Very high	5 Å²	5	40.5 Å²	40.5	5%	0.052	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.5	175.1	0	0	0	0	0	111.8	V743 N744 F745 C773 N900	V743-G775 PolarHBondContact O-N 3.1Å; N744-G775 CarbonylContact C-O 3.59Å; N744-G775 WeakPolarHBondContact CA-O 3.42Å; F745-G775 PolarHBondContact N-O 3.24Å; C773-G775 PolarHBondContact SG-O 3.36Å; G775-N900 VanDerWaalsContact CA-OD1 3.28Å; G775-N900 WeakPolarHBondContact CA-OD1 3.43Å
776	F	97.6	Very high	92.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	121.2	174.9	178.5	-109.8	0	0	0	111.2	F574 F745 A747 I752 I790 L899 N900 I905	F574-F776 HydrophobicContact CD2-CE2 4.17Å; F574-F776 HydrophobicContact CD2-CZ 4.29Å; F574-F776 HydrophobicContact CE2-CZ 4.43Å; F745-F776 HydrophobicContact CB-CD2 4.34Å; F745-F776 AromaticContact CD1-CD2 3.51Å; F745-F776 HydrophobicContact CD1-CD2 3.51Å; F745-F776 AromaticContact CD1-CE2 3.6Å; F745-F776 HydrophobicContact CD1-CE2 3.6Å; F745-F776 HydrophobicContact CE1-CD2 4Å; F745-F776 AromaticContact CE1-CE2 3.57Å; F745-F776 HydrophobicContact CE1-CE2 3.57Å; F745-F776 HydrophobicContact CG-CD2 4.11Å; F745-F776 HydrophobicContact CG-CE2 4.39Å; F745-F776 HydrophobicContact CZ-CE2 4.32Å; F745-F776 WeakPolarHBondContact O-CA 3.5Å; A747-F776 HydrophobicContact CB-CE2 4.21Å; I752-F776 HydrophobicContact CD1-CE2 4.36Å; I752-F776 HydrophobicContact CD1-CZ 4.19Å; F776-I790 HydrophobicContact CE1-CB 4.43Å; F776-I790 HydrophobicContact CE1-CG1 4.16Å; F776-I790 HydrophobicContact CE1-CG2 4.13Å; F776-I790 HydrophobicContact CZ-CG1 4.41Å; F776-L899 HydrophobicContact CB-CD1 4.42Å; F776-L899 HydrophobicContact CB-CG 4.2Å; F776-L899 WeakPolarHBondContact CB-O 3.17Å; F776-L899 HydrophobicContact CD1-CD1 4.41Å; F776-L899 HydrophobicContact CD1-CD2 3.71Å; F776-L899 HydrophobicContact CD1-CG 3.75Å; F776-L899 HydrophobicContact CE1-CD2 3.99Å; F776-L899 HydrophobicContact CG-CD1 4.42Å; F776-L899 HydrophobicContact CG-CD2 4.49Å; F776-L899 HydrophobicContact CG-CG 4.15Å; F776-N900 HydrophobicContact CB-CB 4.44Å; F776-N900 PolarHBondContact N-OD1 3.36Å; F776-N900 WeakPolarHBondContact O-CB 3.34Å; F776-N900 PolarHBondContact O-ND2 2.87Å; F776-N900 VanDerWaalsContact O-ND2 3.13Å; F776-I905 HydrophobicContact CD1-CD1 4.49Å; F776-I905 HydrophobicContact CD1-CG1 4.42Å; F776-I905 HydrophobicContact CD1-CG2 3.59Å; F776-I905 HydrophobicContact CE1-CG2 3.58Å
777	F	98	Very high	92.2	Very high	5 Å²	5	33.7 Å²	33.7	2%	0.022	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	115.1	-172.3	-57.3	-92.9	0	0	0	110.1	N744 F745 F746 A747 I779 F907 E943	N744-F777 HydrophobicContact CB-CD2 4.42Å; N744-F777 HydrophobicContact CB-CE2 4.06Å; F745-F777 PolarHBondContact O-N 3.29Å; F746-F777 HydrophobicContact CD1-CB 3.82Å; F746-F777 AromaticContact CD1-CD2 3.78Å; F746-F777 HydrophobicContact CD1-CD2 3.78Å; F746-F777 AromaticContact CD1-CG 3.96Å; F746-F777 HydrophobicContact CD1-CG 3.96Å; F746-F777 HydrophobicContact CE1-CB 4.36Å; F746-F777 AromaticContact CE1-CD2 3.62Å; F746-F777 HydrophobicContact CE1-CD2 3.62Å; F746-F777 HydrophobicContact CE1-CE2 4.06Å; F746-F777 AromaticContact CE1-CG 4Å; F746-F777 HydrophobicContact CE1-CG 4Å; F746-F777 HydrophobicContact CZ-CD2 4.45Å; A747-F777 PolarHBondContact N-O 2.89Å; F777-I779 HydrophobicContact CB-CD1 4.39Å; F777-I779 HydrophobicContact CB-CG1 4.47Å; F777-F907 HydrophobicContact CD1-CD2 4.32Å; F777-F907 AromaticContact CD1-CE2 3.66Å; F777-F907 HydrophobicContact CD1-CE2 3.66Å; F777-F907 HydrophobicContact CD1-CZ 4.09Å; F777-F907 HydrophobicContact CE1-CE2 4.37Å; F777-F907 HydrophobicContact CE1-CZ 4.43Å; F777-E943 HydrophobicContact CD1-CG 4.34Å; F777-E943 HydrophobicContact CE1-CB 4.2Å; F777-E943 HydrophobicContact CE1-CG 3.65Å; F777-E943 WeakPolarHBondContact CE1-OE2 3.5Å; F777-E943 HydrophobicContact CE2-CB 4.46Å; F777-E943 HydrophobicContact CZ-CB 3.94Å; F777-E943 HydrophobicContact CZ-CG 3.9Å; F777-E943 VanDerWaalsContact CZ-OE2 3.32Å; F777-E943 WeakPolarHBondContact CZ-OE2 3.38Å
778	N	97.8	Very high	92.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	106.8	176.1	-173.4	42.7	0	0	0	109.4	S750 Y788 I790 I905 D906 F907	S750-N778 WeakPolarHBondContact CB-OD1 3.4Å; N778-Y788 PolarHBondContact ND2-O 3.11Å; N778-I790 HydrophobicContact CB-CG1 4.23Å; N778-I905 HydrophobicContact CB-CG2 4.05Å; N778-I905 WeakPolarHBondContact CB-O 3.5Å; N778-I905 PolarHBondContact N-O 3.41Å; N778-D906 PolarHBondContact ND2-OD1 3Å; N778-F907 PolarHBondContact O-N 3.1Å
779	I	97.6	Very high	92.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.6	-171	-62.5	162.3	0	0	0	109.4	F746 A747 L748 G749 F777 I805 F907 T936 L939 L940	F746-I779 HydrophobicContact CD1-CD1 4.16Å; A747-I779 PolarHBondContact O-N 3.09Å; L748-I779 WeakPolarHBondContact CA-O 3.4Å; L748-I779 HydrophobicContact CD2-CB 3.82Å; L748-I779 HydrophobicContact CD2-CD1 3.82Å; L748-I779 HydrophobicContact CD2-CG1 4.39Å; L748-I779 HydrophobicContact CD2-CG2 4.11Å; G749-I779 PolarHBondContact N-O 3.08Å; F777-I779 HydrophobicContact CB-CD1 4.39Å; F777-I779 HydrophobicContact CB-CG1 4.47Å; I779-I805 HydrophobicContact CG2-CD1 3.89Å; I779-F907 WeakPolarHBondContact CA-O 3.48Å; I779-F907 HydrophobicContact CG1-CB 4.2Å; I779-T936 HydrophobicContact CG2-CG2 4.33Å; I779-L939 HydrophobicContact CD1-CD2 3.71Å; I779-L939 HydrophobicContact CD1-CG 4.45Å; I779-L939 HydrophobicContact CG1-CD2 3.85Å; I779-L940 HydrophobicContact CD1-CD1 3.7Å
780	Y	95.1	Very high	92.4	Very high	21 Å²	21	30.5 Å²	30.5	8%	0.082	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	157.9	-177.4	61.5	-87.4	0	0	0	114.7	A787 R789 P802 D906 F907 V908 L909 Y930	Y780-A787 VanDerWaalsContact CB-CB 3.45Å; Y780-A787 HydrophobicContact CD2-CB 4.41Å; Y780-A787 HydrophobicContact CG-CB 4.1Å; Y780-R789 HydrophobicContact CE1-CG 4.21Å; Y780-R789 WeakPolarHBondContact OH-CD 3.43Å; Y780-R789 WeakPolarHBondContact OH-CG 3.43Å; Y780-P802 WeakPolarHBondContact OH-CB 3.4Å; Y780-P802 WeakPolarHBondContact OH-CG 3.32Å; Y780-D906 HydrophobicContact CE1-CB 4.07Å; Y780-F907 PolarHBondContact N-O 3.06Å; Y780-V908 HydrophobicContact CD2-CG2 4.11Å; Y780-V908 HydrophobicContact CE2-CB 4.06Å; Y780-V908 HydrophobicContact CE2-CG2 3.75Å; Y780-V908 CarbonylContact O-C 3.38Å; Y780-V908 WeakPolarHBondContact O-CA 3.44Å; Y780-L909 PolarHBondContact O-N 3.18Å; Y780-Y930 WeakPolarHBondContact CA-OH 3.24Å
781	H	90.9	Very high	92.5	Very high	5 Å²	5	30.4 Å²	30.4	2%	0.023	16%	0.158	C	C	.	.			trans	-88.9	139.4	165.5	-167	-89.3	0	0	0	109.7	L783 D784 L909 E915 S926 Y930	H781-L783 PolarHBondContact ND1-N 3.41Å; H781-L783 PolarHBondContact O-N 3.03Å; H781-D784 HydrophobicContact CB-CB 4.32Å; H781-D784 VanDerWaalsContact O-CB 3.27Å; H781-D784 WeakPolarHBondContact O-CB 3.35Å; H781-D784 PolarHBondContact O-N 3.44Å; H781-L909 HydrophobicContact CB-CD1 4.36Å; H781-E915 IonicContact NE2-OE2 3.76Å; H781-S926 VanDerWaalsContact ND1-CB 3.26Å; H781-S926 WeakPolarHBondContact ND1-CB 3.27Å; H781-Y930 PolarHBondContact N-OH 3.04Å
782	P	89.3	Confident	92.5	Very high	56 Å²	56	30.8 Å²	30.8	36%	0.364	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-24.2	-174.9	24	-34.4	0	0	0	114.1	V908 L909 E911	P782-V908 HydrophobicContact CB-CG2 4.12Å; P782-V908 HydrophobicContact CG-CG2 4.26Å; P782-L909 WeakPolarHBondContact CD-O 3.35Å; P782-E911 HydrophobicContact CG-CG 3.67Å; P782-E911 WeakPolarHBondContact CG-OE1 3.41Å
783	L	84.9	Confident	92.5	Very high	24 Å²	24	31.1 Å²	31.1	13%	0.126	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	4.3	176	-53.9	-178.7	0	0	0	114.5	H781 P785 E915 E919 F922 A923 S926	H781-L783 PolarHBondContact ND1-N 3.41Å; H781-L783 PolarHBondContact O-N 3.03Å; L783-P785 VanDerWaalsContact O-CD 3.3Å; L783-P785 WeakPolarHBondContact O-CD 3.42Å; L783-E915 HydrophobicContact CD1-CB 4.12Å; L783-E919 HydrophobicContact CD2-CB 4.05Å; L783-E919 HydrophobicContact CD2-CG 3.84Å; L783-F922 HydrophobicContact CD1-CB 4.31Å; L783-A923 WeakPolarHBondContact O-CA 3.31Å; L783-S926 PolarHBondContact O-OG 2.88Å; L783-S926 VanDerWaalsContact O-OG 3.11Å
784	D	86.6	Confident	92.4	Very high	9 Å²	9	31 Å²	31	5%	0.048	16%	0.161	C	C	.	.			trans	-77.3	111.9	-177.5	-177.3	-17.5	0	0	0	110.7	G749 H781 V786 A787 S926 H927 Y930	G749-D784 WeakPolarHBondContact CA-OD2 3.45Å; H781-D784 HydrophobicContact CB-CB 4.32Å; H781-D784 VanDerWaalsContact O-CB 3.27Å; H781-D784 WeakPolarHBondContact O-CB 3.35Å; H781-D784 PolarHBondContact O-N 3.44Å; D784-V786 PolarHBondContact O-N 2.82Å; D784-V786 VanDerWaalsContact O-N 3.14Å; D784-V786 PolarHBondContact OD1-N 3.39Å; D784-A787 HydrophobicContact CB-CB 3.79Å; D784-A787 PolarHBondContact O-N 3.49Å; D784-A787 PolarHBondContact OD1-N 2.92Å; D784-S926 WeakPolarHBondContact CA-OG 3.49Å; D784-S926 PolarHBondContact N-OG 3.09Å; D784-H927 VanDerWaalsContact CG-ND1 3.27Å; D784-H927 IonicContact OD1-CE1 3.66Å; D784-H927 IonicContact OD1-CG 3.58Å; D784-H927 IonicContact OD1-ND1 3.88Å; D784-H927 PolarHBondContact OD1-ND1 3.37Å; D784-H927 WeakPolarHBondContact OD2-CA 3.04Å; D784-H927 IonicContact OD2-CE1 2.7Å; D784-H927 IonicContact OD2-CG 3.76Å; D784-H927 IonicContact OD2-ND1 2.71Å; D784-H927 PolarHBondContact OD2-ND1 3.05Å; D784-Y930 WeakPolarHBondContact OD2-CE2 3.37Å; D784-Y930 PolarHBondContact OD2-OH 3.37Å
785	P	82.3	Confident	92.4	Very high	80 Å²	80	24.9 Å²	24.9	52%	0.519	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-4	-174.2	33.3	-37.1	0	0	0	113.8	L783 A923	L783-P785 VanDerWaalsContact O-CD 3.3Å; L783-P785 WeakPolarHBondContact O-CD 3.42Å; P785-A923 HydrophobicContact CG-CB 4.19Å
786	V	84.4	Confident	92	Very high	46 Å²	46	28.3 Å²	28.3	28%	0.279	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-10.3	178.8	-173.7	0	0	0	0	111.2	S750 P751 D784 Y788	S750-V786 CarbonylContact C-O 3.51Å; P751-V786 VanDerWaalsContact CA-O 3.24Å; P751-V786 WeakPolarHBondContact CA-O 3.34Å; P751-V786 HydrophobicContact CB-CG1 3.91Å; P751-V786 WeakPolarHBondContact CB-O 3.06Å; P751-V786 HydrophobicContact CG-CG1 4.18Å; D784-V786 PolarHBondContact O-N 2.82Å; D784-V786 VanDerWaalsContact O-N 3.14Å; D784-V786 PolarHBondContact OD1-N 3.39Å; V786-Y788 WeakPolarHBondContact O-CD2 3.44Å
787	A	90.6	Very high	91.4	Very high	19 Å²	19	35.5 Å²	35.5	16%	0.157	20%	0.196	C	C	.	.			trans	-86.2	130.5	-178.1	0	0	0	0	0	113	S750 Y780 D784	S750-A787 WeakPolarHBondContact O-CA 3.18Å; Y780-A787 VanDerWaalsContact CB-CB 3.45Å; Y780-A787 HydrophobicContact CD2-CB 4.41Å; Y780-A787 HydrophobicContact CG-CB 4.1Å; D784-A787 HydrophobicContact CB-CB 3.79Å; D784-A787 PolarHBondContact O-N 3.49Å; D784-A787 PolarHBondContact OD1-N 2.92Å
788	Y	93.6	Very high	90.8	Very high	99 Å²	99	39.2 Å²	39.2	39%	0.388	22%	0.215	S	C	.	.			trans	-128.4	145.2	177.5	-71	-98.1	0	0	0	111.4	S750 M754 N778 V786	S750-Y788 PolarHBondContact O-N 3.31Å; M754-Y788 HydrophobicContact CB-CD1 3.89Å; M754-Y788 HydrophobicContact CB-CD2 3.68Å; M754-Y788 HydrophobicContact CB-CE1 3.99Å; M754-Y788 HydrophobicContact CB-CE2 3.79Å; M754-Y788 HydrophobicContact CB-CG 3.74Å; M754-Y788 HydrophobicContact CG-CE1 4.34Å; M754-Y788 HydrophobicContact CG-CE2 4.27Å; M754-Y788 HydrophobicContact SD-CE2 3.94Å; N778-Y788 PolarHBondContact ND2-O 3.11Å; V786-Y788 WeakPolarHBondContact O-CD2 3.44Å
789	R	95.3	Very high	90.1	Very high	62 Å²	62	46.6 Å²	46.6	23%	0.234	26%	0.255	C	S	.	.			trans	-73.8	154.1	178.3	-73.3	-165.8	66.4	-173.6	3.9	112.7	Y780 E791 P792 L800 D906	Y780-R789 HydrophobicContact CE1-CG 4.21Å; Y780-R789 WeakPolarHBondContact OH-CD 3.43Å; Y780-R789 WeakPolarHBondContact OH-CG 3.43Å; R789-E791 IonicContact NH2-OE2 3.24Å; R789-E791 PolarHBondContact NH2-OE2 2.86Å; R789-P792 HydrophobicContact CB-CG 4.14Å; R789-L800 PolarHBondContact NH1-O 3.24Å; R789-L800 PolarHBondContact NH2-O 2.6Å; R789-D906 WeakPolarHBondContact CB-OD2 3.28Å; R789-D906 IonicContact CZ-OD2 3.73Å; R789-D906 IonicContact NE-OD2 2.71Å; R789-D906 PolarHBondContact NE-OD2 3.4Å; R789-D906 IonicContact NH2-OD2 2.73Å; R789-D906 PolarHBondContact NH2-OD2 3.2Å
790	I	95.1	Very high	89.6	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.262	C	S	.	.	S	Bend	trans	-115.8	-32.7	178	-56.7	-62.8	0	0	0	112.4	I752 I764 F776 N778 P792 M793 I794 L899 I905 D906	I752-I790 HydrophobicContact CB-CD1 3.99Å; I752-I790 HydrophobicContact CG2-CD1 3.71Å; I764-I790 HydrophobicContact CD1-CG2 4Å; F776-I790 HydrophobicContact CE1-CB 4.43Å; F776-I790 HydrophobicContact CE1-CG1 4.16Å; F776-I790 HydrophobicContact CE1-CG2 4.13Å; F776-I790 HydrophobicContact CZ-CG1 4.41Å; N778-I790 HydrophobicContact CB-CG1 4.23Å; I790-P792 VanDerWaalsContact C-CD 3.5Å; I790-M793 WeakPolarHBondContact O-CB 3.34Å; I790-M793 PolarHBondContact O-N 3.22Å; I790-I794 HydrophobicContact CG2-CD1 4.09Å; I790-L899 HydrophobicContact CG2-CD2 4.23Å; I790-I905 HydrophobicContact CB-CG2 3.98Å; I790-I905 HydrophobicContact CG2-CG2 4.2Å; I790-D906 PolarHBondContact N-OD1 2.97Å; I790-D906 PolarHBondContact N-OD2 3.16Å
