A0A087YL56_POEFO Loading...

Follistatin-like 5

AlphaFold DB , UniProt , Accession A0A087YL56, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 859 aa.

						>A0A087YL56_POEFO|A0A087YL56
MLYVCPHRKRPMKTADWWWVAILMVGISGLGATGRPDKEGFGSQTYRPVVKFRHKDGIPASLRVKGFMGHSSYPGPCEHKYCGLGRHCVINHETDQGECRCLDHCKPHYKPVCGSDGKLYQNHCELHRASCLRGHRITIMHSEECFYKDDDCRLNDYRRLKTKILDLHDKRYLGAAGHGAHKDSMAAKKQLVDLMFKRFDVDRNRLIDASELSQVIKHEGLSKDVSECTLFDLLKYNDINDDEHLTREEFYTAFDVYLLNLPDEQKVSVTTVTVGQSAVMTCAITGERRPPILWKRNNQYLNSLNLEDLNDFGDDGSLYVTKVTTTHMGNYTCHADGYDKLFQTHILQVNVPPVIRVYPDSQAREPGVTASLRCHAEGIPSPQLSWLKNGMDIKTKLSKQLTLQANGSEVHISNVHFEDTGAYTCIAKNEAGVDEDISSLFVEDSARKTLANILWREEGLGIGNMFYVFYEDGIKVIQPVACEIQRHIKPSEKLLALQEEVCPTSPGEVVQRCVWSSAVNVKDKFIYVTQPTLGRVLIVDIQTQKAVQTVGTDPYPVKLHYDKSHDQVWVLSWGDVEKNFPTLQVINQASGKVSHHTVHTQPVGRHFDRVEDFFIPASSLIVNHVRFGLIFHQNEPVIYKINLETTSYVKNISLWEFNCIPKSVAYTHVGGYYFVNCRPDSTGATQPQLILDSVTDSVIGQNRDVTGTPYMSPDGLYLVTVDDVNGLMRIQTISERGKIQEPFDIHTNLHLSDLAFQRSFTEIHQYNVFGSSGRQTDALFVELSTSKVKMIKSLKEAIKSFDWPWSSRNRVMVSSGLFGQYIMTPSRESLFILDGRLNKLNCEITDVLKGNVVVWVGDS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.5	Very low	34.1	Very low	237 Å²	237	173.9 Å²	173.9	100%	1.167	84%	0.841	S	S	*	*				0	135.9	0	-64.8	174.1	178.9	0	0	107
2	L	30.4	Very low	33.4	Very low	164 Å²	164	173.3 Å²	173.3	86%	0.859	84%	0.839	S	S	*	*			cis	-122	169.1	-1.7	-76.8	97.1	0	0	0	111.6
3	Y	30.5	Very low	33.6	Very low	222 Å²	222	174.4 Å²	174.4	87%	0.871	84%	0.837	S	S	*	*			trans	-73.7	169.9	166.5	-85.5	-105.7	0	0	0	110.3
4	V	29.3	Very low	33.5	Very low	141 Å²	141	171.8 Å²	171.8	86%	0.855	84%	0.838	S	S	*	*				-164.8	157.2	65.4	163.6	0	0	0	0	111.7
5	C	26.7	Very low	33.4	Very low	110 Å²	110	165.5 Å²	165.5	74%	0.743	83%	0.825	S	S	*	*			trans	-130.5	-179	175.2	-139.6	0	0	0	0	107.8
6	P	57.9	Low	33.1	Very low	100 Å²	100	164.4 Å²	164.4	65%	0.649	82%	0.822	S	S	*	*			cis	-148.6	-177.6	8.2	40.8	-18	0	0	0	119.1
7	H	32.3	Very low	32.9	Very low	153 Å²	153	167.2 Å²	167.2	71%	0.708	82%	0.821	S	S	*	*			trans	87.7	122.7	132.8	-93.4	-19.9	0	0	0	126.7
8	R	29.3	Very low	32.7	Very low	222 Å²	222	166.7 Å²	166.7	84%	0.838	81%	0.809	S	S	*	*			trans	78.8	138.3	130.1	-94	176.2	168.6	168.7	-1.8	122.5
9	K	28.1	Very low	32.6	Very low	210 Å²	210	168.4 Å²	168.4	91%	0.913	81%	0.806	S	S	*	*			trans	-126.2	164.4	164.8	-75.2	-176.2	174.8	179.9	0	110.9
10	R	29.8	Very low	32.5	Very low	241 Å²	241	165.5 Å²	165.5	91%	0.909	80%	0.799	S	S	*	*			trans	-110.2	-178.1	171.3	-75.8	-176.9	176	-175.4	-0.3	109.2
11	P	50.9	Low	32.3	Very low	113 Å²	113	162 Å²	162	73%	0.734	80%	0.798	S	S	*	*			cis	-121.9	-144.4	4.7	32.6	-7.2	0	0	0	111.5
12	M	25.9	Very low	32.5	Very low	166 Å²	166	157.5 Å²	157.5	82%	0.818	78%	0.777	S	S	*	*			cis	-157.7	-173.9	1.1	-149.1	143.9	80.5	0	0	112.3
13	K	36	Very low	32.4	Very low	188 Å²	188	156.7 Å²	156.7	82%	0.817	77%	0.773	S	S	*	*			trans	-156.3	158	169.3	-74.8	-170.8	174.4	-172.2	0	110
14	T	31.9	Very low	32.4	Very low	138 Å²	138	153.8 Å²	153.8	85%	0.847	77%	0.769	S	S	*	*			trans	146.6	151.1	153.4	44.4	0	0	0	0	111.1
15	A	32.9	Very low	32.5	Very low	78 Å²	78	152.7 Å²	152.7	65%	0.645	76%	0.762	S	S	*	*			cis	-166	-152.5	-13.5	0	0	0	0	0	111
16	D	27.8	Very low	32.6	Very low	147 Å²	147	150.7 Å²	150.7	79%	0.786	76%	0.76	S	S	*	*			trans	77.6	140.9	169.2	-47.6	-25.5	0	0	0	118.3
17	W	30.1	Very low	31.4	Very low	212 Å²	212	153.5 Å²	153.5	80%	0.803	77%	0.768	S	S	*	*			cis	83.5	138.2	16.8	-70.6	43.4	0	0	0	116.3
18	W	29.9	Very low	31.3	Very low	159 Å²	159	151.8 Å²	151.8	60%	0.602	77%	0.774	S	S	*	*			cis	-165.9	140.4	-6.6	-126	45.7	0	0	0	112.3
19	W	29.6	Very low	31.2	Very low	198 Å²	198	144.4 Å²	144.4	75%	0.75	77%	0.767	S	S	*	*			trans	62.6	177	152.5	-64.2	41.1	0	0	0	118.7
20	V	30.9	Very low	31.3	Very low	111 Å²	111	143.5 Å²	143.5	67%	0.673	77%	0.77	S	S	*	*			cis	-153	148.2	18.5	177.4	0	0	0	0	112.6	I22	V20-I22 HydrophobicContact CG1-CD1 3.95Å; V20-I22 HydrophobicContact CG1-CG1 4.43Å
21	A	29.4	Very low	31.1	Very low	93 Å²	93	135.7 Å²	135.7	77%	0.769	77%	0.765	S	S	*	*			trans	161.5	126.7	136.4	0	0	0	0	0	111.6
22	I	31.9	Very low	30	Very low	141 Å²	141	135.2 Å²	135.2	72%	0.723	77%	0.771	S	S	*	*				84.7	100.5	50.2	-65.8	172.9	0	0	0	111.7	V20	V20-I22 HydrophobicContact CG1-CD1 3.95Å; V20-I22 HydrophobicContact CG1-CG1 4.43Å
23	L	29.1	Very low	30.2	Very low	148 Å²	148	134.4 Å²	134.4	78%	0.775	78%	0.776	S	S	*	*				68.7	146.8	81.4	-80.8	169.2	0	0	0	114.2
24	M	31	Very low	29.7	Very low	161 Å²	161	129 Å²	129	79%	0.793	77%	0.773	S	S	*	*			cis	-129	-166.1	7.8	-104.7	-71.3	-158.7	0	0	109.1
25	V	31.4	Very low	29.6	Very low	118 Å²	118	134.3 Å²	134.3	72%	0.715	78%	0.777	S	S	*	*			cis	-142	139.8	12.9	175.1	0	0	0	0	107.6	I27	V25-I27 HydrophobicContact CG1-CD1 4.41Å
26	G	28.3	Very low	29.5	Very low	68 Å²	68	136 Å²	136	70%	0.701	78%	0.782	S	S	*	*				68.7	-173.9	105.7	0	0	0	0	0	115.9
27	I	32.7	Very low	29.4	Very low	158 Å²	158	136.4 Å²	136.4	81%	0.81	78%	0.784	S	S	*	*			cis	-170	143	-24.2	-99.7	161.2	0	0	0	104.7	V25	V25-I27 HydrophobicContact CG1-CD1 4.41Å
28	S	30.8	Very low	29.4	Very low	118 Å²	118	136.2 Å²	136.2	83%	0.825	79%	0.789	S	S	*	*			cis	-165.5	171.4	-20.4	66.7	0	0	0	0	107
29	G	27.1	Very low	29.2	Very low	67 Å²	67	137.7 Å²	137.7	69%	0.691	80%	0.803	S	S	*	*			cis	174.4	-172.6	4.1	0	0	0	0	0	112.6
30	L	29.7	Very low	29.1	Very low	190 Å²	190	131.9 Å²	131.9	100%	0.995	80%	0.804	S	S	*	*			trans	58.5	117.6	170.2	-63.2	173	0	0	0	119.5
31	G	25.9	Very low	28.8	Very low	77 Å²	77	136.8 Å²	136.8	79%	0.794	82%	0.817	S	S	*	*			trans	174.7	128	167.3	0	0	0	0	0	113.1
32	A	27.4	Very low	28.7	Very low	104 Å²	104	135.7 Å²	135.7	86%	0.86	82%	0.815	S	S	*	*			trans	-55.7	162.7	-164.5	0	0	0	0	0	119
33	T	29.7	Very low	28.3	Very low	149 Å²	149	135 Å²	135	91%	0.914	82%	0.823	S	S	*	*			trans	-49.8	135.5	177	46.6	0	0	0	0	116.6
34	G	26.5	Very low	28.3	Very low	74 Å²	74	137 Å²	137	76%	0.763	83%	0.828	S	S	*	*			trans	175.3	121.7	159.6	0	0	0	0	0	111.9
35	R	28.9	Very low	27.9	Very low	249 Å²	249	136 Å²	136	94%	0.94	83%	0.831	S	S	*	*			trans	-145.9	152.8	169.8	-93.4	-163.3	171.7	-176.8	-2.5	111.7
36	P	32.2	Very low	27.6	Very low	115 Å²	115	141.1 Å²	141.1	75%	0.747	84%	0.839	S	S	*	*			trans	-116.9	-172.3	-154.2	41.9	-29	0	0	0	113.7
37	D	25.8	Very low	27.4	Very low	155 Å²	155	149.3 Å²	149.3	83%	0.829	85%	0.849	S	S	*	*			trans	-60.7	163.2	-172	-53.6	-86	0	0	0	116.4
38	K	29	Very low	27.1	Very low	207 Å²	207	147 Å²	147	90%	0.9	84%	0.844	S	S	*	*			trans	-136.3	121.9	158.3	-81.2	-167.7	170.8	-169.5	0	109.6
39	E	26.9	Very low	26.8	Very low	191 Å²	191	148.1 Å²	148.1	89%	0.893	85%	0.846	S	S	*	*			trans	-68.2	155.3	167	-60.9	179	122.5	0	0	111
40	G	25.8	Very low	26.7	Very low	75 Å²	75	150.9 Å²	150.9	77%	0.773	85%	0.849	S	S	*	*			trans	-160	96.9	176.3	0	0	0	0	0	111.8
41	F	25	Very low	26.5	Very low	214 Å²	214	150.8 Å²	150.8	94%	0.939	84%	0.84	S	S	*	*			trans	-79.7	116.6	170.6	-95.5	-93.7	0	0	0	110.4
42	G	27	Very low	26.4	Very low	71 Å²	71	157.3 Å²	157.3	73%	0.732	85%	0.847	S	S	*	*			trans	-104.8	125.6	172.4	0	0	0	0	0	111.1
43	S	24.7	Very low	26.2	Very low	127 Å²	127	162.5 Å²	162.5	89%	0.888	84%	0.844	S	S	*	*			trans	-67.9	149.5	177.2	-177.1	0	0	0	0	112.2
44	Q	27.6	Very low	26	Very low	188 Å²	188	163.2 Å²	163.2	88%	0.879	84%	0.837	S	S	*	*			trans	-126.9	142.2	174.4	-136.1	178.5	23.1	0	0	111.7
45	T	24.5	Very low	25.9	Very low	141 Å²	141	167.3 Å²	167.3	87%	0.865	83%	0.834	S	S	*	*			trans	-94.8	139.3	-163.8	8.8	0	0	0	0	113.9
46	Y	23.8	Very low	25.8	Very low	226 Å²	226	161.9 Å²	161.9	89%	0.886	82%	0.824	S	S	*	*			trans	-86.3	137.4	174.2	-123.4	-106.9	0	0	0	112.1
47	R	25.5	Very low	25.5	Very low	239 Å²	239	159.6 Å²	159.6	90%	0.902	82%	0.821	S	S	*	*			trans	-154	161.4	156.9	-99.6	-160.8	175.9	-179.3	-1.9	110.8
48	P	25.7	Very low	25.8	Very low	109 Å²	109	160.4 Å²	160.4	71%	0.708	82%	0.824	S	S	*	*			trans	-99.4	163.2	-133.8	36.9	-39.1	0	0	0	116.6
49	V	24.2	Very low	26	Very low	143 Å²	143	156.7 Å²	156.7	87%	0.867	82%	0.821	S	S	*	*			trans	-86.8	128.5	174.2	179.6	0	0	0	0	111.1
50	V	25.7	Very low	26	Very low	124 Å²	124	152 Å²	152	75%	0.752	81%	0.814	S	S	*	*			trans	-104.2	131.3	169.1	178.6	0	0	0	0	109.5
51	K	25.6	Very low	26.1	Very low	188 Å²	188	153.6 Å²	153.6	82%	0.817	81%	0.814	S	S	*	*			trans	-73.5	141.2	176.3	-70.8	173.4	176.7	168.3	0	111.6
52	F	23.1	Very low	26.4	Very low	214 Å²	214	152.1 Å²	152.1	94%	0.939	82%	0.815	S	S	*	*			trans	-148.2	163.5	140.2	-94.4	-67	0	0	0	110.8
53	R	22.8	Very low	26.4	Very low	213 Å²	213	159.5 Å²	159.5	80%	0.804	82%	0.821	S	S	*	*			trans	-148	118.9	-162.3	-167.3	-168	-176	173.2	5.6	111.6
54	H	25.4	Very low	26.7	Very low	164 Å²	164	159 Å²	159	76%	0.759	81%	0.812	S	S	*	*			trans	63.7	163.5	178.9	-55.3	-60.1	0	0	0	114.7
55	K	25.9	Very low	26.7	Very low	160 Å²	160	159.7 Å²	159.7	70%	0.696	81%	0.812	S	S	*	*			cis	-154.5	170	9.6	-151	175.4	156.2	-85.7	0	111.5
56	D	26.6	Very low	26.9	Very low	135 Å²	135	156 Å²	156	72%	0.722	80%	0.802	S	S	*	*			trans	66.6	165.7	161.5	-55	-42.8	0	0	0	117.7
57	G	25.7	Very low	27.1	Very low	68 Å²	68	154 Å²	154	70%	0.701	80%	0.798	S	S	*	*			trans	174.6	-168.6	-174.5	0	0	0	0	0	115.5
58	I	31.1	Very low	27.5	Very low	171 Å²	171	149.4 Å²	149.4	88%	0.877	79%	0.789	S	S	*	*			trans	72.7	132.2	-176.2	-53.3	177.4	0	0	0	111
59	P	33.3	Very low	27.5	Very low	129 Å²	129	147.8 Å²	147.8	84%	0.838	79%	0.792	S	S	*	*			cis	-133.9	-169.3	41.3	39.9	-20	0	0	0	117
60	A	26.9	Very low	27.9	Very low	92 Å²	92	148.5 Å²	148.5	76%	0.76	79%	0.785	S	S	*	*			trans	-88.8	173.7	-165.2	0	0	0	0	0	116.4
61	S	27.9	Very low	28.4	Very low	109 Å²	109	147 Å²	147	76%	0.762	78%	0.78	S	S	*	*			trans	108	94.7	154.7	77.2	0	0	0	0	118.7
62	L	30.7	Very low	28.9	Very low	184 Å²	184	143.7 Å²	143.7	96%	0.963	78%	0.781	S	S	*	*			trans	-129.1	144	141.8	-103	164.2	0	0	0	107.8
63	R	27.2	Very low	30.3	Very low	226 Å²	226	143.1 Å²	143.1	85%	0.853	77%	0.774	S	S	*	*			trans	-112.6	130.9	-155.5	-85.4	177.9	169.2	166.5	-4	114.1
64	V	31.3	Very low	32	Very low	117 Å²	117	137.1 Å²	137.1	71%	0.709	76%	0.763	S	S	*	*				50.4	125.1	125.1	-179.4	0	0	0	0	119.6
65	K	28.7	Very low	34.1	Very low	201 Å²	201	130.7 Å²	130.7	87%	0.874	74%	0.74	S	S	*	*			trans	73.3	141.2	168.8	-68.5	163.5	-176.8	-177.8	0	116.4
66	G	27	Very low	36.4	Very low	63 Å²	63	125.4 Å²	125.4	65%	0.649	72%	0.723	S	S	*	*			cis	150.7	165.5	-7.9	0	0	0	0	0	114
67	F	29.5	Very low	38.9	Very low	186 Å²	186	120.6 Å²	120.6	82%	0.816	70%	0.699	S	S	*	*			trans	70.9	142.8	-176.8	-68.8	-99.8	0	0	0	116.6
68	M	32.4	Very low	41.2	Very low	141 Å²	141	123.6 Å²	123.6	70%	0.695	70%	0.695	S	S	*	*			cis	-165.1	150.5	-36.5	-131.8	171.8	-178.1	0	0	110	H70	M68-H70 WeakPolarHBondContact CE-NE2 3.09Å
69	G	27.2	Very low	43.1	Very low	75 Å²	75	123.1 Å²	123.1	77%	0.773	69%	0.688	S	S	*	*			trans	-165.2	93.8	172.6	0	0	0	0	0	110.9
70	H	32.3	Very low	44.9	Very low	159 Å²	159	121.5 Å²	121.5	74%	0.736	67%	0.668	S	S	*	*			trans	-70.4	155.4	166.5	-64.2	-94.5	0	0	0	109	M68	M68-H70 WeakPolarHBondContact CE-NE2 3.09Å
71	S	35.4	Very low	47.2	Very low	92 Å²	92	127 Å²	127	64%	0.643	67%	0.671	S	S	*	*			cis	-146.3	130.2	19	-177	0	0	0	0	112.4
72	S	36.8	Very low	49.4	Very low	119 Å²	119	123 Å²	123	83%	0.832	64%	0.642	S	S	*	*			trans	-128.3	138	146.7	-73.3	0	0	0	0	107.5
73	Y	52.3	Low	51.2	Low	202 Å²	202	115 Å²	115	79%	0.792	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-63.8	145.9	162.8	-77.7	-108.6	0	0	0	108.3	G75	Y73-G75 PolarHBondContact O-N 2.71Å
74	P	58.2	Low	53.6	Low	87 Å²	87	107.3 Å²	107.3	57%	0.565	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-57.5	127.6	171.6	25.8	-33.3	0	0	0	108.2	E78	P74-E78 VanDerWaalsContact CA-OE2 3.26Å; P74-E78 WeakPolarHBondContact CA-OE2 3.23Å
75	G	69.1	Low	55.5	Low	28 Å²	28	102.9 Å²	102.9	29%	0.289	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-57.1	148.9	-173.1	0	0	0	0	0	110.9	Y73 C77 E78	Y73-G75 PolarHBondContact O-N 2.71Å; G75-C77 PolarHBondContact O-N 3.04Å; G75-E78 PolarHBondContact N-OE2 3.37Å; G75-E78 WeakPolarHBondContact O-CB 3.17Å; G75-E78 PolarHBondContact O-N 2.94Å
76	P	73.8	Confident	58	Low	50 Å²	50	98.7 Å²	98.7	33%	0.325	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-14	-173	-25.2	33.3	0	0	0	115.4	I90 D95 G97	P76-I90 HydrophobicContact CB-CG1 4.4Å; P76-I90 HydrophobicContact CG-CD1 4.4Å; P76-I90 HydrophobicContact CG-CG1 4.39Å; P76-I90 HydrophobicContact CG-CG2 4.38Å; P76-D95 WeakPolarHBondContact CG-O 3.32Å; P76-G97 WeakPolarHBondContact O-CA 3.48Å
77	C	79.4	Confident	60.5	Low	33 Å²	33	98.8 Å²	98.8	22%	0.223	52%	0.52	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-9.4	175.8	-71	0	0	0	0	115.5	G75 H79 K80 C88 V89 G97	G75-C77 PolarHBondContact O-N 3.04Å; C77-H79 PolarHBondContact O-N 3.47Å; C77-H79 VanDerWaalsContact O-N 3.16Å; C77-K80 PolarHBondContact O-N 3.46Å; C77-C88 WeakPolarHBondContact CA-SG 3.13Å; C77-C88 HydrophobicContact CB-CB 3.46Å; C77-C88 VanDerWaalsContact CB-CB 3.46Å; C77-C88 WeakPolarHBondContact CB-SG 3.38Å; C77-C88 WeakPolarHBondContact SG-CB 3.47Å; C77-C88 CovalentContact SG-SG 2.04Å; C77-C88 PolarHBondContact SG-SG 2.83Å; C77-V89 PolarHBondContact SG-N 3.4Å; C77-G97 VanDerWaalsContact SG-CA 3.59Å
78	E	74.8	Confident	63.1	Low	131 Å²	131	91.3 Å²	91.3	61%	0.612	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-26.1	-167.5	-166.5	171	-172.9	0	0	113.5	P74 G75	P74-E78 VanDerWaalsContact CA-OE2 3.26Å; P74-E78 WeakPolarHBondContact CA-OE2 3.23Å; G75-E78 PolarHBondContact N-OE2 3.37Å; G75-E78 WeakPolarHBondContact O-CB 3.17Å; G75-E78 PolarHBondContact O-N 2.94Å
79	H	70	Confident	65.5	Low	161 Å²	161	86.7 Å²	86.7	75%	0.745	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126	12.9	175.2	-63.8	85.8	0	0	0	113	C77 Y81	C77-H79 PolarHBondContact O-N 3.47Å; C77-H79 VanDerWaalsContact O-N 3.16Å; H79-Y81 PolarHBondContact O-N 3.49Å
80	K	72.1	Confident	68.1	Low	96 Å²	96	86.4 Å²	86.4	42%	0.417	45%	0.45	S	S	.	.			trans	-92.2	92.7	-172.6	-167.2	162.9	-172.9	165.4	0	112.1	C77 C82 G97	C77-K80 PolarHBondContact O-N 3.46Å; K80-C82 PolarHBondContact O-N 3.07Å; K80-G97 WeakPolarHBondContact CD-O 3.44Å; K80-G97 VanDerWaalsContact CE-O 3.3Å; K80-G97 WeakPolarHBondContact CE-O 3.4Å; K80-G97 PolarHBondContact NZ-O 3.05Å
81	Y	74.7	Confident	70.2	Confident	208 Å²	208	80.3 Å²	80.3	82%	0.816	42%	0.423	S	S	*	.			trans	-70.1	111.4	173.6	-174.5	-94.9	0	0	0	111.2	H79	H79-Y81 PolarHBondContact O-N 3.49Å
82	C	73.9	Confident	72.1	Confident	24 Å²	24	84.2 Å²	84.2	16%	0.162	43%	0.431	C	S	.	.			trans	-90	-13.2	-173.1	-75.1	0	0	0	0	115.8	K80 R86 C88 C99	K80-C82 PolarHBondContact O-N 3.07Å; C82-R86 HydrophobicContact CB-CB 3.59Å; C82-R86 WeakPolarHBondContact CB-O 3.5Å; C82-C88 VanDerWaalsContact SG-CB 3.58Å; C82-C99 WeakPolarHBondContact CA-SG 3.33Å; C82-C99 HydrophobicContact CB-CB 3.5Å; C82-C99 VanDerWaalsContact CB-CB 3.5Å; C82-C99 WeakPolarHBondContact CB-SG 3.42Å; C82-C99 WeakPolarHBondContact SG-CA 3.32Å; C82-C99 WeakPolarHBondContact SG-CB 3.29Å; C82-C99 CovalentContact SG-SG 2.04Å; C82-C99 PolarHBondContact SG-SG 3.46Å
83	G	69.3	Low	74	Confident	17 Å²	17	87.3 Å²	87.3	18%	0.175	43%	0.432	C	S	.	.			trans	65.1	171.9	179.8	0	0	0	0	0	114.9	G85 R86	G83-G85 PolarHBondContact O-N 3.31Å; G83-R86 VanDerWaalsContact O-CB 3.29Å; G83-R86 WeakPolarHBondContact O-CB 3.21Å; G83-R86 PolarHBondContact O-N 3.23Å
84	L	77.9	Confident	75.1	Confident	63 Å²	63	81.4 Å²	81.4	33%	0.33	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	34.3	168.6	-57.4	170.9	0	0	0	115.4	R86 S130 C131 R136	L84-R86 PolarHBondContact O-N 3.05Å; L84-R86 VanDerWaalsContact O-N 3.14Å; L84-S130 CarbonylContact O-C 3.6Å; L84-C131 WeakPolarHBondContact O-CA 3.42Å; L84-C131 WeakPolarHBondContact O-CB 3.34Å; L84-C131 PolarHBondContact O-N 2.78Å; L84-R136 HydrophobicContact CD2-CB 3.84Å
85	G	70.4	Confident	75.9	Confident	24 Å²	24	83 Å²	83	25%	0.247	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	2.7	-176.5	0	0	0	0	0	116.1	G83 H127	G83-G85 PolarHBondContact O-N 3.31Å; G85-H127 WeakPolarHBondContact CA-O 3.34Å
86	R	81.4	Confident	76.3	Confident	113 Å²	113	87.9 Å²	87.9	43%	0.426	44%	0.436	S	S	.	.			trans	-64.3	142.5	170.5	-70.5	167.9	-177	-162.2	-1.8	110.4	C82 G83 L84 C99 R100 C131	C82-R86 HydrophobicContact CB-CB 3.59Å; C82-R86 WeakPolarHBondContact CB-O 3.5Å; G83-R86 VanDerWaalsContact O-CB 3.29Å; G83-R86 WeakPolarHBondContact O-CB 3.21Å; G83-R86 PolarHBondContact O-N 3.23Å; L84-R86 PolarHBondContact O-N 3.05Å; L84-R86 VanDerWaalsContact O-N 3.14Å; R86-C99 HydrophobicContact CB-CB 4.34Å; R86-R100 WeakPolarHBondContact CA-O 3.21Å; R86-C131 HydrophobicContact CG-CB 4.39Å; R86-C131 WeakPolarHBondContact CG-SG 3.47Å
87	H	80.4	Confident	76.6	Confident	65 Å²	65	85.8 Å²	85.8	30%	0.301	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	155.1	167.6	76.7	-43.4	0	0	0	110.2	V89 C99 R100 C101 L102	H87-V89 WeakPolarHBondContact NE2-CG1 3.36Å; H87-C99 CarbonylContact O-C 3.57Å; H87-C99 WeakPolarHBondContact O-CA 3.11Å; H87-R100 PolarHBondContact N-O 3.25Å; H87-R100 PolarHBondContact ND1-O 2.88Å; H87-R100 PolarHBondContact O-N 2.76Å; H87-C101 PolarHBondContact CE1-O 3.29Å; H87-L102 VanDerWaalsContact CD2-CD1 3.47Å; H87-L102 WeakPolarHBondContact CD2-CD1 3.31Å; H87-L102 WeakPolarHBondContact NE2-CD1 3.42Å
88	C	83.1	Confident	76.9	Confident	29 Å²	29	87.5 Å²	87.5	20%	0.196	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	128.8	175	-171.6	0	0	0	0	110	C77 C82 G97 E98	C77-C88 WeakPolarHBondContact CA-SG 3.13Å; C77-C88 HydrophobicContact CB-CB 3.46Å; C77-C88 VanDerWaalsContact CB-CB 3.46Å; C77-C88 WeakPolarHBondContact CB-SG 3.38Å; C77-C88 WeakPolarHBondContact SG-CB 3.47Å; C77-C88 CovalentContact SG-SG 2.04Å; C77-C88 PolarHBondContact SG-SG 2.83Å; C82-C88 VanDerWaalsContact SG-CB 3.58Å; C88-G97 VanDerWaalsContact SG-CA 3.52Å; C88-E98 WeakPolarHBondContact CA-O 3.48Å
89	V	83.1	Confident	77.4	Confident	44 Å²	44	82.9 Å²	82.9	27%	0.267	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	144.1	172.6	-66.5	0	0	0	0	109.3	C77 H87 N91 G97 E98 R100	C77-V89 PolarHBondContact SG-N 3.4Å; H87-V89 WeakPolarHBondContact NE2-CG1 3.36Å; V89-N91 PolarHBondContact O-N 2.77Å; V89-G97 CarbonylContact O-C 3.32Å; V89-G97 WeakPolarHBondContact O-CA 3.44Å; V89-E98 PolarHBondContact N-O 3Å; V89-E98 PolarHBondContact O-N 3.47Å; V89-R100 HydrophobicContact CG2-CB 4.21Å; V89-R100 HydrophobicContact CG2-CG 3.98Å
90	I	81	Confident	78.1	Confident	70 Å²	70	81 Å²	81	36%	0.359	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	123.6	177.7	-57.7	173.7	0	0	0	108.3	P76 H92	P76-I90 HydrophobicContact CB-CG1 4.4Å; P76-I90 HydrophobicContact CG-CD1 4.4Å; P76-I90 HydrophobicContact CG-CG1 4.39Å; P76-I90 HydrophobicContact CG-CG2 4.38Å; I90-H92 PolarHBondContact O-N 2.8Å
91	N	78.1	Confident	78.8	Confident	30 Å²	30	77.9 Å²	77.9	16%	0.16	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	104	174.3	179.6	-46.6	0	0	0	108.8	V89 E93 T94 D95 Q96 E98	V89-N91 PolarHBondContact O-N 2.77Å; N91-E93 PolarHBondContact O-N 3.11Å; N91-E93 PolarHBondContact OD1-N 3.37Å; N91-T94 WeakPolarHBondContact CB-OG1 3.34Å; N91-T94 PolarHBondContact O-N 2.97Å; N91-T94 VanDerWaalsContact O-N 3.08Å; N91-T94 PolarHBondContact OD1-N 3.21Å; N91-T94 PolarHBondContact OD1-OG1 3.23Å; N91-T94 VanDerWaalsContact OD1-OG1 3.08Å; N91-D95 WeakPolarHBondContact O-CA 3.18Å; N91-D95 PolarHBondContact O-N 2.95Å; N91-Q96 WeakPolarHBondContact CB-O 3.31Å; N91-Q96 PolarHBondContact N-O 3.07Å; N91-E98 HydrophobicContact CB-CB 4.41Å; N91-E98 PolarHBondContact ND2-OE2 2.84Å
92	H	74.8	Confident	79.2	Confident	175 Å²	175	70.5 Å²	70.5	81%	0.81	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-9.8	-172.5	-64.7	-63	0	0	0	115.6	I90	I90-H92 PolarHBondContact O-N 2.8Å
93	E	76.7	Confident	79.4	Confident	184 Å²	184	75.9 Å²	75.9	86%	0.86	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-20.2	175.3	-59.8	-178.1	160.8	0	0	112.8	N91	N91-E93 PolarHBondContact O-N 3.11Å; N91-E93 PolarHBondContact OD1-N 3.37Å
94	T	75.2	Confident	80	Confident	78 Å²	78	82.2 Å²	82.2	48%	0.479	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	-7.5	-172.8	54.8	0	0	0	0	113.9	N91 Q96	N91-T94 WeakPolarHBondContact CB-OG1 3.34Å; N91-T94 PolarHBondContact O-N 2.97Å; N91-T94 VanDerWaalsContact O-N 3.08Å; N91-T94 PolarHBondContact OD1-N 3.21Å; N91-T94 PolarHBondContact OD1-OG1 3.23Å; N91-T94 VanDerWaalsContact OD1-OG1 3.08Å; T94-Q96 PolarHBondContact O-N 3.38Å; T94-Q96 VanDerWaalsContact O-N 3.13Å
95	D	74.8	Confident	80.2	Confident	119 Å²	119	80.1 Å²	80.1	64%	0.636	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	23.6	-175.7	-130	8.8	0	0	0	114.3	P76 N91	P76-D95 WeakPolarHBondContact CG-O 3.32Å; N91-D95 WeakPolarHBondContact O-CA 3.18Å; N91-D95 PolarHBondContact O-N 2.95Å
96	Q	76.8	Confident	80.4	Confident	132 Å²	132	87.6 Å²	87.6	62%	0.617	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.7	144.8	177.4	-68.4	-175.4	32.2	0	0	111.5	N91 T94 E98	N91-Q96 WeakPolarHBondContact CB-O 3.31Å; N91-Q96 PolarHBondContact N-O 3.07Å; T94-Q96 PolarHBondContact O-N 3.38Å; T94-Q96 VanDerWaalsContact O-N 3.13Å; Q96-E98 PolarHBondContact O-N 3.27Å
97	G	80.9	Confident	79.8	Confident	5 Å²	5	88.8 Å²	88.8	5%	0.052	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	123.1	174	0	0	0	0	0	110.5	P76 C77 K80 C88 V89	P76-G97 WeakPolarHBondContact O-CA 3.48Å; C77-G97 VanDerWaalsContact SG-CA 3.59Å; K80-G97 WeakPolarHBondContact CD-O 3.44Å; K80-G97 VanDerWaalsContact CE-O 3.3Å; K80-G97 WeakPolarHBondContact CE-O 3.4Å; K80-G97 PolarHBondContact NZ-O 3.05Å; C88-G97 VanDerWaalsContact SG-CA 3.52Å; V89-G97 CarbonylContact O-C 3.32Å; V89-G97 WeakPolarHBondContact O-CA 3.44Å
98	E	84.7	Confident	79.3	Confident	69 Å²	69	91.5 Å²	91.5	32%	0.322	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	140.4	-178.1	-152.5	-166.2	117.9	0	0	110.7	C88 V89 N91 Q96 R100	C88-E98 WeakPolarHBondContact CA-O 3.48Å; V89-E98 PolarHBondContact N-O 3Å; V89-E98 PolarHBondContact O-N 3.47Å; N91-E98 HydrophobicContact CB-CB 4.41Å; N91-E98 PolarHBondContact ND2-OE2 2.84Å; Q96-E98 PolarHBondContact O-N 3.27Å; E98-R100 VanDerWaalsContact CD-NE 3.35Å; E98-R100 VanDerWaalsContact CD-NH2 3.28Å; E98-R100 PolarHBondContact O-N 3.15Å; E98-R100 IonicContact OE1-CZ 2.66Å; E98-R100 IonicContact OE1-NE 2.75Å; E98-R100 PolarHBondContact OE1-NE 3.05Å; E98-R100 IonicContact OE1-NH2 2.55Å; E98-R100 PolarHBondContact OE1-NH2 3Å; E98-R100 VanDerWaalsContact OE1-NH2 3.12Å; E98-R100 IonicContact OE2-CZ 3.86Å; E98-R100 IonicContact OE2-NE 3.88Å; E98-R100 IonicContact OE2-NH2 3.21Å; E98-R100 PolarHBondContact OE2-NH2 3.03Å
99	C	85.4	Confident	78.8	Confident	35 Å²	35	98.6 Å²	98.6	24%	0.236	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	90	-171.4	-69.9	0	0	0	0	111.8	C82 R86 H87	C82-C99 WeakPolarHBondContact CA-SG 3.33Å; C82-C99 HydrophobicContact CB-CB 3.5Å; C82-C99 VanDerWaalsContact CB-CB 3.5Å; C82-C99 WeakPolarHBondContact CB-SG 3.42Å; C82-C99 WeakPolarHBondContact SG-CA 3.32Å; C82-C99 WeakPolarHBondContact SG-CB 3.29Å; C82-C99 CovalentContact SG-SG 2.04Å; C82-C99 PolarHBondContact SG-SG 3.46Å; R86-C99 HydrophobicContact CB-CB 4.34Å; H87-C99 CarbonylContact O-C 3.57Å; H87-C99 WeakPolarHBondContact O-CA 3.11Å
100	R	85.3	Confident	78.5	Confident	122 Å²	122	103 Å²	103	46%	0.46	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	164	-176	-62.7	-168.2	-179.2	171.8	5.9	112.9	R86 H87 V89 E98	R86-R100 WeakPolarHBondContact CA-O 3.21Å; H87-R100 PolarHBondContact N-O 3.25Å; H87-R100 PolarHBondContact ND1-O 2.88Å; H87-R100 PolarHBondContact O-N 2.76Å; V89-R100 HydrophobicContact CG2-CB 4.21Å; V89-R100 HydrophobicContact CG2-CG 3.98Å; E98-R100 VanDerWaalsContact CD-NE 3.35Å; E98-R100 VanDerWaalsContact CD-NH2 3.28Å; E98-R100 PolarHBondContact O-N 3.15Å; E98-R100 IonicContact OE1-CZ 2.66Å; E98-R100 IonicContact OE1-NE 2.75Å; E98-R100 PolarHBondContact OE1-NE 3.05Å; E98-R100 IonicContact OE1-NH2 2.55Å; E98-R100 PolarHBondContact OE1-NH2 3Å; E98-R100 VanDerWaalsContact OE1-NH2 3.12Å; E98-R100 IonicContact OE2-CZ 3.86Å; E98-R100 IonicContact OE2-NE 3.88Å; E98-R100 IonicContact OE2-NH2 3.21Å; E98-R100 PolarHBondContact OE2-NH2 3.03Å
101	C	86.3	Confident	78.4	Confident	29 Å²	29	101.2 Å²	101.2	20%	0.196	50%	0.496	C	S	.	.			trans	-75.3	156.5	167.8	-58.9	0	0	0	0	110.8	H87 C131 L132	H87-C101 PolarHBondContact CE1-O 3.29Å; C101-C131 WeakPolarHBondContact CA-SG 3.31Å; C101-C131 HydrophobicContact CB-CB 3.85Å; C101-C131 WeakPolarHBondContact CB-SG 3.44Å; C101-C131 WeakPolarHBondContact SG-CB 3.49Å; C101-C131 CovalentContact SG-SG 2.03Å; C101-C131 PolarHBondContact SG-SG 3.13Å; C101-L132 HydrophobicContact CB-CD2 3.94Å; C101-L132 HydrophobicContact CB-CG 4.28Å
102	L	83.3	Confident	78.5	Confident	54 Å²	54	100.2 Å²	100.2	28%	0.283	49%	0.491	S	S	.	.			trans	-76.6	125.8	173.2	-149.6	85	0	0	0	108.9	H87 H104 C124 R128	H87-L102 VanDerWaalsContact CD2-CD1 3.47Å; H87-L102 WeakPolarHBondContact CD2-CD1 3.31Å; H87-L102 WeakPolarHBondContact NE2-CD1 3.42Å; L102-H104 VanDerWaalsContact CD2-O 3.28Å; L102-H104 WeakPolarHBondContact CD2-O 3.26Å; L102-C124 WeakPolarHBondContact CD2-SG 3.49Å; L102-R128 WeakPolarHBondContact O-CD 3.39Å; L102-R128 WeakPolarHBondContact O-CG 3.43Å; L102-R128 PolarHBondContact O-NE 2.88Å
103	D	79.1	Confident	78.8	Confident	137 Å²	137	92.1 Å²	92.1	73%	0.733	45%	0.454	S	S	*	.	S	Bend	trans	-69	-39.3	-175.6	-62.2	-58.7	0	0	0	112.2	R128	D103-R128 VanDerWaalsContact O-CZ 3.26Å; D103-R128 PolarHBondContact O-NE 2.87Å; D103-R128 PolarHBondContact O-NH2 2.84Å
104	H	80.7	Confident	79.1	Confident	150 Å²	150	83.4 Å²	83.4	69%	0.694	41%	0.413	S	S	*	.			trans	-147.6	145	176	55.6	49.2	0	0	0	112.3	L102	L102-H104 VanDerWaalsContact CD2-O 3.28Å; L102-H104 WeakPolarHBondContact CD2-O 3.26Å
105	C	81.9	Confident	79.2	Confident	18 Å²	18	82.1 Å²	82.1	12%	0.122	41%	0.407	C	S	.	.			trans	-91.8	158.6	169	-67.6	0	0	0	0	112.3	C124 E125	C105-C124 HydrophobicContact CB-CB 3.73Å; C105-C124 WeakPolarHBondContact CB-SG 3.38Å; C105-C124 WeakPolarHBondContact SG-CB 3.43Å; C105-C124 CovalentContact SG-SG 2.04Å; C105-C124 PolarHBondContact SG-SG 2.98Å; C105-E125 HydrophobicContact CB-CG 4.07Å; C105-E125 WeakPolarHBondContact CB-OE1 3.33Å; C105-E125 PolarHBondContact N-OE1 3.35Å; C105-E125 PolarHBondContact SG-N 2.84Å; C105-E125 VanDerWaalsContact SG-N 3.39Å; C105-E125 PolarHBondContact SG-OE1 2.87Å; C105-E125 VanDerWaalsContact SG-OE1 3.41Å
106	K	75.7	Confident	79.3	Confident	182 Å²	182	79.4 Å²	79.4	79%	0.791	39%	0.393	S	S	*	.			trans	-73	139.8	171	-68.6	-172.7	176.5	-174.7	0	110.1	H108	K106-H108 PolarHBondContact O-N 3.17Å
107	P	67.8	Low	79	Confident	137 Å²	137	74 Å²	74	89%	0.89	37%	0.373	S	S	*	.			trans	-69.4	98.1	177.7	28.2	-34.1	0	0	0	110.5
108	H	71.3	Confident	78.8	Confident	123 Å²	123	78 Å²	78	57%	0.569	39%	0.388	S	S	*	.			trans	-140.2	116.8	173.8	178.3	-65.3	0	0	0	108	K106 K110 N122	K106-H108 PolarHBondContact O-N 3.17Å; H108-K110 PolarHBondContact O-N 3.33Å; H108-N122 WeakPolarHBondContact O-CB 3.46Å; H108-N122 PolarHBondContact O-ND2 2.82Å
109	Y	72.8	Confident	78.4	Confident	177 Å²	177	78.2 Å²	78.2	69%	0.694	39%	0.392	S	S	*	.			trans	-86.4	108.6	-175.7	-161.7	-100.2	0	0	0	111.1	P111 Q121	Y109-P111 HydrophobicContact CE1-CG 4.15Å; Y109-Q121 HydrophobicContact CD2-CB 4.49Å
110	K	76.3	Confident	78.1	Confident	138 Å²	138	77.6 Å²	77.6	60%	0.6	38%	0.384	S	S	*	.			trans	-156.1	83.4	171.2	-173.5	179.7	179.8	-179	0	108.4	H108 Q121 N122	H108-K110 PolarHBondContact O-N 3.33Å; K110-Q121 CarbonylContact C-O 3.57Å; K110-Q121 PolarHBondContact N-O 3.06Å; K110-N122 WeakPolarHBondContact O-CA 3.25Å
111	P	77.8	Confident	77.8	Confident	31 Å²	31	77.8 Å²	77.8	20%	0.201	39%	0.391	C	S	.	.			trans	-68.6	153.1	-164.5	26.6	-35	0	0	0	113.2	Y109 L119 Y120	Y109-P111 HydrophobicContact CE1-CG 4.15Å; P111-L119 HydrophobicContact CB-CD1 4.09Å; P111-L119 HydrophobicContact CB-CD2 4.4Å; P111-L119 HydrophobicContact CB-CG 4.21Å; P111-Y120 CarbonylContact C-O 3.58Å; P111-Y120 WeakPolarHBondContact CA-O 3.47Å
112	V	80.6	Confident	77.6	Confident	10 Å²	10	77.1 Å²	77.1	6%	0.061	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	143.5	179.2	-66.8	0	0	0	0	110.6	Y120 L126 I139	V112-Y120 PolarHBondContact N-O 2.7Å; V112-Y120 PolarHBondContact O-N 3.49Å; V112-L126 HydrophobicContact CG2-CB 4.2Å; V112-L126 HydrophobicContact CG2-CD1 3.69Å; V112-I139 HydrophobicContact CB-CD1 4.42Å; V112-I139 HydrophobicContact CB-CG1 4.23Å; V112-I139 HydrophobicContact CB-CG2 4.35Å; V112-I139 HydrophobicContact CG1-CD1 4.33Å; V112-I139 HydrophobicContact CG2-CD1 4.37Å; V112-I139 HydrophobicContact CG2-CG1 4.21Å
113	C	82.3	Confident	77.6	Confident	5 Å²	5	79.4 Å²	79.4	3%	0.034	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	127.5	175.8	-174.7	0	0	0	0	112.3	I139 M140 H141 E143 C145	C113-I139 CarbonylContact O-C 3.59Å; C113-I139 WeakPolarHBondContact O-CA 3.43Å; C113-M140 PolarHBondContact O-N 2.96Å; C113-H141 HydrophobicContact CB-CB 4.4Å; C113-H141 PolarHBondContact N-O 2.88Å; C113-E143 PolarHBondContact N-O 3.36Å; C113-E143 VanDerWaalsContact N-O 3.16Å; C113-C145 WeakPolarHBondContact CA-SG 3.3Å; C113-C145 HydrophobicContact CB-CB 3.94Å; C113-C145 WeakPolarHBondContact CB-SG 3.36Å; C113-C145 WeakPolarHBondContact SG-CA 3.27Å; C113-C145 WeakPolarHBondContact SG-CB 3.39Å; C113-C145 CovalentContact SG-SG 2.04Å; C113-C145 PolarHBondContact SG-SG 3.38Å
114	G	81.7	Confident	77.9	Confident	0 Å²	0	75 Å²	75	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	155.7	170.7	0	0	0	0	0	113.7	D116 G117 K118 T138	G114-D116 WeakPolarHBondContact CA-OD1 3.43Å; G114-D116 PolarHBondContact O-N 3.25Å; G114-D116 VanDerWaalsContact O-N 3.11Å; G114-G117 PolarHBondContact O-N 3.38Å; G114-K118 PolarHBondContact N-O 2.83Å; G114-T138 CarbonylContact C-O 3.52Å
115	S	78.5	Confident	78.3	Confident	52 Å²	52	70 Å²	70	36%	0.364	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	4.9	174	63.6	0	0	0	0	114.7	T138	S115-T138 WeakPolarHBondContact CB-O 3.46Å; S115-T138 PolarHBondContact N-O 2.88Å; S115-T138 PolarHBondContact OG-N 2.81Å; S115-T138 PolarHBondContact OG-O 2.94Å; S115-T138 PolarHBondContact OG-OG1 2.81Å
116	D	76.6	Confident	78.6	Confident	62 Å²	62	69.1 Å²	69.1	33%	0.332	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	3.7	166.8	68	-38.2	0	0	0	112.4	G114 K118 Y120 R133 I137	G114-D116 WeakPolarHBondContact CA-OD1 3.43Å; G114-D116 PolarHBondContact O-N 3.25Å; G114-D116 VanDerWaalsContact O-N 3.11Å; D116-K118 VanDerWaalsContact C-N 3.29Å; D116-K118 PolarHBondContact O-N 2.79Å; D116-K118 PolarHBondContact OD1-N 2.89Å; D116-Y120 PolarHBondContact OD2-OH 2.82Å; D116-R133 IonicContact OD2-CZ 3.91Å; D116-R133 IonicContact OD2-NH1 2.69Å; D116-R133 PolarHBondContact OD2-NH1 2.66Å; D116-I137 WeakPolarHBondContact OD1-CG2 3.39Å
117	G	71.3	Confident	79.1	Confident	19 Å²	19	64 Å²	64	20%	0.196	32%	0.323	C	S	.	.	S	Bend	trans	79.8	0.6	-179.9	0	0	0	0	0	114.9	G114 C145 Y147	G114-G117 PolarHBondContact O-N 3.38Å; G117-C145 VanDerWaalsContact C-SG 3.55Å; G117-C145 PolarHBondContact O-SG 2.73Å; G117-Y147 PolarHBondContact O-OH 3.34Å
118	K	75.4	Confident	80	Confident	87 Å²	87	60.8 Å²	60.8	38%	0.378	29%	0.293	S	S	.	.			trans	-89.9	137.3	177.3	-170.2	132.7	-171.9	164	0	111.4	G114 D116 Y120 C145 D241	G114-K118 PolarHBondContact N-O 2.83Å; D116-K118 VanDerWaalsContact C-N 3.29Å; D116-K118 PolarHBondContact O-N 2.79Å; D116-K118 PolarHBondContact OD1-N 2.89Å; K118-Y120 HydrophobicContact CB-CE2 3.99Å; K118-Y120 HydrophobicContact CG-CE2 4.4Å; K118-Y120 VanDerWaalsContact O-CD2 3.26Å; K118-Y120 WeakPolarHBondContact O-CD2 3.19Å; K118-Y120 WeakPolarHBondContact O-CE2 3.42Å; K118-C145 PolarHBondContact O-SG 2.85Å; K118-D241 IonicContact NZ-OD2 2.67Å; K118-D241 PolarHBondContact NZ-OD2 3.36Å
119	L	76.4	Confident	80.7	Confident	75 Å²	75	55.7 Å²	55.7	39%	0.393	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	133	170.5	-167.5	67.8	0	0	0	109.8	P111	P111-L119 HydrophobicContact CB-CD1 4.09Å; P111-L119 HydrophobicContact CB-CD2 4.4Å; P111-L119 HydrophobicContact CB-CG 4.21Å
120	Y	79.9	Confident	81.4	Confident	21 Å²	21	47.4 Å²	47.4	8%	0.082	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.8	177	-69.9	-84	0	0	0	110.1	P111 V112 D116 K118 N122 E125 L126 A129 R133 I137	P111-Y120 CarbonylContact C-O 3.58Å; P111-Y120 WeakPolarHBondContact CA-O 3.47Å; V112-Y120 PolarHBondContact N-O 2.7Å; V112-Y120 PolarHBondContact O-N 3.49Å; D116-Y120 PolarHBondContact OD2-OH 2.82Å; K118-Y120 HydrophobicContact CB-CE2 3.99Å; K118-Y120 HydrophobicContact CG-CE2 4.4Å; K118-Y120 VanDerWaalsContact O-CD2 3.26Å; K118-Y120 WeakPolarHBondContact O-CD2 3.19Å; K118-Y120 WeakPolarHBondContact O-CE2 3.42Å; Y120-N122 PolarHBondContact O-N 3.14Å; Y120-E125 HydrophobicContact CD1-CB 4.32Å; Y120-L126 HydrophobicContact CD1-CB 4.23Å; Y120-L126 HydrophobicContact CD2-CB 3.77Å; Y120-L126 HydrophobicContact CD2-CD1 3.76Å; Y120-L126 HydrophobicContact CD2-CG 3.69Å; Y120-L126 HydrophobicContact CE2-CB 4.4Å; Y120-L126 HydrophobicContact CE2-CD1 4.37Å; Y120-L126 HydrophobicContact CE2-CG 4.04Å; Y120-L126 HydrophobicContact CG-CB 3.65Å; Y120-L126 HydrophobicContact CG-CD1 4.4Å; Y120-L126 HydrophobicContact CG-CG 4.13Å; Y120-A129 HydrophobicContact CD1-CB 4.35Å; Y120-A129 HydrophobicContact CE1-CB 3.37Å; Y120-A129 WeakPolarHBondContact OH-CB 3.3Å; Y120-R133 PolarHBondContact OH-NH1 3.41Å; Y120-I137 HydrophobicContact CE2-CG2 4.4Å; Y120-I137 WeakPolarHBondContact OH-CD1 3.42Å
121	Q	78.3	Confident	81.9	Confident	127 Å²	127	41 Å²	41	59%	0.593	21%	0.213	S	C	*	.	S	Bend	trans	-54.3	-28.9	-177.6	-62.4	-176.4	3.3	0	0	113.5	Y109 K110	Y109-Q121 HydrophobicContact CD2-CB 4.49Å; K110-Q121 CarbonylContact C-O 3.57Å; K110-Q121 PolarHBondContact N-O 3.06Å
122	N	82.2	Confident	82.3	Confident	14 Å²	14	44.7 Å²	44.7	8%	0.075	23%	0.23	C	C	.	.	S	Bend	trans	-159.4	171	169	56.2	59.6	0	0	0	112.4	H108 K110 Y120 C124 E125 L126	H108-N122 WeakPolarHBondContact O-CB 3.46Å; H108-N122 PolarHBondContact O-ND2 2.82Å; K110-N122 WeakPolarHBondContact O-CA 3.25Å; Y120-N122 PolarHBondContact O-N 3.14Å; N122-C124 PolarHBondContact O-N 3.43Å; N122-C124 WeakPolarHBondContact OD1-CA 3.49Å; N122-C124 VanDerWaalsContact OD1-CB 3.23Å; N122-C124 WeakPolarHBondContact OD1-CB 3.3Å; N122-C124 PolarHBondContact OD1-N 2.79Å; N122-E125 PolarHBondContact O-N 2.83Å; N122-E125 PolarHBondContact OD1-N 2.95Å; N122-L126 PolarHBondContact O-N 2.81Å
123	H	83.1	Confident	82.4	Confident	102 Å²	102	50.4 Å²	50.4	47%	0.472	25%	0.251	S	S	.	.	H	α-helix	trans	-54.8	-28.2	175.9	-174.1	-41	0	0	0	113.9	H127 I139	H123-H127 AromaticContact CE1-CD2 3.6Å; H123-H127 AromaticContact CE1-CE1 3.58Å; H123-H127 AromaticContact CE1-NE2 3.18Å; H123-H127 PolarHBondContact CE1-NE2 3.07Å; H123-H127 AromaticContact ND1-CD2 3.47Å; H123-H127 PolarHBondContact ND1-CD2 2.87Å; H123-H127 AromaticContact ND1-NE2 3.58Å; H123-H127 PolarHBondContact O-CD2 2.91Å; H123-H127 PolarHBondContact O-N 2.95Å; H123-I139 HydrophobicContact CB-CD1 4.41Å; H123-I139 VanDerWaalsContact CD2-CD1 3.44Å; H123-I139 WeakPolarHBondContact CD2-CD1 3.25Å
124	C	85.9	Confident	82.2	Confident	44 Å²	44	51.8 Å²	51.8	30%	0.297	27%	0.266	S	S	.	.	H	α-helix	trans	-72.2	-48.1	178.2	178.5	0	0	0	0	110.8	L102 C105 N122 L126 H127 R128	L102-C124 WeakPolarHBondContact CD2-SG 3.49Å; C105-C124 HydrophobicContact CB-CB 3.73Å; C105-C124 WeakPolarHBondContact CB-SG 3.38Å; C105-C124 WeakPolarHBondContact SG-CB 3.43Å; C105-C124 CovalentContact SG-SG 2.04Å; C105-C124 PolarHBondContact SG-SG 2.98Å; N122-C124 PolarHBondContact O-N 3.43Å; N122-C124 WeakPolarHBondContact OD1-CA 3.49Å; N122-C124 VanDerWaalsContact OD1-CB 3.23Å; N122-C124 WeakPolarHBondContact OD1-CB 3.3Å; N122-C124 PolarHBondContact OD1-N 2.79Å; C124-L126 VanDerWaalsContact C-N 3.31Å; C124-L126 PolarHBondContact O-N 3.05Å; C124-H127 PolarHBondContact O-N 3.46Å; C124-H127 VanDerWaalsContact O-N 3.14Å; C124-R128 WeakPolarHBondContact O-CB 3.44Å; C124-R128 PolarHBondContact O-N 3Å
125	E	88	Confident	82.1	Confident	46 Å²	46	58.4 Å²	58.4	22%	0.215	30%	0.296	C	S	.	.	H	α-helix	trans	-64.7	-33.6	178.4	-74.8	-59.7	153.2	0	0	112.7	C105 Y120 N122 H127 R128 A129	C105-E125 HydrophobicContact CB-CG 4.07Å; C105-E125 WeakPolarHBondContact CB-OE1 3.33Å; C105-E125 PolarHBondContact N-OE1 3.35Å; C105-E125 PolarHBondContact SG-N 2.84Å; C105-E125 VanDerWaalsContact SG-N 3.39Å; C105-E125 PolarHBondContact SG-OE1 2.87Å; C105-E125 VanDerWaalsContact SG-OE1 3.41Å; Y120-E125 HydrophobicContact CD1-CB 4.32Å; N122-E125 PolarHBondContact O-N 2.83Å; N122-E125 PolarHBondContact OD1-N 2.95Å; E125-H127 PolarHBondContact O-N 3.17Å; E125-R128 PolarHBondContact O-N 3.16Å; E125-R128 IonicContact OE1-NH1 2.68Å; E125-R128 WeakPolarHBondContact OE2-CD 3.28Å; E125-R128 IonicContact OE2-CZ 3.04Å; E125-R128 IonicContact OE2-NH1 3.73Å; E125-R128 PolarHBondContact OE2-NH1 3.18Å; E125-A129 WeakPolarHBondContact O-CB 3.28Å; E125-A129 PolarHBondContact O-N 2.87Å
126	L	88.4	Confident	82.1	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.2	-46.2	171.6	-172.2	156.1	0	0	0	111.6	V112 Y120 N122 C124 A129 S130 I137 I139	V112-L126 HydrophobicContact CG2-CB 4.2Å; V112-L126 HydrophobicContact CG2-CD1 3.69Å; Y120-L126 HydrophobicContact CD1-CB 4.23Å; Y120-L126 HydrophobicContact CD2-CB 3.77Å; Y120-L126 HydrophobicContact CD2-CD1 3.76Å; Y120-L126 HydrophobicContact CD2-CG 3.69Å; Y120-L126 HydrophobicContact CE2-CB 4.4Å; Y120-L126 HydrophobicContact CE2-CD1 4.37Å; Y120-L126 HydrophobicContact CE2-CG 4.04Å; Y120-L126 HydrophobicContact CG-CB 3.65Å; Y120-L126 HydrophobicContact CG-CD1 4.4Å; Y120-L126 HydrophobicContact CG-CG 4.13Å; N122-L126 PolarHBondContact O-N 2.81Å; C124-L126 VanDerWaalsContact C-N 3.31Å; C124-L126 PolarHBondContact O-N 3.05Å; L126-A129 PolarHBondContact O-N 2.93Å; L126-S130 VanDerWaalsContact O-CB 3.3Å; L126-S130 WeakPolarHBondContact O-CB 3.43Å; L126-S130 PolarHBondContact O-N 3.19Å; L126-I137 HydrophobicContact CD1-CG2 4.46Å; L126-I137 HydrophobicContact CD2-CB 4.25Å; L126-I137 HydrophobicContact CD2-CG2 3.93Å; L126-I137 HydrophobicContact CG-CG2 4.01Å; L126-I139 HydrophobicContact CD1-CG1 3.61Å; L126-I139 HydrophobicContact CD2-CG1 4.29Å
127	H	86	Confident	82.4	Confident	74 Å²	74	62.3 Å²	62.3	34%	0.343	30%	0.299	S	S	.	.	H	α-helix	trans	-68.1	-37.8	178.2	-83.2	-129.7	0	0	0	112	G85 H123 C124 E125 S130 C131	G85-H127 WeakPolarHBondContact CA-O 3.34Å; H123-H127 AromaticContact CE1-CD2 3.6Å; H123-H127 AromaticContact CE1-CE1 3.58Å; H123-H127 AromaticContact CE1-NE2 3.18Å; H123-H127 PolarHBondContact CE1-NE2 3.07Å; H123-H127 AromaticContact ND1-CD2 3.47Å; H123-H127 PolarHBondContact ND1-CD2 2.87Å; H123-H127 AromaticContact ND1-NE2 3.58Å; H123-H127 PolarHBondContact O-CD2 2.91Å; H123-H127 PolarHBondContact O-N 2.95Å; C124-H127 PolarHBondContact O-N 3.46Å; C124-H127 VanDerWaalsContact O-N 3.14Å; E125-H127 PolarHBondContact O-N 3.17Å; H127-S130 WeakPolarHBondContact O-CB 3.27Å; H127-S130 PolarHBondContact O-N 2.95Å; H127-C131 WeakPolarHBondContact O-CB 3.45Å; H127-C131 PolarHBondContact O-N 2.84Å
128	R	87.8	Confident	82.7	Confident	69 Å²	69	64.3 Å²	64.3	26%	0.26	31%	0.307	S	S	.	.	H	α-helix	trans	-62.1	-44.9	174	-177.9	168.5	173.7	-88.1	-3.4	111.8	L102 D103 C124 E125 C131 L132	L102-R128 WeakPolarHBondContact O-CD 3.39Å; L102-R128 WeakPolarHBondContact O-CG 3.43Å; L102-R128 PolarHBondContact O-NE 2.88Å; D103-R128 VanDerWaalsContact O-CZ 3.26Å; D103-R128 PolarHBondContact O-NE 2.87Å; D103-R128 PolarHBondContact O-NH2 2.84Å; C124-R128 WeakPolarHBondContact O-CB 3.44Å; C124-R128 PolarHBondContact O-N 3Å; E125-R128 PolarHBondContact O-N 3.16Å; E125-R128 IonicContact OE1-NH1 2.68Å; E125-R128 WeakPolarHBondContact OE2-CD 3.28Å; E125-R128 IonicContact OE2-CZ 3.04Å; E125-R128 IonicContact OE2-NH1 3.73Å; E125-R128 PolarHBondContact OE2-NH1 3.18Å; R128-C131 WeakPolarHBondContact O-CB 3.48Å; R128-C131 PolarHBondContact O-N 3.11Å; R128-L132 HydrophobicContact CG-CD1 4Å; R128-L132 WeakPolarHBondContact O-CG 3.47Å; R128-L132 PolarHBondContact O-N 3.5Å
129	A	86.1	Confident	82.9	Confident	16 Å²	16	63 Å²	63	13%	0.132	30%	0.304	C	S	.	.	H	α-helix	trans	-66.9	-41.3	175.5	0	0	0	0	0	112.9	Y120 E125 L126 C131 L132 R133 I137	Y120-A129 HydrophobicContact CD1-CB 4.35Å; Y120-A129 HydrophobicContact CE1-CB 3.37Å; Y120-A129 WeakPolarHBondContact OH-CB 3.3Å; E125-A129 WeakPolarHBondContact O-CB 3.28Å; E125-A129 PolarHBondContact O-N 2.87Å; L126-A129 PolarHBondContact O-N 2.93Å; A129-C131 PolarHBondContact O-N 3.47Å; A129-L132 PolarHBondContact O-N 2.81Å; A129-R133 VanDerWaalsContact O-CB 3.3Å; A129-R133 WeakPolarHBondContact O-CB 3.48Å; A129-R133 WeakPolarHBondContact O-CG 3.4Å; A129-R133 PolarHBondContact O-N 2.94Å; A129-I137 HydrophobicContact CB-CD1 4.35Å
130	S	86.9	Confident	82.7	Confident	3 Å²	3	65 Å²	65	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-52.2	-42.5	171	-160.6	0	0	0	0	110.9	L84 L126 H127 G134 H135 I137	L84-S130 CarbonylContact O-C 3.6Å; L126-S130 VanDerWaalsContact O-CB 3.3Å; L126-S130 WeakPolarHBondContact O-CB 3.43Å; L126-S130 PolarHBondContact O-N 3.19Å; H127-S130 WeakPolarHBondContact O-CB 3.27Å; H127-S130 PolarHBondContact O-N 2.95Å; S130-G134 PolarHBondContact O-N 2.64Å; S130-H135 WeakPolarHBondContact CA-O 3.23Å; S130-H135 PolarHBondContact O-N 2.86Å; S130-H135 VanDerWaalsContact O-O 3.1Å; S130-H135 PolarHBondContact OG-O 3.43Å; S130-H135 VanDerWaalsContact OG-O 3.06Å; S130-I137 PolarHBondContact OG-N 3.2Å; S130-I137 PolarHBondContact OG-O 3.39Å
131	C	86.9	Confident	82.1	Confident	3 Å²	3	67.8 Å²	67.8	2%	0.02	33%	0.326	C	S	.	.	H	α-helix	trans	-70.5	-52.5	178.7	-172.8	0	0	0	0	113.9	L84 R86 C101 H127 R128 A129 R133 G134	L84-C131 WeakPolarHBondContact O-CA 3.42Å; L84-C131 WeakPolarHBondContact O-CB 3.34Å; L84-C131 PolarHBondContact O-N 2.78Å; R86-C131 HydrophobicContact CG-CB 4.39Å; R86-C131 WeakPolarHBondContact CG-SG 3.47Å; C101-C131 WeakPolarHBondContact CA-SG 3.31Å; C101-C131 HydrophobicContact CB-CB 3.85Å; C101-C131 WeakPolarHBondContact CB-SG 3.44Å; C101-C131 WeakPolarHBondContact SG-CB 3.49Å; C101-C131 CovalentContact SG-SG 2.03Å; C101-C131 PolarHBondContact SG-SG 3.13Å; H127-C131 WeakPolarHBondContact O-CB 3.45Å; H127-C131 PolarHBondContact O-N 2.84Å; R128-C131 WeakPolarHBondContact O-CB 3.48Å; R128-C131 PolarHBondContact O-N 3.11Å; A129-C131 PolarHBondContact O-N 3.47Å; C131-R133 VanDerWaalsContact C-N 3.3Å; C131-R133 PolarHBondContact O-N 3.22Å; C131-G134 PolarHBondContact O-N 3.09Å
132	L	86.1	Confident	81.2	Confident	109 Å²	109	65.8 Å²	65.8	57%	0.571	33%	0.327	S	S	*	.	H	α-helix	trans	-64.6	-35	-176.9	-68.7	169.5	0	0	0	111.9	C101 R128 A129 G134	C101-L132 HydrophobicContact CB-CD2 3.94Å; C101-L132 HydrophobicContact CB-CG 4.28Å; R128-L132 HydrophobicContact CG-CD1 4Å; R128-L132 WeakPolarHBondContact O-CG 3.47Å; R128-L132 PolarHBondContact O-N 3.5Å; A129-L132 PolarHBondContact O-N 2.81Å; L132-G134 VanDerWaalsContact C-N 3.35Å
133	R	83.3	Confident	80.2	Confident	131 Å²	131	71.5 Å²	71.5	49%	0.494	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-11.3	174.7	-67.9	173.2	167.1	178.7	-7.2	113.6	D116 Y120 A129 C131 H135	D116-R133 IonicContact OD2-CZ 3.91Å; D116-R133 IonicContact OD2-NH1 2.69Å; D116-R133 PolarHBondContact OD2-NH1 2.66Å; Y120-R133 PolarHBondContact OH-NH1 3.41Å; A129-R133 VanDerWaalsContact O-CB 3.3Å; A129-R133 WeakPolarHBondContact O-CB 3.48Å; A129-R133 WeakPolarHBondContact O-CG 3.4Å; A129-R133 PolarHBondContact O-N 2.94Å; C131-R133 VanDerWaalsContact C-N 3.3Å; C131-R133 PolarHBondContact O-N 3.22Å; R133-H135 PolarHBondContact O-N 2.86Å; R133-H135 PolarHBondContact O-ND1 3.28Å
134	G	77.9	Confident	79	Confident	33 Å²	33	70.4 Å²	70.4	34%	0.34	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.8	13.9	-178	0	0	0	0	0	115.3	S130 C131 L132	S130-G134 PolarHBondContact O-N 2.64Å; C131-G134 PolarHBondContact O-N 3.09Å; L132-G134 VanDerWaalsContact C-N 3.35Å
135	H	79.6	Confident	77.6	Confident	139 Å²	139	69.4 Å²	69.4	64%	0.644	34%	0.341	S	S	*	.	S	Bend	trans	-122.6	139.6	-174.8	-74.6	79.7	0	0	0	110.2	S130 R133 I137	S130-H135 WeakPolarHBondContact CA-O 3.23Å; S130-H135 PolarHBondContact O-N 2.86Å; S130-H135 VanDerWaalsContact O-O 3.1Å; S130-H135 PolarHBondContact OG-O 3.43Å; S130-H135 VanDerWaalsContact OG-O 3.06Å; R133-H135 PolarHBondContact O-N 2.86Å; R133-H135 PolarHBondContact O-ND1 3.28Å; H135-I137 PolarHBondContact O-N 3.43Å
136	R	79.1	Confident	76	Confident	187 Å²	187	74 Å²	74	71%	0.706	36%	0.361	S	S	*	.			trans	-74.8	86.9	-174.9	-166.8	-173.8	68.1	-174.5	-0.8	112.1	L84 T138	L84-R136 HydrophobicContact CD2-CB 3.84Å; R136-T138 HydrophobicContact CG-CG2 4.09Å
137	I	81.7	Confident	74.2	Confident	10 Å²	10	80.8 Å²	80.8	5%	0.051	39%	0.387	C	S	.	.			trans	-74.5	125.8	163.4	-47.8	177.1	0	0	0	108.1	D116 Y120 L126 A129 S130 H135	D116-I137 WeakPolarHBondContact OD1-CG2 3.39Å; Y120-I137 HydrophobicContact CE2-CG2 4.4Å; Y120-I137 WeakPolarHBondContact OH-CD1 3.42Å; L126-I137 HydrophobicContact CD1-CG2 4.46Å; L126-I137 HydrophobicContact CD2-CB 4.25Å; L126-I137 HydrophobicContact CD2-CG2 3.93Å; L126-I137 HydrophobicContact CG-CG2 4.01Å; A129-I137 HydrophobicContact CB-CD1 4.35Å; S130-I137 PolarHBondContact OG-N 3.2Å; S130-I137 PolarHBondContact OG-O 3.39Å; H135-I137 PolarHBondContact O-N 3.43Å
138	T	78	Confident	72	Confident	60 Å²	60	86.8 Å²	86.8	37%	0.368	41%	0.412	S	S	.	.			trans	-115.5	149.2	172.7	51.8	0	0	0	0	110.2	G114 S115 R136 M140	G114-T138 CarbonylContact C-O 3.52Å; S115-T138 WeakPolarHBondContact CB-O 3.46Å; S115-T138 PolarHBondContact N-O 2.88Å; S115-T138 PolarHBondContact OG-N 2.81Å; S115-T138 PolarHBondContact OG-O 2.94Å; S115-T138 PolarHBondContact OG-OG1 2.81Å; R136-T138 HydrophobicContact CG-CG2 4.09Å; T138-M140 PolarHBondContact O-N 2.67Å
139	I	78.8	Confident	70.2	Confident	61 Å²	61	91 Å²	91	31%	0.313	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	120.5	172.4	-66.5	164.5	0	0	0	109.1	V112 C113 H123 L126 H141	V112-I139 HydrophobicContact CB-CD1 4.42Å; V112-I139 HydrophobicContact CB-CG1 4.23Å; V112-I139 HydrophobicContact CB-CG2 4.35Å; V112-I139 HydrophobicContact CG1-CD1 4.33Å; V112-I139 HydrophobicContact CG2-CD1 4.37Å; V112-I139 HydrophobicContact CG2-CG1 4.21Å; C113-I139 CarbonylContact O-C 3.59Å; C113-I139 WeakPolarHBondContact O-CA 3.43Å; H123-I139 HydrophobicContact CB-CD1 4.41Å; H123-I139 VanDerWaalsContact CD2-CD1 3.44Å; H123-I139 WeakPolarHBondContact CD2-CD1 3.25Å; L126-I139 HydrophobicContact CD1-CG1 3.61Å; L126-I139 HydrophobicContact CD2-CG1 4.29Å; I139-H141 WeakPolarHBondContact CG2-O 3.39Å
140	M	72.6	Confident	68.9	Low	115 Å²	115	93.3 Å²	93.3	57%	0.567	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	-44.9	169.6	-76	-173.2	62.6	0	0	111.2	C113 T138	C113-M140 PolarHBondContact O-N 2.96Å; T138-M140 PolarHBondContact O-N 2.67Å
141	H	67.8	Low	67.7	Low	80 Å²	80	97.6 Å²	97.6	37%	0.37	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	142.9	179.6	-65.6	-84.8	0	0	0	110.3	C113 I139 E143 F146	C113-H141 HydrophobicContact CB-CB 4.4Å; C113-H141 PolarHBondContact N-O 2.88Å; I139-H141 WeakPolarHBondContact CG2-O 3.39Å; H141-E143 PolarHBondContact O-N 3.2Å; H141-E143 VanDerWaalsContact O-N 3.1Å; H141-F146 HydrophobicContact CB-CD2 4.38Å; H141-F146 HydrophobicContact CB-CE2 4.17Å; H141-F146 AromaticContact CD2-CD2 3.58Å; H141-F146 AromaticContact CG-CD2 3.74Å; H141-F146 AromaticContact CG-CE2 3.75Å; H141-F146 AromaticContact ND1-CE2 3.8Å; H141-F146 AromaticContact NE2-CD2 3.81Å
142	S	59.1	Low	67	Low	86 Å²	86	97.9 Å²	97.9	60%	0.601	48%	0.475	S	S	*	.	S	Bend	trans	-76.9	16.5	176.2	56.2	0	0	0	0	113.9
143	E	61.3	Low	66.6	Low	134 Å²	134	101 Å²	101	63%	0.626	48%	0.479	S	S	*	.	S	Bend	trans	-147.2	-155.3	-175.3	-61.5	-172	172.2	0	0	107.9	C113 H141	C113-E143 PolarHBondContact N-O 3.36Å; C113-E143 VanDerWaalsContact N-O 3.16Å; H141-E143 PolarHBondContact O-N 3.2Å; H141-E143 VanDerWaalsContact O-N 3.1Å
144	E	58.1	Low	66.1	Low	78 Å²	78	97.1 Å²	97.1	36%	0.364	47%	0.468	S	S	.	.	S	Bend	trans	-62	162.2	-173.2	-68	176	-177.2	0	0	115	F146	E144-F146 PolarHBondContact O-N 3.09Å
145	C	57.2	Low	66	Low	23 Å²	23	100.6 Å²	100.6	16%	0.155	48%	0.479	C	S	.	.			trans	-83.6	110.2	177.7	-78.9	0	0	0	0	112.6	C113 G117 K118 Y147	C113-C145 WeakPolarHBondContact CA-SG 3.3Å; C113-C145 HydrophobicContact CB-CB 3.94Å; C113-C145 WeakPolarHBondContact CB-SG 3.36Å; C113-C145 WeakPolarHBondContact SG-CA 3.27Å; C113-C145 WeakPolarHBondContact SG-CB 3.39Å; C113-C145 CovalentContact SG-SG 2.04Å; C113-C145 PolarHBondContact SG-SG 3.38Å; G117-C145 VanDerWaalsContact C-SG 3.55Å; G117-C145 PolarHBondContact O-SG 2.73Å; K118-C145 PolarHBondContact O-SG 2.85Å; C145-Y147 HydrophobicContact CB-CE2 4.32Å; C145-Y147 PolarHBondContact O-N 2.78Å; C145-Y147 VanDerWaalsContact O-N 3.1Å
146	F	54.3	Low	66	Low	144 Å²	144	95.7 Å²	95.7	63%	0.632	46%	0.457	S	S	*	.			trans	-74.7	93.2	172.2	-59.7	-87	0	0	0	111.1	H141 E144	H141-F146 HydrophobicContact CB-CD2 4.38Å; H141-F146 HydrophobicContact CB-CE2 4.17Å; H141-F146 AromaticContact CD2-CD2 3.58Å; H141-F146 AromaticContact CG-CD2 3.74Å; H141-F146 AromaticContact CG-CE2 3.75Å; H141-F146 AromaticContact ND1-CE2 3.8Å; H141-F146 AromaticContact NE2-CD2 3.81Å; E144-F146 PolarHBondContact O-N 3.09Å
147	Y	49.1	Very low	66.1	Low	142 Å²	142	86.9 Å²	86.9	56%	0.557	42%	0.424	S	S	*	.			trans	-66.8	139.4	153.7	-72.3	-88.5	0	0	0	108.4	G117 C145 D149	G117-Y147 PolarHBondContact O-OH 3.34Å; C145-Y147 HydrophobicContact CB-CE2 4.32Å; C145-Y147 PolarHBondContact O-N 2.78Å; C145-Y147 VanDerWaalsContact O-N 3.1Å; Y147-D149 VanDerWaalsContact C-N 3.3Å; Y147-D149 PolarHBondContact O-N 3.33Å
148	K	40.5	Very low	66.1	Low	199 Å²	199	92.7 Å²	92.7	87%	0.865	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-3.8	-161.9	-145.4	-176.7	178.5	-172.8	0	114.9
149	D	50.9	Low	66.2	Low	158 Å²	158	96.3 Å²	96.3	85%	0.845	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.4	41.5	-174.2	-60.1	-83.5	0	0	0	109.9	Y147	Y147-D149 VanDerWaalsContact C-N 3.3Å; Y147-D149 PolarHBondContact O-N 3.33Å
150	D	57	Low	66.4	Low	64 Å²	64	93.8 Å²	93.8	34%	0.342	44%	0.439	S	S	.	.			trans	-123	99.9	-165.7	-164.2	3.3	0	0	0	111.5	C152 K235	D150-C152 PolarHBondContact O-N 2.97Å; D150-K235 IonicContact OD1-NZ 2.65Å; D150-K235 PolarHBondContact OD1-NZ 2.93Å; D150-K235 WeakPolarHBondContact OD2-CE 3.41Å; D150-K235 IonicContact OD2-NZ 2.64Å; D150-K235 PolarHBondContact OD2-NZ 2.84Å
151	D	62.4	Low	67	Low	94 Å²	94	89.5 Å²	89.5	50%	0.503	42%	0.417	S	S	.	.			trans	-67.9	-31.7	-170.7	-69.5	-28.9	0	0	0	113.1	K223 E227	D151-K223 IonicContact OD2-NZ 3.16Å; D151-K223 PolarHBondContact OD2-NZ 3.4Å; D151-K223 VanDerWaalsContact OD2-NZ 3.16Å; D151-E227 HydrophobicContact CB-CB 4.47Å
152	C	72.5	Confident	67.7	Low	8 Å²	8	89.4 Å²	89.4	5%	0.054	42%	0.422	C	S	.	.			trans	-89	115.6	-168.1	-178.1	0	0	0	0	113.6	D150 C228 D232 Y236	D150-C152 PolarHBondContact O-N 2.97Å; C152-C228 WeakPolarHBondContact CA-SG 3.26Å; C152-C228 HydrophobicContact CB-CB 3.8Å; C152-C228 WeakPolarHBondContact CB-SG 3.22Å; C152-C228 WeakPolarHBondContact SG-CB 3.45Å; C152-C228 CovalentContact SG-SG 2.03Å; C152-C228 PolarHBondContact SG-SG 3.3Å; C152-D232 HydrophobicContact CB-CB 4.47Å; C152-D232 WeakPolarHBondContact CB-OD1 3.27Å; C152-D232 PolarHBondContact SG-OD1 2.98Å; C152-D232 VanDerWaalsContact SG-OD1 3.41Å; C152-Y236 PolarHBondContact O-OH 3.07Å
153	R	76.6	Confident	68.7	Low	174 Å²	174	88.8 Å²	88.8	66%	0.657	41%	0.409	S	S	*	.			trans	-100.2	152.9	175.7	-55.9	178.5	-175.3	-160.1	0.1	111.9	N155 D156 Y157	R153-N155 VanDerWaalsContact C-N 3.26Å; R153-N155 PolarHBondContact O-N 3.03Å; R153-D156 CarbonylContact O-C 3.5Å; R153-D156 PolarHBondContact O-N 2.75Å; R153-Y157 PolarHBondContact O-N 3.49Å
154	L	73.4	Confident	69.8	Low	51 Å²	51	82.4 Å²	82.4	27%	0.267	38%	0.379	S	S	.	.	H	α-helix	trans	-53.3	-34.5	-178.2	-174.5	68.2	0	0	0	114.9	Y157 R158 Y236	L154-Y157 HydrophobicContact CD1-CD1 4.37Å; L154-R158 VanDerWaalsContact O-CG 3.31Å; L154-R158 WeakPolarHBondContact O-CG 3.42Å; L154-R158 PolarHBondContact O-N 3.01Å; L154-Y236 HydrophobicContact CB-CE1 4.33Å; L154-Y236 HydrophobicContact CD1-CD1 4Å; L154-Y236 HydrophobicContact CD1-CE1 3.84Å; L154-Y236 PolarHBondContact N-OH 2.92Å
155	N	76	Confident	71	Confident	106 Å²	106	79.9 Å²	79.9	57%	0.567	37%	0.368	S	S	*	.	H	α-helix	trans	-73	-37.7	176.9	-77.8	-21.9	0	0	0	112.7	R153 R158 R159	R153-N155 VanDerWaalsContact C-N 3.26Å; R153-N155 PolarHBondContact O-N 3.03Å; N155-R158 WeakPolarHBondContact O-CB 3.35Å; N155-R158 PolarHBondContact O-N 2.92Å; N155-R158 PolarHBondContact OD1-NH1 2.03Å; N155-R159 WeakPolarHBondContact O-CB 3.14Å; N155-R159 PolarHBondContact O-N 3.36Å
156	D	79.4	Confident	72.1	Confident	35 Å²	35	81.5 Å²	81.5	19%	0.187	38%	0.375	C	S	.	.	H	α-helix	trans	-77.7	-26.4	177.1	-65.3	-78.5	0	0	0	111.3	R153 R159 L160	R153-D156 CarbonylContact O-C 3.5Å; R153-D156 PolarHBondContact O-N 2.75Å; D156-R159 WeakPolarHBondContact O-CB 3.36Å; D156-R159 PolarHBondContact O-N 2.86Å; D156-R159 IonicContact OD1-NH1 3.76Å; D156-L160 WeakPolarHBondContact O-CB 3.46Å; D156-L160 PolarHBondContact O-N 2.85Å
157	Y	81.5	Confident	73.4	Confident	3 Å²	3	77.1 Å²	77.1	1%	0.012	36%	0.358	C	S	.	.	H	α-helix	trans	-65.3	-46.8	166.8	177.7	-119.4	0	0	0	111.5	R153 L154 R159 L160 K161 C228 D232 L233 Y236 N237	R153-Y157 PolarHBondContact O-N 3.49Å; L154-Y157 HydrophobicContact CD1-CD1 4.37Å; Y157-R159 VanDerWaalsContact C-N 3.28Å; Y157-R159 PolarHBondContact O-N 2.87Å; Y157-L160 WeakPolarHBondContact O-CB 3.21Å; Y157-L160 PolarHBondContact O-N 2.92Å; Y157-K161 HydrophobicContact CD2-CG 4.46Å; Y157-K161 HydrophobicContact CE1-CD 3.85Å; Y157-K161 HydrophobicContact CE1-CG 4.5Å; Y157-K161 HydrophobicContact CE2-CD 4.11Å; Y157-K161 HydrophobicContact CE2-CG 4.05Å; Y157-K161 WeakPolarHBondContact O-CG 2.97Å; Y157-K161 PolarHBondContact O-N 3.42Å; Y157-C228 PolarHBondContact N-SG 2.95Å; Y157-D232 HydrophobicContact CD2-CB 4.06Å; Y157-D232 HydrophobicContact CE2-CB 4.31Å; Y157-D232 WeakPolarHBondContact CE2-O 3.02Å; Y157-L233 HydrophobicContact CE2-CD2 4.08Å; Y157-Y236 HydrophobicContact CD1-CD1 4.22Å; Y157-Y236 AromaticContact CD1-CD2 3.93Å; Y157-Y236 HydrophobicContact CD1-CD2 3.93Å; Y157-Y236 AromaticContact CD1-CG 3.74Å; Y157-Y236 HydrophobicContact CD1-CG 3.74Å; Y157-Y236 AromaticContact CD2-CD2 3.95Å; Y157-Y236 HydrophobicContact CD2-CD2 3.95Å; Y157-Y236 HydrophobicContact CD2-CG 4.47Å; Y157-Y236 HydrophobicContact CE1-CD1 4.47Å; Y157-Y236 HydrophobicContact CE1-CD2 4.24Å; Y157-Y236 AromaticContact CE1-CG 3.81Å; Y157-Y236 HydrophobicContact CE1-CG 3.81Å; Y157-Y236 HydrophobicContact CE2-CD2 4.28Å; Y157-Y236 AromaticContact CG-CD2 3.77Å; Y157-Y236 HydrophobicContact CG-CD2 3.77Å; Y157-Y236 HydrophobicContact CG-CE2 4.17Å; Y157-Y236 HydrophobicContact CG-CG 4.09Å; Y157-Y236 VanDerWaalsContact CZ-CB 3.5Å; Y157-N237 PolarHBondContact OH-OD1 2.84Å
158	R	80.8	Confident	74.9	Confident	131 Å²	131	70.3 Å²	70.3	49%	0.494	33%	0.331	S	S	.	.	H	α-helix	trans	-54.9	-45.7	170.9	-73.4	166	178.5	146	0.9	111.2	L154 N155 K161 T162	L154-R158 VanDerWaalsContact O-CG 3.31Å; L154-R158 WeakPolarHBondContact O-CG 3.42Å; L154-R158 PolarHBondContact O-N 3.01Å; N155-R158 WeakPolarHBondContact O-CB 3.35Å; N155-R158 PolarHBondContact O-N 2.92Å; N155-R158 PolarHBondContact OD1-NH1 2.03Å; R158-K161 PolarHBondContact O-N 3.04Å; R158-T162 PolarHBondContact O-N 2.84Å; R158-T162 PolarHBondContact O-OG1 3.48Å; R158-T162 VanDerWaalsContact O-OG1 3.13Å
159	R	80.3	Confident	76.7	Confident	136 Å²	136	62.1 Å²	62.1	51%	0.513	30%	0.297	S	S	.	.	H	α-helix	trans	-64	-40	178.7	-170.3	-177.9	-177	-158	1.2	112.6	N155 D156 Y157 K163	N155-R159 WeakPolarHBondContact O-CB 3.14Å; N155-R159 PolarHBondContact O-N 3.36Å; D156-R159 WeakPolarHBondContact O-CB 3.36Å; D156-R159 PolarHBondContact O-N 2.86Å; D156-R159 IonicContact OD1-NH1 3.76Å; Y157-R159 VanDerWaalsContact C-N 3.28Å; Y157-R159 PolarHBondContact O-N 2.87Å; R159-K163 WeakPolarHBondContact O-CG 3.45Å; R159-K163 PolarHBondContact O-N 2.87Å
160	L	82.7	Confident	77.9	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.042	28%	0.282	C	S	.	.	H	α-helix	trans	-59.8	-50.8	171.7	168.9	64.3	0	0	0	110.4	D156 Y157 T162 K163 I164 C228 T229	D156-L160 WeakPolarHBondContact O-CB 3.46Å; D156-L160 PolarHBondContact O-N 2.85Å; Y157-L160 WeakPolarHBondContact O-CB 3.21Å; Y157-L160 PolarHBondContact O-N 2.92Å; L160-T162 VanDerWaalsContact C-N 3.33Å; L160-T162 PolarHBondContact O-N 2.77Å; L160-K163 CarbonylContact O-C 3.1Å; L160-K163 WeakPolarHBondContact O-CA 3.46Å; L160-K163 WeakPolarHBondContact O-CB 3.19Å; L160-K163 PolarHBondContact O-N 3.32Å; L160-I164 HydrophobicContact CD1-CD1 3.8Å; L160-I164 HydrophobicContact CD1-CG1 3.9Å; L160-I164 HydrophobicContact CD2-CD1 4.4Å; L160-I164 HydrophobicContact CG-CD1 3.74Å; L160-I164 HydrophobicContact CG-CG1 4.3Å; L160-I164 WeakPolarHBondContact O-CG1 3.32Å; L160-I164 PolarHBondContact O-N 3.48Å; L160-C228 HydrophobicContact CB-CB 4.17Å; L160-C228 HydrophobicContact CD2-CB 3.67Å; L160-T229 WeakPolarHBondContact CD2-O 3.34Å
161	K	86.1	Confident	78.8	Confident	25 Å²	25	62.7 Å²	62.7	11%	0.109	29%	0.286	C	S	.	.	H	α-helix	trans	-57.6	-42.6	179.1	-69.4	-165.1	-66.7	179.6	0	112.9	Y157 R158 K163 I164 L165 L233 A253 F254	Y157-K161 HydrophobicContact CD2-CG 4.46Å; Y157-K161 HydrophobicContact CE1-CD 3.85Å; Y157-K161 HydrophobicContact CE1-CG 4.5Å; Y157-K161 HydrophobicContact CE2-CD 4.11Å; Y157-K161 HydrophobicContact CE2-CG 4.05Å; Y157-K161 WeakPolarHBondContact O-CG 2.97Å; Y157-K161 PolarHBondContact O-N 3.42Å; R158-K161 PolarHBondContact O-N 3.04Å; K161-K163 PolarHBondContact O-N 2.02Å; K161-I164 PolarHBondContact O-N 3.31Å; K161-L165 WeakPolarHBondContact O-CG 3.44Å; K161-L165 PolarHBondContact O-N 2.91Å; K161-L233 HydrophobicContact CD-CD2 4.36Å; K161-L233 HydrophobicContact CG-CD2 4.29Å; K161-A253 HydrophobicContact CD-CB 4.44Å; K161-A253 WeakPolarHBondContact CD-O 3.42Å; K161-A253 WeakPolarHBondContact CE-O 3.48Å; K161-A253 PolarHBondContact NZ-O 3.31Å; K161-F254 HydrophobicContact CB-CD1 4.28Å; K161-F254 HydrophobicContact CB-CE1 4.01Å; K161-F254 HydrophobicContact CG-CE1 4.12Å
162	T	82.6	Confident	79.2	Confident	78 Å²	78	61.9 Å²	61.9	48%	0.479	28%	0.276	S	S	.	.	H	α-helix	trans	-60.8	-42.4	172.7	-49.7	0	0	0	0	112	R158 L160 L165 D166	R158-T162 PolarHBondContact O-N 2.84Å; R158-T162 PolarHBondContact O-OG1 3.48Å; R158-T162 VanDerWaalsContact O-OG1 3.13Å; L160-T162 VanDerWaalsContact C-N 3.33Å; L160-T162 PolarHBondContact O-N 2.77Å; T162-L165 PolarHBondContact O-N 2.88Å; T162-D166 WeakPolarHBondContact O-CB 3.46Å; T162-D166 PolarHBondContact O-N 3.23Å
163	K	80.1	Confident	78.8	Confident	73 Å²	73	65.8 Å²	65.8	32%	0.317	30%	0.296	S	S	.	.	H	α-helix	trans	-68.6	-35.2	178.5	-74.7	-173.3	179	-170.1	0	113.7	R159 L160 K161 D166 L167 V225	R159-K163 WeakPolarHBondContact O-CG 3.45Å; R159-K163 PolarHBondContact O-N 2.87Å; L160-K163 CarbonylContact O-C 3.1Å; L160-K163 WeakPolarHBondContact O-CA 3.46Å; L160-K163 WeakPolarHBondContact O-CB 3.19Å; L160-K163 PolarHBondContact O-N 3.32Å; K161-K163 PolarHBondContact O-N 2.02Å; K163-D166 PolarHBondContact O-N 3.2Å; K163-L167 VanDerWaalsContact O-CB 3.27Å; K163-L167 WeakPolarHBondContact O-CB 3.4Å; K163-L167 PolarHBondContact O-N 2.93Å; K163-V225 HydrophobicContact CD-CG1 3.44Å; K163-V225 VanDerWaalsContact CD-CG1 3.44Å; K163-V225 PolarHBondContact NZ-O 2.83Å