791	E	95.5	Very high	89.4	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-58.6	-40.5	-177.7	-62.1	177.1	148.7	0	0	113.8	R789 M793 I794 V795 I896 R904 I905 D906	R789-E791 IonicContact NH2-OE2 3.24Å; R789-E791 PolarHBondContact NH2-OE2 2.86Å; E791-M793 PolarHBondContact O-N 2.94Å; E791-I794 PolarHBondContact O-N 2.96Å; E791-V795 WeakPolarHBondContact O-CG2 3.16Å; E791-V795 PolarHBondContact O-N 3.3Å; E791-I896 HydrophobicContact CB-CG2 4.31Å; E791-I896 HydrophobicContact CG-CD1 4.49Å; E791-I896 HydrophobicContact CG-CG1 4.43Å; E791-I896 HydrophobicContact CG-CG2 4.12Å; E791-R904 WeakPolarHBondContact OE1-CA 3.27Å; E791-R904 IonicContact OE1-CZ 2.98Å; E791-R904 IonicContact OE1-NE 3.28Å; E791-R904 PolarHBondContact OE1-NE 2.97Å; E791-R904 IonicContact OE1-NH2 2.83Å; E791-R904 PolarHBondContact OE1-NH2 2.66Å; E791-R904 IonicContact OE2-CZ 2.68Å; E791-R904 IonicContact OE2-NE 3.41Å; E791-R904 IonicContact OE2-NH2 3.46Å; E791-R904 PolarHBondContact OE2-NH2 3.38Å; E791-I905 HydrophobicContact CG-CB 3.87Å; E791-I905 PolarHBondContact OE1-N 3.34Å; E791-D906 WeakPolarHBondContact CB-OD2 3.13Å; E791-D906 HydrophobicContact CG-CB 4.04Å; E791-D906 WeakPolarHBondContact CG-OD2 3.21Å; E791-D906 PolarHBondContact N-OD2 2.97Å; E791-D906 PolarHBondContact OE1-N 2.98Å
792	P	93.9	Very high	89.4	Confident	56 Å²	56	53.9 Å²	53.9	36%	0.364	29%	0.291	S	S	.	.	H	α-helix	trans	-63.9	-20.5	176.3	-22.5	35.3	0	0	0	114.1	R789 I790 I794 P796	R789-P792 HydrophobicContact CB-CG 4.14Å; I790-P792 VanDerWaalsContact C-CD 3.5Å; P792-I794 VanDerWaalsContact C-N 3.33Å; P792-P796 WeakPolarHBondContact O-CA 3.35Å; P792-P796 WeakPolarHBondContact O-CB 3.26Å
793	M	92.5	Very high	89.6	Confident	18 Å²	18	53.3 Å²	53.3	9%	0.089	29%	0.287	C	S	.	.	H	α-helix	trans	-79	-17.6	173.7	-59	-169.2	77.1	0	0	112.5	L756 T757 L761 K763 I764 I790 E791	L756-M793 HydrophobicContact CB-CE 3.88Å; L756-M793 HydrophobicContact CB-SD 4.34Å; T757-M793 WeakPolarHBondContact OG1-CE 3.39Å; L761-M793 VanDerWaalsContact O-CE 3.26Å; L761-M793 WeakPolarHBondContact O-CE 3.47Å; K763-M793 CarbonylContact C-O 3.34Å; K763-M793 WeakPolarHBondContact CA-O 2.85Å; K763-M793 WeakPolarHBondContact CG-O 3.41Å; I764-M793 HydrophobicContact CD1-CB 3.91Å; I764-M793 HydrophobicContact CD1-SD 4.47Å; I764-M793 HydrophobicContact CG1-CB 4.12Å; I764-M793 PolarHBondContact N-O 3.35Å; I790-M793 WeakPolarHBondContact O-CB 3.34Å; I790-M793 PolarHBondContact O-N 3.22Å; E791-M793 PolarHBondContact O-N 2.94Å
794	I	92.8	Very high	89.9	Confident	1 Å²	1	55 Å²	55	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-99.8	-41.4	-179.5	-53.5	162.7	0	0	0	110.5	K763 I764 E766 I790 E791 P792 I896 L899 I905	K763-I794 WeakPolarHBondContact CE-O 3.22Å; K763-I794 PolarHBondContact NZ-O 2.71Å; I764-I794 HydrophobicContact CB-CG1 3.85Å; I764-I794 HydrophobicContact CD1-CG1 4.21Å; I764-I794 HydrophobicContact CG2-CG1 3.99Å; E766-I794 HydrophobicContact CG-CG2 3.95Å; I790-I794 HydrophobicContact CG2-CD1 4.09Å; E791-I794 PolarHBondContact O-N 2.96Å; P792-I794 VanDerWaalsContact C-N 3.33Å; I794-I896 HydrophobicContact CB-CG2 4.06Å; I794-I896 HydrophobicContact CD1-CG2 3.8Å; I794-I896 HydrophobicContact CG2-CG2 4.18Å; I794-I896 WeakPolarHBondContact CG2-O 3.43Å; I794-L899 HydrophobicContact CD1-CD2 4.18Å; I794-I905 HydrophobicContact CD1-CD1 3.48Å; I794-I905 VanDerWaalsContact CD1-CD1 3.48Å
795	V	91.1	Very high	90	Very high	15 Å²	15	54.7 Å²	54.7	9%	0.091	29%	0.294	C	S	.	.			trans	-128.3	68.2	-179.7	-73.8	0	0	0	0	111.3	E791 D797 L798 L800 I896	E791-V795 WeakPolarHBondContact O-CG2 3.16Å; E791-V795 PolarHBondContact O-N 3.3Å; V795-D797 PolarHBondContact O-N 3.49Å; V795-D797 VanDerWaalsContact O-N 3.17Å; V795-L798 HydrophobicContact CB-CB 4.45Å; V795-L798 HydrophobicContact CB-CD1 4.26Å; V795-L798 HydrophobicContact CG2-CB 4.48Å; V795-L798 PolarHBondContact O-N 3.34Å; V795-L798 VanDerWaalsContact O-N 3.08Å; V795-L800 HydrophobicContact CG2-CD1 4Å; V795-I896 WeakPolarHBondContact CG1-O 3.46Å; V795-I896 HydrophobicContact CG2-CD1 4.26Å; V795-I896 HydrophobicContact CG2-CG2 4.21Å
796	P	86.1	Confident	90.2	Very high	78 Å²	78	54.2 Å²	54.2	51%	0.506	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-23	-175.2	25.8	-35.6	0	0	0	114	K763 P792 L798	K763-P796 HydrophobicContact CD-CG 4.48Å; P792-P796 WeakPolarHBondContact O-CA 3.35Å; P792-P796 WeakPolarHBondContact O-CB 3.26Å; P796-L798 PolarHBondContact O-N 2.73Å
797	D	86	Confident	90.2	Very high	151 Å²	151	53.9 Å²	53.9	81%	0.807	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-4.2	177.3	-55.7	-71.1	0	0	0	113.8	V795	V795-D797 PolarHBondContact O-N 3.49Å; V795-D797 VanDerWaalsContact O-N 3.17Å
798	L	84.9	Confident	89.6	Confident	83 Å²	83	54.9 Å²	54.9	44%	0.435	29%	0.286	S	S	.	.			trans	-122.1	109.2	-178.7	-60.7	178.7	0	0	0	111.3	V795 P796 L800 V894	V795-L798 HydrophobicContact CB-CB 4.45Å; V795-L798 HydrophobicContact CB-CD1 4.26Å; V795-L798 HydrophobicContact CG2-CB 4.48Å; V795-L798 PolarHBondContact O-N 3.34Å; V795-L798 VanDerWaalsContact O-N 3.08Å; P796-L798 PolarHBondContact O-N 2.73Å; L798-L800 HydrophobicContact CB-CD1 4.21Å; L798-L800 HydrophobicContact CB-CD2 4.18Å; L798-L800 HydrophobicContact CB-CG 3.83Å; L798-L800 HydrophobicContact CD1-CD1 4.45Å; L798-L800 PolarHBondContact O-N 2.71Å; L798-V894 HydrophobicContact CD1-CG1 3.96Å
799	D	82.9	Confident	88.9	Confident	155 Å²	155	55.6 Å²	55.6	83%	0.829	29%	0.291	S	S	*	.			trans	-74.5	76.1	170.6	-173.9	20.5	0	0	0	111.1
800	L	87.9	Confident	87.1	Confident	27 Å²	27	55.2 Å²	55.2	14%	0.141	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-85.7	124.2	178.5	-59.1	175.3	0	0	0	109.7	R789 V795 L798 V894 I896	R789-L800 PolarHBondContact NH1-O 3.24Å; R789-L800 PolarHBondContact NH2-O 2.6Å; V795-L800 HydrophobicContact CG2-CD1 4Å; L798-L800 HydrophobicContact CB-CD1 4.21Å; L798-L800 HydrophobicContact CB-CD2 4.18Å; L798-L800 HydrophobicContact CB-CG 3.83Å; L798-L800 HydrophobicContact CD1-CD1 4.45Å; L798-L800 PolarHBondContact O-N 2.71Å; L800-V894 HydrophobicContact CD1-CG1 3.85Å; L800-V894 HydrophobicContact CD2-CG1 4.26Å; L800-V894 HydrophobicContact CD2-CG2 4.39Å; L800-I896 HydrophobicContact CD1-CD1 3.31Å
801	K	89.8	Confident	85.3	Confident	118 Å²	118	61.4 Å²	61.4	51%	0.513	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-69.6	140.4	169.4	-71.4	-179.4	174.9	178.2	0	110.8	E885 R904	K801-E885 WeakPolarHBondContact CE-OE1 3.38Å; K801-E885 IonicContact NZ-OE1 2.72Å; K801-E885 PolarHBondContact NZ-OE1 3.23Å; K801-E885 IonicContact NZ-OE2 2.68Å; K801-E885 PolarHBondContact NZ-OE2 3.16Å; K801-R904 PolarHBondContact O-NH1 3.41Å; K801-R904 PolarHBondContact O-NH2 2.82Å
802	P	92.2	Very high	83.4	Confident	34 Å²	34	65 Å²	65	22%	0.221	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-64	155.3	-179.4	29.8	-38.4	0	0	0	112	Y780 L804 D906 V908	Y780-P802 WeakPolarHBondContact OH-CB 3.4Å; Y780-P802 WeakPolarHBondContact OH-CG 3.32Å; P802-L804 PolarHBondContact O-N 3.21Å; P802-D906 HydrophobicContact CB-CB 3.97Å; P802-V908 HydrophobicContact CB-CB 4.19Å; P802-V908 HydrophobicContact CB-CG1 4.07Å; P802-V908 HydrophobicContact CG-CB 4.07Å; P802-V908 HydrophobicContact CG-CG1 3.76Å
803	V	93.4	Very high	81.6	Confident	44 Å²	44	64.4 Å²	64.4	27%	0.267	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	112.4	-177.9	-177.1	0	0	0	0	110.1	I805 R904 D906 F907 V908	V803-I805 PolarHBondContact O-N 3.02Å; V803-R904 HydrophobicContact CG2-CB 3.56Å; V803-R904 HydrophobicContact CG2-CG 3.69Å; V803-D906 PolarHBondContact N-O 3.31Å; V803-F907 HydrophobicContact CB-CD1 3.69Å; V803-F907 HydrophobicContact CB-CE1 3.9Å; V803-F907 HydrophobicContact CB-CG 4.28Å; V803-F907 HydrophobicContact CG1-CD1 3.74Å; V803-F907 HydrophobicContact CG1-CE1 3.73Å; V803-F907 HydrophobicContact CG2-CE1 4.34Å; V803-F907 CarbonylContact O-C 3.48Å; V803-F907 VanDerWaalsContact O-CA 3.29Å; V803-F907 WeakPolarHBondContact O-CA 3.39Å; V803-V908 PolarHBondContact O-N 3.36Å
804	L	90.9	Very high	79.7	Confident	58 Å²	58	70.1 Å²	70.1	30%	0.304	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	118.9	176.7	-171.9	74.3	0	0	0	110.9	P802 P806 K812 L816 V908 Q910	P802-L804 PolarHBondContact O-N 3.21Å; L804-P806 WeakPolarHBondContact O-CD 3.42Å; L804-K812 HydrophobicContact CD2-CD 4Å; L804-K812 HydrophobicContact CD2-CG 4.09Å; L804-L816 HydrophobicContact CD1-CD2 4.25Å; L804-L816 HydrophobicContact CD2-CD2 3.6Å; L804-V908 HydrophobicContact CD1-CG1 4.04Å; L804-Q910 HydrophobicContact CD1-CG 3.78Å; L804-Q910 HydrophobicContact CD2-CG 4.42Å; L804-Q910 HydrophobicContact CG-CG 4.14Å
805	I	89.7	Confident	77.7	Confident	3 Å²	3	73.7 Å²	73.7	2%	0.015	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-68.4	120.7	175.5	-60.2	174.2	0	0	0	108.6	I779 V803 F907 V908 L909 Q910 D935 L939	I779-I805 HydrophobicContact CG2-CD1 3.89Å; V803-I805 PolarHBondContact O-N 3.02Å; I805-F907 HydrophobicContact CD1-CB 3.94Å; I805-F907 HydrophobicContact CG1-CB 3.92Å; I805-V908 WeakPolarHBondContact CG1-O 3.45Å; I805-V908 PolarHBondContact N-O 3.19Å; I805-L909 HydrophobicContact CB-CD2 4.41Å; I805-L909 HydrophobicContact CD1-CD2 3.69Å; I805-L909 HydrophobicContact CD1-CG 4.04Å; I805-L909 HydrophobicContact CG2-CD2 4.39Å; I805-Q910 PolarHBondContact O-NE2 3.01Å; I805-D935 HydrophobicContact CG2-CB 4.14Å; I805-L939 HydrophobicContact CD1-CD2 3.68Å; I805-L939 HydrophobicContact CG1-CD2 3.99Å
806	P	85	Confident	75.9	Confident	70 Å²	70	75 Å²	75	46%	0.455	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-64.4	142.9	175.9	-20.7	33.4	0	0	0	111.1	L804	L804-P806 WeakPolarHBondContact O-CD 3.42Å
807	H	84.1	Confident	74.5	Confident	39 Å²	39	74 Å²	74	18%	0.181	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-65.3	140.7	177	-180	-116.3	0	0	0	109.2	K809 G810 R811 R813 Q910 D935	H807-K809 PolarHBondContact O-N 3.32Å; H807-G810 PolarHBondContact O-N 2.96Å; H807-R811 VanDerWaalsContact CB-O 3.25Å; H807-R811 WeakPolarHBondContact CB-O 3.42Å; H807-R811 PolarHBondContact N-O 2.91Å; H807-R813 HydrophobicContact CB-CG 4.2Å; H807-Q910 VanDerWaalsContact N-NE2 3.16Å; H807-D935 VanDerWaalsContact CA-OD1 3.22Å; H807-D935 WeakPolarHBondContact CA-OD1 3.46Å; H807-D935 IonicContact CD2-OD1 2.71Å; H807-D935 PolarHBondContact CD2-OD1 3.17Å; H807-D935 VanDerWaalsContact CD2-OD1 3.28Å; H807-D935 IonicContact CD2-OD2 2.92Å; H807-D935 IonicContact CG-OD1 3.57Å
808	Y	78.3	Confident	72.9	Confident	40 Å²	40	71.6 Å²	71.6	16%	0.157	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-39.4	-171.5	70.3	-81.2	0	0	0	113	L462 H466 G810 E934 D935	L462-Y808 HydrophobicContact CD2-CD2 4.13Å; L462-Y808 HydrophobicContact CD2-CG 4.45Å; H466-Y808 PolarHBondContact CE1-O 3.42Å; H466-Y808 PolarHBondContact NE2-O 3.43Å; Y808-G810 PolarHBondContact O-N 2.87Å; Y808-E934 HydrophobicContact CD1-CB 3.54Å; Y808-E934 HydrophobicContact CD1-CG 4.2Å; Y808-E934 HydrophobicContact CD2-CB 4.23Å; Y808-E934 HydrophobicContact CE1-CB 3.79Å; Y808-E934 HydrophobicContact CE1-CG 3.9Å; Y808-E934 WeakPolarHBondContact CE1-OE1 3.2Å; Y808-E934 HydrophobicContact CE2-CB 4.46Å; Y808-E934 HydrophobicContact CE2-CG 4.45Å; Y808-E934 HydrophobicContact CG-CB 3.74Å; Y808-E934 PolarHBondContact OH-OE1 3.23Å; Y808-D935 WeakPolarHBondContact CD1-OD1 3.33Å; Y808-D935 PolarHBondContact N-OD1 2.83Å
809	K	80	Confident	71.6	Confident	114 Å²	114	73.3 Å²	73.3	50%	0.496	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	17.6	174.5	-63.1	-179.4	168.1	125.1	0	115.7	H807	H807-K809 PolarHBondContact O-N 3.32Å
810	G	57.2	Low	70.3	Confident	55 Å²	55	69 Å²	69	57%	0.567	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.3	18.2	164.7	0	0	0	0	0	116.9	H807 Y808	H807-G810 PolarHBondContact O-N 2.96Å; Y808-G810 PolarHBondContact O-N 2.87Å
811	R	58	Low	68.7	Low	130 Å²	130	70.8 Å²	70.8	49%	0.491	36%	0.358	S	S	.	.	B	Isolated β-bridge	trans	-141.9	-178.9	-176.2	-63.2	-165	-169.5	-163.9	5.7	112.7	H807 H957	H807-R811 VanDerWaalsContact CB-O 3.25Å; H807-R811 WeakPolarHBondContact CB-O 3.42Å; H807-R811 PolarHBondContact N-O 2.91Å; R811-H957 PolarHBondContact NE-NE2 2.93Å; R811-H957 VanDerWaalsContact NE-NE2 3.13Å; R811-H957 PolarHBondContact NH2-CD2 3.34Å; R811-H957 PolarHBondContact NH2-NE2 3.36Å
812	K	54.3	Low	66.7	Low	75 Å²	75	70.2 Å²	70.2	33%	0.326	36%	0.36	S	S	.	.			trans	-82	152.2	155.3	-66.5	179.8	-173.2	-176.8	0	107.8	L804 L816 E817 E820	L804-K812 HydrophobicContact CD2-CD 4Å; L804-K812 HydrophobicContact CD2-CG 4.09Å; K812-L816 HydrophobicContact CB-CD2 4.38Å; K812-L816 HydrophobicContact CD-CD2 4.2Å; K812-L816 HydrophobicContact CD-CG 4.48Å; K812-L816 HydrophobicContact CG-CD2 4.42Å; K812-E817 HydrophobicContact CB-CG 3.63Å; K812-E817 PolarHBondContact N-OE1 3.31Å; K812-E820 WeakPolarHBondContact CD-OE1 3.43Å; K812-E820 IonicContact NZ-OE1 2.68Å; K812-E820 PolarHBondContact NZ-OE1 3.14Å; K812-E820 IonicContact NZ-OE2 3.67Å; K812-E820 PolarHBondContact NZ-OE2 3.34Å
813	R	57.5	Low	64.9	Low	44 Å²	44	72.3 Å²	72.3	17%	0.166	38%	0.375	C	S	.	.			trans	-63.6	140.8	175.7	-69	179.2	-173.3	166.9	9.9	108.4	H807 H815 L816 E817 Q910 E911 D935	H807-R813 HydrophobicContact CB-CG 4.2Å; R813-H815 PolarHBondContact O-N 3.44Å; R813-L816 WeakPolarHBondContact O-CA 3.29Å; R813-L816 WeakPolarHBondContact O-CB 3.39Å; R813-L816 PolarHBondContact O-N 2.9Å; R813-E817 PolarHBondContact O-N 3.3Å; R813-E817 VanDerWaalsContact O-N 3.07Å; R813-Q910 HydrophobicContact CG-CB 4.4Å; R813-Q910 PolarHBondContact NH1-O 3.49Å; R813-Q910 PolarHBondContact NH2-O 3.15Å; R813-E911 WeakPolarHBondContact CD-O 3.49Å; R813-E911 PolarHBondContact NH1-O 2.95Å; R813-D935 IonicContact CZ-OD2 3.49Å; R813-D935 IonicContact NE-OD2 2.81Å; R813-D935 IonicContact NH2-OD2 3.34Å; R813-D935 PolarHBondContact NH2-OD2 2.82Å
814	L	51.3	Low	63.1	Low	139 Å²	139	77.5 Å²	77.5	73%	0.728	39%	0.39	S	S	*	.	H	α-helix	trans	-53.3	-31.6	-170	-74.3	169.6	0	0	0	114.5	L818	L814-L818 VanDerWaalsContact O-CB 3.3Å; L814-L818 WeakPolarHBondContact O-CB 3.45Å; L814-L818 PolarHBondContact O-N 3.42Å
815	H	51.3	Low	61.2	Low	75 Å²	75	80.2 Å²	80.2	35%	0.347	40%	0.403	S	S	.	.	H	α-helix	trans	-68.5	-35.1	174.7	-178.8	76.6	0	0	0	112.9	R813 L818 K819 P913	R813-H815 PolarHBondContact O-N 3.44Å; H815-L818 WeakPolarHBondContact O-CB 3.02Å; H815-L818 PolarHBondContact O-N 2.83Å; H815-K819 WeakPolarHBondContact O-CB 3.46Å; H815-K819 PolarHBondContact O-N 2.94Å; H815-P913 HydrophobicContact CB-CB 4.02Å; H815-P913 HydrophobicContact CB-CG 3.77Å
816	L	53.8	Low	59.5	Low	42 Å²	42	82.5 Å²	82.5	22%	0.22	43%	0.427	C	S	.	.	H	α-helix	trans	-74.8	-37.1	175.1	-168.6	64.9	0	0	0	111.2	L804 K812 R813 L818 K819 E820 Q910	L804-L816 HydrophobicContact CD1-CD2 4.25Å; L804-L816 HydrophobicContact CD2-CD2 3.6Å; K812-L816 HydrophobicContact CB-CD2 4.38Å; K812-L816 HydrophobicContact CD-CD2 4.2Å; K812-L816 HydrophobicContact CD-CG 4.48Å; K812-L816 HydrophobicContact CG-CD2 4.42Å; R813-L816 WeakPolarHBondContact O-CA 3.29Å; R813-L816 WeakPolarHBondContact O-CB 3.39Å; R813-L816 PolarHBondContact O-N 2.9Å; L816-L818 VanDerWaalsContact C-N 3.26Å; L816-L818 PolarHBondContact O-N 3.28Å; L816-K819 HydrophobicContact CD1-CD 4.36Å; L816-K819 PolarHBondContact O-N 2.93Å; L816-E820 WeakPolarHBondContact O-CB 3.38Å; L816-E820 PolarHBondContact O-N 3.48Å; L816-Q910 HydrophobicContact CD2-CG 4.21Å
817	E	55.1	Low	57.8	Low	59 Å²	59	83.4 Å²	83.4	28%	0.276	44%	0.435	S	S	.	.	H	α-helix	trans	-61.5	-35.9	168.1	-63.3	-171.6	159.6	0	0	111.5	K812 R813 S821	K812-E817 HydrophobicContact CB-CG 3.63Å; K812-E817 PolarHBondContact N-OE1 3.31Å; R813-E817 PolarHBondContact O-N 3.3Å; R813-E817 VanDerWaalsContact O-N 3.07Å; E817-S821 VanDerWaalsContact O-CB 3.23Å; E817-S821 WeakPolarHBondContact O-CB 3.47Å; E817-S821 PolarHBondContact O-N 2.87Å; E817-S821 PolarHBondContact O-OG 2.95Å
818	L	53.5	Low	56.1	Low	99 Å²	99	88.2 Å²	88.2	52%	0.518	46%	0.462	S	S	.	.	H	α-helix	trans	-70.3	-43.5	173.4	-160.2	86.1	0	0	0	111.9	L814 H815 L816 S821 L822	L814-L818 VanDerWaalsContact O-CB 3.3Å; L814-L818 WeakPolarHBondContact O-CB 3.45Å; L814-L818 PolarHBondContact O-N 3.42Å; H815-L818 WeakPolarHBondContact O-CB 3.02Å; H815-L818 PolarHBondContact O-N 2.83Å; L816-L818 VanDerWaalsContact C-N 3.26Å; L816-L818 PolarHBondContact O-N 3.28Å; L818-S821 CarbonylContact O-C 3.56Å; L818-S821 PolarHBondContact O-N 3.31Å; L818-S821 VanDerWaalsContact O-N 3.14Å; L818-L822 HydrophobicContact CD2-CD1 4.05Å; L818-L822 HydrophobicContact CG-CD1 4Å; L818-L822 HydrophobicContact CG-CG 4.46Å; L818-L822 WeakPolarHBondContact O-CB 3.43Å; L818-L822 WeakPolarHBondContact O-CG 3.49Å; L818-L822 PolarHBondContact O-N 3.29Å
819	K	57.6	Low	55	Low	120 Å²	120	90.5 Å²	90.5	52%	0.522	48%	0.476	S	S	.	.	H	α-helix	trans	-61.1	-44.5	177	-171	172	179.5	176.2	0	110.8	H815 L816 L822 S823	H815-K819 WeakPolarHBondContact O-CB 3.46Å; H815-K819 PolarHBondContact O-N 2.94Å; L816-K819 HydrophobicContact CD1-CD 4.36Å; L816-K819 PolarHBondContact O-N 2.93Å; K819-L822 PolarHBondContact O-N 3.16Å; K819-S823 PolarHBondContact O-N 2.8Å; K819-S823 PolarHBondContact O-OG 2.89Å
820	E	56.3	Low	53.3	Low	65 Å²	65	91.1 Å²	91.1	30%	0.304	48%	0.479	S	S	.	.	H	α-helix	trans	-69.3	-31.6	172.2	-72.9	178.4	-158.4	0	0	113	K812 L816 S823 R824	K812-E820 WeakPolarHBondContact CD-OE1 3.43Å; K812-E820 IonicContact NZ-OE1 2.68Å; K812-E820 PolarHBondContact NZ-OE1 3.14Å; K812-E820 IonicContact NZ-OE2 3.67Å; K812-E820 PolarHBondContact NZ-OE2 3.34Å; L816-E820 WeakPolarHBondContact O-CB 3.38Å; L816-E820 PolarHBondContact O-N 3.48Å; E820-S823 PolarHBondContact O-OG 2.83Å; E820-R824 WeakPolarHBondContact O-CB 3.37Å; E820-R824 WeakPolarHBondContact O-CD 3.48Å; E820-R824 WeakPolarHBondContact O-CG 3.37Å; E820-R824 PolarHBondContact O-N 3.25Å; E820-R824 VanDerWaalsContact O-N 3.09Å
821	S	52.8	Low	53.1	Low	63 Å²	63	95.7 Å²	95.7	44%	0.441	49%	0.485	S	S	.	.	H	α-helix	trans	-71.2	-34.1	173.1	-62.7	0	0	0	0	112.2	E817 L818 M825	E817-S821 VanDerWaalsContact O-CB 3.23Å; E817-S821 WeakPolarHBondContact O-CB 3.47Å; E817-S821 PolarHBondContact O-N 2.87Å; E817-S821 PolarHBondContact O-OG 2.95Å; L818-S821 CarbonylContact O-C 3.56Å; L818-S821 PolarHBondContact O-N 3.31Å; L818-S821 VanDerWaalsContact O-N 3.14Å; S821-M825 WeakPolarHBondContact O-CB 3.38Å; S821-M825 PolarHBondContact O-N 3.42Å
822	L	49.5	Very low	52.8	Low	106 Å²	106	91.3 Å²	91.3	56%	0.555	48%	0.48	S	S	*	.	H	α-helix	trans	-76.8	-35.3	178.5	-73.7	165.8	0	0	0	112.5	L818 K819	L818-L822 HydrophobicContact CD2-CD1 4.05Å; L818-L822 HydrophobicContact CG-CD1 4Å; L818-L822 HydrophobicContact CG-CG 4.46Å; L818-L822 WeakPolarHBondContact O-CB 3.43Å; L818-L822 WeakPolarHBondContact O-CG 3.49Å; L818-L822 PolarHBondContact O-N 3.29Å; K819-L822 PolarHBondContact O-N 3.16Å
823	S	54.3	Low	52.4	Low	78 Å²	78	94 Å²	94	55%	0.545	49%	0.492	S	S	.	.	H	α-helix	trans	-72.1	-33.8	171.4	65	0	0	0	0	112	K819 E820	K819-S823 PolarHBondContact O-N 2.8Å; K819-S823 PolarHBondContact O-OG 2.89Å; E820-S823 PolarHBondContact O-OG 2.83Å
824	R	54.3	Low	51.9	Low	154 Å²	154	96.2 Å²	96.2	58%	0.581	51%	0.506	S	S	*	.	S	Bend	trans	-87	-4	-179.8	-60	175.1	93.9	-86.4	-17.2	114.5	E820	E820-R824 WeakPolarHBondContact O-CB 3.37Å; E820-R824 WeakPolarHBondContact O-CD 3.48Å; E820-R824 WeakPolarHBondContact O-CG 3.37Å; E820-R824 PolarHBondContact O-N 3.25Å; E820-R824 VanDerWaalsContact O-N 3.09Å
825	M	50.6	Low	51.8	Low	115 Å²	115	92.8 Å²	92.8	57%	0.567	49%	0.494	S	S	*	.	S	Bend	trans	-138.4	91.1	178.7	-168.9	164.9	55.6	0	0	110.1	S821 L829	S821-M825 WeakPolarHBondContact O-CB 3.38Å; S821-M825 PolarHBondContact O-N 3.42Å; M825-L829 HydrophobicContact CE-CD1 3.98Å; M825-L829 HydrophobicContact SD-CD1 4.46Å
826	G	54.8	Low	51.6	Low	51 Å²	51	92.2 Å²	92.2	53%	0.526	50%	0.498	S	S	.	.			trans	-78.3	-143.9	-158	0	0	0	0	0	119	D828	G826-D828 VanDerWaalsContact C-N 3.32Å; G826-D828 PolarHBondContact O-N 3.16Å
827	S	49.9	Very low	51.1	Low	88 Å²	88	95 Å²	95	62%	0.615	51%	0.512	S	S	*	.	H	α-helix	trans	-36.9	-45.2	-157.3	47.1	0	0	0	0	118.2	L829 K830 H831	S827-L829 PolarHBondContact O-N 2.85Å; S827-K830 WeakPolarHBondContact O-CA 3.47Å; S827-K830 WeakPolarHBondContact O-CB 3.48Å; S827-K830 PolarHBondContact O-N 3.07Å; S827-H831 PolarHBondContact O-N 3.38Å
828	D	48	Very low	50.9	Low	140 Å²	140	99.3 Å²	99.3	75%	0.749	53%	0.526	S	S	*	.	H	α-helix	trans	-74.8	-31.5	-158.3	-61.8	8.1	0	0	0	111.9	G826 G832	G826-D828 VanDerWaalsContact C-N 3.32Å; G826-D828 PolarHBondContact O-N 3.16Å; D828-G832 PolarHBondContact O-N 2.92Å
829	L	53.8	Low	50.6	Low	89 Å²	89	97.8 Å²	97.8	47%	0.466	52%	0.524	S	S	.	.	H	α-helix	trans	-75.2	-28.5	172.5	-126	159.1	0	0	0	111.6	M825 S827 G832 F833	M825-L829 HydrophobicContact CE-CD1 3.98Å; M825-L829 HydrophobicContact SD-CD1 4.46Å; S827-L829 PolarHBondContact O-N 2.85Å; L829-G832 PolarHBondContact O-N 3.05Å; L829-F833 HydrophobicContact CD2-CD2 4.45Å; L829-F833 WeakPolarHBondContact O-CB 3.2Å; L829-F833 PolarHBondContact O-N 2.75Å
830	K	45	Very low	50.3	Low	126 Å²	126	94.5 Å²	94.5	55%	0.548	52%	0.519	S	S	.	.	H	α-helix	trans	-60.5	-45.6	174.2	-156	176.8	-177.1	177.2	0	110.4	S827 M834	S827-K830 WeakPolarHBondContact O-CA 3.47Å; S827-K830 WeakPolarHBondContact O-CB 3.48Å; S827-K830 PolarHBondContact O-N 3.07Å; K830-M834 HydrophobicContact CG-CG 4.44Å; K830-M834 HydrophobicContact CG-SD 3.84Å; K830-M834 WeakPolarHBondContact O-CB 3.33Å; K830-M834 WeakPolarHBondContact O-CG 3.47Å; K830-M834 PolarHBondContact O-N 2.95Å
831	H	52.4	Low	49.8	Very low	151 Å²	151	100 Å²	100	70%	0.699	54%	0.537	S	S	*	.	H	α-helix	trans	-65.6	-40.9	176.6	-165.2	-68.1	0	0	0	112.7	S827 S835	S827-H831 PolarHBondContact O-N 3.38Å; H831-S835 WeakPolarHBondContact O-CB 3.38Å; H831-S835 PolarHBondContact O-N 2.82Å; H831-S835 VanDerWaalsContact O-N 3.16Å
832	G	53	Low	49.9	Very low	38 Å²	38	102.6 Å²	102.6	39%	0.392	54%	0.542	S	S	.	.	H	α-helix	trans	-59.7	-56	175.5	0	0	0	0	0	112.3	D828 L829 S835 S836	D828-G832 PolarHBondContact O-N 2.92Å; L829-G832 PolarHBondContact O-N 3.05Å; G832-S835 PolarHBondContact O-N 3.15Å; G832-S835 PolarHBondContact O-OG 3.01Å; G832-S836 PolarHBondContact O-N 3Å; G832-S836 PolarHBondContact O-OG 3.36Å
833	F	45.5	Very low	50.3	Low	131 Å²	131	101.8 Å²	101.8	58%	0.575	54%	0.542	S	S	*	.	H	α-helix	trans	-71.8	-34.6	-174	-137.8	-93.8	0	0	0	113.1	L829 S835 S836 L837	L829-F833 HydrophobicContact CD2-CD2 4.45Å; L829-F833 WeakPolarHBondContact O-CB 3.2Å; L829-F833 PolarHBondContact O-N 2.75Å; F833-S835 VanDerWaalsContact C-N 3.29Å; F833-S835 PolarHBondContact O-N 2.96Å; F833-S836 WeakPolarHBondContact CA-OG 3.33Å; F833-S836 PolarHBondContact O-N 3.35Å; F833-S836 PolarHBondContact O-OG 3.42Å; F833-L837 HydrophobicContact CD1-CD1 3.86Å; F833-L837 HydrophobicContact CD1-CG 4.24Å; F833-L837 HydrophobicContact CE1-CD1 4.36Å; F833-L837 WeakPolarHBondContact O-CB 3.35Å; F833-L837 WeakPolarHBondContact O-CG 3.25Å; F833-L837 PolarHBondContact O-N 2.89Å
834	M	47.5	Very low	49.7	Very low	91 Å²	91	103.4 Å²	103.4	45%	0.448	54%	0.544	S	S	.	.	H	α-helix	trans	-65.3	-31.2	171.6	-71.7	178.5	76.7	0	0	112.2	K830 R838	K830-M834 HydrophobicContact CG-CG 4.44Å; K830-M834 HydrophobicContact CG-SD 3.84Å; K830-M834 WeakPolarHBondContact O-CB 3.33Å; K830-M834 WeakPolarHBondContact O-CG 3.47Å; K830-M834 PolarHBondContact O-N 2.95Å; M834-R838 WeakPolarHBondContact O-CB 3.47Å; M834-R838 PolarHBondContact O-N 3.44Å
835	S	49.7	Very low	49.5	Very low	68 Å²	68	99.7 Å²	99.7	48%	0.476	54%	0.536	S	S	.	.	H	α-helix	trans	-68.7	-41.6	176.7	77.4	0	0	0	0	112.3	H831 G832 F833 S839	H831-S835 WeakPolarHBondContact O-CB 3.38Å; H831-S835 PolarHBondContact O-N 2.82Å; H831-S835 VanDerWaalsContact O-N 3.16Å; G832-S835 PolarHBondContact O-N 3.15Å; G832-S835 PolarHBondContact O-OG 3.01Å; F833-S835 VanDerWaalsContact C-N 3.29Å; F833-S835 PolarHBondContact O-N 2.96Å; S835-S839 WeakPolarHBondContact O-CB 3.35Å; S835-S839 PolarHBondContact O-N 3.38Å
836	S	45.3	Very low	49.5	Very low	62 Å²	62	101 Å²	101	43%	0.434	54%	0.54	S	S	.	.	H	α-helix	trans	-69.1	-40.4	174.3	44.8	0	0	0	0	112.4	G832 F833 S839 A840	G832-S836 PolarHBondContact O-N 3Å; G832-S836 PolarHBondContact O-OG 3.36Å; F833-S836 WeakPolarHBondContact CA-OG 3.33Å; F833-S836 PolarHBondContact O-N 3.35Å; F833-S836 PolarHBondContact O-OG 3.42Å; S836-S839 PolarHBondContact O-N 3.33Å; S836-A840 PolarHBondContact O-N 3.03Å
837	L	44.8	Very low	49.1	Very low	100 Å²	100	105.3 Å²	105.3	52%	0.524	55%	0.545	S	S	.	.	H	α-helix	trans	-63.6	-47.1	175.1	-80.3	167.8	0	0	0	111.4	F833 S839 A840 W841	F833-L837 HydrophobicContact CD1-CD1 3.86Å; F833-L837 HydrophobicContact CD1-CG 4.24Å; F833-L837 HydrophobicContact CE1-CD1 4.36Å; F833-L837 WeakPolarHBondContact O-CB 3.35Å; F833-L837 WeakPolarHBondContact O-CG 3.25Å; F833-L837 PolarHBondContact O-N 2.89Å; L837-S839 VanDerWaalsContact C-N 3.29Å; L837-S839 PolarHBondContact O-N 3.47Å; L837-A840 PolarHBondContact O-N 2.78Å; L837-W841 WeakPolarHBondContact O-CB 3.49Å; L837-W841 PolarHBondContact O-N 3.46Å
838	R	51.1	Low	48.7	Very low	150 Å²	150	103.1 Å²	103.1	57%	0.566	53%	0.532	S	S	*	.	H	α-helix	trans	-61	-36.6	177	-177.4	172	-79.1	147.4	-6.8	112	M834 Q842	M834-R838 WeakPolarHBondContact O-CB 3.47Å; M834-R838 PolarHBondContact O-N 3.44Å; R838-Q842 WeakPolarHBondContact O-CB 3.4Å; R838-Q842 VanDerWaalsContact O-CG 3.26Å; R838-Q842 WeakPolarHBondContact O-CG 3.24Å; R838-Q842 PolarHBondContact O-N 2.89Å