164	I	83.7	Confident	77.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.9	-48.4	174.5	-67	163.6	0	0	0	109.4	L160 K161 L167 H168 M195 L230 F254	L160-I164 HydrophobicContact CD1-CD1 3.8Å; L160-I164 HydrophobicContact CD1-CG1 3.9Å; L160-I164 HydrophobicContact CD2-CD1 4.4Å; L160-I164 HydrophobicContact CG-CD1 3.74Å; L160-I164 HydrophobicContact CG-CG1 4.3Å; L160-I164 WeakPolarHBondContact O-CG1 3.32Å; L160-I164 PolarHBondContact O-N 3.48Å; K161-I164 PolarHBondContact O-N 3.31Å; I164-L167 PolarHBondContact O-N 3.13Å; I164-H168 PolarHBondContact O-N 2.94Å; I164-H168 PolarHBondContact O-ND1 3.09Å; I164-M195 HydrophobicContact CG2-CE 3.61Å; I164-L230 HydrophobicContact CD1-CD1 3.47Å; I164-L230 VanDerWaalsContact CD1-CD1 3.47Å; I164-L230 HydrophobicContact CG1-CD1 4.19Å; I164-F254 HydrophobicContact CB-CE1 4.16Å; I164-F254 HydrophobicContact CB-CZ 4.46Å; I164-F254 HydrophobicContact CD1-CE1 4.41Å; I164-F254 HydrophobicContact CD1-CZ 4.24Å; I164-F254 HydrophobicContact CG2-CE1 4.07Å; I164-F254 HydrophobicContact CG2-CZ 4.01Å
165	L	84	Confident	76.7	Confident	26 Å²	26	61 Å²	61	14%	0.136	31%	0.305	C	S	.	.	H	α-helix	trans	-59.1	-52.5	175.4	-68.7	167.6	0	0	0	111.6	K161 T162 L167 H168 D169 L191 V192 M195 F254	K161-L165 WeakPolarHBondContact O-CG 3.44Å; K161-L165 PolarHBondContact O-N 2.91Å; T162-L165 PolarHBondContact O-N 2.88Å; L165-L167 PolarHBondContact O-N 3.23Å; L165-H168 PolarHBondContact O-N 3.21Å; L165-D169 WeakPolarHBondContact O-CB 3.49Å; L165-D169 PolarHBondContact O-N 2.74Å; L165-L191 HydrophobicContact CD2-CD2 4.09Å; L165-V192 HydrophobicContact CD2-CG2 3.83Å; L165-M195 HydrophobicContact CD2-CE 4.29Å; L165-M195 HydrophobicContact CD2-SD 3.8Å; L165-F254 HydrophobicContact CD1-CD1 3.99Å; L165-F254 HydrophobicContact CD2-CB 4.47Å; L165-F254 HydrophobicContact CD2-CD1 3.94Å; L165-F254 HydrophobicContact CD2-CG 4.37Å; L165-F254 HydrophobicContact CG-CD1 3.79Å; L165-F254 HydrophobicContact CG-CE1 4.29Å
166	D	80.9	Confident	75.4	Confident	56 Å²	56	61.3 Å²	61.3	30%	0.299	32%	0.322	S	S	.	.	H	α-helix	trans	-57.9	-29.8	178.5	-91.6	6.6	0	0	0	113.3	T162 K163 K170	T162-D166 WeakPolarHBondContact O-CB 3.46Å; T162-D166 PolarHBondContact O-N 3.23Å; K163-D166 PolarHBondContact O-N 3.2Å; D166-K170 WeakPolarHBondContact O-CD 3.49Å; D166-K170 VanDerWaalsContact O-CE 3.28Å; D166-K170 WeakPolarHBondContact O-CE 3.14Å; D166-K170 VanDerWaalsContact O-CG 3.24Å; D166-K170 WeakPolarHBondContact O-CG 2.97Å
167	L	80.9	Confident	74	Confident	52 Å²	52	60.5 Å²	60.5	27%	0.272	32%	0.322	S	S	.	.	H	α-helix	trans	-79.5	-41.8	178.6	-177.7	148.9	0	0	0	111.6	K163 I164 L165 R171 L221	K163-L167 VanDerWaalsContact O-CB 3.27Å; K163-L167 WeakPolarHBondContact O-CB 3.4Å; K163-L167 PolarHBondContact O-N 2.93Å; I164-L167 PolarHBondContact O-N 3.13Å; L165-L167 PolarHBondContact O-N 3.23Å; L167-R171 WeakPolarHBondContact O-CB 3.49Å; L167-R171 PolarHBondContact O-N 3.5Å; L167-L221 HydrophobicContact CD1-CD2 3.97Å
168	H	81.5	Confident	72.3	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-68.9	-42.3	177.9	-78	73.1	0	0	0	112.1	I164 L165 K170 R171 Y172 L191 M195 F199 E219	I164-H168 PolarHBondContact O-N 2.94Å; I164-H168 PolarHBondContact O-ND1 3.09Å; L165-H168 PolarHBondContact O-N 3.21Å; H168-K170 PolarHBondContact O-N 3.18Å; H168-R171 PolarHBondContact O-N 2.87Å; H168-R171 VanDerWaalsContact O-N 3.14Å; H168-Y172 HydrophobicContact CB-CD2 4.16Å; H168-Y172 HydrophobicContact CB-CE2 4.5Å; H168-Y172 AromaticContact CD2-CD2 3.99Å; H168-Y172 AromaticContact CD2-CE2 3.59Å; H168-Y172 WeakPolarHBondContact O-CB 3.41Å; H168-Y172 VanDerWaalsContact O-CD2 3.25Å; H168-Y172 WeakPolarHBondContact O-CD2 2.98Å; H168-Y172 PolarHBondContact O-N 2.71Å; H168-L191 HydrophobicContact CB-CD1 3.9Å; H168-L191 HydrophobicContact CB-CD2 4.46Å; H168-L191 HydrophobicContact CB-CG 4.33Å; H168-M195 HydrophobicContact CB-CG 4.17Å; H168-M195 HydrophobicContact CB-SD 4.3Å; H168-M195 WeakPolarHBondContact CD2-CG 3.42Å; H168-F199 AromaticContact CE1-CE1 3.97Å; H168-F199 AromaticContact NE2-CE1 3.54Å; H168-E219 IonicContact CE1-OE2 3.46Å; H168-E219 PolarHBondContact CE1-OE2 3.48Å; H168-E219 IonicContact NE2-OE1 3.55Å; H168-E219 IonicContact NE2-OE2 3.64Å; H168-E219 PolarHBondContact NE2-OE2 2.99Å; H168-E219 VanDerWaalsContact NE2-OE2 3.1Å
169	D	77.6	Confident	70.8	Confident	27 Å²	27	62.9 Å²	62.9	14%	0.144	35%	0.354	C	S	.	.	H	α-helix	trans	-52.4	-54	175.4	178.1	79.5	0	0	0	111.2	L165 R171 Y172 L173 H181 L191	L165-D169 WeakPolarHBondContact O-CB 3.49Å; L165-D169 PolarHBondContact O-N 2.74Å; D169-R171 VanDerWaalsContact C-N 3.3Å; D169-R171 PolarHBondContact O-N 3Å; D169-Y172 PolarHBondContact O-N 2.93Å; D169-L173 PolarHBondContact O-N 3.1Å; D169-H181 IonicContact OD1-CD2 3.82Å; D169-H181 PolarHBondContact OD1-CD2 2.81Å; D169-H181 VanDerWaalsContact OD1-CD2 3.31Å; D169-H181 IonicContact OD1-CG 2.79Å; D169-L191 HydrophobicContact CB-CD2 4Å
170	K	76.4	Confident	68.9	Low	123 Å²	123	59.8 Å²	59.8	54%	0.535	36%	0.358	S	S	.	.	H	α-helix	trans	-58.9	-37.5	177.2	-70.8	167.7	-163.9	161.4	0	113.3	D166 H168	D166-K170 WeakPolarHBondContact O-CD 3.49Å; D166-K170 VanDerWaalsContact O-CE 3.28Å; D166-K170 WeakPolarHBondContact O-CE 3.14Å; D166-K170 VanDerWaalsContact O-CG 3.24Å; D166-K170 WeakPolarHBondContact O-CG 2.97Å; H168-K170 PolarHBondContact O-N 3.18Å
171	R	74.9	Confident	67.4	Low	111 Å²	111	62.4 Å²	62.4	42%	0.419	37%	0.37	S	S	.	.	H	α-helix	trans	-78.2	-31.2	-176.9	-177.4	172.1	-74.7	157.8	-0	113.2	L167 H168 D169 E219	L167-R171 WeakPolarHBondContact O-CB 3.49Å; L167-R171 PolarHBondContact O-N 3.5Å; H168-R171 PolarHBondContact O-N 2.87Å; H168-R171 VanDerWaalsContact O-N 3.14Å; D169-R171 VanDerWaalsContact C-N 3.3Å; D169-R171 PolarHBondContact O-N 3Å; R171-E219 IonicContact CZ-OE1 3.78Å; R171-E219 PolarHBondContact NH1-O 3.1Å; R171-E219 IonicContact NH1-OE1 2.68Å; R171-E219 PolarHBondContact NH1-OE1 2.91Å; R171-E219 IonicContact NH1-OE2 3.73Å; R171-E219 PolarHBondContact NH2-O 2.88Å
172	Y	70.7	Confident	65.7	Low	77 Å²	77	69 Å²	69	30%	0.302	40%	0.398	S	S	.	.	H	α-helix	trans	-118.3	-17.6	-166.1	-63.5	-59.5	0	0	0	116.1	H168 D169 L194 E219	H168-Y172 HydrophobicContact CB-CD2 4.16Å; H168-Y172 HydrophobicContact CB-CE2 4.5Å; H168-Y172 AromaticContact CD2-CD2 3.99Å; H168-Y172 AromaticContact CD2-CE2 3.59Å; H168-Y172 WeakPolarHBondContact O-CB 3.41Å; H168-Y172 VanDerWaalsContact O-CD2 3.25Å; H168-Y172 WeakPolarHBondContact O-CD2 2.98Å; H168-Y172 PolarHBondContact O-N 2.71Å; D169-Y172 PolarHBondContact O-N 2.93Å; Y172-L194 HydrophobicContact CD1-CD2 4.27Å; Y172-L194 HydrophobicContact CD2-CD2 4.12Å; Y172-L194 HydrophobicContact CG-CD2 3.75Å; Y172-E219 PolarHBondContact OH-OE1 2.96Å; Y172-E219 VanDerWaalsContact OH-OE1 3.1Å
173	L	65.4	Low	64.4	Low	89 Å²	89	72.6 Å²	72.6	47%	0.466	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-19.6	179.5	-63.7	176.5	0	0	0	114.1	D169	D169-L173 PolarHBondContact O-N 3.1Å
174	G	55.1	Low	63.8	Low	34 Å²	34	71.5 Å²	71.5	35%	0.351	42%	0.416	S	S	.	.			trans	77.6	174.1	167.4	0	0	0	0	0	116	A176 G177	G174-A176 PolarHBondContact O-N 2.92Å; G174-G177 PolarHBondContact O-N 3.35Å
175	A	50.7	Low	63.5	Low	92 Å²	92	73 Å²	73	76%	0.76	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-5	-164.2	0	0	0	0	0	116.2
176	A	48	Very low	62.8	Low	111 Å²	111	73.3 Å²	73.3	92%	0.917	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-13.8	179.2	0	0	0	0	0	114	G174	G174-A176 PolarHBondContact O-N 2.92Å
177	G	51.1	Low	62.6	Low	19 Å²	19	71.1 Å²	71.1	20%	0.196	42%	0.42	C	S	.	.			trans	-111.4	6.7	-173.8	0	0	0	0	0	116.2	G174 G179 A180	G174-G177 PolarHBondContact O-N 3.35Å; G177-G179 PolarHBondContact O-N 3.03Å; G177-A180 PolarHBondContact O-N 3.16Å
178	H	44.8	Very low	62.6	Low	125 Å²	125	71 Å²	71	58%	0.579	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	108.8	-170.6	-87.7	-5.2	0	0	0	113.7
179	G	48.3	Very low	62.6	Low	58 Å²	58	73.6 Å²	73.6	60%	0.598	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	116.4	-35.4	176.4	0	0	0	0	0	113.8	G177 H181	G177-G179 PolarHBondContact O-N 3.03Å; G179-H181 VanDerWaalsContact C-N 3.28Å; G179-H181 PolarHBondContact O-N 2.75Å
180	A	41.7	Very low	62.9	Low	71 Å²	71	78.6 Å²	78.6	59%	0.587	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-16.4	-169.4	0	0	0	0	0	115.1	G177	G177-A180 PolarHBondContact O-N 3.16Å
181	H	51.8	Low	63.4	Low	64 Å²	64	73.3 Å²	73.3	30%	0.296	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-6.5	-172.8	-63.3	-43.1	0	0	0	115.3	D169 G179 D183 A187	D169-H181 IonicContact OD1-CD2 3.82Å; D169-H181 PolarHBondContact OD1-CD2 2.81Å; D169-H181 VanDerWaalsContact OD1-CD2 3.31Å; D169-H181 IonicContact OD1-CG 2.79Å; G179-H181 VanDerWaalsContact C-N 3.28Å; G179-H181 PolarHBondContact O-N 2.75Å; H181-D183 VanDerWaalsContact C-N 3.29Å; H181-D183 PolarHBondContact O-N 2.83Å; H181-A187 HydrophobicContact CB-CB 4.41Å; H181-A187 WeakPolarHBondContact ND1-CB 3.45Å
182	K	50.1	Low	64	Low	162 Å²	162	68 Å²	68	70%	0.704	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-26.2	177.4	-80.4	-170.5	170.9	-178.2	0	113.9
183	D	54.2	Low	64.8	Low	154 Å²	154	65.9 Å²	65.9	82%	0.824	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	5.1	-172.1	-50.7	-37.2	0	0	0	113.2	H181	H181-D183 VanDerWaalsContact C-N 3.29Å; H181-D183 PolarHBondContact O-N 2.83Å
184	S	68.4	Low	65.9	Low	50 Å²	50	64.5 Å²	64.5	35%	0.35	40%	0.395	S	S	.	.			trans	-121.5	101.3	-178.7	-170	0	0	0	0	112.9	A186 A187 K188	S184-A186 PolarHBondContact O-N 3.21Å; S184-A187 WeakPolarHBondContact O-CB 3.4Å; S184-A187 PolarHBondContact O-N 2.83Å; S184-K188 PolarHBondContact O-N 2.79Å; S184-K188 VanDerWaalsContact O-N 3.1Å
185	M	76.3	Confident	67.5	Low	32 Å²	32	62.9 Å²	62.9	16%	0.158	38%	0.378	C	S	.	.	H	α-helix	trans	-58.9	-31.7	177.8	-168.6	59.9	-129.4	0	0	112.8	A187 K188 K189 D255 V256 Y338	M185-A187 PolarHBondContact O-N 2.89Å; M185-K188 HydrophobicContact CE-CB 4.15Å; M185-K188 HydrophobicContact CE-CD 3.85Å; M185-K188 HydrophobicContact CE-CG 4.23Å; M185-K188 PolarHBondContact O-N 2.97Å; M185-K188 HydrophobicContact SD-CB 4.41Å; M185-K188 HydrophobicContact SD-CD 3.84Å; M185-K189 WeakPolarHBondContact O-CB 3.3Å; M185-K189 PolarHBondContact O-N 3.02Å; M185-D255 VanDerWaalsContact CE-O 3.3Å; M185-D255 WeakPolarHBondContact CE-O 3.44Å; M185-V256 HydrophobicContact CE-CB 4.05Å; M185-V256 HydrophobicContact CE-CG1 4.21Å; M185-V256 HydrophobicContact CE-CG2 3.7Å; M185-Y338 HydrophobicContact CB-CE2 4.49Å; M185-Y338 HydrophobicContact CG-CD2 4.09Å; M185-Y338 HydrophobicContact CG-CE2 3.45Å; M185-Y338 VanDerWaalsContact CG-CE2 3.45Å
186	A	69.9	Low	69.4	Low	32 Å²	32	58.9 Å²	58.9	26%	0.264	34%	0.344	S	S	.	.	H	α-helix	trans	-61.1	-39.7	173.3	0	0	0	0	0	112.9	S184 Q190 G337	S184-A186 PolarHBondContact O-N 3.21Å; A186-Q190 WeakPolarHBondContact O-CG 3.33Å; A186-Q190 PolarHBondContact O-N 3.27Å; A186-Q190 VanDerWaalsContact O-N 3.08Å; A186-G337 PolarHBondContact N-O 3.3Å
187	A	76.3	Confident	71.4	Confident	11 Å²	11	59.5 Å²	59.5	9%	0.091	33%	0.326	C	S	.	.	H	α-helix	trans	-72.2	-43.1	175.1	0	0	0	0	0	111.4	H181 S184 M185 K189 Q190 L191	H181-A187 HydrophobicContact CB-CB 4.41Å; H181-A187 WeakPolarHBondContact ND1-CB 3.45Å; S184-A187 WeakPolarHBondContact O-CB 3.4Å; S184-A187 PolarHBondContact O-N 2.83Å; M185-A187 PolarHBondContact O-N 2.89Å; A187-K189 VanDerWaalsContact C-N 3.26Å; A187-K189 PolarHBondContact O-N 2.8Å; A187-Q190 PolarHBondContact O-N 3.17Å; A187-Q190 VanDerWaalsContact O-N 3.08Å; A187-L191 PolarHBondContact O-N 2.97Å
188	K	82.3	Confident	73	Confident	50 Å²	50	65.5 Å²	65.5	22%	0.217	34%	0.342	C	S	.	.	H	α-helix	trans	-55.3	-42.7	172.8	-169	-174.1	-177.4	-154.7	0	111.2	S184 M185 L191 V192 F254 D255	S184-K188 PolarHBondContact O-N 2.79Å; S184-K188 VanDerWaalsContact O-N 3.1Å; M185-K188 HydrophobicContact CE-CB 4.15Å; M185-K188 HydrophobicContact CE-CD 3.85Å; M185-K188 HydrophobicContact CE-CG 4.23Å; M185-K188 PolarHBondContact O-N 2.97Å; M185-K188 HydrophobicContact SD-CB 4.41Å; M185-K188 HydrophobicContact SD-CD 3.84Å; K188-L191 PolarHBondContact O-N 3.16Å; K188-V192 WeakPolarHBondContact O-CG2 3.4Å; K188-V192 PolarHBondContact O-N 3.33Å; K188-F254 WeakPolarHBondContact CE-O 3.34Å; K188-F254 PolarHBondContact NZ-O 3.34Å; K188-D255 IonicContact NZ-OD2 3.84Å; K188-D255 PolarHBondContact NZ-OD2 2.83Å
189	K	81.6	Confident	75.1	Confident	53 Å²	53	59.6 Å²	59.6	23%	0.23	32%	0.315	C	S	.	.	H	α-helix	trans	-61.1	-49.7	172.8	178	165.2	-179.5	169.9	0	111.7	M185 A187 L191 V192 D193 V256 Y338	M185-K189 WeakPolarHBondContact O-CB 3.3Å; M185-K189 PolarHBondContact O-N 3.02Å; A187-K189 VanDerWaalsContact C-N 3.26Å; A187-K189 PolarHBondContact O-N 2.8Å; K189-L191 VanDerWaalsContact C-N 3.26Å; K189-L191 PolarHBondContact O-N 3.1Å; K189-V192 PolarHBondContact O-N 2.91Å; K189-D193 WeakPolarHBondContact O-CB 3.24Å; K189-D193 PolarHBondContact O-N 2.79Å; K189-V256 HydrophobicContact CB-CG1 3.95Å; K189-V256 HydrophobicContact CD-CG1 4.03Å; K189-V256 HydrophobicContact CG-CG1 3.81Å; K189-Y338 HydrophobicContact CD-CE1 3.95Å
190	Q	82.1	Confident	77.1	Confident	132 Å²	132	57.6 Å²	57.6	62%	0.617	29%	0.291	S	S	*	.	H	α-helix	trans	-59.2	-36.2	178.3	-73.3	-177.6	-68.5	0	0	113	A186 A187 L194	A186-Q190 WeakPolarHBondContact O-CG 3.33Å; A186-Q190 PolarHBondContact O-N 3.27Å; A186-Q190 VanDerWaalsContact O-N 3.08Å; A187-Q190 PolarHBondContact O-N 3.17Å; A187-Q190 VanDerWaalsContact O-N 3.08Å; Q190-L194 PolarHBondContact O-N 2.82Å; Q190-L194 VanDerWaalsContact O-N 3.14Å
191	L	87.1	Confident	79.2	Confident	13 Å²	13	57.7 Å²	57.7	7%	0.068	28%	0.283	C	S	.	.	H	α-helix	trans	-66.3	-46.2	175.2	-172.9	63.2	0	0	0	111.7	L165 H168 D169 A187 K188 K189 L194 M195	L165-L191 HydrophobicContact CD2-CD2 4.09Å; H168-L191 HydrophobicContact CB-CD1 3.9Å; H168-L191 HydrophobicContact CB-CD2 4.46Å; H168-L191 HydrophobicContact CB-CG 4.33Å; D169-L191 HydrophobicContact CB-CD2 4Å; A187-L191 PolarHBondContact O-N 2.97Å; K188-L191 PolarHBondContact O-N 3.16Å; K189-L191 VanDerWaalsContact C-N 3.26Å; K189-L191 PolarHBondContact O-N 3.1Å; L191-L194 WeakPolarHBondContact O-CB 3.36Å; L191-L194 PolarHBondContact O-N 3.09Å; L191-L194 VanDerWaalsContact O-N 3.08Å; L191-M195 HydrophobicContact CG-SD 4.14Å; L191-M195 VanDerWaalsContact O-CG 3.31Å; L191-M195 WeakPolarHBondContact O-CG 3.29Å; L191-M195 PolarHBondContact O-N 3.04Å
192	V	88.6	Confident	81	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-68.7	-33.7	177.1	174.1	0	0	0	0	111.8	L165 K188 K189 L194 M195 F196 F250 Y251 F254 V256	L165-V192 HydrophobicContact CD2-CG2 3.83Å; K188-V192 WeakPolarHBondContact O-CG2 3.4Å; K188-V192 PolarHBondContact O-N 3.33Å; K189-V192 PolarHBondContact O-N 2.91Å; V192-L194 PolarHBondContact O-N 3Å; V192-M195 HydrophobicContact CG2-SD 4.09Å; V192-M195 PolarHBondContact O-N 2.92Å; V192-F196 WeakPolarHBondContact O-CB 3.43Å; V192-F196 PolarHBondContact O-N 3.43Å; V192-F250 HydrophobicContact CG1-CD1 3.97Å; V192-F250 HydrophobicContact CG1-CE1 3.99Å; V192-Y251 HydrophobicContact CG1-CD1 3.78Å; V192-Y251 HydrophobicContact CG1-CE1 3.93Å; V192-Y251 HydrophobicContact CG1-CG 4.2Å; V192-F254 HydrophobicContact CG1-CB 4.32Å; V192-F254 HydrophobicContact CG1-CD2 4.4Å; V192-F254 HydrophobicContact CG2-CB 3.55Å; V192-F254 HydrophobicContact CG2-CD2 4.41Å; V192-F254 HydrophobicContact CG2-CG 4.05Å; V192-V256 HydrophobicContact CB-CG2 3.86Å; V192-V256 HydrophobicContact CG1-CG2 3.98Å; V192-V256 HydrophobicContact CG2-CG2 3.77Å
193	D	86.6	Confident	82.7	Confident	31 Å²	31	61.9 Å²	61.9	17%	0.166	30%	0.3	C	S	.	.	H	α-helix	trans	-61.6	-26.5	169.6	-116.8	92.1	0	0	0	112.7	K189 K197 R247 Y251	K189-D193 WeakPolarHBondContact O-CB 3.24Å; K189-D193 PolarHBondContact O-N 2.79Å; D193-K197 VanDerWaalsContact O-CD 3.29Å; D193-K197 WeakPolarHBondContact O-CD 3.31Å; D193-K197 WeakPolarHBondContact O-CE 3.47Å; D193-K197 VanDerWaalsContact O-CG 3.31Å; D193-K197 WeakPolarHBondContact O-CG 3.42Å; D193-K197 PolarHBondContact O-NZ 3.28Å; D193-K197 IonicContact OD2-NZ 2.77Å; D193-K197 PolarHBondContact OD2-NZ 2.83Å; D193-R247 IonicContact OD1-NH2 2.97Å; D193-R247 PolarHBondContact OD1-NH2 2.85Å; D193-R247 IonicContact OD2-NH2 3.17Å; D193-R247 PolarHBondContact OD2-NH2 3.12Å; D193-Y251 WeakPolarHBondContact CA-OH 3.4Å; D193-Y251 PolarHBondContact OD1-OH 2.61Å
194	L	88	Confident	84.3	Confident	61 Å²	61	57.9 Å²	57.9	32%	0.319	28%	0.279	S	S	.	.	H	α-helix	trans	-87.3	-43.6	174.4	-176.4	68.6	0	0	0	111.6	Y172 Q190 L191 V192 F196 K197 R198	Y172-L194 HydrophobicContact CD1-CD2 4.27Å; Y172-L194 HydrophobicContact CD2-CD2 4.12Å; Y172-L194 HydrophobicContact CG-CD2 3.75Å; Q190-L194 PolarHBondContact O-N 2.82Å; Q190-L194 VanDerWaalsContact O-N 3.14Å; L191-L194 WeakPolarHBondContact O-CB 3.36Å; L191-L194 PolarHBondContact O-N 3.09Å; L191-L194 VanDerWaalsContact O-N 3.08Å; V192-L194 PolarHBondContact O-N 3Å; L194-F196 PolarHBondContact O-N 2.59Å; L194-K197 CarbonylContact O-C 3.57Å; L194-K197 PolarHBondContact O-N 3.41Å; L194-R198 WeakPolarHBondContact O-CG 3.27Å; L194-R198 PolarHBondContact O-N 2.78Å
195	M	90.1	Very high	85.3	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-55	-49.8	174.9	-72.4	163.3	57.7	0	0	111.3	I164 L165 H168 L191 V192 K197 R198 F199 F250 F254	I164-M195 HydrophobicContact CG2-CE 3.61Å; L165-M195 HydrophobicContact CD2-CE 4.29Å; L165-M195 HydrophobicContact CD2-SD 3.8Å; H168-M195 HydrophobicContact CB-CG 4.17Å; H168-M195 HydrophobicContact CB-SD 4.3Å; H168-M195 WeakPolarHBondContact CD2-CG 3.42Å; L191-M195 HydrophobicContact CG-SD 4.14Å; L191-M195 VanDerWaalsContact O-CG 3.31Å; L191-M195 WeakPolarHBondContact O-CG 3.29Å; L191-M195 PolarHBondContact O-N 3.04Å; V192-M195 HydrophobicContact CG2-SD 4.09Å; V192-M195 PolarHBondContact O-N 2.92Å; M195-K197 VanDerWaalsContact C-N 3.34Å; M195-K197 PolarHBondContact O-N 3.16Å; M195-R198 WeakPolarHBondContact O-CA 3.46Å; M195-R198 WeakPolarHBondContact O-CB 3.39Å; M195-R198 PolarHBondContact O-N 3.11Å; M195-F199 WeakPolarHBondContact O-CD1 3.46Å; M195-F199 PolarHBondContact O-N 2.79Å; M195-F250 HydrophobicContact CB-CE1 3.95Å; M195-F250 HydrophobicContact CB-CZ 4.03Å; M195-F250 HydrophobicContact CE-CE1 4.34Å; M195-F250 HydrophobicContact CE-CZ 4.11Å; M195-F254 HydrophobicContact CE-CD1 4.14Å; M195-F254 HydrophobicContact CE-CD2 3.91Å; M195-F254 HydrophobicContact CE-CE1 3.79Å; M195-F254 HydrophobicContact CE-CE2 3.56Å; M195-F254 HydrophobicContact CE-CG 4.2Å; M195-F254 HydrophobicContact CE-CZ 3.49Å; M195-F254 VanDerWaalsContact CE-CZ 3.49Å
196	F	90.6	Very high	86	Confident	8 Å²	8	65.7 Å²	65.7	4%	0.035	30%	0.303	C	S	.	.	H	α-helix	trans	-55.5	-49.4	178.7	-171.1	-88.4	0	0	0	111	V192 L194 R198 F199 D200 R205 I207 R247 F250 Y251	V192-F196 WeakPolarHBondContact O-CB 3.43Å; V192-F196 PolarHBondContact O-N 3.43Å; L194-F196 PolarHBondContact O-N 2.59Å; F196-R198 PolarHBondContact O-N 2.86Å; F196-F199 PolarHBondContact O-N 3.27Å; F196-F199 VanDerWaalsContact O-N 3.1Å; F196-D200 HydrophobicContact CD1-CB 4.29Å; F196-D200 HydrophobicContact CE1-CB 3.98Å; F196-D200 HydrophobicContact CZ-CB 4.46Å; F196-D200 VanDerWaalsContact O-CB 3.23Å; F196-D200 WeakPolarHBondContact O-CB 3.48Å; F196-D200 PolarHBondContact O-N 2.81Å; F196-R205 WeakPolarHBondContact CZ-O 3.47Å; F196-I207 HydrophobicContact CD2-CD1 3.5Å; F196-I207 VanDerWaalsContact CD2-CD1 3.5Å; F196-I207 HydrophobicContact CD2-CG1 4.32Å; F196-I207 HydrophobicContact CE2-CD1 3.53Å; F196-I207 HydrophobicContact CE2-CG1 3.92Å; F196-I207 HydrophobicContact CG-CD1 4.32Å; F196-I207 HydrophobicContact CZ-CD1 4.38Å; F196-I207 HydrophobicContact CZ-CG1 4.36Å; F196-R247 HydrophobicContact CD1-CG 4.5Å; F196-R247 HydrophobicContact CD2-CG 4.41Å; F196-R247 HydrophobicContact CE1-CB 4.33Å; F196-R247 HydrophobicContact CE1-CG 4.41Å; F196-R247 VanDerWaalsContact CE2-CA 3.47Å; F196-R247 HydrophobicContact CE2-CB 3.99Å; F196-R247 HydrophobicContact CE2-CG 4.33Å; F196-R247 HydrophobicContact CZ-CB 3.87Å; F196-R247 HydrophobicContact CZ-CG 4.33Å; F196-F250 HydrophobicContact CB-CD1 4.07Å; F196-F250 HydrophobicContact CB-CE1 4.04Å; F196-F250 HydrophobicContact CD2-CB 3.83Å; F196-F250 AromaticContact CD2-CD1 3.68Å; F196-F250 HydrophobicContact CD2-CD1 3.68Å; F196-F250 HydrophobicContact CD2-CE1 4.33Å; F196-F250 AromaticContact CD2-CG 3.77Å; F196-F250 HydrophobicContact CD2-CG 3.77Å; F196-F250 HydrophobicContact CE2-CB 4.07Å; F196-F250 HydrophobicContact CE2-CG 4.4Å; F196-F250 HydrophobicContact CG-CD1 4.39Å; F196-Y251 HydrophobicContact CB-CE1 3.97Å; F196-Y251 HydrophobicContact CD2-CE1 4.24Å; F196-Y251 HydrophobicContact CG-CE1 4.13Å
197	K	88.9	Confident	86.9	Confident	124 Å²	124	64.2 Å²	64.2	54%	0.539	29%	0.29	S	S	.	.	H	α-helix	trans	-69.3	3.2	176.8	-62.1	174.7	-167.6	116.6	0	115.1	D193 L194 M195	D193-K197 VanDerWaalsContact O-CD 3.29Å; D193-K197 WeakPolarHBondContact O-CD 3.31Å; D193-K197 WeakPolarHBondContact O-CE 3.47Å; D193-K197 VanDerWaalsContact O-CG 3.31Å; D193-K197 WeakPolarHBondContact O-CG 3.42Å; D193-K197 PolarHBondContact O-NZ 3.28Å; D193-K197 IonicContact OD2-NZ 2.77Å; D193-K197 PolarHBondContact OD2-NZ 2.83Å; L194-K197 CarbonylContact O-C 3.57Å; L194-K197 PolarHBondContact O-N 3.41Å; M195-K197 VanDerWaalsContact C-N 3.34Å; M195-K197 PolarHBondContact O-N 3.16Å
198	R	85.7	Confident	87.6	Confident	145 Å²	145	65.7 Å²	65.7	55%	0.547	30%	0.297	S	S	.	.	H	α-helix	trans	-113.6	-22.2	173.3	-72.8	-63.7	-170.3	177.4	0.7	112.6	L194 M195 F196	L194-R198 WeakPolarHBondContact O-CG 3.27Å; L194-R198 PolarHBondContact O-N 2.78Å; M195-R198 WeakPolarHBondContact O-CA 3.46Å; M195-R198 WeakPolarHBondContact O-CB 3.39Å; M195-R198 PolarHBondContact O-N 3.11Å; F196-R198 PolarHBondContact O-N 2.86Å
199	F	89.1	Confident	87.7	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-90.1	-41.4	175.8	-73.4	36.7	0	0	0	109.6	H168 M195 F196 V201 I207 E211 L212 V215 L230 L233 F250	H168-F199 AromaticContact CE1-CE1 3.97Å; H168-F199 AromaticContact NE2-CE1 3.54Å; M195-F199 WeakPolarHBondContact O-CD1 3.46Å; M195-F199 PolarHBondContact O-N 2.79Å; F196-F199 PolarHBondContact O-N 3.27Å; F196-F199 VanDerWaalsContact O-N 3.1Å; F199-V201 PolarHBondContact O-N 2.76Å; F199-I207 HydrophobicContact CB-CD1 3.51Å; F199-I207 HydrophobicContact CB-CG1 3.87Å; F199-I207 HydrophobicContact CB-CG2 3.92Å; F199-I207 HydrophobicContact CD2-CD1 4.3Å; F199-I207 HydrophobicContact CD2-CG2 4.38Å; F199-I207 HydrophobicContact CG-CD1 4.34Å; F199-E211 WeakPolarHBondContact O-CB 3Å; F199-L212 HydrophobicContact CD2-CD2 3.61Å; F199-L212 HydrophobicContact CE2-CD2 4Å; F199-V215 HydrophobicContact CB-CG2 4.25Å; F199-V215 HydrophobicContact CD1-CG1 4.02Å; F199-V215 HydrophobicContact CD1-CG2 3.71Å; F199-V215 HydrophobicContact CD2-CG2 4.38Å; F199-V215 HydrophobicContact CE1-CG1 3.58Å; F199-V215 HydrophobicContact CE1-CG2 4.16Å; F199-V215 HydrophobicContact CE2-CG1 4.32Å; F199-V215 HydrophobicContact CG-CG2 3.84Å; F199-V215 HydrophobicContact CZ-CG1 3.76Å; F199-L230 HydrophobicContact CE2-CD1 4.1Å; F199-L230 HydrophobicContact CE2-CD2 3.96Å; F199-L230 HydrophobicContact CE2-CG 4.35Å; F199-L230 HydrophobicContact CZ-CD1 4.33Å; F199-L230 HydrophobicContact CZ-CD2 4.25Å; F199-L233 HydrophobicContact CE2-CD1 4.12Å; F199-F250 AromaticContact CD2-CE2 3.49Å; F199-F250 HydrophobicContact CD2-CE2 3.49Å; F199-F250 VanDerWaalsContact CD2-CE2 3.49Å; F199-F250 AromaticContact CD2-CZ 3.78Å; F199-F250 HydrophobicContact CD2-CZ 3.78Å; F199-F250 AromaticContact CE2-CE2 3.74Å; F199-F250 HydrophobicContact CE2-CE2 3.74Å; F199-F250 AromaticContact CE2-CZ 3.9Å; F199-F250 HydrophobicContact CE2-CZ 3.9Å; F199-F250 HydrophobicContact CG-CE2 4.24Å; F199-F250 HydrophobicContact CG-CZ 4.21Å; F199-F250 HydrophobicContact CZ-CZ 4.42Å
200	D	89.6	Confident	87.9	Confident	17 Å²	17	66 Å²	66	9%	0.091	32%	0.315	C	S	.	.			trans	-70.3	87.2	164.6	176.8	27.2	0	0	0	108.3	F196 R203 N204 R205 I207	F196-D200 HydrophobicContact CD1-CB 4.29Å; F196-D200 HydrophobicContact CE1-CB 3.98Å; F196-D200 HydrophobicContact CZ-CB 4.46Å; F196-D200 VanDerWaalsContact O-CB 3.23Å; F196-D200 WeakPolarHBondContact O-CB 3.48Å; F196-D200 PolarHBondContact O-N 2.81Å; D200-R203 VanDerWaalsContact OD1-C 3.23Å; D200-R203 WeakPolarHBondContact OD1-CA 3.43Å; D200-R203 PolarHBondContact OD1-N 2.81Å; D200-N204 PolarHBondContact OD1-N 2.98Å; D200-N204 VanDerWaalsContact OD1-N 3.11Å; D200-R205 PolarHBondContact OD1-N 2.82Å; D200-I207 HydrophobicContact CB-CG1 4.39Å
201	V	86.8	Confident	88.1	Confident	72 Å²	72	60 Å²	60	44%	0.436	29%	0.287	S	S	.	.	S	Bend	trans	-85	-42.8	-174.3	174.6	0	0	0	0	110.7	F199 E211	F199-V201 PolarHBondContact O-N 2.76Å; V201-E211 WeakPolarHBondContact CA-OE1 3.46Å; V201-E211 HydrophobicContact CB-CG 4.42Å; V201-E211 WeakPolarHBondContact CB-OE1 3.37Å; V201-E211 PolarHBondContact N-OE1 2.6Å
202	D	87.9	Confident	88.1	Confident	105 Å²	105	59.4 Å²	59.4	56%	0.561	28%	0.283	S	S	*	.	S	Bend	trans	-80.7	-17.1	-179.8	84.6	-10.2	0	0	0	113.5	N204 E211	D202-N204 WeakPolarHBondContact OD1-CB 3.44Å; D202-N204 PolarHBondContact OD1-N 2.78Å; D202-N204 PolarHBondContact OD1-ND2 3.03Å; D202-N204 PolarHBondContact OD2-ND2 2.82Å; D202-E211 PolarHBondContact N-OE1 3.39Å
203	R	86.1	Confident	87.8	Confident	209 Å²	209	61 Å²	61	79%	0.789	30%	0.295	S	S	*	.	S	Bend	trans	78.2	23.4	-179.2	-49.6	178.4	-175.4	173.4	2.2	115.1	D200 R205	D200-R203 VanDerWaalsContact OD1-C 3.23Å; D200-R203 WeakPolarHBondContact OD1-CA 3.43Å; D200-R203 PolarHBondContact OD1-N 2.81Å; R203-R205 PolarHBondContact O-N 2.73Å
204	N	89	Confident	87.5	Confident	71 Å²	71	63 Å²	63	38%	0.38	30%	0.303	S	S	.	.	S	Bend	trans	-72	-14.2	174.4	75.5	41.8	0	0	0	113.2	D200 D202 L206	D200-N204 PolarHBondContact OD1-N 2.98Å; D200-N204 VanDerWaalsContact OD1-N 3.11Å; D202-N204 WeakPolarHBondContact OD1-CB 3.44Å; D202-N204 PolarHBondContact OD1-N 2.78Å; D202-N204 PolarHBondContact OD1-ND2 3.03Å; D202-N204 PolarHBondContact OD2-ND2 2.82Å; N204-L206 WeakPolarHBondContact OD1-CA 3.49Å; N204-L206 WeakPolarHBondContact OD1-CB 3.19Å; N204-L206 PolarHBondContact OD1-N 3.21Å
205	R	88.6	Confident	87.2	Confident	192 Å²	192	60.5 Å²	60.5	73%	0.725	29%	0.29	S	S	*	.	S	Bend	trans	75.2	18.1	-179	-45.2	174.5	179.7	178.8	1	116	F196 D200 R203	F196-R205 WeakPolarHBondContact CZ-O 3.47Å; D200-R205 PolarHBondContact OD1-N 2.82Å; R203-R205 PolarHBondContact O-N 2.73Å
206	L	90.7	Very high	86.6	Confident	54 Å²	54	62.3 Å²	62.3	28%	0.283	30%	0.299	S	S	.	.	S	Bend	trans	-111.8	177.4	162.6	-52.4	174.7	0	0	0	107.7	N204 H244 L245 T246	N204-L206 WeakPolarHBondContact OD1-CA 3.49Å; N204-L206 WeakPolarHBondContact OD1-CB 3.19Å; N204-L206 PolarHBondContact OD1-N 3.21Å; L206-H244 HydrophobicContact CB-CB 4.02Å; L206-H244 HydrophobicContact CD1-CB 4.18Å; L206-H244 HydrophobicContact CG-CB 4.5Å; L206-L245 CarbonylContact C-O 3.55Å; L206-L245 WeakPolarHBondContact CA-O 3.29Å; L206-T246 HydrophobicContact CD2-CG2 3.89Å
207	I	90.1	Very high	85.8	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	33%	0.332	C	S	.	.			trans	-136.1	118.4	168.3	-60.7	164.5	0	0	0	107.6	F196 F199 D200 E211 L212 L245 F250	F196-I207 HydrophobicContact CD2-CD1 3.5Å; F196-I207 VanDerWaalsContact CD2-CD1 3.5Å; F196-I207 HydrophobicContact CD2-CG1 4.32Å; F196-I207 HydrophobicContact CE2-CD1 3.53Å; F196-I207 HydrophobicContact CE2-CG1 3.92Å; F196-I207 HydrophobicContact CG-CD1 4.32Å; F196-I207 HydrophobicContact CZ-CD1 4.38Å; F196-I207 HydrophobicContact CZ-CG1 4.36Å; F199-I207 HydrophobicContact CB-CD1 3.51Å; F199-I207 HydrophobicContact CB-CG1 3.87Å; F199-I207 HydrophobicContact CB-CG2 3.92Å; F199-I207 HydrophobicContact CD2-CD1 4.3Å; F199-I207 HydrophobicContact CD2-CG2 4.38Å; F199-I207 HydrophobicContact CG-CD1 4.34Å; D200-I207 HydrophobicContact CB-CG1 4.39Å; I207-E211 WeakPolarHBondContact CA-OE2 3.47Å; I207-E211 HydrophobicContact CG2-CB 4.49Å; I207-L212 HydrophobicContact CG2-CD2 3.54Å; I207-L212 HydrophobicContact CG2-CG 3.93Å; I207-L245 HydrophobicContact CB-CB 4.29Å; I207-L245 PolarHBondContact N-O 2.91Å; I207-L245 PolarHBondContact O-N 2.97Å; I207-F250 HydrophobicContact CD1-CB 4.43Å; I207-F250 HydrophobicContact CD1-CD2 3.4Å; I207-F250 HydrophobicContact CD1-CE2 3.59Å; I207-F250 HydrophobicContact CD1-CG 3.9Å; I207-F250 HydrophobicContact CD1-CZ 4.22Å
208	D	89.6	Confident	84.9	Confident	43 Å²	43	71.6 Å²	71.6	23%	0.23	34%	0.342	C	S	.	.			trans	-102.2	171.5	-178.1	84.2	16.9	0	0	0	113.7	S210 E211 L212	D208-S210 VanDerWaalsContact C-N 3.27Å; D208-S210 PolarHBondContact O-N 3.08Å; D208-S210 WeakPolarHBondContact OD1-CA 3.41Å; D208-S210 WeakPolarHBondContact OD1-CB 3.5Å; D208-S210 PolarHBondContact OD1-N 2.8Å; D208-S210 PolarHBondContact OD1-OG 2.84Å; D208-S210 PolarHBondContact OD2-OG 3.46Å; D208-E211 PolarHBondContact N-OE2 3.31Å; D208-E211 PolarHBondContact O-N 3.3Å; D208-E211 PolarHBondContact OD1-N 3.01Å; D208-L212 WeakPolarHBondContact O-CG 3.34Å; D208-L212 PolarHBondContact O-N 2.87Å
209	A	85.5	Confident	84.1	Confident	44 Å²	44	65.6 Å²	65.6	36%	0.364	32%	0.32	S	S	.	.	H	α-helix	trans	-64.9	-25.5	178.3	0	0	0	0	0	114.1	S213 F231 L234	A209-S213 WeakPolarHBondContact O-CB 3.32Å; A209-S213 PolarHBondContact O-N 2.84Å; A209-S213 PolarHBondContact O-OG 3.47Å; A209-F231 HydrophobicContact CB-CD1 4.31Å; A209-F231 HydrophobicContact CB-CE1 4.33Å; A209-F231 WeakPolarHBondContact O-CE1 3.43Å; A209-L234 HydrophobicContact CB-CD1 4.07Å
210	S	84.4	Confident	82.8	Confident	66 Å²	66	68.1 Å²	68.1	46%	0.462	35%	0.346	S	S	.	.	H	α-helix	trans	-72.5	-33.8	174.8	92.3	0	0	0	0	111.8	D208 S213 Q214	D208-S210 VanDerWaalsContact C-N 3.27Å; D208-S210 PolarHBondContact O-N 3.08Å; D208-S210 WeakPolarHBondContact OD1-CA 3.41Å; D208-S210 WeakPolarHBondContact OD1-CB 3.5Å; D208-S210 PolarHBondContact OD1-N 2.8Å; D208-S210 PolarHBondContact OD1-OG 2.84Å; D208-S210 PolarHBondContact OD2-OG 3.46Å; S210-S213 WeakPolarHBondContact O-CB 3.41Å; S210-S213 PolarHBondContact O-N 3.18Å; S210-Q214 WeakPolarHBondContact O-CG 3.39Å; S210-Q214 PolarHBondContact O-N 2.84Å; S210-Q214 PolarHBondContact O-NE2 3.19Å
211	E	87.6	Confident	81.5	Confident	5 Å²	5	68.3 Å²	68.3	2%	0.023	35%	0.347	C	S	.	.	H	α-helix	trans	-76.6	-44.6	175.6	-69.5	-175.2	125.5	0	0	111.7	F199 V201 D202 I207 D208 S213 Q214 V215	F199-E211 WeakPolarHBondContact O-CB 3Å; V201-E211 WeakPolarHBondContact CA-OE1 3.46Å; V201-E211 HydrophobicContact CB-CG 4.42Å; V201-E211 WeakPolarHBondContact CB-OE1 3.37Å; V201-E211 PolarHBondContact N-OE1 2.6Å; D202-E211 PolarHBondContact N-OE1 3.39Å; I207-E211 WeakPolarHBondContact CA-OE2 3.47Å; I207-E211 HydrophobicContact CG2-CB 4.49Å; D208-E211 PolarHBondContact N-OE2 3.31Å; D208-E211 PolarHBondContact O-N 3.3Å; D208-E211 PolarHBondContact OD1-N 3.01Å; E211-S213 PolarHBondContact O-N 3.06Å; E211-Q214 WeakPolarHBondContact O-CA 3.29Å; E211-Q214 WeakPolarHBondContact O-CB 2.97Å; E211-Q214 PolarHBondContact O-N 2.88Å; E211-V215 WeakPolarHBondContact O-CG2 3.44Å; E211-V215 PolarHBondContact O-N 2.82Å
212	L	85.8	Confident	80.1	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-56	-36.9	169.5	-63.3	-176.8	0	0	0	111.2	F199 I207 D208 Q214 V215 I216 L230 F231 L233 L234	F199-L212 HydrophobicContact CD2-CD2 3.61Å; F199-L212 HydrophobicContact CE2-CD2 4Å; I207-L212 HydrophobicContact CG2-CD2 3.54Å; I207-L212 HydrophobicContact CG2-CG 3.93Å; D208-L212 WeakPolarHBondContact O-CG 3.34Å; D208-L212 PolarHBondContact O-N 2.87Å; L212-Q214 VanDerWaalsContact C-N 3.32Å; L212-Q214 PolarHBondContact O-N 2.77Å; L212-V215 PolarHBondContact O-N 2.86Å; L212-I216 WeakPolarHBondContact O-CD1 3.36Å; L212-I216 VanDerWaalsContact O-CG1 3.27Å; L212-I216 WeakPolarHBondContact O-CG1 3.29Å; L212-I216 PolarHBondContact O-N 3.29Å; L212-L230 HydrophobicContact CB-CD2 4.27Å; L212-L230 HydrophobicContact CD2-CD2 3.88Å; L212-L230 HydrophobicContact CD2-CG 4.06Å; L212-F231 HydrophobicContact CB-CD1 4.35Å; L212-F231 HydrophobicContact CB-CE1 4.31Å; L212-L233 HydrophobicContact CD2-CD1 4.49Å; L212-L234 HydrophobicContact CD1-CD1 3.79Å; L212-L234 HydrophobicContact CD1-CG 4.1Å
213	S	82.3	Confident	78.5	Confident	35 Å²	35	69.2 Å²	69.2	25%	0.245	35%	0.348	C	S	.	.	H	α-helix	trans	-65.3	-29.3	173	-64.3	0	0	0	0	114	A209 S210 E211 K217 F231	A209-S213 WeakPolarHBondContact O-CB 3.32Å; A209-S213 PolarHBondContact O-N 2.84Å; A209-S213 PolarHBondContact O-OG 3.47Å; S210-S213 WeakPolarHBondContact O-CB 3.41Å; S210-S213 PolarHBondContact O-N 3.18Å; E211-S213 PolarHBondContact O-N 3.06Å; S213-K217 VanDerWaalsContact O-CD 3.25Å; S213-K217 WeakPolarHBondContact O-CD 3.29Å; S213-K217 WeakPolarHBondContact O-CE 3.43Å; S213-K217 VanDerWaalsContact O-CG 3.25Å; S213-K217 WeakPolarHBondContact O-CG 3.48Å; S213-F231 WeakPolarHBondContact OG-CE1 3.21Å; S213-F231 WeakPolarHBondContact OG-CZ 3.33Å
214	Q	81.5	Confident	76.9	Confident	73 Å²	73	66.1 Å²	66.1	34%	0.341	35%	0.347	S	S	.	.	H	α-helix	trans	-76.6	-45.4	173.9	-71	170.6	73.6	0	0	110.7	S210 E211 L212 I216 K217 H218	S210-Q214 WeakPolarHBondContact O-CG 3.39Å; S210-Q214 PolarHBondContact O-N 2.84Å; S210-Q214 PolarHBondContact O-NE2 3.19Å; E211-Q214 WeakPolarHBondContact O-CA 3.29Å; E211-Q214 WeakPolarHBondContact O-CB 2.97Å; E211-Q214 PolarHBondContact O-N 2.88Å; L212-Q214 VanDerWaalsContact C-N 3.32Å; L212-Q214 PolarHBondContact O-N 2.77Å; Q214-I216 PolarHBondContact O-N 3.22Å; Q214-K217 PolarHBondContact O-N 3.35Å; Q214-H218 PolarHBondContact O-CD2 2.97Å; Q214-H218 VanDerWaalsContact O-CD2 3.28Å; Q214-H218 PolarHBondContact O-N 3.27Å
215	V	80.6	Confident	75.3	Confident	7 Å²	7	65.1 Å²	65.1	4%	0.042	34%	0.343	C	S	.	.	H	α-helix	trans	-54.9	-52.1	175.5	174.2	0	0	0	0	110.5	F199 E211 L212 K217 H218 E219 L221 L230	F199-V215 HydrophobicContact CB-CG2 4.25Å; F199-V215 HydrophobicContact CD1-CG1 4.02Å; F199-V215 HydrophobicContact CD1-CG2 3.71Å; F199-V215 HydrophobicContact CD2-CG2 4.38Å; F199-V215 HydrophobicContact CE1-CG1 3.58Å; F199-V215 HydrophobicContact CE1-CG2 4.16Å; F199-V215 HydrophobicContact CE2-CG1 4.32Å; F199-V215 HydrophobicContact CG-CG2 3.84Å; F199-V215 HydrophobicContact CZ-CG1 3.76Å; E211-V215 WeakPolarHBondContact O-CG2 3.44Å; E211-V215 PolarHBondContact O-N 2.82Å; L212-V215 PolarHBondContact O-N 2.86Å; V215-K217 VanDerWaalsContact C-N 3.26Å; V215-K217 PolarHBondContact O-N 2.58Å; V215-H218 PolarHBondContact O-N 3.21Å; V215-E219 HydrophobicContact CG1-CB 4.48Å; V215-E219 HydrophobicContact CG1-CG 4.01Å; V215-E219 WeakPolarHBondContact O-CB 3.33Å; V215-E219 WeakPolarHBondContact O-CG 3.39Å; V215-E219 PolarHBondContact O-N 3.08Å; V215-L221 HydrophobicContact CG1-CD1 4.11Å; V215-L230 HydrophobicContact CB-CD2 3.96Å; V215-L230 HydrophobicContact CG1-CD2 3.63Å
216	I	78.2	Confident	73.7	Confident	38 Å²	38	56.8 Å²	56.8	20%	0.195	31%	0.314	C	S	.	.	H	α-helix	trans	-51	-46.2	177.8	-70.4	162.2	0	0	0	111.8	L212 Q214 G220 L221 L230 F231	L212-I216 WeakPolarHBondContact O-CD1 3.36Å; L212-I216 VanDerWaalsContact O-CG1 3.27Å; L212-I216 WeakPolarHBondContact O-CG1 3.29Å; L212-I216 PolarHBondContact O-N 3.29Å; Q214-I216 PolarHBondContact O-N 3.22Å; I216-G220 PolarHBondContact O-N 3.07Å; I216-L221 PolarHBondContact O-N 3.28Å; I216-L230 HydrophobicContact CD1-CB 3.89Å; I216-L230 HydrophobicContact CG1-CB 3.81Å; I216-L230 HydrophobicContact CG1-CD2 3.98Å; I216-F231 HydrophobicContact CD1-CD2 4.07Å; I216-F231 HydrophobicContact CD1-CE2 3.42Å; I216-F231 VanDerWaalsContact CD1-CE2 3.42Å; I216-F231 HydrophobicContact CD1-CZ 3.72Å
217	K	73.8	Confident	72.6	Confident	167 Å²	167	59.6 Å²	59.6	73%	0.726	33%	0.326	S	S	*	.	H	α-helix	trans	-70.8	-41.1	-177.4	-69.5	168.3	-170.5	167.5	0	113.1	S213 Q214 V215	S213-K217 VanDerWaalsContact O-CD 3.25Å; S213-K217 WeakPolarHBondContact O-CD 3.29Å; S213-K217 WeakPolarHBondContact O-CE 3.43Å; S213-K217 VanDerWaalsContact O-CG 3.25Å; S213-K217 WeakPolarHBondContact O-CG 3.48Å; Q214-K217 PolarHBondContact O-N 3.35Å; V215-K217 VanDerWaalsContact C-N 3.26Å; V215-K217 PolarHBondContact O-N 2.58Å
218	H	70.8	Confident	71.8	Confident	161 Å²	161	59.7 Å²	59.7	75%	0.745	33%	0.327	S	S	*	.	H	α-helix	trans	-79.2	-27.8	-178.9	-78.1	-66.8	0	0	0	113.2	Q214 V215	Q214-H218 PolarHBondContact O-CD2 2.97Å; Q214-H218 VanDerWaalsContact O-CD2 3.28Å; Q214-H218 PolarHBondContact O-N 3.27Å; V215-H218 PolarHBondContact O-N 3.21Å
219	E	67.9	Low	71.3	Confident	18 Å²	18	59.4 Å²	59.4	8%	0.084	33%	0.327	C	S	.	.	H	α-helix	trans	-102.5	-16.6	-170	-67.6	-131.7	110.7	0	0	115.3	H168 R171 Y172 V215 L221	H168-E219 IonicContact CE1-OE2 3.46Å; H168-E219 PolarHBondContact CE1-OE2 3.48Å; H168-E219 IonicContact NE2-OE1 3.55Å; H168-E219 IonicContact NE2-OE2 3.64Å; H168-E219 PolarHBondContact NE2-OE2 2.99Å; H168-E219 VanDerWaalsContact NE2-OE2 3.1Å; R171-E219 IonicContact CZ-OE1 3.78Å; R171-E219 PolarHBondContact NH1-O 3.1Å; R171-E219 IonicContact NH1-OE1 2.68Å; R171-E219 PolarHBondContact NH1-OE1 2.91Å; R171-E219 IonicContact NH1-OE2 3.73Å; R171-E219 PolarHBondContact NH2-O 2.88Å; Y172-E219 PolarHBondContact OH-OE1 2.96Å; Y172-E219 VanDerWaalsContact OH-OE1 3.1Å; V215-E219 HydrophobicContact CG1-CB 4.48Å; V215-E219 HydrophobicContact CG1-CG 4.01Å; V215-E219 WeakPolarHBondContact O-CB 3.33Å; V215-E219 WeakPolarHBondContact O-CG 3.39Å; V215-E219 PolarHBondContact O-N 3.08Å; E219-L221 HydrophobicContact CB-CD1 4.06Å; E219-L221 HydrophobicContact CB-CG 4.3Å
220	G	62.6	Low	71	Confident	53 Å²	53	57.6 Å²	57.6	55%	0.546	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.8	28.6	-178.9	0	0	0	0	0	114.3	I216 S222	I216-G220 PolarHBondContact O-N 3.07Å; G220-S222 PolarHBondContact O-N 2.9Å; G220-S222 VanDerWaalsContact O-N 3.09Å
221	L	62.3	Low	71	Confident	22 Å²	22	58.2 Å²	58.2	12%	0.115	31%	0.306	C	S	.	.			trans	-84.3	55.9	178.4	-69.4	159.8	0	0	0	111.3	L167 V215 I216 E219 L230	L167-L221 HydrophobicContact CD1-CD2 3.97Å; V215-L221 HydrophobicContact CG1-CD1 4.11Å; I216-L221 PolarHBondContact O-N 3.28Å; E219-L221 HydrophobicContact CB-CD1 4.06Å; E219-L221 HydrophobicContact CB-CG 4.3Å; L221-L230 HydrophobicContact CD1-CD1 4.43Å; L221-L230 HydrophobicContact CD1-CD2 4.32Å
222	S	56.4	Low	70.9	Confident	61 Å²	61	58.7 Å²	58.7	43%	0.427	31%	0.308	S	S	.	.			trans	-75	168	179	60.1	0	0	0	0	113.3	G220 D224	G220-S222 PolarHBondContact O-N 2.9Å; G220-S222 VanDerWaalsContact O-N 3.09Å; S222-D224 WeakPolarHBondContact CB-OD2 3.25Å; S222-D224 PolarHBondContact O-N 3.47Å; S222-D224 PolarHBondContact OG-OD2 2.79Å
223	K	54	Low	70.8	Confident	134 Å²	134	58.7 Å²	58.7	58%	0.583	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-59.7	-10.3	-176.8	-90.6	-155.1	169.4	-154.5	0	115	D151 V225 T229	D151-K223 IonicContact OD2-NZ 3.16Å; D151-K223 PolarHBondContact OD2-NZ 3.4Å; D151-K223 VanDerWaalsContact OD2-NZ 3.16Å; K223-V225 PolarHBondContact O-N 2.81Å; K223-T229 HydrophobicContact CG-CG2 4.39Å
224	D	53.3	Low	70.9	Confident	144 Å²	144	58.1 Å²	58.1	77%	0.77	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-70.7	1.2	-177.4	-46.4	-80.6	0	0	0	114.3	S222	S222-D224 WeakPolarHBondContact CB-OD2 3.25Å; S222-D224 PolarHBondContact O-N 3.47Å; S222-D224 PolarHBondContact OG-OD2 2.79Å
225	V	54.4	Low	70.9	Confident	50 Å²	50	59.2 Å²	59.2	30%	0.303	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-111.2	-28.6	-168.4	-175.4	0	0	0	0	113.1	K163 K223	K163-V225 HydrophobicContact CD-CG1 3.44Å; K163-V225 VanDerWaalsContact CD-CG1 3.44Å; K163-V225 PolarHBondContact NZ-O 2.83Å; K223-V225 PolarHBondContact O-N 2.81Å
226	S	56.4	Low	71	Confident	17 Å²	17	61.6 Å²	61.6	12%	0.119	31%	0.314	C	S	.	.			trans	-167.1	160.3	177.4	40.4	0	0	0	0	111.1	C228	S226-C228 PolarHBondContact O-N 3.32Å; S226-C228 PolarHBondContact OG-O 2.86Å
227	E	67.5	Low	71.3	Confident	113 Å²	113	60.6 Å²	60.6	53%	0.528	31%	0.31	S	S	.	.	S	Bend	trans	-62.5	-25.5	169.2	-63.2	177.7	174.8	0	0	111.3	D151	D151-E227 HydrophobicContact CB-CB 4.47Å
228	C	72.8	Confident	71.8	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.02	28%	0.283	C	S	.	.	S	Bend	trans	-83.8	149.9	170.7	-61	0	0	0	0	114.2	C152 Y157 L160 S226	C152-C228 WeakPolarHBondContact CA-SG 3.26Å; C152-C228 HydrophobicContact CB-CB 3.8Å; C152-C228 WeakPolarHBondContact CB-SG 3.22Å; C152-C228 WeakPolarHBondContact SG-CB 3.45Å; C152-C228 CovalentContact SG-SG 2.03Å; C152-C228 PolarHBondContact SG-SG 3.3Å; Y157-C228 PolarHBondContact N-SG 2.95Å; L160-C228 HydrophobicContact CB-CB 4.17Å; L160-C228 HydrophobicContact CD2-CB 3.67Å; S226-C228 PolarHBondContact O-N 3.32Å; S226-C228 PolarHBondContact OG-O 2.86Å
229	T	78.8	Confident	72.2	Confident	37 Å²	37	52 Å²	52	23%	0.227	28%	0.276	C	S	.	.			trans	-113.6	169.2	178.5	70.2	0	0	0	0	111.8	L160 K223 F231 D232	L160-T229 WeakPolarHBondContact CD2-O 3.34Å; K223-T229 HydrophobicContact CG-CG2 4.39Å; T229-F231 PolarHBondContact O-N 3.23Å; T229-F231 PolarHBondContact OG1-N 2.96Å; T229-D232 WeakPolarHBondContact CA-OD2 3.38Å; T229-D232 PolarHBondContact N-OD2 3.01Å; T229-D232 WeakPolarHBondContact O-CB 3.47Å; T229-D232 PolarHBondContact O-N 2.94Å; T229-D232 VanDerWaalsContact O-N 3.14Å; T229-D232 VanDerWaalsContact O-OD2 3.11Å; T229-D232 PolarHBondContact OG1-OD2 2.62Å
230	L	80.8	Confident	72.8	Confident	5 Å²	5	55.3 Å²	55.3	3%	0.026	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-26.8	178.1	-160.4	67.1	0	0	0	113	I164 F199 L212 V215 I216 L221 D232 L233	I164-L230 HydrophobicContact CD1-CD1 3.47Å; I164-L230 VanDerWaalsContact CD1-CD1 3.47Å; I164-L230 HydrophobicContact CG1-CD1 4.19Å; F199-L230 HydrophobicContact CE2-CD1 4.1Å; F199-L230 HydrophobicContact CE2-CD2 3.96Å; F199-L230 HydrophobicContact CE2-CG 4.35Å; F199-L230 HydrophobicContact CZ-CD1 4.33Å; F199-L230 HydrophobicContact CZ-CD2 4.25Å; L212-L230 HydrophobicContact CB-CD2 4.27Å; L212-L230 HydrophobicContact CD2-CD2 3.88Å; L212-L230 HydrophobicContact CD2-CG 4.06Å; V215-L230 HydrophobicContact CB-CD2 3.96Å; V215-L230 HydrophobicContact CG1-CD2 3.63Å; I216-L230 HydrophobicContact CD1-CB 3.89Å; I216-L230 HydrophobicContact CG1-CB 3.81Å; I216-L230 HydrophobicContact CG1-CD2 3.98Å; L221-L230 HydrophobicContact CD1-CD1 4.43Å; L221-L230 HydrophobicContact CD1-CD2 4.32Å; L230-D232 PolarHBondContact O-N 3.39Å; L230-L233 HydrophobicContact CD1-CD1 3.63Å; L230-L233 HydrophobicContact CD1-CG 4.42Å; L230-L233 HydrophobicContact CG-CD1 4.01Å; L230-L233 WeakPolarHBondContact O-CB 3.49Å; L230-L233 WeakPolarHBondContact O-CG 3.4Å; L230-L233 PolarHBondContact O-N 3.16Å; L230-L233 VanDerWaalsContact O-N 3.12Å
231	F	83.2	Confident	73.6	Confident	80 Å²	80	58.4 Å²	58.4	35%	0.351	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-23.2	175.7	-57.1	-77.6	0	0	0	113.2	A209 L212 S213 I216 T229 L233 L234 K235	A209-F231 HydrophobicContact CB-CD1 4.31Å; A209-F231 HydrophobicContact CB-CE1 4.33Å; A209-F231 WeakPolarHBondContact O-CE1 3.43Å; L212-F231 HydrophobicContact CB-CD1 4.35Å; L212-F231 HydrophobicContact CB-CE1 4.31Å; S213-F231 WeakPolarHBondContact OG-CE1 3.21Å; S213-F231 WeakPolarHBondContact OG-CZ 3.33Å; I216-F231 HydrophobicContact CD1-CD2 4.07Å; I216-F231 HydrophobicContact CD1-CE2 3.42Å; I216-F231 VanDerWaalsContact CD1-CE2 3.42Å; I216-F231 HydrophobicContact CD1-CZ 3.72Å; T229-F231 PolarHBondContact O-N 3.23Å; T229-F231 PolarHBondContact OG1-N 2.96Å; F231-L233 PolarHBondContact O-N 2.69Å; F231-L233 VanDerWaalsContact O-N 3.13Å; F231-L234 WeakPolarHBondContact O-CB 3.34Å; F231-L234 PolarHBondContact O-N 3.09Å; F231-K235 PolarHBondContact O-N 2.85Å
232	D	85.4	Confident	74.7	Confident	14 Å²	14	60.7 Å²	60.7	8%	0.075	31%	0.311	C	S	.	.	H	α-helix	trans	-65.4	-13.2	175.4	-64.6	-81.7	0	0	0	112.4	C152 Y157 T229 L230 K235 Y236	C152-D232 HydrophobicContact CB-CB 4.47Å; C152-D232 WeakPolarHBondContact CB-OD1 3.27Å; C152-D232 PolarHBondContact SG-OD1 2.98Å; C152-D232 VanDerWaalsContact SG-OD1 3.41Å; Y157-D232 HydrophobicContact CD2-CB 4.06Å; Y157-D232 HydrophobicContact CE2-CB 4.31Å; Y157-D232 WeakPolarHBondContact CE2-O 3.02Å; T229-D232 WeakPolarHBondContact CA-OD2 3.38Å; T229-D232 PolarHBondContact N-OD2 3.01Å; T229-D232 WeakPolarHBondContact O-CB 3.47Å; T229-D232 PolarHBondContact O-N 2.94Å; T229-D232 VanDerWaalsContact O-N 3.14Å; T229-D232 VanDerWaalsContact O-OD2 3.11Å; T229-D232 PolarHBondContact OG1-OD2 2.62Å; L230-D232 PolarHBondContact O-N 3.39Å; D232-K235 WeakPolarHBondContact OD1-CD 3.28Å; D232-K235 IonicContact OD1-NZ 2.87Å; D232-Y236 HydrophobicContact CB-CD2 4.2Å; D232-Y236 WeakPolarHBondContact O-CB 3.4Å; D232-Y236 WeakPolarHBondContact O-CD2 3.47Å; D232-Y236 PolarHBondContact O-N 2.9Å
233	L	84.4	Confident	76.1	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-61	-42.8	167	-69.1	173	0	0	0	112	Y157 K161 F199 L212 L230 F231 N237 L245 F250 A253 F254	Y157-L233 HydrophobicContact CE2-CD2 4.08Å; K161-L233 HydrophobicContact CD-CD2 4.36Å; K161-L233 HydrophobicContact CG-CD2 4.29Å; F199-L233 HydrophobicContact CE2-CD1 4.12Å; L212-L233 HydrophobicContact CD2-CD1 4.49Å; L230-L233 HydrophobicContact CD1-CD1 3.63Å; L230-L233 HydrophobicContact CD1-CG 4.42Å; L230-L233 HydrophobicContact CG-CD1 4.01Å; L230-L233 WeakPolarHBondContact O-CB 3.49Å; L230-L233 WeakPolarHBondContact O-CG 3.4Å; L230-L233 PolarHBondContact O-N 3.16Å; L230-L233 VanDerWaalsContact O-N 3.12Å; F231-L233 PolarHBondContact O-N 2.69Å; F231-L233 VanDerWaalsContact O-N 3.13Å; L233-N237 WeakPolarHBondContact O-CA 3.41Å; L233-N237 VanDerWaalsContact O-CB 3.22Å; L233-N237 WeakPolarHBondContact O-CB 3.47Å; L233-N237 PolarHBondContact O-N 2.82Å; L233-L245 HydrophobicContact CB-CD1 3.71Å; L233-F250 HydrophobicContact CD1-CE2 4.3Å; L233-A253 HydrophobicContact CD2-CB 4.27Å; L233-F254 HydrophobicContact CD1-CZ 4.32Å; L233-F254 HydrophobicContact CD2-CE2 4.12Å; L233-F254 HydrophobicContact CD2-CZ 3.84Å
234	L	83.7	Confident	77.8	Confident	23 Å²	23	61.9 Å²	61.9	12%	0.12	31%	0.311	C	S	.	.	H	α-helix	trans	-63.2	-60.1	173.8	-75.9	159.3	0	0	0	108.9	A209 L212 F231 Y236 N237 D238 E243 L245	A209-L234 HydrophobicContact CB-CD1 4.07Å; L212-L234 HydrophobicContact CD1-CD1 3.79Å; L212-L234 HydrophobicContact CD1-CG 4.1Å; F231-L234 WeakPolarHBondContact O-CB 3.34Å; F231-L234 PolarHBondContact O-N 3.09Å; L234-Y236 PolarHBondContact O-N 2.91Å; L234-N237 PolarHBondContact O-N 3.46Å; L234-N237 VanDerWaalsContact O-N 3.12Å; L234-D238 WeakPolarHBondContact O-CB 3.39Å; L234-D238 PolarHBondContact O-N 2.96Å; L234-E243 VanDerWaalsContact CD2-O 3.27Å; L234-E243 WeakPolarHBondContact CD2-O 3.37Å; L234-L245 HydrophobicContact CD2-CD2 4.25Å; L234-L245 HydrophobicContact CD2-CG 3.77Å; L234-L245 HydrophobicContact CG-CD1 4.48Å; L234-L245 HydrophobicContact CG-CG 4.23Å
235	K	81.8	Confident	79.5	Confident	96 Å²	96	55 Å²	55	42%	0.417	28%	0.275	S	S	.	.	H	α-helix	trans	-46.7	-37.9	-178.2	-172.5	-168.2	176	-169.9	0	115.7	D150 F231 D232	D150-K235 IonicContact OD1-NZ 2.65Å; D150-K235 PolarHBondContact OD1-NZ 2.93Å; D150-K235 WeakPolarHBondContact OD2-CE 3.41Å; D150-K235 IonicContact OD2-NZ 2.64Å; D150-K235 PolarHBondContact OD2-NZ 2.84Å; F231-K235 PolarHBondContact O-N 2.85Å; D232-K235 WeakPolarHBondContact OD1-CD 3.28Å; D232-K235 IonicContact OD1-NZ 2.87Å
236	Y	82	Confident	81.2	Confident	57 Å²	57	54.5 Å²	54.5	22%	0.224	27%	0.272	C	S	.	.	H	α-helix	trans	-106.4	-9.9	-175.9	-81.6	-78.5	0	0	0	114.9	C152 L154 Y157 D232 L234	C152-Y236 PolarHBondContact O-OH 3.07Å; L154-Y236 HydrophobicContact CB-CE1 4.33Å; L154-Y236 HydrophobicContact CD1-CD1 4Å; L154-Y236 HydrophobicContact CD1-CE1 3.84Å; L154-Y236 PolarHBondContact N-OH 2.92Å; Y157-Y236 HydrophobicContact CD1-CD1 4.22Å; Y157-Y236 AromaticContact CD1-CD2 3.93Å; Y157-Y236 HydrophobicContact CD1-CD2 3.93Å; Y157-Y236 AromaticContact CD1-CG 3.74Å; Y157-Y236 HydrophobicContact CD1-CG 3.74Å; Y157-Y236 AromaticContact CD2-CD2 3.95Å; Y157-Y236 HydrophobicContact CD2-CD2 3.95Å; Y157-Y236 HydrophobicContact CD2-CG 4.47Å; Y157-Y236 HydrophobicContact CE1-CD1 4.47Å; Y157-Y236 HydrophobicContact CE1-CD2 4.24Å; Y157-Y236 AromaticContact CE1-CG 3.81Å; Y157-Y236 HydrophobicContact CE1-CG 3.81Å; Y157-Y236 HydrophobicContact CE2-CD2 4.28Å; Y157-Y236 AromaticContact CG-CD2 3.77Å; Y157-Y236 HydrophobicContact CG-CD2 3.77Å; Y157-Y236 HydrophobicContact CG-CE2 4.17Å; Y157-Y236 HydrophobicContact CG-CG 4.09Å; Y157-Y236 VanDerWaalsContact CZ-CB 3.5Å; D232-Y236 HydrophobicContact CB-CD2 4.2Å; D232-Y236 WeakPolarHBondContact O-CB 3.4Å; D232-Y236 WeakPolarHBondContact O-CD2 3.47Å; D232-Y236 PolarHBondContact O-N 2.9Å; L234-Y236 PolarHBondContact O-N 2.91Å
237	N	85.6	Confident	82.7	Confident	18 Å²	18	58.7 Å²	58.7	10%	0.096	29%	0.285	C	S	.	.	H	α-helix	trans	-139.8	-7.5	-170.5	-95.9	113	0	0	0	116.3	Y157 L233 L234 I239 L245 E249 A253	Y157-N237 PolarHBondContact OH-OD1 2.84Å; L233-N237 WeakPolarHBondContact O-CA 3.41Å; L233-N237 VanDerWaalsContact O-CB 3.22Å; L233-N237 WeakPolarHBondContact O-CB 3.47Å; L233-N237 PolarHBondContact O-N 2.82Å; L234-N237 PolarHBondContact O-N 3.46Å; L234-N237 VanDerWaalsContact O-N 3.12Å; N237-I239 PolarHBondContact O-N 2.83Å; N237-L245 HydrophobicContact CB-CD2 4.39Å; N237-E249 VanDerWaalsContact O-CB 3.27Å; N237-E249 WeakPolarHBondContact O-CB 2.95Å; N237-E249 WeakPolarHBondContact O-CG 3.22Å; N237-A253 HydrophobicContact CB-CB 3.78Å; N237-A253 VanDerWaalsContact CG-CB 3.44Å; N237-A253 WeakPolarHBondContact ND2-CA 3.26Å; N237-A253 PolarHBondContact ND2-N 3.46Å; N237-A253 WeakPolarHBondContact OD1-CA 3.45Å; N237-A253 WeakPolarHBondContact OD1-CB 3.04Å
238	D	84.1	Confident	83.4	Confident	31 Å²	31	59.2 Å²	59.2	17%	0.166	29%	0.287	C	S	.	.			trans	-60.6	124.8	151.5	178.2	-16.3	0	0	0	107.6	L234 N240 D241 D242 E243 L245	L234-D238 WeakPolarHBondContact O-CB 3.39Å; L234-D238 PolarHBondContact O-N 2.96Å; D238-N240 PolarHBondContact OD1-N 3.47Å; D238-N240 PolarHBondContact OD1-OD1 3.02Å; D238-N240 VanDerWaalsContact OD1-OD1 3.06Å; D238-D241 WeakPolarHBondContact OD1-CA 3.23Å; D238-D241 PolarHBondContact OD1-N 2.82Å; D238-D242 PolarHBondContact OD2-N 3.4Å; D238-E243 PolarHBondContact OD2-N 3.23Å; D238-L245 HydrophobicContact CB-CD2 4.27Å
239	I	78.4	Confident	84	Confident	117 Å²	117	59.6 Å²	59.6	60%	0.6	29%	0.289	S	S	*	.	S	Bend	trans	-103.3	-22.6	-177.2	-66.3	171.8	0	0	0	110.9	N237 E249	N237-I239 PolarHBondContact O-N 2.83Å; I239-E249 HydrophobicContact CB-CG 4.19Å; I239-E249 WeakPolarHBondContact CB-OE1 3.48Å; I239-E249 HydrophobicContact CD1-CG 3.92Å; I239-E249 HydrophobicContact CG1-CG 3.99Å; I239-E249 PolarHBondContact N-OE1 3.46Å
240	N	80.3	Confident	84.6	Confident	87 Å²	87	57.9 Å²	57.9	47%	0.465	28%	0.278	S	S	.	.	S	Bend	trans	-102.6	-10.5	-172.5	74.5	9.8	0	0	0	114.1	D238 D242	D238-N240 PolarHBondContact OD1-N 3.47Å; D238-N240 PolarHBondContact OD1-OD1 3.02Å; D238-N240 VanDerWaalsContact OD1-OD1 3.06Å; N240-D242 PolarHBondContact ND2-OD2 3.05Å; N240-D242 WeakPolarHBondContact OD1-CB 3.37Å; N240-D242 PolarHBondContact OD1-N 2.87Å; N240-D242 PolarHBondContact OD1-OD2 2.85Å
241	D	80.1	Confident	84.9	Confident	118 Å²	118	57.7 Å²	57.7	63%	0.631	28%	0.277	S	S	*	.	S	Bend	trans	69.1	35.7	-179.2	-145.1	30	0	0	0	112.1	K118 D238	K118-D241 IonicContact NZ-OD2 2.67Å; K118-D241 PolarHBondContact NZ-OD2 3.36Å; D238-D241 WeakPolarHBondContact OD1-CA 3.23Å; D238-D241 PolarHBondContact OD1-N 2.82Å
242	D	84.7	Confident	84.9	Confident	70 Å²	70	55.9 Å²	55.9	37%	0.374	27%	0.273	S	S	.	.	S	Bend	trans	-100.6	1	-177.7	90.2	21.5	0	0	0	116.2	D238 N240 H244	D238-D242 PolarHBondContact OD2-N 3.4Å; N240-D242 PolarHBondContact ND2-OD2 3.05Å; N240-D242 WeakPolarHBondContact OD1-CB 3.37Å; N240-D242 PolarHBondContact OD1-N 2.87Å; N240-D242 PolarHBondContact OD1-OD2 2.85Å; D242-H244 VanDerWaalsContact C-N 3.32Å; D242-H244 PolarHBondContact O-CE1 2.9Å; D242-H244 PolarHBondContact O-ND1 3.23Å; D242-H244 VanDerWaalsContact OD1-CB 3.29Å; D242-H244 WeakPolarHBondContact OD1-CB 3.4Å; D242-H244 IonicContact OD1-CG 3.89Å; D242-H244 PolarHBondContact OD1-N 2.82Å; D242-H244 IonicContact OD1-ND1 3.1Å; D242-H244 PolarHBondContact OD1-ND1 2.92Å
243	E	86.1	Confident	84.9	Confident	157 Å²	157	55.2 Å²	55.2	73%	0.734	27%	0.269	S	S	*	.	S	Bend	trans	71.6	12.4	-178.8	-53.7	-172.7	175.5	0	0	115.7	L234 D238	L234-E243 VanDerWaalsContact CD2-O 3.27Å; L234-E243 WeakPolarHBondContact CD2-O 3.37Å; D238-E243 PolarHBondContact OD2-N 3.23Å
244	H	90	Very high	85.1	Confident	63 Å²	63	55.2 Å²	55.2	29%	0.292	27%	0.269	S	S	.	.	S	Bend	trans	-127.2	152.3	174	-47.6	70	0	0	0	112	L206 D242	L206-H244 HydrophobicContact CB-CB 4.02Å; L206-H244 HydrophobicContact CD1-CB 4.18Å; L206-H244 HydrophobicContact CG-CB 4.5Å; D242-H244 VanDerWaalsContact C-N 3.32Å; D242-H244 PolarHBondContact O-CE1 2.9Å; D242-H244 PolarHBondContact O-ND1 3.23Å; D242-H244 VanDerWaalsContact OD1-CB 3.29Å; D242-H244 WeakPolarHBondContact OD1-CB 3.4Å; D242-H244 IonicContact OD1-CG 3.89Å; D242-H244 PolarHBondContact OD1-N 2.82Å; D242-H244 IonicContact OD1-ND1 3.1Å; D242-H244 PolarHBondContact OD1-ND1 2.92Å
245	L	89.1	Confident	85	Confident	0 Å²	0	58 Å²	58	0%	0	28%	0.284	C	S	.	.			trans	-97.4	112.9	167.7	-63.2	171.3	0	0	0	110.3	L206 I207 L233 L234 N237 D238 E249 F250	L206-L245 CarbonylContact C-O 3.55Å; L206-L245 WeakPolarHBondContact CA-O 3.29Å; I207-L245 HydrophobicContact CB-CB 4.29Å; I207-L245 PolarHBondContact N-O 2.91Å; I207-L245 PolarHBondContact O-N 2.97Å; L233-L245 HydrophobicContact CB-CD1 3.71Å; L234-L245 HydrophobicContact CD2-CD2 4.25Å; L234-L245 HydrophobicContact CD2-CG 3.77Å; L234-L245 HydrophobicContact CG-CD1 4.48Å; L234-L245 HydrophobicContact CG-CG 4.23Å; N237-L245 HydrophobicContact CB-CD2 4.39Å; D238-L245 HydrophobicContact CB-CD2 4.27Å; L245-E249 HydrophobicContact CD2-CB 4.14Å; L245-F250 HydrophobicContact CB-CB 4.46Å; L245-F250 HydrophobicContact CD1-CD2 4.08Å
246	T	90.1	Very high	85.1	Confident	39 Å²	39	53.6 Å²	53.6	24%	0.239	27%	0.265	C	S	.	.			trans	-64.1	166.4	164.2	68	0	0	0	0	111	L206 E248 E249 F250	L206-T246 HydrophobicContact CD2-CG2 3.89Å; T246-E248 PolarHBondContact O-N 2.93Å; T246-E248 PolarHBondContact OG1-N 2.63Å; T246-E249 WeakPolarHBondContact CB-OE2 3.4Å; T246-E249 WeakPolarHBondContact CG2-OE2 3.44Å; T246-E249 PolarHBondContact N-OE2 2.69Å; T246-E249 PolarHBondContact O-N 2.96Å; T246-E249 PolarHBondContact OG1-N 2.87Å; T246-E249 PolarHBondContact OG1-OE2 2.88Å; T246-F250 WeakPolarHBondContact O-CB 3.32Å; T246-F250 PolarHBondContact O-N 3.45Å
247	R	87.2	Confident	85.2	Confident	105 Å²	105	54.2 Å²	54.2	40%	0.396	27%	0.268	S	S	.	.	H	α-helix	trans	-55.3	-35	171.2	-168.2	-177.6	-179.3	-172.6	3.1	112.7	D193 F196 Y251	D193-R247 IonicContact OD1-NH2 2.97Å; D193-R247 PolarHBondContact OD1-NH2 2.85Å; D193-R247 IonicContact OD2-NH2 3.17Å; D193-R247 PolarHBondContact OD2-NH2 3.12Å; F196-R247 HydrophobicContact CD1-CG 4.5Å; F196-R247 HydrophobicContact CD2-CG 4.41Å; F196-R247 HydrophobicContact CE1-CB 4.33Å; F196-R247 HydrophobicContact CE1-CG 4.41Å; F196-R247 VanDerWaalsContact CE2-CA 3.47Å; F196-R247 HydrophobicContact CE2-CB 3.99Å; F196-R247 HydrophobicContact CE2-CG 4.33Å; F196-R247 HydrophobicContact CZ-CB 3.87Å; F196-R247 HydrophobicContact CZ-CG 4.33Å; R247-Y251 HydrophobicContact CG-CD1 3.9Å; R247-Y251 HydrophobicContact CG-CE1 3.54Å; R247-Y251 HydrophobicContact CG-CE2 4.45Å; R247-Y251 HydrophobicContact CG-CG 4.5Å; R247-Y251 VanDerWaalsContact NE-CZ 3.26Å; R247-Y251 PolarHBondContact NE-OH 3.06Å; R247-Y251 PolarHBondContact NH2-OH 2.87Å; R247-Y251 VanDerWaalsContact O-CB 3.23Å; R247-Y251 WeakPolarHBondContact O-CB 3.37Å; R247-Y251 WeakPolarHBondContact O-CD1 3.49Å; R247-Y251 PolarHBondContact O-N 3.35Å
248	E	82.8	Confident	85.1	Confident	124 Å²	124	56 Å²	56	58%	0.579	28%	0.277	S	S	*	.	H	α-helix	trans	-73.9	-38.9	-177.9	-81.5	157.4	-160.2	0	0	112.2	T246 T252 L258	T246-E248 PolarHBondContact O-N 2.93Å; T246-E248 PolarHBondContact OG1-N 2.63Å; E248-T252 VanDerWaalsContact O-CB 3.29Å; E248-T252 WeakPolarHBondContact O-CB 3.43Å; E248-T252 PolarHBondContact O-N 3.29Å; E248-T252 PolarHBondContact O-OG1 3.41Å; E248-L258 HydrophobicContact CB-CD1 4.22Å; E248-L258 HydrophobicContact CG-CD1 3.35Å
249	E	86.5	Confident	85.3	Confident	11 Å²	11	55.6 Å²	55.6	5%	0.051	28%	0.275	C	S	.	.	H	α-helix	trans	-69.8	-45.8	175.4	-76.2	156.2	143.8	0	0	112.4	N237 I239 L245 T246 Y251 T252 A253	N237-E249 VanDerWaalsContact O-CB 3.27Å; N237-E249 WeakPolarHBondContact O-CB 2.95Å; N237-E249 WeakPolarHBondContact O-CG 3.22Å; I239-E249 HydrophobicContact CB-CG 4.19Å; I239-E249 WeakPolarHBondContact CB-OE1 3.48Å; I239-E249 HydrophobicContact CD1-CG 3.92Å; I239-E249 HydrophobicContact CG1-CG 3.99Å; I239-E249 PolarHBondContact N-OE1 3.46Å; L245-E249 HydrophobicContact CD2-CB 4.14Å; T246-E249 WeakPolarHBondContact CB-OE2 3.4Å; T246-E249 WeakPolarHBondContact CG2-OE2 3.44Å; T246-E249 PolarHBondContact N-OE2 2.69Å; T246-E249 PolarHBondContact O-N 2.96Å; T246-E249 PolarHBondContact OG1-N 2.87Å; T246-E249 PolarHBondContact OG1-OE2 2.88Å; E249-Y251 VanDerWaalsContact C-N 3.29Å; E249-Y251 PolarHBondContact O-N 2.81Å; E249-T252 CarbonylContact O-C 3.54Å; E249-T252 PolarHBondContact O-N 3.43Å; E249-A253 PolarHBondContact O-N 2.73Å
250	F	89.9	Confident	85.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.8	-38	174.7	-169.2	-93.3	0	0	0	111.9	V192 M195 F196 F199 I207 L233 L245 T246 A253 F254	V192-F250 HydrophobicContact CG1-CD1 3.97Å; V192-F250 HydrophobicContact CG1-CE1 3.99Å; M195-F250 HydrophobicContact CB-CE1 3.95Å; M195-F250 HydrophobicContact CB-CZ 4.03Å; M195-F250 HydrophobicContact CE-CE1 4.34Å; M195-F250 HydrophobicContact CE-CZ 4.11Å; F196-F250 HydrophobicContact CB-CD1 4.07Å; F196-F250 HydrophobicContact CB-CE1 4.04Å; F196-F250 HydrophobicContact CD2-CB 3.83Å; F196-F250 AromaticContact CD2-CD1 3.68Å; F196-F250 HydrophobicContact CD2-CD1 3.68Å; F196-F250 HydrophobicContact CD2-CE1 4.33Å; F196-F250 AromaticContact CD2-CG 3.77Å; F196-F250 HydrophobicContact CD2-CG 3.77Å; F196-F250 HydrophobicContact CE2-CB 4.07Å; F196-F250 HydrophobicContact CE2-CG 4.4Å; F196-F250 HydrophobicContact CG-CD1 4.39Å; F199-F250 AromaticContact CD2-CE2 3.49Å; F199-F250 HydrophobicContact CD2-CE2 3.49Å; F199-F250 VanDerWaalsContact CD2-CE2 3.49Å; F199-F250 AromaticContact CD2-CZ 3.78Å; F199-F250 HydrophobicContact CD2-CZ 3.78Å; F199-F250 AromaticContact CE2-CE2 3.74Å; F199-F250 HydrophobicContact CE2-CE2 3.74Å; F199-F250 AromaticContact CE2-CZ 3.9Å; F199-F250 HydrophobicContact CE2-CZ 3.9Å; F199-F250 HydrophobicContact CG-CE2 4.24Å; F199-F250 HydrophobicContact CG-CZ 4.21Å; F199-F250 HydrophobicContact CZ-CZ 4.42Å; I207-F250 HydrophobicContact CD1-CB 4.43Å; I207-F250 HydrophobicContact CD1-CD2 3.4Å; I207-F250 HydrophobicContact CD1-CE2 3.59Å; I207-F250 HydrophobicContact CD1-CG 3.9Å; I207-F250 HydrophobicContact CD1-CZ 4.22Å; L233-F250 HydrophobicContact CD1-CE2 4.3Å; L245-F250 HydrophobicContact CB-CB 4.46Å; L245-F250 HydrophobicContact CD1-CD2 4.08Å; T246-F250 WeakPolarHBondContact O-CB 3.32Å; T246-F250 PolarHBondContact O-N 3.45Å; F250-A253 WeakPolarHBondContact O-CB 3.49Å; F250-A253 PolarHBondContact O-N 3.07Å; F250-F254 HydrophobicContact CD1-CD2 4.12Å; F250-F254 HydrophobicContact CD1-CE2 4.29Å; F250-F254 HydrophobicContact CD2-CE2 4.24Å; F250-F254 AromaticContact CE1-CD2 3.9Å; F250-F254 HydrophobicContact CE1-CD2 3.9Å; F250-F254 AromaticContact CE1-CE2 3.84Å; F250-F254 HydrophobicContact CE1-CE2 3.84Å; F250-F254 AromaticContact CE2-CE2 3.77Å; F250-F254 HydrophobicContact CE2-CE2 3.77Å; F250-F254 HydrophobicContact CG-CE2 4.5Å; F250-F254 HydrophobicContact CZ-CD2 4.14Å; F250-F254 AromaticContact CZ-CE2 3.57Å; F250-F254 HydrophobicContact CZ-CE2 3.57Å; F250-F254 WeakPolarHBondContact O-CD2 3.26Å; F250-F254 PolarHBondContact O-N 3.24Å