839	S	46.8	Very low	48.7	Very low	67 Å²	67	104.3 Å²	104.3	47%	0.469	53%	0.526	S	S	.	.	H	α-helix	trans	-65	-46.2	173.1	-179.4	0	0	0	0	112.2	S835 S836 L837 W841 Q842 T843	S835-S839 WeakPolarHBondContact O-CB 3.35Å; S835-S839 PolarHBondContact O-N 3.38Å; S836-S839 PolarHBondContact O-N 3.33Å; L837-S839 VanDerWaalsContact C-N 3.29Å; L837-S839 PolarHBondContact O-N 3.47Å; S839-W841 PolarHBondContact O-N 2.91Å; S839-Q842 WeakPolarHBondContact O-CB 3.44Å; S839-Q842 PolarHBondContact O-N 3.22Å; S839-T843 PolarHBondContact O-N 3.39Å; S839-T843 PolarHBondContact O-OG1 3.34Å; S839-T843 VanDerWaalsContact O-OG1 3.12Å
840	A	49.8	Very low	48.6	Very low	51 Å²	51	103.6 Å²	103.6	42%	0.421	53%	0.532	S	S	.	.	H	α-helix	trans	-64.7	-38.3	176.8	0	0	0	0	0	112.5	S836 L837 T843 L844	S836-A840 PolarHBondContact O-N 3.03Å; L837-A840 PolarHBondContact O-N 2.78Å; A840-T843 PolarHBondContact O-N 3.13Å; A840-L844 PolarHBondContact O-N 3.37Å
841	W	47.4	Very low	48.6	Very low	182 Å²	182	104.5 Å²	104.5	69%	0.689	54%	0.538	S	S	*	.	H	α-helix	trans	-66.1	-36.5	174.4	-125.4	74.2	0	0	0	112.1	L837 S839 L844 N845	L837-W841 WeakPolarHBondContact O-CB 3.49Å; L837-W841 PolarHBondContact O-N 3.46Å; S839-W841 PolarHBondContact O-N 2.91Å; W841-L844 PolarHBondContact O-N 3.27Å; W841-N845 VanDerWaalsContact O-CB 3.28Å; W841-N845 WeakPolarHBondContact O-CB 3.42Å; W841-N845 PolarHBondContact O-N 2.79Å
842	Q	54.8	Low	48.1	Very low	117 Å²	117	100.7 Å²	100.7	55%	0.547	53%	0.526	S	S	.	.	H	α-helix	trans	-63.4	-43.8	171.6	-78.1	170	-17	0	0	111.6	R838 S839 L844 N845 E846	R838-Q842 WeakPolarHBondContact O-CB 3.4Å; R838-Q842 VanDerWaalsContact O-CG 3.26Å; R838-Q842 WeakPolarHBondContact O-CG 3.24Å; R838-Q842 PolarHBondContact O-N 2.89Å; S839-Q842 WeakPolarHBondContact O-CB 3.44Å; S839-Q842 PolarHBondContact O-N 3.22Å; Q842-L844 VanDerWaalsContact C-N 3.34Å; Q842-L844 PolarHBondContact O-N 2.78Å; Q842-N845 PolarHBondContact O-N 3.07Å; Q842-E846 WeakPolarHBondContact O-CG 3.45Å; Q842-E846 PolarHBondContact O-N 2.88Å
843	T	57.8	Low	48	Very low	88 Å²	88	102.9 Å²	102.9	54%	0.54	54%	0.535	S	S	.	.	H	α-helix	trans	-62.1	-39.9	174.9	-46.5	0	0	0	0	112.3	S839 A840 F847	S839-T843 PolarHBondContact O-N 3.39Å; S839-T843 PolarHBondContact O-OG1 3.34Å; S839-T843 VanDerWaalsContact O-OG1 3.12Å; A840-T843 PolarHBondContact O-N 3.13Å; T843-F847 WeakPolarHBondContact O-CB 3.37Å; T843-F847 PolarHBondContact O-N 3Å
844	L	42.1	Very low	48.2	Very low	112 Å²	112	101.8 Å²	101.8	59%	0.586	54%	0.544	S	S	*	.	H	α-helix	trans	-67.1	-38	174.2	-81.9	164.8	0	0	0	112.8	A840 W841 Q842 F847 A848	A840-L844 PolarHBondContact O-N 3.37Å; W841-L844 PolarHBondContact O-N 3.27Å; Q842-L844 VanDerWaalsContact C-N 3.34Å; Q842-L844 PolarHBondContact O-N 2.78Å; L844-F847 PolarHBondContact O-N 2.8Å; L844-A848 WeakPolarHBondContact O-CB 3.14Å; L844-A848 PolarHBondContact O-N 3.07Å
845	N	48.7	Very low	48.2	Very low	77 Å²	77	101 Å²	101	41%	0.412	55%	0.551	S	S	.	*	H	α-helix	trans	-71.6	-37.1	177.9	-162.9	-9.6	0	0	0	111.4	W841 Q842 A848 R849	W841-N845 VanDerWaalsContact O-CB 3.28Å; W841-N845 WeakPolarHBondContact O-CB 3.42Å; W841-N845 PolarHBondContact O-N 2.79Å; Q842-N845 PolarHBondContact O-N 3.07Å; N845-A848 PolarHBondContact O-N 3.33Å; N845-R849 WeakPolarHBondContact O-CB 3.19Å; N845-R849 PolarHBondContact O-N 2.83Å
846	E	52.2	Low	47.8	Very low	143 Å²	143	102.3 Å²	102.3	67%	0.668	55%	0.553	S	S	*	*	H	α-helix	trans	-63.2	-41	169.3	-73.7	-170.4	147.6	0	0	112.1	Q842 R849 A850	Q842-E846 WeakPolarHBondContact O-CG 3.45Å; Q842-E846 PolarHBondContact O-N 2.88Å; E846-R849 PolarHBondContact O-N 3.2Å; E846-A850 PolarHBondContact O-N 3.39Å
847	F	44.4	Very low	47.9	Very low	141 Å²	141	101.4 Å²	101.4	62%	0.618	54%	0.542	S	S	*	.	H	α-helix	trans	-64.6	-44	174.9	-173.9	-97.8	0	0	0	112.3	T843 L844 A850 H851	T843-F847 WeakPolarHBondContact O-CB 3.37Å; T843-F847 PolarHBondContact O-N 3Å; L844-F847 PolarHBondContact O-N 2.8Å; F847-A850 WeakPolarHBondContact O-CB 3.18Å; F847-A850 PolarHBondContact O-N 3.29Å; F847-H851 PolarHBondContact O-CD2 3.04Å
848	A	42.5	Very low	48.2	Very low	41 Å²	41	99.3 Å²	99.3	34%	0.339	54%	0.539	S	S	.	.	H	α-helix	trans	-63.6	-42.2	174.5	0	0	0	0	0	111.9	L844 N845 A850 H851 T852	L844-A848 WeakPolarHBondContact O-CB 3.14Å; L844-A848 PolarHBondContact O-N 3.07Å; N845-A848 PolarHBondContact O-N 3.33Å; A848-A850 PolarHBondContact O-N 2.85Å; A848-H851 CarbonylContact O-C 3.57Å; A848-H851 PolarHBondContact O-N 3Å; A848-T852 PolarHBondContact O-N 2.95Å; A848-T852 PolarHBondContact O-OG1 2.86Å
849	R	48.3	Very low	48	Very low	166 Å²	166	98.8 Å²	98.8	63%	0.626	54%	0.543	S	S	*	.	H	α-helix	trans	-63.6	-21.4	176.1	-179.3	173.4	170	78.3	-3.5	113.6	N845 E846 H851	N845-R849 WeakPolarHBondContact O-CB 3.19Å; N845-R849 PolarHBondContact O-N 2.83Å; E846-R849 PolarHBondContact O-N 3.2Å; R849-H851 VanDerWaalsContact C-N 3.32Å
850	A	52.2	Low	47.9	Very low	73 Å²	73	100.8 Å²	100.8	60%	0.603	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-13.1	170.3	0	0	0	0	0	113.6	E846 F847 A848	E846-A850 PolarHBondContact O-N 3.39Å; F847-A850 WeakPolarHBondContact O-CB 3.18Å; F847-A850 PolarHBondContact O-N 3.29Å; A848-A850 PolarHBondContact O-N 2.85Å
851	H	44.3	Very low	47.9	Very low	145 Å²	145	100.8 Å²	100.8	67%	0.671	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.8	-3.4	-170.4	-74.2	-64.3	0	0	0	115.9	F847 A848 R849	F847-H851 PolarHBondContact O-CD2 3.04Å; A848-H851 CarbonylContact O-C 3.57Å; A848-H851 PolarHBondContact O-N 3Å; R849-H851 VanDerWaalsContact C-N 3.32Å
852	T	41.3	Very low	48.4	Very low	72 Å²	72	97 Å²	97	44%	0.442	54%	0.54	S	S	.	.	S	Bend	trans	-120.1	153	175.7	62.6	0	0	0	0	113	A848	A848-T852 PolarHBondContact O-N 2.95Å; A848-T852 PolarHBondContact O-OG1 2.86Å
853	S	51.9	Low	48.1	Very low	83 Å²	83	94.9 Å²	94.9	58%	0.58	54%	0.535	S	S	*	.			trans	-81.7	148.2	-178	60.6	0	0	0	0	112.6	A855 L856 Q857	S853-A855 VanDerWaalsContact C-N 3.28Å; S853-A855 PolarHBondContact O-N 3.43Å; S853-A855 VanDerWaalsContact O-N 3.13Å; S853-L856 PolarHBondContact O-N 3.03Å; S853-Q857 PolarHBondContact O-N 3.21Å
854	S	49.5	Very low	47.5	Very low	108 Å²	108	92.7 Å²	92.7	76%	0.755	53%	0.526	S	S	*	.	H	α-helix	trans	-63.6	-22.4	-166.9	51.8	0	0	0	0	116
855	A	47.1	Very low	47.8	Very low	74 Å²	74	92 Å²	92	61%	0.612	52%	0.523	S	S	*	.	H	α-helix	trans	-71	-45.1	176.2	0	0	0	0	0	111.7	S853 Q857 A858	S853-A855 VanDerWaalsContact C-N 3.28Å; S853-A855 PolarHBondContact O-N 3.43Å; S853-A855 VanDerWaalsContact O-N 3.13Å; A855-Q857 VanDerWaalsContact C-N 3.28Å; A855-Q857 PolarHBondContact O-N 3.06Å; A855-A858 WeakPolarHBondContact O-CB 3.24Å; A855-A858 PolarHBondContact O-N 3.18Å; A855-A858 VanDerWaalsContact O-N 3.14Å
856	L	41.9	Very low	47.5	Very low	96 Å²	96	93.5 Å²	93.5	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-69.5	-29	-176.6	-146.5	121	0	0	0	111.9	S853 A858 L860	S853-L856 PolarHBondContact O-N 3.03Å; L856-A858 VanDerWaalsContact C-N 3.29Å; L856-A858 PolarHBondContact O-N 2.92Å; L856-L860 HydrophobicContact CD2-CD1 3.93Å; L856-L860 WeakPolarHBondContact O-CG 3.42Å; L856-L860 PolarHBondContact O-N 3.08Å
857	Q	47.8	Very low	47.3	Very low	43 Å²	43	90.8 Å²	90.8	20%	0.201	52%	0.516	C	S	.	.	H	α-helix	trans	-69.4	-23.3	174.8	-171	165	55.8	0	0	113	S853 A855 A861	S853-Q857 PolarHBondContact O-N 3.21Å; A855-Q857 VanDerWaalsContact C-N 3.28Å; A855-Q857 PolarHBondContact O-N 3.06Å; Q857-A861 WeakPolarHBondContact O-CB 3.29Å; Q857-A861 PolarHBondContact O-N 3.37Å
858	A	51.4	Low	47.3	Very low	56 Å²	56	89.4 Å²	89.4	46%	0.463	51%	0.512	S	S	.	.	H	α-helix	trans	-76.7	-44.2	177.8	0	0	0	0	0	112.2	A855 L856 A861 I862	A855-A858 WeakPolarHBondContact O-CB 3.24Å; A855-A858 PolarHBondContact O-N 3.18Å; A855-A858 VanDerWaalsContact O-N 3.14Å; L856-A858 VanDerWaalsContact C-N 3.29Å; L856-A858 PolarHBondContact O-N 2.92Å; A858-A861 PolarHBondContact O-N 2.87Å; A858-I862 WeakPolarHBondContact O-CG1 3.35Å; A858-I862 PolarHBondContact O-N 3.26Å
859	E	46.7	Very low	47.5	Very low	139 Å²	139	94.1 Å²	94.1	65%	0.65	53%	0.527	S	S	*	.	H	α-helix	trans	-66	-43.4	177	-66.1	-176.9	144.6	0	0	111.5	A861 I862 V863	E859-A861 VanDerWaalsContact C-N 3.29Å; E859-A861 PolarHBondContact O-N 3.28Å; E859-I862 PolarHBondContact O-N 3.35Å; E859-I862 VanDerWaalsContact O-N 3.15Å; E859-V863 PolarHBondContact O-N 2.93Å
860	L	44.2	Very low	47.2	Very low	109 Å²	109	92.9 Å²	92.9	57%	0.571	53%	0.528	S	S	*	.	H	α-helix	trans	-62.4	-32.9	176	-73.1	172.6	0	0	0	113.2	L856 A864	L856-L860 HydrophobicContact CD2-CD1 3.93Å; L856-L860 WeakPolarHBondContact O-CG 3.42Å; L856-L860 PolarHBondContact O-N 3.08Å; L860-A864 VanDerWaalsContact O-CB 3.31Å; L860-A864 WeakPolarHBondContact O-CB 3.45Å; L860-A864 PolarHBondContact O-N 3.16Å
861	A	50	Low	46.7	Very low	51 Å²	51	95.7 Å²	95.7	42%	0.421	53%	0.529	S	S	.	.	H	α-helix	trans	-71.2	-32.9	175.3	0	0	0	0	0	112.7	Q857 A858 E859 N865	Q857-A861 WeakPolarHBondContact O-CB 3.29Å; Q857-A861 PolarHBondContact O-N 3.37Å; A858-A861 PolarHBondContact O-N 2.87Å; E859-A861 VanDerWaalsContact C-N 3.29Å; E859-A861 PolarHBondContact O-N 3.28Å; A861-N865 PolarHBondContact O-N 2.77Å; A861-N865 VanDerWaalsContact O-N 3.15Å; A861-N865 PolarHBondContact O-OD1 2.84Å
862	I	57	Low	46.4	Very low	102 Å²	102	95.1 Å²	95.1	52%	0.523	53%	0.526	S	S	.	.	H	α-helix	trans	-67.5	-46.8	174.3	-67.6	163.6	0	0	0	110	A858 E859 A864 N865 Q866	A858-I862 WeakPolarHBondContact O-CG1 3.35Å; A858-I862 PolarHBondContact O-N 3.26Å; E859-I862 PolarHBondContact O-N 3.35Å; E859-I862 VanDerWaalsContact O-N 3.15Å; I862-A864 PolarHBondContact O-N 3.18Å; I862-N865 PolarHBondContact O-N 3.03Å; I862-Q866 WeakPolarHBondContact O-CG 3.16Å; I862-Q866 PolarHBondContact O-N 3.21Å; I862-Q866 VanDerWaalsContact O-N 3.1Å
863	V	48.8	Very low	46.1	Very low	73 Å²	73	98.1 Å²	98.1	44%	0.442	54%	0.535	S	S	.	.	H	α-helix	trans	-63.2	-41.4	177.2	175.3	0	0	0	0	111.6	E859 N865 Q866 I867	E859-V863 PolarHBondContact O-N 2.93Å; V863-N865 PolarHBondContact O-N 2.73Å; V863-Q866 PolarHBondContact O-N 3.28Å; V863-I867 HydrophobicContact CG1-CD1 4.08Å; V863-I867 WeakPolarHBondContact O-CG1 3.45Å; V863-I867 PolarHBondContact O-N 3.35Å; V863-I867 VanDerWaalsContact O-N 3.13Å
864	A	45.8	Very low	45.7	Very low	43 Å²	43	98.1 Å²	98.1	36%	0.355	53%	0.532	S	S	.	.	H	α-helix	trans	-61.9	-42.4	177.2	0	0	0	0	0	112.7	L860 I862 I867 E868	L860-A864 VanDerWaalsContact O-CB 3.31Å; L860-A864 WeakPolarHBondContact O-CB 3.45Å; L860-A864 PolarHBondContact O-N 3.16Å; I862-A864 PolarHBondContact O-N 3.18Å; A864-I867 PolarHBondContact O-N 3Å; A864-E868 PolarHBondContact O-N 3.39Å
865	N	47.5	Very low	45	Very low	97 Å²	97	98 Å²	98	52%	0.519	52%	0.519	S	S	.	.	H	α-helix	trans	-65.7	-37.2	176.2	-78.2	18.9	0	0	0	112.4	A861 I862 V863 I867 E868 E869	A861-N865 PolarHBondContact O-N 2.77Å; A861-N865 VanDerWaalsContact O-N 3.15Å; A861-N865 PolarHBondContact O-OD1 2.84Å; I862-N865 PolarHBondContact O-N 3.03Å; V863-N865 PolarHBondContact O-N 2.73Å; N865-I867 VanDerWaalsContact C-N 3.3Å; N865-I867 PolarHBondContact O-N 3.32Å; N865-E868 PolarHBondContact O-N 3Å; N865-E869 WeakPolarHBondContact O-CG 3.22Å; N865-E869 PolarHBondContact O-N 3.31Å
866	Q	43.1	Very low	44.3	Very low	109 Å²	109	99 Å²	99	51%	0.509	51%	0.514	S	S	.	.	H	α-helix	trans	-63.1	-38.3	176.2	-72.6	177.5	-49.2	0	0	111.6	I862 V863 E869 E870	I862-Q866 WeakPolarHBondContact O-CG 3.16Å; I862-Q866 PolarHBondContact O-N 3.21Å; I862-Q866 VanDerWaalsContact O-N 3.1Å; V863-Q866 PolarHBondContact O-N 3.28Å; Q866-E869 PolarHBondContact O-N 3.03Å; Q866-E870 PolarHBondContact O-N 3.16Å
867	I	46.8	Very low	44	Very low	85 Å²	85	101.2 Å²	101.2	44%	0.436	52%	0.521	S	S	.	.	H	α-helix	trans	-67.6	-42.4	174.7	-62.4	167.1	0	0	0	111.1	V863 A864 N865 E869 E870 E871	V863-I867 HydrophobicContact CG1-CD1 4.08Å; V863-I867 WeakPolarHBondContact O-CG1 3.45Å; V863-I867 PolarHBondContact O-N 3.35Å; V863-I867 VanDerWaalsContact O-N 3.13Å; A864-I867 PolarHBondContact O-N 3Å; N865-I867 VanDerWaalsContact C-N 3.3Å; N865-I867 PolarHBondContact O-N 3.32Å; I867-E869 VanDerWaalsContact C-N 3.28Å; I867-E869 PolarHBondContact O-N 2.87Å; I867-E870 PolarHBondContact O-N 3.18Å; I867-E871 HydrophobicContact CG2-CG 4.39Å; I867-E871 WeakPolarHBondContact O-CB 3.41Å; I867-E871 WeakPolarHBondContact O-CG 3.29Å; I867-E871 PolarHBondContact O-N 3.06Å
868	E	46.3	Very low	43.5	Very low	113 Å²	113	105.3 Å²	105.3	53%	0.528	54%	0.54	S	S	.	.	H	α-helix	trans	-65.5	-26.6	175.3	-75.2	-163.4	160.6	0	0	113.5	A864 N865 Q872	A864-E868 PolarHBondContact O-N 3.39Å; N865-E868 PolarHBondContact O-N 3Å; E868-Q872 WeakPolarHBondContact O-CG 3.47Å; E868-Q872 PolarHBondContact O-N 2.88Å; E868-Q872 PolarHBondContact O-NE2 3.18Å