251	Y	87.8	Confident	86.4	Confident	1 Å²	1	50.9 Å²	50.9	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-71.3	-41.6	178.6	-80.7	39.5	0	0	0	109.9	V192 D193 F196 R247 E249 A253 F254 D255 V256 L258	V192-Y251 HydrophobicContact CG1-CD1 3.78Å; V192-Y251 HydrophobicContact CG1-CE1 3.93Å; V192-Y251 HydrophobicContact CG1-CG 4.2Å; D193-Y251 WeakPolarHBondContact CA-OH 3.4Å; D193-Y251 PolarHBondContact OD1-OH 2.61Å; F196-Y251 HydrophobicContact CB-CE1 3.97Å; F196-Y251 HydrophobicContact CD2-CE1 4.24Å; F196-Y251 HydrophobicContact CG-CE1 4.13Å; R247-Y251 HydrophobicContact CG-CD1 3.9Å; R247-Y251 HydrophobicContact CG-CE1 3.54Å; R247-Y251 HydrophobicContact CG-CE2 4.45Å; R247-Y251 HydrophobicContact CG-CG 4.5Å; R247-Y251 VanDerWaalsContact NE-CZ 3.26Å; R247-Y251 PolarHBondContact NE-OH 3.06Å; R247-Y251 PolarHBondContact NH2-OH 2.87Å; R247-Y251 VanDerWaalsContact O-CB 3.23Å; R247-Y251 WeakPolarHBondContact O-CB 3.37Å; R247-Y251 WeakPolarHBondContact O-CD1 3.49Å; R247-Y251 PolarHBondContact O-N 3.35Å; E249-Y251 VanDerWaalsContact C-N 3.29Å; E249-Y251 PolarHBondContact O-N 2.81Å; Y251-A253 VanDerWaalsContact C-N 3.27Å; Y251-A253 PolarHBondContact O-N 3.38Å; Y251-F254 CarbonylContact O-C 3.57Å; Y251-F254 PolarHBondContact O-N 3.19Å; Y251-D255 PolarHBondContact O-N 2.96Å; Y251-V256 CarbonylContact C-O 3.55Å; Y251-V256 WeakPolarHBondContact CB-O 3.47Å; Y251-V256 HydrophobicContact CD2-CB 4.13Å; Y251-V256 HydrophobicContact CD2-CG1 3.63Å; Y251-V256 HydrophobicContact CE2-CG1 4.31Å; Y251-V256 HydrophobicContact CG-CB 4.28Å; Y251-V256 HydrophobicContact CG-CG1 4.28Å; Y251-V256 PolarHBondContact O-N 3.27Å; Y251-L258 HydrophobicContact CD2-CD1 3.93Å; Y251-L258 HydrophobicContact CD2-CD2 3.81Å; Y251-L258 HydrophobicContact CD2-CG 3.82Å; Y251-L258 HydrophobicContact CE2-CD2 4.01Å; Y251-L258 HydrophobicContact CG-CD1 4.18Å; Y251-L258 HydrophobicContact CG-CG 4.48Å
252	T	82.9	Confident	87.1	Confident	43 Å²	43	47.4 Å²	47.4	26%	0.264	24%	0.235	S	C	.	.	H	α-helix	trans	-60.1	-35.2	171.6	-61.5	0	0	0	0	112.1	E248 E249 F254 D255	E248-T252 VanDerWaalsContact O-CB 3.29Å; E248-T252 WeakPolarHBondContact O-CB 3.43Å; E248-T252 PolarHBondContact O-N 3.29Å; E248-T252 PolarHBondContact O-OG1 3.41Å; E249-T252 CarbonylContact O-C 3.54Å; E249-T252 PolarHBondContact O-N 3.43Å; T252-F254 PolarHBondContact O-N 3.07Å; T252-D255 PolarHBondContact O-N 3.41Å
253	A	86.1	Confident	87.4	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-46.5	174.8	0	0	0	0	0	111.2	K161 L233 N237 E249 F250 Y251 D255	K161-A253 HydrophobicContact CD-CB 4.44Å; K161-A253 WeakPolarHBondContact CD-O 3.42Å; K161-A253 WeakPolarHBondContact CE-O 3.48Å; K161-A253 PolarHBondContact NZ-O 3.31Å; L233-A253 HydrophobicContact CD2-CB 4.27Å; N237-A253 HydrophobicContact CB-CB 3.78Å; N237-A253 VanDerWaalsContact CG-CB 3.44Å; N237-A253 WeakPolarHBondContact ND2-CA 3.26Å; N237-A253 PolarHBondContact ND2-N 3.46Å; N237-A253 WeakPolarHBondContact OD1-CA 3.45Å; N237-A253 WeakPolarHBondContact OD1-CB 3.04Å; E249-A253 PolarHBondContact O-N 2.73Å; F250-A253 WeakPolarHBondContact O-CB 3.49Å; F250-A253 PolarHBondContact O-N 3.07Å; Y251-A253 VanDerWaalsContact C-N 3.27Å; Y251-A253 PolarHBondContact O-N 3.38Å; A253-D255 VanDerWaalsContact C-N 3.29Å; A253-D255 PolarHBondContact O-N 3.04Å
254	F	88.7	Confident	87.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	25.1	178.7	-62.7	-75.1	0	0	0	113.8	K161 I164 L165 K188 V192 M195 L233 F250 Y251 T252 V256	K161-F254 HydrophobicContact CB-CD1 4.28Å; K161-F254 HydrophobicContact CB-CE1 4.01Å; K161-F254 HydrophobicContact CG-CE1 4.12Å; I164-F254 HydrophobicContact CB-CE1 4.16Å; I164-F254 HydrophobicContact CB-CZ 4.46Å; I164-F254 HydrophobicContact CD1-CE1 4.41Å; I164-F254 HydrophobicContact CD1-CZ 4.24Å; I164-F254 HydrophobicContact CG2-CE1 4.07Å; I164-F254 HydrophobicContact CG2-CZ 4.01Å; L165-F254 HydrophobicContact CD1-CD1 3.99Å; L165-F254 HydrophobicContact CD2-CB 4.47Å; L165-F254 HydrophobicContact CD2-CD1 3.94Å; L165-F254 HydrophobicContact CD2-CG 4.37Å; L165-F254 HydrophobicContact CG-CD1 3.79Å; L165-F254 HydrophobicContact CG-CE1 4.29Å; K188-F254 WeakPolarHBondContact CE-O 3.34Å; K188-F254 PolarHBondContact NZ-O 3.34Å; V192-F254 HydrophobicContact CG1-CB 4.32Å; V192-F254 HydrophobicContact CG1-CD2 4.4Å; V192-F254 HydrophobicContact CG2-CB 3.55Å; V192-F254 HydrophobicContact CG2-CD2 4.41Å; V192-F254 HydrophobicContact CG2-CG 4.05Å; M195-F254 HydrophobicContact CE-CD1 4.14Å; M195-F254 HydrophobicContact CE-CD2 3.91Å; M195-F254 HydrophobicContact CE-CE1 3.79Å; M195-F254 HydrophobicContact CE-CE2 3.56Å; M195-F254 HydrophobicContact CE-CG 4.2Å; M195-F254 HydrophobicContact CE-CZ 3.49Å; M195-F254 VanDerWaalsContact CE-CZ 3.49Å; L233-F254 HydrophobicContact CD1-CZ 4.32Å; L233-F254 HydrophobicContact CD2-CE2 4.12Å; L233-F254 HydrophobicContact CD2-CZ 3.84Å; F250-F254 HydrophobicContact CD1-CD2 4.12Å; F250-F254 HydrophobicContact CD1-CE2 4.29Å; F250-F254 HydrophobicContact CD2-CE2 4.24Å; F250-F254 AromaticContact CE1-CD2 3.9Å; F250-F254 HydrophobicContact CE1-CD2 3.9Å; F250-F254 AromaticContact CE1-CE2 3.84Å; F250-F254 HydrophobicContact CE1-CE2 3.84Å; F250-F254 AromaticContact CE2-CE2 3.77Å; F250-F254 HydrophobicContact CE2-CE2 3.77Å; F250-F254 HydrophobicContact CG-CE2 4.5Å; F250-F254 HydrophobicContact CZ-CD2 4.14Å; F250-F254 AromaticContact CZ-CE2 3.57Å; F250-F254 HydrophobicContact CZ-CE2 3.57Å; F250-F254 WeakPolarHBondContact O-CD2 3.26Å; F250-F254 PolarHBondContact O-N 3.24Å; Y251-F254 CarbonylContact O-C 3.57Å; Y251-F254 PolarHBondContact O-N 3.19Å; T252-F254 PolarHBondContact O-N 3.07Å; F254-V256 HydrophobicContact CB-CG2 4.48Å; F254-V256 PolarHBondContact O-N 2.71Å; F254-V256 VanDerWaalsContact O-N 3.16Å
255	D	80.2	Confident	87.9	Confident	81 Å²	81	52.6 Å²	52.6	43%	0.433	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	39.7	-179.4	-13.3	-86.2	0	0	0	113.3	M185 K188 Y251 T252 A253	M185-D255 VanDerWaalsContact CE-O 3.3Å; M185-D255 WeakPolarHBondContact CE-O 3.44Å; K188-D255 IonicContact NZ-OD2 3.84Å; K188-D255 PolarHBondContact NZ-OD2 2.83Å; Y251-D255 PolarHBondContact O-N 2.96Å; T252-D255 PolarHBondContact O-N 3.41Å; A253-D255 VanDerWaalsContact C-N 3.29Å; A253-D255 PolarHBondContact O-N 3.04Å
256	V	85.4	Confident	88.1	Confident	3 Å²	3	56.8 Å²	56.8	2%	0.018	28%	0.279	C	S	.	.			trans	-99.3	114.7	172.6	-177.9	0	0	0	0	108.9	M185 K189 V192 Y251 F254	M185-V256 HydrophobicContact CE-CB 4.05Å; M185-V256 HydrophobicContact CE-CG1 4.21Å; M185-V256 HydrophobicContact CE-CG2 3.7Å; K189-V256 HydrophobicContact CB-CG1 3.95Å; K189-V256 HydrophobicContact CD-CG1 4.03Å; K189-V256 HydrophobicContact CG-CG1 3.81Å; V192-V256 HydrophobicContact CB-CG2 3.86Å; V192-V256 HydrophobicContact CG1-CG2 3.98Å; V192-V256 HydrophobicContact CG2-CG2 3.77Å; Y251-V256 CarbonylContact C-O 3.55Å; Y251-V256 WeakPolarHBondContact CB-O 3.47Å; Y251-V256 HydrophobicContact CD2-CB 4.13Å; Y251-V256 HydrophobicContact CD2-CG1 3.63Å; Y251-V256 HydrophobicContact CE2-CG1 4.31Å; Y251-V256 HydrophobicContact CG-CB 4.28Å; Y251-V256 HydrophobicContact CG-CG1 4.28Å; Y251-V256 PolarHBondContact O-N 3.27Å; F254-V256 HydrophobicContact CB-CG2 4.48Å; F254-V256 PolarHBondContact O-N 2.71Å; F254-V256 VanDerWaalsContact O-N 3.16Å
257	Y	83.5	Confident	88.4	Confident	70 Å²	70	59 Å²	59	28%	0.275	29%	0.292	S	S	.	.			trans	-76.7	137.1	173.9	-52.7	-76.2	0	0	0	111.3	R288 P290 Y338	Y257-R288 HydrophobicContact CD1-CB 3.71Å; Y257-R288 WeakPolarHBondContact CD1-O 3.39Å; Y257-R288 HydrophobicContact CE1-CB 3.76Å; Y257-P290 HydrophobicContact CD2-CB 4.26Å; Y257-P290 HydrophobicContact CD2-CG 3.93Å; Y257-P290 HydrophobicContact CE2-CB 4.06Å; Y257-P290 HydrophobicContact CE2-CG 4.25Å; Y257-Y338 WeakPolarHBondContact CA-OH 3.4Å; Y257-Y338 HydrophobicContact CD2-CE2 4.19Å; Y257-Y338 PolarHBondContact N-OH 2.79Å; Y257-Y338 WeakPolarHBondContact O-CE1 3.37Å; Y257-Y338 PolarHBondContact O-OH 3.09Å
258	L	82.6	Confident	88.8	Confident	56 Å²	56	55.2 Å²	55.2	29%	0.293	28%	0.282	S	S	.	.			trans	-97.4	105.9	168.4	-77.4	161.1	0	0	0	107.8	E248 Y251	E248-L258 HydrophobicContact CB-CD1 4.22Å; E248-L258 HydrophobicContact CG-CD1 3.35Å; Y251-L258 HydrophobicContact CD2-CD1 3.93Å; Y251-L258 HydrophobicContact CD2-CD2 3.81Å; Y251-L258 HydrophobicContact CD2-CG 3.82Å; Y251-L258 HydrophobicContact CE2-CD2 4.01Å; Y251-L258 HydrophobicContact CG-CD1 4.18Å; Y251-L258 HydrophobicContact CG-CG 4.48Å
259	L	87.9	Confident	89.4	Confident	23 Å²	23	53.3 Å²	53.3	12%	0.12	28%	0.278	C	S	.	.			trans	-113.7	142	-173.5	-57.5	-178.7	0	0	0	110.2	I284 T285 R289 A335 Y338 L341	L259-I284 HydrophobicContact CB-CG2 4.03Å; L259-I284 HydrophobicContact CD1-CG2 4.12Å; L259-I284 HydrophobicContact CG-CG2 4.48Å; L259-T285 CarbonylContact C-O 3.52Å; L259-T285 VanDerWaalsContact CA-O 3.27Å; L259-T285 WeakPolarHBondContact CA-O 3.33Å; L259-R289 HydrophobicContact CD2-CB 3.64Å; L259-A335 HydrophobicContact CD1-CB 3.52Å; L259-Y338 HydrophobicContact CD1-CD1 3.77Å; L259-Y338 HydrophobicContact CD1-CD2 4.03Å; L259-Y338 HydrophobicContact CD1-CE1 4.06Å; L259-Y338 HydrophobicContact CD1-CE2 4.33Å; L259-Y338 HydrophobicContact CD1-CG 3.77Å; L259-Y338 HydrophobicContact CG-CD1 4.38Å; L259-Y338 HydrophobicContact CG-CE1 4.3Å; L259-L341 HydrophobicContact CB-CD2 3.58Å
260	N	89.9	Confident	89.8	Confident	97 Å²	97	54.5 Å²	54.5	52%	0.519	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-121.6	145	177.8	-174.4	28.6	0	0	0	111	I284 T285	N260-I284 WeakPolarHBondContact O-CA 3.43Å; N260-T285 PolarHBondContact N-O 3.31Å; N260-T285 PolarHBondContact O-N 2.86Å; N260-T285 PolarHBondContact O-OG1 3.45Å
261	L	93.5	Very high	90.1	Very high	8 Å²	8	58 Å²	58	4%	0.042	31%	0.308	C	S	.	.			trans	-143.7	106.9	168.7	177.2	63.2	0	0	0	107.2	Q265 K266 A283 I284 L341 F342 Q343	L261-Q265 HydrophobicContact CD1-CB 4.02Å; L261-K266 HydrophobicContact CD2-CG 3.99Å; L261-K266 HydrophobicContact CG-CG 4.19Å; L261-A283 HydrophobicContact CD1-CB 3.82Å; L261-I284 HydrophobicContact CB-CG1 4.34Å; L261-I284 HydrophobicContact CD1-CG1 4.29Å; L261-I284 HydrophobicContact CD2-CG1 4.25Å; L261-L341 HydrophobicContact CB-CD1 3.79Å; L261-L341 HydrophobicContact CB-CG 4.1Å; L261-F342 VanDerWaalsContact CD2-C 3.46Å; L261-F342 WeakPolarHBondContact CD2-O 3.35Å; L261-Q343 HydrophobicContact CD1-CB 4.28Å; L261-Q343 HydrophobicContact CD2-CB 3.98Å
262	P	93.3	Very high	90.5	Very high	45 Å²	45	58.6 Å²	58.6	29%	0.292	31%	0.312	S	S	.	.			trans	-54	142.7	176.5	-27	35.3	0	0	0	112.2	E264 Q265 K266	P262-E264 VanDerWaalsContact C-N 3.26Å; P262-E264 PolarHBondContact O-N 2.93Å; P262-Q265 HydrophobicContact CB-CB 4.35Å; P262-Q265 HydrophobicContact CB-CG 4.27Å; P262-Q265 WeakPolarHBondContact O-CA 3.24Å; P262-Q265 PolarHBondContact O-N 2.64Å; P262-K266 PolarHBondContact O-N 2.8Å
263	D	91.6	Very high	91.2	Very high	123 Å²	123	58.5 Å²	58.5	66%	0.658	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-56.3	-40.6	-178.8	-79.3	-58.7	0	0	0	112.7	Q265 K266	D263-Q265 PolarHBondContact O-N 2.85Å; D263-K266 WeakPolarHBondContact O-CB 3.34Å; D263-K266 PolarHBondContact O-N 3.08Å; D263-K266 VanDerWaalsContact OD1-CE 3.23Å; D263-K266 WeakPolarHBondContact OD1-CE 3.32Å; D263-K266 IonicContact OD1-NZ 3.35Å; D263-K266 PolarHBondContact OD1-NZ 3.09Å
264	E	93.2	Very high	91.6	Very high	186 Å²	186	61.2 Å²	61.2	87%	0.869	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-60.8	-24.5	175.7	-61.8	177.5	-178.1	0	0	113.3	P262	P262-E264 VanDerWaalsContact C-N 3.26Å; P262-E264 PolarHBondContact O-N 2.93Å
265	Q	93.1	Very high	91.8	Very high	90 Å²	90	63.2 Å²	63.2	42%	0.421	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-97.9	-1	-178.3	-66.4	-179.1	-15.2	0	0	112.9	L261 P262 D263 V267 A283 Q343	L261-Q265 HydrophobicContact CD1-CB 4.02Å; P262-Q265 HydrophobicContact CB-CB 4.35Å; P262-Q265 HydrophobicContact CB-CG 4.27Å; P262-Q265 WeakPolarHBondContact O-CA 3.24Å; P262-Q265 PolarHBondContact O-N 2.64Å; D263-Q265 PolarHBondContact O-N 2.85Å; Q265-V267 PolarHBondContact O-N 2.99Å; Q265-A283 HydrophobicContact CB-CB 4.06Å; Q265-Q343 VanDerWaalsContact O-CG 3.26Å; Q265-Q343 WeakPolarHBondContact O-CG 3.22Å; Q265-Q343 PolarHBondContact O-NE2 3.45Å
266	K	94.2	Very high	92.4	Very high	87 Å²	87	64.3 Å²	64.3	38%	0.378	35%	0.35	S	S	.	.	S	Bend	trans	-63.9	-23.2	177	-73.6	177.8	174.8	171.7	0	113.9	L261 P262 D263 Q343 T344	L261-K266 HydrophobicContact CD2-CG 3.99Å; L261-K266 HydrophobicContact CG-CG 4.19Å; P262-K266 PolarHBondContact O-N 2.8Å; D263-K266 WeakPolarHBondContact O-CB 3.34Å; D263-K266 PolarHBondContact O-N 3.08Å; D263-K266 VanDerWaalsContact OD1-CE 3.23Å; D263-K266 WeakPolarHBondContact OD1-CE 3.32Å; D263-K266 IonicContact OD1-NZ 3.35Å; D263-K266 PolarHBondContact OD1-NZ 3.09Å; K266-Q343 WeakPolarHBondContact O-CA 3.37Å; K266-T344 PolarHBondContact O-N 2.99Å
267	V	96.6	Very high	92.7	Very high	86 Å²	86	68.2 Å²	68.2	52%	0.521	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	131.3	171.5	-176.3	0	0	0	0	109	Q265 T344 I346	Q265-V267 PolarHBondContact O-N 2.99Å; V267-T344 WeakPolarHBondContact CA-O 3.43Å; V267-I346 HydrophobicContact CG1-CD1 3.97Å; V267-I346 HydrophobicContact CG1-CG1 4.36Å
268	S	95.6	Very high	93	Very high	25 Å²	25	65.1 Å²	65.1	18%	0.175	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	149.5	176.2	41.7	0	0	0	0	109.5	Q343 T344 H345 I346	S268-Q343 PolarHBondContact OG-NE2 3.47Å; S268-T344 PolarHBondContact N-O 2.87Å; S268-T344 PolarHBondContact OG-O 3.33Å; S268-H345 CarbonylContact O-C 3.56Å; S268-H345 WeakPolarHBondContact O-CA 3.37Å; S268-H345 WeakPolarHBondContact OG-CA 3.36Å; S268-H345 PolarHBondContact OG-CD2 2.79Å; S268-H345 VanDerWaalsContact OG-CD2 3.26Å; S268-H345 PolarHBondContact OG-CE1 3.4Å; S268-H345 PolarHBondContact OG-ND1 3.34Å; S268-H345 PolarHBondContact OG-NE2 3.02Å; S268-I346 PolarHBondContact O-N 3.31Å
269	V	95.6	Very high	93.5	Very high	84 Å²	84	65.3 Å²	65.3	51%	0.509	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	127.9	178.3	-174.9	0	0	0	0	108.5	I346 Q348	V269-I346 WeakPolarHBondContact CA-O 3.25Å; V269-I346 HydrophobicContact CG2-CB 4.3Å; V269-I346 HydrophobicContact CG2-CD1 4.39Å; V269-Q348 HydrophobicContact CG1-CG 4.36Å; V269-Q348 VanDerWaalsContact CG1-NE2 3.29Å
270	T	95.1	Very high	93.7	Very high	36 Å²	36	64.2 Å²	64.2	22%	0.221	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	117.8	179.5	-57.7	0	0	0	0	108	V272 I346 L347 Q348	T270-V272 HydrophobicContact CG2-CG2 3.82Å; T270-I346 PolarHBondContact N-O 3.2Å; T270-L347 HydrophobicContact CG2-CD1 4.43Å; T270-L347 WeakPolarHBondContact O-CD1 3.11Å; T270-Q348 PolarHBondContact O-N 2.78Å
271	T	96	Very high	93.8	Very high	73 Å²	73	63.4 Å²	63.4	45%	0.448	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.3	178.6	-55.1	0	0	0	0	109.4	Q348 N350	T271-Q348 WeakPolarHBondContact CA-O 3.49Å; T271-Q348 HydrophobicContact CG2-CB 4.31Å; T271-N350 WeakPolarHBondContact CG2-ND2 3.48Å; T271-N350 WeakPolarHBondContact CG2-OD1 3.38Å
272	V	96.4	Very high	93.7	Very high	15 Å²	15	63.7 Å²	63.7	9%	0.091	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	145	-172.1	-175.6	0	0	0	0	110	T270 Q276 A278 V323 L347 Q348 V349 N350	T270-V272 HydrophobicContact CG2-CG2 3.82Å; V272-Q276 HydrophobicContact CG1-CB 3.77Å; V272-A278 HydrophobicContact CG2-CB 3.92Å; V272-V323 HydrophobicContact CB-CG1 4.49Å; V272-V323 HydrophobicContact CB-CG2 4.48Å; V272-V323 HydrophobicContact CG1-CB 4.28Å; V272-V323 HydrophobicContact CG1-CG1 4.48Å; V272-V323 HydrophobicContact CG1-CG2 3.99Å; V272-L347 HydrophobicContact CG2-CD1 4.13Å; V272-Q348 PolarHBondContact N-O 2.92Å; V272-V349 CarbonylContact O-C 3.59Å; V272-V349 WeakPolarHBondContact O-CA 3.42Å; V272-N350 PolarHBondContact O-N 3.21Å
273	T	96.7	Very high	93.7	Very high	41 Å²	41	62.5 Å²	62.5	25%	0.252	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	139.5	175.6	-50	0	0	0	0	110.1	G275 Q276 N350 A431	T273-G275 PolarHBondContact O-N 2.89Å; T273-Q276 VanDerWaalsContact O-CB 3.27Å; T273-Q276 WeakPolarHBondContact O-CB 3.36Å; T273-Q276 WeakPolarHBondContact O-CG 3.46Å; T273-Q276 PolarHBondContact O-N 2.99Å; T273-Q276 VanDerWaalsContact O-N 3.09Å; T273-N350 CarbonylContact C-O 3.4Å; T273-N350 WeakPolarHBondContact CA-O 3.14Å; T273-A431 HydrophobicContact CG2-CB 4.2Å
274	V	95.3	Very high	93.7	Very high	56 Å²	56	56.8 Å²	56.8	34%	0.339	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	137.1	178.6	66.8	0	0	0	0	112.3	Q276 V349 N350 V351	V274-Q276 VanDerWaalsContact C-N 3.3Å; V274-Q276 PolarHBondContact O-N 2.95Å; V274-V349 HydrophobicContact CB-CG1 4.27Å; V274-N350 PolarHBondContact N-O 3.27Å; V274-V351 HydrophobicContact CB-CG2 4.16Å; V274-V351 HydrophobicContact CG1-CB 4.36Å; V274-V351 HydrophobicContact CG1-CG1 4.23Å; V274-V351 HydrophobicContact CG1-CG2 4.21Å
275	G	92.3	Very high	93.6	Very high	42 Å²	42	51.4 Å²	51.4	43%	0.433	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	-15.1	-176.7	0	0	0	0	0	115.6	T273 V323	T273-G275 PolarHBondContact O-N 2.89Å; G275-V323 PolarHBondContact N-O 2.81Å
276	Q	93.3	Very high	93.2	Very high	104 Å²	104	48.8 Å²	48.8	49%	0.486	31%	0.306	S	S	.	.	S	Bend	trans	-76.9	165.2	170.9	-60.2	177.6	-33.9	0	0	111.2	V272 T273 V274 V323	V272-Q276 HydrophobicContact CG1-CB 3.77Å; T273-Q276 VanDerWaalsContact O-CB 3.27Å; T273-Q276 WeakPolarHBondContact O-CB 3.36Å; T273-Q276 WeakPolarHBondContact O-CG 3.46Å; T273-Q276 PolarHBondContact O-N 2.99Å; T273-Q276 VanDerWaalsContact O-N 3.09Å; V274-Q276 VanDerWaalsContact C-N 3.3Å; V274-Q276 PolarHBondContact O-N 2.95Å; Q276-V323 VanDerWaalsContact O-CB 3.3Å; Q276-V323 WeakPolarHBondContact O-CB 3.38Å; Q276-V323 VanDerWaalsContact O-CG2 3.31Å; Q276-V323 WeakPolarHBondContact O-CG2 3.26Å; Q276-V323 PolarHBondContact O-N 2.85Å
277	S	90.3	Very high	92.4	Very high	85 Å²	85	54 Å²	54	59%	0.594	33%	0.332	S	S	*	.			trans	-85.9	155.1	169.6	-47.1	0	0	0	0	111.1	V320 T321	S277-V320 CarbonylContact C-O 3.5Å; S277-V320 VanDerWaalsContact CA-O 3.23Å; S277-V320 WeakPolarHBondContact CA-O 3.23Å; S277-V320 WeakPolarHBondContact CB-O 3.31Å; S277-T321 WeakPolarHBondContact CB-O 3.23Å; S277-T321 PolarHBondContact OG-O 3.34Å
278	A	91.4	Very high	91.6	Very high	5 Å²	5	57.8 Å²	57.8	4%	0.041	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	153.2	172.4	0	0	0	0	0	111.4	V272 Y319 V320 V323	V272-A278 HydrophobicContact CG2-CB 3.92Å; A278-Y319 WeakPolarHBondContact O-CA 3.48Å; A278-V320 HydrophobicContact CB-CB 4.05Å; A278-V320 HydrophobicContact CB-CG2 4.02Å; A278-V320 PolarHBondContact N-O 2.02Å; A278-V320 PolarHBondContact O-N 3.41Å; A278-V323 HydrophobicContact CB-CG2 3.65Å
279	V	91.4	Very high	90.9	Very high	61 Å²	61	61 Å²	61	37%	0.37	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	123.2	171.2	-169.4	0	0	0	0	108.1	T281 Y319	V279-T281 HydrophobicContact CG1-CG2 4.14Å; V279-Y319 HydrophobicContact CB-CD1 4.28Å; V279-Y319 HydrophobicContact CB-CE1 4.26Å; V279-Y319 HydrophobicContact CG1-CD1 3.92Å; V279-Y319 HydrophobicContact CG1-CD2 4.31Å; V279-Y319 HydrophobicContact CG1-CE1 3.62Å; V279-Y319 HydrophobicContact CG1-CE2 4.04Å; V279-Y319 HydrophobicContact CG1-CG 4.23Å; V279-Y319 HydrophobicContact CG2-CD1 3.5Å; V279-Y319 VanDerWaalsContact CG2-CD1 3.5Å; V279-Y319 HydrophobicContact CG2-CE1 3.57Å; V279-Y319 HydrophobicContact CG2-CG 4.35Å
280	M	93.1	Very high	90.4	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	112.6	174.8	-69.4	176.9	-78.5	0	0	108.4	W294 S317 L318 V320 Y331 H345 L347	M280-W294 HydrophobicContact CB-CH2 3.56Å; M280-W294 HydrophobicContact CB-CZ2 4.27Å; M280-W294 HydrophobicContact CB-CZ3 3.94Å; M280-W294 WeakPolarHBondContact O-CH2 3.49Å; M280-W294 WeakPolarHBondContact O-CZ2 3.49Å; M280-S317 WeakPolarHBondContact O-CA 3.42Å; M280-S317 WeakPolarHBondContact O-CB 3.36Å; M280-L318 HydrophobicContact CE-CD2 3.7Å; M280-L318 HydrophobicContact CE-CG 3.98Å; M280-L318 PolarHBondContact N-O 2.97Å; M280-L318 PolarHBondContact O-N 3.21Å; M280-V320 HydrophobicContact CE-CG2 3.89Å; M280-Y331 HydrophobicContact CE-CD1 4Å; M280-Y331 HydrophobicContact CE-CD2 4.13Å; M280-Y331 HydrophobicContact CE-CE1 4.15Å; M280-Y331 HydrophobicContact CE-CE2 4.3Å; M280-Y331 HydrophobicContact CE-CG 4Å; M280-Y331 HydrophobicContact SD-CD2 3.99Å; M280-Y331 HydrophobicContact SD-CG 4.02Å; M280-H345 HydrophobicContact CG-CB 4.33Å; M280-H345 HydrophobicContact SD-CB 3.93Å; M280-L347 HydrophobicContact CE-CD2 4.13Å; M280-L347 HydrophobicContact SD-CB 4.26Å; M280-L347 HydrophobicContact SD-CD2 4.41Å
281	T	91.3	Very high	90	Very high	79 Å²	79	60.2 Å²	60.2	49%	0.485	34%	0.342	S	S	.	.			trans	-97.7	127.7	-173.8	58.9	0	0	0	0	111.4	V279 A283 S317 Q343 H345	V279-T281 HydrophobicContact CG1-CG2 4.14Å; T281-A283 PolarHBondContact O-N 3.42Å; T281-S317 WeakPolarHBondContact CA-OG 3.43Å; T281-S317 WeakPolarHBondContact CG2-OG 3.48Å; T281-Q343 PolarHBondContact O-OE1 2.99Å; T281-H345 PolarHBondContact O-CE1 2.66Å; T281-H345 PolarHBondContact O-NE2 2.9Å
282	C	91.9	Very high	89.7	Confident	14 Å²	14	57 Å²	57	10%	0.095	32%	0.323	C	S	.	.			trans	-83.1	116.1	-177.9	-162.4	0	0	0	0	111.4	I284 I292 W294 C333	C282-I284 PolarHBondContact O-N 2.85Å; C282-I284 VanDerWaalsContact O-N 3.09Å; C282-I292 HydrophobicContact CB-CD1 4.36Å; C282-I292 HydrophobicContact CB-CG1 4.18Å; C282-I292 HydrophobicContact CB-CG2 3.69Å; C282-W294 HydrophobicContact CB-CZ2 3.96Å; C282-C333 WeakPolarHBondContact CA-SG 3.27Å; C282-C333 HydrophobicContact CB-CB 3.79Å; C282-C333 WeakPolarHBondContact CB-SG 3.12Å; C282-C333 WeakPolarHBondContact SG-CB 3.46Å; C282-C333 CovalentContact SG-SG 2.04Å; C282-C333 PolarHBondContact SG-SG 2.83Å
283	A	93.4	Very high	89.5	Confident	20 Å²	20	58 Å²	58	17%	0.165	33%	0.327	C	S	.	.			trans	-77.8	12.9	-173.8	0	0	0	0	0	115.1	L261 Q265 T281 T285	L261-A283 HydrophobicContact CD1-CB 3.82Å; Q265-A283 HydrophobicContact CB-CB 4.06Å; T281-A283 PolarHBondContact O-N 3.42Å; A283-T285 PolarHBondContact O-N 2.85Å
284	I	92.4	Very high	89.4	Confident	4 Å²	4	56 Å²	56	2%	0.021	32%	0.315	C	S	.	.			trans	-78.9	118.2	177.8	-60.8	172.1	0	0	0	109	L259 N260 L261 C282 A335 L341	L259-I284 HydrophobicContact CB-CG2 4.03Å; L259-I284 HydrophobicContact CD1-CG2 4.12Å; L259-I284 HydrophobicContact CG-CG2 4.48Å; N260-I284 WeakPolarHBondContact O-CA 3.43Å; L261-I284 HydrophobicContact CB-CG1 4.34Å; L261-I284 HydrophobicContact CD1-CG1 4.29Å; L261-I284 HydrophobicContact CD2-CG1 4.25Å; C282-I284 PolarHBondContact O-N 2.85Å; C282-I284 VanDerWaalsContact O-N 3.09Å; I284-A335 HydrophobicContact CG2-CB 4.44Å; I284-L341 WeakPolarHBondContact CD1-O 3.45Å; I284-L341 HydrophobicContact CG2-CD2 4.09Å
285	T	89.8	Confident	89.3	Confident	73 Å²	73	55.3 Å²	55.3	45%	0.448	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-113.6	157.5	-173.2	52.1	0	0	0	0	112.1	L259 N260 A283	L259-T285 CarbonylContact C-O 3.52Å; L259-T285 VanDerWaalsContact CA-O 3.27Å; L259-T285 WeakPolarHBondContact CA-O 3.33Å; N260-T285 PolarHBondContact N-O 3.31Å; N260-T285 PolarHBondContact O-N 2.86Å; N260-T285 PolarHBondContact O-OG1 3.45Å; A283-T285 PolarHBondContact O-N 2.85Å
286	G	84.3	Confident	89.4	Confident	35 Å²	35	53.4 Å²	53.4	36%	0.361	29%	0.287	S	S	.	.			trans	165.6	150.4	176.9	0	0	0	0	0	109.8	R288	G286-R288 PolarHBondContact O-N 3.25Å
287	E	78.2	Confident	89.3	Confident	197 Å²	197	50.8 Å²	50.8	92%	0.921	28%	0.276	S	S	*	.	S	Bend	trans	-59.1	-33.1	-177.3	-59.2	-160.2	142.1	0	0	113.1
288	R	78.8	Confident	89.3	Confident	164 Å²	164	52.9 Å²	52.9	62%	0.619	28%	0.281	S	S	*	.	S	Bend	trans	-132.3	142.4	165.5	-58.6	-177.2	-172.6	-177.6	5.2	107.9	Y257 G286	Y257-R288 HydrophobicContact CD1-CB 3.71Å; Y257-R288 WeakPolarHBondContact CD1-O 3.39Å; Y257-R288 HydrophobicContact CE1-CB 3.76Å; G286-R288 PolarHBondContact O-N 3.25Å
289	R	81.4	Confident	89.3	Confident	92 Å²	92	56.1 Å²	56.1	35%	0.347	30%	0.295	S	S	.	.			trans	-140.1	150.5	176.7	62.5	179.7	179.3	144.6	13.3	110	L259 D315	L259-R289 HydrophobicContact CD2-CB 3.64Å; R289-D315 VanDerWaalsContact CZ-O 3.26Å; R289-D315 PolarHBondContact NH1-O 2.87Å; R289-D315 PolarHBondContact NH2-O 2.82Å
290	P	84.9	Confident	89.3	Confident	15 Å²	15	56.6 Å²	56.6	10%	0.097	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-75.4	173.5	166.8	34.4	-30.4	0	0	0	109.9	Y257 A335 D336 Y338	Y257-P290 HydrophobicContact CD2-CB 4.26Å; Y257-P290 HydrophobicContact CD2-CG 3.93Å; Y257-P290 HydrophobicContact CE2-CB 4.06Å; Y257-P290 HydrophobicContact CE2-CG 4.25Å; P290-A335 HydrophobicContact CG-CB 3.83Å; P290-D336 HydrophobicContact CB-CB 4.21Å; P290-D336 WeakPolarHBondContact CG-O 3.29Å; P290-Y338 HydrophobicContact CG-CD2 4.18Å; P290-Y338 HydrophobicContact CG-CE2 4.29Å
291	P	87.2	Confident	89.2	Confident	89 Å²	89	56.7 Å²	56.7	58%	0.578	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-56	151.3	179.8	-26.1	36	0	0	0	113.3	A335 D336	P291-A335 WeakPolarHBondContact O-CA 3.23Å; P291-D336 PolarHBondContact O-N 3.47Å
292	I	90.3	Very high	89	Confident	6 Å²	6	55.8 Å²	55.8	3%	0.031	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	124.3	173.9	-59.2	-56.6	0	0	0	109.9	C282 N302 C333 H334 A335	C282-I292 HydrophobicContact CB-CD1 4.36Å; C282-I292 HydrophobicContact CB-CG1 4.18Å; C282-I292 HydrophobicContact CB-CG2 3.69Å; I292-N302 PolarHBondContact O-ND2 2.61Å; I292-C333 HydrophobicContact CG2-CB 3.88Å; I292-H334 WeakPolarHBondContact CA-O 3.25Å; I292-A335 HydrophobicContact CD1-CB 4.09Å
293	L	91.1	Very high	88.5	Confident	35 Å²	35	59.7 Å²	59.7	18%	0.183	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	122.2	174.2	-59.1	-175.4	0	0	0	109.9	Y300 C333 H334 D336	L293-Y300 HydrophobicContact CB-CD1 4.13Å; L293-Y300 HydrophobicContact CB-CE1 4.16Å; L293-Y300 HydrophobicContact CD1-CD1 4.27Å; L293-Y300 HydrophobicContact CD1-CE1 3.96Å; L293-C333 WeakPolarHBondContact O-CA 3.16Å; L293-H334 PolarHBondContact N-O 3.04Å; L293-H334 PolarHBondContact O-N 3.43Å; L293-H334 VanDerWaalsContact O-N 3.09Å; L293-H334 PolarHBondContact O-ND1 3.48Å; L293-D336 HydrophobicContact CD1-CB 4Å; L293-D336 HydrophobicContact CG-CB 4.14Å
294	W	94.3	Very high	88	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	138.8	174.9	-73.4	90.4	0	0	0	110.8	M280 C282 Y300 L301 N302 F312 G316 L318 T332 C333 H345	M280-W294 HydrophobicContact CB-CH2 3.56Å; M280-W294 HydrophobicContact CB-CZ2 4.27Å; M280-W294 HydrophobicContact CB-CZ3 3.94Å; M280-W294 WeakPolarHBondContact O-CH2 3.49Å; M280-W294 WeakPolarHBondContact O-CZ2 3.49Å; C282-W294 HydrophobicContact CB-CZ2 3.96Å; W294-Y300 WeakPolarHBondContact O-CA 3.4Å; W294-L301 HydrophobicContact CB-CB 4.28Å; W294-L301 HydrophobicContact CB-CD1 4.32Å; W294-L301 PolarHBondContact O-N 3.11Å; W294-N302 PolarHBondContact N-OD1 2.65Å; W294-F312 HydrophobicContact CB-CE1 4.34Å; W294-G316 PolarHBondContact NE1-O 3.2Å; W294-L318 HydrophobicContact CB-CD2 4.18Å; W294-L318 HydrophobicContact CD2-CB 3.62Å; W294-L318 HydrophobicContact CD2-CD2 3.92Å; W294-L318 HydrophobicContact CD2-CG 4.44Å; W294-L318 HydrophobicContact CE3-CB 4.14Å; W294-L318 HydrophobicContact CE3-CD2 3.87Å; W294-L318 HydrophobicContact CG-CB 3.88Å; W294-L318 HydrophobicContact CG-CD2 4.06Å; W294-L318 HydrophobicContact CZ2-CB 4.06Å; W294-T332 CarbonylContact C-O 3.47Å; W294-T332 WeakPolarHBondContact CA-O 3.45Å; W294-C333 HydrophobicContact CD2-CB 3.72Å; W294-C333 HydrophobicContact CE3-CB 3.73Å; W294-C333 HydrophobicContact CG-CB 4.47Å; W294-C333 HydrophobicContact CH2-CB 3.69Å; W294-C333 HydrophobicContact CZ2-CB 3.66Å; W294-C333 HydrophobicContact CZ3-CB 3.73Å; W294-H345 AromaticContact CH2-CD2 3.44Å; W294-H345 VanDerWaalsContact CH2-CD2 3.44Å; W294-H345 WeakPolarHBondContact CH2-CD2 3.02Å; W294-H345 AromaticContact CH2-NE2 3.66Å; W294-H345 HydrophobicContact CZ3-CB 4.3Å; W294-H345 AromaticContact CZ3-CD2 3.67Å
295	K	93.8	Very high	87.2	Confident	42 Å²	42	67.5 Å²	67.5	18%	0.183	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	133.4	-173	-170.2	170.8	-172.2	165.2	0	110.3	N298 Q299 Y300 Y331 T332	K295-N298 WeakPolarHBondContact CE-O 2.98Å; K295-Q299 CarbonylContact C-O 3.58Å; K295-Q299 WeakPolarHBondContact CA-O 3.49Å; K295-Q299 WeakPolarHBondContact CG-O 3.18Å; K295-Y300 HydrophobicContact CD-CE1 4.23Å; K295-Y300 HydrophobicContact CD-CE2 4.31Å; K295-Y300 PolarHBondContact NZ-OH 3.3Å; K295-Y331 CarbonylContact O-C 3.43Å; K295-Y331 WeakPolarHBondContact O-CA 3.39Å; K295-T332 PolarHBondContact N-O 3.45Å; K295-T332 PolarHBondContact O-N 2.62Å; K295-T332 PolarHBondContact O-OG1 2.86Å
296	R	94	Very high	86.8	Confident	2 Å²	2	65 Å²	65	1%	0.008	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	131	175.3	169.8	176.1	161.1	118.5	3.3	107.8	N298 Q299 L301 T326 M328 Y331 G670 D692	R296-N298 PolarHBondContact O-N 3.4Å; R296-N298 VanDerWaalsContact O-N 3.15Å; R296-Q299 PolarHBondContact N-O 2.9Å; R296-Q299 PolarHBondContact O-N 2.73Å; R296-L301 HydrophobicContact CB-CD1 4.1Å; R296-L301 HydrophobicContact CB-CD2 4.17Å; R296-L301 HydrophobicContact CB-CG 4.34Å; R296-T326 PolarHBondContact NH1-O 3.36Å; R296-T326 PolarHBondContact NH2-O 3.32Å; R296-M328 PolarHBondContact NH1-O 3.3Å; R296-Y331 HydrophobicContact CB-CD1 4.2Å; R296-Y331 HydrophobicContact CB-CE1 4.29Å; R296-Y331 PolarHBondContact NH1-OH 3.34Å; R296-G670 PolarHBondContact NH2-O 3.47Å; R296-D692 IonicContact CZ-OD1 2.87Å; R296-D692 IonicContact CZ-OD2 2.71Å; R296-D692 IonicContact NE-OD1 2.77Å; R296-D692 IonicContact NE-OD2 3.55Å; R296-D692 PolarHBondContact NE-OD2 2.81Å; R296-D692 IonicContact NH2-OD1 3.23Å; R296-D692 PolarHBondContact NH2-OD1 2.84Å; R296-D692 IonicContact NH2-OD2 3.85Å; R296-D692 PolarHBondContact NH2-OD2 3.15Å
297	N	91.3	Very high	86.2	Confident	48 Å²	48	69 Å²	69	26%	0.257	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.2	48.3	178.7	-62.7	-34.5	0	0	0	113.2	Q299 D692 I699	N297-Q299 PolarHBondContact O-N 2.93Å; N297-Q299 VanDerWaalsContact O-N 3.15Å; N297-D692 PolarHBondContact ND2-OD2 3.24Å; N297-I699 HydrophobicContact CB-CB 4.26Å; N297-I699 HydrophobicContact CB-CG2 3.6Å
298	N	90.3	Very high	86	Confident	129 Å²	129	62.3 Å²	62.3	69%	0.69	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	-7.2	-173.7	-72.2	-34	0	0	0	118.3	K295 R296	K295-N298 WeakPolarHBondContact CE-O 2.98Å; R296-N298 PolarHBondContact O-N 3.4Å; R296-N298 VanDerWaalsContact O-N 3.15Å
299	Q	91.8	Very high	85.9	Confident	74 Å²	74	54.7 Å²	54.7	35%	0.346	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	139.6	174	-59.4	-56.1	-29.9	0	0	112.6	K295 R296 N297 L304 T695 S697	K295-Q299 CarbonylContact C-O 3.58Å; K295-Q299 WeakPolarHBondContact CA-O 3.49Å; K295-Q299 WeakPolarHBondContact CG-O 3.18Å; R296-Q299 PolarHBondContact N-O 2.9Å; R296-Q299 PolarHBondContact O-N 2.73Å; N297-Q299 PolarHBondContact O-N 2.93Å; N297-Q299 VanDerWaalsContact O-N 3.15Å; Q299-L304 HydrophobicContact CB-CD1 4.37Å; Q299-T695 HydrophobicContact CB-CG2 3.99Å; Q299-T695 HydrophobicContact CG-CG2 4.3Å; Q299-S697 WeakPolarHBondContact CG-OG 3.34Å
300	Y	91.6	Very high	84.9	Confident	71 Å²	71	53.6 Å²	53.6	28%	0.278	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	123.9	171.8	-71.4	-90.7	0	0	0	110.3	L293 W294 K295 S303 L304 H334	L293-Y300 HydrophobicContact CB-CD1 4.13Å; L293-Y300 HydrophobicContact CB-CE1 4.16Å; L293-Y300 HydrophobicContact CD1-CD1 4.27Å; L293-Y300 HydrophobicContact CD1-CE1 3.96Å; W294-Y300 WeakPolarHBondContact O-CA 3.4Å; K295-Y300 HydrophobicContact CD-CE1 4.23Å; K295-Y300 HydrophobicContact CD-CE2 4.31Å; K295-Y300 PolarHBondContact NZ-OH 3.3Å; Y300-S303 WeakPolarHBondContact CB-OG 3.39Å; Y300-S303 PolarHBondContact O-OG 2.56Å; Y300-L304 WeakPolarHBondContact O-CG 3.16Å; Y300-H334 AromaticContact CE1-CE1 3.54Å; Y300-H334 AromaticContact CE1-NE2 3.55Å
301	L	91.5	Very high	83.7	Confident	1 Å²	1	57 Å²	57	1%	0.005	30%	0.304	C	S	.	.	S	Bend	trans	-78.5	-37	-176.5	-61.9	179.6	0	0	0	111.9	W294 R296 S303 L304 L306 F312 L318 Y331 T695	W294-L301 HydrophobicContact CB-CB 4.28Å; W294-L301 HydrophobicContact CB-CD1 4.32Å; W294-L301 PolarHBondContact O-N 3.11Å; R296-L301 HydrophobicContact CB-CD1 4.1Å; R296-L301 HydrophobicContact CB-CD2 4.17Å; R296-L301 HydrophobicContact CB-CG 4.34Å; L301-S303 PolarHBondContact O-N 3.22Å; L301-L304 HydrophobicContact CD2-CD1 4.47Å; L301-L304 PolarHBondContact O-N 2.77Å; L301-L306 HydrophobicContact CD2-CD1 3.79Å; L301-F312 HydrophobicContact CB-CE1 4.41Å; L301-F312 HydrophobicContact CB-CZ 4.15Å; L301-L318 HydrophobicContact CD1-CD2 3.75Å; L301-Y331 HydrophobicContact CD1-CD1 3.63Å; L301-Y331 HydrophobicContact CD1-CE1 3.68Å; L301-T695 HydrophobicContact CD2-CG2 3.92Å
302	N	86.6	Confident	82.9	Confident	60 Å²	60	55.5 Å²	55.5	32%	0.321	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-21	-179.7	-52.2	64.2	0	0	0	113.9	I292 W294 F312	I292-N302 PolarHBondContact O-ND2 2.61Å; W294-N302 PolarHBondContact N-OD1 2.65Å; N302-F312 HydrophobicContact CB-CE1 4.31Å; N302-F312 HydrophobicContact CB-CZ 4.34Å
303	S	82.1	Confident	81.4	Confident	96 Å²	96	56 Å²	56	67%	0.671	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-4.2	177.9	45.4	0	0	0	0	114.1	Y300 L301	Y300-S303 WeakPolarHBondContact CB-OG 3.39Å; Y300-S303 PolarHBondContact O-OG 2.56Å; L301-S303 PolarHBondContact O-N 3.22Å
304	L	82.7	Confident	80.4	Confident	50 Å²	50	63 Å²	63	26%	0.262	33%	0.332	S	S	.	.	S	Bend	trans	-106.9	132.9	-179	-63	173.4	0	0	0	109.8	Q299 Y300 L301 L306 T695	Q299-L304 HydrophobicContact CB-CD1 4.37Å; Y300-L304 WeakPolarHBondContact O-CG 3.16Å; L301-L304 HydrophobicContact CD2-CD1 4.47Å; L301-L304 PolarHBondContact O-N 2.77Å; L304-L306 HydrophobicContact CB-CD1 3.83Å; L304-L306 HydrophobicContact CB-CD2 4Å; L304-L306 HydrophobicContact CB-CG 3.62Å; L304-L306 HydrophobicContact CD1-CD1 4.13Å; L304-L306 PolarHBondContact O-N 2.94Å; L304-T695 HydrophobicContact CD1-CG2 4.14Å
305	N	76.3	Confident	79.4	Confident	139 Å²	139	66 Å²	66	74%	0.743	35%	0.348	S	S	*	.			trans	-80.2	99.1	169.6	-176.4	9.3	0	0	0	108.5	N310	N305-N310 PolarHBondContact OD1-ND2 2.79Å; N305-N310 PolarHBondContact OD1-OD1 3.47Å
306	L	79.8	Confident	78.7	Confident	19 Å²	19	64.7 Å²	64.7	10%	0.099	35%	0.346	C	S	.	.			trans	-123.6	101.2	-173.2	-61	179.2	0	0	0	108.8	L301 L304 D308 L309 N310 V694	L301-L306 HydrophobicContact CD2-CD1 3.79Å; L304-L306 HydrophobicContact CB-CD1 3.83Å; L304-L306 HydrophobicContact CB-CD2 4Å; L304-L306 HydrophobicContact CB-CG 3.62Å; L304-L306 HydrophobicContact CD1-CD1 4.13Å; L304-L306 PolarHBondContact O-N 2.94Å; L306-D308 VanDerWaalsContact C-N 3.25Å; L306-D308 PolarHBondContact O-N 3.21Å; L306-L309 HydrophobicContact CB-CB 3.99Å; L306-L309 HydrophobicContact CD1-CD1 4.08Å; L306-L309 CarbonylContact O-C 3.55Å; L306-L309 PolarHBondContact O-N 2.89Å; L306-N310 VanDerWaalsContact C-CG 3.49Å; L306-N310 PolarHBondContact N-OD1 2.98Å; L306-N310 WeakPolarHBondContact O-CB 3.46Å; L306-N310 PolarHBondContact O-N 2.72Å; L306-N310 PolarHBondContact O-ND2 3.07Å; L306-N310 PolarHBondContact O-OD1 2.88Å; L306-V694 WeakPolarHBondContact CD2-O 3.24Å
307	E	71.8	Confident	78.4	Confident	120 Å²	120	64.7 Å²	64.7	56%	0.561	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-49.3	-41.7	-169.5	-63.2	176.6	-159	0	0	114.6	L309 R626	E307-L309 VanDerWaalsContact C-N 3.35Å; E307-R626 VanDerWaalsContact CD-NH2 3.35Å; E307-R626 IonicContact OE1-NH2 3.7Å; E307-R626 PolarHBondContact OE1-NH2 2.94Å; E307-R626 IonicContact OE2-CZ 3.12Å; E307-R626 IonicContact OE2-NH1 2.73Å; E307-R626 PolarHBondContact OE2-NH1 2.78Å; E307-R626 IonicContact OE2-NH2 2.9Å; E307-R626 PolarHBondContact OE2-NH2 3.06Å
308	D	74.5	Confident	78.4	Confident	57 Å²	57	62.4 Å²	62.4	31%	0.305	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-83.2	-7.1	-177.2	-57.3	-68.4	0	0	0	114.2	L306 V320 T321 R626	L306-D308 VanDerWaalsContact C-N 3.25Å; L306-D308 PolarHBondContact O-N 3.21Å; D308-V320 WeakPolarHBondContact O-CA 3.25Å; D308-T321 PolarHBondContact O-N 2.83Å; D308-R626 IonicContact OD2-NH1 2.74Å
309	L	76.6	Confident	78.3	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.016	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-132.1	13.5	-173.1	-66.2	173.3	0	0	0	113.5	L306 E307 D311 L318 V320 V694	L306-L309 HydrophobicContact CB-CB 3.99Å; L306-L309 HydrophobicContact CD1-CD1 4.08Å; L306-L309 CarbonylContact O-C 3.55Å; L306-L309 PolarHBondContact O-N 2.89Å; E307-L309 VanDerWaalsContact C-N 3.35Å; L309-D311 PolarHBondContact O-N 2.82Å; L309-L318 HydrophobicContact CB-CD1 4.41Å; L309-L318 HydrophobicContact CD2-CD1 4.33Å; L309-V320 HydrophobicContact CD2-CB 4.06Å; L309-V320 HydrophobicContact CD2-CG1 3.82Å; L309-V320 HydrophobicContact CD2-CG2 3.63Å; L309-V694 HydrophobicContact CD1-CG1 3.49Å; L309-V694 VanDerWaalsContact CD1-CG1 3.49Å
310	N	60.6	Low	78.2	Confident	70 Å²	70	56.1 Å²	56.1	37%	0.374	30%	0.298	S	S	.	.			trans	-80.3	-6.4	-166.2	-101.8	-13.4	0	0	0	115.5	N305 L306	N305-N310 PolarHBondContact OD1-ND2 2.79Å; N305-N310 PolarHBondContact OD1-OD1 3.47Å; L306-N310 VanDerWaalsContact C-CG 3.49Å; L306-N310 PolarHBondContact N-OD1 2.98Å; L306-N310 WeakPolarHBondContact O-CB 3.46Å; L306-N310 PolarHBondContact O-N 2.72Å; L306-N310 PolarHBondContact O-ND2 3.07Å; L306-N310 PolarHBondContact O-OD1 2.88Å
311	D	59.5	Low	77.9	Confident	87 Å²	87	56.1 Å²	56.1	47%	0.465	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	112.5	-179.9	-170.9	3.8	0	0	0	110.3	L309 Y319	L309-D311 PolarHBondContact O-N 2.82Å; D311-Y319 HydrophobicContact CB-CG 4.49Å; D311-Y319 WeakPolarHBondContact O-CB 3.46Å; D311-Y319 WeakPolarHBondContact O-CD2 3.22Å; D311-Y319 PolarHBondContact O-N 2.89Å; D311-Y319 VanDerWaalsContact O-N 3.08Å
312	F	70.1	Confident	77.9	Confident	57 Å²	57	62.2 Å²	62.2	25%	0.25	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	99.6	173.3	-60.5	-92.1	0	0	0	106.1	W294 L301 N302 S317 L318	W294-F312 HydrophobicContact CB-CE1 4.34Å; L301-F312 HydrophobicContact CB-CE1 4.41Å; L301-F312 HydrophobicContact CB-CZ 4.15Å; N302-F312 HydrophobicContact CB-CE1 4.31Å; N302-F312 HydrophobicContact CB-CZ 4.34Å; F312-S317 WeakPolarHBondContact CA-O 3.42Å; F312-L318 HydrophobicContact CD1-CD1 4.29Å; F312-L318 HydrophobicContact CE1-CD1 3.76Å; F312-L318 HydrophobicContact CZ-CD1 4.13Å
313	G	60.2	Low	78.2	Confident	16 Å²	16	59.4 Å²	59.4	17%	0.165	32%	0.317	C	S	.	.			trans	-62.3	167.6	-171.6	0	0	0	0	0	113.4	D315 G316 S317	G313-D315 PolarHBondContact O-N 2.89Å; G313-G316 WeakPolarHBondContact O-CA 3.45Å; G313-G316 PolarHBondContact O-N 3.19Å; G313-S317 PolarHBondContact N-O 3.48Å
314	D	68.4	Low	78.7	Confident	182 Å²	182	57 Å²	57	97%	0.973	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-19.7	175	-68.7	-39	0	0	0	112.7
315	D	74.4	Confident	79.3	Confident	64 Å²	64	55.2 Å²	55.2	34%	0.342	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-5.6	174	72.2	-25.6	0	0	0	114.1	R289 G313 S317	R289-D315 VanDerWaalsContact CZ-O 3.26Å; R289-D315 PolarHBondContact NH1-O 2.87Å; R289-D315 PolarHBondContact NH2-O 2.82Å; G313-D315 PolarHBondContact O-N 2.89Å; D315-S317 VanDerWaalsContact C-N 3.31Å; D315-S317 WeakPolarHBondContact OD1-CB 3.4Å; D315-S317 PolarHBondContact OD1-N 2.87Å; D315-S317 PolarHBondContact OD1-OG 2.85Å; D315-S317 VanDerWaalsContact OD2-CB 3.28Å; D315-S317 WeakPolarHBondContact OD2-CB 3.12Å; D315-S317 PolarHBondContact OD2-OG 2.97Å
316	G	79.6	Confident	80.1	Confident	13 Å²	13	49.7 Å²	49.7	13%	0.134	26%	0.261	C	S	.	.			trans	74.9	16.4	-176.9	0	0	0	0	0	114.1	W294 G313	W294-G316 PolarHBondContact NE1-O 3.2Å; G313-G316 WeakPolarHBondContact O-CA 3.45Å; G313-G316 PolarHBondContact O-N 3.19Å
317	S	87.2	Confident	80.7	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.014	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-78.6	147.6	173.9	-63.6	0	0	0	0	111.5	M280 T281 F312 G313 D315 Y319	M280-S317 WeakPolarHBondContact O-CA 3.42Å; M280-S317 WeakPolarHBondContact O-CB 3.36Å; T281-S317 WeakPolarHBondContact CA-OG 3.43Å; T281-S317 WeakPolarHBondContact CG2-OG 3.48Å; F312-S317 WeakPolarHBondContact CA-O 3.42Å; G313-S317 PolarHBondContact N-O 3.48Å; D315-S317 VanDerWaalsContact C-N 3.31Å; D315-S317 WeakPolarHBondContact OD1-CB 3.4Å; D315-S317 PolarHBondContact OD1-N 2.87Å; D315-S317 PolarHBondContact OD1-OG 2.85Å; D315-S317 VanDerWaalsContact OD2-CB 3.28Å; D315-S317 WeakPolarHBondContact OD2-CB 3.12Å; D315-S317 PolarHBondContact OD2-OG 2.97Å; S317-Y319 WeakPolarHBondContact O-CD2 3.32Å; S317-Y319 WeakPolarHBondContact O-CE2 3.3Å
318	L	90.1	Very high	81.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	119	177.8	170.8	58.6	0	0	0	110	M280 W294 L301 L309 F312 Y331	M280-L318 HydrophobicContact CE-CD2 3.7Å; M280-L318 HydrophobicContact CE-CG 3.98Å; M280-L318 PolarHBondContact N-O 2.97Å; M280-L318 PolarHBondContact O-N 3.21Å; W294-L318 HydrophobicContact CB-CD2 4.18Å; W294-L318 HydrophobicContact CD2-CB 3.62Å; W294-L318 HydrophobicContact CD2-CD2 3.92Å; W294-L318 HydrophobicContact CD2-CG 4.44Å; W294-L318 HydrophobicContact CE3-CB 4.14Å; W294-L318 HydrophobicContact CE3-CD2 3.87Å; W294-L318 HydrophobicContact CG-CB 3.88Å; W294-L318 HydrophobicContact CG-CD2 4.06Å; W294-L318 HydrophobicContact CZ2-CB 4.06Å; L301-L318 HydrophobicContact CD1-CD2 3.75Å; L309-L318 HydrophobicContact CB-CD1 4.41Å; L309-L318 HydrophobicContact CD2-CD1 4.33Å; F312-L318 HydrophobicContact CD1-CD1 4.29Å; F312-L318 HydrophobicContact CE1-CD1 3.76Å; F312-L318 HydrophobicContact CZ-CD1 4.13Å; L318-Y331 HydrophobicContact CD2-CD1 3.64Å; L318-Y331 HydrophobicContact CD2-CE1 3.99Å
319	Y	88.4	Confident	82.7	Confident	71 Å²	71	41.2 Å²	41.2	28%	0.278	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	132.6	-179.7	-65.3	-108.9	0	0	0	110.3	A278 V279 D311 S317	A278-Y319 WeakPolarHBondContact O-CA 3.48Å; V279-Y319 HydrophobicContact CB-CD1 4.28Å; V279-Y319 HydrophobicContact CB-CE1 4.26Å; V279-Y319 HydrophobicContact CG1-CD1 3.92Å; V279-Y319 HydrophobicContact CG1-CD2 4.31Å; V279-Y319 HydrophobicContact CG1-CE1 3.62Å; V279-Y319 HydrophobicContact CG1-CE2 4.04Å; V279-Y319 HydrophobicContact CG1-CG 4.23Å; V279-Y319 HydrophobicContact CG2-CD1 3.5Å; V279-Y319 VanDerWaalsContact CG2-CD1 3.5Å; V279-Y319 HydrophobicContact CG2-CE1 3.57Å; V279-Y319 HydrophobicContact CG2-CG 4.35Å; D311-Y319 HydrophobicContact CB-CG 4.49Å; D311-Y319 WeakPolarHBondContact O-CB 3.46Å; D311-Y319 WeakPolarHBondContact O-CD2 3.22Å; D311-Y319 PolarHBondContact O-N 2.89Å; D311-Y319 VanDerWaalsContact O-N 3.08Å; S317-Y319 WeakPolarHBondContact O-CD2 3.32Å; S317-Y319 WeakPolarHBondContact O-CE2 3.3Å
320	V	90.4	Very high	83.6	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	112.5	172.8	-165.3	0	0	0	0	107.3	S277 A278 M280 D308 L309 V323 H327 L347	S277-V320 CarbonylContact C-O 3.5Å; S277-V320 VanDerWaalsContact CA-O 3.23Å; S277-V320 WeakPolarHBondContact CA-O 3.23Å; S277-V320 WeakPolarHBondContact CB-O 3.31Å; A278-V320 HydrophobicContact CB-CB 4.05Å; A278-V320 HydrophobicContact CB-CG2 4.02Å; A278-V320 PolarHBondContact N-O 2.02Å; A278-V320 PolarHBondContact O-N 3.41Å; M280-V320 HydrophobicContact CE-CG2 3.89Å; D308-V320 WeakPolarHBondContact O-CA 3.25Å; L309-V320 HydrophobicContact CD2-CB 4.06Å; L309-V320 HydrophobicContact CD2-CG1 3.82Å; L309-V320 HydrophobicContact CD2-CG2 3.63Å; V320-V323 HydrophobicContact CB-CG2 4.06Å; V320-V323 HydrophobicContact CG1-CG2 3.89Å; V320-H327 WeakPolarHBondContact CG1-ND1 3.19Å; V320-L347 HydrophobicContact CG2-CD2 4.33Å
321	T	86	Confident	85.3	Confident	71 Å²	71	42 Å²	42	44%	0.436	23%	0.226	S	C	.	.	S	Bend	trans	-69	-42	-170.3	59.5	0	0	0	0	112.1	S277 D308	S277-T321 WeakPolarHBondContact CB-O 3.23Å; S277-T321 PolarHBondContact OG-O 3.34Å; D308-T321 PolarHBondContact O-N 2.83Å
322	K	89.8	Confident	87	Confident	129 Å²	129	39.7 Å²	39.7	56%	0.561	22%	0.215	S	C	*	.	S	Bend	trans	-139.6	111.1	176.1	-173.5	-178	179	-174.7	0	109.7	H327	K322-H327 PolarHBondContact O-ND1 3.27Å
323	V	93	Very high	88.2	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.203	C	C	.	.			trans	-75.6	133.1	-177.9	174.9	0	0	0	0	111	V272 G275 Q276 A278 V320 V349	V272-V323 HydrophobicContact CB-CG1 4.49Å; V272-V323 HydrophobicContact CB-CG2 4.48Å; V272-V323 HydrophobicContact CG1-CB 4.28Å; V272-V323 HydrophobicContact CG1-CG1 4.48Å; V272-V323 HydrophobicContact CG1-CG2 3.99Å; G275-V323 PolarHBondContact N-O 2.81Å; Q276-V323 VanDerWaalsContact O-CB 3.3Å; Q276-V323 WeakPolarHBondContact O-CB 3.38Å; Q276-V323 VanDerWaalsContact O-CG2 3.31Å; Q276-V323 WeakPolarHBondContact O-CG2 3.26Å; Q276-V323 PolarHBondContact O-N 2.85Å; A278-V323 HydrophobicContact CB-CG2 3.65Å; V320-V323 HydrophobicContact CB-CG2 4.06Å; V320-V323 HydrophobicContact CG1-CG2 3.89Å; V323-V349 HydrophobicContact CG1-CB 4.13Å; V323-V349 HydrophobicContact CG1-CG1 3.63Å; V323-V349 HydrophobicContact CG1-CG2 3.39Å
324	T	93.7	Very high	89.8	Confident	46 Å²	46	36.5 Å²	36.5	28%	0.282	20%	0.196	S	C	.	.			trans	-127.1	163.9	172.7	50.4	0	0	0	0	109	T326 H327	T324-T326 PolarHBondContact O-N 3.3Å; T324-T326 VanDerWaalsContact O-N 3.12Å; T324-T326 PolarHBondContact OG1-OG1 3.13Å; T324-H327 WeakPolarHBondContact O-CB 3.39Å; T324-H327 PolarHBondContact O-N 2.82Å; T324-H327 PolarHBondContact OG1-CE1 3.04Å; T324-H327 PolarHBondContact OG1-ND1 3.08Å
325	T	94.1	Very high	90.8	Very high	12 Å²	12	27.9 Å²	27.9	7%	0.074	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-58.1	-24.1	175.3	53.8	0	0	0	0	113.3	H327 M328 V351 I379 H668 G670	T325-H327 VanDerWaalsContact C-N 3.26Å; T325-H327 PolarHBondContact O-N 2.83Å; T325-M328 HydrophobicContact CG2-CE 4.27Å; T325-M328 WeakPolarHBondContact O-CB 3.45Å; T325-M328 WeakPolarHBondContact O-CG 3.21Å; T325-M328 PolarHBondContact O-N 2.71Å; T325-V351 HydrophobicContact CG2-CG2 3.61Å; T325-I379 HydrophobicContact CG2-CD1 3.88Å; T325-H668 CarbonylContact C-O 3.5Å; T325-H668 WeakPolarHBondContact CB-O 3.27Å; T325-H668 PolarHBondContact OG1-CD2 3.16Å; T325-H668 PolarHBondContact OG1-O 3.47Å; T325-G670 PolarHBondContact O-N 2.98Å
326	T	93.6	Very high	91.4	Very high	23 Å²	23	28.7 Å²	28.7	14%	0.141	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-67.7	-25.2	175	56.9	0	0	0	0	113	R296 T324 M328 Y666 H668 G670 V694	R296-T326 PolarHBondContact NH1-O 3.36Å; R296-T326 PolarHBondContact NH2-O 3.32Å; T324-T326 PolarHBondContact O-N 3.3Å; T324-T326 VanDerWaalsContact O-N 3.12Å; T324-T326 PolarHBondContact OG1-OG1 3.13Å; T326-M328 VanDerWaalsContact C-N 3.28Å; T326-M328 PolarHBondContact O-N 2.91Å; T326-Y666 WeakPolarHBondContact CG2-OH 3.44Å; T326-H668 PolarHBondContact N-O 2.93Å; T326-G670 CarbonylContact O-C 3.49Å; T326-G670 VanDerWaalsContact O-O 3.11Å; T326-V694 WeakPolarHBondContact O-CG2 3.41Å
327	H	93.6	Very high	91.5	Very high	9 Å²	9	28.7 Å²	28.7	4%	0.042	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-80.1	-5.5	175.7	-58.9	149.9	0	0	0	113.1	V320 K322 T324 T325 Y331 L347	V320-H327 WeakPolarHBondContact CG1-ND1 3.19Å; K322-H327 PolarHBondContact O-ND1 3.27Å; T324-H327 WeakPolarHBondContact O-CB 3.39Å; T324-H327 PolarHBondContact O-N 2.82Å; T324-H327 PolarHBondContact OG1-CE1 3.04Å; T324-H327 PolarHBondContact OG1-ND1 3.08Å; T325-H327 VanDerWaalsContact C-N 3.26Å; T325-H327 PolarHBondContact O-N 2.83Å; H327-Y331 WeakPolarHBondContact O-CE2 3.3Å; H327-Y331 PolarHBondContact O-OH 2.87Å; H327-L347 HydrophobicContact CB-CD2 4.13Å; H327-L347 WeakPolarHBondContact O-CD2 3.37Å
328	M	94.6	Very high	91.5	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	16%	0.157	C	C	.	.			trans	-56.8	145.7	170.1	-68.3	172.1	171.3	0	0	111.5	R296 T325 T326 L347 V349 I379 V669 E735	R296-M328 PolarHBondContact NH1-O 3.3Å; T325-M328 HydrophobicContact CG2-CE 4.27Å; T325-M328 WeakPolarHBondContact O-CB 3.45Å; T325-M328 WeakPolarHBondContact O-CG 3.21Å; T325-M328 PolarHBondContact O-N 2.71Å; T326-M328 VanDerWaalsContact C-N 3.28Å; T326-M328 PolarHBondContact O-N 2.91Å; M328-L347 WeakPolarHBondContact CA-O 3.36Å; M328-V349 HydrophobicContact CE-CB 3.92Å; M328-V349 WeakPolarHBondContact CE-O 3.28Å; M328-V349 HydrophobicContact CG-CB 3.79Å; M328-V349 HydrophobicContact CG-CG2 3.69Å; M328-I379 HydrophobicContact CE-CD1 3.76Å; M328-I379 HydrophobicContact CE-CG2 3.94Å; M328-V669 HydrophobicContact CE-CG1 4.25Å; M328-V669 HydrophobicContact SD-CG1 3.54Å; M328-V669 VanDerWaalsContact SD-CG1 3.54Å; M328-E735 VanDerWaalsContact CE-O 3.27Å; M328-E735 WeakPolarHBondContact CE-O 3.22Å
329	G	93.6	Very high	91.3	Very high	9 Å²	9	33 Å²	33	9%	0.093	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	136.6	-166.5	170.8	0	0	0	0	0	113.7	L347	G329-L347 PolarHBondContact N-O 3.42Å; G329-L347 VanDerWaalsContact N-O 3.1Å; G329-L347 PolarHBondContact O-N 2.74Å
330	N	94.8	Very high	91.2	Very high	89 Å²	89	38.2 Å²	38.2	48%	0.476	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	126.1	-177	-64.9	-1.5	0	0	0	110.8	T344 H345	N330-T344 HydrophobicContact CB-CG2 4.15Å; N330-H345 WeakPolarHBondContact CA-O 3.38Å
331	Y	95.3	Very high	91.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	126.8	174	-67.5	-104.8	0	0	0	107.9	M280 K295 R296 L301 L318 H327 T344 H345 L347	M280-Y331 HydrophobicContact CE-CD1 4Å; M280-Y331 HydrophobicContact CE-CD2 4.13Å; M280-Y331 HydrophobicContact CE-CE1 4.15Å; M280-Y331 HydrophobicContact CE-CE2 4.3Å; M280-Y331 HydrophobicContact CE-CG 4Å; M280-Y331 HydrophobicContact SD-CD2 3.99Å; M280-Y331 HydrophobicContact SD-CG 4.02Å; K295-Y331 CarbonylContact O-C 3.43Å; K295-Y331 WeakPolarHBondContact O-CA 3.39Å; R296-Y331 HydrophobicContact CB-CD1 4.2Å; R296-Y331 HydrophobicContact CB-CE1 4.29Å; R296-Y331 PolarHBondContact NH1-OH 3.34Å; L301-Y331 HydrophobicContact CD1-CD1 3.63Å; L301-Y331 HydrophobicContact CD1-CE1 3.68Å; L318-Y331 HydrophobicContact CD2-CD1 3.64Å; L318-Y331 HydrophobicContact CD2-CE1 3.99Å; H327-Y331 WeakPolarHBondContact O-CE2 3.3Å; H327-Y331 PolarHBondContact O-OH 2.87Å; Y331-T344 CarbonylContact O-C 3.57Å; Y331-H345 PolarHBondContact N-O 2.78Å; Y331-H345 PolarHBondContact O-N 2.75Å; Y331-L347 HydrophobicContact CD2-CB 4.26Å; Y331-L347 HydrophobicContact CE2-CB 4.07Å; Y331-L347 HydrophobicContact CE2-CD2 4.21Å
332	T	96.3	Very high	91.6	Very high	39 Å²	39	41.4 Å²	41.4	24%	0.239	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	131.2	174.5	52.1	0	0	0	0	111	W294 K295 F342 Q343 T344	W294-T332 CarbonylContact C-O 3.47Å; W294-T332 WeakPolarHBondContact CA-O 3.45Å; K295-T332 PolarHBondContact N-O 3.45Å; K295-T332 PolarHBondContact O-N 2.62Å; K295-T332 PolarHBondContact O-OG1 2.86Å; T332-F342 HydrophobicContact CG2-CD2 4.26Å; T332-Q343 CarbonylContact C-O 3.54Å; T332-Q343 VanDerWaalsContact CA-O 3.27Å; T332-Q343 WeakPolarHBondContact CA-O 3.3Å; T332-T344 HydrophobicContact CG2-CG2 4.08Å
333	C	95.3	Very high	92	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	139.7	171.8	78.1	0	0	0	0	110	C282 I292 L293 W294 F342 Q343	C282-C333 WeakPolarHBondContact CA-SG 3.27Å; C282-C333 HydrophobicContact CB-CB 3.79Å; C282-C333 WeakPolarHBondContact CB-SG 3.12Å; C282-C333 WeakPolarHBondContact SG-CB 3.46Å; C282-C333 CovalentContact SG-SG 2.04Å; C282-C333 PolarHBondContact SG-SG 2.83Å; I292-C333 HydrophobicContact CG2-CB 3.88Å; L293-C333 WeakPolarHBondContact O-CA 3.16Å; W294-C333 HydrophobicContact CD2-CB 3.72Å; W294-C333 HydrophobicContact CE3-CB 3.73Å; W294-C333 HydrophobicContact CG-CB 4.47Å; W294-C333 HydrophobicContact CH2-CB 3.69Å; W294-C333 HydrophobicContact CZ2-CB 3.66Å; W294-C333 HydrophobicContact CZ3-CB 3.73Å; C333-F342 CarbonylContact O-C 3.54Å; C333-F342 VanDerWaalsContact O-CA 3.24Å; C333-F342 WeakPolarHBondContact O-CA 3.43Å; C333-F342 WeakPolarHBondContact O-CB 3.27Å; C333-Q343 PolarHBondContact N-O 3.26Å; C333-Q343 PolarHBondContact O-N 2.87Å
334	H	93.3	Very high	92.2	Very high	6 Å²	6	36.7 Å²	36.7	3%	0.028	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	159.1	173.4	55.2	-65.9	0	0	0	108.6	I292 L293 Y300 D339 F342	I292-H334 WeakPolarHBondContact CA-O 3.25Å; L293-H334 PolarHBondContact N-O 3.04Å; L293-H334 PolarHBondContact O-N 3.43Å; L293-H334 VanDerWaalsContact O-N 3.09Å; L293-H334 PolarHBondContact O-ND1 3.48Å; Y300-H334 AromaticContact CE1-CE1 3.54Å; Y300-H334 AromaticContact CE1-NE2 3.55Å; H334-D339 IonicContact NE2-OD1 3.29Å; H334-F342 HydrophobicContact CB-CB 4.07Å
335	A	90.4	Very high	92.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	144.6	169.7	0	0	0	0	0	109.5	L259 I284 P290 P291 I292 G337 Y338	L259-A335 HydrophobicContact CD1-CB 3.52Å; I284-A335 HydrophobicContact CG2-CB 4.44Å; P290-A335 HydrophobicContact CG-CB 3.83Å; P291-A335 WeakPolarHBondContact O-CA 3.23Å; I292-A335 HydrophobicContact CD1-CB 4.09Å; A335-G337 PolarHBondContact O-N 2.91Å; A335-Y338 WeakPolarHBondContact O-CA 3.29Å; A335-Y338 WeakPolarHBondContact O-CB 3.47Å; A335-Y338 PolarHBondContact O-N 2.62Å
336	D	86.5	Confident	92.4	Very high	82 Å²	82	36.3 Å²	36.3	44%	0.439	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	124.5	-174.8	-178.8	22	0	0	0	112.7	P290 P291 L293 Y338	P290-D336 HydrophobicContact CB-CB 4.21Å; P290-D336 WeakPolarHBondContact CG-O 3.29Å; P291-D336 PolarHBondContact O-N 3.47Å; L293-D336 HydrophobicContact CD1-CB 4Å; L293-D336 HydrophobicContact CG-CB 4.14Å; D336-Y338 VanDerWaalsContact C-N 3.26Å; D336-Y338 WeakPolarHBondContact O-CD2 3.43Å; D336-Y338 PolarHBondContact O-N 2.93Å
337	G	81.5	Confident	92.5	Very high	12 Å²	12	35.3 Å²	35.3	12%	0.124	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	71	7.5	-175	0	0	0	0	0	116.4	A186 A335	A186-G337 PolarHBondContact N-O 3.3Å; A335-G337 PolarHBondContact O-N 2.91Å
338	Y	86.8	Confident	92.6	Very high	17 Å²	17	36.2 Å²	36.2	7%	0.067	19%	0.185	C	C	.	.			trans	-110.7	36	174.9	-74.4	-107.9	0	0	0	112	M185 K189 Y257 L259 P290 A335 D336 K340 L341	M185-Y338 HydrophobicContact CB-CE2 4.49Å; M185-Y338 HydrophobicContact CG-CD2 4.09Å; M185-Y338 HydrophobicContact CG-CE2 3.45Å; M185-Y338 VanDerWaalsContact CG-CE2 3.45Å; K189-Y338 HydrophobicContact CD-CE1 3.95Å; Y257-Y338 WeakPolarHBondContact CA-OH 3.4Å; Y257-Y338 HydrophobicContact CD2-CE2 4.19Å; Y257-Y338 PolarHBondContact N-OH 2.79Å; Y257-Y338 WeakPolarHBondContact O-CE1 3.37Å; Y257-Y338 PolarHBondContact O-OH 3.09Å; L259-Y338 HydrophobicContact CD1-CD1 3.77Å; L259-Y338 HydrophobicContact CD1-CD2 4.03Å; L259-Y338 HydrophobicContact CD1-CE1 4.06Å; L259-Y338 HydrophobicContact CD1-CE2 4.33Å; L259-Y338 HydrophobicContact CD1-CG 3.77Å; L259-Y338 HydrophobicContact CG-CD1 4.38Å; L259-Y338 HydrophobicContact CG-CE1 4.3Å; P290-Y338 HydrophobicContact CG-CD2 4.18Å; P290-Y338 HydrophobicContact CG-CE2 4.29Å; A335-Y338 WeakPolarHBondContact O-CA 3.29Å; A335-Y338 WeakPolarHBondContact O-CB 3.47Å; A335-Y338 PolarHBondContact O-N 2.62Å; D336-Y338 VanDerWaalsContact C-N 3.26Å; D336-Y338 WeakPolarHBondContact O-CD2 3.43Å; D336-Y338 PolarHBondContact O-N 2.93Å; Y338-K340 PolarHBondContact O-N 2.62Å; Y338-L341 PolarHBondContact O-N 2.83Å
339	D	86.4	Confident	92.6	Very high	77 Å²	77	36.2 Å²	36.2	41%	0.412	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.9	-26.8	-173.3	-52.7	-116	0	0	0	115.8	H334 L341 F342	H334-D339 IonicContact NE2-OD1 3.29Å; D339-L341 VanDerWaalsContact C-N 3.32Å; D339-F342 WeakPolarHBondContact O-CD1 3.3Å
340	K	86.6	Confident	92.8	Very high	179 Å²	179	36.7 Å²	36.7	78%	0.778	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-12.8	178.3	-63.5	-178.2	-179.1	176.2	0	113.8	Y338	Y338-K340 PolarHBondContact O-N 2.62Å
341	L	90.2	Very high	92.9	Very high	43 Å²	43	32.8 Å²	32.8	23%	0.225	16%	0.164	C	C	.	.	S	Bend	trans	-112	87.9	175.3	-171.5	74.4	0	0	0	107.8	L259 L261 I284 Y338 D339	L259-L341 HydrophobicContact CB-CD2 3.58Å; L261-L341 HydrophobicContact CB-CD1 3.79Å; L261-L341 HydrophobicContact CB-CG 4.1Å; I284-L341 WeakPolarHBondContact CD1-O 3.45Å; I284-L341 HydrophobicContact CG2-CD2 4.09Å; Y338-L341 PolarHBondContact O-N 2.83Å; D339-L341 VanDerWaalsContact C-N 3.32Å
342	F	95.1	Very high	93	Very high	96 Å²	96	34.9 Å²	34.9	42%	0.421	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	149.5	-174.8	67.4	-86.7	0	0	0	111.8	L261 T332 C333 H334 D339	L261-F342 VanDerWaalsContact CD2-C 3.46Å; L261-F342 WeakPolarHBondContact CD2-O 3.35Å; T332-F342 HydrophobicContact CG2-CD2 4.26Å; C333-F342 CarbonylContact O-C 3.54Å; C333-F342 VanDerWaalsContact O-CA 3.24Å; C333-F342 WeakPolarHBondContact O-CA 3.43Å; C333-F342 WeakPolarHBondContact O-CB 3.27Å; H334-F342 HydrophobicContact CB-CB 4.07Å; D339-F342 WeakPolarHBondContact O-CD1 3.3Å
343	Q	96.5	Very high	93.1	Very high	7 Å²	7	33.4 Å²	33.4	3%	0.033	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	142.5	169.7	168	180	51.6	0	0	109.2	L261 Q265 K266 S268 T281 T332 C333 H345	L261-Q343 HydrophobicContact CD1-CB 4.28Å; L261-Q343 HydrophobicContact CD2-CB 3.98Å; Q265-Q343 VanDerWaalsContact O-CG 3.26Å; Q265-Q343 WeakPolarHBondContact O-CG 3.22Å; Q265-Q343 PolarHBondContact O-NE2 3.45Å; K266-Q343 WeakPolarHBondContact O-CA 3.37Å; S268-Q343 PolarHBondContact OG-NE2 3.47Å; T281-Q343 PolarHBondContact O-OE1 2.99Å; T332-Q343 CarbonylContact C-O 3.54Å; T332-Q343 VanDerWaalsContact CA-O 3.27Å; T332-Q343 WeakPolarHBondContact CA-O 3.3Å; C333-Q343 PolarHBondContact N-O 3.26Å; C333-Q343 PolarHBondContact O-N 2.87Å; Q343-H345 PolarHBondContact OE1-NE2 3.23Å
344	T	97.1	Very high	93.1	Very high	24 Å²	24	35.3 Å²	35.3	15%	0.147	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	110.5	174.1	-50.1	0	0	0	0	110.3	K266 V267 S268 N330 Y331 T332	K266-T344 PolarHBondContact O-N 2.99Å; V267-T344 WeakPolarHBondContact CA-O 3.43Å; S268-T344 PolarHBondContact N-O 2.87Å; S268-T344 PolarHBondContact OG-O 3.33Å; N330-T344 HydrophobicContact CB-CG2 4.15Å; Y331-T344 CarbonylContact O-C 3.57Å; T332-T344 HydrophobicContact CG2-CG2 4.08Å
345	H	96.2	Very high	93.2	Very high	5 Å²	5	35 Å²	35	2%	0.023	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	129.3	167.8	-74.8	-101.8	0	0	0	109.9	S268 M280 T281 W294 N330 Y331 Q343	S268-H345 CarbonylContact O-C 3.56Å; S268-H345 WeakPolarHBondContact O-CA 3.37Å; S268-H345 WeakPolarHBondContact OG-CA 3.36Å; S268-H345 PolarHBondContact OG-CD2 2.79Å; S268-H345 VanDerWaalsContact OG-CD2 3.26Å; S268-H345 PolarHBondContact OG-CE1 3.4Å; S268-H345 PolarHBondContact OG-ND1 3.34Å; S268-H345 PolarHBondContact OG-NE2 3.02Å; M280-H345 HydrophobicContact CG-CB 4.33Å; M280-H345 HydrophobicContact SD-CB 3.93Å; T281-H345 PolarHBondContact O-CE1 2.66Å; T281-H345 PolarHBondContact O-NE2 2.9Å; W294-H345 AromaticContact CH2-CD2 3.44Å; W294-H345 VanDerWaalsContact CH2-CD2 3.44Å; W294-H345 WeakPolarHBondContact CH2-CD2 3.02Å; W294-H345 AromaticContact CH2-NE2 3.66Å; W294-H345 HydrophobicContact CZ3-CB 4.3Å; W294-H345 AromaticContact CZ3-CD2 3.67Å; N330-H345 WeakPolarHBondContact CA-O 3.38Å; Y331-H345 PolarHBondContact N-O 2.78Å; Y331-H345 PolarHBondContact O-N 2.75Å; Q343-H345 PolarHBondContact OE1-NE2 3.23Å
346	I	95.9	Very high	93.3	Very high	45 Å²	45	41 Å²	41	23%	0.231	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	106.8	173.7	-52.8	-179.8	0	0	0	107.6	V267 S268 V269 T270 Q348	V267-I346 HydrophobicContact CG1-CD1 3.97Å; V267-I346 HydrophobicContact CG1-CG1 4.36Å; S268-I346 PolarHBondContact O-N 3.31Å; V269-I346 WeakPolarHBondContact CA-O 3.25Å; V269-I346 HydrophobicContact CG2-CB 4.3Å; V269-I346 HydrophobicContact CG2-CD1 4.39Å; T270-I346 PolarHBondContact N-O 3.2Å; I346-Q348 HydrophobicContact CG2-CG 4.23Å