869	E	45.1	Very low	42.5	Very low	139 Å²	139	108 Å²	108	65%	0.65	54%	0.542	S	S	*	.	H	α-helix	trans	-78.4	-41.2	173.8	-74.2	-177.1	164	0	0	112.2	N865 Q866 I867 Q872 H873	N865-E869 WeakPolarHBondContact O-CG 3.22Å; N865-E869 PolarHBondContact O-N 3.31Å; Q866-E869 PolarHBondContact O-N 3.03Å; I867-E869 VanDerWaalsContact C-N 3.28Å; I867-E869 PolarHBondContact O-N 2.87Å; E869-Q872 PolarHBondContact O-N 3.33Å; E869-H873 PolarHBondContact O-N 3.45Å; E869-H873 VanDerWaalsContact O-N 3.14Å
870	E	42.4	Very low	41.9	Very low	141 Å²	141	107.3 Å²	107.3	66%	0.659	55%	0.547	S	S	*	.	H	α-helix	trans	-66.5	-43.1	174.1	-73	-175.6	155.8	0	0	112.1	Q866 I867 Q872 H873 V874	Q866-E870 PolarHBondContact O-N 3.16Å; I867-E870 PolarHBondContact O-N 3.18Å; E870-Q872 VanDerWaalsContact C-N 3.3Å; E870-Q872 PolarHBondContact O-N 2.71Å; E870-H873 PolarHBondContact O-N 2.97Å; E870-V874 PolarHBondContact O-N 3.03Å; E870-V874 VanDerWaalsContact O-N 3.09Å
871	E	41.2	Very low	41.4	Very low	132 Å²	132	105.9 Å²	105.9	62%	0.617	55%	0.551	S	S	*	*	H	α-helix	trans	-59	-39.6	175.1	-79.3	-170.3	179.1	0	0	112.1	I867 H875	I867-E871 HydrophobicContact CG2-CG 4.39Å; I867-E871 WeakPolarHBondContact O-CB 3.41Å; I867-E871 WeakPolarHBondContact O-CG 3.29Å; I867-E871 PolarHBondContact O-N 3.06Å; E871-H875 VanDerWaalsContact O-CB 3.28Å; E871-H875 WeakPolarHBondContact O-CB 3.31Å; E871-H875 PolarHBondContact O-N 3.07Å
872	Q	39	Very low	40.6	Very low	132 Å²	132	110 Å²	110	62%	0.617	56%	0.561	S	S	*	*	H	α-helix	trans	-67.8	-39.1	176.7	-81.3	175	76.6	0	0	112.6	E868 E869 E870 H875 D876	E868-Q872 WeakPolarHBondContact O-CG 3.47Å; E868-Q872 PolarHBondContact O-N 2.88Å; E868-Q872 PolarHBondContact O-NE2 3.18Å; E869-Q872 PolarHBondContact O-N 3.33Å; E870-Q872 VanDerWaalsContact C-N 3.3Å; E870-Q872 PolarHBondContact O-N 2.71Å; Q872-H875 PolarHBondContact O-N 3.18Å; Q872-D876 PolarHBondContact O-N 3.45Å
873	H	35.6	Very low	39.3	Very low	136 Å²	136	110.1 Å²	110.1	63%	0.63	57%	0.571	S	S	*	*	H	α-helix	trans	-65.9	-39	178.9	-160.8	-65.7	0	0	0	112.1	E869 E870	E869-H873 PolarHBondContact O-N 3.45Å; E869-H873 VanDerWaalsContact O-N 3.14Å; E870-H873 PolarHBondContact O-N 2.97Å
874	V	41.7	Very low	38.6	Very low	83 Å²	83	110.8 Å²	110.8	50%	0.503	59%	0.585	S	S	.	*	H	α-helix	trans	-71.2	-37.5	175.6	177.2	0	0	0	0	111.6	E870 D876 E877 H878	E870-V874 PolarHBondContact O-N 3.03Å; E870-V874 VanDerWaalsContact O-N 3.09Å; V874-D876 VanDerWaalsContact C-N 3.32Å; V874-D876 PolarHBondContact O-N 3.3Å; V874-E877 PolarHBondContact O-N 3.01Å; V874-H878 PolarHBondContact O-CD2 3.18Å; V874-H878 PolarHBondContact O-N 3.43Å
875	H	35.4	Very low	38.2	Very low	105 Å²	105	114.4 Å²	114.4	49%	0.486	59%	0.594	S	S	.	*	H	α-helix	trans	-71.2	-23	-175.7	-156.7	55.4	0	0	0	114.1	E871 Q872	E871-H875 VanDerWaalsContact O-CB 3.28Å; E871-H875 WeakPolarHBondContact O-CB 3.31Å; E871-H875 PolarHBondContact O-N 3.07Å; Q872-H875 PolarHBondContact O-N 3.18Å
876	D	33.1	Very low	37.5	Very low	96 Å²	96	117.2 Å²	117.2	51%	0.513	61%	0.608	S	S	.	*	H	α-helix	trans	-84.8	-26.6	177.4	-90.3	4.6	0	0	0	114.1	Q872 V874 K879	Q872-D876 PolarHBondContact O-N 3.45Å; V874-D876 VanDerWaalsContact C-N 3.32Å; V874-D876 PolarHBondContact O-N 3.3Å; D876-K879 WeakPolarHBondContact OD1-CD 3.32Å; D876-K879 WeakPolarHBondContact OD1-CE 3.46Å; D876-K879 IonicContact OD1-NZ 3.26Å; D876-K879 PolarHBondContact OD1-NZ 2.94Å
877	E	34.6	Very low	36.8	Very low	141 Å²	141	121 Å²	121	66%	0.659	63%	0.626	S	S	*	*	H	α-helix	trans	-71.6	-41.8	171.5	-67.1	-165.1	135.9	0	0	111.5	V874 K879 V880	V874-E877 PolarHBondContact O-N 3.01Å; E877-K879 VanDerWaalsContact C-N 3.28Å; E877-K879 PolarHBondContact O-N 3.46Å; E877-V880 PolarHBondContact O-N 2.74Å
878	H	38.3	Very low	36.8	Very low	129 Å²	129	124.8 Å²	124.8	60%	0.597	64%	0.635	S	S	*	*	H	α-helix	trans	-62.8	-28.5	178.2	-85.4	-99.8	0	0	0	114	V874 V880 A881	V874-H878 PolarHBondContact O-CD2 3.18Å; V874-H878 PolarHBondContact O-N 3.43Å; H878-V880 PolarHBondContact O-N 3.03Å; H878-A881 PolarHBondContact O-N 3.48Å
879	K	30.3	Very low	36.2	Very low	113 Å²	113	125.9 Å²	125.9	49%	0.491	64%	0.644	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.1	-29.7	-179.8	-90.7	174.8	-173.9	159.2	0	114.6	D876 E877	D876-K879 WeakPolarHBondContact OD1-CD 3.32Å; D876-K879 WeakPolarHBondContact OD1-CE 3.46Å; D876-K879 IonicContact OD1-NZ 3.26Å; D876-K879 PolarHBondContact OD1-NZ 2.94Å; E877-K879 VanDerWaalsContact C-N 3.28Å; E877-K879 PolarHBondContact O-N 3.46Å
880	V	34.6	Very low	35.7	Very low	124 Å²	124	127 Å²	127	75%	0.752	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-30.1	-172.8	-175.1	0	0	0	0	111.4	E877 H878	E877-V880 PolarHBondContact O-N 2.74Å; H878-V880 PolarHBondContact O-N 3.03Å
881	A	33.3	Very low	35.8	Very low	80 Å²	80	128.1 Å²	128.1	66%	0.661	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-36.4	179.8	0	0	0	0	0	113.6	H878 S883	H878-A881 PolarHBondContact O-N 3.48Å; A881-S883 PolarHBondContact O-N 3.1Å
882	E	33.3	Very low	36	Very low	137 Å²	137	126.4 Å²	126.4	64%	0.64	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-69.1	-10.3	-169.8	-156.8	173.2	-151.6	0	0	114.2	A884	E882-A884 PolarHBondContact O-N 3.42Å
883	S	28.3	Very low	36.8	Very low	105 Å²	105	129.1 Å²	129.1	73%	0.734	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-72.8	-5	-176.5	-65.1	0	0	0	0	115.5	A881	A881-S883 PolarHBondContact O-N 3.1Å
884	A	34.8	Very low	38.7	Very low	87 Å²	87	124.8 Å²	124.8	72%	0.719	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-92.7	-22.3	-176.3	0	0	0	0	0	114.9	E882 L886	E882-A884 PolarHBondContact O-N 3.42Å; A884-L886 PolarHBondContact O-N 3.2Å
885	E	36.5	Very low	40.7	Very low	119 Å²	119	128.7 Å²	128.7	56%	0.556	67%	0.666	S	S	*	*			trans	-88.6	58.8	-165.5	-63.7	-162.9	135.4	0	0	114.6	K801	K801-E885 WeakPolarHBondContact CE-OE1 3.38Å; K801-E885 IonicContact NZ-OE1 2.72Å; K801-E885 PolarHBondContact NZ-OE1 3.23Å; K801-E885 IonicContact NZ-OE2 2.68Å; K801-E885 PolarHBondContact NZ-OE2 3.16Å
886	L	33.7	Very low	43.1	Very low	156 Å²	156	123.8 Å²	123.8	82%	0.817	64%	0.643	S	S	*	*			trans	-123.2	65.8	173.6	-79.9	174.7	0	0	0	113.7	A884	A884-L886 PolarHBondContact O-N 3.2Å
887	Q	29.1	Very low	45.7	Very low	189 Å²	189	119.6 Å²	119.6	88%	0.883	62%	0.623	S	S	*	*			trans	-150.1	154.2	149	-111	132	103.6	0	0	110
888	R	45.2	Very low	48.5	Very low	164 Å²	164	117 Å²	117	62%	0.619	61%	0.612	S	S	*	*			trans	-143.8	164.6	173.3	-73.6	-156.5	-41.6	178.8	11.3	109.7
889	D	34.6	Very low	51.1	Low	136 Å²	136	111 Å²	111	73%	0.727	58%	0.584	S	S	*	*	S	Bend	trans	73.1	136.8	-178	-49.8	-24.4	0	0	0	111.5
890	D	35.4	Very low	54.1	Low	162 Å²	162	105.9 Å²	105.9	87%	0.866	56%	0.562	S	S	*	*			trans	54.3	61.5	-167.7	-61	-19.8	0	0	0	115.9	P892	D890-P892 WeakPolarHBondContact O-CD 3.23Å
891	E	43.8	Very low	56.7	Low	165 Å²	165	102 Å²	102	77%	0.771	55%	0.547	S	S	*	.			trans	-61.7	118.4	158	-172.2	177.7	-129.5	0	0	108.4
892	P	44.6	Very low	59.4	Low	96 Å²	96	99 Å²	99	62%	0.623	52%	0.524	S	S	*	.			trans	-66.6	152.5	-176.2	27.7	-34.7	0	0	0	110.6	D890 V894	D890-P892 WeakPolarHBondContact O-CD 3.23Å; P892-V894 HydrophobicContact CG-CG2 4.4Å; P892-V894 PolarHBondContact O-N 3.23Å
893	Q	57.5	Low	62.2	Low	188 Å²	188	96.8 Å²	96.8	88%	0.879	52%	0.517	S	S	*	.			trans	-67.4	83.7	172.4	-75.8	-171.5	-28.4	0	0	110.8	K895	Q893-K895 PolarHBondContact O-N 3.1Å; Q893-K895 VanDerWaalsContact O-N 3.13Å
894	V	75.3	Confident	65.3	Low	45 Å²	45	94 Å²	94	27%	0.273	49%	0.49	S	S	.	.			trans	-66	109.3	173.7	-174.3	0	0	0	0	108.4	L798 L800 P892 I896	L798-V894 HydrophobicContact CD1-CG1 3.96Å; L800-V894 HydrophobicContact CD1-CG1 3.85Å; L800-V894 HydrophobicContact CD2-CG1 4.26Å; L800-V894 HydrophobicContact CD2-CG2 4.39Å; P892-V894 HydrophobicContact CG-CG2 4.4Å; P892-V894 PolarHBondContact O-N 3.23Å; V894-I896 HydrophobicContact CG1-CD1 4.3Å; V894-I896 PolarHBondContact O-N 3.26Å
895	K	83.9	Confident	68.2	Low	166 Å²	166	89.9 Å²	89.9	72%	0.722	46%	0.456	S	S	*	.			trans	-76.9	113.8	174.1	-67.3	-176.2	177.3	-175.5	0	108.7	Q893 G902	Q893-K895 PolarHBondContact O-N 3.1Å; Q893-K895 VanDerWaalsContact O-N 3.13Å; K895-G902 WeakPolarHBondContact CA-O 3.48Å
896	I	85.4	Confident	71.1	Confident	1 Å²	1	84.2 Å²	84.2	1%	0.005	43%	0.429	C	S	.	.			trans	-73.1	-51.8	179.6	-53.4	-56.1	0	0	0	110.8	E791 I794 V795 L800 V894 I905	E791-I896 HydrophobicContact CB-CG2 4.31Å; E791-I896 HydrophobicContact CG-CD1 4.49Å; E791-I896 HydrophobicContact CG-CG1 4.43Å; E791-I896 HydrophobicContact CG-CG2 4.12Å; I794-I896 HydrophobicContact CB-CG2 4.06Å; I794-I896 HydrophobicContact CD1-CG2 3.8Å; I794-I896 HydrophobicContact CG2-CG2 4.18Å; I794-I896 WeakPolarHBondContact CG2-O 3.43Å; V795-I896 WeakPolarHBondContact CG1-O 3.46Å; V795-I896 HydrophobicContact CG2-CD1 4.26Å; V795-I896 HydrophobicContact CG2-CG2 4.21Å; L800-I896 HydrophobicContact CD1-CD1 3.31Å; V894-I896 HydrophobicContact CG1-CD1 4.3Å; V894-I896 PolarHBondContact O-N 3.26Å; I896-I905 HydrophobicContact CG2-CD1 4.11Å
897	G	88.3	Confident	74.1	Confident	9 Å²	9	77.9 Å²	77.9	9%	0.093	40%	0.395	C	S	.	.			trans	165	174.5	-175.5	0	0	0	0	0	111.3	E766 L899 G902	E766-G897 CarbonylContact O-C 3.48Å; E766-G897 VanDerWaalsContact O-CA 3.3Å; E766-G897 WeakPolarHBondContact O-CA 3.27Å; G897-L899 PolarHBondContact O-N 3.35Å; G897-G902 VanDerWaalsContact O-CA 3.25Å; G897-G902 WeakPolarHBondContact O-CA 3.34Å; G897-G902 PolarHBondContact O-N 3.29Å
898	M	93.1	Very high	77.2	Confident	86 Å²	86	69.7 Å²	69.7	42%	0.424	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-73.2	-11.7	-172.3	-65.9	-55.2	-59.5	0	0	114.5	E766 Y768 Q769 N900 G901	E766-M898 PolarHBondContact O-N 3.36Å; Y768-M898 CarbonylContact O-C 3.58Å; Y768-M898 VanDerWaalsContact O-C 3.22Å; Q769-M898 HydrophobicContact CB-CB 4.39Å; Q769-M898 PolarHBondContact NE2-O 2.72Å; M898-N900 PolarHBondContact O-N 3.45Å; M898-G901 PolarHBondContact O-N 3.49Å
899	L	91.4	Very high	79.4	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.01	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-58.5	-30.9	-178.9	-177.6	58.1	0	0	0	113.4	Y768 L770 F776 I790 I794 G897 I905	Y768-L899 HydrophobicContact CD1-CD1 4.04Å; Y768-L899 HydrophobicContact CE1-CD1 4.03Å; Y768-L899 WeakPolarHBondContact O-CA 3.17Å; Y768-L899 PolarHBondContact O-N 2.85Å; L770-L899 HydrophobicContact CD1-CD1 4.31Å; L770-L899 HydrophobicContact CD2-CD1 4.42Å; L770-L899 HydrophobicContact CG-CD1 3.84Å; F776-L899 HydrophobicContact CB-CD1 4.42Å; F776-L899 HydrophobicContact CB-CG 4.2Å; F776-L899 WeakPolarHBondContact CB-O 3.17Å; F776-L899 HydrophobicContact CD1-CD1 4.41Å; F776-L899 HydrophobicContact CD1-CD2 3.71Å; F776-L899 HydrophobicContact CD1-CG 3.75Å; F776-L899 HydrophobicContact CE1-CD2 3.99Å; F776-L899 HydrophobicContact CG-CD1 4.42Å; F776-L899 HydrophobicContact CG-CD2 4.49Å; F776-L899 HydrophobicContact CG-CG 4.15Å; I790-L899 HydrophobicContact CG2-CD2 4.23Å; I794-L899 HydrophobicContact CD1-CD2 4.18Å; G897-L899 PolarHBondContact O-N 3.35Å; L899-I905 HydrophobicContact CB-CD1 4.08Å; L899-I905 HydrophobicContact CD2-CD1 4.26Å; L899-I905 HydrophobicContact CG-CD1 4.3Å
900	N	94.1	Very high	81.7	Confident	7 Å²	7	55.9 Å²	55.9	4%	0.037	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-123.3	37.3	167.3	-164.5	21.4	0	0	0	111.7	G775 F776 M898 G902 N903 R904 I905	G775-N900 VanDerWaalsContact CA-OD1 3.28Å; G775-N900 WeakPolarHBondContact CA-OD1 3.43Å; F776-N900 HydrophobicContact CB-CB 4.44Å; F776-N900 PolarHBondContact N-OD1 3.36Å; F776-N900 WeakPolarHBondContact O-CB 3.34Å; F776-N900 PolarHBondContact O-ND2 2.87Å; F776-N900 VanDerWaalsContact O-ND2 3.13Å; M898-N900 PolarHBondContact O-N 3.45Å; N900-G902 VanDerWaalsContact C-N 3.27Å; N900-G902 PolarHBondContact O-N 3.49Å; N900-N903 HydrophobicContact CB-CB 4.5Å; N900-N903 VanDerWaalsContact O-CB 3.32Å; N900-N903 WeakPolarHBondContact O-CB 3.44Å; N900-N903 PolarHBondContact O-N 3.03Å; N900-N903 PolarHBondContact O-ND2 3.04Å; N900-R904 PolarHBondContact ND2-O 3.46Å; N900-I905 HydrophobicContact CB-CD1 4.17Å; N900-I905 HydrophobicContact CB-CG1 3.59Å
901	G	89.1	Confident	83.4	Confident	42 Å²	42	51.2 Å²	51.2	43%	0.433	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	27.7	178	0	0	0	0	0	115.1	M898	M898-G901 PolarHBondContact O-N 3.49Å
902	G	89.4	Confident	84.6	Confident	16 Å²	16	47.6 Å²	47.6	17%	0.165	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	-0.3	-174.6	0	0	0	0	0	115.1	K895 G897 N900	K895-G902 WeakPolarHBondContact CA-O 3.48Å; G897-G902 VanDerWaalsContact O-CA 3.25Å; G897-G902 WeakPolarHBondContact O-CA 3.34Å; G897-G902 PolarHBondContact O-N 3.29Å; N900-G902 VanDerWaalsContact C-N 3.27Å; N900-G902 PolarHBondContact O-N 3.49Å
903	N	92.6	Very high	85	Confident	92 Å²	92	46 Å²	46	49%	0.492	24%	0.241	S	C	.	.	S	Bend	trans	-82.9	170.7	175.9	-58.8	-79.4	0	0	0	112.2	N900	N900-N903 HydrophobicContact CB-CB 4.5Å; N900-N903 VanDerWaalsContact O-CB 3.32Å; N900-N903 WeakPolarHBondContact O-CB 3.44Å; N900-N903 PolarHBondContact O-N 3.03Å; N900-N903 PolarHBondContact O-ND2 3.04Å
904	R	94.4	Very high	85.1	Confident	46 Å²	46	43 Å²	43	17%	0.174	23%	0.229	C	C	.	.			trans	-62.6	150.7	169	-60.8	-60.3	-55.7	-89.8	-3.4	111.4	E791 K801 V803 N900 F907	E791-R904 WeakPolarHBondContact OE1-CA 3.27Å; E791-R904 IonicContact OE1-CZ 2.98Å; E791-R904 IonicContact OE1-NE 3.28Å; E791-R904 PolarHBondContact OE1-NE 2.97Å; E791-R904 IonicContact OE1-NH2 2.83Å; E791-R904 PolarHBondContact OE1-NH2 2.66Å; E791-R904 IonicContact OE2-CZ 2.68Å; E791-R904 IonicContact OE2-NE 3.41Å; E791-R904 IonicContact OE2-NH2 3.46Å; E791-R904 PolarHBondContact OE2-NH2 3.38Å; K801-R904 PolarHBondContact O-NH1 3.41Å; K801-R904 PolarHBondContact O-NH2 2.82Å; V803-R904 HydrophobicContact CG2-CB 3.56Å; V803-R904 HydrophobicContact CG2-CG 3.69Å; N900-R904 PolarHBondContact ND2-O 3.46Å; R904-F907 HydrophobicContact CB-CZ 4.5Å
905	I	95.6	Very high	84.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.218	C	C	.	.			trans	-120.7	-40.5	-174.2	-70.3	166.6	0	0	0	112.1	F776 N778 I790 E791 I794 I896 L899 N900 F907	F776-I905 HydrophobicContact CD1-CD1 4.49Å; F776-I905 HydrophobicContact CD1-CG1 4.42Å; F776-I905 HydrophobicContact CD1-CG2 3.59Å; F776-I905 HydrophobicContact CE1-CG2 3.58Å; N778-I905 HydrophobicContact CB-CG2 4.05Å; N778-I905 WeakPolarHBondContact CB-O 3.5Å; N778-I905 PolarHBondContact N-O 3.41Å; I790-I905 HydrophobicContact CB-CG2 3.98Å; I790-I905 HydrophobicContact CG2-CG2 4.2Å; E791-I905 HydrophobicContact CG-CB 3.87Å; E791-I905 PolarHBondContact OE1-N 3.34Å; I794-I905 HydrophobicContact CD1-CD1 3.48Å; I794-I905 VanDerWaalsContact CD1-CD1 3.48Å; I896-I905 HydrophobicContact CG2-CD1 4.11Å; L899-I905 HydrophobicContact CB-CD1 4.08Å; L899-I905 HydrophobicContact CD2-CD1 4.26Å; L899-I905 HydrophobicContact CG-CD1 4.3Å; N900-I905 HydrophobicContact CB-CD1 4.17Å; N900-I905 HydrophobicContact CB-CG1 3.59Å; I905-F907 VanDerWaalsContact O-CD2 3.28Å; I905-F907 WeakPolarHBondContact O-CD2 3.44Å
906	D	97	Very high	83.1	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	118.4	-177.2	-71.2	-34.4	0	0	0	110.7	N778 Y780 R789 I790 E791 P802 V803	N778-D906 PolarHBondContact ND2-OD1 3Å; Y780-D906 HydrophobicContact CE1-CB 4.07Å; R789-D906 WeakPolarHBondContact CB-OD2 3.28Å; R789-D906 IonicContact CZ-OD2 3.73Å; R789-D906 IonicContact NE-OD2 2.71Å; R789-D906 PolarHBondContact NE-OD2 3.4Å; R789-D906 IonicContact NH2-OD2 2.73Å; R789-D906 PolarHBondContact NH2-OD2 3.2Å; I790-D906 PolarHBondContact N-OD1 2.97Å; I790-D906 PolarHBondContact N-OD2 3.16Å; E791-D906 WeakPolarHBondContact CB-OD2 3.13Å; E791-D906 HydrophobicContact CG-CB 4.04Å; E791-D906 WeakPolarHBondContact CG-OD2 3.21Å; E791-D906 PolarHBondContact N-OD2 2.97Å; E791-D906 PolarHBondContact OE1-N 2.98Å; P802-D906 HydrophobicContact CB-CB 3.97Å; V803-D906 PolarHBondContact N-O 3.31Å
907	F	96.2	Very high	81.7	Confident	24 Å²	24	43.5 Å²	43.5	11%	0.105	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.7	178.6	-67.1	-98	0	0	0	110.5	F777 N778 I779 Y780 V803 I805 R904 I905 L939	F777-F907 HydrophobicContact CD1-CD2 4.32Å; F777-F907 AromaticContact CD1-CE2 3.66Å; F777-F907 HydrophobicContact CD1-CE2 3.66Å; F777-F907 HydrophobicContact CD1-CZ 4.09Å; F777-F907 HydrophobicContact CE1-CE2 4.37Å; F777-F907 HydrophobicContact CE1-CZ 4.43Å; N778-F907 PolarHBondContact O-N 3.1Å; I779-F907 WeakPolarHBondContact CA-O 3.48Å; I779-F907 HydrophobicContact CG1-CB 4.2Å; Y780-F907 PolarHBondContact N-O 3.06Å; V803-F907 HydrophobicContact CB-CD1 3.69Å; V803-F907 HydrophobicContact CB-CE1 3.9Å; V803-F907 HydrophobicContact CB-CG 4.28Å; V803-F907 HydrophobicContact CG1-CD1 3.74Å; V803-F907 HydrophobicContact CG1-CE1 3.73Å; V803-F907 HydrophobicContact CG2-CE1 4.34Å; V803-F907 CarbonylContact O-C 3.48Å; V803-F907 VanDerWaalsContact O-CA 3.29Å; V803-F907 WeakPolarHBondContact O-CA 3.39Å; I805-F907 HydrophobicContact CD1-CB 3.94Å; I805-F907 HydrophobicContact CG1-CB 3.92Å; R904-F907 HydrophobicContact CB-CZ 4.5Å; I905-F907 VanDerWaalsContact O-CD2 3.28Å; I905-F907 WeakPolarHBondContact O-CD2 3.44Å; F907-L939 HydrophobicContact CB-CD2 4.14Å; F907-L939 HydrophobicContact CD1-CD1 4.47Å; F907-L939 HydrophobicContact CD1-CD2 4.13Å; F907-L939 HydrophobicContact CG-CD2 4.16Å
908	V	94.4	Very high	80.4	Confident	16 Å²	16	46.7 Å²	46.7	10%	0.097	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	130.1	-174.4	67.7	0	0	0	0	112.1	Y780 P782 P802 V803 L804 I805	Y780-V908 HydrophobicContact CD2-CG2 4.11Å; Y780-V908 HydrophobicContact CE2-CB 4.06Å; Y780-V908 HydrophobicContact CE2-CG2 3.75Å; Y780-V908 CarbonylContact O-C 3.38Å; Y780-V908 WeakPolarHBondContact O-CA 3.44Å; P782-V908 HydrophobicContact CB-CG2 4.12Å; P782-V908 HydrophobicContact CG-CG2 4.26Å; P802-V908 HydrophobicContact CB-CB 4.19Å; P802-V908 HydrophobicContact CB-CG1 4.07Å; P802-V908 HydrophobicContact CG-CB 4.07Å; P802-V908 HydrophobicContact CG-CG1 3.76Å; V803-V908 PolarHBondContact O-N 3.36Å; L804-V908 HydrophobicContact CD1-CG1 4.04Å; I805-V908 WeakPolarHBondContact CG1-O 3.45Å; I805-V908 PolarHBondContact N-O 3.19Å
909	L	90.8	Very high	79.2	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.026	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-71.3	155.9	174.1	-70.7	171	0	0	0	111.6	Y780 H781 P782 I805 Y930 D935	Y780-L909 PolarHBondContact O-N 3.18Å; H781-L909 HydrophobicContact CB-CD1 4.36Å; P782-L909 WeakPolarHBondContact CD-O 3.35Å; I805-L909 HydrophobicContact CB-CD2 4.41Å; I805-L909 HydrophobicContact CD1-CD2 3.69Å; I805-L909 HydrophobicContact CD1-CG 4.04Å; I805-L909 HydrophobicContact CG2-CD2 4.39Å; L909-Y930 HydrophobicContact CD1-CD1 3.82Å; L909-Y930 HydrophobicContact CD1-CE1 3.69Å; L909-D935 HydrophobicContact CD2-CB 3.76Å
910	Q	82.7	Confident	77.5	Confident	5 Å²	5	58.3 Å²	58.3	2%	0.023	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-82.4	137.9	172.7	-66.6	178.8	50.7	0	0	110.7	L804 I805 H807 R813 L816	L804-Q910 HydrophobicContact CD1-CG 3.78Å; L804-Q910 HydrophobicContact CD2-CG 4.42Å; L804-Q910 HydrophobicContact CG-CG 4.14Å; I805-Q910 PolarHBondContact O-NE2 3.01Å; H807-Q910 VanDerWaalsContact N-NE2 3.16Å; R813-Q910 HydrophobicContact CG-CB 4.4Å; R813-Q910 PolarHBondContact NH1-O 3.49Å; R813-Q910 PolarHBondContact NH2-O 3.15Å; L816-Q910 HydrophobicContact CD2-CG 4.21Å
911	E	72.3	Confident	75.7	Confident	64 Å²	64	63.4 Å²	63.4	30%	0.299	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-65.1	154	169.9	-67.7	152.4	-150.4	0	0	111.4	P782 R813	P782-E911 HydrophobicContact CG-CG 3.67Å; P782-E911 WeakPolarHBondContact CG-OE1 3.41Å; R813-E911 WeakPolarHBondContact CD-O 3.49Å; R813-E911 PolarHBondContact NH1-O 2.95Å
912	K	68.8	Low	74.6	Confident	90 Å²	90	62.9 Å²	62.9	39%	0.391	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-84.4	149.9	163	-59.1	178.4	-157.4	70.6	0	109.4	I914 E915	K912-I914 PolarHBondContact O-N 3.2Å; K912-E915 HydrophobicContact CB-CG 4.11Å; K912-E915 VanDerWaalsContact CB-OE2 3.23Å; K912-E915 WeakPolarHBondContact CB-OE2 3.48Å; K912-E915 WeakPolarHBondContact CD-OE1 3.34Å; K912-E915 VanDerWaalsContact CG-OE2 3.25Å; K912-E915 WeakPolarHBondContact CG-OE2 3.34Å; K912-E915 PolarHBondContact N-OE2 2.94Å; K912-E915 IonicContact NZ-OE1 3.42Å; K912-E915 PolarHBondContact NZ-OE1 3.3Å; K912-E915 IonicContact NZ-OE2 3.75Å; K912-E915 PolarHBondContact NZ-OE2 2.95Å; K912-E915 WeakPolarHBondContact O-CB 3.49Å; K912-E915 PolarHBondContact O-N 3.12Å
913	P	53.3	Low	73.5	Confident	62 Å²	62	63 Å²	63	40%	0.403	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-7.4	-178.2	-22.1	33.2	0	0	0	116	H815 F917	H815-P913 HydrophobicContact CB-CB 4.02Å; H815-P913 HydrophobicContact CB-CG 3.77Å; P913-F917 VanDerWaalsContact O-CD2 3.25Å; P913-F917 WeakPolarHBondContact O-CD2 3.45Å; P913-F917 WeakPolarHBondContact O-CE2 3.16Å
914	I	58.3	Low	72.3	Confident	125 Å²	125	62.5 Å²	62.5	64%	0.641	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-28.2	174.2	-57.5	178.4	0	0	0	110.7	K912 S916 F917 F922	K912-I914 PolarHBondContact O-N 3.2Å; I914-S916 VanDerWaalsContact C-N 3.34Å; I914-S916 PolarHBondContact O-N 3.16Å; I914-F917 PolarHBondContact O-N 3.22Å; I914-F922 HydrophobicContact CG2-CE2 4.41Å; I914-F922 HydrophobicContact CG2-CZ 3.93Å; I914-F922 WeakPolarHBondContact O-CE2 3.29Å
915	E	59.5	Low	71.3	Confident	7 Å²	7	64.1 Å²	64.1	3%	0.033	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-71.2	-32.6	-175.6	-70.4	161.7	173.7	0	0	111.5	H781 L783 K912 F917 N918 F922	H781-E915 IonicContact NE2-OE2 3.76Å; L783-E915 HydrophobicContact CD1-CB 4.12Å; K912-E915 HydrophobicContact CB-CG 4.11Å; K912-E915 VanDerWaalsContact CB-OE2 3.23Å; K912-E915 WeakPolarHBondContact CB-OE2 3.48Å; K912-E915 WeakPolarHBondContact CD-OE1 3.34Å; K912-E915 VanDerWaalsContact CG-OE2 3.25Å; K912-E915 WeakPolarHBondContact CG-OE2 3.34Å; K912-E915 PolarHBondContact N-OE2 2.94Å; K912-E915 IonicContact NZ-OE1 3.42Å; K912-E915 PolarHBondContact NZ-OE1 3.3Å; K912-E915 IonicContact NZ-OE2 3.75Å; K912-E915 PolarHBondContact NZ-OE2 2.95Å; K912-E915 WeakPolarHBondContact O-CB 3.49Å; K912-E915 PolarHBondContact O-N 3.12Å; E915-F917 PolarHBondContact O-N 3.06Å; E915-F917 VanDerWaalsContact O-N 3.09Å; E915-N918 PolarHBondContact O-N 3.31Å; E915-F922 VanDerWaalsContact CA-CD2 3.48Å; E915-F922 HydrophobicContact CB-CB 4.38Å; E915-F922 HydrophobicContact CB-CD2 4.16Å; E915-F922 HydrophobicContact CB-CG 4.17Å; E915-F922 HydrophobicContact CG-CB 4.16Å; E915-F922 HydrophobicContact CG-CD1 3.88Å; E915-F922 HydrophobicContact CG-CD2 4.16Å; E915-F922 HydrophobicContact CG-CE1 4.32Å; E915-F922 HydrophobicContact CG-CG 3.79Å
916	S	58.1	Low	70.5	Confident	45 Å²	45	64.2 Å²	64.2	32%	0.315	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-70.4	6.8	174.5	62.2	0	0	0	0	115.4	I914	I914-S916 VanDerWaalsContact C-N 3.34Å; I914-S916 PolarHBondContact O-N 3.16Å
917	F	56	Low	69.9	Low	171 Å²	171	65 Å²	65	75%	0.75	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-104.5	-14.2	175.3	-74.9	-78.1	0	0	0	114.1	P913 I914 E915	P913-F917 VanDerWaalsContact O-CD2 3.25Å; P913-F917 WeakPolarHBondContact O-CD2 3.45Å; P913-F917 WeakPolarHBondContact O-CE2 3.16Å; I914-F917 PolarHBondContact O-N 3.22Å; E915-F917 PolarHBondContact O-N 3.06Å; E915-F917 VanDerWaalsContact O-N 3.09Å
918	N	62.4	Low	69.1	Low	76 Å²	76	65.6 Å²	65.6	41%	0.406	32%	0.321	S	S	.	.			trans	-161.2	89.1	175.5	-169.3	-38.7	0	0	0	111.6	E915 Y920 L921 F922	E915-N918 PolarHBondContact O-N 3.31Å; N918-Y920 VanDerWaalsContact C-N 3.34Å; N918-Y920 PolarHBondContact O-N 3.12Å; N918-Y920 PolarHBondContact OD1-N 3.38Å; N918-L921 HydrophobicContact CB-CB 3.98Å; N918-L921 PolarHBondContact O-N 3.25Å; N918-L921 VanDerWaalsContact O-N 3.15Å; N918-L921 WeakPolarHBondContact OD1-CB 3.39Å; N918-L921 PolarHBondContact OD1-N 2.96Å; N918-F922 WeakPolarHBondContact O-CD2 3.47Å; N918-F922 PolarHBondContact O-N 3.07Å
919	E	66.1	Low	68.7	Low	122 Å²	122	66.1 Å²	66.1	57%	0.57	33%	0.325	S	S	*	.	H	α-helix	trans	-52.9	-47.9	-175.5	-57	-179.9	164.5	0	0	112.7	L783 L921 F922 A923	L783-E919 HydrophobicContact CD2-CB 4.05Å; L783-E919 HydrophobicContact CD2-CG 3.84Å; E919-L921 VanDerWaalsContact C-N 3.32Å; E919-L921 PolarHBondContact O-N 3.4Å; E919-F922 PolarHBondContact O-N 3.04Å; E919-A923 PolarHBondContact O-N 2.96Å
920	Y	57.1	Low	68.6	Low	210 Å²	210	65.9 Å²	65.9	82%	0.824	32%	0.324	S	S	*	.	H	α-helix	trans	-64.3	-31.8	-178.5	-62.9	-75.6	0	0	0	113.9	N918 F922	N918-Y920 VanDerWaalsContact C-N 3.34Å; N918-Y920 PolarHBondContact O-N 3.12Å; N918-Y920 PolarHBondContact OD1-N 3.38Å; Y920-F922 VanDerWaalsContact C-N 3.35Å
921	L	56.7	Low	68.8	Low	114 Å²	114	65.8 Å²	65.8	60%	0.597	32%	0.324	S	S	*	.	H	α-helix	trans	-73.8	-28.4	178.3	-171.1	143.2	0	0	0	112.1	N918 E919	N918-L921 HydrophobicContact CB-CB 3.98Å; N918-L921 PolarHBondContact O-N 3.25Å; N918-L921 VanDerWaalsContact O-N 3.15Å; N918-L921 WeakPolarHBondContact OD1-CB 3.39Å; N918-L921 PolarHBondContact OD1-N 2.96Å; E919-L921 VanDerWaalsContact C-N 3.32Å; E919-L921 PolarHBondContact O-N 3.4Å