347	L	95.7	Very high	93.6	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	116.9	176.3	-178.1	51.8	0	0	0	109.4	T270 V272 M280 V320 H327 M328 G329 Y331 V349	T270-L347 HydrophobicContact CG2-CD1 4.43Å; T270-L347 WeakPolarHBondContact O-CD1 3.11Å; V272-L347 HydrophobicContact CG2-CD1 4.13Å; M280-L347 HydrophobicContact CE-CD2 4.13Å; M280-L347 HydrophobicContact SD-CB 4.26Å; M280-L347 HydrophobicContact SD-CD2 4.41Å; V320-L347 HydrophobicContact CG2-CD2 4.33Å; H327-L347 HydrophobicContact CB-CD2 4.13Å; H327-L347 WeakPolarHBondContact O-CD2 3.37Å; M328-L347 WeakPolarHBondContact CA-O 3.36Å; G329-L347 PolarHBondContact N-O 3.42Å; G329-L347 VanDerWaalsContact N-O 3.1Å; G329-L347 PolarHBondContact O-N 2.74Å; Y331-L347 HydrophobicContact CD2-CB 4.26Å; Y331-L347 HydrophobicContact CE2-CB 4.07Å; Y331-L347 HydrophobicContact CE2-CD2 4.21Å; L347-V349 HydrophobicContact CG-CG2 4.33Å
348	Q	95.6	Very high	94	Very high	28 Å²	28	39.3 Å²	39.3	13%	0.131	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	139.5	174	-62.1	-177.6	36.1	0	0	108.6	V269 T270 T271 V272 I346	V269-Q348 HydrophobicContact CG1-CG 4.36Å; V269-Q348 VanDerWaalsContact CG1-NE2 3.29Å; T270-Q348 PolarHBondContact O-N 2.78Å; T271-Q348 WeakPolarHBondContact CA-O 3.49Å; T271-Q348 HydrophobicContact CG2-CB 4.31Å; V272-Q348 PolarHBondContact N-O 2.92Å; I346-Q348 HydrophobicContact CG2-CG 4.23Å
349	V	96.4	Very high	94	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	111.9	-173.9	-177.9	0	0	0	0	109.3	V272 V274 V323 M328 L347	V272-V349 CarbonylContact O-C 3.59Å; V272-V349 WeakPolarHBondContact O-CA 3.42Å; V274-V349 HydrophobicContact CB-CG1 4.27Å; V323-V349 HydrophobicContact CG1-CB 4.13Å; V323-V349 HydrophobicContact CG1-CG1 3.63Å; V323-V349 HydrophobicContact CG1-CG2 3.39Å; M328-V349 HydrophobicContact CE-CB 3.92Å; M328-V349 WeakPolarHBondContact CE-O 3.28Å; M328-V349 HydrophobicContact CG-CB 3.79Å; M328-V349 HydrophobicContact CG-CG2 3.69Å; L347-V349 HydrophobicContact CG-CG2 4.33Å
350	N	96.9	Very high	94	Very high	18 Å²	18	40.9 Å²	40.9	10%	0.096	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	141.8	177.6	-65.4	3.7	0	0	0	109.8	T271 V272 T273 V274 I379 E430 A431	T271-N350 WeakPolarHBondContact CG2-ND2 3.48Å; T271-N350 WeakPolarHBondContact CG2-OD1 3.38Å; V272-N350 PolarHBondContact O-N 3.21Å; T273-N350 CarbonylContact C-O 3.4Å; T273-N350 WeakPolarHBondContact CA-O 3.14Å; V274-N350 PolarHBondContact N-O 3.27Å; N350-I379 CarbonylContact C-O 3.55Å; N350-I379 VanDerWaalsContact CA-O 3.22Å; N350-I379 WeakPolarHBondContact CA-O 3.45Å; N350-I379 WeakPolarHBondContact CB-O 3.39Å; N350-E430 PolarHBondContact ND2-OE1 3.35Å; N350-A431 HydrophobicContact CB-CB 3.83Å
351	V	96.9	Very high	93.9	Very high	7 Å²	7	35.3 Å²	35.3	4%	0.042	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	120.4	-176.8	178.8	0	0	0	0	106.7	V274 T325 I379 N429 I621	V274-V351 HydrophobicContact CB-CG2 4.16Å; V274-V351 HydrophobicContact CG1-CB 4.36Å; V274-V351 HydrophobicContact CG1-CG1 4.23Å; V274-V351 HydrophobicContact CG1-CG2 4.21Å; T325-V351 HydrophobicContact CG2-CG2 3.61Å; V351-I379 HydrophobicContact CB-CB 3.97Å; V351-I379 HydrophobicContact CB-CG1 4.12Å; V351-I379 HydrophobicContact CG2-CB 4.04Å; V351-I379 HydrophobicContact CG2-CD1 4.04Å; V351-I379 HydrophobicContact CG2-CG1 4.05Å; V351-I379 PolarHBondContact N-O 3.08Å; V351-I379 PolarHBondContact O-N 2.88Å; V351-N429 PolarHBondContact O-ND2 3.19Å; V351-I621 HydrophobicContact CG1-CB 3.78Å; V351-I621 HydrophobicContact CG1-CD1 4.11Å; V351-I621 HydrophobicContact CG1-CG2 3.56Å
352	P	97.6	Very high	93.6	Very high	45 Å²	45	34.3 Å²	34.3	29%	0.292	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	159.3	178	29.7	-35.3	0	0	0	110.4	A431	P352-A431 HydrophobicContact CB-CB 4.29Å
353	P	97.4	Very high	93.1	Very high	7 Å²	7	32.1 Å²	32.1	5%	0.045	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	146.7	-179.4	-18.4	32.8	0	0	0	111.5	E377 P382 A427 G432 D434	P353-E377 CarbonylContact C-O 3.51Å; P353-E377 VanDerWaalsContact CA-O 3.29Å; P353-E377 WeakPolarHBondContact CA-O 3.23Å; P353-P382 HydrophobicContact CB-CB 4.06Å; P353-P382 HydrophobicContact CB-CG 4.37Å; P353-P382 HydrophobicContact CG-CB 4Å; P353-A427 HydrophobicContact CB-CB 3.81Å; P353-A427 HydrophobicContact CG-CB 4.49Å; P353-G432 VanDerWaalsContact CD-C 3.45Å; P353-G432 WeakPolarHBondContact CD-O 3.33Å; P353-G432 WeakPolarHBondContact CG-O 3.48Å; P353-D434 HydrophobicContact CB-CB 4.07Å; P353-D434 WeakPolarHBondContact O-CB 3.43Å
354	V	96.5	Very high	92.6	Very high	40 Å²	40	36.5 Å²	36.5	24%	0.242	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	118.6	166.7	-179.5	0	0	0	0	108	A376 E377 D434 L620 I621	V354-A376 VanDerWaalsContact O-CA 3.31Å; V354-A376 WeakPolarHBondContact O-CA 3.31Å; V354-E377 PolarHBondContact N-O 2.82Å; V354-E377 PolarHBondContact O-N 2.94Å; V354-E377 VanDerWaalsContact O-N 3.1Å; V354-D434 WeakPolarHBondContact CA-OD2 3.35Å; V354-L620 HydrophobicContact CB-CB 4.24Å; V354-L620 HydrophobicContact CG1-CB 3.99Å; V354-I621 HydrophobicContact CB-CG2 4.2Å; V354-I621 HydrophobicContact CG2-CG2 3.89Å
355	I	94.9	Very high	92	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	150.2	-174.2	-61.1	176	0	0	0	112.1	H375 A376 A427 D434 D436	I355-H375 WeakPolarHBondContact CA-O 3.3Å; I355-A376 HydrophobicContact CG1-CB 3.98Å; I355-A427 HydrophobicContact CD1-CB 3.42Å; I355-A427 VanDerWaalsContact CD1-CB 3.42Å; I355-A427 HydrophobicContact CG1-CB 3.53Å; I355-D434 VanDerWaalsContact CD1-C 3.43Å; I355-D434 HydrophobicContact CD1-CB 4Å; I355-D434 WeakPolarHBondContact CD1-O 3.11Å; I355-D434 HydrophobicContact CG1-CB 4.01Å; I355-D434 PolarHBondContact N-OD2 2.79Å; I355-D436 HydrophobicContact CB-CB 4.07Å; I355-D436 HydrophobicContact CG2-CB 3.52Å
356	R	93.3	Very high	91.8	Very high	126 Å²	126	39.9 Å²	39.9	48%	0.475	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	140.2	146.5	-67.8	-67.4	175	-104.1	6.1	110	C374 H375 D436 L620 F818	R356-C374 WeakPolarHBondContact O-CA 3.12Å; R356-H375 PolarHBondContact N-O 3.33Å; R356-H375 PolarHBondContact O-N 3.47Å; R356-D436 WeakPolarHBondContact CA-OD2 3.21Å; R356-L620 HydrophobicContact CG-CD1 4.17Å; R356-L620 HydrophobicContact CG-CD2 3.9Å; R356-F818 HydrophobicContact CB-CE2 3.65Å; R356-F818 HydrophobicContact CB-CZ 3.69Å; R356-F818 WeakPolarHBondContact O-CZ 3.27Å
357	V	92.8	Very high	91.5	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.024	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	165.4	158.6	-63.5	0	0	0	0	111.5	R373 C374 W386 C425 D436	V357-R373 CarbonylContact C-O 3.55Å; V357-R373 WeakPolarHBondContact CA-O 3.43Å; V357-R373 WeakPolarHBondContact CB-O 3.45Å; V357-C374 HydrophobicContact CG1-CB 4.39Å; V357-W386 HydrophobicContact CG1-CH2 4.4Å; V357-C425 HydrophobicContact CG1-CB 4Å; V357-D436 HydrophobicContact CG1-CB 4.03Å; V357-D436 PolarHBondContact N-OD2 2.88Å
358	Y	89.3	Confident	91.2	Very high	54 Å²	54	42.6 Å²	42.6	21%	0.212	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	135.9	160.2	177.3	-84.4	0	0	0	112	R373 N464 F818 D858	Y358-R373 VanDerWaalsContact CD1-NH2 3.25Å; Y358-R373 PolarHBondContact N-O 3.22Å; Y358-R373 PolarHBondContact O-N 3.43Å; Y358-N464 PolarHBondContact OH-ND2 2.96Å; Y358-F818 VanDerWaalsContact CB-CD2 3.49Å; Y358-F818 HydrophobicContact CD1-CB 4.09Å; Y358-F818 HydrophobicContact CD2-CB 4.29Å; Y358-F818 HydrophobicContact CD2-CD2 4.42Å; Y358-F818 HydrophobicContact CG-CB 3.78Å; Y358-F818 HydrophobicContact CG-CD2 4.16Å; Y358-F818 AromaticContact CG-CG 3.91Å; Y358-F818 HydrophobicContact CG-CG 3.91Å; Y358-D858 WeakPolarHBondContact CE2-OD2 3.36Å
359	P	87.5	Confident	91	Very high	16 Å²	16	44.5 Å²	44.5	10%	0.104	25%	0.251	C	S	.	.			cis	-80.5	156.6	-10.7	35.5	-37	0	0	0	111.1	S361 Q362 S438	P359-S361 PolarHBondContact O-N 3.15Å; P359-Q362 HydrophobicContact CG-CB 3.81Å; P359-Q362 HydrophobicContact CG-CG 4.28Å; P359-S438 WeakPolarHBondContact O-CB 3.46Å; P359-S438 PolarHBondContact O-OG 3.32Å
360	D	86.1	Confident	90.7	Very high	111 Å²	111	44.5 Å²	44.5	59%	0.594	25%	0.252	S	S	*	.	S	Bend	trans	-57.4	-35.9	173.5	-53.4	10.8	0	0	0	111.5	S439	D360-S439 PolarHBondContact O-N 3Å
361	S	83.8	Confident	90.4	Very high	62 Å²	62	45 Å²	45	43%	0.434	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	139.2	177	-176.5	0	0	0	0	111.3	P359 S439 F441	P359-S361 PolarHBondContact O-N 3.15Å; S361-S439 CarbonylContact C-O 3.51Å; S361-S439 WeakPolarHBondContact CA-O 3.46Å; S361-F441 WeakPolarHBondContact OG-CE2 3.38Å
362	Q	84.6	Confident	90.3	Very high	23 Å²	23	44.6 Å²	44.6	11%	0.107	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	126.9	176.5	-162.6	172.8	104.6	0	0	110.8	P359 R364 S371 L372 S439 L440 F441	P359-Q362 HydrophobicContact CG-CB 3.81Å; P359-Q362 HydrophobicContact CG-CG 4.28Å; Q362-R364 VanDerWaalsContact CD-NE 3.32Å; Q362-R364 HydrophobicContact CG-CG 4.17Å; Q362-S371 PolarHBondContact NE2-O 2.63Å; Q362-L372 HydrophobicContact CB-CD2 4.45Å; Q362-S439 PolarHBondContact N-O 3.08Å; Q362-L440 HydrophobicContact CB-CD1 4.34Å; Q362-F441 PolarHBondContact O-N 3.28Å
363	A	84.3	Confident	90	Very high	50 Å²	50	44.3 Å²	44.3	41%	0.413	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	133	166.4	0	0	0	0	0	110.1	F441 W455	A363-F441 CarbonylContact C-O 3.58Å; A363-F441 WeakPolarHBondContact CA-O 3.19Å; A363-W455 HydrophobicContact CB-CZ2 4.47Å
364	R	85.1	Confident	89.8	Confident	98 Å²	98	44.2 Å²	44.2	37%	0.37	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	155.3	175.8	-68.3	-59.8	-175.4	-177.9	-5.5	111.5	Q362 V368 T369 A370 V415 L440 F441 V442 E443	Q362-R364 VanDerWaalsContact CD-NE 3.32Å; Q362-R364 HydrophobicContact CG-CG 4.17Å; R364-V368 HydrophobicContact CB-CG2 3.9Å; R364-V368 HydrophobicContact CG-CG2 4.15Å; R364-T369 PolarHBondContact NE-O 2.98Å; R364-A370 HydrophobicContact CG-CB 4.22Å; R364-V415 HydrophobicContact CB-CG1 4.32Å; R364-L440 HydrophobicContact CB-CD1 4.37Å; R364-L440 HydrophobicContact CG-CD1 4.07Å; R364-F441 PolarHBondContact N-O 3.04Å; R364-V442 VanDerWaalsContact O-CA 3.32Å; R364-V442 WeakPolarHBondContact O-CA 3.37Å; R364-E443 PolarHBondContact O-N 2.82Å
365	E	86.3	Confident	89.7	Confident	53 Å²	53	43 Å²	43	25%	0.248	24%	0.238	C	C	.	.			trans	-85.3	153.3	167.7	-77.4	152.7	155	0	0	110.2	V368 S445 K448	E365-V368 HydrophobicContact CB-CG1 4.4Å; E365-V368 WeakPolarHBondContact O-CG2 3.47Å; E365-V368 PolarHBondContact O-N 3.14Å; E365-S445 VanDerWaalsContact OE1-CB 3.29Å; E365-S445 WeakPolarHBondContact OE1-CB 3.4Å; E365-K448 WeakPolarHBondContact OE1-CD 3.37Å; E365-K448 WeakPolarHBondContact OE1-CE 3.49Å; E365-K448 IonicContact OE1-NZ 2.77Å; E365-K448 PolarHBondContact OE1-NZ 3.42Å; E365-K448 IonicContact OE2-NZ 2.77Å; E365-K448 PolarHBondContact OE2-NZ 3.2Å
366	P	91	Very high	89.6	Confident	48 Å²	48	43.1 Å²	43.1	31%	0.312	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	141.5	165.1	-23.1	32.8	0	0	0	111.3	V415 F417 V442	P366-V415 WeakPolarHBondContact CA-O 3.48Å; P366-F417 HydrophobicContact CG-CD1 4.47Å; P366-F417 HydrophobicContact CG-CD2 4.35Å; P366-F417 HydrophobicContact CG-CE1 3.83Å; P366-F417 HydrophobicContact CG-CE2 3.69Å; P366-F417 HydrophobicContact CG-CZ 3.4Å; P366-F417 VanDerWaalsContact CG-CZ 3.4Å; P366-V442 HydrophobicContact CG-CG1 3.98Å
367	G	90.2	Very high	89.7	Confident	51 Å²	51	37.9 Å²	37.9	53%	0.526	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	94	-17.5	178.3	0	0	0	0	0	116.2	N414 V415	G367-N414 WeakPolarHBondContact CA-OD1 3.26Å; G367-V415 PolarHBondContact N-O 3.39Å
368	V	89.9	Confident	89.8	Confident	52 Å²	52	38.1 Å²	38.1	32%	0.315	22%	0.223	S	C	.	.	S	Bend	trans	-97.6	169.8	-178	-43	0	0	0	0	112.8	R364 E365 V415	R364-V368 HydrophobicContact CB-CG2 3.9Å; R364-V368 HydrophobicContact CG-CG2 4.15Å; E365-V368 HydrophobicContact CB-CG1 4.4Å; E365-V368 WeakPolarHBondContact O-CG2 3.47Å; E365-V368 PolarHBondContact O-N 3.14Å; V368-V415 VanDerWaalsContact O-CB 3.31Å; V368-V415 WeakPolarHBondContact O-CB 3.31Å; V368-V415 WeakPolarHBondContact O-CG2 3.42Å; V368-V415 PolarHBondContact O-N 2.83Å
369	T	90.5	Very high	90.1	Very high	69 Å²	69	36 Å²	36	42%	0.423	22%	0.215	S	C	.	.			trans	-85	138.3	176.7	-54.4	0	0	0	0	112.5	R364 I412 S413	R364-T369 PolarHBondContact NE-O 2.98Å; T369-I412 CarbonylContact C-O 3.52Å; T369-I412 VanDerWaalsContact CA-O 3.25Å; T369-I412 WeakPolarHBondContact CA-O 3.11Å; T369-I412 WeakPolarHBondContact CG2-O 3.49Å; T369-S413 WeakPolarHBondContact CA-O 3.39Å; T369-S413 PolarHBondContact OG1-O 3.22Å
370	A	90.2	Very high	90.5	Very high	1 Å²	1	37 Å²	37	1%	0.008	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	150.4	164.3	0	0	0	0	0	111.3	R364 I412 V415 L440	R364-A370 HydrophobicContact CG-CB 4.22Å; A370-I412 HydrophobicContact CB-CB 4.27Å; A370-I412 PolarHBondContact N-O 2.84Å; A370-I412 PolarHBondContact O-N 2.94Å; A370-V415 HydrophobicContact CB-CG2 3.6Å; A370-L440 HydrophobicContact CB-CD1 4.11Å; A370-L440 HydrophobicContact CB-CD2 4.05Å
371	S	91.2	Very high	90.8	Very high	27 Å²	27	33.8 Å²	33.8	19%	0.189	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	122	174.9	174.9	0	0	0	0	107.7	Q362 E409 V410	Q362-S371 PolarHBondContact NE2-O 2.63Å; S371-E409 WeakPolarHBondContact CB-OE1 3.35Å; S371-E409 PolarHBondContact OG-OE1 2.78Å; S371-V410 WeakPolarHBondContact CA-O 3.44Å
372	L	93.2	Very high	91.4	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	125.1	178.1	-41.9	177.6	0	0	0	106.8	Q362 W386 E409 V410 Y423 L440	Q362-L372 HydrophobicContact CB-CD2 4.45Å; L372-W386 HydrophobicContact CB-CH2 4.4Å; L372-E409 CarbonylContact O-C 3.46Å; L372-E409 WeakPolarHBondContact O-CA 3.19Å; L372-V410 HydrophobicContact CB-CB 4.37Å; L372-V410 PolarHBondContact N-O 2.98Å; L372-V410 PolarHBondContact O-N 3.14Å; L372-Y423 HydrophobicContact CD1-CD1 3.93Å; L372-Y423 HydrophobicContact CD1-CD2 3.64Å; L372-Y423 HydrophobicContact CD1-CE1 4.43Å; L372-Y423 HydrophobicContact CD1-CE2 4.21Å; L372-Y423 HydrophobicContact CD1-CG 3.49Å; L372-Y423 VanDerWaalsContact CD1-CG 3.49Å; L372-L440 HydrophobicContact CD1-CB 4.4Å
373	R	92.4	Very high	91.9	Very high	39 Å²	39	37.5 Å²	37.5	15%	0.147	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	155.6	-172.6	-68.4	178.2	-67.8	157.6	-0.1	111.1	V357 Y358 S408 E409 F818	V357-R373 CarbonylContact C-O 3.55Å; V357-R373 WeakPolarHBondContact CA-O 3.43Å; V357-R373 WeakPolarHBondContact CB-O 3.45Å; Y358-R373 VanDerWaalsContact CD1-NH2 3.25Å; Y358-R373 PolarHBondContact N-O 3.22Å; Y358-R373 PolarHBondContact O-N 3.43Å; R373-S408 CarbonylContact C-O 3.47Å; R373-S408 WeakPolarHBondContact CA-O 3.34Å; R373-E409 HydrophobicContact CG-CB 4.04Å; R373-E409 HydrophobicContact CG-CG 3.91Å; R373-F818 HydrophobicContact CB-CD1 4.31Å; R373-F818 HydrophobicContact CB-CE1 4.45Å; R373-F818 PolarHBondContact NH1-O 2.8Å; R373-F818 PolarHBondContact NH2-O 2.94Å
374	C	93.9	Very high	92.4	Very high	5 Å²	5	36.7 Å²	36.7	3%	0.034	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	129.8	177.7	177.5	0	0	0	0	109.4	R356 V357 L384 W386 S408 C425	R356-C374 WeakPolarHBondContact O-CA 3.12Å; V357-C374 HydrophobicContact CG1-CB 4.39Å; C374-L384 HydrophobicContact CB-CD1 4.44Å; C374-W386 HydrophobicContact CB-CH2 3.79Å; C374-W386 HydrophobicContact CB-CZ2 3.31Å; C374-S408 PolarHBondContact N-O 3.19Å; C374-S408 WeakPolarHBondContact O-CB 3.4Å; C374-C425 HydrophobicContact CB-CB 3.58Å; C374-C425 WeakPolarHBondContact CB-SG 3.42Å; C374-C425 WeakPolarHBondContact SG-CB 3.43Å; C374-C425 CovalentContact SG-SG 2.03Å; C374-C425 PolarHBondContact SG-SG 2.83Å
375	H	92.9	Very high	93	Very high	15 Å²	15	34.1 Å²	34.1	7%	0.069	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	144.5	169.6	169.1	80.2	0	0	0	108.6	I355 R356 E377 R758 L817 F818	I355-H375 WeakPolarHBondContact CA-O 3.3Å; R356-H375 PolarHBondContact N-O 3.33Å; R356-H375 PolarHBondContact O-N 3.47Å; H375-E377 IonicContact CD2-OE1 3.89Å; H375-E377 IonicContact CE1-OE1 3.63Å; H375-E377 IonicContact NE2-OE1 3.62Å; H375-E377 PolarHBondContact NE2-OE1 3.44Å; H375-R758 PolarHBondContact CE1-NE 2.85Å; H375-L817 HydrophobicContact CB-CD1 4.35Å; H375-L817 HydrophobicContact CB-CD2 4.41Å; H375-F818 HydrophobicContact CB-CE1 3.85Å; H375-F818 HydrophobicContact CB-CZ 3.92Å
376	A	94.2	Very high	93.5	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.008	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	133.5	179	0	0	0	0	0	110.3	V354 I355 P382 L384 A427 H764	V354-A376 VanDerWaalsContact O-CA 3.31Å; V354-A376 WeakPolarHBondContact O-CA 3.31Å; I355-A376 HydrophobicContact CG1-CB 3.98Å; A376-P382 HydrophobicContact CB-CG 3.71Å; A376-L384 HydrophobicContact CB-CD2 3.87Å; A376-A427 HydrophobicContact CB-CB 3.64Å; A376-H764 PolarHBondContact O-CE1 3.13Å; A376-H764 VanDerWaalsContact O-CE1 3.23Å
377	E	94.5	Very high	93.9	Very high	16 Å²	16	31.4 Å²	31.4	8%	0.075	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	151.4	168.1	-81.8	155.6	-132.8	0	0	110	P353 V354 H375 S619 L620 I621	P353-E377 CarbonylContact C-O 3.51Å; P353-E377 VanDerWaalsContact CA-O 3.29Å; P353-E377 WeakPolarHBondContact CA-O 3.23Å; V354-E377 PolarHBondContact N-O 2.82Å; V354-E377 PolarHBondContact O-N 2.94Å; V354-E377 VanDerWaalsContact O-N 3.1Å; H375-E377 IonicContact CD2-OE1 3.89Å; H375-E377 IonicContact CE1-OE1 3.63Å; H375-E377 IonicContact NE2-OE1 3.62Å; H375-E377 PolarHBondContact NE2-OE1 3.44Å; E377-S619 WeakPolarHBondContact OE2-CB 3.31Å; E377-S619 PolarHBondContact OE2-OG 2.85Å; E377-L620 HydrophobicContact CB-CB 4.23Å; E377-L620 PolarHBondContact OE2-N 2.9Å; E377-I621 HydrophobicContact CB-CB 4.46Å; E377-I621 HydrophobicContact CB-CD1 4.37Å; E377-I621 HydrophobicContact CB-CG1 4.07Å; E377-I621 HydrophobicContact CB-CG2 3.73Å; E377-I621 PolarHBondContact OE2-N 2.93Å
378	G	95.3	Very high	94.2	Very high	9 Å²	9	30 Å²	30	9%	0.093	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171	162.6	-178.6	0	0	0	0	0	109.8	P380	G378-P380 CarbonylContact C-O 3.36Å; G378-P380 CarbonylContact O-C 3.51Å
379	I	95.5	Very high	94.5	Very high	11 Å²	11	31.7 Å²	31.7	6%	0.056	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	119.1	-179.8	-54.7	-176	0	0	0	108.8	T325 M328 N350 V351 N429 I621 V669 E735	T325-I379 HydrophobicContact CG2-CD1 3.88Å; M328-I379 HydrophobicContact CE-CD1 3.76Å; M328-I379 HydrophobicContact CE-CG2 3.94Å; N350-I379 CarbonylContact C-O 3.55Å; N350-I379 VanDerWaalsContact CA-O 3.22Å; N350-I379 WeakPolarHBondContact CA-O 3.45Å; N350-I379 WeakPolarHBondContact CB-O 3.39Å; V351-I379 HydrophobicContact CB-CB 3.97Å; V351-I379 HydrophobicContact CB-CG1 4.12Å; V351-I379 HydrophobicContact CG2-CB 4.04Å; V351-I379 HydrophobicContact CG2-CD1 4.04Å; V351-I379 HydrophobicContact CG2-CG1 4.05Å; V351-I379 PolarHBondContact N-O 3.08Å; V351-I379 PolarHBondContact O-N 2.88Å; I379-N429 PolarHBondContact N-ND2 3.18Å; I379-N429 PolarHBondContact O-ND2 2.86Å; I379-I621 HydrophobicContact CD1-CD1 4.32Å; I379-I621 HydrophobicContact CG1-CD1 4.25Å; I379-V669 HydrophobicContact CD1-CG2 4.47Å; I379-E735 HydrophobicContact CG2-CB 4.07Å
380	P	95	Very high	94.7	Very high	37 Å²	37	31.2 Å²	31.2	24%	0.24	18%	0.183	C	C	.	.	S	Bend	cis	-57.1	160.3	-10.4	-24.5	35.5	0	0	0	113.7	G378 N429 E430	G378-P380 CarbonylContact C-O 3.36Å; G378-P380 CarbonylContact O-C 3.51Å; P380-N429 VanDerWaalsContact O-CB 3.32Å; P380-N429 WeakPolarHBondContact O-CB 3.36Å; P380-N429 PolarHBondContact O-ND2 2.8Å; P380-E430 HydrophobicContact CG-CG 4.12Å
381	S	93.2	Very high	95	Very high	42 Å²	42	35.6 Å²	35.6	29%	0.294	21%	0.205	S	C	.	.	P	Polyproline II helix	trans	-53.7	126.5	-178.4	-64.2	0	0	0	0	111.5	E735	S381-E735 VanDerWaalsContact CB-OE1 3.26Å; S381-E735 WeakPolarHBondContact CB-OE1 3.36Å; S381-E735 PolarHBondContact N-OE1 3.07Å; S381-E735 PolarHBondContact OG-OE1 2.79Å
382	P	95.5	Very high	95.3	Very high	4 Å²	4	37.3 Å²	37.3	3%	0.026	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-77.1	144.8	-169.1	30	-35.9	0	0	0	113.4	P353 A376 A427 K428 N429 H764	P353-P382 HydrophobicContact CB-CB 4.06Å; P353-P382 HydrophobicContact CB-CG 4.37Å; P353-P382 HydrophobicContact CG-CB 4Å; A376-P382 HydrophobicContact CB-CG 3.71Å; P382-A427 HydrophobicContact CB-CB 4.11Å; P382-A427 HydrophobicContact CG-CB 4.44Å; P382-K428 CarbonylContact C-O 3.57Å; P382-K428 WeakPolarHBondContact CA-O 3.5Å; P382-N429 HydrophobicContact CB-CB 4.45Å; P382-H764 PolarHBondContact O-NE2 3.19Å
383	Q	95.4	Very high	95.4	Very high	159 Å²	159	37.3 Å²	37.3	74%	0.743	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	133.1	169.7	-63	-176.9	0.8	0	0	109.8	A427 K428	Q383-A427 WeakPolarHBondContact O-CA 3.39Å; Q383-K428 PolarHBondContact N-O 2.85Å; Q383-K428 PolarHBondContact O-N 2.82Å
384	L	96	Very high	95.5	Very high	33 Å²	33	41.7 Å²	41.7	17%	0.173	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	148	176.3	-63.8	-175.6	0	0	0	112.4	C374 A376 I426 A427 I763	C374-L384 HydrophobicContact CB-CD1 4.44Å; A376-L384 HydrophobicContact CB-CD2 3.87Å; L384-I426 CarbonylContact C-O 3.54Å; L384-I426 WeakPolarHBondContact CA-O 3.08Å; L384-A427 HydrophobicContact CD2-CB 3.49Å; L384-A427 VanDerWaalsContact CD2-CB 3.49Å; L384-I763 HydrophobicContact CB-CD1 4.24Å; L384-I763 HydrophobicContact CD1-CD1 3.63Å; L384-I763 HydrophobicContact CD1-CG1 4.46Å; L384-I763 HydrophobicContact CG-CD1 3.72Å
385	S	96.4	Very high	95.5	Very high	44 Å²	44	46.1 Å²	46.1	31%	0.308	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	162.7	169.8	58.4	0	0	0	0	109.7	I426	S385-I426 PolarHBondContact N-O 2.93Å; S385-I426 PolarHBondContact O-N 2.93Å; S385-I426 PolarHBondContact OG-O 2.83Å
386	W	98.2	Very high	95.4	Very high	3 Å²	3	49.6 Å²	49.6	1%	0.011	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	141.1	-175.3	-74.6	92.3	0	0	0	111.5	V357 L372 C374 I393 L403 G407 V410 Y423 T424 C425	V357-W386 HydrophobicContact CG1-CH2 4.4Å; L372-W386 HydrophobicContact CB-CH2 4.4Å; C374-W386 HydrophobicContact CB-CH2 3.79Å; C374-W386 HydrophobicContact CB-CZ2 3.31Å; W386-I393 HydrophobicContact CB-CB 4.1Å; W386-I393 HydrophobicContact CB-CD1 4.27Å; W386-I393 HydrophobicContact CB-CG2 3.68Å; W386-I393 WeakPolarHBondContact O-CB 3.26Å; W386-I393 PolarHBondContact O-N 2.77Å; W386-L403 HydrophobicContact CG-CD2 4.36Å; W386-G407 PolarHBondContact NE1-O 3.31Å; W386-V410 HydrophobicContact CB-CG2 4.39Å; W386-V410 HydrophobicContact CD2-CG2 3.47Å; W386-V410 VanDerWaalsContact CD2-CG2 3.47Å; W386-V410 HydrophobicContact CE3-CG2 3.79Å; W386-V410 HydrophobicContact CG-CG2 3.78Å; W386-V410 HydrophobicContact CH2-CG2 4.26Å; W386-V410 HydrophobicContact CZ2-CG2 3.97Å; W386-V410 HydrophobicContact CZ3-CG2 4.18Å; W386-Y423 WeakPolarHBondContact CZ3-O 3.48Å; W386-T424 CarbonylContact C-O 3.54Å; W386-T424 VanDerWaalsContact CA-O 3.27Å; W386-T424 WeakPolarHBondContact CA-O 3.48Å; W386-C425 HydrophobicContact CD2-CB 4.02Å; W386-C425 HydrophobicContact CE3-CB 3.87Å; W386-C425 HydrophobicContact CH2-CB 3.97Å; W386-C425 HydrophobicContact CZ2-CB 4.1Å; W386-C425 HydrophobicContact CZ3-CB 3.83Å
387	L	98.2	Very high	95.3	Very high	41 Å²	41	53.3 Å²	53.3	22%	0.215	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	138.3	169.8	-49.5	-177	0	0	0	109.9	M391 D392 Y423 T424 I426	L387-M391 CarbonylContact C-O 3.6Å; L387-M391 WeakPolarHBondContact CA-O 3.11Å; L387-D392 HydrophobicContact CD2-CB 4.45Å; L387-Y423 CarbonylContact O-C 3.52Å; L387-Y423 VanDerWaalsContact O-CA 3.3Å; L387-Y423 WeakPolarHBondContact O-CA 3.08Å; L387-T424 PolarHBondContact N-O 2.74Å; L387-T424 PolarHBondContact O-N 2.78Å; L387-I426 HydrophobicContact CD1-CD1 3.73Å; L387-I426 HydrophobicContact CD2-CD1 4.49Å; L387-I426 HydrophobicContact CG-CD1 3.88Å
388	K	97.1	Very high	95.3	Very high	23 Å²	23	55.6 Å²	55.6	10%	0.1	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	114.6	164.3	-177.6	179.9	178.7	-177.3	0	108	G390 M391 I393 L401 E418 D419 Y423	K388-G390 VanDerWaalsContact C-N 3.29Å; K388-G390 PolarHBondContact O-N 2.88Å; K388-M391 PolarHBondContact N-O 3.01Å; K388-M391 PolarHBondContact O-N 2.88Å; K388-I393 HydrophobicContact CB-CG1 4.28Å; K388-L401 HydrophobicContact CD-CD1 4.25Å; K388-E418 WeakPolarHBondContact CE-O 3.41Å; K388-E418 PolarHBondContact NZ-O 3.32Å; K388-D419 IonicContact NZ-OD1 3.28Å; K388-D419 PolarHBondContact NZ-OD1 3.06Å; K388-Y423 HydrophobicContact CB-CD1 4.37Å; K388-Y423 HydrophobicContact CB-CE1 4.23Å; K388-Y423 HydrophobicContact CD-CE1 3.91Å; K388-Y423 HydrophobicContact CD-CE2 4.41Å; K388-Y423 WeakPolarHBondContact CD-OH 3.27Å; K388-Y423 WeakPolarHBondContact CE-OH 3.4Å; K388-Y423 HydrophobicContact CG-CD1 4.43Å; K388-Y423 HydrophobicContact CG-CE1 3.97Å; K388-Y423 HydrophobicContact CG-CE2 4.2Å; K388-Y423 PolarHBondContact NZ-OH 3.18Å
389	N	95.3	Very high	95.1	Very high	87 Å²	87	65.3 Å²	65.3	47%	0.465	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	50	46.3	-176	-60.7	-31.8	0	0	0	112.7	M391 G421 A422	N389-M391 VanDerWaalsContact C-N 3.31Å; N389-M391 PolarHBondContact O-N 3.14Å; N389-G421 WeakPolarHBondContact OD1-CA 3.32Å; N389-A422 PolarHBondContact N-O 3.27Å; N389-A422 PolarHBondContact OD1-N 2.89Å
390	G	95.3	Very high	95.1	Very high	58 Å²	58	66.7 Å²	66.7	60%	0.598	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	-1.9	178.4	0	0	0	0	0	116.6	K388	K388-G390 VanDerWaalsContact C-N 3.29Å; K388-G390 PolarHBondContact O-N 2.88Å
391	M	96.5	Very high	95.1	Very high	93 Å²	93	65.1 Å²	65.1	46%	0.458	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	140.7	174.7	-66.6	173.1	-80.6	0	0	111.4	L387 K388 N389 I393	L387-M391 CarbonylContact C-O 3.6Å; L387-M391 WeakPolarHBondContact CA-O 3.11Å; K388-M391 PolarHBondContact N-O 3.01Å; K388-M391 PolarHBondContact O-N 2.88Å; N389-M391 VanDerWaalsContact C-N 3.31Å; N389-M391 PolarHBondContact O-N 3.14Å; M391-I393 PolarHBondContact O-N 2.81Å
392	D	96.4	Very high	95.2	Very high	63 Å²	63	65.1 Å²	65.1	34%	0.337	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.1	121.3	175.1	-177.3	-13.9	0	0	0	110.8	L387 K394 T395	L387-D392 HydrophobicContact CD2-CB 4.45Å; D392-K394 PolarHBondContact O-N 3.27Å; D392-K394 VanDerWaalsContact O-N 3.11Å; D392-K394 VanDerWaalsContact OD1-CB 3.25Å; D392-K394 WeakPolarHBondContact OD1-CB 3.14Å; D392-K394 VanDerWaalsContact OD1-CG 3.23Å; D392-K394 WeakPolarHBondContact OD1-CG 3.4Å; D392-K394 PolarHBondContact OD1-N 3.43Å; D392-T395 WeakPolarHBondContact O-CB 3.43Å; D392-T395 PolarHBondContact O-N 3.31Å; D392-T395 PolarHBondContact O-OG1 3.03Å
393	I	95.9	Very high	95.2	Very high	1 Å²	1	67.6 Å²	67.6	1%	0.005	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-61	-22.6	-176.6	-150.8	169.9	0	0	0	112.3	W386 K388 M391 T395 K396 L397 L401 L403 V410 Y423	W386-I393 HydrophobicContact CB-CB 4.1Å; W386-I393 HydrophobicContact CB-CD1 4.27Å; W386-I393 HydrophobicContact CB-CG2 3.68Å; W386-I393 WeakPolarHBondContact O-CB 3.26Å; W386-I393 PolarHBondContact O-N 2.77Å; K388-I393 HydrophobicContact CB-CG1 4.28Å; M391-I393 PolarHBondContact O-N 2.81Å; I393-T395 PolarHBondContact O-N 3.28Å; I393-T395 VanDerWaalsContact O-N 3.16Å; I393-K396 CarbonylContact O-C 3.26Å; I393-K396 WeakPolarHBondContact O-CA 3.45Å; I393-K396 PolarHBondContact O-N 3.28Å; I393-L397 HydrophobicContact CG2-CD2 4.45Å; I393-L397 WeakPolarHBondContact O-CG 3.38Å; I393-L397 PolarHBondContact O-N 3.45Å; I393-L401 HydrophobicContact CD1-CD2 3.91Å; I393-L401 HydrophobicContact CG1-CD2 3.85Å; I393-L403 HydrophobicContact CG2-CD1 3.98Å; I393-L403 HydrophobicContact CG2-CD2 4.33Å; I393-L403 HydrophobicContact CG2-CG 4.36Å; I393-V410 HydrophobicContact CD1-CB 4.46Å; I393-V410 HydrophobicContact CD1-CG1 3.77Å; I393-V410 HydrophobicContact CD1-CG2 3.74Å; I393-Y423 HydrophobicContact CD1-CD1 3.82Å; I393-Y423 HydrophobicContact CD1-CE1 3.92Å
394	K	94.6	Very high	94.9	Very high	131 Å²	131	62.8 Å²	62.8	57%	0.57	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-56.9	-29.1	174.3	-66.4	169.6	-166.5	158.6	0	111.9	D392 K396	D392-K394 PolarHBondContact O-N 3.27Å; D392-K394 VanDerWaalsContact O-N 3.11Å; D392-K394 VanDerWaalsContact OD1-CB 3.25Å; D392-K394 WeakPolarHBondContact OD1-CB 3.14Å; D392-K394 VanDerWaalsContact OD1-CG 3.23Å; D392-K394 WeakPolarHBondContact OD1-CG 3.4Å; D392-K394 PolarHBondContact OD1-N 3.43Å; K394-K396 PolarHBondContact O-N 3.02Å
395	T	93.1	Very high	94.4	Very high	97 Å²	97	61.8 Å²	61.8	60%	0.595	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-76.3	-7.6	174.5	70.6	0	0	0	0	114.1	D392 I393	D392-T395 WeakPolarHBondContact O-CB 3.43Å; D392-T395 PolarHBondContact O-N 3.31Å; D392-T395 PolarHBondContact O-OG1 3.03Å; I393-T395 PolarHBondContact O-N 3.28Å; I393-T395 VanDerWaalsContact O-N 3.16Å
396	K	90.8	Very high	93.9	Very high	89 Å²	89	65.1 Å²	65.1	39%	0.387	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-121.3	1.1	-175.1	-50.6	-59.7	175	-174.9	0	113.5	I393 K394	I393-K396 CarbonylContact O-C 3.26Å; I393-K396 WeakPolarHBondContact O-CA 3.45Å; I393-K396 PolarHBondContact O-N 3.28Å; K394-K396 PolarHBondContact O-N 3.02Å
397	L	93.8	Very high	93.4	Very high	78 Å²	78	65.7 Å²	65.7	41%	0.408	35%	0.352	S	S	.	.			trans	-64.9	142.8	178.2	-59.6	179.1	0	0	0	111.2	I393 L401 L403	I393-L397 HydrophobicContact CG2-CD2 4.45Å; I393-L397 WeakPolarHBondContact O-CG 3.38Å; I393-L397 PolarHBondContact O-N 3.45Å; L397-L401 WeakPolarHBondContact CA-O 3.39Å; L397-L401 HydrophobicContact CD2-CD2 3.71Å; L397-L403 HydrophobicContact CD2-CD1 4.35Å; L397-L403 HydrophobicContact CD2-CG 4.07Å
398	S	93.9	Very high	93.1	Very high	64 Å²	64	64.6 Å²	64.6	45%	0.448	35%	0.348	S	S	.	.			trans	-153.3	-169.9	-177.9	72.6	0	0	0	0	110.7	Q400 L401 T402	S398-Q400 PolarHBondContact O-N 2.97Å; S398-Q400 PolarHBondContact OG-N 2.85Å; S398-L401 PolarHBondContact N-O 3.29Å; S398-L401 VanDerWaalsContact O-O 3.13Å; S398-L401 PolarHBondContact OG-N 2.72Å; S398-T402 WeakPolarHBondContact O-CG2 3.38Å
399	K	91.8	Very high	92.9	Very high	213 Å²	213	63.6 Å²	63.6	93%	0.926	34%	0.344	S	S	*	.	S	Bend	trans	-71	-15.1	168.7	-69.1	-178.1	177.7	-180	0	113.2
400	Q	94.1	Very high	93	Very high	41 Å²	41	59.4 Å²	59.4	19%	0.192	32%	0.322	C	S	.	.	S	Bend	trans	-97.1	-51.1	-179.2	166	179.6	-35.6	0	0	110.7	S398 I412 S413 N414 H416 D419	S398-Q400 PolarHBondContact O-N 2.97Å; S398-Q400 PolarHBondContact OG-N 2.85Å; Q400-I412 HydrophobicContact CG-CG2 4Å; Q400-I412 CarbonylContact O-C 3.59Å; Q400-I412 VanDerWaalsContact O-CA 3.3Å; Q400-I412 WeakPolarHBondContact O-CA 3.15Å; Q400-S413 PolarHBondContact O-N 2.93Å; Q400-S413 PolarHBondContact O-OG 3.35Å; Q400-N414 VanDerWaalsContact CG-O 3.26Å; Q400-N414 WeakPolarHBondContact CG-O 3.34Å; Q400-N414 PolarHBondContact NE2-O 3.31Å; Q400-N414 VanDerWaalsContact NE2-O 3.14Å; Q400-H416 PolarHBondContact NE2-ND1 3.13Å; Q400-H416 PolarHBondContact OE1-CE1 2.92Å; Q400-H416 PolarHBondContact OE1-ND1 2.73Å; Q400-D419 PolarHBondContact NE2-OD2 3.39Å
401	L	95.8	Very high	93	Very high	4 Å²	4	58.3 Å²	58.3	2%	0.021	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	115.2	-178.2	-170.5	162.3	0	0	0	109.4	K388 I393 L397 S398 I412 Y423	K388-L401 HydrophobicContact CD-CD1 4.25Å; I393-L401 HydrophobicContact CD1-CD2 3.91Å; I393-L401 HydrophobicContact CG1-CD2 3.85Å; L397-L401 WeakPolarHBondContact CA-O 3.39Å; L397-L401 HydrophobicContact CD2-CD2 3.71Å; S398-L401 PolarHBondContact N-O 3.29Å; S398-L401 VanDerWaalsContact O-O 3.13Å; S398-L401 PolarHBondContact OG-N 2.72Å; L401-I412 HydrophobicContact CB-CG1 4.47Å; L401-I412 HydrophobicContact CD1-CD1 4.34Å; L401-I412 HydrophobicContact CD1-CG1 4.4Å; L401-I412 HydrophobicContact CG-CG1 4.06Å; L401-Y423 HydrophobicContact CD1-CE1 4.29Å
402	T	95.6	Very high	93	Very high	41 Å²	41	53.9 Å²	53.9	25%	0.252	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	155.6	-173.7	57.5	0	0	0	0	111.4	S398 Q404 H411	S398-T402 WeakPolarHBondContact O-CG2 3.38Å; T402-Q404 PolarHBondContact OG1-NE2 3.06Å; T402-H411 PolarHBondContact N-O 2.83Å; T402-H411 PolarHBondContact O-N 2.93Å; T402-H411 PolarHBondContact OG1-O 2.88Å
403	L	93.9	Very high	92.8	Very high	57 Å²	57	53.2 Å²	53.2	30%	0.298	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	131.2	164.4	-73	169.6	0	0	0	109	W386 I393 L397 E409 V410	W386-L403 HydrophobicContact CG-CD2 4.36Å; I393-L403 HydrophobicContact CG2-CD1 3.98Å; I393-L403 HydrophobicContact CG2-CD2 4.33Å; I393-L403 HydrophobicContact CG2-CG 4.36Å; L397-L403 HydrophobicContact CD2-CD1 4.35Å; L397-L403 HydrophobicContact CD2-CG 4.07Å; L403-E409 CarbonylContact C-O 3.53Å; L403-E409 WeakPolarHBondContact CA-O 3.48Å; L403-V410 HydrophobicContact CD2-CG2 3.84Å
404	Q	90.3	Very high	92.7	Very high	58 Å²	58	56.2 Å²	56.2	27%	0.271	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	174.6	178.7	-62.8	-174.5	7.7	0	0	110	T402 N406 G407 S408 E409 H411	T402-Q404 PolarHBondContact OG1-NE2 3.06Å; Q404-N406 VanDerWaalsContact C-N 3.29Å; Q404-N406 PolarHBondContact O-N 3.39Å; Q404-G407 PolarHBondContact O-N 3.49Å; Q404-S408 PolarHBondContact O-N 3.18Å; Q404-E409 HydrophobicContact CB-CB 4.13Å; Q404-E409 HydrophobicContact CB-CG 4.4Å; Q404-E409 PolarHBondContact N-O 3.48Å; Q404-E409 PolarHBondContact O-N 3.49Å; Q404-H411 VanDerWaalsContact CD-CB 3.47Å; Q404-H411 HydrophobicContact CG-CB 3.9Å; Q404-H411 PolarHBondContact NE2-CD2 3.1Å
405	A	84.3	Confident	92.7	Very high	11 Å²	11	50 Å²	50	9%	0.091	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	47.6	49.6	-179.7	0	0	0	0	0	113.2	G407 S408 E409 F760 T761	A405-G407 PolarHBondContact O-N 2.74Å; A405-G407 VanDerWaalsContact O-N 3.09Å; A405-S408 WeakPolarHBondContact CB-OG 3.46Å; A405-S408 PolarHBondContact O-N 2.98Å; A405-S408 VanDerWaalsContact O-N 3.13Å; A405-S408 PolarHBondContact O-OG 3.41Å; A405-E409 HydrophobicContact CB-CB 4.44Å; A405-F760 WeakPolarHBondContact CB-O 2.99Å; A405-T761 WeakPolarHBondContact CA-O 3.38Å
406	N	85.9	Confident	92.7	Very high	114 Å²	114	49.1 Å²	49.1	61%	0.61	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	50.5	31	-176.4	-149.3	-6.3	0	0	0	115	Q404 E762 I763	Q404-N406 VanDerWaalsContact C-N 3.29Å; Q404-N406 PolarHBondContact O-N 3.39Å; N406-E762 PolarHBondContact ND2-OE2 3.3Å; N406-I763 HydrophobicContact CB-CB 4.26Å; N406-I763 HydrophobicContact CB-CG2 4.1Å
407	G	89	Confident	92.8	Very high	15 Å²	15	50 Å²	50	16%	0.155	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	106.7	-5.5	177.4	0	0	0	0	0	115.4	W386 Q404 A405	W386-G407 PolarHBondContact NE1-O 3.31Å; Q404-G407 PolarHBondContact O-N 3.49Å; A405-G407 PolarHBondContact O-N 2.74Å; A405-G407 VanDerWaalsContact O-N 3.09Å
408	S	91.5	Very high	92.7	Very high	18 Å²	18	53.6 Å²	53.6	13%	0.126	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-13.2	-179.9	60.1	0	0	0	0	115	R373 C374 Q404 A405	R373-S408 CarbonylContact C-O 3.47Å; R373-S408 WeakPolarHBondContact CA-O 3.34Å; C374-S408 PolarHBondContact N-O 3.19Å; C374-S408 WeakPolarHBondContact O-CB 3.4Å; Q404-S408 PolarHBondContact O-N 3.18Å; A405-S408 WeakPolarHBondContact CB-OG 3.46Å; A405-S408 PolarHBondContact O-N 2.98Å; A405-S408 VanDerWaalsContact O-N 3.13Å; A405-S408 PolarHBondContact O-OG 3.41Å
409	E	93.4	Very high	92.7	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.009	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	125.7	175.5	178.9	177.6	166	0	0	111.5	S371 L372 R373 L403 Q404 A405 H411 R836	S371-E409 WeakPolarHBondContact CB-OE1 3.35Å; S371-E409 PolarHBondContact OG-OE1 2.78Å; L372-E409 CarbonylContact O-C 3.46Å; L372-E409 WeakPolarHBondContact O-CA 3.19Å; R373-E409 HydrophobicContact CG-CB 4.04Å; R373-E409 HydrophobicContact CG-CG 3.91Å; L403-E409 CarbonylContact C-O 3.53Å; L403-E409 WeakPolarHBondContact CA-O 3.48Å; Q404-E409 HydrophobicContact CB-CB 4.13Å; Q404-E409 HydrophobicContact CB-CG 4.4Å; Q404-E409 PolarHBondContact N-O 3.48Å; Q404-E409 PolarHBondContact O-N 3.49Å; A405-E409 HydrophobicContact CB-CB 4.44Å; E409-H411 HydrophobicContact CG-CB 4.37Å; E409-H411 IonicContact OE1-ND1 2.94Å; E409-H411 PolarHBondContact OE1-ND1 3.28Å; E409-R836 VanDerWaalsContact CD-NH1 3.33Å; E409-R836 IonicContact OE1-CZ 2.88Å; E409-R836 IonicContact OE1-NH1 3.71Å; E409-R836 PolarHBondContact OE1-NH1 3.12Å; E409-R836 VanDerWaalsContact OE1-NH1 3.09Å; E409-R836 IonicContact OE1-NH2 3.39Å; E409-R836 PolarHBondContact OE1-NH2 3.21Å; E409-R836 IonicContact OE2-CZ 3.72Å; E409-R836 IonicContact OE2-NH1 3.25Å; E409-R836 PolarHBondContact OE2-NH1 2.83Å; E409-R836 IonicContact OE2-NH2 3.03Å; E409-R836 PolarHBondContact OE2-NH2 3.21Å
410	V	96.1	Very high	92.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	119.1	160.6	179.9	0	0	0	0	108	S371 L372 W386 I393 L403 I412 Y423	S371-V410 WeakPolarHBondContact CA-O 3.44Å; L372-V410 HydrophobicContact CB-CB 4.37Å; L372-V410 PolarHBondContact N-O 2.98Å; L372-V410 PolarHBondContact O-N 3.14Å; W386-V410 HydrophobicContact CB-CG2 4.39Å; W386-V410 HydrophobicContact CD2-CG2 3.47Å; W386-V410 VanDerWaalsContact CD2-CG2 3.47Å; W386-V410 HydrophobicContact CE3-CG2 3.79Å; W386-V410 HydrophobicContact CG-CG2 3.78Å; W386-V410 HydrophobicContact CH2-CG2 4.26Å; W386-V410 HydrophobicContact CZ2-CG2 3.97Å; W386-V410 HydrophobicContact CZ3-CG2 4.18Å; I393-V410 HydrophobicContact CD1-CB 4.46Å; I393-V410 HydrophobicContact CD1-CG1 3.77Å; I393-V410 HydrophobicContact CD1-CG2 3.74Å; L403-V410 HydrophobicContact CD2-CG2 3.84Å; V410-I412 HydrophobicContact CG1-CG1 4.4Å; V410-Y423 HydrophobicContact CG1-CD1 3.96Å; V410-Y423 HydrophobicContact CG1-CE1 3.89Å; V410-Y423 HydrophobicContact CG2-CD1 4.49Å
411	H	95.3	Very high	92.9	Very high	34 Å²	34	41.9 Å²	41.9	16%	0.157	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	124.1	-177.1	-177.8	98.3	0	0	0	110.9	T402 Q404 E409	T402-H411 PolarHBondContact N-O 2.83Å; T402-H411 PolarHBondContact O-N 2.93Å; T402-H411 PolarHBondContact OG1-O 2.88Å; Q404-H411 VanDerWaalsContact CD-CB 3.47Å; Q404-H411 HydrophobicContact CG-CB 3.9Å; Q404-H411 PolarHBondContact NE2-CD2 3.1Å; E409-H411 HydrophobicContact CG-CB 4.37Å; E409-H411 IonicContact OE1-ND1 2.94Å; E409-H411 PolarHBondContact OE1-ND1 3.28Å
412	I	96.4	Very high	92.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	103.9	-179	-53.5	175.6	0	0	0	107.7	T369 A370 Q400 L401 V410 V415 D419 Y423 L440	T369-I412 CarbonylContact C-O 3.52Å; T369-I412 VanDerWaalsContact CA-O 3.25Å; T369-I412 WeakPolarHBondContact CA-O 3.11Å; T369-I412 WeakPolarHBondContact CG2-O 3.49Å; A370-I412 HydrophobicContact CB-CB 4.27Å; A370-I412 PolarHBondContact N-O 2.84Å; A370-I412 PolarHBondContact O-N 2.94Å; Q400-I412 HydrophobicContact CG-CG2 4Å; Q400-I412 CarbonylContact O-C 3.59Å; Q400-I412 VanDerWaalsContact O-CA 3.3Å; Q400-I412 WeakPolarHBondContact O-CA 3.15Å; L401-I412 HydrophobicContact CB-CG1 4.47Å; L401-I412 HydrophobicContact CD1-CD1 4.34Å; L401-I412 HydrophobicContact CD1-CG1 4.4Å; L401-I412 HydrophobicContact CG-CG1 4.06Å; V410-I412 HydrophobicContact CG1-CG1 4.4Å; I412-V415 HydrophobicContact CB-CG2 4.13Å; I412-V415 HydrophobicContact CG2-CB 4.48Å; I412-V415 HydrophobicContact CG2-CG2 3.75Å; I412-D419 HydrophobicContact CD1-CB 4.08Å; I412-D419 WeakPolarHBondContact CG2-OD2 3.41Å; I412-Y423 HydrophobicContact CD1-CE1 4.25Å; I412-Y423 WeakPolarHBondContact CD1-OH 3.42Å; I412-L440 HydrophobicContact CD1-CD2 3.61Å
413	S	94.1	Very high	93	Very high	49 Å²	49	41.3 Å²	41.3	34%	0.343	23%	0.225	S	C	.	.	S	Bend	trans	-70	-36.2	-170.4	56.9	0	0	0	0	113.6	T369 Q400	T369-S413 WeakPolarHBondContact CA-O 3.39Å; T369-S413 PolarHBondContact OG1-O 3.22Å; Q400-S413 PolarHBondContact O-N 2.93Å; Q400-S413 PolarHBondContact O-OG 3.35Å
414	N	93.5	Very high	93.2	Very high	65 Å²	65	39.3 Å²	39.3	35%	0.348	22%	0.216	S	C	.	.	S	Bend	trans	-135.7	94	-179.4	174.5	13.4	0	0	0	108.9	G367 Q400 H416	G367-N414 WeakPolarHBondContact CA-OD1 3.26Å; Q400-N414 VanDerWaalsContact CG-O 3.26Å; Q400-N414 WeakPolarHBondContact CG-O 3.34Å; Q400-N414 PolarHBondContact NE2-O 3.31Å; Q400-N414 VanDerWaalsContact NE2-O 3.14Å; N414-H416 PolarHBondContact ND2-CE1 3.14Å; N414-H416 PolarHBondContact O-ND1 3.12Å
415	V	93.8	Very high	93.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.203	C	C	.	.			trans	-67.5	134.4	-176	169	0	0	0	0	111.5	R364 P366 G367 V368 A370 I412 D419 V442	R364-V415 HydrophobicContact CB-CG1 4.32Å; P366-V415 WeakPolarHBondContact CA-O 3.48Å; G367-V415 PolarHBondContact N-O 3.39Å; V368-V415 VanDerWaalsContact O-CB 3.31Å; V368-V415 WeakPolarHBondContact O-CB 3.31Å; V368-V415 WeakPolarHBondContact O-CG2 3.42Å; V368-V415 PolarHBondContact O-N 2.83Å; A370-V415 HydrophobicContact CB-CG2 3.6Å; I412-V415 HydrophobicContact CB-CG2 4.13Å; I412-V415 HydrophobicContact CG2-CB 4.48Å; I412-V415 HydrophobicContact CG2-CG2 3.75Å; V415-D419 HydrophobicContact CG1-CB 4.4Å; V415-V442 HydrophobicContact CG1-CB 4.22Å; V415-V442 HydrophobicContact CG1-CG1 3.78Å; V415-V442 HydrophobicContact CG1-CG2 3.35Å
416	H	93.7	Very high	94.2	Very high	79 Å²	79	37.4 Å²	37.4	37%	0.366	21%	0.205	S	C	.	.			trans	-119.4	164	171.9	-67.7	71.3	0	0	0	110.6	Q400 N414 E418 D419	Q400-H416 PolarHBondContact NE2-ND1 3.13Å; Q400-H416 PolarHBondContact OE1-CE1 2.92Å; Q400-H416 PolarHBondContact OE1-ND1 2.73Å; N414-H416 PolarHBondContact ND2-CE1 3.14Å; N414-H416 PolarHBondContact O-ND1 3.12Å; H416-E418 HydrophobicContact CB-CG 4.01Å; H416-E418 PolarHBondContact O-N 3.43Å; H416-E418 VanDerWaalsContact O-N 3.11Å; H416-D419 PolarHBondContact N-OD2 2.93Å; H416-D419 WeakPolarHBondContact O-CB 3.42Å; H416-D419 PolarHBondContact O-N 3.4Å
417	F	92.2	Very high	94.8	Very high	108 Å²	108	32 Å²	32	47%	0.474	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-56	-31.5	180	-68	-70.9	0	0	0	114.1	P366 D419 T420 V442	P366-F417 HydrophobicContact CG-CD1 4.47Å; P366-F417 HydrophobicContact CG-CD2 4.35Å; P366-F417 HydrophobicContact CG-CE1 3.83Å; P366-F417 HydrophobicContact CG-CE2 3.69Å; P366-F417 HydrophobicContact CG-CZ 3.4Å; P366-F417 VanDerWaalsContact CG-CZ 3.4Å; F417-D419 PolarHBondContact O-N 2.87Å; F417-T420 VanDerWaalsContact O-CB 3.23Å; F417-T420 WeakPolarHBondContact O-CB 3.37Å; F417-T420 PolarHBondContact O-N 2.97Å; F417-T420 PolarHBondContact O-OG1 3.44Å; F417-V442 HydrophobicContact CD1-CB 4.11Å; F417-V442 HydrophobicContact CD1-CG1 3.8Å; F417-V442 WeakPolarHBondContact CD1-O 3.33Å; F417-V442 HydrophobicContact CE1-CG1 4.16Å; F417-V442 HydrophobicContact CG-CG1 4.38Å
418	E	92.4	Very high	95.2	Very high	152 Å²	152	37.3 Å²	37.3	71%	0.71	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-70.8	-5.6	173.9	60.6	173.4	-130.1	0	0	115	K388 H416 T420	K388-E418 WeakPolarHBondContact CE-O 3.41Å; K388-E418 PolarHBondContact NZ-O 3.32Å; H416-E418 HydrophobicContact CB-CG 4.01Å; H416-E418 PolarHBondContact O-N 3.43Å; H416-E418 VanDerWaalsContact O-N 3.11Å; E418-T420 VanDerWaalsContact C-N 3.32Å
419	D	94.1	Very high	95.5	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.021	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-84.1	-4.9	165.9	-70.2	-46.7	0	0	0	113.5	K388 Q400 I412 V415 H416 F417 G421 Y423 L440	K388-D419 IonicContact NZ-OD1 3.28Å; K388-D419 PolarHBondContact NZ-OD1 3.06Å; Q400-D419 PolarHBondContact NE2-OD2 3.39Å; I412-D419 HydrophobicContact CD1-CB 4.08Å; I412-D419 WeakPolarHBondContact CG2-OD2 3.41Å; V415-D419 HydrophobicContact CG1-CB 4.4Å; H416-D419 PolarHBondContact N-OD2 2.93Å; H416-D419 WeakPolarHBondContact O-CB 3.42Å; H416-D419 PolarHBondContact O-N 3.4Å; F417-D419 PolarHBondContact O-N 2.87Å; D419-G421 PolarHBondContact O-N 2.89Å; D419-Y423 WeakPolarHBondContact O-CE2 3.29Å; D419-Y423 PolarHBondContact O-OH 2.83Å; D419-L440 HydrophobicContact CB-CD2 4.07Å; D419-L440 WeakPolarHBondContact O-CD2 3.3Å
420	T	94.4	Very high	95.6	Very high	55 Å²	55	44.1 Å²	44.1	34%	0.337	23%	0.226	S	C	.	.			trans	-60.8	128.6	167.3	-55.2	0	0	0	0	110.7	F417 E418 L440 F441 V442	F417-T420 VanDerWaalsContact O-CB 3.23Å; F417-T420 WeakPolarHBondContact O-CB 3.37Å; F417-T420 PolarHBondContact O-N 2.97Å; F417-T420 PolarHBondContact O-OG1 3.44Å; E418-T420 VanDerWaalsContact C-N 3.32Å; T420-L440 VanDerWaalsContact CA-O 3.31Å; T420-L440 WeakPolarHBondContact CA-O 3.27Å; T420-F441 HydrophobicContact CG2-CD1 4.45Å; T420-V442 WeakPolarHBondContact OG1-CB 3.48Å; T420-V442 PolarHBondContact OG1-N 3.22Å
421	G	94.6	Very high	95.7	Very high	14 Å²	14	45.5 Å²	45.5	14%	0.144	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164	175	177.8	0	0	0	0	0	115.2	N389 D419 L440	N389-G421 WeakPolarHBondContact OD1-CA 3.32Å; D419-G421 PolarHBondContact O-N 2.89Å; G421-L440 PolarHBondContact N-O 2.79Å; G421-L440 PolarHBondContact O-N 2.82Å
422	A	96.4	Very high	95.8	Very high	33 Å²	33	44.9 Å²	44.9	27%	0.273	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	125.2	168.7	0	0	0	0	0	109.6	N389 I437	N389-A422 PolarHBondContact N-O 3.27Å; N389-A422 PolarHBondContact OD1-N 2.89Å; A422-I437 HydrophobicContact CB-CG2 3.81Å
423	Y	98	Very high	95.8	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	96.3	173.9	-70.3	-109	0	0	0	108	L372 W386 L387 K388 I393 L401 V410 I412 D419 S438 L440	L372-Y423 HydrophobicContact CD1-CD1 3.93Å; L372-Y423 HydrophobicContact CD1-CD2 3.64Å; L372-Y423 HydrophobicContact CD1-CE1 4.43Å; L372-Y423 HydrophobicContact CD1-CE2 4.21Å; L372-Y423 HydrophobicContact CD1-CG 3.49Å; L372-Y423 VanDerWaalsContact CD1-CG 3.49Å; W386-Y423 WeakPolarHBondContact CZ3-O 3.48Å; L387-Y423 CarbonylContact O-C 3.52Å; L387-Y423 VanDerWaalsContact O-CA 3.3Å; L387-Y423 WeakPolarHBondContact O-CA 3.08Å; K388-Y423 HydrophobicContact CB-CD1 4.37Å; K388-Y423 HydrophobicContact CB-CE1 4.23Å; K388-Y423 HydrophobicContact CD-CE1 3.91Å; K388-Y423 HydrophobicContact CD-CE2 4.41Å; K388-Y423 WeakPolarHBondContact CD-OH 3.27Å; K388-Y423 WeakPolarHBondContact CE-OH 3.4Å; K388-Y423 HydrophobicContact CG-CD1 4.43Å; K388-Y423 HydrophobicContact CG-CE1 3.97Å; K388-Y423 HydrophobicContact CG-CE2 4.2Å; K388-Y423 PolarHBondContact NZ-OH 3.18Å; I393-Y423 HydrophobicContact CD1-CD1 3.82Å; I393-Y423 HydrophobicContact CD1-CE1 3.92Å; L401-Y423 HydrophobicContact CD1-CE1 4.29Å; V410-Y423 HydrophobicContact CG1-CD1 3.96Å; V410-Y423 HydrophobicContact CG1-CE1 3.89Å; V410-Y423 HydrophobicContact CG2-CD1 4.49Å; I412-Y423 HydrophobicContact CD1-CE1 4.25Å; I412-Y423 WeakPolarHBondContact CD1-OH 3.42Å; D419-Y423 WeakPolarHBondContact O-CE2 3.29Å; D419-Y423 PolarHBondContact O-OH 2.83Å; Y423-S438 WeakPolarHBondContact CA-O 3.33Å; Y423-S438 WeakPolarHBondContact CB-O 3.28Å; Y423-S438 PolarHBondContact N-O 2.9Å; Y423-S438 PolarHBondContact O-N 3.08Å; Y423-L440 HydrophobicContact CD2-CB 4.25Å; Y423-L440 HydrophobicContact CE2-CB 3.95Å; Y423-L440 HydrophobicContact CE2-CD2 4.3Å
424	T	98.2	Very high	96.1	Very high	15 Å²	15	49.2 Å²	49.2	9%	0.092	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	121.1	178.8	-50.8	0	0	0	0	109.2	W386 L387 I426 E435 D436 I437	W386-T424 CarbonylContact C-O 3.54Å; W386-T424 VanDerWaalsContact CA-O 3.27Å; W386-T424 WeakPolarHBondContact CA-O 3.48Å; L387-T424 PolarHBondContact N-O 2.74Å; L387-T424 PolarHBondContact O-N 2.78Å; T424-I426 HydrophobicContact CG2-CG1 3.97Å; T424-E435 HydrophobicContact CG2-CB 3.99Å; T424-E435 HydrophobicContact CG2-CG 4.47Å; T424-D436 CarbonylContact C-O 3.52Å; T424-D436 WeakPolarHBondContact CA-O 3.39Å; T424-I437 HydrophobicContact CG2-CG1 4.09Å
425	C	98.1	Very high	96.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	135.6	163.7	-173.7	0	0	0	0	109.1	V357 C374 W386 E435 D436	V357-C425 HydrophobicContact CG1-CB 4Å; C374-C425 HydrophobicContact CB-CB 3.58Å; C374-C425 WeakPolarHBondContact CB-SG 3.42Å; C374-C425 WeakPolarHBondContact SG-CB 3.43Å; C374-C425 CovalentContact SG-SG 2.03Å; C374-C425 PolarHBondContact SG-SG 2.83Å; W386-C425 HydrophobicContact CD2-CB 4.02Å; W386-C425 HydrophobicContact CE3-CB 3.87Å; W386-C425 HydrophobicContact CH2-CB 3.97Å; W386-C425 HydrophobicContact CZ2-CB 4.1Å; W386-C425 HydrophobicContact CZ3-CB 3.83Å; C425-E435 VanDerWaalsContact O-CA 3.26Å; C425-E435 WeakPolarHBondContact O-CA 3.49Å; C425-D436 PolarHBondContact N-O 3.46Å; C425-D436 PolarHBondContact O-N 3.21Å
426	I	98.3	Very high	96.4	Very high	29 Å²	29	53.9 Å²	53.9	15%	0.149	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122.8	177	-55.9	178	0	0	0	108.1	L384 S385 L387 T424 V433 E435	L384-I426 CarbonylContact C-O 3.54Å; L384-I426 WeakPolarHBondContact CA-O 3.08Å; S385-I426 PolarHBondContact N-O 2.93Å; S385-I426 PolarHBondContact O-N 2.93Å; S385-I426 PolarHBondContact OG-O 2.83Å; L387-I426 HydrophobicContact CD1-CD1 3.73Å; L387-I426 HydrophobicContact CD2-CD1 4.49Å; L387-I426 HydrophobicContact CG-CD1 3.88Å; T424-I426 HydrophobicContact CG2-CG1 3.97Å; I426-V433 HydrophobicContact CG2-CG1 3.6Å; I426-E435 HydrophobicContact CG1-CB 3.94Å
427	A	98	Very high	96.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	135.5	177.4	0	0	0	0	0	109.9	P353 I355 A376 P382 Q383 L384 V433 D434	P353-A427 HydrophobicContact CB-CB 3.81Å; P353-A427 HydrophobicContact CG-CB 4.49Å; I355-A427 HydrophobicContact CD1-CB 3.42Å; I355-A427 VanDerWaalsContact CD1-CB 3.42Å; I355-A427 HydrophobicContact CG1-CB 3.53Å; A376-A427 HydrophobicContact CB-CB 3.64Å; P382-A427 HydrophobicContact CB-CB 4.11Å; P382-A427 HydrophobicContact CG-CB 4.44Å; Q383-A427 WeakPolarHBondContact O-CA 3.39Å; L384-A427 HydrophobicContact CD2-CB 3.49Å; L384-A427 VanDerWaalsContact CD2-CB 3.49Å; A427-V433 VanDerWaalsContact O-CA 3.32Å; A427-V433 WeakPolarHBondContact O-CA 3.11Å; A427-D434 PolarHBondContact N-O 2.8Å; A427-D434 PolarHBondContact O-N 3.23Å
428	K	97.8	Very high	96.7	Very high	127 Å²	127	48.6 Å²	48.6	55%	0.552	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.1	135.5	-176.3	178.5	167.4	-175.1	175.5	0	112.9	P382 Q383 V433	P382-K428 CarbonylContact C-O 3.57Å; P382-K428 WeakPolarHBondContact CA-O 3.5Å; Q383-K428 PolarHBondContact N-O 2.85Å; Q383-K428 PolarHBondContact O-N 2.82Å; K428-V433 HydrophobicContact CB-CG2 4.11Å; K428-V433 HydrophobicContact CD-CG2 3.83Å; K428-V433 HydrophobicContact CG-CG2 3.81Å
429	N	97.2	Very high	96.7	Very high	20 Å²	20	42.9 Å²	42.9	11%	0.107	24%	0.239	C	C	.	.			trans	-132.4	-161.3	161.7	69	13.3	0	0	0	110.3	V351 I379 P380 P382 A431 G432	V351-N429 PolarHBondContact O-ND2 3.19Å; I379-N429 PolarHBondContact N-ND2 3.18Å; I379-N429 PolarHBondContact O-ND2 2.86Å; P380-N429 VanDerWaalsContact O-CB 3.32Å; P380-N429 WeakPolarHBondContact O-CB 3.36Å; P380-N429 PolarHBondContact O-ND2 2.8Å; P382-N429 HydrophobicContact CB-CB 4.45Å; N429-A431 PolarHBondContact OD1-N 2.8Å; N429-G432 PolarHBondContact N-O 2.83Å; N429-G432 PolarHBondContact OD1-N 2.87Å
430	E	96	Very high	96.6	Very high	142 Å²	142	42.7 Å²	42.7	66%	0.664	24%	0.238	S	C	*	.	S	Bend	trans	-82.2	-15.1	178.9	54.8	175.8	-161.7	0	0	114.6	N350 P380	N350-E430 PolarHBondContact ND2-OE1 3.35Å; P380-E430 HydrophobicContact CG-CG 4.12Å
431	A	96.7	Very high	96.4	Very high	29 Å²	29	44.9 Å²	44.9	24%	0.24	24%	0.243	C	C	.	.	S	Bend	trans	-90.2	-22.7	173.6	0	0	0	0	0	113.7	T273 N350 P352 N429	T273-A431 HydrophobicContact CG2-CB 4.2Å; N350-A431 HydrophobicContact CB-CB 3.83Å; P352-A431 HydrophobicContact CB-CB 4.29Å; N429-A431 PolarHBondContact OD1-N 2.8Å
432	G	97.3	Very high	96.2	Very high	22 Å²	22	44.8 Å²	44.8	23%	0.227	24%	0.24	C	C	.	.			trans	179.7	-172.6	179.2	0	0	0	0	0	116.1	P353 N429	P353-G432 VanDerWaalsContact CD-C 3.45Å; P353-G432 WeakPolarHBondContact CD-O 3.33Å; P353-G432 WeakPolarHBondContact CG-O 3.48Å; N429-G432 PolarHBondContact N-O 2.83Å; N429-G432 PolarHBondContact OD1-N 2.87Å
433	V	98.2	Very high	95.5	Very high	85 Å²	85	46.3 Å²	46.3	52%	0.515	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	142.4	172.1	-179.1	0	0	0	0	107	I426 A427 K428	I426-V433 HydrophobicContact CG2-CG1 3.6Å; A427-V433 VanDerWaalsContact O-CA 3.32Å; A427-V433 WeakPolarHBondContact O-CA 3.11Å; K428-V433 HydrophobicContact CB-CG2 4.11Å; K428-V433 HydrophobicContact CD-CG2 3.83Å; K428-V433 HydrophobicContact CG-CG2 3.81Å
434	D	98.4	Very high	94.4	Very high	54 Å²	54	50.9 Å²	50.9	29%	0.289	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	158.7	167.7	-170	25.9	0	0	0	108.6	P353 V354 I355 A427	P353-D434 HydrophobicContact CB-CB 4.07Å; P353-D434 WeakPolarHBondContact O-CB 3.43Å; V354-D434 WeakPolarHBondContact CA-OD2 3.35Å; I355-D434 VanDerWaalsContact CD1-C 3.43Å; I355-D434 HydrophobicContact CD1-CB 4Å; I355-D434 WeakPolarHBondContact CD1-O 3.11Å; I355-D434 HydrophobicContact CG1-CB 4.01Å; I355-D434 PolarHBondContact N-OD2 2.79Å; A427-D434 PolarHBondContact N-O 2.8Å; A427-D434 PolarHBondContact O-N 3.23Å
435	E	97.9	Very high	92.8	Very high	116 Å²	116	53.8 Å²	53.8	54%	0.542	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	143.5	176	68	175.3	-162.6	0	0	113	T424 C425 I426	T424-E435 HydrophobicContact CG2-CB 3.99Å; T424-E435 HydrophobicContact CG2-CG 4.47Å; C425-E435 VanDerWaalsContact O-CA 3.26Å; C425-E435 WeakPolarHBondContact O-CA 3.49Å; I426-E435 HydrophobicContact CG1-CB 3.94Å
436	D	97.6	Very high	90.8	Very high	47 Å²	47	57.9 Å²	57.9	25%	0.251	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	153.1	-176.7	-168.6	8.5	0	0	0	110.2	I355 R356 V357 T424 C425	I355-D436 HydrophobicContact CB-CB 4.07Å; I355-D436 HydrophobicContact CG2-CB 3.52Å; R356-D436 WeakPolarHBondContact CA-OD2 3.21Å; V357-D436 HydrophobicContact CG1-CB 4.03Å; V357-D436 PolarHBondContact N-OD2 2.88Å; T424-D436 CarbonylContact C-O 3.52Å; T424-D436 WeakPolarHBondContact CA-O 3.39Å; C425-D436 PolarHBondContact N-O 3.46Å; C425-D436 PolarHBondContact O-N 3.21Å
437	I	97	Very high	88.8	Confident	76 Å²	76	64.3 Å²	64.3	39%	0.39	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	115.3	-161.9	-54.7	-178.8	0	0	0	112.1	A422 T424	A422-I437 HydrophobicContact CB-CG2 3.81Å; T424-I437 HydrophobicContact CG2-CG1 4.09Å
438	S	94.6	Very high	86.5	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	127	167.9	-175.9	0	0	0	0	110	P359 Y423	P359-S438 WeakPolarHBondContact O-CB 3.46Å; P359-S438 PolarHBondContact O-OG 3.32Å; Y423-S438 WeakPolarHBondContact CA-O 3.33Å; Y423-S438 WeakPolarHBondContact CB-O 3.28Å; Y423-S438 PolarHBondContact N-O 2.9Å; Y423-S438 PolarHBondContact O-N 3.08Å
439	S	91.9	Very high	84.4	Confident	32 Å²	32	66.7 Å²	66.7	22%	0.224	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.9	-177.8	-59.1	0	0	0	0	111.7	D360 S361 Q362	D360-S439 PolarHBondContact O-N 3Å; S361-S439 CarbonylContact C-O 3.51Å; S361-S439 WeakPolarHBondContact CA-O 3.46Å; Q362-S439 PolarHBondContact N-O 3.08Å
440	L	92.1	Very high	82.1	Confident	1 Å²	1	72 Å²	72	1%	0.005	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	127.6	173.3	-179.4	57.4	0	0	0	110.3	Q362 R364 A370 L372 I412 D419 T420 G421 Y423 V442	Q362-L440 HydrophobicContact CB-CD1 4.34Å; R364-L440 HydrophobicContact CB-CD1 4.37Å; R364-L440 HydrophobicContact CG-CD1 4.07Å; A370-L440 HydrophobicContact CB-CD1 4.11Å; A370-L440 HydrophobicContact CB-CD2 4.05Å; L372-L440 HydrophobicContact CD1-CB 4.4Å; I412-L440 HydrophobicContact CD1-CD2 3.61Å; D419-L440 HydrophobicContact CB-CD2 4.07Å; D419-L440 WeakPolarHBondContact O-CD2 3.3Å; T420-L440 VanDerWaalsContact CA-O 3.31Å; T420-L440 WeakPolarHBondContact CA-O 3.27Å; G421-L440 PolarHBondContact N-O 2.79Å; G421-L440 PolarHBondContact O-N 2.82Å; Y423-L440 HydrophobicContact CD2-CB 4.25Å; Y423-L440 HydrophobicContact CE2-CB 3.95Å; Y423-L440 HydrophobicContact CE2-CD2 4.3Å; L440-V442 HydrophobicContact CG-CG2 4.39Å
441	F	90.3	Very high	79.7	Confident	100 Å²	100	66.6 Å²	66.6	44%	0.439	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	134.8	174.7	-62.2	-83	0	0	0	110.1	S361 Q362 A363 R364 T420	S361-F441 WeakPolarHBondContact OG-CE2 3.38Å; Q362-F441 PolarHBondContact O-N 3.28Å; A363-F441 CarbonylContact C-O 3.58Å; A363-F441 WeakPolarHBondContact CA-O 3.19Å; R364-F441 PolarHBondContact N-O 3.04Å; T420-F441 HydrophobicContact CG2-CD1 4.45Å
442	V	89.8	Confident	77.3	Confident	12 Å²	12	69 Å²	69	7%	0.073	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	115.5	-178.9	-171.3	0	0	0	0	109.7	R364 P366 V415 F417 T420 L440	R364-V442 VanDerWaalsContact O-CA 3.32Å; R364-V442 WeakPolarHBondContact O-CA 3.37Å; P366-V442 HydrophobicContact CG-CG1 3.98Å; V415-V442 HydrophobicContact CG1-CB 4.22Å; V415-V442 HydrophobicContact CG1-CG1 3.78Å; V415-V442 HydrophobicContact CG1-CG2 3.35Å; F417-V442 HydrophobicContact CD1-CB 4.11Å; F417-V442 HydrophobicContact CD1-CG1 3.8Å; F417-V442 WeakPolarHBondContact CD1-O 3.33Å; F417-V442 HydrophobicContact CE1-CG1 4.16Å; F417-V442 HydrophobicContact CG-CG1 4.38Å; T420-V442 WeakPolarHBondContact OG1-CB 3.48Å; T420-V442 PolarHBondContact OG1-N 3.22Å; L440-V442 HydrophobicContact CG-CG2 4.39Å
443	E	83	Confident	74.9	Confident	65 Å²	65	72 Å²	72	30%	0.304	39%	0.388	S	S	.	.			trans	-132.7	148.2	-174.6	-68.3	-147.2	120.7	0	0	113	R364 R447	R364-E443 PolarHBondContact O-N 2.82Å; E443-R447 WeakPolarHBondContact OE1-CD 3.45Å; E443-R447 IonicContact OE1-CZ 3.65Å; E443-R447 IonicContact OE1-NE 3.79Å; E443-R447 IonicContact OE1-NH1 2.71Å; E443-R447 PolarHBondContact OE1-NH1 2.7Å
444	D	74.9	Confident	72.2	Confident	96 Å²	96	71.9 Å²	71.9	51%	0.513	38%	0.383	S	S	.	.			trans	-72.4	145	171.4	-78.4	-46.5	0	0	0	112.6	A446 R447	D444-A446 PolarHBondContact O-N 3.14Å; D444-R447 PolarHBondContact O-N 2.68Å
445	S	63.9	Low	69.8	Low	77 Å²	77	74.3 Å²	74.3	54%	0.538	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-20.1	-178.6	61.9	0	0	0	0	114.8	E365 R447 K448	E365-S445 VanDerWaalsContact OE1-CB 3.29Å; E365-S445 WeakPolarHBondContact OE1-CB 3.4Å; S445-R447 VanDerWaalsContact C-N 3.35Å; S445-R447 PolarHBondContact O-N 3.29Å; S445-K448 WeakPolarHBondContact O-CB 3.49Å; S445-K448 PolarHBondContact O-N 2.96Å
446	A	56.5	Low	67.1	Low	85 Å²	85	79.4 Å²	79.4	70%	0.702	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-27.8	176.1	0	0	0	0	0	114.2	D444	D444-A446 PolarHBondContact O-N 3.14Å
447	R	56.1	Low	64.3	Low	165 Å²	165	84.4 Å²	84.4	62%	0.623	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-25.2	172.7	-73.1	-175.9	174.7	-175.6	0.1	112.7	E443 D444 S445 T449 L450 A451	E443-R447 WeakPolarHBondContact OE1-CD 3.45Å; E443-R447 IonicContact OE1-CZ 3.65Å; E443-R447 IonicContact OE1-NE 3.79Å; E443-R447 IonicContact OE1-NH1 2.71Å; E443-R447 PolarHBondContact OE1-NH1 2.7Å; D444-R447 PolarHBondContact O-N 2.68Å; S445-R447 VanDerWaalsContact C-N 3.35Å; S445-R447 PolarHBondContact O-N 3.29Å; R447-T449 PolarHBondContact O-N 2.77Å; R447-L450 PolarHBondContact O-N 3.03Å; R447-A451 PolarHBondContact O-N 2.98Å
448	K	49.1	Very low	61.6	Low	78 Å²	78	86.9 Å²	86.9	34%	0.339	43%	0.434	S	S	.	.	H	α-helix	trans	-58.4	-22.4	-174.7	-129.4	-174.7	-165.1	-178.6	0	113.8	E365 S445 L450 A451 N452	E365-K448 WeakPolarHBondContact OE1-CD 3.37Å; E365-K448 WeakPolarHBondContact OE1-CE 3.49Å; E365-K448 IonicContact OE1-NZ 2.77Å; E365-K448 PolarHBondContact OE1-NZ 3.42Å; E365-K448 IonicContact OE2-NZ 2.77Å; E365-K448 PolarHBondContact OE2-NZ 3.2Å; S445-K448 WeakPolarHBondContact O-CB 3.49Å; S445-K448 PolarHBondContact O-N 2.96Å; K448-L450 PolarHBondContact O-N 2.89Å; K448-A451 PolarHBondContact O-N 3.02Å; K448-N452 WeakPolarHBondContact O-CB 3.43Å; K448-N452 PolarHBondContact O-N 3.37Å; K448-N452 PolarHBondContact O-ND2 3.14Å
449	T	53.4	Low	59.1	Low	99 Å²	99	88.2 Å²	88.2	61%	0.607	45%	0.449	S	S	*	.	H	α-helix	trans	-63	-39.7	175.4	-45.5	0	0	0	0	112.4	R447 I453	R447-T449 PolarHBondContact O-N 2.77Å; T449-I453 WeakPolarHBondContact O-CD1 3.46Å; T449-I453 VanDerWaalsContact O-CG1 3.31Å; T449-I453 WeakPolarHBondContact O-CG1 3.44Å