922	F	64.5	Low	69.5	Low	30 Å²	30	67.4 Å²	67.4	13%	0.132	33%	0.331	C	S	.	.	H	α-helix	trans	-101.7	-9.9	-177.9	-64.3	-68.8	0	0	0	114.7	L783 I914 E915 N918 E919 Y920 L924 Q925 S926	L783-F922 HydrophobicContact CD1-CB 4.31Å; I914-F922 HydrophobicContact CG2-CE2 4.41Å; I914-F922 HydrophobicContact CG2-CZ 3.93Å; I914-F922 WeakPolarHBondContact O-CE2 3.29Å; E915-F922 VanDerWaalsContact CA-CD2 3.48Å; E915-F922 HydrophobicContact CB-CB 4.38Å; E915-F922 HydrophobicContact CB-CD2 4.16Å; E915-F922 HydrophobicContact CB-CG 4.17Å; E915-F922 HydrophobicContact CG-CB 4.16Å; E915-F922 HydrophobicContact CG-CD1 3.88Å; E915-F922 HydrophobicContact CG-CD2 4.16Å; E915-F922 HydrophobicContact CG-CE1 4.32Å; E915-F922 HydrophobicContact CG-CG 3.79Å; N918-F922 WeakPolarHBondContact O-CD2 3.47Å; N918-F922 PolarHBondContact O-N 3.07Å; E919-F922 PolarHBondContact O-N 3.04Å; Y920-F922 VanDerWaalsContact C-N 3.35Å; F922-L924 PolarHBondContact O-N 3.3Å; F922-Q925 WeakPolarHBondContact O-CB 3.48Å; F922-Q925 PolarHBondContact O-N 3.29Å; F922-S926 PolarHBondContact O-N 3.31Å
923	A	66.4	Low	70.5	Confident	20 Å²	20	63.7 Å²	63.7	17%	0.165	32%	0.317	C	S	.	.	H	α-helix	trans	-47.9	-56.4	-178.9	0	0	0	0	0	113.6	L783 P785 E919 Q925 S926 H927	L783-A923 WeakPolarHBondContact O-CA 3.31Å; P785-A923 HydrophobicContact CG-CB 4.19Å; E919-A923 PolarHBondContact O-N 2.96Å; A923-Q925 VanDerWaalsContact C-N 3.34Å; A923-Q925 PolarHBondContact O-N 3.13Å; A923-S926 PolarHBondContact O-N 3.08Å; A923-S926 PolarHBondContact O-OG 3.17Å; A923-H927 PolarHBondContact O-N 3.14Å
924	L	67.3	Low	72.5	Confident	81 Å²	81	63.8 Å²	63.8	42%	0.424	31%	0.312	S	S	.	.	H	α-helix	trans	-66.5	-33.2	178.8	-176.2	64.5	0	0	0	112.9	L443 F515 F922 S926 L928	L443-L924 HydrophobicContact CD2-CD2 3.95Å; L443-L924 HydrophobicContact CD2-CG 3.99Å; F515-L924 HydrophobicContact CZ-CD1 4.28Å; F515-L924 HydrophobicContact CZ-CD2 4.46Å; F922-L924 PolarHBondContact O-N 3.3Å; L924-S926 VanDerWaalsContact C-N 3.32Å; L924-L928 HydrophobicContact CD1-CD1 4.28Å; L924-L928 HydrophobicContact CG-CD1 4.34Å
925	Q	73.4	Confident	74.1	Confident	79 Å²	79	58 Å²	58	37%	0.369	28%	0.282	S	S	.	.	H	α-helix	trans	-66.7	-37.2	175.7	-177.5	170.7	-2.7	0	0	111.5	L443 F922 A923 L928 C929	L443-Q925 HydrophobicContact CD1-CB 3.78Å; L443-Q925 HydrophobicContact CD1-CG 3.84Å; F922-Q925 WeakPolarHBondContact O-CB 3.48Å; F922-Q925 PolarHBondContact O-N 3.29Å; A923-Q925 VanDerWaalsContact C-N 3.34Å; A923-Q925 PolarHBondContact O-N 3.13Å; Q925-L928 PolarHBondContact O-N 3.34Å; Q925-C929 PolarHBondContact O-N 3.1Å
926	S	80.1	Confident	75.8	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-69.5	-38	180	75.1	0	0	0	0	112.9	H781 L783 D784 F922 A923 L924 L928 C929	H781-S926 VanDerWaalsContact ND1-CB 3.26Å; H781-S926 WeakPolarHBondContact ND1-CB 3.27Å; L783-S926 PolarHBondContact O-OG 2.88Å; L783-S926 VanDerWaalsContact O-OG 3.11Å; D784-S926 WeakPolarHBondContact CA-OG 3.49Å; D784-S926 PolarHBondContact N-OG 3.09Å; F922-S926 PolarHBondContact O-N 3.31Å; A923-S926 PolarHBondContact O-N 3.08Å; A923-S926 PolarHBondContact O-OG 3.17Å; L924-S926 VanDerWaalsContact C-N 3.32Å; S926-L928 PolarHBondContact O-N 3.21Å; S926-L928 VanDerWaalsContact O-N 3.16Å; S926-C929 PolarHBondContact O-N 3.45Å; S926-C929 PolarHBondContact O-SG 2.78Å
927	H	83.7	Confident	77.6	Confident	17 Å²	17	55.5 Å²	55.5	8%	0.079	27%	0.266	C	S	.	.	H	α-helix	trans	-60.4	-25.4	174.6	-171.2	62.2	0	0	0	113.5	H566 S567 G749 D784 A923 Y930	H566-H927 AromaticContact CE1-NE2 3.77Å; H566-H927 AromaticContact NE2-NE2 3.85Å; H566-H927 PolarHBondContact NE2-O 2.91Å; S567-H927 VanDerWaalsContact CB-CE1 3.49Å; S567-H927 WeakPolarHBondContact CB-CE1 3.41Å; S567-H927 VanDerWaalsContact CB-NE2 3.27Å; S567-H927 WeakPolarHBondContact CB-NE2 3.31Å; S567-H927 PolarHBondContact OG-CE1 3.05Å; S567-H927 VanDerWaalsContact OG-CE1 3.26Å; S567-H927 PolarHBondContact OG-NE2 3.24Å; G749-H927 PolarHBondContact O-CE1 3.05Å; D784-H927 VanDerWaalsContact CG-ND1 3.27Å; D784-H927 IonicContact OD1-CE1 3.66Å; D784-H927 IonicContact OD1-CG 3.58Å; D784-H927 IonicContact OD1-ND1 3.88Å; D784-H927 PolarHBondContact OD1-ND1 3.37Å; D784-H927 WeakPolarHBondContact OD2-CA 3.04Å; D784-H927 IonicContact OD2-CE1 2.7Å; D784-H927 IonicContact OD2-CG 3.76Å; D784-H927 IonicContact OD2-ND1 2.71Å; D784-H927 PolarHBondContact OD2-ND1 3.05Å; A923-H927 PolarHBondContact O-N 3.14Å; H927-Y930 VanDerWaalsContact O-CD2 3.3Å; H927-Y930 WeakPolarHBondContact O-CD2 3.48Å; H927-Y930 VanDerWaalsContact O-CE2 3.24Å; H927-Y930 WeakPolarHBondContact O-CE2 3.34Å
928	L	80.3	Confident	79.5	Confident	35 Å²	35	47.5 Å²	47.5	18%	0.183	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	1.8	-175.8	-60.7	169.5	0	0	0	112.8	L443 L924 Q925 S926 Y930	L443-L928 HydrophobicContact CD2-CD1 3.76Å; L443-L928 HydrophobicContact CG-CD1 3.86Å; L924-L928 HydrophobicContact CD1-CD1 4.28Å; L924-L928 HydrophobicContact CG-CD1 4.34Å; Q925-L928 PolarHBondContact O-N 3.34Å; S926-L928 PolarHBondContact O-N 3.21Å; S926-L928 VanDerWaalsContact O-N 3.16Å; L928-Y930 PolarHBondContact O-N 3.43Å
929	C	84.3	Confident	81	Confident	27 Å²	27	44.5 Å²	44.5	18%	0.182	22%	0.215	C	C	.	.			trans	-78.4	-18.4	-172.7	79.4	0	0	0	0	114.9	Q925 S926 W931 Q932 S933	Q925-C929 PolarHBondContact O-N 3.1Å; S926-C929 PolarHBondContact O-N 3.45Å; S926-C929 PolarHBondContact O-SG 2.78Å; C929-W931 VanDerWaalsContact C-N 3.32Å; C929-W931 PolarHBondContact O-N 3.01Å; C929-Q932 PolarHBondContact O-N 3.32Å; C929-S933 PolarHBondContact O-N 3.08Å
930	Y	89.4	Confident	82.5	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-59.2	-38.1	-171.6	-53.8	-75.7	0	0	0	113.5	H566 L748 G749 Y780 H781 D784 L909 H927 L928 Q932 S933	H566-Y930 AromaticContact CD2-CD2 3.73Å; H566-Y930 AromaticContact NE2-CD2 3.85Å; L748-Y930 HydrophobicContact CB-CD1 4.4Å; L748-Y930 HydrophobicContact CB-CD2 4.45Å; L748-Y930 HydrophobicContact CB-CG 4.16Å; G749-Y930 WeakPolarHBondContact CA-OH 3.47Å; Y780-Y930 WeakPolarHBondContact CA-OH 3.24Å; H781-Y930 PolarHBondContact N-OH 3.04Å; D784-Y930 WeakPolarHBondContact OD2-CE2 3.37Å; D784-Y930 PolarHBondContact OD2-OH 3.37Å; L909-Y930 HydrophobicContact CD1-CD1 3.82Å; L909-Y930 HydrophobicContact CD1-CE1 3.69Å; H927-Y930 VanDerWaalsContact O-CD2 3.3Å; H927-Y930 WeakPolarHBondContact O-CD2 3.48Å; H927-Y930 VanDerWaalsContact O-CE2 3.24Å; H927-Y930 WeakPolarHBondContact O-CE2 3.34Å; L928-Y930 PolarHBondContact O-N 3.43Å; Y930-Q932 PolarHBondContact O-N 3.03Å; Y930-S933 PolarHBondContact O-N 3.33Å
931	W	87.6	Confident	84.4	Confident	4 Å²	4	28.7 Å²	28.7	2%	0.015	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-62	-23.2	-178.8	-55.4	111.3	0	0	0	114.5	M433 C441 C451 V452 H566 C929	M433-W931 HydrophobicContact CE-CE3 4.21Å; M433-W931 HydrophobicContact CE-CZ3 3.63Å; M433-W931 HydrophobicContact SD-CZ3 4.11Å; C441-W931 VanDerWaalsContact O-CD1 3.29Å; C441-W931 PolarHBondContact O-NE1 3.16Å; C451-W931 HydrophobicContact CB-CB 4.09Å; C451-W931 HydrophobicContact CB-CD2 3.95Å; C451-W931 HydrophobicContact CB-CE3 4.26Å; C451-W931 HydrophobicContact CB-CG 3.87Å; V452-W931 HydrophobicContact CG2-CE3 4.37Å; V452-W931 HydrophobicContact CG2-CZ3 3.84Å; H566-W931 HydrophobicContact CB-CH2 4.02Å; H566-W931 HydrophobicContact CB-CZ2 3.54Å; H566-W931 AromaticContact CG-CZ2 3.71Å; H566-W931 AromaticContact ND1-CZ2 3.87Å; C929-W931 VanDerWaalsContact C-N 3.32Å; C929-W931 PolarHBondContact O-N 3.01Å
932	Q	86.5	Confident	86.2	Confident	98 Å²	98	25.8 Å²	25.8	46%	0.458	13%	0.131	S	C	.	.	G	3₁₀ helix	trans	-115	3.7	179.9	-64.7	-174.8	-28.7	0	0	112.9	D454 C929 Y930 E934	D454-Q932 HydrophobicContact CB-CG 4.31Å; D454-Q932 WeakPolarHBondContact OD2-CG 3.25Å; D454-Q932 PolarHBondContact OD2-NE2 3.4Å; C929-Q932 PolarHBondContact O-N 3.32Å; Y930-Q932 PolarHBondContact O-N 3.03Å; Q932-E934 PolarHBondContact O-N 3.04Å
933	S	90.7	Very high	87.6	Confident	12 Å²	12	25.9 Å²	25.9	8%	0.084	13%	0.131	C	C	.	.			trans	-80.8	108.6	-173.3	175.8	0	0	0	0	111.3	C929 Y930 D935 T936 A937	C929-S933 PolarHBondContact O-N 3.08Å; Y930-S933 PolarHBondContact O-N 3.33Å; S933-D935 PolarHBondContact O-N 3.36Å; S933-T936 VanDerWaalsContact CB-OG1 3.23Å; S933-T936 WeakPolarHBondContact CB-OG1 3.46Å; S933-T936 PolarHBondContact O-N 2.68Å; S933-T936 VanDerWaalsContact O-N 3.14Å; S933-T936 WeakPolarHBondContact OG-CB 3.38Å; S933-T936 PolarHBondContact OG-N 2.67Å; S933-T936 VanDerWaalsContact OG-N 3.1Å; S933-T936 PolarHBondContact OG-OG1 3.25Å; S933-A937 PolarHBondContact O-N 3.29Å
934	E	93.4	Very high	89	Confident	64 Å²	64	25 Å²	25	30%	0.299	12%	0.124	S	C	.	.	H	α-helix	trans	-61.5	-33.3	174.2	-48.6	103.3	122.4	0	0	111.5	V458 L462 Y808 Q932 L938	V458-E934 HydrophobicContact CG1-CB 4.16Å; V458-E934 HydrophobicContact CG1-CG 3.96Å; L462-E934 HydrophobicContact CD1-CB 4.35Å; L462-E934 WeakPolarHBondContact CD1-O 3.4Å; L462-E934 HydrophobicContact CD2-CB 4.41Å; Y808-E934 HydrophobicContact CD1-CB 3.54Å; Y808-E934 HydrophobicContact CD1-CG 4.2Å; Y808-E934 HydrophobicContact CD2-CB 4.23Å; Y808-E934 HydrophobicContact CE1-CB 3.79Å; Y808-E934 HydrophobicContact CE1-CG 3.9Å; Y808-E934 WeakPolarHBondContact CE1-OE1 3.2Å; Y808-E934 HydrophobicContact CE2-CB 4.46Å; Y808-E934 HydrophobicContact CE2-CG 4.45Å; Y808-E934 HydrophobicContact CG-CB 3.74Å; Y808-E934 PolarHBondContact OH-OE1 3.23Å; Q932-E934 PolarHBondContact O-N 3.04Å; E934-L938 WeakPolarHBondContact O-CB 3.19Å; E934-L938 PolarHBondContact O-N 2.82Å
935	D	92.9	Very high	90.3	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.011	11%	0.105	C	C	.	.	H	α-helix	trans	-63.1	-40.9	175.6	-62.1	-23.5	0	0	0	111.6	I805 H807 Y808 R813 L909 S933 L939	I805-D935 HydrophobicContact CG2-CB 4.14Å; H807-D935 VanDerWaalsContact CA-OD1 3.22Å; H807-D935 WeakPolarHBondContact CA-OD1 3.46Å; H807-D935 IonicContact CD2-OD1 2.71Å; H807-D935 PolarHBondContact CD2-OD1 3.17Å; H807-D935 VanDerWaalsContact CD2-OD1 3.28Å; H807-D935 IonicContact CD2-OD2 2.92Å; H807-D935 IonicContact CG-OD1 3.57Å; Y808-D935 WeakPolarHBondContact CD1-OD1 3.33Å; Y808-D935 PolarHBondContact N-OD1 2.83Å; R813-D935 IonicContact CZ-OD2 3.49Å; R813-D935 IonicContact NE-OD2 2.81Å; R813-D935 IonicContact NH2-OD2 3.34Å; R813-D935 PolarHBondContact NH2-OD2 2.82Å; L909-D935 HydrophobicContact CD2-CB 3.76Å; S933-D935 PolarHBondContact O-N 3.36Å; D935-L939 PolarHBondContact O-N 3.21Å
936	T	95.1	Very high	91.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-70.4	-49.7	176.3	-57.1	0	0	0	0	111.2	F455 L748 I779 S933 L938 L939 L940	F455-T936 HydrophobicContact CE2-CG2 4.27Å; F455-T936 HydrophobicContact CZ-CG2 4.49Å; L748-T936 HydrophobicContact CD2-CG2 4.02Å; I779-T936 HydrophobicContact CG2-CG2 4.33Å; S933-T936 VanDerWaalsContact CB-OG1 3.23Å; S933-T936 WeakPolarHBondContact CB-OG1 3.46Å; S933-T936 PolarHBondContact O-N 2.68Å; S933-T936 VanDerWaalsContact O-N 3.14Å; S933-T936 WeakPolarHBondContact OG-CB 3.38Å; S933-T936 PolarHBondContact OG-N 2.67Å; S933-T936 VanDerWaalsContact OG-N 3.1Å; S933-T936 PolarHBondContact OG-OG1 3.25Å; T936-L938 VanDerWaalsContact C-N 3.32Å; T936-L938 PolarHBondContact O-N 3.06Å; T936-L939 WeakPolarHBondContact O-CB 3.36Å; T936-L939 PolarHBondContact O-N 2.93Å; T936-L939 VanDerWaalsContact O-N 3.14Å; T936-L940 HydrophobicContact CG2-CD1 4.16Å; T936-L940 WeakPolarHBondContact O-CD1 3.3Å; T936-L940 PolarHBondContact O-N 3.43Å; T936-L940 VanDerWaalsContact O-N 3.07Å
937	A	96	Very high	91.5	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.008	13%	0.128	C	C	.	.	H	α-helix	trans	-60.4	-41.2	179.8	0	0	0	0	0	111.9	F455 V458 L462 S933 L939 L940 L941	F455-A937 HydrophobicContact CE1-CB 4.25Å; F455-A937 HydrophobicContact CE2-CB 3.93Å; F455-A937 HydrophobicContact CZ-CB 3.76Å; V458-A937 HydrophobicContact CG1-CB 3.78Å; L462-A937 HydrophobicContact CD1-CB 3.62Å; S933-A937 PolarHBondContact O-N 3.29Å; A937-L939 VanDerWaalsContact C-N 3.33Å; A937-L939 PolarHBondContact O-N 3.14Å; A937-L940 PolarHBondContact O-N 2.8Å; A937-L941 WeakPolarHBondContact O-CG 3.17Å; A937-L941 PolarHBondContact O-N 2.66Å
938	L	95	Very high	91.6	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-67.3	-32.3	176.9	-173.7	61.5	0	0	0	112.5	L462 H466 F467 E934 T936 K942	L462-L938 HydrophobicContact CD1-CB 4Å; L462-L938 HydrophobicContact CD2-CB 4.32Å; L462-L938 HydrophobicContact CD2-CD1 4.47Å; H466-L938 HydrophobicContact CB-CD1 3.97Å; F467-L938 HydrophobicContact CE2-CD1 4.12Å; E934-L938 WeakPolarHBondContact O-CB 3.19Å; E934-L938 PolarHBondContact O-N 2.82Å; T936-L938 VanDerWaalsContact C-N 3.32Å; T936-L938 PolarHBondContact O-N 3.06Å; L938-K942 HydrophobicContact CG-CD 4.2Å; L938-K942 WeakPolarHBondContact O-CB 3.46Å; L938-K942 WeakPolarHBondContact O-CD 3.46Å; L938-K942 WeakPolarHBondContact O-CG 3.36Å; L938-K942 PolarHBondContact O-N 3.2Å