450	L	49.9	Very low	56.8	Low	132 Å²	132	91.9 Å²	91.9	69%	0.691	47%	0.465	S	S	*	.	H	α-helix	trans	-76.8	-44.2	175	-78.7	162.7	0	0	0	111	R447 K448 N452 I453 L454	R447-L450 PolarHBondContact O-N 3.03Å; K448-L450 PolarHBondContact O-N 2.89Å; L450-N452 PolarHBondContact O-N 2.58Å; L450-I453 PolarHBondContact O-N 3.06Å; L450-L454 PolarHBondContact O-N 2.93Å; L450-L454 VanDerWaalsContact O-N 3.15Å
451	A	44.9	Very low	54.8	Low	27 Å²	27	94.7 Å²	94.7	22%	0.223	49%	0.494	C	S	.	.	H	α-helix	trans	-60.5	-46	178.4	0	0	0	0	0	112	R447 K448 I453 L454 W455	R447-A451 PolarHBondContact O-N 2.98Å; K448-A451 PolarHBondContact O-N 3.02Å; A451-I453 PolarHBondContact O-N 2.93Å; A451-L454 CarbonylContact O-C 3.59Å; A451-L454 WeakPolarHBondContact O-CA 3.39Å; A451-L454 PolarHBondContact O-N 2.88Å; A451-W455 PolarHBondContact O-N 3.04Å
452	N	46.5	Very low	53.1	Low	80 Å²	80	91.6 Å²	91.6	43%	0.428	48%	0.482	S	S	.	.	H	α-helix	trans	-69	-17.2	-178.8	-68.7	-15.6	0	0	0	114	K448 L450	K448-N452 WeakPolarHBondContact O-CB 3.43Å; K448-N452 PolarHBondContact O-N 3.37Å; K448-N452 PolarHBondContact O-ND2 3.14Å; L450-N452 PolarHBondContact O-N 2.58Å
453	I	46.9	Very low	51.8	Low	86 Å²	86	92.7 Å²	92.7	44%	0.441	50%	0.496	S	S	.	.	H	α-helix	trans	-75.6	-49.6	167.1	-68.8	168.2	0	0	0	108.6	T449 L450 A451 W455 R456 E457	T449-I453 WeakPolarHBondContact O-CD1 3.46Å; T449-I453 VanDerWaalsContact O-CG1 3.31Å; T449-I453 WeakPolarHBondContact O-CG1 3.44Å; L450-I453 PolarHBondContact O-N 3.06Å; A451-I453 PolarHBondContact O-N 2.93Å; I453-W455 PolarHBondContact O-N 2.98Å; I453-R456 WeakPolarHBondContact O-CA 3.2Å; I453-R456 WeakPolarHBondContact O-CB 3.37Å; I453-R456 PolarHBondContact O-N 2.57Å; I453-E457 HydrophobicContact CG2-CG 4.45Å; I453-E457 PolarHBondContact O-N 3.08Å
454	L	42.2	Very low	51.7	Low	81 Å²	81	91.7 Å²	91.7	42%	0.424	49%	0.493	S	S	.	.	H	α-helix	trans	-61.3	-42	176.4	-68.9	165.8	0	0	0	113.4	L450 A451 R456 E457 E458	L450-L454 PolarHBondContact O-N 2.93Å; L450-L454 VanDerWaalsContact O-N 3.15Å; A451-L454 CarbonylContact O-C 3.59Å; A451-L454 WeakPolarHBondContact O-CA 3.39Å; A451-L454 PolarHBondContact O-N 2.88Å; L454-R456 PolarHBondContact O-N 3.27Å; L454-E457 PolarHBondContact O-N 2.79Å; L454-E458 WeakPolarHBondContact O-CB 3.49Å; L454-E458 WeakPolarHBondContact O-CG 3.33Å; L454-E458 PolarHBondContact O-N 2.64Å
455	W	46.4	Very low	52.4	Low	105 Å²	105	87.5 Å²	87.5	40%	0.398	47%	0.47	S	S	.	.	H	α-helix	trans	-57.9	-22.6	173.7	-70.5	112.5	0	0	0	113.1	A363 A451 I453 L460	A363-W455 HydrophobicContact CB-CZ2 4.47Å; A451-W455 PolarHBondContact O-N 3.04Å; I453-W455 PolarHBondContact O-N 2.98Å; W455-L460 HydrophobicContact CE3-CB 3.57Å; W455-L460 HydrophobicContact CE3-CD1 4.05Å; W455-L460 HydrophobicContact CE3-CG 4.44Å; W455-L460 HydrophobicContact CZ3-CB 3.76Å; W455-L460 HydrophobicContact CZ3-CD1 3.94Å; W455-L460 HydrophobicContact CZ3-CG 4.36Å
456	R	42.6	Very low	53.9	Low	224 Å²	224	83.9 Å²	83.9	85%	0.845	44%	0.444	S	S	*	.	H	α-helix	trans	-91.6	-28.2	173	-82.4	-178.5	163.9	177.4	-3.6	113.8	I453 L454	I453-R456 WeakPolarHBondContact O-CA 3.2Å; I453-R456 WeakPolarHBondContact O-CB 3.37Å; I453-R456 PolarHBondContact O-N 2.57Å; L454-R456 PolarHBondContact O-N 3.27Å
457	E	38.2	Very low	55.7	Low	151 Å²	151	79.8 Å²	79.8	71%	0.706	41%	0.411	S	S	*	.	H	α-helix	trans	-90	-27	-178.7	-68.4	-178.3	159.1	0	0	113.1	I453 L454	I453-E457 HydrophobicContact CG2-CG 4.45Å; I453-E457 PolarHBondContact O-N 3.08Å; L454-E457 PolarHBondContact O-N 2.79Å
458	E	39.9	Very low	57.6	Low	128 Å²	128	72 Å²	72	60%	0.598	38%	0.381	S	S	*	.	S	Bend	trans	-93.2	-3.1	179.5	-61.9	-174.1	148.2	0	0	113.7	L454 L460	L454-E458 WeakPolarHBondContact O-CB 3.49Å; L454-E458 WeakPolarHBondContact O-CG 3.33Å; L454-E458 PolarHBondContact O-N 2.64Å; E458-L460 HydrophobicContact CB-CD1 4.3Å; E458-L460 PolarHBondContact O-N 2.74Å
459	G	42.5	Very low	59.8	Low	29 Å²	29	68.2 Å²	68.2	30%	0.299	37%	0.365	S	S	.	.			trans	73.9	3.1	173.8	0	0	0	0	0	116.2	G461 I462	G459-G461 PolarHBondContact O-N 2.81Å; G459-G461 VanDerWaalsContact O-N 3.09Å; G459-I462 VanDerWaalsContact O-CB 3.3Å; G459-I462 WeakPolarHBondContact O-CB 3.16Å; G459-I462 VanDerWaalsContact O-CG1 3.28Å; G459-I462 WeakPolarHBondContact O-CG1 3.03Å; G459-I462 PolarHBondContact O-N 2.81Å; G459-I462 VanDerWaalsContact O-N 3.13Å
460	L	43.4	Very low	61.6	Low	109 Å²	109	63.9 Å²	63.9	57%	0.571	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-18	-177.8	-77.9	161.6	0	0	0	114.7	W455 E458 I462	W455-L460 HydrophobicContact CE3-CB 3.57Å; W455-L460 HydrophobicContact CE3-CD1 4.05Å; W455-L460 HydrophobicContact CE3-CG 4.44Å; W455-L460 HydrophobicContact CZ3-CB 3.76Å; W455-L460 HydrophobicContact CZ3-CD1 3.94Å; W455-L460 HydrophobicContact CZ3-CG 4.36Å; E458-L460 HydrophobicContact CB-CD1 4.3Å; E458-L460 PolarHBondContact O-N 2.74Å; L460-I462 VanDerWaalsContact C-N 3.33Å; L460-I462 PolarHBondContact O-N 2.65Å
461	G	49.9	Very low	63.5	Low	60 Å²	60	59.8 Å²	59.8	62%	0.619	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	9.3	174.6	0	0	0	0	0	116	G459	G459-G461 PolarHBondContact O-N 2.81Å; G459-G461 VanDerWaalsContact O-N 3.09Å
462	I	55.8	Low	65.7	Low	34 Å²	34	61.9 Å²	61.9	17%	0.174	32%	0.323	C	S	.	.	S	Bend	trans	-99.4	-22.3	-170.3	-61.9	176	0	0	0	113.2	G459 L460 M465 I541 Q542	G459-I462 VanDerWaalsContact O-CB 3.3Å; G459-I462 WeakPolarHBondContact O-CB 3.16Å; G459-I462 VanDerWaalsContact O-CG1 3.28Å; G459-I462 WeakPolarHBondContact O-CG1 3.03Å; G459-I462 PolarHBondContact O-N 2.81Å; G459-I462 VanDerWaalsContact O-N 3.13Å; L460-I462 VanDerWaalsContact C-N 3.33Å; L460-I462 PolarHBondContact O-N 2.65Å; I462-M465 WeakPolarHBondContact O-CG 3.41Å; I462-I541 HydrophobicContact CG2-CG2 3.83Å; I462-I541 VanDerWaalsContact CG2-O 3.27Å; I462-I541 WeakPolarHBondContact CG2-O 3.37Å; I462-Q542 VanDerWaalsContact CD1-O 3.28Å; I462-Q542 WeakPolarHBondContact CD1-O 3.42Å
463	G	61.2	Low	68	Low	36 Å²	36	58.1 Å²	58.1	37%	0.371	30%	0.302	S	S	.	.	S	Bend	trans	-73.7	160.6	170.7	0	0	0	0	0	112.4
464	N	81	Confident	70.3	Confident	44 Å²	44	54 Å²	54	24%	0.235	28%	0.281	C	S	.	.	S	Bend	trans	72.1	49.3	178.8	-56.2	-74.8	0	0	0	114.9	Y358 W855 V856	Y358-N464 PolarHBondContact OH-ND2 2.96Å; N464-W855 VanDerWaalsContact C-CZ3 3.49Å; N464-W855 HydrophobicContact CB-CH2 3.72Å; N464-W855 HydrophobicContact CB-CZ2 3.76Å; N464-W855 WeakPolarHBondContact O-CH2 3.26Å; N464-W855 WeakPolarHBondContact OD1-CZ2 3.16Å; N464-V856 CarbonylContact C-O 3.55Å; N464-V856 WeakPolarHBondContact CA-O 3.42Å; N464-V856 PolarHBondContact N-O 2.89Å
465	M	90.8	Very high	72.7	Confident	8 Å²	8	51 Å²	51	4%	0.039	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	144.1	-174.1	-63.7	-65.2	-67.9	0	0	111.8	I462 Y467 V476 I477 Q478 Q485 V856	I462-M465 WeakPolarHBondContact O-CG 3.41Å; M465-Y467 HydrophobicContact CB-CE2 4.19Å; M465-V476 HydrophobicContact CB-CG1 4.17Å; M465-V476 HydrophobicContact CE-CG1 3.77Å; M465-I477 VanDerWaalsContact CE-C 3.4Å; M465-I477 WeakPolarHBondContact CE-O 3.43Å; M465-Q478 HydrophobicContact CE-CB 3.82Å; M465-Q478 HydrophobicContact SD-CB 3.78Å; M465-Q478 HydrophobicContact SD-CG 3.96Å; M465-Q485 HydrophobicContact CE-CB 3.82Å; M465-Q485 HydrophobicContact CE-CG 3.7Å; M465-V856 PolarHBondContact N-O 3.4Å; M465-V856 PolarHBondContact O-N 3.09Å
466	F	93.9	Very high	75	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	132.8	168.5	-72.8	-80	0	0	0	110.9	I477 P479 V813 M823 V853 V854 W855	F466-I477 HydrophobicContact CB-CB 4.27Å; F466-I477 PolarHBondContact N-O 3.23Å; F466-I477 PolarHBondContact O-N 2.79Å; F466-P479 HydrophobicContact CD2-CB 4Å; F466-P479 HydrophobicContact CD2-CG 4.2Å; F466-P479 HydrophobicContact CE2-CB 3.93Å; F466-P479 HydrophobicContact CE2-CG 4.21Å; F466-V813 HydrophobicContact CE1-CB 4.35Å; F466-V813 HydrophobicContact CE1-CG1 4.12Å; F466-V813 WeakPolarHBondContact CE1-O 3.38Å; F466-M823 HydrophobicContact CB-SD 3.43Å; F466-M823 WeakPolarHBondContact CB-SD 3.48Å; F466-M823 HydrophobicContact CD1-CB 3.84Å; F466-M823 HydrophobicContact CD1-CG 4.47Å; F466-M823 HydrophobicContact CD1-SD 3.77Å; F466-M823 HydrophobicContact CD2-CB 4.32Å; F466-M823 HydrophobicContact CD2-SD 4Å; F466-M823 HydrophobicContact CE1-CB 3.64Å; F466-M823 HydrophobicContact CE2-CB 4.15Å; F466-M823 HydrophobicContact CG-CB 4.18Å; F466-M823 HydrophobicContact CG-SD 3.47Å; F466-M823 WeakPolarHBondContact CG-SD 3.38Å; F466-M823 HydrophobicContact CZ-CB 3.81Å; F466-V853 HydrophobicContact CD1-CG1 3.98Å; F466-V854 WeakPolarHBondContact CA-O 3.45Å; F466-W855 HydrophobicContact CD1-CB 4.36Å; F466-W855 AromaticContact CD1-CE3 3.78Å; F466-W855 HydrophobicContact CD1-CE3 3.78Å; F466-W855 AromaticContact CD2-CE3 3.79Å; F466-W855 HydrophobicContact CD2-CE3 3.79Å; F466-W855 AromaticContact CD2-CZ3 3.72Å; F466-W855 HydrophobicContact CD2-CZ3 3.72Å; F466-W855 HydrophobicContact CE1-CB 4.2Å; F466-W855 HydrophobicContact CE1-CD2 4.45Å; F466-W855 AromaticContact CE1-CE3 3.71Å; F466-W855 HydrophobicContact CE1-CE3 3.71Å; F466-W855 HydrophobicContact CE1-CZ3 4.46Å; F466-W855 AromaticContact CE2-CE3 3.73Å; F466-W855 HydrophobicContact CE2-CE3 3.73Å; F466-W855 AromaticContact CE2-CZ3 3.63Å; F466-W855 HydrophobicContact CE2-CZ3 3.63Å; F466-W855 AromaticContact CG-CE3 3.81Å; F466-W855 HydrophobicContact CG-CE3 3.81Å; F466-W855 HydrophobicContact CG-CZ3 4.19Å; F466-W855 AromaticContact CZ-CE3 3.69Å; F466-W855 HydrophobicContact CZ-CE3 3.69Å; F466-W855 HydrophobicContact CZ-CZ3 4.02Å
467	Y	95.4	Very high	77.3	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	127.9	172.2	-75.7	-108.2	0	0	0	109.4	M465 I474 V476 I526 V853 V854 V856	M465-Y467 HydrophobicContact CB-CE2 4.19Å; Y467-I474 HydrophobicContact CD1-CG2 4.38Å; Y467-V476 HydrophobicContact CD1-CB 4.48Å; Y467-V476 HydrophobicContact CD1-CG1 4.15Å; Y467-V476 HydrophobicContact CD1-CG2 3.75Å; Y467-V476 HydrophobicContact CD2-CG1 4.09Å; Y467-V476 HydrophobicContact CE1-CB 4.33Å; Y467-V476 HydrophobicContact CE1-CG1 3.82Å; Y467-V476 HydrophobicContact CE1-CG2 3.54Å; Y467-V476 HydrophobicContact CE2-CG1 3.74Å; Y467-V476 HydrophobicContact CG-CG1 4.28Å; Y467-I526 HydrophobicContact CD1-CD1 3.38Å; Y467-I526 HydrophobicContact CD2-CD1 3.54Å; Y467-I526 HydrophobicContact CE1-CD1 3.83Å; Y467-I526 HydrophobicContact CE2-CD1 3.99Å; Y467-I526 HydrophobicContact CG-CD1 3.21Å; Y467-V853 CarbonylContact O-C 3.58Å; Y467-V853 WeakPolarHBondContact O-CA 3.22Å; Y467-V854 PolarHBondContact N-O 3.03Å; Y467-V854 PolarHBondContact O-N 2.69Å; Y467-V856 HydrophobicContact CD2-CB 4.07Å; Y467-V856 HydrophobicContact CD2-CG2 3.72Å; Y467-V856 HydrophobicContact CE2-CB 3.87Å; Y467-V856 HydrophobicContact CE2-CG1 4.28Å; Y467-V856 HydrophobicContact CE2-CG2 3.77Å
468	V	96	Very high	79.7	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	124	-173.7	-175.2	0	0	0	0	109.7	I474 K475 I477 M823 L830 V847 V853	V468-I474 CarbonylContact O-C 3.54Å; V468-I474 WeakPolarHBondContact O-CA 3.38Å; V468-K475 PolarHBondContact N-O 3.02Å; V468-K475 PolarHBondContact O-N 2.85Å; V468-I477 HydrophobicContact CG2-CG1 3.98Å; V468-M823 HydrophobicContact CG2-CE 3.54Å; V468-M823 HydrophobicContact CG2-SD 3.93Å; V468-L830 HydrophobicContact CB-CD1 4.44Å; V468-L830 HydrophobicContact CG1-CD1 4.13Å; V468-L830 HydrophobicContact CG1-CD2 3.98Å; V468-L830 HydrophobicContact CG2-CD1 4.06Å; V468-V847 HydrophobicContact CG1-CG1 4.19Å; V468-V853 HydrophobicContact CG1-CG2 4.34Å; V468-V853 HydrophobicContact CG2-CG2 4.33Å
469	F	94.6	Very high	82.1	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	122.6	-175.7	-54.6	-101.3	0	0	0	108.7	I474 W515 A518 I526 V528 V852 V854	F469-I474 HydrophobicContact CD1-CB 4.31Å; F469-I474 HydrophobicContact CD1-CD1 3.95Å; F469-I474 HydrophobicContact CD1-CG1 3.73Å; F469-I474 HydrophobicContact CD1-CG2 3.77Å; F469-I474 HydrophobicContact CE1-CB 4.45Å; F469-I474 HydrophobicContact CE1-CD1 3.74Å; F469-I474 HydrophobicContact CE1-CG1 3.98Å; F469-I474 HydrophobicContact CE1-CG2 3.63Å; F469-I474 HydrophobicContact CG-CG2 4.29Å; F469-I474 HydrophobicContact CZ-CG2 4.05Å; F469-W515 VanDerWaalsContact C-CD1 3.41Å; F469-W515 HydrophobicContact CB-CB 4.18Å; F469-W515 HydrophobicContact CB-CD2 3.92Å; F469-W515 HydrophobicContact CB-CG 3.68Å; F469-W515 HydrophobicContact CD1-CD2 4.31Å; F469-W515 HydrophobicContact CD1-CE3 4.38Å; F469-W515 HydrophobicContact CD1-CH2 4.43Å; F469-W515 HydrophobicContact CD1-CZ2 4.38Å; F469-W515 HydrophobicContact CD1-CZ3 4.43Å; F469-A518 HydrophobicContact CD2-CB 4.29Å; F469-A518 HydrophobicContact CE2-CB 3.99Å; F469-A518 HydrophobicContact CZ-CB 4.43Å; F469-I526 HydrophobicContact CE2-CG2 4.3Å; F469-I526 HydrophobicContact CZ-CB 4.47Å; F469-I526 HydrophobicContact CZ-CD1 4.29Å; F469-I526 HydrophobicContact CZ-CG2 3.79Å; F469-V528 HydrophobicContact CD1-CB 4.07Å; F469-V528 HydrophobicContact CD1-CG1 3.94Å; F469-V528 HydrophobicContact CD1-CG2 3.72Å; F469-V528 HydrophobicContact CE1-CB 3.82Å; F469-V528 HydrophobicContact CE1-CG1 3.6Å; F469-V528 HydrophobicContact CE1-CG2 4Å; F469-V528 HydrophobicContact CG-CG2 4.06Å; F469-V528 HydrophobicContact CZ-CB 4.27Å; F469-V528 HydrophobicContact CZ-CG1 4.41Å; F469-V852 HydrophobicContact CB-CB 4.11Å; F469-V852 HydrophobicContact CB-CG1 4.19Å; F469-V852 HydrophobicContact CD2-CG1 3.9Å; F469-V852 HydrophobicContact CG-CG1 4.3Å; F469-V852 PolarHBondContact N-O 2.98Å; F469-V854 HydrophobicContact CE2-CB 4.48Å; F469-V854 HydrophobicContact CE2-CG2 4.25Å
470	Y	91.8	Very high	84.2	Confident	7 Å²	7	28.6 Å²	28.6	3%	0.027	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	177.2	-168.5	73.8	-73.5	0	0	0	111.5	D472 G473 K475 H487 C513 W515 V847	Y470-D472 HydrophobicContact CD2-CB 4.22Å; Y470-D472 HydrophobicContact CE2-CB 3.51Å; Y470-D472 WeakPolarHBondContact CE2-OD2 3.25Å; Y470-D472 PolarHBondContact O-N 3.35Å; Y470-D472 VanDerWaalsContact O-N 3.09Å; Y470-D472 PolarHBondContact OH-O 2.69Å; Y470-D472 PolarHBondContact OH-OD2 2.87Å; Y470-G473 VanDerWaalsContact CD1-O 3.23Å; Y470-G473 WeakPolarHBondContact CD1-O 3.42Å; Y470-G473 PolarHBondContact N-O 2.88Å; Y470-G473 PolarHBondContact O-N 2.86Å; Y470-G473 VanDerWaalsContact O-O 3.14Å; Y470-K475 HydrophobicContact CE1-CB 3.94Å; Y470-K475 HydrophobicContact CE1-CD 3.76Å; Y470-K475 HydrophobicContact CE1-CG 3.6Å; Y470-K475 HydrophobicContact CE2-CD 4.5Å; Y470-K475 WeakPolarHBondContact OH-CE 3.14Å; Y470-H487 PolarHBondContact OH-CD2 3.03Å; Y470-H487 PolarHBondContact OH-NE2 2.92Å; Y470-C513 WeakPolarHBondContact O-CB 3.35Å; Y470-W515 VanDerWaalsContact N-CD1 3.28Å; Y470-W515 VanDerWaalsContact N-NE1 3.19Å; Y470-W515 PolarHBondContact O-NE1 3.46Å; Y470-V847 HydrophobicContact CD1-CG1 4.05Å; Y470-V847 HydrophobicContact CD2-CG1 3.86Å; Y470-V847 HydrophobicContact CE2-CG1 4.41Å; Y470-V847 HydrophobicContact CG-CG1 3.68Å
471	E	90.4	Very high	86.1	Confident	47 Å²	47	25.5 Å²	25.5	22%	0.22	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-23.4	-170.5	-72.2	-170.4	161.5	0	0	115	R512 C513 K849	E471-R512 WeakPolarHBondContact O-CA 3.43Å; E471-C513 PolarHBondContact O-N 3.03Å; E471-K849 VanDerWaalsContact CD-CD 3.45Å; E471-K849 HydrophobicContact CG-CB 4.39Å; E471-K849 HydrophobicContact CG-CD 3.98Å; E471-K849 WeakPolarHBondContact OE1-CD 3.4Å; E471-K849 WeakPolarHBondContact OE1-CE 3.38Å; E471-K849 IonicContact OE1-NZ 3.16Å; E471-K849 PolarHBondContact OE1-NZ 2.68Å
472	D	91	Very high	87.9	Confident	71 Å²	71	24.1 Å²	24.1	38%	0.38	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	35.5	175.5	156.5	71.5	0	0	0	111.6	Y470 H487 P490	Y470-D472 HydrophobicContact CD2-CB 4.22Å; Y470-D472 HydrophobicContact CE2-CB 3.51Å; Y470-D472 WeakPolarHBondContact CE2-OD2 3.25Å; Y470-D472 PolarHBondContact O-N 3.35Å; Y470-D472 VanDerWaalsContact O-N 3.09Å; Y470-D472 PolarHBondContact OH-O 2.69Å; Y470-D472 PolarHBondContact OH-OD2 2.87Å; D472-H487 PolarHBondContact O-NE2 2.87Å; D472-H487 IonicContact OD1-CE1 3.47Å; D472-H487 IonicContact OD1-NE2 3.09Å; D472-H487 IonicContact OD2-CE1 3.38Å; D472-H487 PolarHBondContact OD2-CE1 2.83Å; D472-H487 IonicContact OD2-NE2 3.2Å; D472-H487 PolarHBondContact OD2-NE2 2.98Å; D472-P490 WeakPolarHBondContact O-CD 3.33Å
473	G	93	Very high	89.5	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	101.9	-131.3	167.9	0	0	0	0	0	113.9	Y470 C513 W515	Y470-G473 VanDerWaalsContact CD1-O 3.23Å; Y470-G473 WeakPolarHBondContact CD1-O 3.42Å; Y470-G473 PolarHBondContact N-O 2.88Å; Y470-G473 PolarHBondContact O-N 2.86Å; Y470-G473 VanDerWaalsContact O-O 3.14Å; G473-C513 VanDerWaalsContact CA-SG 3.54Å; G473-W515 PolarHBondContact O-NE1 3.29Å
474	I	95.3	Very high	90.8	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	120.5	-170.3	-40.4	172.7	0	0	0	109.6	Y467 V468 F469 H487 I488 W515 V539	Y467-I474 HydrophobicContact CD1-CG2 4.38Å; V468-I474 CarbonylContact O-C 3.54Å; V468-I474 WeakPolarHBondContact O-CA 3.38Å; F469-I474 HydrophobicContact CD1-CB 4.31Å; F469-I474 HydrophobicContact CD1-CD1 3.95Å; F469-I474 HydrophobicContact CD1-CG1 3.73Å; F469-I474 HydrophobicContact CD1-CG2 3.77Å; F469-I474 HydrophobicContact CE1-CB 4.45Å; F469-I474 HydrophobicContact CE1-CD1 3.74Å; F469-I474 HydrophobicContact CE1-CG1 3.98Å; F469-I474 HydrophobicContact CE1-CG2 3.63Å; F469-I474 HydrophobicContact CG-CG2 4.29Å; F469-I474 HydrophobicContact CZ-CG2 4.05Å; I474-H487 CarbonylContact O-C 3.54Å; I474-H487 WeakPolarHBondContact O-CA 3.41Å; I474-I488 HydrophobicContact CB-CB 4.1Å; I474-I488 HydrophobicContact CB-CD1 4.4Å; I474-I488 HydrophobicContact CB-CG1 4.45Å; I474-I488 HydrophobicContact CD1-CB 4.43Å; I474-I488 HydrophobicContact CD1-CD1 4.2Å; I474-I488 HydrophobicContact CG1-CB 4.45Å; I474-I488 PolarHBondContact N-O 2.91Å; I474-I488 PolarHBondContact O-N 3.33Å; I474-W515 HydrophobicContact CD1-CH2 4.09Å; I474-W515 HydrophobicContact CD1-CZ2 4.36Å; I474-W515 HydrophobicContact CG1-CH2 4.08Å; I474-W515 HydrophobicContact CG1-CZ2 3.83Å; I474-V539 HydrophobicContact CD1-CG2 3.86Å
475	K	94.2	Very high	91.2	Very high	19 Å²	19	31.9 Å²	31.9	8%	0.083	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	134.6	174	-88.4	171.6	175.8	-179.9	0	109.8	V468 Y470 I477 I484 R486 H487 D846 V847	V468-K475 PolarHBondContact N-O 3.02Å; V468-K475 PolarHBondContact O-N 2.85Å; Y470-K475 HydrophobicContact CE1-CB 3.94Å; Y470-K475 HydrophobicContact CE1-CD 3.76Å; Y470-K475 HydrophobicContact CE1-CG 3.6Å; Y470-K475 HydrophobicContact CE2-CD 4.5Å; Y470-K475 WeakPolarHBondContact OH-CE 3.14Å; K475-I477 HydrophobicContact CB-CD1 4.09Å; K475-I484 HydrophobicContact CB-CG2 4.42Å; K475-I484 HydrophobicContact CD-CD1 3.98Å; K475-I484 HydrophobicContact CD-CG1 4.36Å; K475-I484 HydrophobicContact CD-CG2 4.45Å; K475-I484 HydrophobicContact CG-CG2 3.97Å; K475-R486 WeakPolarHBondContact CA-O 3.35Å; K475-H487 HydrophobicContact CG-CB 4.49Å; K475-D846 PolarHBondContact NZ-O 3.13Å; K475-V847 HydrophobicContact CD-CG2 3.69Å
476	V	93.3	Very high	91.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	119.7	177.7	-162.7	0	0	0	0	108	M465 Y467 I484 Q485 R486	M465-V476 HydrophobicContact CB-CG1 4.17Å; M465-V476 HydrophobicContact CE-CG1 3.77Å; Y467-V476 HydrophobicContact CD1-CB 4.48Å; Y467-V476 HydrophobicContact CD1-CG1 4.15Å; Y467-V476 HydrophobicContact CD1-CG2 3.75Å; Y467-V476 HydrophobicContact CD2-CG1 4.09Å; Y467-V476 HydrophobicContact CE1-CB 4.33Å; Y467-V476 HydrophobicContact CE1-CG1 3.82Å; Y467-V476 HydrophobicContact CE1-CG2 3.54Å; Y467-V476 HydrophobicContact CE2-CG1 3.74Å; Y467-V476 HydrophobicContact CG-CG1 4.28Å; V476-I484 CarbonylContact O-C 3.57Å; V476-Q485 PolarHBondContact O-N 3.48Å; V476-R486 HydrophobicContact CB-CB 4.04Å; V476-R486 HydrophobicContact CG2-CB 3.84Å; V476-R486 HydrophobicContact CG2-CG 4.07Å; V476-R486 PolarHBondContact N-O 2.77Å; V476-R486 PolarHBondContact O-N 2.82Å
477	I	91.9	Very high	91.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	125.5	-163.7	-56.1	-57	0	0	0	110.3	M465 F466 V468 K475 P479 E483 I484 M823 L830 I832 I844	M465-I477 VanDerWaalsContact CE-C 3.4Å; M465-I477 WeakPolarHBondContact CE-O 3.43Å; F466-I477 HydrophobicContact CB-CB 4.27Å; F466-I477 PolarHBondContact N-O 3.23Å; F466-I477 PolarHBondContact O-N 2.79Å; V468-I477 HydrophobicContact CG2-CG1 3.98Å; K475-I477 HydrophobicContact CB-CD1 4.09Å; I477-P479 WeakPolarHBondContact O-CD 3.2Å; I477-E483 WeakPolarHBondContact CA-O 3.35Å; I477-I484 HydrophobicContact CD1-CB 4.22Å; I477-I484 HydrophobicContact CD1-CG1 3.57Å; I477-I484 HydrophobicContact CD1-CG2 4.47Å; I477-M823 HydrophobicContact CG1-CE 4.23Å; I477-M823 HydrophobicContact CG2-CE 4.37Å; I477-L830 HydrophobicContact CD1-CD1 4.49Å; I477-L830 HydrophobicContact CG1-CD1 4.42Å; I477-I832 HydrophobicContact CG2-CD1 3.99Å; I477-I844 HydrophobicContact CD1-CD1 4.26Å; I477-I844 HydrophobicContact CG2-CD1 3.38Å
478	Q	89.2	Confident	91	Very high	65 Å²	65	36.6 Å²	36.6	30%	0.304	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	112.5	173.9	-172	177.6	6.7	0	0	109.8	M465 V480 A481 C482 E483 Q485	M465-Q478 HydrophobicContact CE-CB 3.82Å; M465-Q478 HydrophobicContact SD-CB 3.78Å; M465-Q478 HydrophobicContact SD-CG 3.96Å; Q478-V480 VanDerWaalsContact C-N 3.31Å; Q478-V480 PolarHBondContact O-N 3.42Å; Q478-A481 HydrophobicContact CB-CB 4.49Å; Q478-A481 HydrophobicContact CG-CB 4.34Å; Q478-A481 PolarHBondContact O-N 3.48Å; Q478-C482 WeakPolarHBondContact O-CA 3.4Å; Q478-C482 PolarHBondContact O-N 2.94Å; Q478-E483 PolarHBondContact N-O 3.27Å; Q478-Q485 HydrophobicContact CB-CG 3.84Å
479	P	90	Very high	90.8	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.019	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-23.5	-170.3	29.8	-37.4	0	0	0	114.2	F466 I477 Y821 I832 W855	F466-P479 HydrophobicContact CD2-CB 4Å; F466-P479 HydrophobicContact CD2-CG 4.2Å; F466-P479 HydrophobicContact CE2-CB 3.93Å; F466-P479 HydrophobicContact CE2-CG 4.21Å; I477-P479 WeakPolarHBondContact O-CD 3.2Å; P479-Y821 HydrophobicContact CB-CD1 4.4Å; P479-Y821 HydrophobicContact CB-CD2 3.68Å; P479-Y821 HydrophobicContact CB-CE2 4.34Å; P479-Y821 HydrophobicContact CB-CG 3.7Å; P479-Y821 HydrophobicContact CG-CD2 3.81Å; P479-Y821 HydrophobicContact CG-CE2 4.4Å; P479-Y821 HydrophobicContact CG-CG 4.31Å; P479-I832 HydrophobicContact CB-CD1 4.48Å; P479-I832 HydrophobicContact CB-CG2 4.21Å; P479-W855 HydrophobicContact CG-CH2 4.29Å; P479-W855 HydrophobicContact CG-CZ3 4.04Å
480	V	85	Confident	90.8	Very high	98 Å²	98	42.2 Å²	42.2	59%	0.594	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-43.7	177.8	-179.5	0	0	0	0	111.5	Q478 Y821	Q478-V480 VanDerWaalsContact C-N 3.31Å; Q478-V480 PolarHBondContact O-N 3.42Å; V480-Y821 HydrophobicContact CG2-CE2 3.78Å
481	A	84	Confident	90.7	Very high	44 Å²	44	44.9 Å²	44.9	36%	0.364	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-19	-178.5	0	0	0	0	0	113	Q478 E483	Q478-A481 HydrophobicContact CB-CB 4.49Å; Q478-A481 HydrophobicContact CG-CB 4.34Å; Q478-A481 PolarHBondContact O-N 3.48Å; A481-E483 HydrophobicContact CB-CB 4.16Å; A481-E483 HydrophobicContact CB-CG 4Å; A481-E483 PolarHBondContact O-N 3.26Å
482	C	88.9	Confident	90.8	Very high	31 Å²	31	45 Å²	45	21%	0.209	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	29	-170.1	-53.3	0	0	0	0	113.7	Q478 N841 C842 I844	Q478-C482 WeakPolarHBondContact O-CA 3.4Å; Q478-C482 PolarHBondContact O-N 2.94Å; C482-N841 PolarHBondContact SG-ND2 3.5Å; C482-C842 HydrophobicContact CB-CB 3.65Å; C482-C842 WeakPolarHBondContact CB-SG 3.27Å; C482-C842 WeakPolarHBondContact SG-CB 3.48Å; C482-C842 CovalentContact SG-SG 2.02Å; C482-C842 PolarHBondContact SG-SG 2.89Å; C482-I844 WeakPolarHBondContact O-CD1 3.28Å; C482-I844 WeakPolarHBondContact O-CG1 3.49Å
483	E	88.3	Confident	90.7	Very high	112 Å²	112	47.1 Å²	47.1	52%	0.523	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	150.6	-174	-70.8	178.6	169.5	0	0	112.6	I477 Q478 A481 Q485	I477-E483 WeakPolarHBondContact CA-O 3.35Å; Q478-E483 PolarHBondContact N-O 3.27Å; A481-E483 HydrophobicContact CB-CB 4.16Å; A481-E483 HydrophobicContact CB-CG 4Å; A481-E483 PolarHBondContact O-N 3.26Å; E483-Q485 PolarHBondContact O-N 2.84Å
484	I	89.1	Confident	90.4	Very high	71 Å²	71	47.4 Å²	47.4	36%	0.364	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	104.2	169.3	-58.7	159.6	0	0	0	107.7	K475 V476 I477 I844	K475-I484 HydrophobicContact CB-CG2 4.42Å; K475-I484 HydrophobicContact CD-CD1 3.98Å; K475-I484 HydrophobicContact CD-CG1 4.36Å; K475-I484 HydrophobicContact CD-CG2 4.45Å; K475-I484 HydrophobicContact CG-CG2 3.97Å; V476-I484 CarbonylContact O-C 3.57Å; I477-I484 HydrophobicContact CD1-CB 4.22Å; I477-I484 HydrophobicContact CD1-CG1 3.57Å; I477-I484 HydrophobicContact CD1-CG2 4.47Å; I484-I844 HydrophobicContact CD1-CG2 4.26Å; I484-I844 HydrophobicContact CG1-CG2 4.22Å
485	Q	88.3	Confident	89.1	Confident	94 Å²	94	52.1 Å²	52.1	44%	0.439	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	-31.2	178.1	-72	-61.2	-36	0	0	112.4	M465 V476 Q478 E483	M465-Q485 HydrophobicContact CE-CB 3.82Å; M465-Q485 HydrophobicContact CE-CG 3.7Å; V476-Q485 PolarHBondContact O-N 3.48Å; Q478-Q485 HydrophobicContact CB-CG 3.84Å; E483-Q485 PolarHBondContact O-N 2.84Å
486	R	90.4	Very high	87.9	Confident	58 Å²	58	56.6 Å²	56.6	22%	0.219	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	144.9	-179.7	171.6	65	157.7	120.6	6.6	111.6	K475 V476 I488 E492 Q544	K475-R486 WeakPolarHBondContact CA-O 3.35Å; V476-R486 HydrophobicContact CB-CB 4.04Å; V476-R486 HydrophobicContact CG2-CB 3.84Å; V476-R486 HydrophobicContact CG2-CG 4.07Å; V476-R486 PolarHBondContact N-O 2.77Å; V476-R486 PolarHBondContact O-N 2.82Å; R486-I488 HydrophobicContact CG-CG1 4.23Å; R486-E492 IonicContact CZ-OE1 2.69Å; R486-E492 IonicContact CZ-OE2 2.66Å; R486-E492 IonicContact NH1-OE1 3.46Å; R486-E492 IonicContact NH1-OE2 3.64Å; R486-E492 PolarHBondContact NH1-OE2 2.9Å; R486-E492 IonicContact NH2-OE1 3.25Å; R486-E492 PolarHBondContact NH2-OE1 3.13Å; R486-E492 IonicContact NH2-OE2 2.79Å; R486-E492 PolarHBondContact NH2-OE2 3.28Å; R486-Q544 VanDerWaalsContact CB-OE1 3.29Å; R486-Q544 HydrophobicContact CG-CB 4.33Å; R486-Q544 PolarHBondContact NH2-O 2.88Å
487	H	92.5	Very high	86.9	Confident	48 Å²	48	60.7 Å²	60.7	22%	0.222	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	113.1	169.4	173.5	-158.6	0	0	0	108.4	Y470 D472 I474 K475	Y470-H487 PolarHBondContact OH-CD2 3.03Å; Y470-H487 PolarHBondContact OH-NE2 2.92Å; D472-H487 PolarHBondContact O-NE2 2.87Å; D472-H487 IonicContact OD1-CE1 3.47Å; D472-H487 IonicContact OD1-NE2 3.09Å; D472-H487 IonicContact OD2-CE1 3.38Å; D472-H487 PolarHBondContact OD2-CE1 2.83Å; D472-H487 IonicContact OD2-NE2 3.2Å; D472-H487 PolarHBondContact OD2-NE2 2.98Å; I474-H487 CarbonylContact O-C 3.54Å; I474-H487 WeakPolarHBondContact O-CA 3.41Å; K475-H487 HydrophobicContact CG-CB 4.49Å
488	I	93.4	Very high	86.2	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	119.3	169.6	-49.7	177.3	0	0	0	106.7	I474 R486 E492 V501 V539 Q544	I474-I488 HydrophobicContact CB-CB 4.1Å; I474-I488 HydrophobicContact CB-CD1 4.4Å; I474-I488 HydrophobicContact CB-CG1 4.45Å; I474-I488 HydrophobicContact CD1-CB 4.43Å; I474-I488 HydrophobicContact CD1-CD1 4.2Å; I474-I488 HydrophobicContact CG1-CB 4.45Å; I474-I488 PolarHBondContact N-O 2.91Å; I474-I488 PolarHBondContact O-N 3.33Å; R486-I488 HydrophobicContact CG-CG1 4.23Å; I488-E492 HydrophobicContact CG2-CB 4.27Å; I488-V501 HydrophobicContact CG2-CG2 4.13Å; I488-V539 HydrophobicContact CD1-CG1 4.1Å; I488-Q544 WeakPolarHBondContact CD1-O 2.98Å
489	K	93.1	Very high	86	Confident	112 Å²	112	69 Å²	69	49%	0.487	37%	0.367	S	S	.	.			trans	-86.4	154.8	-169.5	-67.4	-170.9	175.2	-171.7	0	112.6	S491 E492	K489-S491 PolarHBondContact O-N 2.82Å; K489-E492 HydrophobicContact CB-CB 4.48Å; K489-E492 VanDerWaalsContact O-CB 3.29Å; K489-E492 WeakPolarHBondContact O-CB 3.43Å; K489-E492 PolarHBondContact O-N 2.94Å
490	P	93.2	Very high	86.1	Confident	7 Å²	7	71.1 Å²	71.1	5%	0.045	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-39.7	175.1	-28.4	36.9	0	0	0	113.7	D472 V501 C502 Q511	D472-P490 WeakPolarHBondContact O-CD 3.33Å; P490-V501 PolarHBondContact O-N 2.83Å; P490-C502 HydrophobicContact CB-CB 4.09Å; P490-C502 PolarHBondContact O-N 3.21Å; P490-Q511 HydrophobicContact CB-CG 3.89Å; P490-Q511 PolarHBondContact O-NE2 3.25Å
491	S	91.3	Very high	86.5	Confident	63 Å²	63	66.5 Å²	66.5	44%	0.441	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	5.8	178.8	50.4	0	0	0	0	114.9	K489 K493	K489-S491 PolarHBondContact O-N 2.82Å; S491-K493 PolarHBondContact O-N 2.87Å
492	E	92.1	Very high	86.9	Confident	49 Å²	49	64.5 Å²	64.5	23%	0.229	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-68.6	132.7	172	-161.9	169.1	143.2	0	0	109	R486 I488 K489 E500 V501	R486-E492 IonicContact CZ-OE1 2.69Å; R486-E492 IonicContact CZ-OE2 2.66Å; R486-E492 IonicContact NH1-OE1 3.46Å; R486-E492 IonicContact NH1-OE2 3.64Å; R486-E492 PolarHBondContact NH1-OE2 2.9Å; R486-E492 IonicContact NH2-OE1 3.25Å; R486-E492 PolarHBondContact NH2-OE1 3.13Å; R486-E492 IonicContact NH2-OE2 2.79Å; R486-E492 PolarHBondContact NH2-OE2 3.28Å; I488-E492 HydrophobicContact CG2-CB 4.27Å; K489-E492 HydrophobicContact CB-CB 4.48Å; K489-E492 VanDerWaalsContact O-CB 3.29Å; K489-E492 WeakPolarHBondContact O-CB 3.43Å; K489-E492 PolarHBondContact O-N 2.94Å; E492-E500 WeakPolarHBondContact O-CA 3.41Å; E492-V501 HydrophobicContact CB-CG2 4.34Å; E492-V501 WeakPolarHBondContact O-CG2 3.35Å; E492-V501 PolarHBondContact O-N 2.83Å
493	K	89.1	Confident	87	Confident	116 Å²	116	65.4 Å²	65.4	50%	0.504	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-91.9	137.8	-174	-74.1	-175.6	179.1	-74.6	0	112.3	S491 Q498 E499 E500	S491-K493 PolarHBondContact O-N 2.87Å; K493-Q498 WeakPolarHBondContact CD-O 3.48Å; K493-Q498 PolarHBondContact NZ-O 3.23Å; K493-E499 CarbonylContact C-O 3.55Å; K493-E499 VanDerWaalsContact CA-O 3.24Å; K493-E499 WeakPolarHBondContact CA-O 3.46Å; K493-E500 WeakPolarHBondContact CE-OE1 3.46Å; K493-E500 HydrophobicContact CG-CG 3.73Å; K493-E500 IonicContact NZ-OE1 3.49Å; K493-E500 PolarHBondContact NZ-OE1 3.35Å
494	L	85.3	Confident	86.9	Confident	6 Å²	6	63.3 Å²	63.3	3%	0.031	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-66.3	143.4	175.2	-80.8	80.2	0	0	0	110.9	L497 E499 V501 L537 A546 T549	L494-L497 HydrophobicContact CB-CB 4.36Å; L494-L497 HydrophobicContact CD2-CD1 4.31Å; L494-E499 HydrophobicContact CD1-CB 4.34Å; L494-E499 PolarHBondContact N-O 3.15Å; L494-V501 HydrophobicContact CD1-CG2 4.21Å; L494-L537 HydrophobicContact CD1-CD1 4.3Å; L494-L537 HydrophobicContact CD2-CD1 3.88Å; L494-L537 HydrophobicContact CG-CD1 4.46Å; L494-A546 HydrophobicContact CD1-CB 4.33Å; L494-A546 HydrophobicContact CG-CB 4.05Å; L494-T549 HydrophobicContact CD2-CG2 3.7Å
495	L	69.5	Low	86.5	Confident	99 Å²	99	62.5 Å²	62.5	52%	0.518	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	141.3	171.9	-59.5	178.4	0	0	0	109.8	L497 V547	L495-L497 PolarHBondContact O-N 2.95Å; L495-V547 HydrophobicContact CD1-CG1 4.42Å
496	A	69.1	Low	86	Confident	113 Å²	113	64.8 Å²	64.8	93%	0.934	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	-27.6	-176.7	0	0	0	0	0	118.2
497	L	70.5	Confident	85.3	Confident	86 Å²	86	66 Å²	66	45%	0.45	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-15.1	-169.6	-69.2	170.9	0	0	0	116.1	L494 L495 E499 T549	L494-L497 HydrophobicContact CB-CB 4.36Å; L494-L497 HydrophobicContact CD2-CD1 4.31Å; L495-L497 PolarHBondContact O-N 2.95Å; L497-E499 HydrophobicContact CB-CB 4.37Å; L497-E499 HydrophobicContact CB-CG 4.26Å; L497-E499 PolarHBondContact O-N 2.85Å; L497-T549 WeakPolarHBondContact CD1-OG1 3.47Å
498	Q	77.9	Confident	84.7	Confident	161 Å²	161	67.8 Å²	67.8	75%	0.752	40%	0.395	S	S	*	.			trans	58.9	-12.8	-170.5	-61	-165.2	9	0	0	116.8	K493	K493-Q498 WeakPolarHBondContact CD-O 3.48Å; K493-Q498 PolarHBondContact NZ-O 3.23Å
499	E	85.3	Confident	84	Confident	77 Å²	77	74.9 Å²	74.9	36%	0.36	44%	0.438	S	S	.	.			trans	-51.3	154.6	166.6	-68.3	-174.2	-173.8	0	0	112.3	K493 L494 L497 R535 T549	K493-E499 CarbonylContact C-O 3.55Å; K493-E499 VanDerWaalsContact CA-O 3.24Å; K493-E499 WeakPolarHBondContact CA-O 3.46Å; L494-E499 HydrophobicContact CD1-CB 4.34Å; L494-E499 PolarHBondContact N-O 3.15Å; L497-E499 HydrophobicContact CB-CB 4.37Å; L497-E499 HydrophobicContact CB-CG 4.26Å; L497-E499 PolarHBondContact O-N 2.85Å; E499-R535 IonicContact OE2-CZ 2.76Å; E499-R535 IonicContact OE2-NH1 3.61Å; E499-R535 PolarHBondContact OE2-NH1 2.94Å; E499-T549 PolarHBondContact OE2-OG1 2.74Å
500	E	91.6	Very high	83.6	Confident	49 Å²	49	73.2 Å²	73.2	23%	0.229	44%	0.437	C	S	.	.	B	Isolated β-bridge	trans	-99.6	155.8	173.9	-73.5	166.1	-152.4	0	0	110.7	E492 K493 C502 Q511 R535	E492-E500 WeakPolarHBondContact O-CA 3.41Å; K493-E500 WeakPolarHBondContact CE-OE1 3.46Å; K493-E500 HydrophobicContact CG-CG 3.73Å; K493-E500 IonicContact NZ-OE1 3.49Å; K493-E500 PolarHBondContact NZ-OE1 3.35Å; E500-C502 PolarHBondContact O-N 3.3Å; E500-Q511 PolarHBondContact OE2-NE2 3.07Å; E500-R535 PolarHBondContact O-NH2 2.89Å
501	V	93.5	Very high	83.3	Confident	1 Å²	1	75.4 Å²	75.4	1%	0.006	45%	0.447	C	S	.	.	S	Bend	trans	-55.1	-43.3	177.1	165.8	0	0	0	0	110.6	I488 P490 E492 L494 W515 Q530 R535 L537 A546	I488-V501 HydrophobicContact CG2-CG2 4.13Å; P490-V501 PolarHBondContact O-N 2.83Å; E492-V501 HydrophobicContact CB-CG2 4.34Å; E492-V501 WeakPolarHBondContact O-CG2 3.35Å; E492-V501 PolarHBondContact O-N 2.83Å; L494-V501 HydrophobicContact CD1-CG2 4.21Å; V501-W515 HydrophobicContact CG1-CH2 3.99Å; V501-W515 HydrophobicContact CG1-CZ2 4.41Å; V501-Q530 PolarHBondContact O-NE2 3.12Å; V501-Q530 PolarHBondContact O-OE1 3.24Å; V501-R535 PolarHBondContact O-NH2 3.23Å; V501-R535 VanDerWaalsContact O-NH2 3.08Å; V501-L537 HydrophobicContact CG1-CD2 3.94Å; V501-A546 HydrophobicContact CG2-CB 3.76Å
502	C	92.6	Very high	83.3	Confident	2 Å²	2	78.3 Å²	78.3	1%	0.014	45%	0.448	C	S	.	.	S	Bend	trans	-139.3	90.1	173.5	-53.7	0	0	0	0	109.7	P490 E500 Q511 C513 Q530	P490-C502 HydrophobicContact CB-CB 4.09Å; P490-C502 PolarHBondContact O-N 3.21Å; E500-C502 PolarHBondContact O-N 3.3Å; C502-Q511 WeakPolarHBondContact O-CG 3.46Å; C502-Q511 PolarHBondContact O-NE2 3.15Å; C502-C513 HydrophobicContact CB-CB 3.95Å; C502-C513 WeakPolarHBondContact CB-SG 3.24Å; C502-C513 WeakPolarHBondContact SG-CA 3.46Å; C502-C513 WeakPolarHBondContact SG-CB 3.44Å; C502-C513 CovalentContact SG-SG 2.02Å; C502-C513 PolarHBondContact SG-SG 2.69Å; C502-Q530 PolarHBondContact SG-NE2 2.95Å
503	P	90.5	Very high	83.3	Confident	50 Å²	50	76.1 Å²	76.1	33%	0.325	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-63.4	147.8	-179.2	27.1	-36	0	0	0	112.4	L533	P503-L533 HydrophobicContact CG-CD1 4.18Å; P503-L533 HydrophobicContact CG-CD2 4.25Å
504	T	87.3	Confident	83.4	Confident	68 Å²	68	72.6 Å²	72.6	42%	0.417	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-69.8	128.5	178.7	-48.8	0	0	0	0	112	E508 Q511	T504-E508 HydrophobicContact CG2-CB 4.42Å; T504-E508 WeakPolarHBondContact CG2-O 3.34Å; T504-Q511 WeakPolarHBondContact OG1-CB 3.06Å; T504-Q511 WeakPolarHBondContact OG1-CG 3.4Å
505	S	80.4	Confident	83.8	Confident	54 Å²	54	72.3 Å²	72.3	38%	0.378	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-67.5	146.9	177.1	-41.7	0	0	0	0	112.2	G507 E508	S505-G507 PolarHBondContact O-N 2.94Å; S505-G507 VanDerWaalsContact O-N 3.08Å; S505-E508 WeakPolarHBondContact CB-OE2 3.39Å; S505-E508 PolarHBondContact O-N 2.88Å; S505-E508 PolarHBondContact OG-OE2 3.14Å
506	P	76.5	Confident	85	Confident	141 Å²	141	68.1 Å²	68.1	92%	0.916	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	115.8	174.8	-25.1	34.9	0	0	0	112.2
507	G	76	Confident	86.3	Confident	83 Å²	83	63.7 Å²	63.7	86%	0.856	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.2	-7.9	-179.3	0	0	0	0	0	115.5	S505	S505-G507 PolarHBondContact O-N 2.94Å; S505-G507 VanDerWaalsContact O-N 3.08Å
508	E	79.9	Confident	87.6	Confident	87 Å²	87	60.4 Å²	60.4	41%	0.407	35%	0.351	S	S	.	.			trans	-82.7	132.3	171.5	-73.1	-166.3	115.5	0	0	111.7	T504 S505	T504-E508 HydrophobicContact CG2-CB 4.42Å; T504-E508 WeakPolarHBondContact CG2-O 3.34Å; S505-E508 WeakPolarHBondContact CB-OE2 3.39Å; S505-E508 PolarHBondContact O-N 2.88Å; S505-E508 PolarHBondContact OG-OE2 3.14Å
509	V	79.5	Confident	88.5	Confident	148 Å²	148	53.8 Å²	53.8	90%	0.897	32%	0.322	S	S	*	.	S	Bend	trans	-85.4	-17	178.6	-171.3	0	0	0	0	111.9
510	V	83.9	Confident	89	Confident	78 Å²	78	51.3 Å²	51.3	47%	0.473	31%	0.311	S	S	.	.	S	Bend	trans	-124.4	115.3	-176.9	-175.8	0	0	0	0	109.1	R512	V510-R512 HydrophobicContact CG1-CG 4.13Å; V510-R512 PolarHBondContact O-N 3.37Å
511	Q	88.3	Confident	89.1	Confident	52 Å²	52	49 Å²	49	24%	0.243	30%	0.3	C	S	.	.			trans	-63	125.2	172.7	-170.5	171.1	16.4	0	0	110.1	P490 E500 C502 T504	P490-Q511 HydrophobicContact CB-CG 3.89Å; P490-Q511 PolarHBondContact O-NE2 3.25Å; E500-Q511 PolarHBondContact OE2-NE2 3.07Å; C502-Q511 WeakPolarHBondContact O-CG 3.46Å; C502-Q511 PolarHBondContact O-NE2 3.15Å; T504-Q511 WeakPolarHBondContact OG1-CB 3.06Å; T504-Q511 WeakPolarHBondContact OG1-CG 3.4Å
512	R	89.9	Confident	89	Confident	124 Å²	124	53.1 Å²	53.1	47%	0.468	32%	0.318	S	S	.	.			trans	-139.4	151.3	-178.6	-70.7	-178	178.8	151.2	-1.6	111.6	E471 V510	E471-R512 WeakPolarHBondContact O-CA 3.43Å; V510-R512 HydrophobicContact CG1-CG 4.13Å; V510-R512 PolarHBondContact O-N 3.37Å
513	C	91.8	Very high	88.8	Confident	4 Å²	4	55 Å²	55	3%	0.027	33%	0.328	C	S	.	.			trans	-95.1	141.5	171.3	-61.8	0	0	0	0	111.5	Y470 E471 G473 C502 W515	Y470-C513 WeakPolarHBondContact O-CB 3.35Å; E471-C513 PolarHBondContact O-N 3.03Å; G473-C513 VanDerWaalsContact CA-SG 3.54Å; C502-C513 HydrophobicContact CB-CB 3.95Å; C502-C513 WeakPolarHBondContact CB-SG 3.24Å; C502-C513 WeakPolarHBondContact SG-CA 3.46Å; C502-C513 WeakPolarHBondContact SG-CB 3.44Å; C502-C513 CovalentContact SG-SG 2.02Å; C502-C513 PolarHBondContact SG-SG 2.69Å; C513-W515 HydrophobicContact CB-CD2 4.41Å; C513-W515 HydrophobicContact CB-CZ2 3.74Å; C513-W515 VanDerWaalsContact CB-NE1 3.28Å
514	V	92.7	Very high	88.8	Confident	42 Å²	42	57 Å²	57	26%	0.255	33%	0.332	S	S	.	.			trans	-117	133.5	163.8	-169.2	0	0	0	0	107.6	P531 T532 W805	V514-P531 HydrophobicContact CB-CG 4.42Å; V514-P531 HydrophobicContact CG1-CG 3.68Å; V514-T532 HydrophobicContact CB-CG2 4.3Å; V514-T532 HydrophobicContact CG1-CG2 4.33Å; V514-T532 HydrophobicContact CG2-CG2 4.12Å; V514-W805 HydrophobicContact CG1-CZ2 3.62Å
515	W	94.1	Very high	89.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.314	C	S	.	.			trans	-132.2	157.2	179.8	-46.7	106.6	0	0	0	109.1	F469 Y470 G473 I474 V501 C513 V528 T529 Q530 L537 W803 V852	F469-W515 VanDerWaalsContact C-CD1 3.41Å; F469-W515 HydrophobicContact CB-CB 4.18Å; F469-W515 HydrophobicContact CB-CD2 3.92Å; F469-W515 HydrophobicContact CB-CG 3.68Å; F469-W515 HydrophobicContact CD1-CD2 4.31Å; F469-W515 HydrophobicContact CD1-CE3 4.38Å; F469-W515 HydrophobicContact CD1-CH2 4.43Å; F469-W515 HydrophobicContact CD1-CZ2 4.38Å; F469-W515 HydrophobicContact CD1-CZ3 4.43Å; Y470-W515 VanDerWaalsContact N-CD1 3.28Å; Y470-W515 VanDerWaalsContact N-NE1 3.19Å; Y470-W515 PolarHBondContact O-NE1 3.46Å; G473-W515 PolarHBondContact O-NE1 3.29Å; I474-W515 HydrophobicContact CD1-CH2 4.09Å; I474-W515 HydrophobicContact CD1-CZ2 4.36Å; I474-W515 HydrophobicContact CG1-CH2 4.08Å; I474-W515 HydrophobicContact CG1-CZ2 3.83Å; V501-W515 HydrophobicContact CG1-CH2 3.99Å; V501-W515 HydrophobicContact CG1-CZ2 4.41Å; C513-W515 HydrophobicContact CB-CD2 4.41Å; C513-W515 HydrophobicContact CB-CZ2 3.74Å; C513-W515 VanDerWaalsContact CB-NE1 3.28Å; W515-V528 HydrophobicContact CB-CG2 4.46Å; W515-V528 HydrophobicContact CD2-CG2 4.19Å; W515-V528 HydrophobicContact CE3-CB 4.44Å; W515-V528 HydrophobicContact CE3-CG1 4.03Å; W515-V528 HydrophobicContact CE3-CG2 3.49Å; W515-V528 VanDerWaalsContact CE3-CG2 3.49Å; W515-V528 HydrophobicContact CZ3-CG1 3.66Å; W515-V528 HydrophobicContact CZ3-CG2 4.02Å; W515-T529 WeakPolarHBondContact CA-O 3.25Å; W515-Q530 HydrophobicContact CE3-CG 3.55Å; W515-Q530 HydrophobicContact CH2-CG 4.4Å; W515-Q530 VanDerWaalsContact CH2-NE2 3.35Å; W515-Q530 HydrophobicContact CZ3-CG 3.4Å; W515-Q530 VanDerWaalsContact CZ3-CG 3.4Å; W515-L537 HydrophobicContact CH2-CD2 3.82Å; W515-L537 HydrophobicContact CZ3-CD2 3.95Å; W515-W803 WeakPolarHBondContact O-CH2 3.43Å; W515-W803 WeakPolarHBondContact O-CZ2 3.45Å; W515-V852 HydrophobicContact CB-CG2 4.28Å
516	S	94.3	Very high	89.9	Confident	10 Å²	10	51.8 Å²	51.8	7%	0.07	30%	0.296	C	S	.	.			trans	-135.6	-40.8	179	43.7	0	0	0	0	113.9	T529 P556 V852	S516-T529 PolarHBondContact N-O 2.76Å; S516-T529 WeakPolarHBondContact OG-CB 3.35Å; S516-T529 PolarHBondContact OG-OG1 3.12Å; S516-P556 PolarHBondContact OG-O 3.44Å; S516-V852 WeakPolarHBondContact O-CG2 3.47Å
517	S	96.3	Very high	90.9	Very high	21 Å²	21	45 Å²	45	15%	0.147	25%	0.253	C	S	.	.			trans	-154	153.2	179	-176.4	0	0	0	0	111.2	V528 T529 V557 L559	S517-V528 WeakPolarHBondContact O-CA 3.19Å; S517-V528 WeakPolarHBondContact O-CG2 3.03Å; S517-T529 PolarHBondContact N-OG1 2.73Å; S517-T529 PolarHBondContact O-N 2.9Å; S517-T529 PolarHBondContact O-OG1 3.43Å; S517-V557 WeakPolarHBondContact CB-O 3.46Å; S517-L559 PolarHBondContact OG-N 2.82Å
518	A	97.1	Very high	92	Very high	17 Å²	17	41.1 Å²	41.1	14%	0.14	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	149	177.5	0	0	0	0	0	111.4	F469 I526 Y527 V528 V852 V854	F469-A518 HydrophobicContact CD2-CB 4.29Å; F469-A518 HydrophobicContact CE2-CB 3.99Å; F469-A518 HydrophobicContact CZ-CB 4.43Å; A518-I526 HydrophobicContact CB-CG2 4.24Å; A518-Y527 CarbonylContact C-O 3.56Å; A518-Y527 WeakPolarHBondContact CA-O 3.34Å; A518-V528 HydrophobicContact CB-CB 3.83Å; A518-V528 HydrophobicContact CB-CG2 3.87Å; A518-V852 HydrophobicContact CB-CG1 3.59Å; A518-V854 HydrophobicContact CB-CG2 3.37Å
519	V	96.7	Very high	92.8	Very high	21 Å²	21	37 Å²	37	13%	0.127	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	141.1	177.9	-69	0	0	0	0	112	V521 I526 Y527 L559 V568	V519-V521 HydrophobicContact CG2-CG2 4.4Å; V519-I526 WeakPolarHBondContact O-CA 3.42Å; V519-I526 WeakPolarHBondContact O-CG2 3.44Å; V519-Y527 PolarHBondContact N-O 2.04Å; V519-Y527 PolarHBondContact O-N 3.47Å; V519-L559 HydrophobicContact CB-CB 4.44Å; V519-L559 HydrophobicContact CG1-CB 3.77Å; V519-L559 HydrophobicContact CG2-CB 3.89Å; V519-L559 HydrophobicContact CG2-CD1 4.01Å; V519-V568 HydrophobicContact CG2-CG1 4.14Å; V519-V568 HydrophobicContact CG2-CG2 4.24Å
520	N	95.1	Very high	93.6	Very high	26 Å²	26	30 Å²	30	14%	0.139	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	129.9	170.7	174.4	-0.5	0	0	0	109.9	D523 Y561 V854 W855	N520-D523 PolarHBondContact ND2-OD1 3.37Å; N520-D523 VanDerWaalsContact OD1-CA 3.27Å; N520-D523 WeakPolarHBondContact OD1-CA 3.3Å; N520-D523 PolarHBondContact OD1-N 2.99Å; N520-Y561 VanDerWaalsContact O-CD1 3.23Å; N520-Y561 WeakPolarHBondContact O-CD1 3.37Å; N520-V854 HydrophobicContact CB-CG1 3.75Å; N520-W855 PolarHBondContact ND2-O 2.68Å
521	V	94.9	Very high	94.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	97.8	-178.6	179.4	0	0	0	0	109.8	V519 D523 K524 F525 Y527 Y561 V568 A589	V519-V521 HydrophobicContact CG2-CG2 4.4Å; V521-D523 PolarHBondContact O-N 3.45Å; V521-D523 VanDerWaalsContact O-N 3.1Å; V521-K524 PolarHBondContact O-N 2.85Å; V521-K524 VanDerWaalsContact O-N 3.1Å; V521-F525 HydrophobicContact CB-CB 4.39Å; V521-F525 PolarHBondContact N-O 2.76Å; V521-F525 PolarHBondContact O-N 2.69Å; V521-Y527 HydrophobicContact CB-CD2 4.2Å; V521-Y527 HydrophobicContact CB-CE2 4.23Å; V521-Y527 HydrophobicContact CG1-CE2 4.44Å; V521-Y527 HydrophobicContact CG2-CD2 3.5Å; V521-Y527 VanDerWaalsContact CG2-CD2 3.5Å; V521-Y527 HydrophobicContact CG2-CE2 3.87Å; V521-Y527 HydrophobicContact CG2-CG 4.25Å; V521-Y561 HydrophobicContact CB-CD2 4.45Å; V521-Y561 HydrophobicContact CB-CE2 4.42Å; V521-Y561 HydrophobicContact CG1-CD2 4.19Å; V521-Y561 HydrophobicContact CG1-CE1 4.37Å; V521-Y561 HydrophobicContact CG1-CE2 3.73Å; V521-Y561 HydrophobicContact CG2-CD1 4.42Å; V521-Y561 HydrophobicContact CG2-CD2 3.83Å; V521-Y561 HydrophobicContact CG2-CE2 4.24Å; V521-Y561 HydrophobicContact CG2-CG 3.96Å; V521-V568 HydrophobicContact CG2-CG2 3.64Å; V521-A589 HydrophobicContact CG1-CB 3.88Å; V521-A589 WeakPolarHBondContact CG1-O 3.4Å
522	K	90.7	Very high	94.3	Very high	87 Å²	87	27.5 Å²	27.5	38%	0.378	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.1	36.6	-178	-50.2	-169.2	-167.9	160.1	0	114.4	K524 Y561 D566 S590	K522-K524 PolarHBondContact O-N 3.43Å; K522-Y561 WeakPolarHBondContact CE-OH 3.47Å; K522-Y561 HydrophobicContact CG-CE1 4.19Å; K522-Y561 WeakPolarHBondContact CG-OH 3.3Å; K522-D566 WeakPolarHBondContact CE-OD1 3.43Å; K522-D566 IonicContact NZ-OD1 2.75Å; K522-D566 PolarHBondContact NZ-OD1 3.49Å; K522-D566 IonicContact NZ-OD2 3.3Å; K522-D566 PolarHBondContact NZ-OD2 3.45Å; K522-S590 WeakPolarHBondContact CD-OG 3.24Å; K522-S590 WeakPolarHBondContact CE-OG 3.36Å; K522-S590 PolarHBondContact NZ-OG 3.04Å
523	D	88.5	Confident	94.4	Very high	43 Å²	43	24.8 Å²	24.8	23%	0.23	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	19.9	178.6	-61.4	-78.2	0	0	0	114.3	N520 V521 I541 G857 S859	N520-D523 PolarHBondContact ND2-OD1 3.37Å; N520-D523 VanDerWaalsContact OD1-CA 3.27Å; N520-D523 WeakPolarHBondContact OD1-CA 3.3Å; N520-D523 PolarHBondContact OD1-N 2.99Å; V521-D523 PolarHBondContact O-N 3.45Å; V521-D523 VanDerWaalsContact O-N 3.1Å; D523-I541 VanDerWaalsContact C-CD1 3.49Å; D523-G857 PolarHBondContact OD1-N 3.12Å; D523-S859 PolarHBondContact OD2-OG 3.16Å
524	K	90.6	Very high	94.6	Very high	91 Å²	91	25.5 Å²	25.5	40%	0.396	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-42.9	175.6	-69.1	166.9	-178.6	175	0	112.8	V521 K522 I541 S590	V521-K524 PolarHBondContact O-N 2.85Å; V521-K524 VanDerWaalsContact O-N 3.1Å; K522-K524 PolarHBondContact O-N 3.43Å; K524-I541 WeakPolarHBondContact O-CB 3.48Å; K524-I541 PolarHBondContact O-N 3.2Å; K524-S590 PolarHBondContact NZ-O 2.8Å
525	F	94.6	Very high	94.7	Very high	12 Å²	12	24.6 Å²	24.6	5%	0.053	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	150	-177	-56.8	-65	0	0	0	111.5	V521 Y527 I538 V539 D540 G591 K592	V521-F525 HydrophobicContact CB-CB 4.39Å; V521-F525 PolarHBondContact N-O 2.76Å; V521-F525 PolarHBondContact O-N 2.69Å; F525-Y527 HydrophobicContact CB-CD2 4.08Å; F525-Y527 HydrophobicContact CB-CE2 3.78Å; F525-Y527 HydrophobicContact CG-CE2 4.41Å; F525-I538 HydrophobicContact CB-CG2 4.03Å; F525-I538 HydrophobicContact CD1-CG2 3.84Å; F525-I538 HydrophobicContact CG-CG2 4.06Å; F525-V539 CarbonylContact C-O 3.46Å; F525-V539 VanDerWaalsContact CA-O 3.26Å; F525-V539 WeakPolarHBondContact CA-O 3.35Å; F525-D540 HydrophobicContact CD1-CB 4.14Å; F525-D540 HydrophobicContact CE1-CB 4.08Å; F525-G591 VanDerWaalsContact CE2-O 3.27Å; F525-G591 WeakPolarHBondContact CE2-O 3.47Å; F525-K592 HydrophobicContact CZ-CG 4.42Å
526	I	96.8	Very high	94.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	125.2	160.9	-48.1	172.1	0	0	0	107.7	Y467 F469 A518 V519 V539 I541 V854 V856	Y467-I526 HydrophobicContact CD1-CD1 3.38Å; Y467-I526 HydrophobicContact CD2-CD1 3.54Å; Y467-I526 HydrophobicContact CE1-CD1 3.83Å; Y467-I526 HydrophobicContact CE2-CD1 3.99Å; Y467-I526 HydrophobicContact CG-CD1 3.21Å; F469-I526 HydrophobicContact CE2-CG2 4.3Å; F469-I526 HydrophobicContact CZ-CB 4.47Å; F469-I526 HydrophobicContact CZ-CD1 4.29Å; F469-I526 HydrophobicContact CZ-CG2 3.79Å; A518-I526 HydrophobicContact CB-CG2 4.24Å; V519-I526 WeakPolarHBondContact O-CA 3.42Å; V519-I526 WeakPolarHBondContact O-CG2 3.44Å; I526-V539 HydrophobicContact CB-CB 4.4Å; I526-V539 PolarHBondContact N-O 3.32Å; I526-V539 PolarHBondContact O-N 2.87Å; I526-I541 HydrophobicContact CD1-CG1 4.32Å; I526-I541 HydrophobicContact CG1-CD1 3.85Å; I526-I541 HydrophobicContact CG1-CG1 3.88Å; I526-V854 HydrophobicContact CG2-CB 4.46Å; I526-V854 HydrophobicContact CG2-CG1 4.25Å; I526-V854 HydrophobicContact CG2-CG2 4.23Å; I526-V856 HydrophobicContact CD1-CG2 3.79Å; I526-V856 HydrophobicContact CG1-CG2 3.97Å
527	Y	98.1	Very high	95	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	127.1	170.8	-76	-124.4	0	0	0	106.6	A518 V519 V521 F525 V536 I538 L559 V568 I586 A589 H595	A518-Y527 CarbonylContact C-O 3.56Å; A518-Y527 WeakPolarHBondContact CA-O 3.34Å; V519-Y527 PolarHBondContact N-O 2.04Å; V519-Y527 PolarHBondContact O-N 3.47Å; V521-Y527 HydrophobicContact CB-CD2 4.2Å; V521-Y527 HydrophobicContact CB-CE2 4.23Å; V521-Y527 HydrophobicContact CG1-CE2 4.44Å; V521-Y527 HydrophobicContact CG2-CD2 3.5Å; V521-Y527 VanDerWaalsContact CG2-CD2 3.5Å; V521-Y527 HydrophobicContact CG2-CE2 3.87Å; V521-Y527 HydrophobicContact CG2-CG 4.25Å; F525-Y527 HydrophobicContact CB-CD2 4.08Å; F525-Y527 HydrophobicContact CB-CE2 3.78Å; F525-Y527 HydrophobicContact CG-CE2 4.41Å; Y527-V536 HydrophobicContact CD1-CG1 3.8Å; Y527-V536 HydrophobicContact CG-CG1 4.25Å; Y527-I538 HydrophobicContact CD1-CD1 4.28Å; Y527-I538 HydrophobicContact CD1-CG1 4Å; Y527-I538 HydrophobicContact CD2-CG1 4.35Å; Y527-I538 HydrophobicContact CD2-CG2 4.47Å; Y527-I538 HydrophobicContact CE1-CD1 3.56Å; Y527-I538 HydrophobicContact CE1-CG1 3.79Å; Y527-I538 HydrophobicContact CE2-CD1 4.21Å; Y527-I538 HydrophobicContact CE2-CG1 4.16Å; Y527-I538 HydrophobicContact CE2-CG2 4.11Å; Y527-I538 HydrophobicContact CG-CG1 4.26Å; Y527-L559 VanDerWaalsContact O-CD1 3.25Å; Y527-L559 WeakPolarHBondContact O-CD1 3.26Å; Y527-V568 HydrophobicContact CD1-CB 4.22Å; Y527-V568 HydrophobicContact CD1-CG1 4.14Å; Y527-V568 HydrophobicContact CD1-CG2 3.99Å; Y527-V568 HydrophobicContact CD2-CG2 4.38Å; Y527-V568 HydrophobicContact CE1-CG2 4.31Å; Y527-V568 HydrophobicContact CG-CG1 4.48Å; Y527-V568 HydrophobicContact CG-CG2 4.06Å; Y527-I586 HydrophobicContact CD1-CD1 4.08Å; Y527-I586 HydrophobicContact CE1-CD1 4.01Å; Y527-I586 HydrophobicContact CE1-CG2 4.14Å; Y527-A589 HydrophobicContact CE1-CB 4.43Å; Y527-A589 HydrophobicContact CE2-CB 4.33Å; Y527-A589 PolarHBondContact OH-O 2.04Å; Y527-A589 VanDerWaalsContact OH-O 3.07Å; Y527-H595 PolarHBondContact OH-CD2 2.81Å; Y527-H595 PolarHBondContact OH-CE1 3.11Å; Y527-H595 PolarHBondContact OH-ND1 2.98Å; Y527-H595 PolarHBondContact OH-NE2 2.9Å
528	V	97.8	Very high	95	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	136.6	177.6	60.4	0	0	0	0	111.1	F469 W515 S517 A518 V536 L537	F469-V528 HydrophobicContact CD1-CB 4.07Å; F469-V528 HydrophobicContact CD1-CG1 3.94Å; F469-V528 HydrophobicContact CD1-CG2 3.72Å; F469-V528 HydrophobicContact CE1-CB 3.82Å; F469-V528 HydrophobicContact CE1-CG1 3.6Å; F469-V528 HydrophobicContact CE1-CG2 4Å; F469-V528 HydrophobicContact CG-CG2 4.06Å; F469-V528 HydrophobicContact CZ-CB 4.27Å; F469-V528 HydrophobicContact CZ-CG1 4.41Å; W515-V528 HydrophobicContact CB-CG2 4.46Å; W515-V528 HydrophobicContact CD2-CG2 4.19Å; W515-V528 HydrophobicContact CE3-CB 4.44Å; W515-V528 HydrophobicContact CE3-CG1 4.03Å; W515-V528 HydrophobicContact CE3-CG2 3.49Å; W515-V528 VanDerWaalsContact CE3-CG2 3.49Å; W515-V528 HydrophobicContact CZ3-CG1 3.66Å; W515-V528 HydrophobicContact CZ3-CG2 4.02Å; S517-V528 WeakPolarHBondContact O-CA 3.19Å; S517-V528 WeakPolarHBondContact O-CG2 3.03Å; A518-V528 HydrophobicContact CB-CB 3.83Å; A518-V528 HydrophobicContact CB-CG2 3.87Å; V528-V536 CarbonylContact O-C 3.56Å; V528-V536 WeakPolarHBondContact O-CA 3.38Å; V528-L537 HydrophobicContact CG1-CB 3.92Å; V528-L537 HydrophobicContact CG1-CD2 4.43Å; V528-L537 PolarHBondContact N-O 3.5Å; V528-L537 PolarHBondContact O-N 2.86Å
529	T	97.7	Very high	94.8	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	139.7	179.5	48	0	0	0	0	112.6	W515 S516 S517 V536 P556 L559	W515-T529 WeakPolarHBondContact CA-O 3.25Å; S516-T529 PolarHBondContact N-O 2.76Å; S516-T529 WeakPolarHBondContact OG-CB 3.35Å; S516-T529 PolarHBondContact OG-OG1 3.12Å; S517-T529 PolarHBondContact N-OG1 2.73Å; S517-T529 PolarHBondContact O-N 2.9Å; S517-T529 PolarHBondContact O-OG1 3.43Å; T529-V536 HydrophobicContact CG2-CG2 3.8Å; T529-P556 WeakPolarHBondContact CB-O 3.31Å; T529-P556 HydrophobicContact CG2-CB 3.7Å; T529-P556 HydrophobicContact CG2-CG 4.23Å; T529-L559 HydrophobicContact CG2-CD1 3.96Å; T529-L559 HydrophobicContact CG2-CD2 3.59Å; T529-L559 HydrophobicContact CG2-CG 3.63Å
530	Q	95.8	Very high	94.6	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	90.4	170.2	-64.7	-171	-58.9	0	0	108.4	V501 C502 W515 T532 L533 G534 R535	V501-Q530 PolarHBondContact O-NE2 3.12Å; V501-Q530 PolarHBondContact O-OE1 3.24Å; C502-Q530 PolarHBondContact SG-NE2 2.95Å; W515-Q530 HydrophobicContact CE3-CG 3.55Å; W515-Q530 HydrophobicContact CH2-CG 4.4Å; W515-Q530 VanDerWaalsContact CH2-NE2 3.35Å; W515-Q530 HydrophobicContact CZ3-CG 3.4Å; W515-Q530 VanDerWaalsContact CZ3-CG 3.4Å; Q530-T532 PolarHBondContact O-N 3.49Å; Q530-L533 HydrophobicContact CB-CB 4.07Å; Q530-L533 HydrophobicContact CB-CD1 4.12Å; Q530-L533 HydrophobicContact CB-CG 4.37Å; Q530-L533 PolarHBondContact O-N 2.97Å; Q530-G534 PolarHBondContact O-N 2.88Å; Q530-R535 HydrophobicContact CB-CG 4.17Å; Q530-R535 PolarHBondContact N-O 2.84Å; Q530-R535 VanDerWaalsContact OE1-NH2 3.12Å
531	P	94.3	Very high	94.4	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.013	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-61.3	-41.6	-164.3	21.1	-32	0	0	0	112.9	V514 L533 G534 Y555 W805	V514-P531 HydrophobicContact CB-CG 4.42Å; V514-P531 HydrophobicContact CG1-CG 3.68Å; P531-L533 PolarHBondContact O-N 3.21Å; P531-G534 PolarHBondContact O-N 3.5Å; P531-Y555 HydrophobicContact CB-CD1 4.38Å; P531-Y555 WeakPolarHBondContact O-CA 3.39Å; P531-Y555 PolarHBondContact O-N 3.39Å; P531-W805 HydrophobicContact CB-CE3 4.04Å; P531-W805 HydrophobicContact CB-CH2 4.09Å; P531-W805 HydrophobicContact CB-CZ3 3.8Å; P531-W805 HydrophobicContact CG-CD2 4.02Å; P531-W805 HydrophobicContact CG-CE3 4.04Å; P531-W805 HydrophobicContact CG-CH2 4.03Å; P531-W805 HydrophobicContact CG-CZ2 4Å; P531-W805 HydrophobicContact CG-CZ3 4.04Å
532	T	92	Very high	93.9	Very high	77 Å²	77	27.4 Å²	27.4	47%	0.472	14%	0.138	S	C	.	.	G	3₁₀ helix	trans	-71.8	-9.8	179.2	50.8	0	0	0	0	114.4	V514 Q530 W805	V514-T532 HydrophobicContact CB-CG2 4.3Å; V514-T532 HydrophobicContact CG1-CG2 4.33Å; V514-T532 HydrophobicContact CG2-CG2 4.12Å; Q530-T532 PolarHBondContact O-N 3.49Å; T532-W805 HydrophobicContact CG2-CH2 4.46Å
533	L	93.3	Very high	93.7	Very high	67 Å²	67	26.7 Å²	26.7	35%	0.351	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-111.5	1.1	-179.6	-61	178.6	0	0	0	113	P503 Q530 P531 R535	P503-L533 HydrophobicContact CG-CD1 4.18Å; P503-L533 HydrophobicContact CG-CD2 4.25Å; Q530-L533 HydrophobicContact CB-CB 4.07Å; Q530-L533 HydrophobicContact CB-CD1 4.12Å; Q530-L533 HydrophobicContact CB-CG 4.37Å; Q530-L533 PolarHBondContact O-N 2.97Å; P531-L533 PolarHBondContact O-N 3.21Å; L533-R535 VanDerWaalsContact C-N 3.26Å; L533-R535 HydrophobicContact CB-CG 3.93Å; L533-R535 PolarHBondContact O-N 3.5Å
534	G	95.1	Very high	93.7	Very high	18 Å²	18	26.4 Å²	26.4	19%	0.186	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	38.1	179.8	0	0	0	0	0	113.4	Q530 P531 T552	Q530-G534 PolarHBondContact O-N 2.88Å; P531-G534 PolarHBondContact O-N 3.5Å; G534-T552 VanDerWaalsContact C-OG1 3.26Å; G534-T552 PolarHBondContact O-N 2.74Å; G534-T552 PolarHBondContact O-OG1 2.8Å
535	R	95.9	Very high	93.6	Very high	24 Å²	24	26.3 Å²	26.3	9%	0.091	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	155.8	-175	74	-169.8	-165.6	169.7	8.8	114.1	E499 E500 V501 Q530 L533 V550	E499-R535 IonicContact OE2-CZ 2.76Å; E499-R535 IonicContact OE2-NH1 3.61Å; E499-R535 PolarHBondContact OE2-NH1 2.94Å; E500-R535 PolarHBondContact O-NH2 2.89Å; V501-R535 PolarHBondContact O-NH2 3.23Å; V501-R535 VanDerWaalsContact O-NH2 3.08Å; Q530-R535 HydrophobicContact CB-CG 4.17Å; Q530-R535 PolarHBondContact N-O 2.84Å; Q530-R535 VanDerWaalsContact OE1-NH2 3.12Å; L533-R535 VanDerWaalsContact C-N 3.26Å; L533-R535 HydrophobicContact CB-CG 3.93Å; L533-R535 PolarHBondContact O-N 3.5Å; R535-V550 CarbonylContact C-O 3.49Å; R535-V550 VanDerWaalsContact CA-O 3.25Å; R535-V550 WeakPolarHBondContact CA-O 3.38Å; R535-V550 WeakPolarHBondContact CB-O 3.33Å
536	V	97.4	Very high	93.4	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	134.3	160.1	170.2	0	0	0	0	108.9	Y527 V528 T529 T549 V550 T552 L559	Y527-V536 HydrophobicContact CD1-CG1 3.8Å; Y527-V536 HydrophobicContact CG-CG1 4.25Å; V528-V536 CarbonylContact O-C 3.56Å; V528-V536 WeakPolarHBondContact O-CA 3.38Å; T529-V536 HydrophobicContact CG2-CG2 3.8Å; V536-T549 WeakPolarHBondContact O-CA 3.47Å; V536-V550 HydrophobicContact CB-CB 4.45Å; V536-V550 PolarHBondContact N-O 2.94Å; V536-V550 PolarHBondContact O-N 2.87Å; V536-T552 HydrophobicContact CB-CG2 4.48Å; V536-T552 HydrophobicContact CG2-CG2 3.92Å; V536-L559 HydrophobicContact CG2-CD2 4.16Å
537	L	96.3	Very high	93.2	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	133.8	170.7	-173.3	71.7	0	0	0	108.7	L494 V501 W515 V528 A546 T549	L494-L537 HydrophobicContact CD1-CD1 4.3Å; L494-L537 HydrophobicContact CD2-CD1 3.88Å; L494-L537 HydrophobicContact CG-CD1 4.46Å; V501-L537 HydrophobicContact CG1-CD2 3.94Å; W515-L537 HydrophobicContact CH2-CD2 3.82Å; W515-L537 HydrophobicContact CZ3-CD2 3.95Å; V528-L537 HydrophobicContact CG1-CB 3.92Å; V528-L537 HydrophobicContact CG1-CD2 4.43Å; V528-L537 PolarHBondContact N-O 3.5Å; V528-L537 PolarHBondContact O-N 2.86Å; L537-A546 HydrophobicContact CD1-CB 4.03Å; L537-A546 HydrophobicContact CD2-CB 4.23Å; L537-A546 HydrophobicContact CG-CB 4.26Å; L537-T549 HydrophobicContact CD1-CG2 3.67Å
538	I	95.6	Very high	92.9	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	120.6	176.2	-58.8	174.9	0	0	0	108.6	F525 Y527 V547 Q548 V550 H595	F525-I538 HydrophobicContact CB-CG2 4.03Å; F525-I538 HydrophobicContact CD1-CG2 3.84Å; F525-I538 HydrophobicContact CG-CG2 4.06Å; Y527-I538 HydrophobicContact CD1-CD1 4.28Å; Y527-I538 HydrophobicContact CD1-CG1 4Å; Y527-I538 HydrophobicContact CD2-CG1 4.35Å; Y527-I538 HydrophobicContact CD2-CG2 4.47Å; Y527-I538 HydrophobicContact CE1-CD1 3.56Å; Y527-I538 HydrophobicContact CE1-CG1 3.79Å; Y527-I538 HydrophobicContact CE2-CD1 4.21Å; Y527-I538 HydrophobicContact CE2-CG1 4.16Å; Y527-I538 HydrophobicContact CE2-CG2 4.11Å; Y527-I538 HydrophobicContact CG-CG1 4.26Å; I538-V547 HydrophobicContact CB-CG2 4.41Å; I538-V547 HydrophobicContact CG2-CG2 3.97Å; I538-V547 WeakPolarHBondContact O-CG2 3.22Å; I538-V547 PolarHBondContact O-N 2.79Å; I538-Q548 HydrophobicContact CB-CB 4.23Å; I538-Q548 HydrophobicContact CD1-CB 4.15Å; I538-Q548 HydrophobicContact CD1-CG 4.12Å; I538-Q548 PolarHBondContact N-O 3.4Å; I538-V550 HydrophobicContact CD1-CG2 3.68Å; I538-V550 HydrophobicContact CG1-CG2 4.31Å; I538-H595 HydrophobicContact CD1-CB 4.21Å
539	V	94.1	Very high	92.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	122.7	174	-176.9	0	0	0	0	108.6	I474 I488 F525 I526 K545	I474-V539 HydrophobicContact CD1-CG2 3.86Å; I488-V539 HydrophobicContact CD1-CG1 4.1Å; F525-V539 CarbonylContact C-O 3.46Å; F525-V539 VanDerWaalsContact CA-O 3.26Å; F525-V539 WeakPolarHBondContact CA-O 3.35Å; I526-V539 HydrophobicContact CB-CB 4.4Å; I526-V539 PolarHBondContact N-O 3.32Å; I526-V539 PolarHBondContact O-N 2.87Å; V539-K545 CarbonylContact C-O 3.6Å; V539-K545 WeakPolarHBondContact CA-O 3.01Å
540	D	91.8	Very high	92.6	Very high	17 Å²	17	30.9 Å²	30.9	9%	0.091	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	122.5	171.9	176.4	-69.4	0	0	0	109.1	F525 Q542 T543 Q544 K545 V547	F525-D540 HydrophobicContact CD1-CB 4.14Å; F525-D540 HydrophobicContact CE1-CB 4.08Å; D540-Q542 PolarHBondContact OD1-N 2.94Å; D540-T543 WeakPolarHBondContact CB-OG1 3.3Å; D540-T543 VanDerWaalsContact CG-OG1 3.26Å; D540-T543 WeakPolarHBondContact OD1-CB 3.31Å; D540-T543 WeakPolarHBondContact OD1-CG2 3.35Å; D540-T543 PolarHBondContact OD1-N 2.78Å; D540-T543 PolarHBondContact OD1-OG1 3Å; D540-Q544 WeakPolarHBondContact O-CA 3.47Å; D540-Q544 PolarHBondContact O-N 3.06Å; D540-K545 PolarHBondContact N-O 3.01Å; D540-K545 PolarHBondContact O-N 3.02Å; D540-V547 HydrophobicContact CB-CB 4.36Å; D540-V547 HydrophobicContact CB-CG1 3.53Å; D540-V547 HydrophobicContact CB-CG2 3.87Å
541	I	90.8	Very high	92.6	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.021	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-44.5	-174	-75.3	165	0	0	0	110.4	I462 D523 K524 I526 T543 Q544 V856	I462-I541 HydrophobicContact CG2-CG2 3.83Å; I462-I541 VanDerWaalsContact CG2-O 3.27Å; I462-I541 WeakPolarHBondContact CG2-O 3.37Å; D523-I541 VanDerWaalsContact C-CD1 3.49Å; K524-I541 WeakPolarHBondContact O-CB 3.48Å; K524-I541 PolarHBondContact O-N 3.2Å; I526-I541 HydrophobicContact CD1-CG1 4.32Å; I526-I541 HydrophobicContact CG1-CD1 3.85Å; I526-I541 HydrophobicContact CG1-CG1 3.88Å; I541-T543 VanDerWaalsContact C-N 3.29Å; I541-T543 PolarHBondContact O-N 2.83Å; I541-Q544 WeakPolarHBondContact O-CG 3.49Å; I541-Q544 PolarHBondContact O-N 2.96Å; I541-V856 HydrophobicContact CD1-CB 4.28Å; I541-V856 HydrophobicContact CD1-CG1 3.66Å; I541-V856 HydrophobicContact CD1-CG2 3.57Å; I541-V856 HydrophobicContact CG1-CG1 4.16Å; I541-V856 HydrophobicContact CG1-CG2 4.16Å; I541-V856 HydrophobicContact CG2-CG1 3.66Å
542	Q	85.4	Confident	92.7	Very high	130 Å²	130	34.1 Å²	34.1	61%	0.607	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-31.6	-175.5	-62.2	-170.5	-42.4	0	0	112.7	I462 D540	I462-Q542 VanDerWaalsContact CD1-O 3.28Å; I462-Q542 WeakPolarHBondContact CD1-O 3.42Å; D540-Q542 PolarHBondContact OD1-N 2.94Å
543	T	86.7	Confident	92.9	Very high	73 Å²	73	32 Å²	32	45%	0.448	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-7	179.6	62.4	0	0	0	0	114	D540 I541 K545	D540-T543 WeakPolarHBondContact CB-OG1 3.3Å; D540-T543 VanDerWaalsContact CG-OG1 3.26Å; D540-T543 WeakPolarHBondContact OD1-CB 3.31Å; D540-T543 WeakPolarHBondContact OD1-CG2 3.35Å; D540-T543 PolarHBondContact OD1-N 2.78Å; D540-T543 PolarHBondContact OD1-OG1 3Å; I541-T543 VanDerWaalsContact C-N 3.29Å; I541-T543 PolarHBondContact O-N 2.83Å; T543-K545 VanDerWaalsContact C-N 3.34Å; T543-K545 WeakPolarHBondContact O-CG 3.36Å; T543-K545 PolarHBondContact O-N 2.75Å
544	Q	87.4	Confident	92.9	Very high	37 Å²	37	32 Å²	32	17%	0.173	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	50.2	-176.6	-58.9	-174.3	-2.6	0	0	113.2	R486 I488 D540 I541	R486-Q544 VanDerWaalsContact CB-OE1 3.29Å; R486-Q544 HydrophobicContact CG-CB 4.33Å; R486-Q544 PolarHBondContact NH2-O 2.88Å; I488-Q544 WeakPolarHBondContact CD1-O 2.98Å; D540-Q544 WeakPolarHBondContact O-CA 3.47Å; D540-Q544 PolarHBondContact O-N 3.06Å; I541-Q544 WeakPolarHBondContact O-CG 3.49Å; I541-Q544 PolarHBondContact O-N 2.96Å
545	K	88.6	Confident	93	Very high	89 Å²	89	34.4 Å²	34.4	39%	0.387	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	149.8	-174.5	-77.1	169.8	-172.7	174.3	0	112.2	V539 D540 T543	V539-K545 CarbonylContact C-O 3.6Å; V539-K545 WeakPolarHBondContact CA-O 3.01Å; D540-K545 PolarHBondContact N-O 3.01Å; D540-K545 PolarHBondContact O-N 3.02Å; T543-K545 VanDerWaalsContact C-N 3.34Å; T543-K545 WeakPolarHBondContact O-CG 3.36Å; T543-K545 PolarHBondContact O-N 2.75Å
546	A	91.6	Very high	93	Very high	5 Å²	5	33.2 Å²	33.2	4%	0.041	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	124.5	164.2	0	0	0	0	0	110	L494 V501 L537	L494-A546 HydrophobicContact CD1-CB 4.33Å; L494-A546 HydrophobicContact CG-CB 4.05Å; V501-A546 HydrophobicContact CG2-CB 3.76Å; L537-A546 HydrophobicContact CD1-CB 4.03Å; L537-A546 HydrophobicContact CD2-CB 4.23Å; L537-A546 HydrophobicContact CG-CB 4.26Å
547	V	92.1	Very high	92.9	Very high	42 Å²	42	33.6 Å²	33.6	26%	0.255	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	-26.6	-172	-67.8	0	0	0	0	114.3	L495 I538 D540	L495-V547 HydrophobicContact CD1-CG1 4.42Å; I538-V547 HydrophobicContact CB-CG2 4.41Å; I538-V547 HydrophobicContact CG2-CG2 3.97Å; I538-V547 WeakPolarHBondContact O-CG2 3.22Å; I538-V547 PolarHBondContact O-N 2.79Å; D540-V547 HydrophobicContact CB-CB 4.36Å; D540-V547 HydrophobicContact CB-CG1 3.53Å; D540-V547 HydrophobicContact CB-CG2 3.87Å
548	Q	91.8	Very high	92.8	Very high	30 Å²	30	36.5 Å²	36.5	14%	0.14	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	147.7	-179.8	173.3	176.1	13.1	0	0	110.7	I538 V550 H595	I538-Q548 HydrophobicContact CB-CB 4.23Å; I538-Q548 HydrophobicContact CD1-CB 4.15Å; I538-Q548 HydrophobicContact CD1-CG 4.12Å; I538-Q548 PolarHBondContact N-O 3.4Å; Q548-V550 HydrophobicContact CG-CG2 4.18Å; Q548-H595 VanDerWaalsContact NE2-N 3.19Å; Q548-H595 PolarHBondContact NE2-O 3.47Å; Q548-H595 PolarHBondContact OE1-ND1 3.03Å
549	T	93.8	Very high	92.9	Very high	26 Å²	26	36.9 Å²	36.9	16%	0.16	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	145.3	159	38.2	0	0	0	0	110.9	L494 L497 E499 V536 L537	L494-T549 HydrophobicContact CD2-CG2 3.7Å; L497-T549 WeakPolarHBondContact CD1-OG1 3.47Å; E499-T549 PolarHBondContact OE2-OG1 2.74Å; V536-T549 WeakPolarHBondContact O-CA 3.47Å; L537-T549 HydrophobicContact CD1-CG2 3.67Å
550	V	95.5	Very high	93	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.024	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	117.7	175.2	-174.5	0	0	0	0	107.4	R535 V536 I538 Q548 I586 H595 T597	R535-V550 CarbonylContact C-O 3.49Å; R535-V550 VanDerWaalsContact CA-O 3.25Å; R535-V550 WeakPolarHBondContact CA-O 3.38Å; R535-V550 WeakPolarHBondContact CB-O 3.33Å; V536-V550 HydrophobicContact CB-CB 4.45Å; V536-V550 PolarHBondContact N-O 2.94Å; V536-V550 PolarHBondContact O-N 2.87Å; I538-V550 HydrophobicContact CD1-CG2 3.68Å; I538-V550 HydrophobicContact CG1-CG2 4.31Å; Q548-V550 HydrophobicContact CG-CG2 4.18Å; V550-I586 HydrophobicContact CB-CD1 4.42Å; V550-I586 HydrophobicContact CG1-CD1 3.99Å; V550-I586 HydrophobicContact CG1-CG1 4.44Å; V550-H595 HydrophobicContact CG2-CB 3.76Å; V550-T597 HydrophobicContact CG1-CG2 4.36Å
551	G	96.3	Very high	93.3	Very high	51 Å²	51	39.4 Å²	39.4	53%	0.526	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	145.6	174.6	0	0	0	0	0	111.5	T597	G551-T597 PolarHBondContact O-OG1 3.07Å
552	T	96.2	Very high	93.5	Very high	20 Å²	20	39.4 Å²	39.4	12%	0.123	21%	0.212	C	C	.	.			trans	-134.7	173.7	177.2	68.3	0	0	0	0	109.7	G534 V536 P556 V570 T597	G534-T552 VanDerWaalsContact C-OG1 3.26Å; G534-T552 PolarHBondContact O-N 2.74Å; G534-T552 PolarHBondContact O-OG1 2.8Å; V536-T552 HydrophobicContact CB-CG2 4.48Å; V536-T552 HydrophobicContact CG2-CG2 3.92Å; T552-P556 WeakPolarHBondContact OG1-CG 3.32Å; T552-V570 HydrophobicContact CG2-CG1 4.19Å; T552-T597 HydrophobicContact CG2-CG2 4.01Å
553	D	94.6	Very high	93.8	Very high	32 Å²	32	37.1 Å²	37.1	17%	0.171	20%	0.2	C	C	.	.	S	Bend	trans	-61.5	153.5	162.5	-61.3	-20.1	0	0	0	110.3	P556 S572 T582 Q584 H599	D553-P556 WeakPolarHBondContact O-CD 3.44Å; D553-S572 PolarHBondContact O-OG 2.93Å; D553-T582 WeakPolarHBondContact CB-OG1 3.24Å; D553-T582 VanDerWaalsContact OD2-CB 3.25Å; D553-T582 WeakPolarHBondContact OD2-CB 3.31Å; D553-T582 PolarHBondContact OD2-OG1 2.9Å; D553-Q584 VanDerWaalsContact CG-CD 3.48Å; D553-Q584 PolarHBondContact OD1-NE2 3.02Å; D553-Q584 PolarHBondContact OD2-NE2 2.7Å; D553-Q584 VanDerWaalsContact OD2-NE2 3.14Å; D553-H599 IonicContact OD1-CE1 3.86Å; D553-H599 IonicContact OD1-NE2 2.83Å; D553-H599 IonicContact OD2-CE1 3.32Å; D553-H599 PolarHBondContact OD2-CE1 2.97Å; D553-H599 IonicContact OD2-ND1 2.87Å; D553-H599 IonicContact OD2-NE2 3.71Å
554	P	95.1	Very high	94.1	Very high	68 Å²	68	35.1 Å²	35.1	44%	0.442	19%	0.189	S	C	.	.	S	Bend	trans	-60.8	150.4	-173.2	-22.5	33.1	0	0	0	114	S572 G574	P554-S572 WeakPolarHBondContact O-CB 3.14Å; P554-G574 PolarHBondContact O-N 2.87Å
555	Y	95.3	Very high	94.4	Very high	68 Å²	68	35.3 Å²	35.3	27%	0.267	19%	0.19	S	C	.	.	S	Bend	trans	53.1	57.9	-176	-55.1	-82.3	0	0	0	114.3	P531 V557 S572 W573 V576 W805	P531-Y555 HydrophobicContact CB-CD1 4.38Å; P531-Y555 WeakPolarHBondContact O-CA 3.39Å; P531-Y555 PolarHBondContact O-N 3.39Å; Y555-V557 PolarHBondContact O-N 2.86Å; Y555-S572 WeakPolarHBondContact O-CA 3.44Å; Y555-W573 PolarHBondContact O-N 3.36Å; Y555-V576 HydrophobicContact CD1-CG2 4.43Å; Y555-V576 HydrophobicContact CE1-CG2 3.77Å; Y555-V576 HydrophobicContact CE2-CG2 4.21Å; Y555-W805 HydrophobicContact CD1-CH2 4.17Å; Y555-W805 AromaticContact CD1-CZ3 3.97Å; Y555-W805 HydrophobicContact CD1-CZ3 3.97Å; Y555-W805 HydrophobicContact CE1-CH2 4.41Å
556	P	96.6	Very high	94.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	125.2	166.2	30.4	-38.9	0	0	0	110.3	S516 T529 T552 D553 V570 S572	S516-P556 PolarHBondContact OG-O 3.44Å; T529-P556 WeakPolarHBondContact CB-O 3.31Å; T529-P556 HydrophobicContact CG2-CB 3.7Å; T529-P556 HydrophobicContact CG2-CG 4.23Å; T552-P556 WeakPolarHBondContact OG1-CG 3.32Å; D553-P556 WeakPolarHBondContact O-CD 3.44Å; P556-V570 HydrophobicContact CB-CG1 3.97Å; P556-S572 VanDerWaalsContact CA-OG 3.27Å; P556-S572 WeakPolarHBondContact CA-OG 3.27Å
557	V	94.8	Very high	94.9	Very high	8 Å²	8	32.2 Å²	32.2	5%	0.048	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	-27.6	-170.3	-74.7	0	0	0	0	116	S517 Y555 L571 W573 W805	S517-V557 WeakPolarHBondContact CB-O 3.46Å; Y555-V557 PolarHBondContact O-N 2.86Å; V557-L571 HydrophobicContact CG2-CD2 4.45Å; V557-L571 HydrophobicContact CG2-CG 4.3Å; V557-L571 WeakPolarHBondContact CG2-O 3.01Å; V557-L571 PolarHBondContact N-O 2.83Å; V557-W573 HydrophobicContact CB-CD2 4.47Å; V557-W573 HydrophobicContact CB-CZ2 4.19Å; V557-W573 HydrophobicContact CG1-CD2 3.76Å; V557-W573 HydrophobicContact CG1-CE3 3.93Å; V557-W573 HydrophobicContact CG1-CG 4.31Å; V557-W573 HydrophobicContact CG1-CH2 4.05Å; V557-W573 HydrophobicContact CG1-CZ2 3.9Å; V557-W573 HydrophobicContact CG1-CZ3 4.08Å; V557-W573 HydrophobicContact CG2-CD2 4.06Å; V557-W573 HydrophobicContact CG2-CG 4.04Å; V557-W573 HydrophobicContact CG2-CZ2 4.1Å; V557-W573 VanDerWaalsContact CG2-NE1 3.32Å; V557-W805 HydrophobicContact CG1-CE3 4.08Å
558	K	95.8	Very high	95.2	Very high	61 Å²	61	30.2 Å²	30.2	27%	0.265	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	126.3	-178.1	-177.2	-171.9	-174.3	-176.2	0	109.7	L571 D612 F613	K558-L571 HydrophobicContact CB-CB 4.11Å; K558-L571 HydrophobicContact CB-CD2 4.22Å; K558-L571 HydrophobicContact CD-CD2 4.4Å; K558-L571 PolarHBondContact N-O 2.85Å; K558-L571 PolarHBondContact O-N 2.86Å; K558-D612 WeakPolarHBondContact CD-OD1 3.46Å; K558-D612 WeakPolarHBondContact CE-OD1 3.32Å; K558-D612 IonicContact NZ-OD1 3.12Å; K558-D612 PolarHBondContact NZ-OD1 2.87Å; K558-D612 IonicContact NZ-OD2 3.27Å; K558-D612 PolarHBondContact NZ-OD2 3.09Å; K558-F613 HydrophobicContact CD-CD1 4.27Å; K558-F613 HydrophobicContact CD-CE1 3.85Å; K558-F613 HydrophobicContact CG-CE1 4.21Å; K558-F613 PolarHBondContact NZ-O 3.25Å
559	L	97.3	Very high	95.5	Very high	9 Å²	9	28.9 Å²	28.9	5%	0.047	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	148	167.5	-61.8	-175.2	0	0	0	110.5	S517 V519 Y527 T529 V536 V568 W569 V570	S517-L559 PolarHBondContact OG-N 2.82Å; V519-L559 HydrophobicContact CB-CB 4.44Å; V519-L559 HydrophobicContact CG1-CB 3.77Å; V519-L559 HydrophobicContact CG2-CB 3.89Å; V519-L559 HydrophobicContact CG2-CD1 4.01Å; Y527-L559 VanDerWaalsContact O-CD1 3.25Å; Y527-L559 WeakPolarHBondContact O-CD1 3.26Å; T529-L559 HydrophobicContact CG2-CD1 3.96Å; T529-L559 HydrophobicContact CG2-CD2 3.59Å; T529-L559 HydrophobicContact CG2-CG 3.63Å; V536-L559 HydrophobicContact CG2-CD2 4.16Å; L559-V568 HydrophobicContact CD1-CG1 4.48Å; L559-V568 HydrophobicContact CD2-CG1 3.98Å; L559-W569 VanDerWaalsContact CA-O 3.3Å; L559-W569 WeakPolarHBondContact CA-O 3.36Å; L559-V570 HydrophobicContact CD2-CB 4.12Å; L559-V570 HydrophobicContact CD2-CG1 3.97Å; L559-V570 HydrophobicContact CD2-CG2 3.74Å
560	H	96.8	Very high	95.6	Very high	48 Å²	48	27.6 Å²	27.6	22%	0.222	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	138.9	162	-174.6	97.4	0	0	0	108.5	V568 W569 F613 I615	H560-V568 CarbonylContact O-C 3.58Å; H560-V568 WeakPolarHBondContact O-CA 3.24Å; H560-W569 HydrophobicContact CB-CB 4.47Å; H560-W569 PolarHBondContact N-O 3.33Å; H560-W569 PolarHBondContact O-N 3.11Å; H560-F613 HydrophobicContact CB-CE2 3.63Å; H560-F613 HydrophobicContact CB-CZ 3.61Å; H560-I615 PolarHBondContact CE1-O 2.84Å; H560-I615 WeakPolarHBondContact NE2-CG2 3.46Å
561	Y	96.3	Very high	95.7	Very high	22 Å²	22	27.6 Å²	27.6	9%	0.086	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	111.1	176.1	175.7	-121	0	0	0	110.6	N520 V521 K522 K563 D566 Q567 V568 A589	N520-Y561 VanDerWaalsContact O-CD1 3.23Å; N520-Y561 WeakPolarHBondContact O-CD1 3.37Å; V521-Y561 HydrophobicContact CB-CD2 4.45Å; V521-Y561 HydrophobicContact CB-CE2 4.42Å; V521-Y561 HydrophobicContact CG1-CD2 4.19Å; V521-Y561 HydrophobicContact CG1-CE1 4.37Å; V521-Y561 HydrophobicContact CG1-CE2 3.73Å; V521-Y561 HydrophobicContact CG2-CD1 4.42Å; V521-Y561 HydrophobicContact CG2-CD2 3.83Å; V521-Y561 HydrophobicContact CG2-CE2 4.24Å; V521-Y561 HydrophobicContact CG2-CG 3.96Å; K522-Y561 WeakPolarHBondContact CE-OH 3.47Å; K522-Y561 HydrophobicContact CG-CE1 4.19Å; K522-Y561 WeakPolarHBondContact CG-OH 3.3Å; Y561-K563 HydrophobicContact CD1-CG 4.01Å; Y561-K563 HydrophobicContact CE1-CB 4.31Å; Y561-K563 HydrophobicContact CE1-CG 3.61Å; Y561-K563 PolarHBondContact O-N 2.76Å; Y561-D566 PolarHBondContact OH-OD1 2.77Å; Y561-Q567 VanDerWaalsContact CD2-O 3.29Å; Y561-Q567 WeakPolarHBondContact CD2-O 3.27Å; Y561-V568 HydrophobicContact CD2-CG2 3.72Å; Y561-V568 HydrophobicContact CG-CG2 4.47Å; Y561-A589 HydrophobicContact CE2-CB 4.44Å
562	D	95.6	Very high	95.6	Very high	5 Å²	5	25.2 Å²	25.2	3%	0.027	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	101.4	172.1	179.7	-3.8	0	0	0	109.3	S564 H565 D566 Q567	D562-S564 PolarHBondContact O-N 2.87Å; D562-S564 WeakPolarHBondContact OD1-CA 3.41Å; D562-S564 WeakPolarHBondContact OD1-CB 3.33Å; D562-S564 PolarHBondContact OD1-N 2.77Å; D562-S564 PolarHBondContact OD1-OG 3.08Å; D562-H565 PolarHBondContact OD1-N 3.42Å; D562-H565 IonicContact OD1-ND1 3.64Å; D562-H565 IonicContact OD2-CE1 3.65Å; D562-H565 IonicContact OD2-CG 2.71Å; D562-H565 IonicContact OD2-ND1 3.21Å; D562-H565 PolarHBondContact OD2-ND1 2.04Å; D562-D566 WeakPolarHBondContact O-CA 3.48Å; D562-D566 PolarHBondContact O-N 2.82Å; D562-D566 VanDerWaalsContact O-N 3.09Å; D562-Q567 HydrophobicContact CB-CB 4.36Å; D562-Q567 PolarHBondContact N-O 2.89Å; D562-Q567 PolarHBondContact O-N 3.48Å
563	K	92.6	Very high	95.5	Very high	81 Å²	81	25.4 Å²	25.4	35%	0.352	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-26.1	174.7	-85.6	-173.6	170.5	-173.4	0	112.7	Y561 S859	Y561-K563 HydrophobicContact CD1-CG 4.01Å; Y561-K563 HydrophobicContact CE1-CB 4.31Å; Y561-K563 HydrophobicContact CE1-CG 3.61Å; Y561-K563 PolarHBondContact O-N 2.76Å; K563-S859 VanDerWaalsContact NZ-C 3.26Å; K563-S859 PolarHBondContact NZ-O 3.35Å; K563-S859 PolarHBondContact NZ-OG 2.64Å
564	S	92.4	Very high	95.3	Very high	32 Å²	32	24.9 Å²	24.9	22%	0.224	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-40.6	-172.8	67.5	0	0	0	0	114.4	D562 N623 V625	D562-S564 PolarHBondContact O-N 2.87Å; D562-S564 WeakPolarHBondContact OD1-CA 3.41Å; D562-S564 WeakPolarHBondContact OD1-CB 3.33Å; D562-S564 PolarHBondContact OD1-N 2.77Å; D562-S564 PolarHBondContact OD1-OG 3.08Å; S564-N623 VanDerWaalsContact CB-O 3.28Å; S564-N623 WeakPolarHBondContact CB-O 3.37Å; S564-V625 PolarHBondContact OG-N 2.83Å
565	H	94.2	Very high	95.1	Very high	40 Å²	40	23.1 Å²	23.1	19%	0.185	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-2.7	175.8	-60.2	99	0	0	0	114.3	D562 Q567 H624 V625	D562-H565 PolarHBondContact OD1-N 3.42Å; D562-H565 IonicContact OD1-ND1 3.64Å; D562-H565 IonicContact OD2-CE1 3.65Å; D562-H565 IonicContact OD2-CG 2.71Å; D562-H565 IonicContact OD2-ND1 3.21Å; D562-H565 PolarHBondContact OD2-ND1 2.04Å; H565-Q567 HydrophobicContact CB-CG 3.79Å; H565-H624 AromaticContact NE2-NE2 3.94Å; H565-V625 PolarHBondContact CE1-O 2.93Å; H565-V625 VanDerWaalsContact CE1-O 3.3Å
566	D	95.1	Very high	94.6	Very high	22 Å²	22	23.5 Å²	23.5	12%	0.118	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	46.2	-173	-160.3	34.7	0	0	0	113.4	K522 Y561 D562 Q588 A589 S590	K522-D566 WeakPolarHBondContact CE-OD1 3.43Å; K522-D566 IonicContact NZ-OD1 2.75Å; K522-D566 PolarHBondContact NZ-OD1 3.49Å; K522-D566 IonicContact NZ-OD2 3.3Å; K522-D566 PolarHBondContact NZ-OD2 3.45Å; Y561-D566 PolarHBondContact OH-OD1 2.77Å; D562-D566 WeakPolarHBondContact O-CA 3.48Å; D562-D566 PolarHBondContact O-N 2.82Å; D562-D566 VanDerWaalsContact O-N 3.09Å; D566-Q588 PolarHBondContact O-N 3.04Å; D566-A589 PolarHBondContact O-N 3.22Å; D566-S590 VanDerWaalsContact CG-OG 3.25Å; D566-S590 VanDerWaalsContact OD1-CB 3.28Å; D566-S590 WeakPolarHBondContact OD1-CB 3.23Å; D566-S590 PolarHBondContact OD1-N 2.96Å; D566-S590 PolarHBondContact OD1-OG 2.93Å; D566-S590 WeakPolarHBondContact OD2-CB 3.42Å; D566-S590 PolarHBondContact OD2-N 2.87Å; D566-S590 VanDerWaalsContact OD2-N 3.08Å; D566-S590 PolarHBondContact OD2-OG 3.19Å
567	Q	95.9	Very high	94.2	Very high	7 Å²	7	29.9 Å²	29.9	3%	0.033	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135.5	-174.8	-68.5	173.9	-0	0	0	111.6	Y561 D562 H565 V585 I586 L643	Y561-Q567 VanDerWaalsContact CD2-O 3.29Å; Y561-Q567 WeakPolarHBondContact CD2-O 3.27Å; D562-Q567 HydrophobicContact CB-CB 4.36Å; D562-Q567 PolarHBondContact N-O 2.89Å; D562-Q567 PolarHBondContact O-N 3.48Å; H565-Q567 HydrophobicContact CB-CG 3.79Å; Q567-V585 HydrophobicContact CB-CG1 3.83Å; Q567-V585 HydrophobicContact CG-CG1 3.93Å; Q567-I586 WeakPolarHBondContact CA-O 3.38Å; Q567-L643 PolarHBondContact NE2-O 3.15Å; Q567-L643 PolarHBondContact OE1-O 2.76Å
568	V	97.7	Very high	93.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	114.6	164.7	173.9	0	0	0	0	108.9	V519 V521 Y527 L559 H560 Y561 V570 I586 A589	V519-V568 HydrophobicContact CG2-CG1 4.14Å; V519-V568 HydrophobicContact CG2-CG2 4.24Å; V521-V568 HydrophobicContact CG2-CG2 3.64Å; Y527-V568 HydrophobicContact CD1-CB 4.22Å; Y527-V568 HydrophobicContact CD1-CG1 4.14Å; Y527-V568 HydrophobicContact CD1-CG2 3.99Å; Y527-V568 HydrophobicContact CD2-CG2 4.38Å; Y527-V568 HydrophobicContact CE1-CG2 4.31Å; Y527-V568 HydrophobicContact CG-CG1 4.48Å; Y527-V568 HydrophobicContact CG-CG2 4.06Å; L559-V568 HydrophobicContact CD1-CG1 4.48Å; L559-V568 HydrophobicContact CD2-CG1 3.98Å; H560-V568 CarbonylContact O-C 3.58Å; H560-V568 WeakPolarHBondContact O-CA 3.24Å; Y561-V568 HydrophobicContact CD2-CG2 3.72Å; Y561-V568 HydrophobicContact CG-CG2 4.47Å; V568-V570 HydrophobicContact CG1-CG2 4.37Å; V568-I586 HydrophobicContact CB-CB 4.35Å; V568-I586 PolarHBondContact N-O 2.82Å; V568-I586 PolarHBondContact O-N 3.1Å; V568-A589 HydrophobicContact CB-CB 4.45Å; V568-A589 HydrophobicContact CG2-CB 3.72Å
569	W	97.3	Very high	93.4	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.008	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	134.8	175.8	-70.8	65.5	0	0	0	109.7	L559 H560 L583 V585 T600 F613 I615 I641 L643 T646	L559-W569 VanDerWaalsContact CA-O 3.3Å; L559-W569 WeakPolarHBondContact CA-O 3.36Å; H560-W569 HydrophobicContact CB-CB 4.47Å; H560-W569 PolarHBondContact N-O 3.33Å; H560-W569 PolarHBondContact O-N 3.11Å; W569-L583 HydrophobicContact CE3-CD1 4.29Å; W569-L583 HydrophobicContact CE3-CD2 3.86Å; W569-L583 HydrophobicContact CE3-CG 4.04Å; W569-L583 HydrophobicContact CZ3-CD2 3.76Å; W569-L583 HydrophobicContact CZ3-CG 4.28Å; W569-V585 HydrophobicContact CD2-CG2 3.62Å; W569-V585 HydrophobicContact CE3-CG2 3.74Å; W569-V585 HydrophobicContact CG-CG2 4.17Å; W569-V585 HydrophobicContact CH2-CG2 4.03Å; W569-V585 HydrophobicContact CZ2-CG2 3.9Å; W569-V585 HydrophobicContact CZ3-CG2 3.97Å; W569-T600 HydrophobicContact CE3-CG2 4.31Å; W569-T600 HydrophobicContact CH2-CG2 3.95Å; W569-T600 HydrophobicContact CZ3-CG2 3.54Å; W569-F613 HydrophobicContact CB-CE2 3.62Å; W569-F613 HydrophobicContact CB-CZ 3.68Å; W569-F613 HydrophobicContact CG-CE2 4.25Å; W569-I615 HydrophobicContact CB-CD1 4.44Å; W569-I615 HydrophobicContact CD2-CD1 3.75Å; W569-I615 HydrophobicContact CE3-CD1 4.37Å; W569-I615 HydrophobicContact CG-CD1 3.73Å; W569-I641 HydrophobicContact CH2-CD1 3.77Å; W569-I641 HydrophobicContact CH2-CG1 4.27Å; W569-I641 HydrophobicContact CZ3-CD1 4Å; W569-L643 HydrophobicContact CH2-CD2 3.72Å; W569-L643 HydrophobicContact CZ2-CB 4.45Å; W569-L643 HydrophobicContact CZ2-CD2 3.39Å; W569-T646 HydrophobicContact CH2-CG2 4.21Å; W569-T646 HydrophobicContact CZ2-CG2 4.05Å
570	V	97.3	Very high	92.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	115.6	-171.9	-169.8	0	0	0	0	109.1	T552 P556 L559 V568 Q584 I586	T552-V570 HydrophobicContact CG2-CG1 4.19Å; P556-V570 HydrophobicContact CB-CG1 3.97Å; L559-V570 HydrophobicContact CD2-CB 4.12Å; L559-V570 HydrophobicContact CD2-CG1 3.97Å; L559-V570 HydrophobicContact CD2-CG2 3.74Å; V568-V570 HydrophobicContact CG1-CG2 4.37Å; V570-Q584 HydrophobicContact CB-CB 4.34Å; V570-Q584 PolarHBondContact N-O 3.34Å; V570-Q584 PolarHBondContact O-N 2.99Å; V570-I586 HydrophobicContact CG2-CD1 4.14Å; V570-I586 HydrophobicContact CG2-CG1 4.31Å
571	L	96	Very high	92.7	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.5	169.4	175.4	66.9	0	0	0	109.5	V557 K558 L583 V610 F613	V557-L571 HydrophobicContact CG2-CD2 4.45Å; V557-L571 HydrophobicContact CG2-CG 4.3Å; V557-L571 WeakPolarHBondContact CG2-O 3.01Å; V557-L571 PolarHBondContact N-O 2.83Å; K558-L571 HydrophobicContact CB-CB 4.11Å; K558-L571 HydrophobicContact CB-CD2 4.22Å; K558-L571 HydrophobicContact CD-CD2 4.4Å; K558-L571 PolarHBondContact N-O 2.85Å; K558-L571 PolarHBondContact O-N 2.86Å; L571-L583 HydrophobicContact CB-CD1 4.32Å; L571-V610 HydrophobicContact CD1-CB 4.17Å; L571-V610 HydrophobicContact CD1-CG1 3.73Å; L571-F613 HydrophobicContact CB-CD1 4.11Å; L571-F613 HydrophobicContact CB-CE1 3.86Å; L571-F613 HydrophobicContact CD2-CD1 4.45Å
572	S	95.2	Very high	92.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	147.3	173.3	-79.6	0	0	0	0	110.8	D553 P554 Y555 P556 P581 T582	D553-S572 PolarHBondContact O-OG 2.93Å; P554-S572 WeakPolarHBondContact O-CB 3.14Å; Y555-S572 WeakPolarHBondContact O-CA 3.44Å; P556-S572 VanDerWaalsContact CA-OG 3.27Å; P556-S572 WeakPolarHBondContact CA-OG 3.27Å; S572-P581 CarbonylContact O-C 3.48Å; S572-P581 WeakPolarHBondContact O-CA 3.47Å; S572-P581 WeakPolarHBondContact O-CB 3.04Å; S572-T582 PolarHBondContact N-O 2.62Å; S572-T582 PolarHBondContact O-N 3.18Å
573	W	93.7	Very high	92.4	Very high	24 Å²	24	37 Å²	37	9%	0.091	19%	0.188	C	C	.	.			trans	-87.8	-17.6	177.1	-71.5	-16.9	0	0	0	114.4	Y555 V557 D575 K578 F580 W805	Y555-W573 PolarHBondContact O-N 3.36Å; V557-W573 HydrophobicContact CB-CD2 4.47Å; V557-W573 HydrophobicContact CB-CZ2 4.19Å; V557-W573 HydrophobicContact CG1-CD2 3.76Å; V557-W573 HydrophobicContact CG1-CE3 3.93Å; V557-W573 HydrophobicContact CG1-CG 4.31Å; V557-W573 HydrophobicContact CG1-CH2 4.05Å; V557-W573 HydrophobicContact CG1-CZ2 3.9Å; V557-W573 HydrophobicContact CG1-CZ3 4.08Å; V557-W573 HydrophobicContact CG2-CD2 4.06Å; V557-W573 HydrophobicContact CG2-CG 4.04Å; V557-W573 HydrophobicContact CG2-CZ2 4.1Å; V557-W573 VanDerWaalsContact CG2-NE1 3.32Å; W573-D575 WeakPolarHBondContact CB-O 3.48Å; W573-D575 PolarHBondContact O-N 2.85Å; W573-K578 HydrophobicContact CB-CB 4.41Å; W573-K578 HydrophobicContact CB-CG 4.08Å; W573-K578 HydrophobicContact CD2-CD 3.7Å; W573-K578 HydrophobicContact CD2-CG 3.73Å; W573-K578 HydrophobicContact CE3-CD 4.2Å; W573-K578 HydrophobicContact CE3-CG 4.04Å; W573-K578 HydrophobicContact CG-CB 4.37Å; W573-K578 HydrophobicContact CG-CD 3.96Å; W573-K578 HydrophobicContact CG-CG 3.74Å; W573-K578 HydrophobicContact CZ2-CD 4.23Å; W573-K578 VanDerWaalsContact CZ2-CE 3.47Å; W573-F580 CarbonylContact O-C 3.22Å; W573-W805 HydrophobicContact CZ3-CE3 4.16Å; W573-W805 HydrophobicContact CZ3-CZ3 4.44Å
574	G	90.3	Very high	92.5	Very high	21 Å²	21	33.3 Å²	33.3	22%	0.216	17%	0.172	C	C	.	.	S	Bend	trans	77.5	-47.3	-176	0	0	0	0	0	113.1	P554	P554-G574 PolarHBondContact O-N 2.87Å
575	D	90.2	Very high	92.6	Very high	31 Å²	31	31.9 Å²	31.9	17%	0.166	16%	0.161	C	C	.	.	S	Bend	trans	-140.1	-176.7	169	56.9	24.1	0	0	0	111.3	W573 K578 N579	W573-D575 WeakPolarHBondContact CB-O 3.48Å; W573-D575 PolarHBondContact O-N 2.85Å; D575-K578 WeakPolarHBondContact OD1-CA 3.45Å; D575-K578 PolarHBondContact OD1-N 2.87Å; D575-N579 PolarHBondContact OD1-N 2.78Å; D575-N579 WeakPolarHBondContact OD2-CB 3.43Å; D575-N579 PolarHBondContact OD2-ND2 2.86Å
576	V	86.8	Confident	92.8	Very high	77 Å²	77	30 Å²	30	47%	0.467	15%	0.153	S	C	.	.	S	Bend	trans	-77	-31	-177.4	-178.6	0	0	0	0	110.9	Y555 K578	Y555-V576 HydrophobicContact CD1-CG2 4.43Å; Y555-V576 HydrophobicContact CE1-CG2 3.77Å; Y555-V576 HydrophobicContact CE2-CG2 4.21Å; V576-K578 VanDerWaalsContact C-N 3.31Å
577	E	87.4	Confident	92.7	Very high	133 Å²	133	32 Å²	32	62%	0.621	16%	0.164	S	C	*	.	S	Bend	trans	-74	-18.5	177.9	-66.8	71.3	-160.5	0	0	113.1	N579	E577-N579 WeakPolarHBondContact CB-ND2 3.38Å
578	K	87.9	Confident	92.7	Very high	69 Å²	69	37.8 Å²	37.8	30%	0.3	19%	0.191	S	C	.	.			trans	68.4	40.1	-179.6	-37.9	-177.8	-168.8	-172.6	0	113.5	W573 D575 V576 P581	W573-K578 HydrophobicContact CB-CB 4.41Å; W573-K578 HydrophobicContact CB-CG 4.08Å; W573-K578 HydrophobicContact CD2-CD 3.7Å; W573-K578 HydrophobicContact CD2-CG 3.73Å; W573-K578 HydrophobicContact CE3-CD 4.2Å; W573-K578 HydrophobicContact CE3-CG 4.04Å; W573-K578 HydrophobicContact CG-CB 4.37Å; W573-K578 HydrophobicContact CG-CD 3.96Å; W573-K578 HydrophobicContact CG-CG 3.74Å; W573-K578 HydrophobicContact CZ2-CD 4.23Å; W573-K578 VanDerWaalsContact CZ2-CE 3.47Å; D575-K578 WeakPolarHBondContact OD1-CA 3.45Å; D575-K578 PolarHBondContact OD1-N 2.87Å; V576-K578 VanDerWaalsContact C-N 3.31Å; K578-P581 WeakPolarHBondContact O-CD 3.43Å
579	N	85.4	Confident	92.5	Very high	89 Å²	89	37.8 Å²	37.8	48%	0.476	19%	0.191	S	C	.	.	S	Bend	trans	-75.3	-30.7	178.1	-59.7	-60.2	0	0	0	112.7	D575 E577 P581	D575-N579 PolarHBondContact OD1-N 2.78Å; D575-N579 WeakPolarHBondContact OD2-CB 3.43Å; D575-N579 PolarHBondContact OD2-ND2 2.86Å; E577-N579 WeakPolarHBondContact CB-ND2 3.38Å; N579-P581 VanDerWaalsContact C-CD 3.44Å
580	F	87.4	Confident	92.4	Very high	128 Å²	128	38.3 Å²	38.3	56%	0.561	20%	0.195	S	C	*	.	S	Bend	trans	-129	55	-173.5	-52	-75.9	0	0	0	112.9	W573	W573-F580 CarbonylContact O-C 3.22Å
581	P	91.3	Very high	92.2	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.019	21%	0.205	C	C	.	.			trans	-82.3	134.9	-174.7	36.1	-36.6	0	0	0	111.3	S572 K578 N579 D608 R609 V610	S572-P581 CarbonylContact O-C 3.48Å; S572-P581 WeakPolarHBondContact O-CA 3.47Å; S572-P581 WeakPolarHBondContact O-CB 3.04Å; K578-P581 WeakPolarHBondContact O-CD 3.43Å; N579-P581 VanDerWaalsContact C-CD 3.44Å; P581-D608 WeakPolarHBondContact O-CA 3.46Å; P581-R609 PolarHBondContact O-N 3.26Å; P581-V610 VanDerWaalsContact CB-O 3.27Å; P581-V610 WeakPolarHBondContact CB-O 3.43Å; P581-V610 WeakPolarHBondContact CG-O 3.26Å; P581-V610 PolarHBondContact O-N 3.09Å
582	T	91.9	Very high	91.6	Very high	11 Å²	11	47.6 Å²	47.6	7%	0.067	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	159	-168.2	59.5	0	0	0	0	112	D553 S572	D553-T582 WeakPolarHBondContact CB-OG1 3.24Å; D553-T582 VanDerWaalsContact OD2-CB 3.25Å; D553-T582 WeakPolarHBondContact OD2-CB 3.31Å; D553-T582 PolarHBondContact OD2-OG1 2.9Å; S572-T582 PolarHBondContact N-O 2.62Å; S572-T582 PolarHBondContact O-N 3.18Å
583	L	94	Very high	91.1	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.016	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	121.4	178.2	-165.7	63.9	0	0	0	110.8	W569 L571 T600 V610 F613 I630	W569-L583 HydrophobicContact CE3-CD1 4.29Å; W569-L583 HydrophobicContact CE3-CD2 3.86Å; W569-L583 HydrophobicContact CE3-CG 4.04Å; W569-L583 HydrophobicContact CZ3-CD2 3.76Å; W569-L583 HydrophobicContact CZ3-CG 4.28Å; L571-L583 HydrophobicContact CB-CD1 4.32Å; L583-T600 HydrophobicContact CB-CG2 4.41Å; L583-T600 HydrophobicContact CD2-CG2 4.08Å; L583-T600 HydrophobicContact CG-CG2 4.07Å; L583-T600 PolarHBondContact O-N 3.2Å; L583-V610 HydrophobicContact CB-CG1 4.39Å; L583-V610 HydrophobicContact CB-CG2 4.16Å; L583-V610 HydrophobicContact CD2-CG1 4.42Å; L583-F613 HydrophobicContact CD1-CD1 3.72Å; L583-F613 HydrophobicContact CD1-CE1 3.98Å; L583-F613 HydrophobicContact CD1-CG 4.06Å; L583-F613 HydrophobicContact CD2-CB 4.44Å; L583-I630 HydrophobicContact CD2-CD1 3.53Å; L583-I630 HydrophobicContact CD2-CG1 3.93Å
584	Q	94.6	Very high	90.7	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.019	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	155.1	-179.9	-71.5	-178.9	-31.3	0	0	110.4	D553 V570 T597 V598 H599	D553-Q584 VanDerWaalsContact CG-CD 3.48Å; D553-Q584 PolarHBondContact OD1-NE2 3.02Å; D553-Q584 PolarHBondContact OD2-NE2 2.7Å; D553-Q584 VanDerWaalsContact OD2-NE2 3.14Å; V570-Q584 HydrophobicContact CB-CB 4.34Å; V570-Q584 PolarHBondContact N-O 3.34Å; V570-Q584 PolarHBondContact O-N 2.99Å; Q584-T597 HydrophobicContact CB-CG2 3.99Å; Q584-V598 CarbonylContact C-O 3.56Å; Q584-V598 WeakPolarHBondContact CA-O 3.01Å; Q584-H599 PolarHBondContact NE2-CE1 2.78Å; Q584-H599 VanDerWaalsContact NE2-CE1 3.28Å; Q584-H599 PolarHBondContact NE2-NE2 2.96Å
585	V	95.7	Very high	90.8	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	135.6	179.8	-175.1	0	0	0	0	109.8	Q567 W569 V598 T600 T646	Q567-V585 HydrophobicContact CB-CG1 3.83Å; Q567-V585 HydrophobicContact CG-CG1 3.93Å; W569-V585 HydrophobicContact CD2-CG2 3.62Å; W569-V585 HydrophobicContact CE3-CG2 3.74Å; W569-V585 HydrophobicContact CG-CG2 4.17Å; W569-V585 HydrophobicContact CH2-CG2 4.03Å; W569-V585 HydrophobicContact CZ2-CG2 3.9Å; W569-V585 HydrophobicContact CZ3-CG2 3.97Å; V585-V598 PolarHBondContact N-O 3.06Å; V585-V598 PolarHBondContact O-N 2.97Å; V585-T600 HydrophobicContact CG2-CG2 3.87Å; V585-T646 HydrophobicContact CG2-CG2 4.27Å
586	I	96.8	Very high	90.9	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	113.4	169.4	-56	170.6	0	0	0	107.5	Y527 V550 Q567 V568 V570 H595 T597	Y527-I586 HydrophobicContact CD1-CD1 4.08Å; Y527-I586 HydrophobicContact CE1-CD1 4.01Å; Y527-I586 HydrophobicContact CE1-CG2 4.14Å; V550-I586 HydrophobicContact CB-CD1 4.42Å; V550-I586 HydrophobicContact CG1-CD1 3.99Å; V550-I586 HydrophobicContact CG1-CG1 4.44Å; Q567-I586 WeakPolarHBondContact CA-O 3.38Å; V568-I586 HydrophobicContact CB-CB 4.35Å; V568-I586 PolarHBondContact N-O 2.82Å; V568-I586 PolarHBondContact O-N 3.1Å; V570-I586 HydrophobicContact CG2-CD1 4.14Å; V570-I586 HydrophobicContact CG2-CG1 4.31Å; I586-H595 HydrophobicContact CG2-CB 3.79Å; I586-T597 HydrophobicContact CD1-CG2 4.33Å; I586-T597 HydrophobicContact CG1-CG2 3.86Å
587	N	94.9	Very high	91.2	Very high	66 Å²	66	56.5 Å²	56.5	35%	0.353	29%	0.289	S	S	.	.			trans	-86.2	156.4	-178.6	-65.6	-71.7	0	0	0	112.1	A589	N587-A589 VanDerWaalsContact C-N 3.29Å; N587-A589 PolarHBondContact O-N 3.35Å
588	Q	94.3	Very high	91.3	Very high	127 Å²	127	53 Å²	53	59%	0.593	28%	0.277	S	S	*	.	S	Bend	trans	58.1	35.4	177.8	-56.4	-175.2	-19.4	0	0	113.9	D566 S590 G591 H595	D566-Q588 PolarHBondContact O-N 3.04Å; Q588-S590 PolarHBondContact O-N 2.7Å; Q588-G591 WeakPolarHBondContact O-CA 3.49Å; Q588-G591 PolarHBondContact O-N 2.94Å; Q588-H595 PolarHBondContact O-NE2 3.32Å
589	A	94.8	Very high	91.4	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.4	-166.8	0	0	0	0	0	115.2	V521 Y527 Y561 D566 V568 N587 G591	V521-A589 HydrophobicContact CG1-CB 3.88Å; V521-A589 WeakPolarHBondContact CG1-O 3.4Å; Y527-A589 HydrophobicContact CE1-CB 4.43Å; Y527-A589 HydrophobicContact CE2-CB 4.33Å; Y527-A589 PolarHBondContact OH-O 2.04Å; Y527-A589 VanDerWaalsContact OH-O 3.07Å; Y561-A589 HydrophobicContact CE2-CB 4.44Å; D566-A589 PolarHBondContact O-N 3.22Å; V568-A589 HydrophobicContact CB-CB 4.45Å; V568-A589 HydrophobicContact CG2-CB 3.72Å; N587-A589 VanDerWaalsContact C-N 3.29Å; N587-A589 PolarHBondContact O-N 3.35Å; A589-G591 VanDerWaalsContact C-N 3.31Å
590	S	94.6	Very high	91.3	Very high	14 Å²	14	50.1 Å²	50.1	10%	0.098	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	4.9	172.6	76.5	0	0	0	0	114.3	K522 K524 D566 Q588	K522-S590 WeakPolarHBondContact CD-OG 3.24Å; K522-S590 WeakPolarHBondContact CE-OG 3.36Å; K522-S590 PolarHBondContact NZ-OG 3.04Å; K524-S590 PolarHBondContact NZ-O 2.8Å; D566-S590 VanDerWaalsContact CG-OG 3.25Å; D566-S590 VanDerWaalsContact OD1-CB 3.28Å; D566-S590 WeakPolarHBondContact OD1-CB 3.23Å; D566-S590 PolarHBondContact OD1-N 2.96Å; D566-S590 PolarHBondContact OD1-OG 2.93Å; D566-S590 WeakPolarHBondContact OD2-CB 3.42Å; D566-S590 PolarHBondContact OD2-N 2.87Å; D566-S590 VanDerWaalsContact OD2-N 3.08Å; D566-S590 PolarHBondContact OD2-OG 3.19Å; Q588-S590 PolarHBondContact O-N 2.7Å
591	G	92.4	Very high	91	Very high	21 Å²	21	48.6 Å²	48.6	22%	0.216	26%	0.257	C	S	.	.	S	Bend	trans	-86.1	170.8	179.2	0	0	0	0	0	114.2	F525 Q588 A589 H595	F525-G591 VanDerWaalsContact CE2-O 3.27Å; F525-G591 WeakPolarHBondContact CE2-O 3.47Å; Q588-G591 WeakPolarHBondContact O-CA 3.49Å; Q588-G591 PolarHBondContact O-N 2.94Å; A589-G591 VanDerWaalsContact C-N 3.31Å; G591-H595 PolarHBondContact O-CE1 2.93Å
592	K	83.4	Confident	90.3	Very high	177 Å²	177	51.2 Å²	51.2	77%	0.77	27%	0.274	S	S	*	.	S	Bend	trans	-105	33.8	174.9	-59.9	-163.3	175.6	-162.7	0	112	F525	F525-K592 HydrophobicContact CZ-CG 4.42Å
593	V	85.1	Confident	89.2	Confident	70 Å²	70	51 Å²	51	42%	0.424	27%	0.272	S	S	.	.	S	Bend	trans	-93.9	164.3	-179.3	-65.6	0	0	0	0	111	H595	V593-H595 PolarHBondContact O-CE1 2.99Å; V593-H595 VanDerWaalsContact O-CE1 3.29Å; V593-H595 PolarHBondContact O-N 3.49Å; V593-H595 PolarHBondContact O-ND1 2.95Å
594	S	85.4	Confident	87.8	Confident	102 Å²	102	53 Å²	53	71%	0.713	29%	0.294	S	S	*	.			trans	-74.3	97.4	171.1	-175.3	0	0	0	0	109.9
595	H	92.1	Very high	86.3	Confident	13 Å²	13	63.7 Å²	63.7	6%	0.06	33%	0.334	C	S	.	.			trans	-62.8	147.1	178.3	-58.3	100.4	0	0	0	112.8	Y527 I538 Q548 V550 I586 Q588 G591 V593	Y527-H595 PolarHBondContact OH-CD2 2.81Å; Y527-H595 PolarHBondContact OH-CE1 3.11Å; Y527-H595 PolarHBondContact OH-ND1 2.98Å; Y527-H595 PolarHBondContact OH-NE2 2.9Å; I538-H595 HydrophobicContact CD1-CB 4.21Å; Q548-H595 VanDerWaalsContact NE2-N 3.19Å; Q548-H595 PolarHBondContact NE2-O 3.47Å; Q548-H595 PolarHBondContact OE1-ND1 3.03Å; V550-H595 HydrophobicContact CG2-CB 3.76Å; I586-H595 HydrophobicContact CG2-CB 3.79Å; Q588-H595 PolarHBondContact O-NE2 3.32Å; G591-H595 PolarHBondContact O-CE1 2.93Å; V593-H595 PolarHBondContact O-CE1 2.99Å; V593-H595 VanDerWaalsContact O-CE1 3.29Å; V593-H595 PolarHBondContact O-N 3.49Å; V593-H595 PolarHBondContact O-ND1 2.95Å
596	H	92.3	Very high	84.9	Confident	124 Å²	124	67.4 Å²	67.4	57%	0.574	35%	0.352	S	S	*	.			trans	-146.9	158.8	172.4	58.7	-82	0	0	0	108.7
597	T	92.7	Very high	83.4	Confident	31 Å²	31	72.5 Å²	72.5	19%	0.19	37%	0.374	C	S	.	.			trans	-82.3	149.7	171.5	43.3	0	0	0	0	111.7	V550 G551 T552 Q584 I586	V550-T597 HydrophobicContact CG1-CG2 4.36Å; G551-T597 PolarHBondContact O-OG1 3.07Å; T552-T597 HydrophobicContact CG2-CG2 4.01Å; Q584-T597 HydrophobicContact CB-CG2 3.99Å; I586-T597 HydrophobicContact CD1-CG2 4.33Å; I586-T597 HydrophobicContact CG1-CG2 3.86Å
598	V	91.3	Very high	82.1	Confident	60 Å²	60	72.6 Å²	72.6	36%	0.364	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	130.8	168.9	-175	0	0	0	0	107.3	Q584 V585	Q584-V598 CarbonylContact C-O 3.56Å; Q584-V598 WeakPolarHBondContact CA-O 3.01Å; V585-V598 PolarHBondContact N-O 3.06Å; V585-V598 PolarHBondContact O-N 2.97Å
599	H	88	Confident	81.6	Confident	89 Å²	89	71.7 Å²	71.7	41%	0.412	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	146.9	174.9	-66.7	-103.7	0	0	0	110.8	D553 Q584	D553-H599 IonicContact OD1-CE1 3.86Å; D553-H599 IonicContact OD1-NE2 2.83Å; D553-H599 IonicContact OD2-CE1 3.32Å; D553-H599 PolarHBondContact OD2-CE1 2.97Å; D553-H599 IonicContact OD2-ND1 2.87Å; D553-H599 IonicContact OD2-NE2 3.71Å; Q584-H599 PolarHBondContact NE2-CE1 2.78Å; Q584-H599 VanDerWaalsContact NE2-CE1 3.28Å; Q584-H599 PolarHBondContact NE2-NE2 2.96Å
600	T	84.9	Confident	81.4	Confident	8 Å²	8	71.8 Å²	71.8	5%	0.049	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-64.8	162.7	166	57.3	0	0	0	0	110.9	W569 L583 V585 F607 I641	W569-T600 HydrophobicContact CE3-CG2 4.31Å; W569-T600 HydrophobicContact CH2-CG2 3.95Å; W569-T600 HydrophobicContact CZ3-CG2 3.54Å; L583-T600 HydrophobicContact CB-CG2 4.41Å; L583-T600 HydrophobicContact CD2-CG2 4.08Å; L583-T600 HydrophobicContact CG-CG2 4.07Å; L583-T600 PolarHBondContact O-N 3.2Å; V585-T600 HydrophobicContact CG2-CG2 3.87Å; T600-F607 WeakPolarHBondContact O-CE1 3.44Å; T600-I641 HydrophobicContact CG2-CD1 4.11Å
601	Q	81.3	Confident	81.2	Confident	97 Å²	97	73.5 Å²	73.5	45%	0.453	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-60.6	152.9	168.2	-63.6	-170.3	11.1	0	0	110.9	V603 T646 S647	Q601-V603 PolarHBondContact O-N 3.08Å; Q601-T646 PolarHBondContact N-O 3.46Å; Q601-T646 VanDerWaalsContact N-O 3.14Å; Q601-S647 VanDerWaalsContact CD-CB 3.41Å
602	P	75.4	Confident	81.2	Confident	58 Å²	58	74.7 Å²	74.7	38%	0.377	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-65.7	137.8	-178.9	26.6	-31.1	0	0	0	110.2	F607	P602-F607 HydrophobicContact CB-CD1 3.95Å; P602-F607 HydrophobicContact CB-CD2 3.85Å; P602-F607 HydrophobicContact CB-CE1 3.9Å; P602-F607 HydrophobicContact CB-CE2 3.78Å; P602-F607 HydrophobicContact CB-CG 3.94Å; P602-F607 HydrophobicContact CB-CZ 3.82Å; P602-F607 VanDerWaalsContact CD-CE1 3.49Å; P602-F607 HydrophobicContact CG-CE1 4.04Å; P602-F607 HydrophobicContact CG-CE2 3.94Å; P602-F607 HydrophobicContact CG-CZ 3.69Å
603	V	69	Low	81.8	Confident	5 Å²	5	66.5 Å²	66.5	3%	0.03	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-99.2	112.3	-174.1	177.6	0	0	0	0	108.4	Q601 R605 H606 I630 Y639 Y648	Q601-V603 PolarHBondContact O-N 3.08Å; V603-R605 PolarHBondContact O-N 2.82Å; V603-H606 PolarHBondContact N-O 3.27Å; V603-H606 PolarHBondContact O-N 3.22Å; V603-I630 HydrophobicContact CG1-CG2 4.41Å; V603-I630 HydrophobicContact CG2-CD1 3.92Å; V603-Y639 VanDerWaalsContact CG1-CB 3.4Å; V603-Y639 HydrophobicContact CG1-CD1 3.29Å; V603-Y639 HydrophobicContact CG1-CD2 4.16Å; V603-Y639 HydrophobicContact CG1-CE1 4.07Å; V603-Y639 HydrophobicContact CG1-CG 3.35Å; V603-Y648 HydrophobicContact CG1-CD2 4.2Å
604	G	65.7	Low	82.4	Confident	46 Å²	46	65.1 Å²	65.1	47%	0.474	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	-91.6	-173.1	0	0	0	0	0	113
605	R	62.3	Low	82.9	Confident	228 Å²	228	60.6 Å²	60.6	86%	0.86	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.3	-2.6	-177.8	-72.7	-170.8	178.9	-176.6	1.2	114.6	V603	V603-R605 PolarHBondContact O-N 2.82Å
606	H	66.4	Low	83	Confident	80 Å²	80	60.3 Å²	60.3	37%	0.37	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-136.4	151.1	-170.7	-56.3	-65.5	0	0	0	110.8	V603 D608	V603-H606 PolarHBondContact N-O 3.27Å; V603-H606 PolarHBondContact O-N 3.22Å; H606-D608 WeakPolarHBondContact CB-O 3.01Å
607	F	64.4	Low	82.8	Confident	106 Å²	106	58.3 Å²	58.3	47%	0.465	30%	0.299	S	S	.	.	S	Bend	trans	-88.2	-30	165.3	-77.8	-84.5	0	0	0	111.2	T600 P602	T600-F607 WeakPolarHBondContact O-CE1 3.44Å; P602-F607 HydrophobicContact CB-CD1 3.95Å; P602-F607 HydrophobicContact CB-CD2 3.85Å; P602-F607 HydrophobicContact CB-CE1 3.9Å; P602-F607 HydrophobicContact CB-CE2 3.78Å; P602-F607 HydrophobicContact CB-CG 3.94Å; P602-F607 HydrophobicContact CB-CZ 3.82Å; P602-F607 VanDerWaalsContact CD-CE1 3.49Å; P602-F607 HydrophobicContact CG-CE1 4.04Å; P602-F607 HydrophobicContact CG-CE2 3.94Å; P602-F607 HydrophobicContact CG-CZ 3.69Å
608	D	67.5	Low	82.5	Confident	69 Å²	69	58.7 Å²	58.7	37%	0.369	30%	0.303	S	S	.	.	S	Bend	trans	-102.8	151.7	-173.6	-19.9	-78.8	0	0	0	109.7	P581 H606	P581-D608 WeakPolarHBondContact O-CA 3.46Å; H606-D608 WeakPolarHBondContact CB-O 3.01Å
609	R	84.8	Confident	82.4	Confident	108 Å²	108	56.8 Å²	56.8	41%	0.408	29%	0.292	S	S	.	.			trans	106.2	7.7	-175	-61.8	164.7	174.4	-150.6	-2.1	116.1	P581 E611 H632 Q633 E635	P581-R609 PolarHBondContact O-N 3.26Å; R609-E611 PolarHBondContact O-N 2.81Å; R609-H632 WeakPolarHBondContact O-CA 3.48Å; R609-Q633 PolarHBondContact O-N 3.18Å; R609-E635 IonicContact NH1-OE1 3.31Å; R609-E635 PolarHBondContact NH1-OE1 2.99Å
610	V	90.2	Very high	82.4	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	108.8	171.1	179.7	0	0	0	0	108.8	L571 P581 L583 I630	L571-V610 HydrophobicContact CD1-CB 4.17Å; L571-V610 HydrophobicContact CD1-CG1 3.73Å; P581-V610 VanDerWaalsContact CB-O 3.27Å; P581-V610 WeakPolarHBondContact CB-O 3.43Å; P581-V610 WeakPolarHBondContact CG-O 3.26Å; P581-V610 PolarHBondContact O-N 3.09Å; L583-V610 HydrophobicContact CB-CG1 4.39Å; L583-V610 HydrophobicContact CB-CG2 4.16Å; L583-V610 HydrophobicContact CD2-CG1 4.42Å; V610-I630 HydrophobicContact CG1-CG2 4.14Å; V610-I630 HydrophobicContact CG2-CG2 3.99Å
611	E	90.1	Very high	82.7	Confident	49 Å²	49	55.6 Å²	55.6	23%	0.229	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-39	-178.6	-169.6	177.6	-172.5	0	0	111.4	R609 F631 Q633 R678	R609-E611 PolarHBondContact O-N 2.81Å; E611-F631 PolarHBondContact N-O 3.07Å; E611-Q633 HydrophobicContact CB-CB 4.12Å; E611-Q633 HydrophobicContact CG-CG 4.45Å; E611-Q633 WeakPolarHBondContact OE2-CA 3.39Å; E611-R678 IonicContact OE1-CZ 3.82Å; E611-R678 VanDerWaalsContact OE1-CZ 3.23Å; E611-R678 IonicContact OE1-NH1 3.54Å; E611-R678 PolarHBondContact OE1-NH1 2.83Å; E611-R678 IonicContact OE1-NH2 3.82Å; E611-R678 PolarHBondContact OE1-NH2 2.79Å; E611-R678 IonicContact OE2-CZ 2.74Å; E611-R678 IonicContact OE2-NH1 3.06Å; E611-R678 PolarHBondContact OE2-NH1 2.82Å; E611-R678 VanDerWaalsContact OE2-NH1 3.08Å; E611-R678 IonicContact OE2-NH2 2.83Å; E611-R678 PolarHBondContact OE2-NH2 2.96Å
612	D	93.6	Very high	83.1	Confident	47 Å²	47	52.3 Å²	52.3	25%	0.251	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	168.2	164.5	-163.5	22.7	0	0	0	111.4	K558 F631	K558-D612 WeakPolarHBondContact CD-OD1 3.46Å; K558-D612 WeakPolarHBondContact CE-OD1 3.32Å; K558-D612 IonicContact NZ-OD1 3.12Å; K558-D612 PolarHBondContact NZ-OD1 2.87Å; K558-D612 IonicContact NZ-OD2 3.27Å; K558-D612 PolarHBondContact NZ-OD2 3.09Å; D612-F631 HydrophobicContact CB-CD2 4.21Å; D612-F631 PolarHBondContact N-O 3.41Å; D612-F631 WeakPolarHBondContact O-CB 3.45Å; D612-F631 WeakPolarHBondContact O-CD2 3.42Å; D612-F631 PolarHBondContact O-N 2.94Å
613	F	95.3	Very high	83.7	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.018	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	153.6	175.6	76	-78.2	0	0	0	111.9	K558 H560 W569 L571 L583 I615 L629 I630	K558-F613 HydrophobicContact CD-CD1 4.27Å; K558-F613 HydrophobicContact CD-CE1 3.85Å; K558-F613 HydrophobicContact CG-CE1 4.21Å; K558-F613 PolarHBondContact NZ-O 3.25Å; H560-F613 HydrophobicContact CB-CE2 3.63Å; H560-F613 HydrophobicContact CB-CZ 3.61Å; W569-F613 HydrophobicContact CB-CE2 3.62Å; W569-F613 HydrophobicContact CB-CZ 3.68Å; W569-F613 HydrophobicContact CG-CE2 4.25Å; L571-F613 HydrophobicContact CB-CD1 4.11Å; L571-F613 HydrophobicContact CB-CE1 3.86Å; L571-F613 HydrophobicContact CD2-CD1 4.45Å; L583-F613 HydrophobicContact CD1-CD1 3.72Å; L583-F613 HydrophobicContact CD1-CE1 3.98Å; L583-F613 HydrophobicContact CD1-CG 4.06Å; L583-F613 HydrophobicContact CD2-CB 4.44Å; F613-I615 HydrophobicContact CD2-CD1 4.22Å; F613-I615 HydrophobicContact CD2-CG1 4.18Å; F613-I615 HydrophobicContact CE2-CD1 3.97Å; F613-I615 HydrophobicContact CE2-CG1 4.3Å; F613-L629 CarbonylContact C-O 3.36Å; F613-L629 WeakPolarHBondContact CA-O 3.44Å; F613-I630 HydrophobicContact CB-CG1 4.22Å
614	F	96.8	Very high	84.6	Confident	42 Å²	42	60.3 Å²	60.3	18%	0.184	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	126.5	178.7	177.3	-92.2	0	0	0	110.8	P616 G628 L629 F631 V664 Y673	F614-P616 HydrophobicContact CE1-CB 4.48Å; F614-P616 HydrophobicContact CE1-CG 3.99Å; F614-G628 WeakPolarHBondContact O-CA 3.32Å; F614-L629 HydrophobicContact CB-CB 4.42Å; F614-L629 HydrophobicContact CD1-CD1 4.35Å; F614-L629 PolarHBondContact N-O 3.01Å; F614-L629 PolarHBondContact O-N 3.18Å; F614-F631 HydrophobicContact CB-CE2 3.87Å; F614-F631 HydrophobicContact CB-CZ 3.82Å; F614-V664 HydrophobicContact CD1-CG1 4.22Å; F614-V664 HydrophobicContact CD2-CB 4.33Å; F614-V664 WeakPolarHBondContact CD2-O 3.01Å; F614-V664 HydrophobicContact CE1-CG1 4.33Å; F614-V664 WeakPolarHBondContact CE2-O 3.17Å; F614-V664 HydrophobicContact CG-CB 4.22Å; F614-V664 HydrophobicContact CG-CG1 4.41Å; F614-Y673 HydrophobicContact CD1-CE1 4.27Å; F614-Y673 HydrophobicContact CE1-CD1 4.14Å; F614-Y673 AromaticContact CE1-CE1 3.97Å; F614-Y673 HydrophobicContact CE1-CE1 3.97Å
615	I	96.4	Very high	85.9	Confident	7 Å²	7	58.5 Å²	58.5	4%	0.036	29%	0.29	C	S	.	.			trans	-118.1	127.3	169.9	-67.6	174.3	0	0	0	106.9	H560 W569 F613 V625 L643	H560-I615 PolarHBondContact CE1-O 2.84Å; H560-I615 WeakPolarHBondContact NE2-CG2 3.46Å; W569-I615 HydrophobicContact CB-CD1 4.44Å; W569-I615 HydrophobicContact CD2-CD1 3.75Å; W569-I615 HydrophobicContact CE3-CD1 4.37Å; W569-I615 HydrophobicContact CG-CD1 3.73Å; F613-I615 HydrophobicContact CD2-CD1 4.22Å; F613-I615 HydrophobicContact CD2-CG1 4.18Å; F613-I615 HydrophobicContact CE2-CD1 3.97Å; F613-I615 HydrophobicContact CE2-CG1 4.3Å; I615-V625 HydrophobicContact CG2-CG1 4.28Å; I615-L643 HydrophobicContact CD1-CD1 4.26Å; I615-L643 HydrophobicContact CD1-CD2 3.84Å; I615-L643 HydrophobicContact CG1-CD1 4.18Å; I615-L643 HydrophobicContact CG1-CD2 4.04Å; I615-L643 HydrophobicContact CG2-CD1 3.76Å
616	P	94.5	Very high	87.2	Confident	6 Å²	6	51.2 Å²	51.2	4%	0.039	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-54.1	140.5	172.7	-26.4	32.8	0	0	0	112.7	F614 V625 F627 Y666 Y673	F614-P616 HydrophobicContact CE1-CB 4.48Å; F614-P616 HydrophobicContact CE1-CG 3.99Å; P616-V625 HydrophobicContact CB-CG1 3.75Å; P616-V625 HydrophobicContact CB-CG2 4.42Å; P616-V625 HydrophobicContact CG-CG1 3.77Å; P616-F627 WeakPolarHBondContact CD-O 3.36Å; P616-Y666 HydrophobicContact CB-CD1 3.68Å; P616-Y666 HydrophobicContact CB-CE1 4.06Å; P616-Y666 HydrophobicContact CB-CG 4.32Å; P616-Y666 HydrophobicContact CG-CD1 4Å; P616-Y666 HydrophobicContact CG-CE1 4.31Å; P616-Y666 HydrophobicContact CG-CG 4.23Å; P616-Y673 HydrophobicContact CG-CE1 4.3Å
617	A	87.9	Confident	88.5	Confident	83 Å²	83	49.3 Å²	49.3	69%	0.686	25%	0.253	S	S	*	.	P	Polyproline II helix	trans	-72.7	142.4	171.8	0	0	0	0	0	111.2
618	S	87.1	Confident	90	Very high	39 Å²	39	44.3 Å²	44.3	27%	0.273	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-76.2	147.1	168.1	57.8	0	0	0	0	111.6	V622	S618-V622 CarbonylContact C-O 3.56Å; S618-V622 WeakPolarHBondContact CA-O 3.33Å; S618-V622 VanDerWaalsContact CB-O 3.24Å; S618-V622 WeakPolarHBondContact CB-O 3.01Å
619	S	88.1	Confident	91.4	Very high	19 Å²	19	41 Å²	41	13%	0.133	21%	0.214	C	C	.	.			trans	-119.9	-175.6	169.8	95	0	0	0	0	110.6	E377 I621 V622 P713	E377-S619 WeakPolarHBondContact OE2-CB 3.31Å; E377-S619 PolarHBondContact OE2-OG 2.85Å; S619-I621 VanDerWaalsContact C-N 3.27Å; S619-I621 PolarHBondContact O-N 3.15Å; S619-I621 WeakPolarHBondContact OG-CG1 3.1Å; S619-I621 PolarHBondContact OG-N 2.04Å; S619-V622 PolarHBondContact N-O 3.14Å; S619-V622 CarbonylContact O-C 3.56Å; S619-V622 PolarHBondContact O-N 2.84Å; S619-V622 PolarHBondContact OG-N 3.33Å; S619-P713 WeakPolarHBondContact CB-O 3.28Å
620	L	89	Confident	91.9	Very high	37 Å²	37	36 Å²	36	19%	0.194	20%	0.195	C	C	.	.	S	Bend	trans	-62.8	-35.8	174.9	-66	-173.8	0	0	0	112.1	V354 R356 E377 L817	V354-L620 HydrophobicContact CB-CB 4.24Å; V354-L620 HydrophobicContact CG1-CB 3.99Å; R356-L620 HydrophobicContact CG-CD1 4.17Å; R356-L620 HydrophobicContact CG-CD2 3.9Å; E377-L620 HydrophobicContact CB-CB 4.23Å; E377-L620 PolarHBondContact OE2-N 2.9Å; L620-L817 HydrophobicContact CD1-CD2 4.38Å
621	I	91.6	Very high	92	Very high	35 Å²	35	36.2 Å²	36.2	18%	0.179	20%	0.195	C	C	.	.	S	Bend	trans	-92.8	-15.4	178.2	56.7	167.8	0	0	0	114.3	V351 V354 E377 I379 S619	V351-I621 HydrophobicContact CG1-CB 3.78Å; V351-I621 HydrophobicContact CG1-CD1 4.11Å; V351-I621 HydrophobicContact CG1-CG2 3.56Å; V354-I621 HydrophobicContact CB-CG2 4.2Å; V354-I621 HydrophobicContact CG2-CG2 3.89Å; E377-I621 HydrophobicContact CB-CB 4.46Å; E377-I621 HydrophobicContact CB-CD1 4.37Å; E377-I621 HydrophobicContact CB-CG1 4.07Å; E377-I621 HydrophobicContact CB-CG2 3.73Å; E377-I621 PolarHBondContact OE2-N 2.93Å; I379-I621 HydrophobicContact CD1-CD1 4.32Å; I379-I621 HydrophobicContact CG1-CD1 4.25Å; S619-I621 VanDerWaalsContact C-N 3.27Å; S619-I621 PolarHBondContact O-N 3.15Å; S619-I621 WeakPolarHBondContact OG-CG1 3.1Å; S619-I621 PolarHBondContact OG-N 2.04Å
622	V	89.9	Confident	92.1	Very high	28 Å²	28	34.1 Å²	34.1	17%	0.17	19%	0.186	C	C	.	.			trans	-116.9	82.3	174.8	-173.9	0	0	0	0	109.9	S618 S619 H668	S618-V622 CarbonylContact C-O 3.56Å; S618-V622 WeakPolarHBondContact CA-O 3.33Å; S618-V622 VanDerWaalsContact CB-O 3.24Å; S618-V622 WeakPolarHBondContact CB-O 3.01Å; S619-V622 PolarHBondContact N-O 3.14Å; S619-V622 CarbonylContact O-C 3.56Å; S619-V622 PolarHBondContact O-N 2.84Å; S619-V622 PolarHBondContact OG-N 3.33Å; V622-H668 HydrophobicContact CG2-CB 3.86Å
623	N	86.3	Confident	91.8	Very high	128 Å²	128	35.1 Å²	35.1	68%	0.684	19%	0.189	S	C	*	.			trans	-89.8	-5.8	-177.4	66.8	0.2	0	0	0	114.9	S564	S564-N623 VanDerWaalsContact CB-O 3.28Å; S564-N623 WeakPolarHBondContact CB-O 3.37Å
624	H	89.6	Confident	91.5	Very high	104 Å²	104	39.6 Å²	39.6	48%	0.481	21%	0.213	S	C	.	.			trans	-135.9	116.2	-176.6	-176.4	-71.4	0	0	0	111.7	H565	H565-H624 AromaticContact NE2-NE2 3.94Å
625	V	91.1	Very high	91.3	Very high	8 Å²	8	39.4 Å²	39.4	5%	0.048	21%	0.213	C	C	.	.			trans	-108.2	106.6	-176.8	178.5	0	0	0	0	109	S564 H565 I615 P616 L643	S564-V625 PolarHBondContact OG-N 2.83Å; H565-V625 PolarHBondContact CE1-O 2.93Å; H565-V625 VanDerWaalsContact CE1-O 3.3Å; I615-V625 HydrophobicContact CG2-CG1 4.28Å; P616-V625 HydrophobicContact CB-CG1 3.75Å; P616-V625 HydrophobicContact CB-CG2 4.42Å; P616-V625 HydrophobicContact CG-CG1 3.77Å; V625-L643 HydrophobicContact CG1-CD1 4.03Å
626	R	90.8	Very high	91.2	Very high	75 Å²	75	39.6 Å²	39.6	28%	0.283	21%	0.214	S	C	.	.			trans	-74	-33.1	-171.4	-170.6	173.4	-179.8	-163.6	-6.3	114.3	E307 D308 N642 L643	E307-R626 VanDerWaalsContact CD-NH2 3.35Å; E307-R626 IonicContact OE1-NH2 3.7Å; E307-R626 PolarHBondContact OE1-NH2 2.94Å; E307-R626 IonicContact OE2-CZ 3.12Å; E307-R626 IonicContact OE2-NH1 2.73Å; E307-R626 PolarHBondContact OE2-NH1 2.78Å; E307-R626 IonicContact OE2-NH2 2.9Å; E307-R626 PolarHBondContact OE2-NH2 3.06Å; D308-R626 IonicContact OD2-NH1 2.74Å; R626-N642 PolarHBondContact O-OD1 2.94Å; R626-L643 PolarHBondContact O-N 2.85Å
627	F	93.7	Very high	91.2	Very high	40 Å²	40	39.8 Å²	39.8	18%	0.175	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	138	-169.4	-57.4	-68.9	0	0	0	113.1	P616 K640 I641 N642 V649	P616-F627 WeakPolarHBondContact CD-O 3.36Å; F627-K640 HydrophobicContact CB-CG 4.14Å; F627-K640 HydrophobicContact CD1-CG 4.17Å; F627-K640 HydrophobicContact CG-CD 4.38Å; F627-K640 HydrophobicContact CG-CG 4.23Å; F627-I641 VanDerWaalsContact CA-O 3.29Å; F627-I641 WeakPolarHBondContact CA-O 3.19Å; F627-N642 HydrophobicContact CD1-CB 4.39Å; F627-N642 HydrophobicContact CE1-CB 4.41Å; F627-V649 HydrophobicContact CD1-CG2 4.23Å; F627-V649 HydrophobicContact CE1-CG2 4.06Å
628	G	95.4	Very high	91.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	169.7	163.5	0	0	0	0	0	111.7	F614 I641	F614-G628 WeakPolarHBondContact O-CA 3.32Å; G628-I641 PolarHBondContact N-O 3.41Å; G628-I641 WeakPolarHBondContact O-CG2 3.44Å; G628-I641 PolarHBondContact O-N 2.04Å
629	L	96.5	Very high	91.9	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	139.5	174.3	-55.4	-179.8	0	0	0	109.8	F613 F614 F631 I638 Y639 V664 Y673	F613-L629 CarbonylContact C-O 3.36Å; F613-L629 WeakPolarHBondContact CA-O 3.44Å; F614-L629 HydrophobicContact CB-CB 4.42Å; F614-L629 HydrophobicContact CD1-CD1 4.35Å; F614-L629 PolarHBondContact N-O 3.01Å; F614-L629 PolarHBondContact O-N 3.18Å; L629-F631 HydrophobicContact CB-CE1 3.91Å; L629-F631 HydrophobicContact CB-CZ 3.99Å; L629-I638 HydrophobicContact CB-CG2 3.9Å; L629-I638 HydrophobicContact CD1-CG2 4.11Å; L629-I638 HydrophobicContact CD2-CG2 3.8Å; L629-I638 HydrophobicContact CG-CG2 4.15Å; L629-Y639 CarbonylContact C-O 3.52Å; L629-Y639 WeakPolarHBondContact CA-O 3.38Å; L629-V664 HydrophobicContact CD1-CG1 4.26Å; L629-Y673 HydrophobicContact CD1-CD1 3.59Å; L629-Y673 HydrophobicContact CD1-CD2 4.41Å; L629-Y673 HydrophobicContact CD1-CE1 3.55Å; L629-Y673 HydrophobicContact CD1-CE2 4.34Å; L629-Y673 HydrophobicContact CD1-CG 4.05Å; L629-Y673 HydrophobicContact CG-CE1 4.1Å
630	I	95.1	Very high	92.1	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	137.8	177.7	-72.8	171.3	0	0	0	108.6	L583 V603 V610 F613 Y639 I641	L583-I630 HydrophobicContact CD2-CD1 3.53Å; L583-I630 HydrophobicContact CD2-CG1 3.93Å; V603-I630 HydrophobicContact CG1-CG2 4.41Å; V603-I630 HydrophobicContact CG2-CD1 3.92Å; V610-I630 HydrophobicContact CG1-CG2 4.14Å; V610-I630 HydrophobicContact CG2-CG2 3.99Å; F613-I630 HydrophobicContact CB-CG1 4.22Å; I630-Y639 PolarHBondContact N-O 3.38Å; I630-Y639 PolarHBondContact O-N 3.36Å; I630-I641 HydrophobicContact CD1-CB 4.11Å; I630-I641 HydrophobicContact CD1-CD1 3.74Å; I630-I641 HydrophobicContact CD1-CG2 3.84Å; I630-I641 HydrophobicContact CG1-CG2 4.08Å
631	F	93.5	Very high	92.4	Very high	7 Å²	7	33 Å²	33	3%	0.031	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	127.7	-179.9	-45.3	-50.9	0	0	0	109.2	E611 D612 F614 L629 I638 P661 V664	E611-F631 PolarHBondContact N-O 3.07Å; D612-F631 HydrophobicContact CB-CD2 4.21Å; D612-F631 PolarHBondContact N-O 3.41Å; D612-F631 WeakPolarHBondContact O-CB 3.45Å; D612-F631 WeakPolarHBondContact O-CD2 3.42Å; D612-F631 PolarHBondContact O-N 2.94Å; F614-F631 HydrophobicContact CB-CE2 3.87Å; F614-F631 HydrophobicContact CB-CZ 3.82Å; L629-F631 HydrophobicContact CB-CE1 3.91Å; L629-F631 HydrophobicContact CB-CZ 3.99Å; F631-I638 HydrophobicContact CD1-CB 4.5Å; F631-I638 HydrophobicContact CD1-CG1 3.93Å; F631-I638 HydrophobicContact CD1-CG2 4.3Å; F631-I638 HydrophobicContact CE1-CB 4.41Å; F631-I638 HydrophobicContact CE1-CD1 4.08Å; F631-I638 HydrophobicContact CE1-CG1 3.84Å; F631-I638 HydrophobicContact CE1-CG2 3.9Å; F631-P661 HydrophobicContact CB-CG 4.05Å; F631-P661 HydrophobicContact CD1-CB 3.94Å; F631-P661 HydrophobicContact CD1-CG 3.77Å; F631-P661 HydrophobicContact CE1-CB 4.37Å; F631-P661 HydrophobicContact CG-CB 4.27Å; F631-P661 HydrophobicContact CG-CG 4.07Å; F631-V664 HydrophobicContact CE1-CG2 3.94Å; F631-V664 HydrophobicContact CE2-CG2 4.17Å; F631-V664 HydrophobicContact CZ-CB 4.09Å; F631-V664 HydrophobicContact CZ-CG2 3.4Å; F631-V664 VanDerWaalsContact CZ-CG2 3.4Å
632	H	91.2	Very high	92.4	Very high	6 Å²	6	32.2 Å²	32.2	3%	0.028	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	150.9	179	-74.4	177	0	0	0	112.3	R609 N634 E635 Y639	R609-H632 WeakPolarHBondContact O-CA 3.48Å; H632-N634 PolarHBondContact O-N 2.94Å; H632-N634 VanDerWaalsContact O-N 3.08Å; H632-E635 HydrophobicContact CB-CB 3.96Å; H632-E635 HydrophobicContact CB-CG 3.98Å; H632-E635 WeakPolarHBondContact CB-OE2 3.2Å; H632-E635 IonicContact CG-OE2 3.6Å; H632-E635 IonicContact ND1-OE2 3.93Å; H632-E635 PolarHBondContact ND1-OE2 2.03Å; H632-E635 PolarHBondContact O-N 3.39Å; H632-Y639 HydrophobicContact CB-CE2 4.21Å; H632-Y639 AromaticContact CE1-CE2 3.75Å; H632-Y639 AromaticContact CE1-CZ 3.88Å; H632-Y639 AromaticContact CG-CE2 3.73Å; H632-Y639 AromaticContact ND1-CD2 3.93Å; H632-Y639 AromaticContact ND1-CE2 3.32Å; H632-Y639 VanDerWaalsContact ND1-CE2 3.32Å; H632-Y639 WeakPolarHBondContact ND1-CE2 3.39Å; H632-Y639 AromaticContact ND1-CZ 3.62Å
633	Q	88.4	Confident	92.6	Very high	67 Å²	67	30.9 Å²	30.9	31%	0.313	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	114	-175.9	-163.9	-173.5	42.9	0	0	112.4	R609 E611 E635	R609-Q633 PolarHBondContact O-N 3.18Å; E611-Q633 HydrophobicContact CB-CB 4.12Å; E611-Q633 HydrophobicContact CG-CG 4.45Å; E611-Q633 WeakPolarHBondContact OE2-CA 3.39Å; Q633-E635 PolarHBondContact O-N 3.25Å
634	N	89	Confident	92.9	Very high	98 Å²	98	31.2 Å²	31.2	52%	0.524	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	18.9	180	-54	-42.6	0	0	0	116.1	H632 I660	H632-N634 PolarHBondContact O-N 2.94Å; H632-N634 VanDerWaalsContact O-N 3.08Å; N634-I660 HydrophobicContact CB-CD1 4.46Å
635	E	91.8	Very high	93	Very high	39 Å²	39	29.3 Å²	29.3	18%	0.182	14%	0.142	C	C	.	.			trans	-97.9	125.5	177	-63.9	180	-178.4	0	0	110.3	R609 H632 Q633 V637 Y639 P661	R609-E635 IonicContact NH1-OE1 3.31Å; R609-E635 PolarHBondContact NH1-OE1 2.99Å; H632-E635 HydrophobicContact CB-CB 3.96Å; H632-E635 HydrophobicContact CB-CG 3.98Å; H632-E635 WeakPolarHBondContact CB-OE2 3.2Å; H632-E635 IonicContact CG-OE2 3.6Å; H632-E635 IonicContact ND1-OE2 3.93Å; H632-E635 PolarHBondContact ND1-OE2 2.03Å; H632-E635 PolarHBondContact O-N 3.39Å; Q633-E635 PolarHBondContact O-N 3.25Å; E635-V637 PolarHBondContact O-N 3.42Å; E635-Y639 PolarHBondContact OE2-OH 3.03Å; E635-Y639 VanDerWaalsContact OE2-OH 3.11Å; E635-P661 WeakPolarHBondContact O-CD 3.07Å
636	P	94.4	Very high	93	Very high	10 Å²	10	30.1 Å²	30.1	7%	0.065	15%	0.148	C	C	.	.	S	Bend	trans	-80.2	57.9	176.5	34.6	-36	0	0	0	110.8	L654 W655 C659 I660	P636-L654 HydrophobicContact CB-CB 4.47Å; P636-L654 WeakPolarHBondContact O-CA 3.27Å; P636-L654 WeakPolarHBondContact O-CB 3.49Å; P636-L654 PolarHBondContact O-N 3.1Å; P636-W655 HydrophobicContact CG-CD2 3.55Å; P636-W655 VanDerWaalsContact CG-CE2 3.47Å; P636-W655 HydrophobicContact CG-CE3 3.96Å; P636-W655 HydrophobicContact CG-CG 3.93Å; P636-W655 HydrophobicContact CG-CH2 4.21Å; P636-W655 HydrophobicContact CG-CZ2 3.82Å; P636-W655 HydrophobicContact CG-CZ3 4.27Å; P636-C659 WeakPolarHBondContact CA-O 3.37Å; P636-C659 WeakPolarHBondContact CB-O 3.44Å; P636-I660 HydrophobicContact CB-CG1 4.22Å
637	V	94.1	Very high	92.9	Very high	10 Å²	10	27.6 Å²	27.6	6%	0.061	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	136.4	-173.9	-177.1	0	0	0	0	108.8	E635 Y639 N651 I652	E635-V637 PolarHBondContact O-N 3.42Å; V637-Y639 HydrophobicContact CB-CE2 3.79Å; V637-Y639 HydrophobicContact CG1-CD2 4.02Å; V637-Y639 HydrophobicContact CG1-CE1 4.15Å; V637-Y639 HydrophobicContact CG1-CE2 3.52Å; V637-N651 HydrophobicContact CG1-CB 3.74Å; V637-I652 WeakPolarHBondContact CA-O 3.41Å