939	L	95	Very high	92	Very high	14 Å²	14	30.4 Å²	30.4	7%	0.073	17%	0.171	C	C	.	.	H	α-helix	trans	-66.2	-45.8	173.5	179	61.4	0	0	0	111.4	I779 I805 F907 D935 T936 A937 L941 K942 E943	I779-L939 HydrophobicContact CD1-CD2 3.71Å; I779-L939 HydrophobicContact CD1-CG 4.45Å; I779-L939 HydrophobicContact CG1-CD2 3.85Å; I805-L939 HydrophobicContact CD1-CD2 3.68Å; I805-L939 HydrophobicContact CG1-CD2 3.99Å; F907-L939 HydrophobicContact CB-CD2 4.14Å; F907-L939 HydrophobicContact CD1-CD1 4.47Å; F907-L939 HydrophobicContact CD1-CD2 4.13Å; F907-L939 HydrophobicContact CG-CD2 4.16Å; D935-L939 PolarHBondContact O-N 3.21Å; T936-L939 WeakPolarHBondContact O-CB 3.36Å; T936-L939 PolarHBondContact O-N 2.93Å; T936-L939 VanDerWaalsContact O-N 3.14Å; A937-L939 VanDerWaalsContact C-N 3.33Å; A937-L939 PolarHBondContact O-N 3.14Å; L939-L941 PolarHBondContact O-N 3.24Å; L939-K942 PolarHBondContact O-N 3.18Å; L939-E943 HydrophobicContact CD1-CG 4.13Å; L939-E943 PolarHBondContact O-N 3.26Å
940	L	97.1	Very high	92.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60	-46.7	175.9	-92	70	0	0	0	111.2	F455 F481 F746 I779 T936 A937 K942 E943 I944	F455-L940 HydrophobicContact CE1-CD2 4.2Å; F455-L940 HydrophobicContact CZ-CD2 4.04Å; F481-L940 HydrophobicContact CE1-CD2 4.46Å; F746-L940 HydrophobicContact CB-CD1 4.29Å; F746-L940 HydrophobicContact CB-CD2 4.39Å; F746-L940 HydrophobicContact CB-CG 4.39Å; F746-L940 HydrophobicContact CD1-CD1 3.77Å; F746-L940 HydrophobicContact CD1-CG 3.75Å; F746-L940 HydrophobicContact CD2-CD2 3.93Å; F746-L940 HydrophobicContact CD2-CG 3.84Å; F746-L940 HydrophobicContact CE1-CD1 4.22Å; F746-L940 HydrophobicContact CE1-CG 3.89Å; F746-L940 HydrophobicContact CE2-CD2 4.32Å; F746-L940 HydrophobicContact CE2-CG 3.95Å; F746-L940 HydrophobicContact CG-CD1 3.97Å; F746-L940 HydrophobicContact CG-CD2 4.05Å; F746-L940 HydrophobicContact CG-CG 3.72Å; F746-L940 HydrophobicContact CZ-CB 4.48Å; F746-L940 HydrophobicContact CZ-CG 3.98Å; I779-L940 HydrophobicContact CD1-CD1 3.7Å; T936-L940 HydrophobicContact CG2-CD1 4.16Å; T936-L940 WeakPolarHBondContact O-CD1 3.3Å; T936-L940 PolarHBondContact O-N 3.43Å; T936-L940 VanDerWaalsContact O-N 3.07Å; A937-L940 PolarHBondContact O-N 2.8Å; L940-K942 PolarHBondContact O-N 3.36Å; L940-E943 PolarHBondContact O-N 3.4Å; L940-I944 VanDerWaalsContact O-CB 3.32Å; L940-I944 WeakPolarHBondContact O-CB 3.45Å; L940-I944 VanDerWaalsContact O-CG1 3.24Å; L940-I944 WeakPolarHBondContact O-CG1 3.35Å; L940-I944 PolarHBondContact O-N 3.14Å
941	L	96.3	Very high	92.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.8	-43.7	176.2	-70.8	175.1	0	0	0	112.5	S459 L462 L463 F467 V479 A937 L939 Y945	S459-L941 WeakPolarHBondContact OG-CD2 3.44Å; L462-L941 HydrophobicContact CB-CD1 3.77Å; L462-L941 HydrophobicContact CD1-CD1 4.48Å; L463-L941 HydrophobicContact CD2-CD2 4.38Å; L463-L941 HydrophobicContact CG-CD1 4.3Å; L463-L941 HydrophobicContact CG-CD2 4.37Å; F467-L941 HydrophobicContact CE2-CB 4.03Å; F467-L941 HydrophobicContact CZ-CB 4.3Å; V479-L941 HydrophobicContact CB-CD2 4.36Å; V479-L941 HydrophobicContact CG2-CD2 3.73Å; A937-L941 WeakPolarHBondContact O-CG 3.17Å; A937-L941 PolarHBondContact O-N 2.66Å; L939-L941 PolarHBondContact O-N 3.24Å; L941-Y945 HydrophobicContact CD2-CD2 4.5Å; L941-Y945 HydrophobicContact CD2-CE2 3.92Å; L941-Y945 VanDerWaalsContact O-CD2 3.28Å; L941-Y945 WeakPolarHBondContact O-CD2 3.39Å; L941-Y945 PolarHBondContact O-N 3.42Å
942	K	94.4	Very high	92.1	Very high	53 Å²	53	38.4 Å²	38.4	23%	0.23	21%	0.21	C	C	.	.	H	α-helix	trans	-57.9	-53.7	175.9	-80.8	164.5	-179.5	162.9	0	111.6	L938 L939 L940 I944 K946 P952	L938-K942 HydrophobicContact CG-CD 4.2Å; L938-K942 WeakPolarHBondContact O-CB 3.46Å; L938-K942 WeakPolarHBondContact O-CD 3.46Å; L938-K942 WeakPolarHBondContact O-CG 3.36Å; L938-K942 PolarHBondContact O-N 3.2Å; L939-K942 PolarHBondContact O-N 3.18Å; L940-K942 PolarHBondContact O-N 3.36Å; K942-I944 VanDerWaalsContact C-N 3.32Å; K942-I944 PolarHBondContact O-N 2.9Å; K942-K946 WeakPolarHBondContact O-CB 3.19Å; K942-K946 PolarHBondContact O-N 3.13Å; K942-P952 HydrophobicContact CD-CG 4.4Å; K942-P952 HydrophobicContact CG-CG 3.89Å
943	E	95.1	Very high	91.9	Very high	31 Å²	31	37.3 Å²	37.3	15%	0.145	21%	0.205	C	C	.	.	H	α-helix	trans	-74.6	-21.6	-175	-66.1	-62.7	126.9	0	0	113.1	N744 F746 F777 L939 L940 K946	N744-E943 PolarHBondContact ND2-O 3.06Å; F746-E943 HydrophobicContact CE1-CB 4.18Å; F746-E943 HydrophobicContact CZ-CB 4.36Å; F777-E943 HydrophobicContact CD1-CG 4.34Å; F777-E943 HydrophobicContact CE1-CB 4.2Å; F777-E943 HydrophobicContact CE1-CG 3.65Å; F777-E943 WeakPolarHBondContact CE1-OE2 3.5Å; F777-E943 HydrophobicContact CE2-CB 4.46Å; F777-E943 HydrophobicContact CZ-CB 3.94Å; F777-E943 HydrophobicContact CZ-CG 3.9Å; F777-E943 VanDerWaalsContact CZ-OE2 3.32Å; F777-E943 WeakPolarHBondContact CZ-OE2 3.38Å; L939-E943 HydrophobicContact CD1-CG 4.13Å; L939-E943 PolarHBondContact O-N 3.26Å; L940-E943 PolarHBondContact O-N 3.4Å; E943-K946 VanDerWaalsContact OE1-CD 3.31Å; E943-K946 WeakPolarHBondContact OE1-CD 3.11Å; E943-K946 IonicContact OE1-NZ 3.4Å; E943-K946 PolarHBondContact OE1-NZ 2.8Å; E943-K946 WeakPolarHBondContact OE2-CD 3.19Å; E943-K946 IonicContact OE2-NZ 3.46Å; E943-K946 PolarHBondContact OE2-NZ 2.59Å
944	I	95.8	Very high	90.8	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-69.4	-62.4	166.4	-74.3	168.2	0	0	0	110.5	H429 V431 V479 F746 L940 K942 K946 T947	H429-I944 HydrophobicContact CB-CG2 3.63Å; V431-I944 HydrophobicContact CG2-CD1 3.84Å; V479-I944 HydrophobicContact CG1-CD1 3.99Å; V479-I944 HydrophobicContact CG2-CD1 4.3Å; V479-I944 HydrophobicContact CG2-CG2 4.07Å; F746-I944 HydrophobicContact CE2-CD1 4.39Å; F746-I944 HydrophobicContact CE2-CG1 4.33Å; F746-I944 HydrophobicContact CZ-CG1 4.23Å; L940-I944 VanDerWaalsContact O-CB 3.32Å; L940-I944 WeakPolarHBondContact O-CB 3.45Å; L940-I944 VanDerWaalsContact O-CG1 3.24Å; L940-I944 WeakPolarHBondContact O-CG1 3.35Å; L940-I944 PolarHBondContact O-N 3.14Å; K942-I944 VanDerWaalsContact C-N 3.32Å; K942-I944 PolarHBondContact O-N 2.9Å; I944-K946 VanDerWaalsContact C-N 3.27Å; I944-K946 PolarHBondContact O-N 3.34Å; I944-T947 WeakPolarHBondContact O-CB 3.46Å; I944-T947 PolarHBondContact O-N 3.08Å; I944-T947 PolarHBondContact O-OG1 2.97Å
945	Y	94.9	Very high	89.3	Confident	4 Å²	4	42.8 Å²	42.8	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-69.7	-22.8	-172.5	-73.2	-63.2	0	0	0	114.2	D428 L463 F467 I476 V479 L941 T947 V948 G949 I950	D428-Y945 HydrophobicContact CB-CE1 4.07Å; D428-Y945 PolarHBondContact OD2-OH 2.98Å; L463-Y945 HydrophobicContact CD2-CE2 3.64Å; F467-Y945 HydrophobicContact CE1-CD2 4.13Å; F467-Y945 HydrophobicContact CE1-CG 4.46Å; F467-Y945 HydrophobicContact CZ-CD2 4.22Å; I476-Y945 HydrophobicContact CB-CD1 4.5Å; I476-Y945 HydrophobicContact CB-CE1 3.83Å; I476-Y945 HydrophobicContact CD1-CE1 4.39Å; I476-Y945 HydrophobicContact CD1-CE2 4.37Å; I476-Y945 HydrophobicContact CG2-CD1 3.68Å; I476-Y945 HydrophobicContact CG2-CE1 3.47Å; I476-Y945 VanDerWaalsContact CG2-CE1 3.47Å; V479-Y945 HydrophobicContact CG2-CE2 3.96Å; L941-Y945 HydrophobicContact CD2-CD2 4.5Å; L941-Y945 HydrophobicContact CD2-CE2 3.92Å; L941-Y945 VanDerWaalsContact O-CD2 3.28Å; L941-Y945 WeakPolarHBondContact O-CD2 3.39Å; L941-Y945 PolarHBondContact O-N 3.42Å; Y945-T947 PolarHBondContact O-N 3.09Å; Y945-V948 HydrophobicContact CD1-CG2 4.08Å; Y945-V948 CarbonylContact O-C 3.58Å; Y945-V948 WeakPolarHBondContact O-CG2 3.34Å; Y945-V948 PolarHBondContact O-N 3.21Å; Y945-G949 PolarHBondContact O-N 3.37Å; Y945-I950 CarbonylContact C-O 3.22Å; Y945-I950 PolarHBondContact O-N 3.37Å
946	K	91.3	Very high	87.1	Confident	96 Å²	96	47.6 Å²	47.6	42%	0.417	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-55.7	-30.5	168.1	176.2	-174.7	-179.4	-173.1	0	112.9	K942 E943 I944 V948 G949 I950	K942-K946 WeakPolarHBondContact O-CB 3.19Å; K942-K946 PolarHBondContact O-N 3.13Å; E943-K946 VanDerWaalsContact OE1-CD 3.31Å; E943-K946 WeakPolarHBondContact OE1-CD 3.11Å; E943-K946 IonicContact OE1-NZ 3.4Å; E943-K946 PolarHBondContact OE1-NZ 2.8Å; E943-K946 WeakPolarHBondContact OE2-CD 3.19Å; E943-K946 IonicContact OE2-NZ 3.46Å; E943-K946 PolarHBondContact OE2-NZ 2.59Å; I944-K946 VanDerWaalsContact C-N 3.27Å; I944-K946 PolarHBondContact O-N 3.34Å; K946-V948 VanDerWaalsContact C-N 3.29Å; K946-V948 PolarHBondContact O-N 3.37Å; K946-G949 PolarHBondContact O-N 3.2Å; K946-G949 VanDerWaalsContact O-N 3.16Å; K946-I950 PolarHBondContact N-O 2.58Å
947	T	85.8	Confident	84.5	Confident	75 Å²	75	56.7 Å²	56.7	46%	0.46	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-68.8	-26.8	176.8	67.8	0	0	0	0	113.2	V743 I944 Y945	V743-T947 HydrophobicContact CG1-CG2 3.97Å; I944-T947 WeakPolarHBondContact O-CB 3.46Å; I944-T947 PolarHBondContact O-N 3.08Å; I944-T947 PolarHBondContact O-OG1 2.97Å; Y945-T947 PolarHBondContact O-N 3.09Å
948	V	86.9	Confident	83.9	Confident	98 Å²	98	59.5 Å²	59.5	59%	0.594	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-98.8	12.6	172.9	-60.4	0	0	0	0	112.8	Y945 K946 I950	Y945-V948 HydrophobicContact CD1-CG2 4.08Å; Y945-V948 CarbonylContact O-C 3.58Å; Y945-V948 WeakPolarHBondContact O-CG2 3.34Å; Y945-V948 PolarHBondContact O-N 3.21Å; K946-V948 VanDerWaalsContact C-N 3.29Å; K946-V948 PolarHBondContact O-N 3.37Å; V948-I950 VanDerWaalsContact C-N 3.32Å; V948-I950 HydrophobicContact CG2-CB 4.28Å; V948-I950 HydrophobicContact CG2-CD1 4.11Å; V948-I950 HydrophobicContact CG2-CG1 4.17Å; V948-I950 PolarHBondContact O-N 3.32Å
949	G	89.2	Confident	83.3	Confident	56 Å²	56	62.5 Å²	62.5	58%	0.577	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	13.8	177.4	0	0	0	0	0	115.2	Y945 K946	Y945-G949 PolarHBondContact O-N 3.37Å; K946-G949 PolarHBondContact O-N 3.2Å; K946-G949 VanDerWaalsContact O-N 3.16Å
950	I	90.3	Very high	82.6	Confident	33 Å²	33	65.2 Å²	65.2	17%	0.169	37%	0.372	C	S	.	.			trans	-99.4	139.2	-179.3	-65.3	178.1	0	0	0	109.6	F467 A475 I476 Y945 K946 V948	F467-I950 HydrophobicContact CD1-CG2 4.11Å; F467-I950 HydrophobicContact CE1-CG2 4.46Å; A475-I950 HydrophobicContact CB-CD1 4.42Å; I476-I950 HydrophobicContact CG2-CD1 3.47Å; I476-I950 VanDerWaalsContact CG2-CD1 3.47Å; I476-I950 HydrophobicContact CG2-CG2 4.4Å; Y945-I950 CarbonylContact C-O 3.22Å; Y945-I950 PolarHBondContact O-N 3.37Å; K946-I950 PolarHBondContact N-O 2.58Å; V948-I950 VanDerWaalsContact C-N 3.32Å; V948-I950 HydrophobicContact CG2-CB 4.28Å; V948-I950 HydrophobicContact CG2-CD1 4.11Å; V948-I950 HydrophobicContact CG2-CG1 4.17Å; V948-I950 PolarHBondContact O-N 3.32Å
951	H	87.4	Confident	81.8	Confident	123 Å²	123	69 Å²	69	57%	0.569	39%	0.394	S	S	*	.			trans	-131.6	148.6	-173.2	-64.6	-18.9	0	0	0	110.4
952	P	85.5	Confident	80.9	Confident	43 Å²	43	73.3 Å²	73.3	28%	0.279	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-68	147	177.9	31.3	-38.2	0	0	0	111.3	H466 F467 K942	H466-P952 HydrophobicContact CB-CB 4.16Å; H466-P952 CarbonylContact O-C 3.54Å; H466-P952 WeakPolarHBondContact O-CA 3.28Å; F467-P952 HydrophobicContact CD1-CB 4.49Å; F467-P952 HydrophobicContact CE1-CB 4.02Å; F467-P952 HydrophobicContact CE2-CB 4.18Å; F467-P952 HydrophobicContact CZ-CB 3.86Å; F467-P952 HydrophobicContact CZ-CG 4.42Å; K942-P952 HydrophobicContact CD-CG 4.4Å; K942-P952 HydrophobicContact CG-CG 3.89Å
953	E	81.6	Confident	80	Confident	74 Å²	74	74.7 Å²	74.7	35%	0.346	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-70.6	141.4	173.7	-71.5	162	-104.9	0	0	111.1	H466 F467 K468 K469 L955	H466-E953 PolarHBondContact O-N 3.25Å; F467-E953 VanDerWaalsContact C-OE1 3.28Å; K468-E953 PolarHBondContact N-OE1 3.12Å; K469-E953 VanDerWaalsContact CB-OE1 3.32Å; K469-E953 WeakPolarHBondContact CB-OE1 3.5Å; K469-E953 PolarHBondContact N-OE1 3.44Å; E953-L955 PolarHBondContact O-N 3.12Å
954	P	67.2	Low	78.9	Confident	123 Å²	123	77.8 Å²	77.8	80%	0.799	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-68.2	121.5	167.4	29.1	-32.1	0	0	0	108.8	A956	P954-A956 PolarHBondContact O-N 3.26Å
955	L	62.3	Low	77.6	Confident	68 Å²	68	83.6 Å²	83.6	36%	0.356	49%	0.486	S	S	.	.			trans	-57.6	115	174.9	-73	173.5	0	0	0	109.9	E953 H957	E953-L955 PolarHBondContact O-N 3.12Å; L955-H957 PolarHBondContact O-N 3.44Å
956	A	47.4	Very low	76.2	Confident	103 Å²	103	90.3 Å²	90.3	85%	0.851	53%	0.525	S	S	*	.			trans	-64.6	132.4	170.1	0	0	0	0	0	109.7	P954	P954-A956 PolarHBondContact O-N 3.26Å
957	H	39.3	Very low	74.8	Confident	191 Å²	191	89.7 Å²	89.7	88%	0.884	54%	0.535	S	S	*	.			trans	-106.9	0	178.5	-76.6	-34.1	0	0	0	111	R811 L955	R811-H957 PolarHBondContact NE-NE2 2.93Å; R811-H957 VanDerWaalsContact NE-NE2 3.13Å; R811-H957 PolarHBondContact NH2-CD2 3.34Å; R811-H957 PolarHBondContact NH2-NE2 3.36Å; L955-H957 PolarHBondContact O-N 3.44Å

Retrieved 957 of 957 residues in 188.3 ms (Link to these results)

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