638	I	95.6	Very high	92.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.9	167.4	-64.3	175.3	0	0	0	108.6	L629 F631 N651 I652 L654 P661 V675 L691	L629-I638 HydrophobicContact CB-CG2 3.9Å; L629-I638 HydrophobicContact CD1-CG2 4.11Å; L629-I638 HydrophobicContact CD2-CG2 3.8Å; L629-I638 HydrophobicContact CG-CG2 4.15Å; F631-I638 HydrophobicContact CD1-CB 4.5Å; F631-I638 HydrophobicContact CD1-CG1 3.93Å; F631-I638 HydrophobicContact CD1-CG2 4.3Å; F631-I638 HydrophobicContact CE1-CB 4.41Å; F631-I638 HydrophobicContact CE1-CD1 4.08Å; F631-I638 HydrophobicContact CE1-CG1 3.84Å; F631-I638 HydrophobicContact CE1-CG2 3.9Å; I638-N651 CarbonylContact O-C 3.46Å; I638-N651 WeakPolarHBondContact O-CA 3.46Å; I638-I652 HydrophobicContact CB-CB 4.18Å; I638-I652 HydrophobicContact CG2-CD1 4.32Å; I638-I652 PolarHBondContact N-O 2.86Å; I638-I652 PolarHBondContact O-N 3.32Å; I638-L654 HydrophobicContact CD1-CD1 3.93Å; I638-L654 HydrophobicContact CG1-CD1 3.92Å; I638-P661 HydrophobicContact CG1-CB 4.33Å; I638-P661 HydrophobicContact CG1-CG 4.15Å; I638-V675 HydrophobicContact CD1-CG1 4.11Å; I638-V675 HydrophobicContact CD1-CG2 3.81Å; I638-L691 HydrophobicContact CD1-CD2 4.3Å
639	Y	94.3	Very high	92.5	Very high	24 Å²	24	32.4 Å²	32.4	9%	0.094	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	120.8	178.8	-65.2	-95.5	0	0	0	110.3	V603 L629 I630 H632 E635 V637 Y648 N651	V603-Y639 VanDerWaalsContact CG1-CB 3.4Å; V603-Y639 HydrophobicContact CG1-CD1 3.29Å; V603-Y639 HydrophobicContact CG1-CD2 4.16Å; V603-Y639 HydrophobicContact CG1-CE1 4.07Å; V603-Y639 HydrophobicContact CG1-CG 3.35Å; L629-Y639 CarbonylContact C-O 3.52Å; L629-Y639 WeakPolarHBondContact CA-O 3.38Å; I630-Y639 PolarHBondContact N-O 3.38Å; I630-Y639 PolarHBondContact O-N 3.36Å; H632-Y639 HydrophobicContact CB-CE2 4.21Å; H632-Y639 AromaticContact CE1-CE2 3.75Å; H632-Y639 AromaticContact CE1-CZ 3.88Å; H632-Y639 AromaticContact CG-CE2 3.73Å; H632-Y639 AromaticContact ND1-CD2 3.93Å; H632-Y639 AromaticContact ND1-CE2 3.32Å; H632-Y639 VanDerWaalsContact ND1-CE2 3.32Å; H632-Y639 WeakPolarHBondContact ND1-CE2 3.39Å; H632-Y639 AromaticContact ND1-CZ 3.62Å; E635-Y639 PolarHBondContact OE2-OH 3.03Å; E635-Y639 VanDerWaalsContact OE2-OH 3.11Å; V637-Y639 HydrophobicContact CB-CE2 3.79Å; V637-Y639 HydrophobicContact CG1-CD2 4.02Å; V637-Y639 HydrophobicContact CG1-CE1 4.15Å; V637-Y639 HydrophobicContact CG1-CE2 3.52Å; Y639-Y648 HydrophobicContact CD1-CD2 4.28Å; Y639-Y648 AromaticContact CD1-CE2 3.73Å; Y639-Y648 HydrophobicContact CD1-CE2 3.73Å; Y639-N651 HydrophobicContact CD1-CB 3.9Å; Y639-N651 HydrophobicContact CE1-CB 3.95Å
640	K	93.9	Very high	92.2	Very high	10 Å²	10	35.4 Å²	35.4	4%	0.043	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	129.1	178.5	-170	168.6	-179.4	170.9	0	109.7	F627 V649 K650 S693 D696	F627-K640 HydrophobicContact CB-CG 4.14Å; F627-K640 HydrophobicContact CD1-CG 4.17Å; F627-K640 HydrophobicContact CG-CD 4.38Å; F627-K640 HydrophobicContact CG-CG 4.23Å; K640-V649 HydrophobicContact CB-CB 4.42Å; K640-V649 HydrophobicContact CG-CB 4.41Å; K640-V649 WeakPolarHBondContact O-CB 3.14Å; K640-V649 PolarHBondContact O-N 3.28Å; K640-K650 HydrophobicContact CB-CG 4.25Å; K640-K650 WeakPolarHBondContact CB-O 3.4Å; K640-K650 HydrophobicContact CD-CG 4.36Å; K640-K650 PolarHBondContact N-O 3.04Å; K640-S693 PolarHBondContact NZ-O 3.21Å; K640-D696 WeakPolarHBondContact CD-OD1 3.49Å; K640-D696 WeakPolarHBondContact CE-OD1 3.48Å; K640-D696 IonicContact NZ-OD1 3.8Å; K640-D696 PolarHBondContact NZ-OD1 3.39Å; K640-D696 IonicContact NZ-OD2 2.69Å; K640-D696 PolarHBondContact NZ-OD2 3.22Å
641	I	93.4	Very high	92.1	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.015	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	137.2	179.7	-178.4	159.4	0	0	0	109.9	W569 T600 F627 G628 I630 L643	W569-I641 HydrophobicContact CH2-CD1 3.77Å; W569-I641 HydrophobicContact CH2-CG1 4.27Å; W569-I641 HydrophobicContact CZ3-CD1 4Å; T600-I641 HydrophobicContact CG2-CD1 4.11Å; F627-I641 VanDerWaalsContact CA-O 3.29Å; F627-I641 WeakPolarHBondContact CA-O 3.19Å; G628-I641 PolarHBondContact N-O 3.41Å; G628-I641 WeakPolarHBondContact O-CG2 3.44Å; G628-I641 PolarHBondContact O-N 2.04Å; I630-I641 HydrophobicContact CD1-CB 4.11Å; I630-I641 HydrophobicContact CD1-CD1 3.74Å; I630-I641 HydrophobicContact CD1-CG2 3.84Å; I630-I641 HydrophobicContact CG1-CG2 4.08Å; I641-L643 HydrophobicContact CG2-CD2 4.36Å
642	N	93.3	Very high	92.1	Very high	17 Å²	17	39.4 Å²	39.4	9%	0.091	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	127	169.8	-179.2	2.3	0	0	0	108.5	R626 F627 E644 T645 T646 S647 V649	R626-N642 PolarHBondContact O-OD1 2.94Å; F627-N642 HydrophobicContact CD1-CB 4.39Å; F627-N642 HydrophobicContact CE1-CB 4.41Å; N642-E644 PolarHBondContact OD1-N 3.4Å; N642-E644 VanDerWaalsContact OD1-N 3.14Å; N642-T645 WeakPolarHBondContact CB-OG1 3.45Å; N642-T645 VanDerWaalsContact CG-OG1 3.3Å; N642-T645 PolarHBondContact ND2-OG1 3.31Å; N642-T646 WeakPolarHBondContact O-CA 3.2Å; N642-T646 PolarHBondContact O-N 2.87Å; N642-S647 PolarHBondContact N-O 2.89Å; N642-S647 PolarHBondContact O-N 2.9Å; N642-V649 HydrophobicContact CB-CG2 3.86Å
643	L	93.9	Very high	92.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-29.5	-175.3	-59	179.7	0	0	0	112.4	Q567 W569 I615 V625 R626 I641	Q567-L643 PolarHBondContact NE2-O 3.15Å; Q567-L643 PolarHBondContact OE1-O 2.76Å; W569-L643 HydrophobicContact CH2-CD2 3.72Å; W569-L643 HydrophobicContact CZ2-CB 4.45Å; W569-L643 HydrophobicContact CZ2-CD2 3.39Å; I615-L643 HydrophobicContact CD1-CD1 4.26Å; I615-L643 HydrophobicContact CD1-CD2 3.84Å; I615-L643 HydrophobicContact CG1-CD1 4.18Å; I615-L643 HydrophobicContact CG1-CD2 4.04Å; I615-L643 HydrophobicContact CG2-CD1 3.76Å; V625-L643 HydrophobicContact CG1-CD1 4.03Å; R626-L643 PolarHBondContact O-N 2.85Å; I641-L643 HydrophobicContact CG2-CD2 4.36Å
644	E	92.1	Very high	92.6	Very high	135 Å²	135	39.1 Å²	39.1	63%	0.631	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-44.8	176.4	-171.9	-175.9	-165.3	0	0	111.7	N642	N642-E644 PolarHBondContact OD1-N 3.4Å; N642-E644 VanDerWaalsContact OD1-N 3.14Å
645	T	91.8	Very high	92.9	Very high	64 Å²	64	42.9 Å²	42.9	39%	0.393	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	0.6	-173.7	56.1	0	0	0	0	114.2	N642 S647	N642-T645 WeakPolarHBondContact CB-OG1 3.45Å; N642-T645 VanDerWaalsContact CG-OG1 3.3Å; N642-T645 PolarHBondContact ND2-OG1 3.31Å; T645-S647 PolarHBondContact O-N 2.93Å; T645-S647 PolarHBondContact OG1-OG 2.98Å
646	T	90.4	Very high	92.9	Very high	26 Å²	26	49.6 Å²	49.6	16%	0.16	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	43.7	32.1	-172.1	65.3	0	0	0	0	114.4	W569 V585 Q601 N642	W569-T646 HydrophobicContact CH2-CG2 4.21Å; W569-T646 HydrophobicContact CZ2-CG2 4.05Å; V585-T646 HydrophobicContact CG2-CG2 4.27Å; Q601-T646 PolarHBondContact N-O 3.46Å; Q601-T646 VanDerWaalsContact N-O 3.14Å; N642-T646 WeakPolarHBondContact O-CA 3.2Å; N642-T646 PolarHBondContact O-N 2.87Å
647	S	89.1	Confident	92.8	Very high	22 Å²	22	52.3 Å²	52.3	15%	0.154	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	138.7	-170.4	68.4	0	0	0	0	112.7	Q601 N642 T645	Q601-S647 VanDerWaalsContact CD-CB 3.41Å; N642-S647 PolarHBondContact N-O 2.89Å; N642-S647 PolarHBondContact O-N 2.9Å; T645-S647 PolarHBondContact O-N 2.93Å; T645-S647 PolarHBondContact OG1-OG 2.98Å
648	Y	90	Very high	92.7	Very high	77 Å²	77	57.1 Å²	57.1	30%	0.302	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	137.4	169.6	168.9	-109.8	0	0	0	111.5	V603 Y639 K650 N651	V603-Y648 HydrophobicContact CG1-CD2 4.2Å; Y639-Y648 HydrophobicContact CD1-CD2 4.28Å; Y639-Y648 AromaticContact CD1-CE2 3.73Å; Y639-Y648 HydrophobicContact CD1-CE2 3.73Å; Y648-K650 WeakPolarHBondContact CE2-O 3.3Å; Y648-N651 HydrophobicContact CE2-CB 4.39Å; Y648-N651 PolarHBondContact OH-N 3.05Å
649	V	90.1	Very high	92.6	Very high	64 Å²	64	57.1 Å²	57.1	39%	0.388	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-62.8	-178.6	-179.3	0	0	0	0	110.7	F627 K640 N642	F627-V649 HydrophobicContact CD1-CG2 4.23Å; F627-V649 HydrophobicContact CE1-CG2 4.06Å; K640-V649 HydrophobicContact CB-CB 4.42Å; K640-V649 HydrophobicContact CG-CB 4.41Å; K640-V649 WeakPolarHBondContact O-CB 3.14Å; K640-V649 PolarHBondContact O-N 3.28Å; N642-V649 HydrophobicContact CB-CG2 3.86Å
650	K	90.4	Very high	92.6	Very high	63 Å²	63	58 Å²	58	27%	0.274	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	161.1	-178.9	62.6	-164.3	-90.2	-159	0	110.1	K640 Y648 T695 D696	K640-K650 HydrophobicContact CB-CG 4.25Å; K640-K650 WeakPolarHBondContact CB-O 3.4Å; K640-K650 HydrophobicContact CD-CG 4.36Å; K640-K650 PolarHBondContact N-O 3.04Å; Y648-K650 WeakPolarHBondContact CE2-O 3.3Å; K650-T695 PolarHBondContact NZ-O 3.23Å; K650-T695 VanDerWaalsContact NZ-O 3.07Å; K650-D696 HydrophobicContact CD-CB 4.42Å; K650-D696 VanDerWaalsContact CD-OD2 3.32Å; K650-D696 WeakPolarHBondContact CD-OD2 3.49Å; K650-D696 VanDerWaalsContact CE-OD2 3.24Å; K650-D696 WeakPolarHBondContact CE-OD2 3.42Å; K650-D696 VanDerWaalsContact NZ-CB 3.35Å; K650-D696 IonicContact NZ-OD2 3.2Å; K650-D696 PolarHBondContact NZ-OD2 3.15Å
651	N	92.7	Very high	92.7	Very high	88 Å²	88	57.7 Å²	57.7	47%	0.471	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	158.4	171	64.5	-21.4	0	0	0	110.9	V637 I638 Y639 Y648	V637-N651 HydrophobicContact CG1-CB 3.74Å; I638-N651 CarbonylContact O-C 3.46Å; I638-N651 WeakPolarHBondContact O-CA 3.46Å; Y639-N651 HydrophobicContact CD1-CB 3.9Å; Y639-N651 HydrophobicContact CE1-CB 3.95Å; Y648-N651 HydrophobicContact CE2-CB 4.39Å; Y648-N651 PolarHBondContact OH-N 3.05Å
652	I	94.6	Very high	92.7	Very high	5 Å²	5	62.7 Å²	62.7	3%	0.026	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	112.1	-175.2	-55.2	176.1	0	0	0	106	V637 I638 L691 D696	V637-I652 WeakPolarHBondContact CA-O 3.41Å; I638-I652 HydrophobicContact CB-CB 4.18Å; I638-I652 HydrophobicContact CG2-CD1 4.32Å; I638-I652 PolarHBondContact N-O 2.86Å; I638-I652 PolarHBondContact O-N 3.32Å; I652-L691 HydrophobicContact CD1-CD1 4.34Å; I652-L691 HydrophobicContact CD1-CD2 3.96Å; I652-L691 HydrophobicContact CG2-CD1 3.74Å; I652-L691 HydrophobicContact CG2-CD2 4.38Å; I652-D696 HydrophobicContact CD1-CB 3.74Å; I652-D696 HydrophobicContact CG1-CB 3.96Å
653	S	94.6	Very high	92.7	Very high	66 Å²	66	63 Å²	63	46%	0.462	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	129.4	-177.4	-174.9	0	0	0	0	111	W655	S653-W655 PolarHBondContact OG-N 3.18Å
654	L	95.7	Very high	92.9	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.315	C	S	.	.			trans	-112.4	8.6	168.3	-52.7	-177.7	0	0	0	112.1	P636 I638 E656 F657 N658 C659 V675 L689 V698	P636-L654 HydrophobicContact CB-CB 4.47Å; P636-L654 WeakPolarHBondContact O-CA 3.27Å; P636-L654 WeakPolarHBondContact O-CB 3.49Å; P636-L654 PolarHBondContact O-N 3.1Å; I638-L654 HydrophobicContact CD1-CD1 3.93Å; I638-L654 HydrophobicContact CG1-CD1 3.92Å; L654-E656 VanDerWaalsContact C-N 3.31Å; L654-E656 PolarHBondContact O-N 2.81Å; L654-F657 PolarHBondContact O-N 2.86Å; L654-N658 PolarHBondContact O-N 3.43Å; L654-C659 HydrophobicContact CB-CB 4.19Å; L654-C659 VanDerWaalsContact CB-O 3.3Å; L654-C659 WeakPolarHBondContact CB-O 3.21Å; L654-C659 HydrophobicContact CD1-CB 4.41Å; L654-C659 WeakPolarHBondContact CD1-O 3.48Å; L654-C659 PolarHBondContact O-N 3.27Å; L654-V675 HydrophobicContact CD1-CG1 4.3Å; L654-L689 HydrophobicContact CD2-CD1 4.11Å; L654-V698 HydrophobicContact CD2-CG2 3.53Å
655	W	93.8	Very high	93.1	Very high	178 Å²	178	57.5 Å²	57.5	67%	0.674	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-56.4	-41	-177.6	-78.5	89.7	0	0	0	113.1	P636 S653 F657 N658	P636-W655 HydrophobicContact CG-CD2 3.55Å; P636-W655 VanDerWaalsContact CG-CE2 3.47Å; P636-W655 HydrophobicContact CG-CE3 3.96Å; P636-W655 HydrophobicContact CG-CG 3.93Å; P636-W655 HydrophobicContact CG-CH2 4.21Å; P636-W655 HydrophobicContact CG-CZ2 3.82Å; P636-W655 HydrophobicContact CG-CZ3 4.27Å; S653-W655 PolarHBondContact OG-N 3.18Å; W655-F657 PolarHBondContact O-N 3.07Å; W655-F657 VanDerWaalsContact O-N 3.15Å; W655-N658 PolarHBondContact O-N 3.4Å; W655-N658 VanDerWaalsContact O-N 3.1Å
656	E	92.7	Very high	93.4	Very high	180 Å²	180	56.5 Å²	56.5	84%	0.841	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-62.4	-20.7	179.2	-63.2	179.4	177.1	0	0	113.1	L654	L654-E656 VanDerWaalsContact C-N 3.31Å; L654-E656 PolarHBondContact O-N 2.81Å
657	F	92.2	Very high	93.6	Very high	66 Å²	66	55.3 Å²	55.3	29%	0.289	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-105.5	-1.5	-179.5	-55.3	-83.4	0	0	0	112.8	L654 W655 C659 Q686 L689 V698	L654-F657 PolarHBondContact O-N 2.86Å; W655-F657 PolarHBondContact O-N 3.07Å; W655-F657 VanDerWaalsContact O-N 3.15Å; F657-C659 HydrophobicContact CB-CB 4.18Å; F657-C659 PolarHBondContact O-N 3.14Å; F657-Q686 PolarHBondContact O-OE1 2.77Å; F657-L689 HydrophobicContact CB-CD1 3.66Å; F657-L689 HydrophobicContact CB-CD2 4.08Å; F657-L689 HydrophobicContact CD1-CD1 4.4Å; F657-L689 HydrophobicContact CD1-CD2 3.69Å; F657-L689 HydrophobicContact CD2-CD1 4.09Å; F657-L689 HydrophobicContact CE1-CD2 4.38Å; F657-L689 HydrophobicContact CG-CD1 3.78Å; F657-L689 HydrophobicContact CG-CD2 3.92Å; F657-V698 HydrophobicContact CD2-CB 4.38Å; F657-V698 HydrophobicContact CD2-CG1 4.19Å; F657-V698 HydrophobicContact CD2-CG2 4.25Å; F657-V698 HydrophobicContact CE1-CG1 3.97Å; F657-V698 HydrophobicContact CE2-CB 3.61Å; F657-V698 HydrophobicContact CE2-CG1 3.6Å; F657-V698 HydrophobicContact CE2-CG2 3.89Å; F657-V698 HydrophobicContact CZ-CB 3.85Å; F657-V698 HydrophobicContact CZ-CG1 3.48Å; F657-V698 VanDerWaalsContact CZ-CG1 3.48Å
658	N	91.8	Very high	93.8	Very high	111 Å²	111	54.9 Å²	54.9	59%	0.594	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	36	-172.2	-167.9	38.4	0	0	0	113.3	L654 W655 Q686	L654-N658 PolarHBondContact O-N 3.43Å; W655-N658 PolarHBondContact O-N 3.4Å; W655-N658 VanDerWaalsContact O-N 3.1Å; N658-Q686 PolarHBondContact O-NE2 2.81Å
659	C	93.6	Very high	94	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.251	C	S	.	.			trans	-105.6	106.7	-172.6	176.6	0	0	0	0	111.1	P636 L654 F657 C677 L689	P636-C659 WeakPolarHBondContact CA-O 3.37Å; P636-C659 WeakPolarHBondContact CB-O 3.44Å; L654-C659 HydrophobicContact CB-CB 4.19Å; L654-C659 VanDerWaalsContact CB-O 3.3Å; L654-C659 WeakPolarHBondContact CB-O 3.21Å; L654-C659 HydrophobicContact CD1-CB 4.41Å; L654-C659 WeakPolarHBondContact CD1-O 3.48Å; L654-C659 PolarHBondContact O-N 3.27Å; F657-C659 HydrophobicContact CB-CB 4.18Å; F657-C659 PolarHBondContact O-N 3.14Å; C659-C677 HydrophobicContact CB-CB 3.95Å; C659-C677 WeakPolarHBondContact CB-SG 3.24Å; C659-C677 WeakPolarHBondContact SG-CB 3.22Å; C659-C677 CovalentContact SG-SG 2.04Å; C659-C677 PolarHBondContact SG-SG 3.12Å; C659-L689 HydrophobicContact CB-CD1 3.68Å
660	I	95.1	Very high	94.2	Very high	43 Å²	43	48.2 Å²	48.2	22%	0.221	23%	0.232	C	C	.	.			trans	-82.5	123	163.3	-59	166.9	0	0	0	107.1	N634 P636 C677 R678	N634-I660 HydrophobicContact CB-CD1 4.46Å; P636-I660 HydrophobicContact CB-CG1 4.22Å; I660-C677 CarbonylContact O-C 3.55Å; I660-C677 WeakPolarHBondContact O-CA 3.42Å; I660-R678 HydrophobicContact CB-CB 4.45Å; I660-R678 HydrophobicContact CB-CG 4.3Å; I660-R678 HydrophobicContact CG2-CG 4.27Å; I660-R678 PolarHBondContact O-N 3.17Å
661	P	95.4	Very high	94.4	Very high	4 Å²	4	45.2 Å²	45.2	3%	0.026	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	140.8	-176.7	26.4	-32.8	0	0	0	111.6	F631 E635 I638 V675	F631-P661 HydrophobicContact CB-CG 4.05Å; F631-P661 HydrophobicContact CD1-CB 3.94Å; F631-P661 HydrophobicContact CD1-CG 3.77Å; F631-P661 HydrophobicContact CE1-CB 4.37Å; F631-P661 HydrophobicContact CG-CB 4.27Å; F631-P661 HydrophobicContact CG-CG 4.07Å; E635-P661 WeakPolarHBondContact O-CD 3.07Å; I638-P661 HydrophobicContact CG1-CB 4.33Å; I638-P661 HydrophobicContact CG1-CG 4.15Å; P661-V675 HydrophobicContact CB-CG1 4.11Å
662	K	92.9	Very high	94.5	Very high	108 Å²	108	42 Å²	42	47%	0.47	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	-40.4	177.7	-177.5	-178.6	172.9	-174.4	0	112.3	N676 R678	K662-N676 WeakPolarHBondContact CB-O 3.02Å; K662-N676 PolarHBondContact N-O 3.24Å; K662-R678 HydrophobicContact CB-CG 3.95Å; K662-R678 HydrophobicContact CG-CG 4.47Å
663	S	93.9	Very high	94.7	Very high	24 Å²	24	42 Å²	42	17%	0.168	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	150.9	177.8	44.2	0	0	0	0	110.4	N676	S663-N676 PolarHBondContact N-O 3.21Å; S663-N676 PolarHBondContact O-N 2.62Å; S663-N676 PolarHBondContact OG-ND2 2.92Å
664	V	97	Very high	94.9	Very high	13 Å²	13	38.9 Å²	38.9	8%	0.079	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	142.3	-177.5	179	0	0	0	0	110	F614 L629 F631 Y673 F674 V675	F614-V664 HydrophobicContact CD1-CG1 4.22Å; F614-V664 HydrophobicContact CD2-CB 4.33Å; F614-V664 WeakPolarHBondContact CD2-O 3.01Å; F614-V664 HydrophobicContact CE1-CG1 4.33Å; F614-V664 WeakPolarHBondContact CE2-O 3.17Å; F614-V664 HydrophobicContact CG-CB 4.22Å; F614-V664 HydrophobicContact CG-CG1 4.41Å; L629-V664 HydrophobicContact CD1-CG1 4.26Å; F631-V664 HydrophobicContact CE1-CG2 3.94Å; F631-V664 HydrophobicContact CE2-CG2 4.17Å; F631-V664 HydrophobicContact CZ-CB 4.09Å; F631-V664 HydrophobicContact CZ-CG2 3.4Å; F631-V664 VanDerWaalsContact CZ-CG2 3.4Å; V664-Y673 HydrophobicContact CG1-CD1 3.84Å; V664-Y673 HydrophobicContact CG1-CG 4.36Å; V664-F674 VanDerWaalsContact CA-O 3.3Å; V664-F674 WeakPolarHBondContact CA-O 3.41Å; V664-V675 HydrophobicContact CG2-CB 4.4Å; V664-V675 HydrophobicContact CG2-CG1 4.22Å; V664-V675 HydrophobicContact CG2-CG2 4.08Å
665	A	97.4	Very high	95	Very high	5 Å²	5	38.9 Å²	38.9	4%	0.041	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	162.2	163	0	0	0	0	0	109.8	Y673 F674 P709 M711 L718	A665-Y673 CarbonylContact O-C 3.54Å; A665-Y673 VanDerWaalsContact O-CA 3.3Å; A665-Y673 WeakPolarHBondContact O-CA 3.29Å; A665-F674 PolarHBondContact N-O 3.29Å; A665-F674 PolarHBondContact O-N 3.14Å; A665-P709 HydrophobicContact CB-CB 3.73Å; A665-P709 HydrophobicContact CB-CG 3.94Å; A665-M711 HydrophobicContact CB-CB 4.28Å; A665-L718 HydrophobicContact CB-CD1 4.43Å
666	Y	97.1	Very high	95.1	Very high	44 Å²	44	30.8 Å²	30.8	17%	0.173	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	137.1	-175.9	172.2	-102.3	0	0	0	111.3	T326 P616 H668 Y672 Y673 M711	T326-Y666 WeakPolarHBondContact CG2-OH 3.44Å; P616-Y666 HydrophobicContact CB-CD1 3.68Å; P616-Y666 HydrophobicContact CB-CE1 4.06Å; P616-Y666 HydrophobicContact CB-CG 4.32Å; P616-Y666 HydrophobicContact CG-CD1 4Å; P616-Y666 HydrophobicContact CG-CE1 4.31Å; P616-Y666 HydrophobicContact CG-CG 4.23Å; Y666-H668 HydrophobicContact CE1-CB 4.04Å; Y666-Y672 WeakPolarHBondContact CA-O 3.03Å; Y666-Y672 WeakPolarHBondContact CD2-O 3.2Å; Y666-Y673 AromaticContact CD2-CD1 3.45Å; Y666-Y673 HydrophobicContact CD2-CD1 3.45Å; Y666-Y673 VanDerWaalsContact CD2-CD1 3.45Å; Y666-Y673 HydrophobicContact CD2-CD2 4.12Å; Y666-Y673 AromaticContact CD2-CE1 3.33Å; Y666-Y673 HydrophobicContact CD2-CE1 3.33Å; Y666-Y673 HydrophobicContact CD2-CE2 4.06Å; Y666-Y673 AromaticContact CD2-CG 3.84Å; Y666-Y673 HydrophobicContact CD2-CG 3.84Å; Y666-Y673 AromaticContact CD2-CZ 3.66Å; Y666-Y673 HydrophobicContact CE2-CD1 4.42Å; Y666-Y673 HydrophobicContact CE2-CD2 4.49Å; Y666-Y673 HydrophobicContact CE2-CE1 4.03Å; Y666-Y673 HydrophobicContact CE2-CE2 4.13Å; Y666-Y673 AromaticContact CE2-CZ 3.87Å; Y666-Y673 AromaticContact CG-CD1 3.97Å; Y666-Y673 HydrophobicContact CG-CD1 3.97Å; Y666-Y673 AromaticContact CG-CE1 3.83Å; Y666-Y673 HydrophobicContact CG-CE1 3.83Å; Y666-M711 WeakPolarHBondContact O-CG 3.36Å
667	T	96.1	Very high	95.2	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	136.5	163.5	-177.4	0	0	0	0	110.7	V669 G671 Y672 F674 G715 I733	T667-V669 VanDerWaalsContact C-N 3.25Å; T667-V669 PolarHBondContact OG1-N 2.89Å; T667-V669 VanDerWaalsContact OG1-N 3.13Å; T667-G671 CarbonylContact O-C 3.53Å; T667-G671 VanDerWaalsContact O-CA 3.28Å; T667-G671 WeakPolarHBondContact O-CA 3.27Å; T667-Y672 HydrophobicContact CG2-CD2 4.11Å; T667-Y672 PolarHBondContact N-O 3.47Å; T667-Y672 PolarHBondContact O-N 3.18Å; T667-Y672 VanDerWaalsContact O-N 3.12Å; T667-F674 HydrophobicContact CG2-CE2 4.08Å; T667-G715 WeakPolarHBondContact CB-O 3.38Å; T667-G715 PolarHBondContact OG1-O 3.06Å; T667-I733 HydrophobicContact CG2-CD1 3.89Å
668	H	93.8	Very high	95.2	Very high	14 Å²	14	22.7 Å²	22.7	7%	0.065	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-15.6	171.9	66.5	-102.7	0	0	0	112.5	T325 T326 V622 Y666 G670 D714	T325-H668 CarbonylContact C-O 3.5Å; T325-H668 WeakPolarHBondContact CB-O 3.27Å; T325-H668 PolarHBondContact OG1-CD2 3.16Å; T325-H668 PolarHBondContact OG1-O 3.47Å; T326-H668 PolarHBondContact N-O 2.93Å; V622-H668 HydrophobicContact CG2-CB 3.86Å; Y666-H668 HydrophobicContact CE1-CB 4.04Å; H668-G670 PolarHBondContact O-N 3.28Å; H668-D714 PolarHBondContact CE1-O 3.01Å; H668-D714 VanDerWaalsContact CE1-O 3.23Å
669	V	93.9	Very high	95	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.006	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	102.4	-176.3	-167.6	0	0	0	0	109	M328 I379 T667 G671 L716 I733 S734	M328-V669 HydrophobicContact CE-CG1 4.25Å; M328-V669 HydrophobicContact SD-CG1 3.54Å; M328-V669 VanDerWaalsContact SD-CG1 3.54Å; I379-V669 HydrophobicContact CD1-CG2 4.47Å; T667-V669 VanDerWaalsContact C-N 3.25Å; T667-V669 PolarHBondContact OG1-N 2.89Å; T667-V669 VanDerWaalsContact OG1-N 3.13Å; V669-G671 PolarHBondContact O-N 3.34Å; V669-L716 HydrophobicContact CG2-CD2 4.14Å; V669-I733 HydrophobicContact CB-CG2 4.17Å; V669-I733 HydrophobicContact CG1-CG2 4.36Å; V669-S734 WeakPolarHBondContact CG1-O 3.26Å
670	G	93.1	Very high	94.4	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	-12.9	-167.9	0	0	0	0	0	114.6	R296 T325 T326 H668	R296-G670 PolarHBondContact NH2-O 3.47Å; T325-G670 PolarHBondContact O-N 2.98Å; T326-G670 CarbonylContact O-C 3.49Å; T326-G670 VanDerWaalsContact O-O 3.11Å; H668-G670 PolarHBondContact O-N 3.28Å
671	G	94.5	Very high	93.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	73	58.2	169.4	0	0	0	0	0	114	T667 V669 S693	T667-G671 CarbonylContact O-C 3.53Å; T667-G671 VanDerWaalsContact O-CA 3.28Å; T667-G671 WeakPolarHBondContact O-CA 3.27Å; V669-G671 PolarHBondContact O-N 3.34Å; G671-S693 VanDerWaalsContact C-OG 3.29Å; G671-S693 WeakPolarHBondContact CA-OG 3.33Å; G671-S693 VanDerWaalsContact O-CB 3.24Å; G671-S693 WeakPolarHBondContact O-CB 3.43Å; G671-S693 PolarHBondContact O-N 2.91Å; G671-S693 PolarHBondContact O-OG 3.39Å
672	Y	96.3	Very high	93.1	Very high	19 Å²	19	32.5 Å²	32.5	8%	0.075	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	135.5	-177.8	-55.5	-72.3	0	0	0	112.3	Y666 T667 I690 L691 I699 G737 I739	Y666-Y672 WeakPolarHBondContact CA-O 3.03Å; Y666-Y672 WeakPolarHBondContact CD2-O 3.2Å; T667-Y672 HydrophobicContact CG2-CD2 4.11Å; T667-Y672 PolarHBondContact N-O 3.47Å; T667-Y672 PolarHBondContact O-N 3.18Å; T667-Y672 VanDerWaalsContact O-N 3.12Å; Y672-I690 HydrophobicContact CD1-CG2 3.99Å; Y672-I690 HydrophobicContact CG-CG2 4.29Å; Y672-L691 WeakPolarHBondContact CA-O 3.01Å; Y672-I699 HydrophobicContact CD1-CD1 4.1Å; Y672-I699 HydrophobicContact CE1-CD1 3.89Å; Y672-G737 WeakPolarHBondContact CE2-O 3.19Å; Y672-I739 HydrophobicContact CD2-CD1 4.31Å; Y672-I739 HydrophobicContact CG-CD1 4.48Å
673	Y	97.9	Very high	92.4	Very high	6 Å²	6	29.8 Å²	29.8	2%	0.024	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	138.4	162.9	-59.2	-87	0	0	0	110.1	F614 P616 L629 V664 A665 Y666 I690 L691 S693	F614-Y673 HydrophobicContact CD1-CE1 4.27Å; F614-Y673 HydrophobicContact CE1-CD1 4.14Å; F614-Y673 AromaticContact CE1-CE1 3.97Å; F614-Y673 HydrophobicContact CE1-CE1 3.97Å; P616-Y673 HydrophobicContact CG-CE1 4.3Å; L629-Y673 HydrophobicContact CD1-CD1 3.59Å; L629-Y673 HydrophobicContact CD1-CD2 4.41Å; L629-Y673 HydrophobicContact CD1-CE1 3.55Å; L629-Y673 HydrophobicContact CD1-CE2 4.34Å; L629-Y673 HydrophobicContact CD1-CG 4.05Å; L629-Y673 HydrophobicContact CG-CE1 4.1Å; V664-Y673 HydrophobicContact CG1-CD1 3.84Å; V664-Y673 HydrophobicContact CG1-CG 4.36Å; A665-Y673 CarbonylContact O-C 3.54Å; A665-Y673 VanDerWaalsContact O-CA 3.3Å; A665-Y673 WeakPolarHBondContact O-CA 3.29Å; Y666-Y673 AromaticContact CD2-CD1 3.45Å; Y666-Y673 HydrophobicContact CD2-CD1 3.45Å; Y666-Y673 VanDerWaalsContact CD2-CD1 3.45Å; Y666-Y673 HydrophobicContact CD2-CD2 4.12Å; Y666-Y673 AromaticContact CD2-CE1 3.33Å; Y666-Y673 HydrophobicContact CD2-CE1 3.33Å; Y666-Y673 HydrophobicContact CD2-CE2 4.06Å; Y666-Y673 AromaticContact CD2-CG 3.84Å; Y666-Y673 HydrophobicContact CD2-CG 3.84Å; Y666-Y673 AromaticContact CD2-CZ 3.66Å; Y666-Y673 HydrophobicContact CE2-CD1 4.42Å; Y666-Y673 HydrophobicContact CE2-CD2 4.49Å; Y666-Y673 HydrophobicContact CE2-CE1 4.03Å; Y666-Y673 HydrophobicContact CE2-CE2 4.13Å; Y666-Y673 AromaticContact CE2-CZ 3.87Å; Y666-Y673 AromaticContact CG-CD1 3.97Å; Y666-Y673 HydrophobicContact CG-CD1 3.97Å; Y666-Y673 AromaticContact CG-CE1 3.83Å; Y666-Y673 HydrophobicContact CG-CE1 3.83Å; Y673-I690 WeakPolarHBondContact O-CA 3.48Å; Y673-L691 HydrophobicContact CD2-CD2 3.98Å; Y673-L691 HydrophobicContact CD2-CG 4.18Å; Y673-L691 HydrophobicContact CG-CD2 4.39Å; Y673-L691 PolarHBondContact N-O 2.73Å; Y673-L691 PolarHBondContact O-N 3.5Å; Y673-S693 VanDerWaalsContact CE2-CB 3.45Å
674	F	98.1	Very high	91.8	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	110.4	172.6	-61.4	-88.4	0	0	0	108	V664 A665 T667 I690 P709 M711 L718 I733 I739	V664-F674 VanDerWaalsContact CA-O 3.3Å; V664-F674 WeakPolarHBondContact CA-O 3.41Å; A665-F674 PolarHBondContact N-O 3.29Å; A665-F674 PolarHBondContact O-N 3.14Å; T667-F674 HydrophobicContact CG2-CE2 4.08Å; F674-I690 HydrophobicContact CD1-CG1 4.08Å; F674-I690 HydrophobicContact CE1-CD1 4.26Å; F674-I690 HydrophobicContact CE1-CG1 4.07Å; F674-I690 HydrophobicContact CE1-CG2 4.49Å; F674-P709 HydrophobicContact CB-CB 4.31Å; F674-P709 HydrophobicContact CB-CG 4.43Å; F674-M711 HydrophobicContact CD2-CE 3.79Å; F674-M711 HydrophobicContact CE2-CE 3.61Å; F674-L718 HydrophobicContact CB-CD1 4.44Å; F674-L718 HydrophobicContact CD1-CD2 3.48Å; F674-L718 VanDerWaalsContact CD1-CD2 3.48Å; F674-L718 HydrophobicContact CD2-CD1 4.19Å; F674-L718 HydrophobicContact CD2-CD2 4.08Å; F674-L718 HydrophobicContact CE1-CD2 3.52Å; F674-L718 HydrophobicContact CE2-CD2 4.12Å; F674-L718 HydrophobicContact CG-CD1 4.19Å; F674-L718 HydrophobicContact CG-CD2 3.77Å; F674-L718 HydrophobicContact CZ-CD2 3.86Å; F674-I733 HydrophobicContact CE2-CD1 4.3Å; F674-I733 HydrophobicContact CZ-CD1 4.38Å; F674-I739 HydrophobicContact CE1-CD1 3.8Å; F674-I739 HydrophobicContact CE1-CG1 4.46Å; F674-I739 HydrophobicContact CZ-CD1 3.66Å; F674-I739 HydrophobicContact CZ-CG1 4.03Å
675	V	97.8	Very high	91.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	116.1	-173.5	-176.3	0	0	0	0	109.4	I638 L654 P661 V664 Q688 L689	I638-V675 HydrophobicContact CD1-CG1 4.11Å; I638-V675 HydrophobicContact CD1-CG2 3.81Å; L654-V675 HydrophobicContact CD1-CG1 4.3Å; P661-V675 HydrophobicContact CB-CG1 4.11Å; V664-V675 HydrophobicContact CG2-CB 4.4Å; V664-V675 HydrophobicContact CG2-CG1 4.22Å; V664-V675 HydrophobicContact CG2-CG2 4.08Å; V675-Q688 CarbonylContact O-C 3.59Å; V675-Q688 VanDerWaalsContact O-CA 3.24Å; V675-Q688 WeakPolarHBondContact O-CA 3.35Å; V675-L689 HydrophobicContact CB-CB 4.35Å; V675-L689 PolarHBondContact N-O 3.21Å; V675-L689 PolarHBondContact O-N 3.38Å
676	N	96.3	Very high	90.7	Very high	8 Å²	8	34.3 Å²	34.3	4%	0.043	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	128.1	171.1	168.8	56.2	0	0	0	110.1	K662 S663 Q688 G707 P709	K662-N676 WeakPolarHBondContact CB-O 3.02Å; K662-N676 PolarHBondContact N-O 3.24Å; S663-N676 PolarHBondContact N-O 3.21Å; S663-N676 PolarHBondContact O-N 2.62Å; S663-N676 PolarHBondContact OG-ND2 2.92Å; N676-Q688 HydrophobicContact CB-CG 4.17Å; N676-G707 WeakPolarHBondContact CB-O 3.45Å; N676-G707 PolarHBondContact OD1-O 2.55Å; N676-P709 HydrophobicContact CB-CG 4.36Å
677	C	94.5	Very high	90.6	Very high	6 Å²	6	33.6 Å²	33.6	4%	0.041	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	163.9	-176.4	-50.9	0	0	0	0	111.6	C659 I660	C659-C677 HydrophobicContact CB-CB 3.95Å; C659-C677 WeakPolarHBondContact CB-SG 3.24Å; C659-C677 WeakPolarHBondContact SG-CB 3.22Å; C659-C677 CovalentContact SG-SG 2.04Å; C659-C677 PolarHBondContact SG-SG 3.12Å; I660-C677 CarbonylContact O-C 3.55Å; I660-C677 WeakPolarHBondContact O-CA 3.42Å
678	R	92	Very high	90.6	Very high	71 Å²	71	33.6 Å²	33.6	27%	0.268	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-69	147.9	161.8	-65	-178.7	-175.5	-137.6	-26.8	109.4	E611 I660 K662	E611-R678 IonicContact OE1-CZ 3.82Å; E611-R678 VanDerWaalsContact OE1-CZ 3.23Å; E611-R678 IonicContact OE1-NH1 3.54Å; E611-R678 PolarHBondContact OE1-NH1 2.83Å; E611-R678 IonicContact OE1-NH2 3.82Å; E611-R678 PolarHBondContact OE1-NH2 2.79Å; E611-R678 IonicContact OE2-CZ 2.74Å; E611-R678 IonicContact OE2-NH1 3.06Å; E611-R678 PolarHBondContact OE2-NH1 2.82Å; E611-R678 VanDerWaalsContact OE2-NH1 3.08Å; E611-R678 IonicContact OE2-NH2 2.83Å; E611-R678 PolarHBondContact OE2-NH2 2.96Å; I660-R678 HydrophobicContact CB-CB 4.45Å; I660-R678 HydrophobicContact CB-CG 4.3Å; I660-R678 HydrophobicContact CG2-CG 4.27Å; I660-R678 PolarHBondContact O-N 3.17Å; K662-R678 HydrophobicContact CB-CG 3.95Å; K662-R678 HydrophobicContact CG-CG 4.47Å
679	P	88.1	Confident	90.7	Very high	61 Å²	61	33 Å²	33	40%	0.396	21%	0.209	S	C	.	.	P	Polyproline II helix	trans	-57	150.3	165.4	-19.6	31.9	0	0	0	110.5	A684 T685	P679-A684 VanDerWaalsContact CA-O 3.27Å; P679-A684 WeakPolarHBondContact CA-O 3.38Å; P679-T685 HydrophobicContact CG-CG2 4.36Å
680	D	81.3	Confident	90.9	Very high	56 Å²	56	33.6 Å²	33.6	30%	0.299	21%	0.212	S	C	.	.			trans	-75.3	-176	177.4	71.3	20.2	0	0	0	112.9	T682 G683 A684	D680-T682 PolarHBondContact O-N 3.03Å; D680-T682 VanDerWaalsContact O-N 3.14Å; D680-T682 WeakPolarHBondContact OD1-CA 3.44Å; D680-T682 WeakPolarHBondContact OD1-CB 3.09Å; D680-T682 PolarHBondContact OD1-N 2.96Å; D680-T682 PolarHBondContact OD1-OG1 3.44Å; D680-G683 PolarHBondContact O-N 2.93Å; D680-G683 PolarHBondContact OD1-N 2.85Å; D680-A684 PolarHBondContact N-O 3.31Å; D680-A684 VanDerWaalsContact N-O 3.07Å; D680-A684 PolarHBondContact OD1-N 3.25Å; D680-A684 VanDerWaalsContact OD1-N 3.12Å
681	S	81.1	Confident	91.1	Very high	130 Å²	130	33.6 Å²	33.6	91%	0.909	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-10.9	179.5	53.6	0	0	0	0	114.8
682	T	81.9	Confident	91.1	Very high	116 Å²	116	33.6 Å²	33.6	71%	0.712	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-9.5	170.8	76.2	0	0	0	0	112.5	D680 A684	D680-T682 PolarHBondContact O-N 3.03Å; D680-T682 VanDerWaalsContact O-N 3.14Å; D680-T682 WeakPolarHBondContact OD1-CA 3.44Å; D680-T682 WeakPolarHBondContact OD1-CB 3.09Å; D680-T682 PolarHBondContact OD1-N 2.96Å; D680-T682 PolarHBondContact OD1-OG1 3.44Å; T682-A684 PolarHBondContact OG1-N 2.96Å
683	G	78.2	Confident	91	Very high	52 Å²	52	33.4 Å²	33.4	54%	0.536	21%	0.214	S	C	.	.			trans	86.8	5.5	-172.8	0	0	0	0	0	114	D680	D680-G683 PolarHBondContact O-N 2.93Å; D680-G683 PolarHBondContact OD1-N 2.85Å
684	A	80.5	Confident	90.7	Very high	46 Å²	46	34 Å²	34	38%	0.38	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-72.8	133.4	179.8	0	0	0	0	0	111.3	P679 D680 T682	P679-A684 VanDerWaalsContact CA-O 3.27Å; P679-A684 WeakPolarHBondContact CA-O 3.38Å; D680-A684 PolarHBondContact N-O 3.31Å; D680-A684 VanDerWaalsContact N-O 3.07Å; D680-A684 PolarHBondContact OD1-N 3.25Å; D680-A684 VanDerWaalsContact OD1-N 3.12Å; T682-A684 PolarHBondContact OG1-N 2.96Å
685	T	83.3	Confident	90.4	Very high	54 Å²	54	34.2 Å²	34.2	33%	0.331	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-84.9	120.4	174.6	45.7	0	0	0	0	110.7	P679	P679-T685 HydrophobicContact CG-CG2 4.36Å
686	Q	89.2	Confident	90.2	Very high	36 Å²	36	35 Å²	35	17%	0.168	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-77.4	151.1	171.7	-62.3	172	4.6	0	0	110.8	F657 N658	F657-Q686 PolarHBondContact O-OE1 2.77Å; N658-Q686 PolarHBondContact O-NE2 2.81Å
687	P	93.9	Very high	90	Very high	30 Å²	30	35.3 Å²	35.3	20%	0.195	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-60	148.9	167.8	-20.5	32.3	0	0	0	111.7	Q701 R703 V705	P687-Q701 HydrophobicContact CB-CB 4.26Å; P687-Q701 HydrophobicContact CB-CG 4.24Å; P687-R703 VanDerWaalsContact CB-O 3.24Å; P687-R703 WeakPolarHBondContact CB-O 3.43Å; P687-V705 WeakPolarHBondContact CA-O 3.36Å
688	Q	96.3	Very high	90.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-56.7	146	174.7	-69.7	168.9	-2.7	0	0	111.6	V675 N676 Q701 N702 V705 G707 T720	V675-Q688 CarbonylContact O-C 3.59Å; V675-Q688 VanDerWaalsContact O-CA 3.24Å; V675-Q688 WeakPolarHBondContact O-CA 3.35Å; N676-Q688 HydrophobicContact CB-CG 4.17Å; Q688-Q701 CarbonylContact O-C 3.54Å; Q688-Q701 VanDerWaalsContact O-CA 3.31Å; Q688-Q701 WeakPolarHBondContact O-CA 3.42Å; Q688-N702 HydrophobicContact CB-CB 4.03Å; Q688-N702 PolarHBondContact O-N 2.77Å; Q688-N702 PolarHBondContact OE1-ND2 3.27Å; Q688-N702 VanDerWaalsContact OE1-ND2 3.13Å; Q688-V705 WeakPolarHBondContact CG-O 3.41Å; Q688-V705 PolarHBondContact N-O 3.36Å; Q688-G707 PolarHBondContact NE2-O 2.92Å; Q688-T720 PolarHBondContact NE2-OG1 2.59Å
689	L	97.4	Very high	90.2	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	144	169.2	-56.4	179.2	0	0	0	110.2	L654 F657 C659 V675 V698 Q701	L654-L689 HydrophobicContact CD2-CD1 4.11Å; F657-L689 HydrophobicContact CB-CD1 3.66Å; F657-L689 HydrophobicContact CB-CD2 4.08Å; F657-L689 HydrophobicContact CD1-CD1 4.4Å; F657-L689 HydrophobicContact CD1-CD2 3.69Å; F657-L689 HydrophobicContact CD2-CD1 4.09Å; F657-L689 HydrophobicContact CE1-CD2 4.38Å; F657-L689 HydrophobicContact CG-CD1 3.78Å; F657-L689 HydrophobicContact CG-CD2 3.92Å; C659-L689 HydrophobicContact CB-CD1 3.68Å; V675-L689 HydrophobicContact CB-CB 4.35Å; V675-L689 PolarHBondContact N-O 3.21Å; V675-L689 PolarHBondContact O-N 3.38Å; L689-V698 HydrophobicContact CB-CG1 4.14Å; L689-V698 HydrophobicContact CD1-CG1 4.41Å; L689-V698 HydrophobicContact CD2-CG1 4.39Å; L689-Q701 HydrophobicContact CD2-CG 3.85Å
690	I	97.4	Very high	90.5	Very high	14 Å²	14	33.9 Å²	33.9	7%	0.072	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	131.2	169.6	-51.2	170.9	0	0	0	108.3	Y672 Y673 F674 V698 I699 G700 N702 I739	Y672-I690 HydrophobicContact CD1-CG2 3.99Å; Y672-I690 HydrophobicContact CG-CG2 4.29Å; Y673-I690 WeakPolarHBondContact O-CA 3.48Å; F674-I690 HydrophobicContact CD1-CG1 4.08Å; F674-I690 HydrophobicContact CE1-CD1 4.26Å; F674-I690 HydrophobicContact CE1-CG1 4.07Å; F674-I690 HydrophobicContact CE1-CG2 4.49Å; I690-V698 WeakPolarHBondContact O-CA 3.23Å; I690-I699 HydrophobicContact CB-CD1 4.12Å; I690-I699 HydrophobicContact CB-CG1 3.76Å; I690-I699 HydrophobicContact CG2-CD1 3.64Å; I690-I699 HydrophobicContact CG2-CG1 3.79Å; I690-I699 PolarHBondContact O-N 3.24Å; I690-G700 PolarHBondContact N-O 2.91Å; I690-N702 HydrophobicContact CD1-CB 3.9Å; I690-N702 HydrophobicContact CG1-CB 3.79Å; I690-I739 HydrophobicContact CD1-CD1 3.94Å; I690-I739 HydrophobicContact CG2-CD1 4.37Å
691	L	96.8	Very high	91.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.1	-177	167.8	69.2	0	0	0	109.3	I638 I652 Y672 Y673 S697	I638-L691 HydrophobicContact CD1-CD2 4.3Å; I652-L691 HydrophobicContact CD1-CD1 4.34Å; I652-L691 HydrophobicContact CD1-CD2 3.96Å; I652-L691 HydrophobicContact CG2-CD1 3.74Å; I652-L691 HydrophobicContact CG2-CD2 4.38Å; Y672-L691 WeakPolarHBondContact CA-O 3.01Å; Y673-L691 HydrophobicContact CD2-CD2 3.98Å; Y673-L691 HydrophobicContact CD2-CG 4.18Å; Y673-L691 HydrophobicContact CG-CD2 4.39Å; Y673-L691 PolarHBondContact N-O 2.73Å; Y673-L691 PolarHBondContact O-N 3.5Å; L691-S697 VanDerWaalsContact CD1-C 3.41Å
692	D	95.3	Very high	91.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	121	176.2	-179	-4.4	0	0	0	110.1	R296 N297 V694 D696 S697 I699	R296-D692 IonicContact CZ-OD1 2.87Å; R296-D692 IonicContact CZ-OD2 2.71Å; R296-D692 IonicContact NE-OD1 2.77Å; R296-D692 IonicContact NE-OD2 3.55Å; R296-D692 PolarHBondContact NE-OD2 2.81Å; R296-D692 IonicContact NH2-OD1 3.23Å; R296-D692 PolarHBondContact NH2-OD1 2.84Å; R296-D692 IonicContact NH2-OD2 3.85Å; R296-D692 PolarHBondContact NH2-OD2 3.15Å; N297-D692 PolarHBondContact ND2-OD2 3.24Å; D692-V694 VanDerWaalsContact C-N 3.25Å; D692-V694 PolarHBondContact O-N 2.84Å; D692-V694 WeakPolarHBondContact OD1-CB 3.47Å; D692-V694 PolarHBondContact OD1-N 3.5Å; D692-D696 WeakPolarHBondContact O-CA 3.38Å; D692-D696 PolarHBondContact O-N 3.1Å; D692-S697 PolarHBondContact N-O 2.91Å; D692-S697 VanDerWaalsContact N-O 3.11Å; D692-I699 HydrophobicContact CB-CG2 3.7Å
693	S	93.2	Very high	92.4	Very high	15 Å²	15	29.6 Å²	29.6	11%	0.105	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-14.8	-177.7	64.7	0	0	0	0	114.7	K640 G671 Y673	K640-S693 PolarHBondContact NZ-O 3.21Å; G671-S693 VanDerWaalsContact C-OG 3.29Å; G671-S693 WeakPolarHBondContact CA-OG 3.33Å; G671-S693 VanDerWaalsContact O-CB 3.24Å; G671-S693 WeakPolarHBondContact O-CB 3.43Å; G671-S693 PolarHBondContact O-N 2.91Å; G671-S693 PolarHBondContact O-OG 3.39Å; Y673-S693 VanDerWaalsContact CE2-CB 3.45Å
694	V	91.9	Very high	93.1	Very high	17 Å²	17	31.1 Å²	31.1	10%	0.103	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-46.5	179.1	-179.7	0	0	0	0	110.8	L306 L309 T326 D692	L306-V694 WeakPolarHBondContact CD2-O 3.24Å; L309-V694 HydrophobicContact CD1-CG1 3.49Å; L309-V694 VanDerWaalsContact CD1-CG1 3.49Å; T326-V694 WeakPolarHBondContact O-CG2 3.41Å; D692-V694 VanDerWaalsContact C-N 3.25Å; D692-V694 PolarHBondContact O-N 2.84Å; D692-V694 WeakPolarHBondContact OD1-CB 3.47Å; D692-V694 PolarHBondContact OD1-N 3.5Å
695	T	92.4	Very high	93.7	Very high	5 Å²	5	29 Å²	29	3%	0.031	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-25.3	179.1	55.8	0	0	0	0	112.5	Q299 L301 L304 K650 S697	Q299-T695 HydrophobicContact CB-CG2 3.99Å; Q299-T695 HydrophobicContact CG-CG2 4.3Å; L301-T695 HydrophobicContact CD2-CG2 3.92Å; L304-T695 HydrophobicContact CD1-CG2 4.14Å; K650-T695 PolarHBondContact NZ-O 3.23Å; K650-T695 VanDerWaalsContact NZ-O 3.07Å; T695-S697 PolarHBondContact OG1-N 2.98Å; T695-S697 PolarHBondContact OG1-OG 3.04Å
696	D	92.9	Very high	94.2	Very high	16 Å²	16	27.1 Å²	27.1	9%	0.086	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	43.5	-164	-54	-62.5	0	0	0	113.3	K640 K650 I652 D692	K640-D696 WeakPolarHBondContact CD-OD1 3.49Å; K640-D696 WeakPolarHBondContact CE-OD1 3.48Å; K640-D696 IonicContact NZ-OD1 3.8Å; K640-D696 PolarHBondContact NZ-OD1 3.39Å; K640-D696 IonicContact NZ-OD2 2.69Å; K640-D696 PolarHBondContact NZ-OD2 3.22Å; K650-D696 HydrophobicContact CD-CB 4.42Å; K650-D696 VanDerWaalsContact CD-OD2 3.32Å; K650-D696 WeakPolarHBondContact CD-OD2 3.49Å; K650-D696 VanDerWaalsContact CE-OD2 3.24Å; K650-D696 WeakPolarHBondContact CE-OD2 3.42Å; K650-D696 VanDerWaalsContact NZ-CB 3.35Å; K650-D696 IonicContact NZ-OD2 3.2Å; K650-D696 PolarHBondContact NZ-OD2 3.15Å; I652-D696 HydrophobicContact CD1-CB 3.74Å; I652-D696 HydrophobicContact CG1-CB 3.96Å; D692-D696 WeakPolarHBondContact O-CA 3.38Å; D692-D696 PolarHBondContact O-N 3.1Å
697	S	93	Very high	94.4	Very high	16 Å²	16	25.8 Å²	25.8	11%	0.112	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	139	176.8	64.7	0	0	0	0	112	Q299 L691 D692 T695 I699	Q299-S697 WeakPolarHBondContact CG-OG 3.34Å; L691-S697 VanDerWaalsContact CD1-C 3.41Å; D692-S697 PolarHBondContact N-O 2.91Å; D692-S697 VanDerWaalsContact N-O 3.11Å; T695-S697 PolarHBondContact OG1-N 2.98Å; T695-S697 PolarHBondContact OG1-OG 3.04Å; S697-I699 WeakPolarHBondContact O-CG2 3.35Å; S697-I699 PolarHBondContact O-N 3.17Å
698	V	95.9	Very high	94.4	Very high	24 Å²	24	26.2 Å²	26.2	15%	0.145	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	126.1	168	-177.9	0	0	0	0	108.6	L654 F657 L689 I690	L654-V698 HydrophobicContact CD2-CG2 3.53Å; F657-V698 HydrophobicContact CD2-CB 4.38Å; F657-V698 HydrophobicContact CD2-CG1 4.19Å; F657-V698 HydrophobicContact CD2-CG2 4.25Å; F657-V698 HydrophobicContact CE1-CG1 3.97Å; F657-V698 HydrophobicContact CE2-CB 3.61Å; F657-V698 HydrophobicContact CE2-CG1 3.6Å; F657-V698 HydrophobicContact CE2-CG2 3.89Å; F657-V698 HydrophobicContact CZ-CB 3.85Å; F657-V698 HydrophobicContact CZ-CG1 3.48Å; F657-V698 VanDerWaalsContact CZ-CG1 3.48Å; L689-V698 HydrophobicContact CB-CG1 4.14Å; L689-V698 HydrophobicContact CD1-CG1 4.41Å; L689-V698 HydrophobicContact CD2-CG1 4.39Å; I690-V698 WeakPolarHBondContact O-CA 3.23Å
699	I	94.4	Very high	94.5	Very high	59 Å²	59	26.5 Å²	26.5	30%	0.303	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-15.9	-177.4	73.2	172.2	0	0	0	112.5	N297 Y672 I690 D692 S697	N297-I699 HydrophobicContact CB-CB 4.26Å; N297-I699 HydrophobicContact CB-CG2 3.6Å; Y672-I699 HydrophobicContact CD1-CD1 4.1Å; Y672-I699 HydrophobicContact CE1-CD1 3.89Å; I690-I699 HydrophobicContact CB-CD1 4.12Å; I690-I699 HydrophobicContact CB-CG1 3.76Å; I690-I699 HydrophobicContact CG2-CD1 3.64Å; I690-I699 HydrophobicContact CG2-CG1 3.79Å; I690-I699 PolarHBondContact O-N 3.24Å; D692-I699 HydrophobicContact CB-CG2 3.7Å; S697-I699 WeakPolarHBondContact O-CG2 3.35Å; S697-I699 PolarHBondContact O-N 3.17Å
700	G	94	Very high	94.4	Very high	24 Å²	24	28.8 Å²	28.8	25%	0.247	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.2	-171.9	178.8	0	0	0	0	0	112.4	I690	I690-G700 PolarHBondContact N-O 2.91Å
701	Q	95.7	Very high	94.3	Very high	110 Å²	110	29.6 Å²	29.6	51%	0.514	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	148.3	169.8	-76.7	169.5	-25.6	0	0	111.3	P687 Q688 L689 R703	P687-Q701 HydrophobicContact CB-CB 4.26Å; P687-Q701 HydrophobicContact CB-CG 4.24Å; Q688-Q701 CarbonylContact O-C 3.54Å; Q688-Q701 VanDerWaalsContact O-CA 3.31Å; Q688-Q701 WeakPolarHBondContact O-CA 3.42Å; L689-Q701 HydrophobicContact CD2-CG 3.85Å; Q701-R703 PolarHBondContact O-N 3.25Å
702	N	95.8	Very high	94.2	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.016	16%	0.158	C	C	.	.			trans	-75.9	62.7	167.3	-170.5	19.7	0	0	0	110	Q688 I690 D704 V705 Q731	Q688-N702 HydrophobicContact CB-CB 4.03Å; Q688-N702 PolarHBondContact O-N 2.77Å; Q688-N702 PolarHBondContact OE1-ND2 3.27Å; Q688-N702 VanDerWaalsContact OE1-ND2 3.13Å; I690-N702 HydrophobicContact CD1-CB 3.9Å; I690-N702 HydrophobicContact CG1-CB 3.79Å; N702-D704 PolarHBondContact O-N 2.66Å; N702-V705 HydrophobicContact CB-CB 4.36Å; N702-V705 WeakPolarHBondContact O-CB 3.46Å; N702-V705 VanDerWaalsContact O-CG2 3.26Å; N702-V705 WeakPolarHBondContact O-CG2 3.34Å; N702-V705 PolarHBondContact O-N 2.94Å; N702-Q731 PolarHBondContact ND2-OE1 2.92Å; N702-Q731 PolarHBondContact OD1-NE2 3.01Å; N702-Q731 PolarHBondContact OD1-OE1 3.03Å
703	R	92.9	Very high	94	Very high	100 Å²	100	32.7 Å²	32.7	38%	0.377	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	-127.4	-179.3	-51.3	153.3	-179.8	-86	9	110.6	P687 Q701 Q740 E741	P687-R703 VanDerWaalsContact CB-O 3.24Å; P687-R703 WeakPolarHBondContact CB-O 3.43Å; Q701-R703 PolarHBondContact O-N 3.25Å; R703-Q740 PolarHBondContact NH2-O 2.88Å; R703-E741 VanDerWaalsContact CZ-CD 3.5Å; R703-E741 IonicContact CZ-OE1 2.9Å; R703-E741 VanDerWaalsContact CZ-OE1 3.25Å; R703-E741 IonicContact CZ-OE2 3.87Å; R703-E741 VanDerWaalsContact CZ-OE2 3.25Å; R703-E741 IonicContact NH1-OE1 2.7Å; R703-E741 PolarHBondContact NH1-OE1 2.83Å; R703-E741 IonicContact NH1-OE2 3.78Å; R703-E741 PolarHBondContact NH1-OE2 3.11Å; R703-E741 IonicContact NH2-OE1 3.45Å; R703-E741 PolarHBondContact NH2-OE1 2.95Å; R703-E741 IonicContact NH2-OE2 2.93Å; R703-E741 PolarHBondContact NH2-OE2 2.04Å
704	D	92.3	Very high	93.9	Very high	84 Å²	84	32.4 Å²	32.4	45%	0.449	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	10.2	174.8	65.8	-54.6	0	0	0	113.3	N702 T706 R729	N702-D704 PolarHBondContact O-N 2.66Å; D704-T706 PolarHBondContact O-N 2.95Å; D704-T706 VanDerWaalsContact O-N 3.1Å; D704-R729 PolarHBondContact O-NH1 3.24Å; D704-R729 PolarHBondContact O-NH2 3.47Å; D704-R729 IonicContact OD2-CZ 2.66Å; D704-R729 IonicContact OD2-NE 3.67Å; D704-R729 IonicContact OD2-NH2 2.83Å; D704-R729 PolarHBondContact OD2-NH2 3.49Å
705	V	94.8	Very high	93.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.171	C	C	.	.			trans	-73.1	105.9	-172.7	-179.2	0	0	0	0	110.7	P687 Q688 N702 T720 P742	P687-V705 WeakPolarHBondContact CA-O 3.36Å; Q688-V705 WeakPolarHBondContact CG-O 3.41Å; Q688-V705 PolarHBondContact N-O 3.36Å; N702-V705 HydrophobicContact CB-CB 4.36Å; N702-V705 WeakPolarHBondContact O-CB 3.46Å; N702-V705 VanDerWaalsContact O-CG2 3.26Å; N702-V705 WeakPolarHBondContact O-CG2 3.34Å; N702-V705 PolarHBondContact O-N 2.94Å; V705-T720 HydrophobicContact CG1-CG2 3.82Å; V705-P742 HydrophobicContact CG2-CB 4.29Å; V705-P742 HydrophobicContact CG2-CG 4.28Å
706	T	93.6	Very high	94	Very high	15 Å²	15	33 Å²	33	9%	0.092	18%	0.177	C	C	.	.			trans	-100.8	151.5	176.7	49.8	0	0	0	0	111.3	D704 T720 D722 R729	D704-T706 PolarHBondContact O-N 2.95Å; D704-T706 VanDerWaalsContact O-N 3.1Å; T706-T720 WeakPolarHBondContact O-CG2 3.48Å; T706-D722 WeakPolarHBondContact CB-OD2 3.44Å; T706-D722 PolarHBondContact OG1-OD2 3.46Å; T706-R729 PolarHBondContact OG1-NH1 3.16Å
707	G	92.6	Very high	94.1	Very high	8 Å²	8	33.2 Å²	33.2	8%	0.082	18%	0.177	C	C	.	.	S	Bend	trans	106.6	-177.7	171.6	0	0	0	0	0	115.1	N676 Q688 P709 V721	N676-G707 WeakPolarHBondContact CB-O 3.45Å; N676-G707 PolarHBondContact OD1-O 2.55Å; Q688-G707 PolarHBondContact NE2-O 2.92Å; G707-P709 WeakPolarHBondContact O-CD 3.3Å; G707-V721 CarbonylContact C-O 3.54Å; G707-V721 WeakPolarHBondContact CA-O 3.4Å
708	T	94.4	Very high	94.3	Very high	39 Å²	39	32.5 Å²	32.5	24%	0.239	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	120.9	-173.6	-59.8	0	0	0	0	111.2	Y710 T720 V721	T708-Y710 HydrophobicContact CG2-CD2 4.34Å; T708-Y710 HydrophobicContact CG2-CE2 3.66Å; T708-Y710 WeakPolarHBondContact O-CD2 3.3Å; T708-T720 CarbonylContact O-C 3.45Å; T708-T720 WeakPolarHBondContact O-CA 3.36Å; T708-V721 PolarHBondContact N-O 3.24Å; T708-V721 PolarHBondContact O-N 2.74Å
709	P	96.9	Very high	94.3	Very high	7 Å²	7	31.3 Å²	31.3	5%	0.045	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	144.6	178.7	33.3	-33.6	0	0	0	112.1	A665 F674 N676 G707 L718	A665-P709 HydrophobicContact CB-CB 3.73Å; A665-P709 HydrophobicContact CB-CG 3.94Å; F674-P709 HydrophobicContact CB-CB 4.31Å; F674-P709 HydrophobicContact CB-CG 4.43Å; N676-P709 HydrophobicContact CB-CG 4.36Å; G707-P709 WeakPolarHBondContact O-CD 3.3Å; P709-L718 HydrophobicContact CB-CD1 3.69Å
710	Y	96.3	Very high	94.4	Very high	49 Å²	49	28.6 Å²	28.6	19%	0.192	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	134.9	171.8	-59.7	-101.4	0	0	0	107.8	T708 V719 V721 L754	T708-Y710 HydrophobicContact CG2-CD2 4.34Å; T708-Y710 HydrophobicContact CG2-CE2 3.66Å; T708-Y710 WeakPolarHBondContact O-CD2 3.3Å; Y710-V719 WeakPolarHBondContact CB-O 3.41Å; Y710-V719 PolarHBondContact N-O 3.36Å; Y710-V719 PolarHBondContact O-N 3.06Å; Y710-V721 HydrophobicContact CD2-CG2 4.37Å; Y710-V721 HydrophobicContact CE2-CB 4.29Å; Y710-V721 HydrophobicContact CE2-CG2 4.05Å; Y710-L754 HydrophobicContact CD1-CB 4.12Å; Y710-L754 HydrophobicContact CD2-CD1 3.72Å; Y710-L754 HydrophobicContact CD2-CG 4.25Å; Y710-L754 HydrophobicContact CE1-CB 4.15Å; Y710-L754 HydrophobicContact CE2-CD1 4.04Å; Y710-L754 HydrophobicContact CE2-CG 4.13Å; Y710-L754 HydrophobicContact CG-CB 4.35Å; Y710-L754 HydrophobicContact CG-CD1 4.03Å; Y710-L754 HydrophobicContact CG-CG 4.5Å
711	M	96.2	Very high	94.4	Very high	31 Å²	31	27.9 Å²	27.9	15%	0.153	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	140.5	175.4	-167.2	65.9	59.5	0	0	110.2	A665 Y666 F674 Y717 L718 I733 F756	A665-M711 HydrophobicContact CB-CB 4.28Å; Y666-M711 WeakPolarHBondContact O-CG 3.36Å; F674-M711 HydrophobicContact CD2-CE 3.79Å; F674-M711 HydrophobicContact CE2-CE 3.61Å; M711-Y717 VanDerWaalsContact SD-O 3.42Å; M711-L718 HydrophobicContact CE-CB 3.91Å; M711-L718 HydrophobicContact CE-CD1 3.97Å; M711-L718 HydrophobicContact CE-CG 4.48Å; M711-L718 HydrophobicContact SD-CB 4.27Å; M711-I733 HydrophobicContact CE-CD1 3.74Å; M711-I733 HydrophobicContact SD-CD1 3.76Å; M711-F756 WeakPolarHBondContact O-CE2 3.42Å
712	S	94.1	Very high	94.2	Very high	4 Å²	4	22.9 Å²	22.9	3%	0.028	12%	0.118	C	C	.	.			trans	-62.3	151.7	168.1	56.2	0	0	0	0	112	D714 G715 L716 Y717 Y766	S712-D714 VanDerWaalsContact CB-OD1 3.27Å; S712-D714 WeakPolarHBondContact CB-OD1 3.5Å; S712-D714 PolarHBondContact O-N 3.29Å; S712-D714 VanDerWaalsContact O-N 3.15Å; S712-D714 PolarHBondContact OG-OD1 2.83Å; S712-G715 PolarHBondContact O-N 2.89Å; S712-L716 PolarHBondContact OG-N 3.27Å; S712-Y717 PolarHBondContact N-O 3.48Å; S712-Y717 PolarHBondContact OG-N 2.8Å; S712-Y717 PolarHBondContact OG-O 3.24Å; S712-Y766 VanDerWaalsContact CB-CD2 3.48Å
713	P	91	Very high	93.7	Very high	61 Å²	61	24.8 Å²	24.8	40%	0.396	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-25.6	177.1	-25.5	31.5	0	0	0	115.3	S619 G715 Y766	S619-P713 WeakPolarHBondContact CB-O 3.28Å; P713-G715 VanDerWaalsContact C-N 3.33Å; P713-Y766 HydrophobicContact CB-CE2 4.31Å; P713-Y766 WeakPolarHBondContact CB-OH 3.23Å; P713-Y766 HydrophobicContact CG-CE1 4.18Å; P713-Y766 HydrophobicContact CG-CE2 4.26Å
714	D	90.5	Very high	93.2	Very high	9 Å²	9	25.6 Å²	25.6	5%	0.048	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-5.2	173.7	57.9	17.6	0	0	0	113.9	H668 S712 L716 R758 Y766	H668-D714 PolarHBondContact CE1-O 3.01Å; H668-D714 VanDerWaalsContact CE1-O 3.23Å; S712-D714 VanDerWaalsContact CB-OD1 3.27Å; S712-D714 WeakPolarHBondContact CB-OD1 3.5Å; S712-D714 PolarHBondContact O-N 3.29Å; S712-D714 VanDerWaalsContact O-N 3.15Å; S712-D714 PolarHBondContact OG-OD1 2.83Å; D714-L716 HydrophobicContact CB-CD1 4.49Å; D714-L716 HydrophobicContact CB-CG 4.4Å; D714-L716 PolarHBondContact O-N 2.99Å; D714-L716 PolarHBondContact OD1-N 3.48Å; D714-R758 IonicContact OD2-CZ 3.38Å; D714-R758 IonicContact OD2-NH1 2.74Å; D714-R758 PolarHBondContact OD2-NH1 3.18Å; D714-R758 IonicContact OD2-NH2 3.21Å; D714-R758 PolarHBondContact OD2-NH2 3.44Å; D714-Y766 HydrophobicContact CB-CE2 4.04Å; D714-Y766 VanDerWaalsContact CG-CE2 3.41Å; D714-Y766 VanDerWaalsContact OD2-CD2 3.23Å; D714-Y766 WeakPolarHBondContact OD2-CD2 3.38Å; D714-Y766 WeakPolarHBondContact OD2-CE2 3.13Å
715	G	93	Very high	92.9	Very high	3 Å²	3	26.4 Å²	26.4	3%	0.031	15%	0.149	C	C	.	.	S	Bend	trans	73.8	5	179.4	0	0	0	0	0	115.4	T667 S712 P713 I733	T667-G715 WeakPolarHBondContact CB-O 3.38Å; T667-G715 PolarHBondContact OG1-O 3.06Å; S712-G715 PolarHBondContact O-N 2.89Å; P713-G715 VanDerWaalsContact C-N 3.33Å; G715-I733 WeakPolarHBondContact O-CD1 3.42Å
716	L	93.3	Very high	92.5	Very high	30 Å²	30	27.1 Å²	27.1	16%	0.157	16%	0.156	C	C	.	.			trans	-96	-16.7	-172.6	-59.5	178.8	0	0	0	114.4	V669 S712 D714 T732 I733	V669-L716 HydrophobicContact CG2-CD2 4.14Å; S712-L716 PolarHBondContact OG-N 3.27Å; D714-L716 HydrophobicContact CB-CD1 4.49Å; D714-L716 HydrophobicContact CB-CG 4.4Å; D714-L716 PolarHBondContact O-N 2.99Å; D714-L716 PolarHBondContact OD1-N 3.48Å; L716-T732 CarbonylContact O-C 3.58Å; L716-T732 WeakPolarHBondContact O-CA 3.39Å; L716-I733 PolarHBondContact O-N 3.39Å
717	Y	94.8	Very high	92.3	Very high	22 Å²	22	27.3 Å²	27.3	9%	0.086	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	109	-177.9	-63.8	-98.8	0	0	0	111	M711 S712 T732 Q765 L783	M711-Y717 VanDerWaalsContact SD-O 3.42Å; S712-Y717 PolarHBondContact N-O 3.48Å; S712-Y717 PolarHBondContact OG-N 2.8Å; S712-Y717 PolarHBondContact OG-O 3.24Å; Y717-T732 HydrophobicContact CD1-CG2 3.92Å; Y717-T732 HydrophobicContact CE1-CG2 3.65Å; Y717-Q765 VanDerWaalsContact OH-CD 3.24Å; Y717-Q765 PolarHBondContact OH-NE2 3.21Å; Y717-Q765 PolarHBondContact OH-OE1 3.38Å; Y717-L783 HydrophobicContact CD1-CB 3.93Å; Y717-L783 HydrophobicContact CD1-CD1 3.67Å; Y717-L783 HydrophobicContact CD1-CG 4.41Å; Y717-L783 HydrophobicContact CE1-CB 3.93Å; Y717-L783 HydrophobicContact CE1-CD1 4.39Å; Y717-L783 HydrophobicContact CG-CD1 3.8Å
718	L	96.8	Very high	92.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	121.9	166.2	173.4	64.4	0	0	0	108.8	A665 F674 P709 M711 Q731 I733	A665-L718 HydrophobicContact CB-CD1 4.43Å; F674-L718 HydrophobicContact CB-CD1 4.44Å; F674-L718 HydrophobicContact CD1-CD2 3.48Å; F674-L718 VanDerWaalsContact CD1-CD2 3.48Å; F674-L718 HydrophobicContact CD2-CD1 4.19Å; F674-L718 HydrophobicContact CD2-CD2 4.08Å; F674-L718 HydrophobicContact CE1-CD2 3.52Å; F674-L718 HydrophobicContact CE2-CD2 4.12Å; F674-L718 HydrophobicContact CG-CD1 4.19Å; F674-L718 HydrophobicContact CG-CD2 3.77Å; F674-L718 HydrophobicContact CZ-CD2 3.86Å; P709-L718 HydrophobicContact CB-CD1 3.69Å; M711-L718 HydrophobicContact CE-CB 3.91Å; M711-L718 HydrophobicContact CE-CD1 3.97Å; M711-L718 HydrophobicContact CE-CG 4.48Å; M711-L718 HydrophobicContact SD-CB 4.27Å; L718-Q731 HydrophobicContact CB-CB 4.26Å; L718-Q731 HydrophobicContact CD2-CB 4.5Å; L718-Q731 PolarHBondContact N-O 3.2Å; L718-Q731 PolarHBondContact O-N 3.02Å; L718-I733 HydrophobicContact CB-CD1 4.38Å
719	V	96.8	Very high	92.3	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	114.1	178.8	-179.8	0	0	0	0	108	Y710 M728 R729 I730 L754 F756 V768 L783	Y710-V719 WeakPolarHBondContact CB-O 3.41Å; Y710-V719 PolarHBondContact N-O 3.36Å; Y710-V719 PolarHBondContact O-N 3.06Å; V719-M728 HydrophobicContact CG1-CE 3.43Å; V719-M728 VanDerWaalsContact CG1-CE 3.43Å; V719-M728 HydrophobicContact CG1-CG 4.3Å; V719-R729 WeakPolarHBondContact CA-O 3.33Å; V719-I730 HydrophobicContact CG2-CG1 4.43Å; V719-L754 HydrophobicContact CG1-CD1 3.68Å; V719-F756 HydrophobicContact CB-CZ 4.16Å; V719-F756 HydrophobicContact CG2-CE1 3.87Å; V719-F756 HydrophobicContact CG2-CZ 3.9Å; V719-V768 HydrophobicContact CG2-CG2 4.26Å; V719-L783 HydrophobicContact CG2-CD1 4.38Å; V719-L783 HydrophobicContact CG2-CD2 4.28Å
720	T	96	Very high	92.3	Very high	1 Å²	1	26 Å²	26	1%	0.006	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	136.9	-178.7	-68.5	0	0	0	0	110.9	Q688 V705 T706 T708 M728 R729	Q688-T720 PolarHBondContact NE2-OG1 2.59Å; V705-T720 HydrophobicContact CG1-CG2 3.82Å; T706-T720 WeakPolarHBondContact O-CG2 3.48Å; T708-T720 CarbonylContact O-C 3.45Å; T708-T720 WeakPolarHBondContact O-CA 3.36Å; T720-M728 CarbonylContact O-C 3.56Å; T720-M728 WeakPolarHBondContact O-CA 3.2Å; T720-R729 PolarHBondContact N-O 3.1Å; T720-R729 PolarHBondContact O-N 3.33Å
721	V	94.1	Very high	92.2	Very high	10 Å²	10	23.7 Å²	23.7	6%	0.061	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	117.9	179.2	177.9	0	0	0	0	111.3	G707 T708 Y710 L751 L754	G707-V721 CarbonylContact C-O 3.54Å; G707-V721 WeakPolarHBondContact CA-O 3.4Å; T708-V721 PolarHBondContact N-O 3.24Å; T708-V721 PolarHBondContact O-N 2.74Å; Y710-V721 HydrophobicContact CD2-CG2 4.37Å; Y710-V721 HydrophobicContact CE2-CB 4.29Å; Y710-V721 HydrophobicContact CE2-CG2 4.05Å; V721-L751 HydrophobicContact CG1-CB 3.74Å; V721-L751 HydrophobicContact CG1-CD1 3.86Å; V721-L751 HydrophobicContact CG1-CG 4.45Å; V721-L751 HydrophobicContact CG2-CD1 4.16Å; V721-L754 HydrophobicContact CG2-CD1 3.6Å; V721-L754 HydrophobicContact CG2-CD2 4.35Å; V721-L754 HydrophobicContact CG2-CG 4.06Å
722	D	91.3	Very high	92.2	Very high	4 Å²	4	25 Å²	25	2%	0.021	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	91.2	168.5	-168.5	-27.7	0	0	0	109.7	T706 V724 N725 G726 L727	T706-D722 WeakPolarHBondContact CB-OD2 3.44Å; T706-D722 PolarHBondContact OG1-OD2 3.46Å; D722-V724 PolarHBondContact O-N 3.31Å; D722-V724 WeakPolarHBondContact OD1-CB 3.34Å; D722-V724 PolarHBondContact OD1-N 3.07Å; D722-V724 VanDerWaalsContact OD1-N 3.12Å; D722-N725 HydrophobicContact CB-CB 4.5Å; D722-N725 VanDerWaalsContact CG-ND2 3.34Å; D722-N725 PolarHBondContact O-N 3.16Å; D722-N725 PolarHBondContact OD1-N 2.75Å; D722-N725 PolarHBondContact OD1-ND2 2.76Å; D722-N725 PolarHBondContact OD2-ND2 3.06Å; D722-G726 PolarHBondContact O-N 2.8Å; D722-L727 HydrophobicContact CB-CB 4.38Å; D722-L727 PolarHBondContact N-O 3.48Å; D722-L727 PolarHBondContact O-N 3.33Å
723	D	85.8	Confident	92.2	Very high	44 Å²	44	25 Å²	25	24%	0.235	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.8	177.9	179.7	61.4	0	0	0	113.5	H750 L751 R774	D723-H750 PolarHBondContact O-CE1 2.92Å; D723-H750 PolarHBondContact O-ND1 2.97Å; D723-H750 VanDerWaalsContact O-ND1 3.12Å; D723-H750 VanDerWaalsContact OD1-C 3.32Å; D723-H750 WeakPolarHBondContact OD1-CA 3.27Å; D723-H750 WeakPolarHBondContact OD1-CB 3.29Å; D723-H750 IonicContact OD1-CG 2.83Å; D723-H750 IonicContact OD1-ND1 3.08Å; D723-H750 PolarHBondContact OD1-ND1 2.96Å; D723-H750 IonicContact OD2-ND1 2.62Å; D723-L751 PolarHBondContact OD1-N 3.04Å; D723-R774 IonicContact OD2-CZ 2.75Å; D723-R774 IonicContact OD2-NH2 3.97Å; D723-R774 PolarHBondContact OD2-NH2 2.84Å
724	V	83.3	Confident	92.3	Very high	117 Å²	117	23.8 Å²	23.8	71%	0.709	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-44.3	-179.3	-177	0	0	0	0	109.8	D722	D722-V724 PolarHBondContact O-N 3.31Å; D722-V724 WeakPolarHBondContact OD1-CB 3.34Å; D722-V724 PolarHBondContact OD1-N 3.07Å; D722-V724 VanDerWaalsContact OD1-N 3.12Å
725	N	84.8	Confident	92.1	Very high	101 Å²	101	26.5 Å²	26.5	54%	0.54	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-4.6	-179	-65.7	-57.9	0	0	0	114	D722 L727	D722-N725 HydrophobicContact CB-CB 4.5Å; D722-N725 VanDerWaalsContact CG-ND2 3.34Å; D722-N725 PolarHBondContact O-N 3.16Å; D722-N725 PolarHBondContact OD1-N 2.75Å; D722-N725 PolarHBondContact OD1-ND2 2.76Å; D722-N725 PolarHBondContact OD2-ND2 3.06Å; N725-L727 VanDerWaalsContact C-N 3.35Å; N725-L727 HydrophobicContact CB-CB 4.39Å
726	G	86.3	Confident	91.8	Very high	15 Å²	15	34.2 Å²	34.2	16%	0.155	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	68	34	-177.6	0	0	0	0	0	112.8	D722 T747	D722-G726 PolarHBondContact O-N 2.8Å; G726-T747 CarbonylContact C-O 3.58Å; G726-T747 WeakPolarHBondContact CA-O 3.37Å; G726-T747 PolarHBondContact O-N 2.83Å; G726-T747 VanDerWaalsContact O-O 3.05Å
727	L	90.8	Very high	91.7	Very high	18 Å²	18	33.1 Å²	33.1	9%	0.094	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.5	-167.9	-177.3	58.5	0	0	0	111.5	D722 N725 R729 D744	D722-L727 HydrophobicContact CB-CB 4.38Å; D722-L727 PolarHBondContact N-O 3.48Å; D722-L727 PolarHBondContact O-N 3.33Å; N725-L727 VanDerWaalsContact C-N 3.35Å; N725-L727 HydrophobicContact CB-CB 4.39Å; L727-R729 HydrophobicContact CD1-CG 4.49Å; L727-R729 HydrophobicContact CD2-CG 4.24Å; L727-R729 HydrophobicContact CG-CG 4.01Å; L727-D744 HydrophobicContact CD1-CB 3.91Å
728	M	93.4	Very high	91.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	113.8	175.3	176.3	-176.5	-178.7	0	0	108.5	V719 T720 I745 V768 L779 V781	V719-M728 HydrophobicContact CG1-CE 3.43Å; V719-M728 VanDerWaalsContact CG1-CE 3.43Å; V719-M728 HydrophobicContact CG1-CG 4.3Å; T720-M728 CarbonylContact O-C 3.56Å; T720-M728 WeakPolarHBondContact O-CA 3.2Å; M728-I745 HydrophobicContact CB-CB 4.19Å; M728-I745 PolarHBondContact N-O 3.42Å; M728-I745 PolarHBondContact O-N 3.36Å; M728-V768 HydrophobicContact CE-CB 4.22Å; M728-V768 HydrophobicContact CE-CG1 3.77Å; M728-L779 HydrophobicContact SD-CD2 3.71Å; M728-V781 HydrophobicContact CE-CB 4.36Å; M728-V781 HydrophobicContact CE-CG2 3.89Å; M728-V781 HydrophobicContact SD-CG2 3.93Å
729	R	94	Very high	91.4	Very high	17 Å²	17	39.2 Å²	39.2	6%	0.064	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	133.5	-179.1	-58.2	-160.2	175.7	103.4	-33.5	111	D704 T706 V719 T720 L727 P742 F743 D744	D704-R729 PolarHBondContact O-NH1 3.24Å; D704-R729 PolarHBondContact O-NH2 3.47Å; D704-R729 IonicContact OD2-CZ 2.66Å; D704-R729 IonicContact OD2-NE 3.67Å; D704-R729 IonicContact OD2-NH2 2.83Å; D704-R729 PolarHBondContact OD2-NH2 3.49Å; T706-R729 PolarHBondContact OG1-NH1 3.16Å; V719-R729 WeakPolarHBondContact CA-O 3.33Å; T720-R729 PolarHBondContact N-O 3.1Å; T720-R729 PolarHBondContact O-N 3.33Å; L727-R729 HydrophobicContact CD1-CG 4.49Å; L727-R729 HydrophobicContact CD2-CG 4.24Å; L727-R729 HydrophobicContact CG-CG 4.01Å; R729-P742 HydrophobicContact CB-CB 4.32Å; R729-F743 CarbonylContact C-O 3.49Å; R729-F743 WeakPolarHBondContact CA-O 3.44Å; R729-D744 VanDerWaalsContact CD-OD1 3.31Å; R729-D744 WeakPolarHBondContact CD-OD1 3.18Å; R729-D744 VanDerWaalsContact CG-OD1 3.25Å; R729-D744 WeakPolarHBondContact CG-OD1 3.12Å; R729-D744 IonicContact NE-OD1 3.31Å; R729-D744 PolarHBondContact NE-OD1 2.81Å; R729-D744 IonicContact NE-OD2 3.92Å
730	I	95.2	Very high	91.3	Very high	11 Å²	11	41.9 Å²	41.9	6%	0.056	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	123.3	178.5	-59.4	163.3	0	0	0	109	V719 P742 F743 I745 V781 L783	V719-I730 HydrophobicContact CG2-CG1 4.43Å; I730-P742 CarbonylContact O-C 3.56Å; I730-P742 WeakPolarHBondContact O-CA 3.35Å; I730-F743 PolarHBondContact N-O 3.45Å; I730-F743 PolarHBondContact O-N 3.3Å; I730-I745 HydrophobicContact CD1-CD1 3.53Å; I730-I745 HydrophobicContact CD1-CG1 4.44Å; I730-V781 HydrophobicContact CD1-CG1 4.06Å; I730-L783 HydrophobicContact CD1-CD2 3.61Å; I730-L783 HydrophobicContact CG1-CD2 4.12Å; I730-L783 HydrophobicContact CG2-CD2 4.28Å
731	Q	95.5	Very high	91.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.6	171.5	-72.7	173	-82.8	0	0	109.7	N702 L718 Q740 P742	N702-Q731 PolarHBondContact ND2-OE1 2.92Å; N702-Q731 PolarHBondContact OD1-NE2 3.01Å; N702-Q731 PolarHBondContact OD1-OE1 3.03Å; L718-Q731 HydrophobicContact CB-CB 4.26Å; L718-Q731 HydrophobicContact CD2-CB 4.5Å; L718-Q731 PolarHBondContact N-O 3.2Å; L718-Q731 PolarHBondContact O-N 3.02Å; Q731-Q740 PolarHBondContact NE2-O 2.76Å; Q731-P742 HydrophobicContact CG-CB 3.77Å
732	T	94.9	Very high	91.2	Very high	57 Å²	57	48.7 Å²	48.7	35%	0.35	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	146	167.1	50.3	0	0	0	0	110.8	L716 Y717 Q740	L716-T732 CarbonylContact O-C 3.58Å; L716-T732 WeakPolarHBondContact O-CA 3.39Å; Y717-T732 HydrophobicContact CD1-CG2 3.92Å; Y717-T732 HydrophobicContact CE1-CG2 3.65Å; T732-Q740 WeakPolarHBondContact O-CB 3.42Å; T732-Q740 WeakPolarHBondContact O-CG 3.41Å; T732-Q740 PolarHBondContact O-N 3.44Å; T732-Q740 WeakPolarHBondContact OG1-CG 3.5Å
733	I	94.8	Very high	91.2	Very high	5 Å²	5	53.5 Å²	53.5	3%	0.026	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	122.2	169.5	-65.3	147.2	0	0	0	105.6	T667 V669 F674 M711 G715 L716 L718 I739	T667-I733 HydrophobicContact CG2-CD1 3.89Å; V669-I733 HydrophobicContact CB-CG2 4.17Å; V669-I733 HydrophobicContact CG1-CG2 4.36Å; F674-I733 HydrophobicContact CE2-CD1 4.3Å; F674-I733 HydrophobicContact CZ-CD1 4.38Å; M711-I733 HydrophobicContact CE-CD1 3.74Å; M711-I733 HydrophobicContact SD-CD1 3.76Å; G715-I733 WeakPolarHBondContact O-CD1 3.42Å; L716-I733 PolarHBondContact O-N 3.39Å; L718-I733 HydrophobicContact CB-CD1 4.38Å; I733-I739 HydrophobicContact CG1-CG1 4.24Å
734	S	92.3	Very high	91.6	Very high	36 Å²	36	54.4 Å²	54.4	25%	0.252	27%	0.274	S	S	.	.			trans	-70.5	159.2	177.9	73.7	0	0	0	0	111.5	V669 R736 G737 K738	V669-S734 WeakPolarHBondContact CG1-O 3.26Å; S734-R736 PolarHBondContact O-N 3.2Å; S734-R736 PolarHBondContact OG-N 3.32Å; S734-G737 PolarHBondContact O-N 3.35Å; S734-K738 PolarHBondContact N-O 3.04Å; S734-K738 WeakPolarHBondContact OG-CB 3.39Å; S734-K738 PolarHBondContact OG-N 3.08Å
735	E	87.3	Confident	91.9	Very high	66 Å²	66	49.3 Å²	49.3	31%	0.308	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-11	170.3	-63.8	-179.5	157.1	0	0	114.5	M328 I379 S381	M328-E735 VanDerWaalsContact CE-O 3.27Å; M328-E735 WeakPolarHBondContact CE-O 3.22Å; I379-E735 HydrophobicContact CG2-CB 4.07Å; S381-E735 VanDerWaalsContact CB-OE1 3.26Å; S381-E735 WeakPolarHBondContact CB-OE1 3.36Å; S381-E735 PolarHBondContact N-OE1 3.07Å; S381-E735 PolarHBondContact OG-OE1 2.79Å
736	R	87.5	Confident	92.2	Very high	165 Å²	165	51.4 Å²	51.4	62%	0.623	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.9	14.8	174.3	-61.8	-176.9	175.1	168.4	0.7	113.4	S734 K738	S734-R736 PolarHBondContact O-N 3.2Å; S734-R736 PolarHBondContact OG-N 3.32Å; R736-K738 VanDerWaalsContact C-N 3.32Å; R736-K738 PolarHBondContact O-N 3.08Å
737	G	89.6	Confident	92.2	Very high	7 Å²	7	51.5 Å²	51.5	7%	0.072	25%	0.247	C	C	.	.	S	Bend	trans	70.9	19.1	-179.9	0	0	0	0	0	114.9	Y672 S734	Y672-G737 WeakPolarHBondContact CE2-O 3.19Å; S734-G737 PolarHBondContact O-N 3.35Å
738	K	92.3	Very high	91.9	Very high	121 Å²	121	58.1 Å²	58.1	53%	0.526	28%	0.282	S	S	.	.			trans	-91.1	114.7	176.5	-169.6	-165.3	171.5	-148.7	0	110.7	S734 R736	S734-K738 PolarHBondContact N-O 3.04Å; S734-K738 WeakPolarHBondContact OG-CB 3.39Å; S734-K738 PolarHBondContact OG-N 3.08Å; R736-K738 VanDerWaalsContact C-N 3.32Å; R736-K738 PolarHBondContact O-N 3.08Å
739	I	94.6	Very high	91.7	Very high	29 Å²	29	58.4 Å²	58.4	15%	0.149	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	127.8	169.1	-53.5	162.2	0	0	0	108.9	Y672 F674 I690 I733	Y672-I739 HydrophobicContact CD2-CD1 4.31Å; Y672-I739 HydrophobicContact CG-CD1 4.48Å; F674-I739 HydrophobicContact CE1-CD1 3.8Å; F674-I739 HydrophobicContact CE1-CG1 4.46Å; F674-I739 HydrophobicContact CZ-CD1 3.66Å; F674-I739 HydrophobicContact CZ-CG1 4.03Å; I690-I739 HydrophobicContact CD1-CD1 3.94Å; I690-I739 HydrophobicContact CG2-CD1 4.37Å; I733-I739 HydrophobicContact CG1-CG1 4.24Å
740	Q	94.6	Very high	91.4	Very high	56 Å²	56	60.3 Å²	60.3	26%	0.262	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-174.7	-178.6	-54.4	-63.6	-3.4	0	0	112.7	R703 Q731 T732	R703-Q740 PolarHBondContact NH2-O 2.88Å; Q731-Q740 PolarHBondContact NE2-O 2.76Å; T732-Q740 WeakPolarHBondContact O-CB 3.42Å; T732-Q740 WeakPolarHBondContact O-CG 3.41Å; T732-Q740 PolarHBondContact O-N 3.44Å; T732-Q740 WeakPolarHBondContact OG1-CG 3.5Å
741	E	93.5	Very high	91.2	Very high	121 Å²	121	60.6 Å²	60.6	57%	0.565	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.6	146.9	169.2	-56.6	-55.8	131.1	0	0	111.1	R703	R703-E741 VanDerWaalsContact CZ-CD 3.5Å; R703-E741 IonicContact CZ-OE1 2.9Å; R703-E741 VanDerWaalsContact CZ-OE1 3.25Å; R703-E741 IonicContact CZ-OE2 3.87Å; R703-E741 VanDerWaalsContact CZ-OE2 3.25Å; R703-E741 IonicContact NH1-OE1 2.7Å; R703-E741 PolarHBondContact NH1-OE1 2.83Å; R703-E741 IonicContact NH1-OE2 3.78Å; R703-E741 PolarHBondContact NH1-OE2 3.11Å; R703-E741 IonicContact NH2-OE1 3.45Å; R703-E741 PolarHBondContact NH2-OE1 2.95Å; R703-E741 IonicContact NH2-OE2 2.93Å; R703-E741 PolarHBondContact NH2-OE2 2.04Å
742	P	93.8	Very high	90.9	Very high	33 Å²	33	61.2 Å²	61.2	21%	0.214	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	146.8	168.4	30.4	-33.4	0	0	0	111.9	V705 R729 I730 Q731	V705-P742 HydrophobicContact CG2-CB 4.29Å; V705-P742 HydrophobicContact CG2-CG 4.28Å; R729-P742 HydrophobicContact CB-CB 4.32Å; I730-P742 CarbonylContact O-C 3.56Å; I730-P742 WeakPolarHBondContact O-CA 3.35Å; Q731-P742 HydrophobicContact CG-CB 3.77Å
743	F	91.4	Very high	90.7	Very high	104 Å²	104	58.7 Å²	58.7	46%	0.456	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131.1	162.8	179.5	-84.8	0	0	0	109.7	R729 I730 I745 S786	R729-F743 CarbonylContact C-O 3.49Å; R729-F743 WeakPolarHBondContact CA-O 3.44Å; I730-F743 PolarHBondContact N-O 3.45Å; I730-F743 PolarHBondContact O-N 3.3Å; F743-I745 HydrophobicContact CD1-CG1 4.05Å; F743-I745 HydrophobicContact CE1-CD1 4.47Å; F743-I745 HydrophobicContact CE1-CG1 3.73Å; F743-S786 VanDerWaalsContact CD1-OG 3.26Å; F743-S786 WeakPolarHBondContact CD1-OG 3.39Å; F743-S786 VanDerWaalsContact CE1-OG 3.31Å; F743-S786 WeakPolarHBondContact CE1-OG 3.44Å
744	D	93.2	Very high	90.7	Very high	63 Å²	63	59 Å²	59	34%	0.337	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	117.5	-168.8	-80.3	16.3	0	0	0	112.9	L727 R729	L727-D744 HydrophobicContact CD1-CB 3.91Å; R729-D744 VanDerWaalsContact CD-OD1 3.31Å; R729-D744 WeakPolarHBondContact CD-OD1 3.18Å; R729-D744 VanDerWaalsContact CG-OD1 3.25Å; R729-D744 WeakPolarHBondContact CG-OD1 3.12Å; R729-D744 IonicContact NE-OD1 3.31Å; R729-D744 PolarHBondContact NE-OD1 2.81Å; R729-D744 IonicContact NE-OD2 3.92Å
745	I	90.3	Very high	90.8	Very high	10 Å²	10	57.6 Å²	57.6	5%	0.051	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	110.4	170.5	-65.2	173.1	0	0	0	108.7	M728 I730 F743 V781 V788	M728-I745 HydrophobicContact CB-CB 4.19Å; M728-I745 PolarHBondContact N-O 3.42Å; M728-I745 PolarHBondContact O-N 3.36Å; I730-I745 HydrophobicContact CD1-CD1 3.53Å; I730-I745 HydrophobicContact CD1-CG1 4.44Å; F743-I745 HydrophobicContact CD1-CG1 4.05Å; F743-I745 HydrophobicContact CE1-CD1 4.47Å; F743-I745 HydrophobicContact CE1-CG1 3.73Å; I745-V781 HydrophobicContact CD1-CB 4.47Å; I745-V781 HydrophobicContact CD1-CG1 3.47Å; I745-V781 VanDerWaalsContact CD1-CG1 3.47Å; I745-V781 HydrophobicContact CD1-CG2 4.11Å; I745-V788 HydrophobicContact CD1-CG2 3.92Å; I745-V788 HydrophobicContact CG1-CG2 4.3Å; I745-V788 HydrophobicContact CG2-CG2 3.84Å
746	H	90.8	Very high	91.2	Very high	146 Å²	146	55.6 Å²	55.6	68%	0.676	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	131.2	172.7	-68.6	65.7	0	0	0	109.6
747	T	85.8	Confident	91.4	Very high	17 Å²	17	47.9 Å²	47.9	10%	0.104	24%	0.237	C	C	.	.			trans	-143.4	132.5	-176.7	-177.6	0	0	0	0	111.9	G726 L749 L751	G726-T747 CarbonylContact C-O 3.58Å; G726-T747 WeakPolarHBondContact CA-O 3.37Å; G726-T747 PolarHBondContact O-N 2.83Å; G726-T747 VanDerWaalsContact O-O 3.05Å; T747-L749 PolarHBondContact O-N 3Å; T747-L749 WeakPolarHBondContact OG1-CB 3.39Å; T747-L749 PolarHBondContact OG1-N 2.83Å; T747-L751 HydrophobicContact CG2-CD1 4.42Å
748	N	85.7	Confident	91.4	Very high	157 Å²	157	48.9 Å²	48.9	84%	0.84	24%	0.239	S	C	*	.	S	Bend	trans	-80.1	11.4	172.6	-62.6	-8.9	0	0	0	112.1	Q775	N748-Q775 PolarHBondContact O-NE2 3.1Å
749	L	87.8	Confident	91.3	Very high	6 Å²	6	43.7 Å²	43.7	3%	0.031	22%	0.217	C	C	.	.	S	Bend	trans	-99.3	118.2	-178.5	-164.3	76.7	0	0	0	110.4	T747 L751 Q775 D777 L779 M790	T747-L749 PolarHBondContact O-N 3Å; T747-L749 WeakPolarHBondContact OG1-CB 3.39Å; T747-L749 PolarHBondContact OG1-N 2.83Å; L749-L751 HydrophobicContact CD2-CD2 3.97Å; L749-L751 PolarHBondContact O-N 2.68Å; L749-Q775 HydrophobicContact CD1-CB 3.91Å; L749-D777 HydrophobicContact CD1-CB 4Å; L749-L779 HydrophobicContact CD2-CB 3.95Å; L749-M790 HydrophobicContact CB-CE 4.48Å; L749-M790 HydrophobicContact CD1-CE 3.95Å; L749-M790 HydrophobicContact CD2-CE 4.05Å; L749-M790 HydrophobicContact CG-CE 4.39Å
750	H	89.3	Confident	90.9	Very high	57 Å²	57	43.6 Å²	43.6	26%	0.264	22%	0.216	S	C	.	.			trans	-74.2	105.5	174.7	-77.6	-60.7	0	0	0	110.9	D723 S772 G773 R774	D723-H750 PolarHBondContact O-CE1 2.92Å; D723-H750 PolarHBondContact O-ND1 2.97Å; D723-H750 VanDerWaalsContact O-ND1 3.12Å; D723-H750 VanDerWaalsContact OD1-C 3.32Å; D723-H750 WeakPolarHBondContact OD1-CA 3.27Å; D723-H750 WeakPolarHBondContact OD1-CB 3.29Å; D723-H750 IonicContact OD1-CG 2.83Å; D723-H750 IonicContact OD1-ND1 3.08Å; D723-H750 PolarHBondContact OD1-ND1 2.96Å; D723-H750 IonicContact OD2-ND1 2.62Å; H750-S772 CarbonylContact O-C 3.59Å; H750-S772 WeakPolarHBondContact O-CA 3.34Å; H750-S772 WeakPolarHBondContact O-CB 3.45Å; H750-S772 PolarHBondContact O-OG 3.08Å; H750-G773 PolarHBondContact O-N 2.91Å; H750-R774 HydrophobicContact CB-CB 4.14Å; H750-R774 HydrophobicContact CB-CG 3.99Å; H750-R774 PolarHBondContact CD2-NH1 2.85Å; H750-R774 PolarHBondContact CE1-NH1 3.11Å; H750-R774 VanDerWaalsContact CG-NH1 3.35Å; H750-R774 PolarHBondContact ND1-NH1 2.77Å; H750-R774 VanDerWaalsContact ND1-NH1 3.15Å; H750-R774 PolarHBondContact NE2-NH1 3.17Å; H750-R774 VanDerWaalsContact NE2-NH1 3.14Å
751	L	90.6	Very high	90.4	Very high	16 Å²	16	44.6 Å²	44.6	8%	0.084	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.5	-168.9	-76.7	169.3	0	0	0	111.9	V721 D723 T747 L749 L754 S771 L779	V721-L751 HydrophobicContact CG1-CB 3.74Å; V721-L751 HydrophobicContact CG1-CD1 3.86Å; V721-L751 HydrophobicContact CG1-CG 4.45Å; V721-L751 HydrophobicContact CG2-CD1 4.16Å; D723-L751 PolarHBondContact OD1-N 3.04Å; T747-L751 HydrophobicContact CG2-CD1 4.42Å; L749-L751 HydrophobicContact CD2-CD2 3.97Å; L749-L751 PolarHBondContact O-N 2.68Å; L751-L754 HydrophobicContact CD1-CD2 4.45Å; L751-L754 HydrophobicContact CD2-CD2 4.37Å; L751-S771 CarbonylContact C-O 3.58Å; L751-S771 WeakPolarHBondContact CA-O 3.43Å; L751-L779 HydrophobicContact CD1-CD2 4.22Å; L751-L779 HydrophobicContact CD2-CB 4.26Å
752	S	88.3	Confident	90	Very high	14 Å²	14	42.6 Å²	42.6	10%	0.098	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-34.4	177.4	174.5	0	0	0	0	113.6	S771 R808 N809 R810	S752-S771 PolarHBondContact N-O 2.98Å; S752-R808 WeakPolarHBondContact O-CG 3.48Å; S752-R808 WeakPolarHBondContact OG-CA 3.48Å; S752-N809 WeakPolarHBondContact CB-OD1 3.34Å; S752-N809 PolarHBondContact OG-N 2.85Å; S752-N809 VanDerWaalsContact OG-N 3.14Å; S752-N809 PolarHBondContact OG-OD1 3.41Å; S752-R810 PolarHBondContact OG-N 3.48Å; S752-R810 VanDerWaalsContact OG-N 3.14Å; S752-R810 PolarHBondContact OG-O 3.43Å
753	D	92.4	Very high	89.6	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.016	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	155.6	-172.7	-157.3	15.2	0	0	0	110.2	G770 S771 R808 R810 V811 M812	D753-G770 WeakPolarHBondContact O-CA 3.45Å; D753-S771 WeakPolarHBondContact CB-OG 3.44Å; D753-S771 PolarHBondContact N-OG 3.38Å; D753-S771 VanDerWaalsContact N-OG 3.15Å; D753-S771 PolarHBondContact O-N 3.12Å; D753-S771 PolarHBondContact O-OG 2.85Å; D753-R808 VanDerWaalsContact CG-CD 3.46Å; D753-R808 VanDerWaalsContact CG-NH1 3.32Å; D753-R808 WeakPolarHBondContact OD1-CD 3.41Å; D753-R808 IonicContact OD1-CZ 2.6Å; D753-R808 IonicContact OD1-NE 3.35Å; D753-R808 IonicContact OD1-NH1 3.35Å; D753-R808 PolarHBondContact OD1-NH1 3.13Å; D753-R808 IonicContact OD2-CZ 3.57Å; D753-R808 IonicContact OD2-NH1 2.77Å; D753-R808 PolarHBondContact OD2-NH1 3.12Å; D753-R810 WeakPolarHBondContact CB-O 3.49Å; D753-V811 VanDerWaalsContact OD2-CA 3.26Å; D753-V811 WeakPolarHBondContact OD2-CA 3.3Å; D753-M812 HydrophobicContact CB-CB 4.45Å; D753-M812 PolarHBondContact OD2-N 3.31Å
754	L	94.1	Very high	89.3	Confident	12 Å²	12	39.3 Å²	39.3	6%	0.063	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	142.3	175.5	-65.8	-170.7	0	0	0	111.2	Y710 V719 V721 L751 V768 F769	Y710-L754 HydrophobicContact CD1-CB 4.12Å; Y710-L754 HydrophobicContact CD2-CD1 3.72Å; Y710-L754 HydrophobicContact CD2-CG 4.25Å; Y710-L754 HydrophobicContact CE1-CB 4.15Å; Y710-L754 HydrophobicContact CE2-CD1 4.04Å; Y710-L754 HydrophobicContact CE2-CG 4.13Å; Y710-L754 HydrophobicContact CG-CB 4.35Å; Y710-L754 HydrophobicContact CG-CD1 4.03Å; Y710-L754 HydrophobicContact CG-CG 4.5Å; V719-L754 HydrophobicContact CG1-CD1 3.68Å; V721-L754 HydrophobicContact CG2-CD1 3.6Å; V721-L754 HydrophobicContact CG2-CD2 4.35Å; V721-L754 HydrophobicContact CG2-CG 4.06Å; L751-L754 HydrophobicContact CD1-CD2 4.45Å; L751-L754 HydrophobicContact CD2-CD2 4.37Å; L754-V768 HydrophobicContact CB-CG1 4.34Å; L754-V768 HydrophobicContact CD1-CG1 4.01Å; L754-V768 HydrophobicContact CD2-CG1 3.86Å; L754-V768 HydrophobicContact CG-CG1 4.31Å; L754-F769 WeakPolarHBondContact CA-O 2.99Å
755	A	94.8	Very high	89	Confident	6 Å²	6	38 Å²	38	5%	0.05	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	130.2	167.5	0	0	0	0	0	110.9	F769 M812 I822	A755-F769 PolarHBondContact N-O 3.06Å; A755-F769 PolarHBondContact O-N 3.47Å; A755-M812 HydrophobicContact CB-CB 4.16Å; A755-M812 HydrophobicContact CB-CG 3.69Å; A755-M812 HydrophobicContact CB-SD 4.08Å; A755-I822 HydrophobicContact CB-CG2 4.11Å
756	F	94.6	Very high	89.1	Confident	24 Å²	24	38 Å²	38	11%	0.105	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	141.3	167.2	-70	-82.9	0	0	0	110.4	M711 V719 Y766 V768 L783 S814	M711-F756 WeakPolarHBondContact O-CE2 3.42Å; V719-F756 HydrophobicContact CB-CZ 4.16Å; V719-F756 HydrophobicContact CG2-CE1 3.87Å; V719-F756 HydrophobicContact CG2-CZ 3.9Å; F756-Y766 HydrophobicContact CB-CD1 3.9Å; F756-Y766 HydrophobicContact CB-CE1 4.24Å; F756-Y766 HydrophobicContact CD1-CD1 4.42Å; F756-Y766 HydrophobicContact CD1-CG 4.23Å; F756-V768 HydrophobicContact CD1-CG2 3.61Å; F756-V768 HydrophobicContact CE1-CG2 3.53Å; F756-V768 HydrophobicContact CG-CG2 4.48Å; F756-V768 HydrophobicContact CZ-CG2 4.35Å; F756-L783 HydrophobicContact CE1-CD1 4.24Å; F756-S814 WeakPolarHBondContact O-CB 3.46Å; F756-S814 PolarHBondContact O-OG 3.47Å
757	Q	93.1	Very high	89.2	Confident	3 Å²	3	31.2 Å²	31.2	1%	0.014	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	128.9	179.5	175	56.6	65.1	0	0	108.7	F760 Y766 N767 F769 G819 I822	Q757-F760 HydrophobicContact CG-CE2 4.48Å; Q757-Y766 WeakPolarHBondContact O-CD1 3.29Å; Q757-N767 PolarHBondContact N-O 3.02Å; Q757-N767 PolarHBondContact O-N 2.73Å; Q757-F769 HydrophobicContact CB-CD2 4.13Å; Q757-F769 HydrophobicContact CB-CE2 4.03Å; Q757-F769 HydrophobicContact CG-CE2 4.14Å; Q757-G819 PolarHBondContact NE2-O 3.1Å; Q757-I822 HydrophobicContact CB-CD1 3.81Å; Q757-I822 HydrophobicContact CG-CD1 4.03Å
758	R	89.7	Confident	89.7	Confident	29 Å²	29	30.5 Å²	30.5	11%	0.109	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	141.8	177.2	-147.2	72.6	-179.6	137.6	-22.4	109.6	H375 D714 Q765 Y766	H375-R758 PolarHBondContact CE1-NE 2.85Å; D714-R758 IonicContact OD2-CZ 3.38Å; D714-R758 IonicContact OD2-NH1 2.74Å; D714-R758 PolarHBondContact OD2-NH1 3.18Å; D714-R758 IonicContact OD2-NH2 3.21Å; D714-R758 PolarHBondContact OD2-NH2 3.44Å; R758-Q765 PolarHBondContact NH1-O 3.3Å; R758-Y766 HydrophobicContact CB-CE1 4.3Å; R758-Y766 VanDerWaalsContact CD-CE1 3.48Å; R758-Y766 VanDerWaalsContact CD-CZ 3.41Å
759	S	89.3	Confident	90.2	Very high	11 Å²	11	23 Å²	23	8%	0.077	12%	0.116	C	C	.	.			trans	-69	143.4	-178.2	-175.1	0	0	0	0	111.9	T761 E762 Q765	S759-T761 PolarHBondContact OG-N 2.98Å; S759-T761 PolarHBondContact OG-OG1 3.41Å; S759-E762 WeakPolarHBondContact CB-O 3.46Å; S759-E762 PolarHBondContact OG-N 2.91Å; S759-Q765 WeakPolarHBondContact CB-O 2.95Å; S759-Q765 PolarHBondContact N-O 3.4Å
760	F	85.5	Confident	90.5	Very high	28 Å²	28	22.8 Å²	22.8	12%	0.123	12%	0.115	C	C	.	.	S	Bend	trans	-97.8	2	173.4	-71.4	-87	0	0	0	112.8	A405 Q757 G819 Q820 G835 R836	A405-F760 WeakPolarHBondContact CB-O 2.99Å; Q757-F760 HydrophobicContact CG-CE2 4.48Å; F760-G819 WeakPolarHBondContact CZ-O 3.37Å; F760-Q820 HydrophobicContact CZ-CB 4.05Å; F760-Q820 HydrophobicContact CZ-CG 4.31Å; F760-G835 VanDerWaalsContact CD2-O 3.29Å; F760-G835 WeakPolarHBondContact CD2-O 3.2Å; F760-R836 HydrophobicContact CB-CB 4.4Å; F760-R836 HydrophobicContact CB-CG 4.04Å; F760-R836 HydrophobicContact CD1-CB 4.09Å; F760-R836 HydrophobicContact CD1-CG 3.99Å; F760-R836 HydrophobicContact CD2-CB 4.01Å; F760-R836 HydrophobicContact CE1-CB 4.39Å; F760-R836 HydrophobicContact CE2-CB 4.32Å; F760-R836 HydrophobicContact CG-CB 3.9Å; F760-R836 HydrophobicContact CG-CG 3.93Å
761	T	84.6	Confident	90.6	Very high	77 Å²	77	20.1 Å²	20.1	47%	0.472	10%	0.103	S	C	.	.	S	Bend	trans	-114.5	-40.4	-179.5	47.7	0	0	0	0	112	A405 S759	A405-T761 WeakPolarHBondContact CA-O 3.38Å; S759-T761 PolarHBondContact OG-N 2.98Å; S759-T761 PolarHBondContact OG-OG1 3.41Å
762	E	85.5	Confident	90.7	Very high	79 Å²	79	19.3 Å²	19.3	37%	0.369	10%	0.099	S	C	.	.	S	Bend	trans	-122.4	136.3	-173.4	-66.2	-61.7	169.1	0	0	112.3	N406 S759 Q765	N406-E762 PolarHBondContact ND2-OE2 3.3Å; S759-E762 WeakPolarHBondContact CB-O 3.46Å; S759-E762 PolarHBondContact OG-N 2.91Å; E762-Q765 HydrophobicContact CB-CB 3.91Å; E762-Q765 HydrophobicContact CB-CG 3.62Å
763	I	85.3	Confident	90.7	Very high	37 Å²	37	19.2 Å²	19.2	19%	0.19	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	144.9	173.9	-166.9	176.5	0	0	0	110.7	L384 N406 Q765	L384-I763 HydrophobicContact CB-CD1 4.24Å; L384-I763 HydrophobicContact CD1-CD1 3.63Å; L384-I763 HydrophobicContact CD1-CG1 4.46Å; L384-I763 HydrophobicContact CG-CD1 3.72Å; N406-I763 HydrophobicContact CB-CB 4.26Å; N406-I763 HydrophobicContact CB-CG2 4.1Å; I763-Q765 PolarHBondContact O-N 3.03Å; I763-Q765 VanDerWaalsContact O-N 3.12Å
764	H	83.8	Confident	90.5	Very high	30 Å²	30	26.7 Å²	26.7	14%	0.139	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	19.3	178.9	-54.7	-41.6	0	0	0	115.6	A376 P382	A376-H764 PolarHBondContact O-CE1 3.13Å; A376-H764 VanDerWaalsContact O-CE1 3.23Å; P382-H764 PolarHBondContact O-NE2 3.19Å
765	Q	88.9	Confident	90.3	Very high	37 Å²	37	29.4 Å²	29.4	17%	0.173	14%	0.14	C	C	.	.			trans	-111.7	141.8	179.7	-64.7	-59.1	-77.3	0	0	112.6	Y717 R758 S759 E762 I763	Y717-Q765 VanDerWaalsContact OH-CD 3.24Å; Y717-Q765 PolarHBondContact OH-NE2 3.21Å; Y717-Q765 PolarHBondContact OH-OE1 3.38Å; R758-Q765 PolarHBondContact NH1-O 3.3Å; S759-Q765 WeakPolarHBondContact CB-O 2.95Å; S759-Q765 PolarHBondContact N-O 3.4Å; E762-Q765 HydrophobicContact CB-CB 3.91Å; E762-Q765 HydrophobicContact CB-CG 3.62Å; I763-Q765 PolarHBondContact O-N 3.03Å; I763-Q765 VanDerWaalsContact O-N 3.12Å
766	Y	91.6	Very high	90.2	Very high	10 Å²	10	32 Å²	32	4%	0.039	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	146	168.9	-88.2	-66.4	0	0	0	111	S712 P713 D714 F756 Q757 R758 L783	S712-Y766 VanDerWaalsContact CB-CD2 3.48Å; P713-Y766 HydrophobicContact CB-CE2 4.31Å; P713-Y766 WeakPolarHBondContact CB-OH 3.23Å; P713-Y766 HydrophobicContact CG-CE1 4.18Å; P713-Y766 HydrophobicContact CG-CE2 4.26Å; D714-Y766 HydrophobicContact CB-CE2 4.04Å; D714-Y766 VanDerWaalsContact CG-CE2 3.41Å; D714-Y766 VanDerWaalsContact OD2-CD2 3.23Å; D714-Y766 WeakPolarHBondContact OD2-CD2 3.38Å; D714-Y766 WeakPolarHBondContact OD2-CE2 3.13Å; F756-Y766 HydrophobicContact CB-CD1 3.9Å; F756-Y766 HydrophobicContact CB-CE1 4.24Å; F756-Y766 HydrophobicContact CD1-CD1 4.42Å; F756-Y766 HydrophobicContact CD1-CG 4.23Å; Q757-Y766 WeakPolarHBondContact O-CD1 3.29Å; R758-Y766 HydrophobicContact CB-CE1 4.3Å; R758-Y766 VanDerWaalsContact CD-CE1 3.48Å; R758-Y766 VanDerWaalsContact CD-CZ 3.41Å; Y766-L783 VanDerWaalsContact O-CB 3.22Å; Y766-L783 WeakPolarHBondContact O-CB 3.45Å; Y766-L783 WeakPolarHBondContact O-CD1 3.22Å; Y766-L783 WeakPolarHBondContact O-CG 3.36Å; Y766-L783 PolarHBondContact O-N 3.26Å
767	N	93.3	Very high	90.1	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.016	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	155.3	161.5	-64.2	-24.9	0	0	0	108.5	Q757 F780 V781 E782	Q757-N767 PolarHBondContact N-O 3.02Å; Q757-N767 PolarHBondContact O-N 2.73Å; N767-F780 HydrophobicContact CB-CE2 3.73Å; N767-F780 HydrophobicContact CB-CZ 4.2Å; N767-V781 WeakPolarHBondContact CA-O 3.35Å; N767-E782 WeakPolarHBondContact OD1-CA 3.43Å
768	V	95.4	Very high	90.1	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.012	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	135.8	176.2	170.9	0	0	0	0	109.8	V719 M728 L754 F756 F780 V781 L783	V719-V768 HydrophobicContact CG2-CG2 4.26Å; M728-V768 HydrophobicContact CE-CB 4.22Å; M728-V768 HydrophobicContact CE-CG1 3.77Å; L754-V768 HydrophobicContact CB-CG1 4.34Å; L754-V768 HydrophobicContact CD1-CG1 4.01Å; L754-V768 HydrophobicContact CD2-CG1 3.86Å; L754-V768 HydrophobicContact CG-CG1 4.31Å; F756-V768 HydrophobicContact CD1-CG2 3.61Å; F756-V768 HydrophobicContact CE1-CG2 3.53Å; F756-V768 HydrophobicContact CG-CG2 4.48Å; F756-V768 HydrophobicContact CZ-CG2 4.35Å; V768-F780 CarbonylContact O-C 3.54Å; V768-F780 WeakPolarHBondContact O-CA 3.49Å; V768-V781 PolarHBondContact N-O 2.91Å; V768-V781 PolarHBondContact O-N 3.48Å; V768-L783 HydrophobicContact CB-CD2 4.43Å; V768-L783 HydrophobicContact CG2-CD1 3.99Å; V768-L783 HydrophobicContact CG2-CD2 3.9Å; V768-L783 HydrophobicContact CG2-CG 4.17Å
769	F	95.7	Very high	90.3	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	143.5	164.7	-68.1	-111.8	0	0	0	108.3	L754 A755 Q757 L779 F780 I791 M812 I822 L833 N838	L754-F769 WeakPolarHBondContact CA-O 2.99Å; A755-F769 PolarHBondContact N-O 3.06Å; A755-F769 PolarHBondContact O-N 3.47Å; Q757-F769 HydrophobicContact CB-CD2 4.13Å; Q757-F769 HydrophobicContact CB-CE2 4.03Å; Q757-F769 HydrophobicContact CG-CE2 4.14Å; F769-L779 CarbonylContact C-O 3.58Å; F769-L779 VanDerWaalsContact CA-O 3.3Å; F769-L779 WeakPolarHBondContact CA-O 3.4Å; F769-F780 HydrophobicContact CD1-CB 4.35Å; F769-F780 HydrophobicContact CD1-CD2 4.11Å; F769-F780 AromaticContact CD2-CD2 3.93Å; F769-F780 HydrophobicContact CD2-CD2 3.93Å; F769-F780 HydrophobicContact CD2-CE2 4.43Å; F769-F780 HydrophobicContact CE1-CB 4.33Å; F769-F780 AromaticContact CE1-CD2 3.66Å; F769-F780 HydrophobicContact CE1-CD2 3.66Å; F769-F780 HydrophobicContact CE1-CE2 4.47Å; F769-F780 HydrophobicContact CE1-CG 4.4Å; F769-F780 AromaticContact CE2-CD2 3.46Å; F769-F780 HydrophobicContact CE2-CD2 3.46Å; F769-F780 VanDerWaalsContact CE2-CD2 3.46Å; F769-F780 AromaticContact CE2-CE2 3.67Å; F769-F780 HydrophobicContact CE2-CE2 3.67Å; F769-F780 HydrophobicContact CG-CD2 4.24Å; F769-F780 AromaticContact CZ-CD2 3.3Å; F769-F780 HydrophobicContact CZ-CD2 3.3Å; F769-F780 AromaticContact CZ-CE2 3.69Å; F769-F780 HydrophobicContact CZ-CE2 3.69Å; F769-F780 HydrophobicContact CZ-CG 4.39Å; F769-I791 HydrophobicContact CD1-CD1 3.96Å; F769-I791 HydrophobicContact CE1-CD1 3.73Å; F769-M812 HydrophobicContact CB-CE 4.22Å; F769-M812 HydrophobicContact CB-SD 3.41Å; F769-M812 WeakPolarHBondContact CB-SD 3.36Å; F769-I822 HydrophobicContact CB-CD1 3.96Å; F769-I822 HydrophobicContact CD1-CD1 3.91Å; F769-I822 HydrophobicContact CD2-CD1 3.09Å; F769-I822 HydrophobicContact CE1-CD1 4.13Å; F769-I822 HydrophobicContact CE2-CD1 3.37Å; F769-I822 HydrophobicContact CG-CD1 3.39Å; F769-I822 HydrophobicContact CZ-CD1 3.89Å; F769-L833 HydrophobicContact CD1-CD1 3.89Å; F769-L833 HydrophobicContact CE1-CD1 4.4Å; F769-N838 WeakPolarHBondContact CZ-OD1 3.19Å
770	G	94.1	Very high	90.6	Very high	1 Å²	1	31 Å²	31	1%	0.01	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	127.5	-178.4	0	0	0	0	0	112.5	D753 A778 L779	D753-G770 WeakPolarHBondContact O-CA 3.45Å; G770-A778 CarbonylContact O-C 3.55Å; G770-A778 VanDerWaalsContact O-CA 3.27Å; G770-A778 WeakPolarHBondContact O-CA 3.03Å; G770-A778 VanDerWaalsContact O-CB 3.27Å; G770-A778 WeakPolarHBondContact O-CB 3.28Å; G770-L779 PolarHBondContact N-O 2.94Å; G770-L779 PolarHBondContact O-N 3.35Å
771	S	92.9	Very high	91	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	145	178.2	64	0	0	0	0	111.1	L751 S752 D753 R810	L751-S771 CarbonylContact C-O 3.58Å; L751-S771 WeakPolarHBondContact CA-O 3.43Å; S752-S771 PolarHBondContact N-O 2.98Å; D753-S771 WeakPolarHBondContact CB-OG 3.44Å; D753-S771 PolarHBondContact N-OG 3.38Å; D753-S771 VanDerWaalsContact N-OG 3.15Å; D753-S771 PolarHBondContact O-N 3.12Å; D753-S771 PolarHBondContact O-OG 2.85Å; S771-R810 WeakPolarHBondContact CB-O 3.38Å; S771-R810 PolarHBondContact OG-O 3.33Å
772	S	92	Very high	91.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	133	168.9	-172.4	0	0	0	0	113.1	H750 R774 Q775 D777 R810	H750-S772 CarbonylContact O-C 3.59Å; H750-S772 WeakPolarHBondContact O-CA 3.34Å; H750-S772 WeakPolarHBondContact O-CB 3.45Å; H750-S772 PolarHBondContact O-OG 3.08Å; S772-R774 PolarHBondContact OG-N 2.92Å; S772-Q775 WeakPolarHBondContact OG-CB 3.41Å; S772-Q775 PolarHBondContact OG-N 3.14Å; S772-Q775 PolarHBondContact OG-OE1 3.31Å; S772-D777 VanDerWaalsContact CB-O 3.29Å; S772-D777 WeakPolarHBondContact CB-O 3.39Å; S772-R810 WeakPolarHBondContact O-CD 3.49Å
773	G	87.6	Confident	91.7	Very high	11 Å²	11	23.9 Å²	23.9	11%	0.113	11%	0.114	C	C	.	.	S	Bend	trans	-81.2	-10.9	171.6	0	0	0	0	0	114.6	H750 N809	H750-G773 PolarHBondContact O-N 2.91Å; G773-N809 WeakPolarHBondContact CA-OD1 3.12Å; G773-N809 PolarHBondContact O-ND2 2.99Å
774	R	87.9	Confident	91.6	Very high	161 Å²	161	24.4 Å²	24.4	61%	0.608	12%	0.121	S	C	*	.	S	Bend	trans	-130.1	-21.2	-175.1	-56.8	-173.3	-168.8	140.9	16.2	114.4	D723 H750 S772	D723-R774 IonicContact OD2-CZ 2.75Å; D723-R774 IonicContact OD2-NH2 3.97Å; D723-R774 PolarHBondContact OD2-NH2 2.84Å; H750-R774 HydrophobicContact CB-CB 4.14Å; H750-R774 HydrophobicContact CB-CG 3.99Å; H750-R774 PolarHBondContact CD2-NH1 2.85Å; H750-R774 PolarHBondContact CE1-NH1 3.11Å; H750-R774 VanDerWaalsContact CG-NH1 3.35Å; H750-R774 PolarHBondContact ND1-NH1 2.77Å; H750-R774 VanDerWaalsContact ND1-NH1 3.15Å; H750-R774 PolarHBondContact NE2-NH1 3.17Å; H750-R774 VanDerWaalsContact NE2-NH1 3.14Å; S772-R774 PolarHBondContact OG-N 2.92Å
775	Q	91.4	Very high	91.8	Very high	68 Å²	68	26 Å²	26	32%	0.318	13%	0.133	S	C	.	.	S	Bend	trans	-117.9	169	-175.3	-66.9	141.3	-74	0	0	111.5	N748 L749 S772 D777	N748-Q775 PolarHBondContact O-NE2 3.1Å; L749-Q775 HydrophobicContact CD1-CB 3.91Å; S772-Q775 WeakPolarHBondContact OG-CB 3.41Å; S772-Q775 PolarHBondContact OG-N 3.14Å; S772-Q775 PolarHBondContact OG-OE1 3.31Å; Q775-D777 VanDerWaalsContact C-N 3.35Å
776	T	93	Very high	91.6	Very high	62 Å²	62	25.7 Å²	25.7	38%	0.38	14%	0.135	S	C	.	.	S	Bend	trans	-94.5	12.6	-175.2	58.4	0	0	0	0	113.8	S793 L794 K795 E796	T776-S793 PolarHBondContact O-N 3.41Å; T776-L794 WeakPolarHBondContact O-CA 3.23Å; T776-L794 WeakPolarHBondContact O-CB 3.29Å; T776-L794 PolarHBondContact O-N 3.23Å; T776-K795 WeakPolarHBondContact CA-O 3.31Å; T776-E796 HydrophobicContact CG2-CG 4.3Å
777	D	92.3	Very high	91.5	Very high	32 Å²	32	31 Å²	31	17%	0.171	16%	0.158	C	C	.	.			trans	-115.5	160.8	-179.7	-69.5	-12.5	0	0	0	110.9	L749 S772 Q775 M790 I791 K792	L749-D777 HydrophobicContact CD1-CB 4Å; S772-D777 VanDerWaalsContact CB-O 3.29Å; S772-D777 WeakPolarHBondContact CB-O 3.39Å; Q775-D777 VanDerWaalsContact C-N 3.35Å; D777-M790 HydrophobicContact CB-CE 3.73Å; D777-I791 CarbonylContact C-O 3.59Å; D777-I791 VanDerWaalsContact CA-O 3.3Å; D777-I791 WeakPolarHBondContact CA-O 3.31Å; D777-K792 VanDerWaalsContact OD1-CA 3.26Å; D777-K792 WeakPolarHBondContact OD1-CA 3.14Å; D777-K792 WeakPolarHBondContact OD1-CB 3.02Å; D777-K792 WeakPolarHBondContact OD1-CG 2.97Å
778	A	93	Very high	91.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	154.5	167.9	0	0	0	0	0	111.1	G770 I791 L794 M812	G770-A778 CarbonylContact O-C 3.55Å; G770-A778 VanDerWaalsContact O-CA 3.27Å; G770-A778 WeakPolarHBondContact O-CA 3.03Å; G770-A778 VanDerWaalsContact O-CB 3.27Å; G770-A778 WeakPolarHBondContact O-CB 3.28Å; A778-I791 HydrophobicContact CB-CB 4.46Å; A778-I791 PolarHBondContact N-O 3.03Å; A778-I791 PolarHBondContact O-N 3.04Å; A778-L794 HydrophobicContact CB-CD1 3.38Å; A778-M812 HydrophobicContact CB-CE 4.15Å
779	L	94.2	Very high	91.3	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.016	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	143.8	175.2	-162.4	67.5	0	0	0	110.2	M728 L749 L751 F769 G770 V781 V788 M790	M728-L779 HydrophobicContact SD-CD2 3.71Å; L749-L779 HydrophobicContact CD2-CB 3.95Å; L751-L779 HydrophobicContact CD1-CD2 4.22Å; L751-L779 HydrophobicContact CD2-CB 4.26Å; F769-L779 CarbonylContact C-O 3.58Å; F769-L779 VanDerWaalsContact CA-O 3.3Å; F769-L779 WeakPolarHBondContact CA-O 3.4Å; G770-L779 PolarHBondContact N-O 2.94Å; G770-L779 PolarHBondContact O-N 3.35Å; L779-V781 HydrophobicContact CD2-CG2 3.95Å; L779-V781 HydrophobicContact CG-CG2 4.02Å; L779-V788 HydrophobicContact CD1-CG1 3.45Å; L779-V788 VanDerWaalsContact CD1-CG1 3.45Å; L779-V788 HydrophobicContact CG-CG1 4.28Å; L779-M790 HydrophobicContact CD1-SD 3.61Å
780	F	95.1	Very high	91.2	Very high	10 Å²	10	42.1 Å²	42.1	4%	0.044	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	137.6	162.4	165.6	-92.9	0	0	0	109.1	N767 V768 F769 E782 V788 K789 I791 N838	N767-F780 HydrophobicContact CB-CE2 3.73Å; N767-F780 HydrophobicContact CB-CZ 4.2Å; V768-F780 CarbonylContact O-C 3.54Å; V768-F780 WeakPolarHBondContact O-CA 3.49Å; F769-F780 HydrophobicContact CD1-CB 4.35Å; F769-F780 HydrophobicContact CD1-CD2 4.11Å; F769-F780 AromaticContact CD2-CD2 3.93Å; F769-F780 HydrophobicContact CD2-CD2 3.93Å; F769-F780 HydrophobicContact CD2-CE2 4.43Å; F769-F780 HydrophobicContact CE1-CB 4.33Å; F769-F780 AromaticContact CE1-CD2 3.66Å; F769-F780 HydrophobicContact CE1-CD2 3.66Å; F769-F780 HydrophobicContact CE1-CE2 4.47Å; F769-F780 HydrophobicContact CE1-CG 4.4Å; F769-F780 AromaticContact CE2-CD2 3.46Å; F769-F780 HydrophobicContact CE2-CD2 3.46Å; F769-F780 VanDerWaalsContact CE2-CD2 3.46Å; F769-F780 AromaticContact CE2-CE2 3.67Å; F769-F780 HydrophobicContact CE2-CE2 3.67Å; F769-F780 HydrophobicContact CG-CD2 4.24Å; F769-F780 AromaticContact CZ-CD2 3.3Å; F769-F780 HydrophobicContact CZ-CD2 3.3Å; F769-F780 AromaticContact CZ-CE2 3.69Å; F769-F780 HydrophobicContact CZ-CE2 3.69Å; F769-F780 HydrophobicContact CZ-CG 4.39Å; F780-E782 HydrophobicContact CE1-CB 4.07Å; F780-E782 HydrophobicContact CZ-CB 4.13Å; F780-V788 CarbonylContact O-C 3.52Å; F780-V788 WeakPolarHBondContact O-CA 3.42Å; F780-K789 HydrophobicContact CB-CB 4.23Å; F780-K789 HydrophobicContact CD1-CB 3.88Å; F780-K789 HydrophobicContact CG-CB 4.5Å; F780-K789 PolarHBondContact N-O 3.02Å; F780-K789 PolarHBondContact O-N 3.28Å; F780-I791 HydrophobicContact CB-CD1 4.35Å; F780-N838 HydrophobicContact CD1-CB 4.44Å; F780-N838 HydrophobicContact CD2-CB 4.29Å; F780-N838 HydrophobicContact CE1-CB 4.41Å; F780-N838 HydrophobicContact CE2-CB 4.23Å; F780-N838 VanDerWaalsContact CE2-CG 3.44Å; F780-N838 WeakPolarHBondContact CE2-OD1 3.08Å; F780-N838 HydrophobicContact CG-CB 4.37Å; F780-N838 HydrophobicContact CZ-CB 4.3Å; F780-N838 VanDerWaalsContact CZ-CG 3.47Å; F780-N838 VanDerWaalsContact CZ-ND2 3.33Å; F780-N838 WeakPolarHBondContact CZ-ND2 3.07Å
781	V	94.1	Very high	91.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	126.6	176.5	-172.2	0	0	0	0	110.7	M728 I730 I745 N767 V768 L779 L783 K787 V788	M728-V781 HydrophobicContact CE-CB 4.36Å; M728-V781 HydrophobicContact CE-CG2 3.89Å; M728-V781 HydrophobicContact SD-CG2 3.93Å; I730-V781 HydrophobicContact CD1-CG1 4.06Å; I745-V781 HydrophobicContact CD1-CB 4.47Å; I745-V781 HydrophobicContact CD1-CG1 3.47Å; I745-V781 VanDerWaalsContact CD1-CG1 3.47Å; I745-V781 HydrophobicContact CD1-CG2 4.11Å; N767-V781 WeakPolarHBondContact CA-O 3.35Å; V768-V781 PolarHBondContact N-O 2.91Å; V768-V781 PolarHBondContact O-N 3.48Å; L779-V781 HydrophobicContact CD2-CG2 3.95Å; L779-V781 HydrophobicContact CG-CG2 4.02Å; V781-L783 HydrophobicContact CG1-CD2 4.17Å; V781-K787 WeakPolarHBondContact CA-O 3.34Å; V781-V788 HydrophobicContact CG2-CG2 4.34Å
782	E	92.3	Very high	91.1	Very high	23 Å²	23	48.6 Å²	48.6	11%	0.107	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	103.9	169.7	179.4	175.3	-103	0	0	108.9	N767 F780 S784 T785 S786 K787	N767-E782 WeakPolarHBondContact OD1-CA 3.43Å; F780-E782 HydrophobicContact CE1-CB 4.07Å; F780-E782 HydrophobicContact CZ-CB 4.13Å; E782-S784 WeakPolarHBondContact CG-OG 3.18Å; E782-S784 PolarHBondContact O-N 3.25Å; E782-T785 HydrophobicContact CG-CG2 4.47Å; E782-T785 PolarHBondContact O-N 3.1Å; E782-T785 VanDerWaalsContact OE2-CG2 3.31Å; E782-T785 WeakPolarHBondContact OE2-CG2 3.27Å; E782-T785 PolarHBondContact OE2-OG1 2.67Å; E782-S786 WeakPolarHBondContact O-CA 3.48Å; E782-S786 PolarHBondContact O-N 2.69Å; E782-K787 HydrophobicContact CB-CB 4.35Å; E782-K787 PolarHBondContact N-O 3.23Å; E782-K787 WeakPolarHBondContact OE2-CE 3.15Å; E782-K787 IonicContact OE2-NZ 3.64Å; E782-K787 PolarHBondContact OE2-NZ 2.95Å
783	L	91.1	Very high	90.9	Very high	12 Å²	12	52.8 Å²	52.8	6%	0.063	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-21	-170.1	-56.6	179.5	0	0	0	113.6	Y717 V719 I730 F756 Y766 V768 V781 T785	Y717-L783 HydrophobicContact CD1-CB 3.93Å; Y717-L783 HydrophobicContact CD1-CD1 3.67Å; Y717-L783 HydrophobicContact CD1-CG 4.41Å; Y717-L783 HydrophobicContact CE1-CB 3.93Å; Y717-L783 HydrophobicContact CE1-CD1 4.39Å; Y717-L783 HydrophobicContact CG-CD1 3.8Å; V719-L783 HydrophobicContact CG2-CD1 4.38Å; V719-L783 HydrophobicContact CG2-CD2 4.28Å; I730-L783 HydrophobicContact CD1-CD2 3.61Å; I730-L783 HydrophobicContact CG1-CD2 4.12Å; I730-L783 HydrophobicContact CG2-CD2 4.28Å; F756-L783 HydrophobicContact CE1-CD1 4.24Å; Y766-L783 VanDerWaalsContact O-CB 3.22Å; Y766-L783 WeakPolarHBondContact O-CB 3.45Å; Y766-L783 WeakPolarHBondContact O-CD1 3.22Å; Y766-L783 WeakPolarHBondContact O-CG 3.36Å; Y766-L783 PolarHBondContact O-N 3.26Å; V768-L783 HydrophobicContact CB-CD2 4.43Å; V768-L783 HydrophobicContact CG2-CD1 3.99Å; V768-L783 HydrophobicContact CG2-CD2 3.9Å; V768-L783 HydrophobicContact CG2-CG 4.17Å; V781-L783 HydrophobicContact CG1-CD2 4.17Å; L783-T785 VanDerWaalsContact C-N 3.32Å
784	S	84.5	Confident	91	Very high	47 Å²	47	52.2 Å²	52.2	33%	0.329	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-22.2	178	60.7	0	0	0	0	113.7	E782	E782-S784 WeakPolarHBondContact CG-OG 3.18Å; E782-S784 PolarHBondContact O-N 3.25Å
785	T	87	Confident	91.3	Very high	64 Å²	64	48.3 Å²	48.3	39%	0.393	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.3	-2.4	-174.9	72	0	0	0	0	114.2	E782 L783 K787	E782-T785 HydrophobicContact CG-CG2 4.47Å; E782-T785 PolarHBondContact O-N 3.1Å; E782-T785 VanDerWaalsContact OE2-CG2 3.31Å; E782-T785 WeakPolarHBondContact OE2-CG2 3.27Å; E782-T785 PolarHBondContact OE2-OG1 2.67Å; L783-T785 VanDerWaalsContact C-N 3.32Å; T785-K787 PolarHBondContact O-N 3.02Å; T785-K787 VanDerWaalsContact O-N 3.13Å; T785-K787 WeakPolarHBondContact OG1-CB 3.35Å; T785-K787 WeakPolarHBondContact OG1-CD 3.46Å; T785-K787 VanDerWaalsContact OG1-CE 3.23Å; T785-K787 WeakPolarHBondContact OG1-CE 3.4Å; T785-K787 VanDerWaalsContact OG1-CG 3.22Å; T785-K787 WeakPolarHBondContact OG1-CG 3.45Å; T785-K787 PolarHBondContact OG1-N 2.82Å; T785-K787 PolarHBondContact OG1-NZ 3.06Å
786	S	84.7	Confident	91.3	Very high	30 Å²	30	50.6 Å²	50.6	21%	0.21	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	20.5	-169.4	-59.3	0	0	0	0	115	F743 E782 V788	F743-S786 VanDerWaalsContact CD1-OG 3.26Å; F743-S786 WeakPolarHBondContact CD1-OG 3.39Å; F743-S786 VanDerWaalsContact CE1-OG 3.31Å; F743-S786 WeakPolarHBondContact CE1-OG 3.44Å; E782-S786 WeakPolarHBondContact O-CA 3.48Å; E782-S786 PolarHBondContact O-N 2.69Å; S786-V788 PolarHBondContact O-N 3.44Å
787	K	89.7	Confident	91.2	Very high	122 Å²	122	48.1 Å²	48.1	53%	0.53	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	131.2	175	-76	174.5	-135.6	136.6	0	110.7	V781 E782 T785	V781-K787 WeakPolarHBondContact CA-O 3.34Å; E782-K787 HydrophobicContact CB-CB 4.35Å; E782-K787 PolarHBondContact N-O 3.23Å; E782-K787 WeakPolarHBondContact OE2-CE 3.15Å; E782-K787 IonicContact OE2-NZ 3.64Å; E782-K787 PolarHBondContact OE2-NZ 2.95Å; T785-K787 PolarHBondContact O-N 3.02Å; T785-K787 VanDerWaalsContact O-N 3.13Å; T785-K787 WeakPolarHBondContact OG1-CB 3.35Å; T785-K787 WeakPolarHBondContact OG1-CD 3.46Å; T785-K787 VanDerWaalsContact OG1-CE 3.23Å; T785-K787 WeakPolarHBondContact OG1-CE 3.4Å; T785-K787 VanDerWaalsContact OG1-CG 3.22Å; T785-K787 WeakPolarHBondContact OG1-CG 3.45Å; T785-K787 PolarHBondContact OG1-N 2.82Å; T785-K787 PolarHBondContact OG1-NZ 3.06Å
788	V	91.9	Very high	91	Very high	72 Å²	72	46.7 Å²	46.7	44%	0.436	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	140.7	-178.8	-176	0	0	0	0	110.6	I745 L779 F780 V781 S786	I745-V788 HydrophobicContact CD1-CG2 3.92Å; I745-V788 HydrophobicContact CG1-CG2 4.3Å; I745-V788 HydrophobicContact CG2-CG2 3.84Å; L779-V788 HydrophobicContact CD1-CG1 3.45Å; L779-V788 VanDerWaalsContact CD1-CG1 3.45Å; L779-V788 HydrophobicContact CG-CG1 4.28Å; F780-V788 CarbonylContact O-C 3.52Å; F780-V788 WeakPolarHBondContact O-CA 3.42Å; V781-V788 HydrophobicContact CG2-CG2 4.34Å; S786-V788 PolarHBondContact O-N 3.44Å
789	K	92.9	Very high	90.8	Very high	94 Å²	94	52.6 Å²	52.6	41%	0.409	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	139.7	174.1	-175.3	-175.2	-178.9	-175.1	0	110.1	F780 N838	F780-K789 HydrophobicContact CB-CB 4.23Å; F780-K789 HydrophobicContact CD1-CB 3.88Å; F780-K789 HydrophobicContact CG-CB 4.5Å; F780-K789 PolarHBondContact N-O 3.02Å; F780-K789 PolarHBondContact O-N 3.28Å; K789-N838 HydrophobicContact CD-CB 4.47Å; K789-N838 WeakPolarHBondContact CE-O 3.44Å; K789-N838 PolarHBondContact NZ-O 3.44Å
790	M	92.6	Very high	90.2	Very high	72 Å²	72	55.8 Å²	55.8	36%	0.355	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	134.2	170.4	-60.3	-56.4	-59.3	0	0	110.5	L749 D777 L779	L749-M790 HydrophobicContact CB-CE 4.48Å; L749-M790 HydrophobicContact CD1-CE 3.95Å; L749-M790 HydrophobicContact CD2-CE 4.05Å; L749-M790 HydrophobicContact CG-CE 4.39Å; D777-M790 HydrophobicContact CB-CE 3.73Å; L779-M790 HydrophobicContact CD1-SD 3.61Å
791	I	93.6	Very high	89.6	Confident	8 Å²	8	64.3 Å²	64.3	4%	0.041	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	123.6	170.3	-60	174.5	0	0	0	107.2	F769 D777 A778 F780 L794 L833 L840	F769-I791 HydrophobicContact CD1-CD1 3.96Å; F769-I791 HydrophobicContact CE1-CD1 3.73Å; D777-I791 CarbonylContact C-O 3.59Å; D777-I791 VanDerWaalsContact CA-O 3.3Å; D777-I791 WeakPolarHBondContact CA-O 3.31Å; A778-I791 HydrophobicContact CB-CB 4.46Å; A778-I791 PolarHBondContact N-O 3.03Å; A778-I791 PolarHBondContact O-N 3.04Å; F780-I791 HydrophobicContact CB-CD1 4.35Å; I791-L794 HydrophobicContact CG2-CD2 4.45Å; I791-L833 HydrophobicContact CD1-CD1 4.15Å; I791-L833 HydrophobicContact CG2-CD2 4Å; I791-L840 HydrophobicContact CG2-CB 4.28Å
792	K	91.6	Very high	89.1	Confident	130 Å²	130	67 Å²	67	57%	0.565	34%	0.342	S	S	*	.			trans	-106.3	172.4	-169.5	-57	-156.9	170.8	-166.7	0	113.7	D777	D777-K792 VanDerWaalsContact OD1-CA 3.26Å; D777-K792 WeakPolarHBondContact OD1-CA 3.14Å; D777-K792 WeakPolarHBondContact OD1-CB 3.02Å; D777-K792 WeakPolarHBondContact OD1-CG 2.97Å
793	S	89.1	Confident	88.7	Confident	87 Å²	87	66.4 Å²	66.4	61%	0.608	34%	0.339	S	S	*	.			trans	72.8	29.3	168.9	-49.5	0	0	0	0	115.6	T776 K795 F831	T776-S793 PolarHBondContact O-N 3.41Å; S793-K795 VanDerWaalsContact C-N 3.34Å; S793-K795 PolarHBondContact O-N 2.03Å; S793-F831 WeakPolarHBondContact O-CE1 3.45Å
794	L	89.6	Confident	88.5	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.359	C	S	.	.			trans	-90.2	14.9	-175.8	-51.1	179.7	0	0	0	114.4	T776 A778 I791 R810 T824 F831 L833 L840	T776-L794 WeakPolarHBondContact O-CA 3.23Å; T776-L794 WeakPolarHBondContact O-CB 3.29Å; T776-L794 PolarHBondContact O-N 3.23Å; A778-L794 HydrophobicContact CB-CD1 3.38Å; I791-L794 HydrophobicContact CG2-CD2 4.45Å; L794-R810 PolarHBondContact O-NH1 3.21Å; L794-R810 PolarHBondContact O-NH2 3.2Å; L794-T824 HydrophobicContact CD1-CG2 4.43Å; L794-F831 VanDerWaalsContact C-CE2 3.45Å; L794-F831 VanDerWaalsContact C-CZ 3.48Å; L794-F831 HydrophobicContact CB-CD1 4.46Å; L794-F831 HydrophobicContact CB-CD2 4.33Å; L794-F831 HydrophobicContact CB-CG 4.28Å; L794-F831 HydrophobicContact CD2-CB 3.91Å; L794-F831 HydrophobicContact CD2-CD1 3.68Å; L794-F831 HydrophobicContact CD2-CE1 4.43Å; L794-F831 HydrophobicContact CD2-CG 3.81Å; L794-F831 WeakPolarHBondContact O-CD2 3.35Å; L794-F831 WeakPolarHBondContact O-CE2 3.33Å; L794-L833 HydrophobicContact CD2-CD2 4.01Å; L794-L840 HydrophobicContact CD2-CD1 3.97Å; L794-L840 HydrophobicContact CD2-CD2 4.36Å
795	K	93.3	Very high	88.6	Confident	78 Å²	78	69.1 Å²	69.1	34%	0.339	35%	0.35	S	S	.	.			trans	52.6	176.5	-175.4	-67	-179	-171.9	175.6	0	115	T776 S793 R810 S829 F831 E843	T776-K795 WeakPolarHBondContact CA-O 3.31Å; S793-K795 VanDerWaalsContact C-N 3.34Å; S793-K795 PolarHBondContact O-N 2.03Å; K795-R810 PolarHBondContact O-NH1 3.19Å; K795-S829 PolarHBondContact NZ-OG 3.2Å; K795-F831 HydrophobicContact CB-CE2 4.13Å; K795-F831 HydrophobicContact CB-CZ 4.04Å; K795-F831 HydrophobicContact CD-CE2 4.49Å; K795-F831 HydrophobicContact CD-CZ 4Å; K795-F831 HydrophobicContact CG-CE2 4.39Å; K795-F831 HydrophobicContact CG-CZ 3.83Å; K795-E843 WeakPolarHBondContact CE-OE1 3.28Å; K795-E843 WeakPolarHBondContact CE-OE2 3.15Å; K795-E843 IonicContact NZ-OE1 2.68Å; K795-E843 PolarHBondContact NZ-OE1 3.32Å; K795-E843 IonicContact NZ-OE2 3.58Å
796	E	91.7	Very high	88.5	Confident	117 Å²	117	67.6 Å²	67.6	55%	0.547	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-67.6	137.9	-179.1	-66.1	-170.7	176.2	0	0	112.5	T776 S826 R827	T776-E796 HydrophobicContact CG2-CG 4.3Å; E796-S826 VanDerWaalsContact O-CB 3.3Å; E796-S826 WeakPolarHBondContact O-CB 3.16Å; E796-R827 PolarHBondContact O-N 2.8Å
797	A	90.9	Very high	88.1	Confident	10 Å²	10	71.8 Å²	71.8	8%	0.083	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-63.4	163.9	167.9	0	0	0	0	0	111.7	R810	A797-R810 HydrophobicContact CB-CB 4.01Å; A797-R810 HydrophobicContact CB-CG 4.49Å
798	I	88.8	Confident	88	Confident	1 Å²	1	71 Å²	71	1%	0.005	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-71.9	138.3	171.3	-44	-152.2	0	0	0	108.4	D802 W803 N809 K849 N851	I798-D802 HydrophobicContact CG2-CB 3.84Å; I798-W803 HydrophobicContact CG2-CB 4.01Å; I798-N809 WeakPolarHBondContact O-CB 3.31Å; I798-N809 PolarHBondContact O-ND2 3.34Å; I798-K849 HydrophobicContact CD1-CB 4.11Å; I798-K849 HydrophobicContact CD1-CG 4.12Å; I798-N851 HydrophobicContact CD1-CB 3.96Å; I798-N851 WeakPolarHBondContact CD1-OD1 3.47Å
799	K	87.7	Confident	87.8	Confident	125 Å²	125	68.3 Å²	68.3	54%	0.543	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-71.7	139.3	176	-60.4	178.4	-178.7	179.3	0	108.8	F801 D802 W803	K799-F801 PolarHBondContact O-N 2.92Å; K799-D802 WeakPolarHBondContact O-CA 3.37Å; K799-D802 WeakPolarHBondContact O-CB 3.35Å; K799-D802 PolarHBondContact O-N 3.24Å; K799-W803 PolarHBondContact O-N 3.36Å
800	S	81.6	Confident	87.7	Confident	69 Å²	69	63.9 Å²	63.9	48%	0.483	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-59.5	-25.7	-174.9	-43.2	0	0	0	0	113.8	W803	S800-W803 CarbonylContact O-C 3.52Å; S800-W803 VanDerWaalsContact O-C 3.26Å; S800-W803 PolarHBondContact O-N 3.36Å
801	F	83.3	Confident	87.7	Confident	189 Å²	189	61.2 Å²	61.2	83%	0.829	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-71	-33.5	171.7	-177.7	-94.4	0	0	0	113.3	K799 W803	K799-F801 PolarHBondContact O-N 2.92Å; F801-W803 PolarHBondContact O-N 3.13Å
802	D	83.8	Confident	87.8	Confident	56 Å²	56	61.3 Å²	61.3	30%	0.299	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-74.3	-8.9	176.1	-60.4	-29	0	0	0	112.2	I798 K799	I798-D802 HydrophobicContact CG2-CB 3.84Å; K799-D802 WeakPolarHBondContact O-CA 3.37Å; K799-D802 WeakPolarHBondContact O-CB 3.35Å; K799-D802 PolarHBondContact O-N 3.24Å
803	W	83.6	Confident	87.9	Confident	12 Å²	12	56.6 Å²	56.6	5%	0.045	30%	0.3	C	S	.	.			trans	-147.7	70.5	-179.1	-160.7	-95.9	0	0	0	112.6	W515 I798 K799 S800 F801 W805 K849 N851 V852	W515-W803 WeakPolarHBondContact O-CH2 3.43Å; W515-W803 WeakPolarHBondContact O-CZ2 3.45Å; I798-W803 HydrophobicContact CG2-CB 4.01Å; K799-W803 PolarHBondContact O-N 3.36Å; S800-W803 CarbonylContact O-C 3.52Å; S800-W803 VanDerWaalsContact O-C 3.26Å; S800-W803 PolarHBondContact O-N 3.36Å; F801-W803 PolarHBondContact O-N 3.13Å; W803-W805 AromaticContact CD2-CD1 4Å; W803-W805 AromaticContact CE2-CD1 3.78Å; W803-W805 AromaticContact CZ2-CD1 3.97Å; W803-W805 PolarHBondContact O-N 3.07Å; W803-W805 VanDerWaalsContact O-N 3.14Å; W803-K849 HydrophobicContact CE3-CB 4.42Å; W803-K849 HydrophobicContact CZ3-CB 4.19Å; W803-N851 HydrophobicContact CD2-CB 3.9Å; W803-N851 HydrophobicContact CE3-CB 4.5Å; W803-N851 HydrophobicContact CG-CB 4.19Å; W803-N851 HydrophobicContact CZ2-CB 4.06Å; W803-V852 HydrophobicContact CZ2-CG2 3.97Å
804	P	86.6	Confident	88.1	Confident	75 Å²	75	53.9 Å²	53.9	49%	0.487	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-13.3	-171.3	28.9	-36.8	0	0	0	114.6	S806	P804-S806 PolarHBondContact O-N 3.05Å
805	W	86.9	Confident	88.2	Confident	40 Å²	40	54 Å²	54	15%	0.152	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-14	-171.6	-47.2	117	0	0	0	115.1	V514 P531 T532 Y555 V557 W573 W803	V514-W805 HydrophobicContact CG1-CZ2 3.62Å; P531-W805 HydrophobicContact CB-CE3 4.04Å; P531-W805 HydrophobicContact CB-CH2 4.09Å; P531-W805 HydrophobicContact CB-CZ3 3.8Å; P531-W805 HydrophobicContact CG-CD2 4.02Å; P531-W805 HydrophobicContact CG-CE3 4.04Å; P531-W805 HydrophobicContact CG-CH2 4.03Å; P531-W805 HydrophobicContact CG-CZ2 4Å; P531-W805 HydrophobicContact CG-CZ3 4.04Å; T532-W805 HydrophobicContact CG2-CH2 4.46Å; Y555-W805 HydrophobicContact CD1-CH2 4.17Å; Y555-W805 AromaticContact CD1-CZ3 3.97Å; Y555-W805 HydrophobicContact CD1-CZ3 3.97Å; Y555-W805 HydrophobicContact CE1-CH2 4.41Å; V557-W805 HydrophobicContact CG1-CE3 4.08Å; W573-W805 HydrophobicContact CZ3-CE3 4.16Å; W573-W805 HydrophobicContact CZ3-CZ3 4.44Å; W803-W805 AromaticContact CD2-CD1 4Å; W803-W805 AromaticContact CE2-CD1 3.78Å; W803-W805 AromaticContact CZ2-CD1 3.97Å; W803-W805 PolarHBondContact O-N 3.07Å; W803-W805 VanDerWaalsContact O-N 3.14Å
806	S	83.8	Confident	87.8	Confident	32 Å²	32	51.5 Å²	51.5	22%	0.224	28%	0.278	C	S	.	.			trans	-145.8	141.4	-174.2	170.2	0	0	0	0	110.7	P804 R808	P804-S806 PolarHBondContact O-N 3.05Å; S806-R808 PolarHBondContact O-N 3.28Å; S806-R808 PolarHBondContact OG-N 3.14Å; S806-R808 PolarHBondContact OG-O 3.27Å
807	S	78.1	Confident	87.5	Confident	119 Å²	119	47.1 Å²	47.1	83%	0.832	26%	0.258	S	S	*	.	S	Bend	trans	-66.5	-25.4	168.2	52.7	0	0	0	0	112.6
808	R	86.4	Confident	87.2	Confident	105 Å²	105	47.6 Å²	47.6	40%	0.396	26%	0.258	S	S	.	.			trans	-89.6	110.4	176.1	-56.4	-175.5	-79.9	173.8	-2.6	108.7	S752 D753 S806 V811	S752-R808 WeakPolarHBondContact O-CG 3.48Å; S752-R808 WeakPolarHBondContact OG-CA 3.48Å; D753-R808 VanDerWaalsContact CG-CD 3.46Å; D753-R808 VanDerWaalsContact CG-NH1 3.32Å; D753-R808 WeakPolarHBondContact OD1-CD 3.41Å; D753-R808 IonicContact OD1-CZ 2.6Å; D753-R808 IonicContact OD1-NE 3.35Å; D753-R808 IonicContact OD1-NH1 3.35Å; D753-R808 PolarHBondContact OD1-NH1 3.13Å; D753-R808 IonicContact OD2-CZ 3.57Å; D753-R808 IonicContact OD2-NH1 2.77Å; D753-R808 PolarHBondContact OD2-NH1 3.12Å; S806-R808 PolarHBondContact O-N 3.28Å; S806-R808 PolarHBondContact OG-N 3.14Å; S806-R808 PolarHBondContact OG-O 3.27Å; R808-V811 HydrophobicContact CB-CG1 4.48Å
809	N	87.3	Confident	87	Confident	15 Å²	15	47.7 Å²	47.7	8%	0.08	26%	0.259	C	S	.	.	S	Bend	trans	-91.9	-11.4	-177.3	72.6	-43.6	0	0	0	113.3	S752 G773 I798 N851	S752-N809 WeakPolarHBondContact CB-OD1 3.34Å; S752-N809 PolarHBondContact OG-N 2.85Å; S752-N809 VanDerWaalsContact OG-N 3.14Å; S752-N809 PolarHBondContact OG-OD1 3.41Å; G773-N809 WeakPolarHBondContact CA-OD1 3.12Å; G773-N809 PolarHBondContact O-ND2 2.99Å; I798-N809 WeakPolarHBondContact O-CB 3.31Å; I798-N809 PolarHBondContact O-ND2 3.34Å; N809-N851 PolarHBondContact O-ND2 3.17Å; N809-N851 PolarHBondContact O-OD1 3.01Å
810	R	91.7	Very high	87.1	Confident	1 Å²	1	44.1 Å²	44.1	0%	0.004	25%	0.245	C	C	.	.	S	Bend	trans	-137.8	94.3	169.9	-171.9	-179.9	-172.4	132.7	28.6	110.2	S752 D753 S771 S772 L794 K795 A797 T824 P825	S752-R810 PolarHBondContact OG-N 3.48Å; S752-R810 VanDerWaalsContact OG-N 3.14Å; S752-R810 PolarHBondContact OG-O 3.43Å; D753-R810 WeakPolarHBondContact CB-O 3.49Å; S771-R810 WeakPolarHBondContact CB-O 3.38Å; S771-R810 PolarHBondContact OG-O 3.33Å; S772-R810 WeakPolarHBondContact O-CD 3.49Å; L794-R810 PolarHBondContact O-NH1 3.21Å; L794-R810 PolarHBondContact O-NH2 3.2Å; K795-R810 PolarHBondContact O-NH1 3.19Å; A797-R810 HydrophobicContact CB-CB 4.01Å; A797-R810 HydrophobicContact CB-CG 4.49Å; R810-T824 WeakPolarHBondContact CG-OG1 3.48Å; R810-T824 PolarHBondContact NE-OG1 3.35Å; R810-P825 PolarHBondContact NE-O 2.97Å; R810-P825 VanDerWaalsContact NE-O 3.07Å; R810-P825 PolarHBondContact NH2-O 2.92Å
811	V	93	Very high	87.6	Confident	17 Å²	17	42.3 Å²	42.3	10%	0.103	23%	0.228	C	C	.	.			trans	-68	160.8	-179.9	-62.5	0	0	0	0	112.8	D753 R808 T824 P825 N851 V853	D753-V811 VanDerWaalsContact OD2-CA 3.26Å; D753-V811 WeakPolarHBondContact OD2-CA 3.3Å; R808-V811 HydrophobicContact CB-CG1 4.48Å; V811-T824 WeakPolarHBondContact O-CB 3.49Å; V811-T824 PolarHBondContact O-OG1 2.98Å; V811-P825 HydrophobicContact CG2-CG 3.83Å; V811-P825 VanDerWaalsContact O-CD 3.32Å; V811-P825 WeakPolarHBondContact O-CD 3.39Å; V811-N851 WeakPolarHBondContact CG2-O 3.41Å; V811-V853 HydrophobicContact CG2-CG2 4.29Å
812	M	94.4	Very high	88.2	Confident	9 Å²	9	33.3 Å²	33.3	4%	0.044	19%	0.188	C	C	.	.			trans	-139	127	171.2	-166.7	173.9	-95.1	0	0	111.1	D753 A755 F769 A778 I822 M823 T824 L833	D753-M812 HydrophobicContact CB-CB 4.45Å; D753-M812 PolarHBondContact OD2-N 3.31Å; A755-M812 HydrophobicContact CB-CB 4.16Å; A755-M812 HydrophobicContact CB-CG 3.69Å; A755-M812 HydrophobicContact CB-SD 4.08Å; F769-M812 HydrophobicContact CB-CE 4.22Å; F769-M812 HydrophobicContact CB-SD 3.41Å; F769-M812 WeakPolarHBondContact CB-SD 3.36Å; A778-M812 HydrophobicContact CB-CE 4.15Å; M812-I822 HydrophobicContact CG-CG2 3.46Å; M812-I822 VanDerWaalsContact CG-CG2 3.46Å; M812-I822 HydrophobicContact SD-CG2 4Å; M812-M823 WeakPolarHBondContact CA-O 3.47Å; M812-T824 HydrophobicContact CE-CG2 4.18Å; M812-L833 HydrophobicContact CE-CD1 4.04Å
813	V	94.7	Very high	88.8	Confident	31 Å²	31	30.6 Å²	30.6	19%	0.188	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	119.1	-171.6	-174.9	0	0	0	0	110.1	F466 I822 M823 V853 W855	F466-V813 HydrophobicContact CE1-CB 4.35Å; F466-V813 HydrophobicContact CE1-CG1 4.12Å; F466-V813 WeakPolarHBondContact CE1-O 3.38Å; V813-I822 CarbonylContact O-C 3.59Å; V813-I822 WeakPolarHBondContact O-CA 2.98Å; V813-M823 PolarHBondContact N-O 3.04Å; V813-M823 PolarHBondContact O-N 2.85Å; V813-V853 HydrophobicContact CB-CG1 4.15Å; V813-V853 HydrophobicContact CG2-CB 3.97Å; V813-V853 HydrophobicContact CG2-CG1 4.04Å; V813-W855 HydrophobicContact CG1-CB 4.31Å
814	S	93.6	Very high	89.4	Confident	31 Å²	31	30 Å²	30	22%	0.217	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	158.1	173.2	49.7	0	0	0	0	112	F756 G816	F756-S814 WeakPolarHBondContact O-CB 3.46Å; F756-S814 PolarHBondContact O-OG 3.47Å; S814-G816 PolarHBondContact O-N 2.7Å
815	S	90.1	Very high	89.7	Confident	2 Å²	2	26.5 Å²	26.5	1%	0.014	15%	0.148	C	C	.	.			trans	-84.2	44.1	-174.5	36.9	0	0	0	0	114.3	G819 Q820 Y821 W855	S815-G819 WeakPolarHBondContact O-CA 3.47Å; S815-G819 PolarHBondContact O-N 2.97Å; S815-G819 VanDerWaalsContact O-N 3.11Å; S815-G819 WeakPolarHBondContact OG-CA 3.39Å; S815-Q820 PolarHBondContact OG-N 3Å; S815-Y821 WeakPolarHBondContact CB-O 3.44Å; S815-Y821 PolarHBondContact N-O 3.25Å; S815-Y821 WeakPolarHBondContact OG-CA 3.38Å; S815-Y821 PolarHBondContact OG-N 3.29Å; S815-Y821 PolarHBondContact OG-O 2.69Å; S815-W855 VanDerWaalsContact C-CD1 3.46Å; S815-W855 VanDerWaalsContact C-CE2 3.42Å; S815-W855 VanDerWaalsContact C-NE1 3.26Å; S815-W855 VanDerWaalsContact CA-CD2 3.41Å; S815-W855 VanDerWaalsContact CB-CE2 3.47Å; S815-W855 VanDerWaalsContact CB-CZ3 3.49Å; S815-W855 VanDerWaalsContact O-CE2 3.24Å; S815-W855 WeakPolarHBondContact O-CZ2 3.25Å; S815-W855 PolarHBondContact O-NE1 2.98Å; S815-W855 VanDerWaalsContact O-NE1 3.09Å
816	G	86.2	Confident	90	Very high	25 Å²	25	24.7 Å²	24.7	26%	0.258	14%	0.142	S	C	.	.			trans	69.6	-166.8	-179.5	0	0	0	0	0	113.9	S814 F818 G819	S814-G816 PolarHBondContact O-N 2.7Å; G816-F818 PolarHBondContact O-N 3.33Å; G816-G819 PolarHBondContact O-N 3.22Å; G816-G819 VanDerWaalsContact O-N 3.16Å
817	L	84.4	Confident	90.3	Very high	25 Å²	25	28.2 Å²	28.2	13%	0.131	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-46.3	-171.9	175.4	59.5	0	0	0	113	H375 L620	H375-L817 HydrophobicContact CB-CD1 4.35Å; H375-L817 HydrophobicContact CB-CD2 4.41Å; L620-L817 HydrophobicContact CD1-CD2 4.38Å
818	F	84.6	Confident	90.8	Very high	20 Å²	20	26.6 Å²	26.6	9%	0.088	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	12.4	178.5	-62.2	-71.2	0	0	0	113.1	R356 Y358 R373 H375 G816	R356-F818 HydrophobicContact CB-CE2 3.65Å; R356-F818 HydrophobicContact CB-CZ 3.69Å; R356-F818 WeakPolarHBondContact O-CZ 3.27Å; Y358-F818 VanDerWaalsContact CB-CD2 3.49Å; Y358-F818 HydrophobicContact CD1-CB 4.09Å; Y358-F818 HydrophobicContact CD2-CB 4.29Å; Y358-F818 HydrophobicContact CD2-CD2 4.42Å; Y358-F818 HydrophobicContact CG-CB 3.78Å; Y358-F818 HydrophobicContact CG-CD2 4.16Å; Y358-F818 AromaticContact CG-CG 3.91Å; Y358-F818 HydrophobicContact CG-CG 3.91Å; R373-F818 HydrophobicContact CB-CD1 4.31Å; R373-F818 HydrophobicContact CB-CE1 4.45Å; R373-F818 PolarHBondContact NH1-O 2.8Å; R373-F818 PolarHBondContact NH2-O 2.94Å; H375-F818 HydrophobicContact CB-CE1 3.85Å; H375-F818 HydrophobicContact CB-CZ 3.92Å; G816-F818 PolarHBondContact O-N 3.33Å
819	G	84.8	Confident	91.1	Very high	3 Å²	3	21.7 Å²	21.7	3%	0.031	11%	0.112	C	C	.	.			trans	-59	138.4	176.4	0	0	0	0	0	113.3	Q757 F760 S815 G816	Q757-G819 PolarHBondContact NE2-O 3.1Å; F760-G819 WeakPolarHBondContact CZ-O 3.37Å; S815-G819 WeakPolarHBondContact O-CA 3.47Å; S815-G819 PolarHBondContact O-N 2.97Å; S815-G819 VanDerWaalsContact O-N 3.11Å; S815-G819 WeakPolarHBondContact OG-CA 3.39Å; G816-G819 PolarHBondContact O-N 3.22Å; G816-G819 VanDerWaalsContact O-N 3.16Å
820	Q	89.4	Confident	91.5	Very high	51 Å²	51	21 Å²	21	24%	0.238	11%	0.108	C	C	.	.			trans	-98.3	-23.7	164.8	177.3	173.3	-11.3	0	0	112	F760 S815 D834 G835 R836	F760-Q820 HydrophobicContact CZ-CB 4.05Å; F760-Q820 HydrophobicContact CZ-CG 4.31Å; S815-Q820 PolarHBondContact OG-N 3Å; Q820-D834 VanDerWaalsContact NE2-CG 3.32Å; Q820-D834 PolarHBondContact NE2-OD1 3.31Å; Q820-D834 PolarHBondContact NE2-OD2 3.5Å; Q820-G835 WeakPolarHBondContact O-CA 3.32Å; Q820-G835 PolarHBondContact O-N 2.97Å; Q820-R836 HydrophobicContact CG-CB 4.01Å
821	Y	93.9	Very high	91.7	Very high	30 Å²	30	21 Å²	21	12%	0.118	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	146.5	-166.2	-60.7	-74.6	0	0	0	112.4	P479 V480 S815 I832 L833	P479-Y821 HydrophobicContact CB-CD1 4.4Å; P479-Y821 HydrophobicContact CB-CD2 3.68Å; P479-Y821 HydrophobicContact CB-CE2 4.34Å; P479-Y821 HydrophobicContact CB-CG 3.7Å; P479-Y821 HydrophobicContact CG-CD2 3.81Å; P479-Y821 HydrophobicContact CG-CE2 4.4Å; P479-Y821 HydrophobicContact CG-CG 4.31Å; V480-Y821 HydrophobicContact CG2-CE2 3.78Å; S815-Y821 WeakPolarHBondContact CB-O 3.44Å; S815-Y821 PolarHBondContact N-O 3.25Å; S815-Y821 WeakPolarHBondContact OG-CA 3.38Å; S815-Y821 PolarHBondContact OG-N 3.29Å; S815-Y821 PolarHBondContact OG-O 2.69Å; Y821-I832 HydrophobicContact CD1-CG2 3.71Å; Y821-I832 HydrophobicContact CG-CG2 4.13Å; Y821-L833 VanDerWaalsContact CA-O 3.29Å; Y821-L833 WeakPolarHBondContact CA-O 3.38Å
822	I	95.8	Very high	91.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	129.4	177.1	-54.1	172.9	0	0	0	108	A755 Q757 F769 M812 V813 L833	A755-I822 HydrophobicContact CB-CG2 4.11Å; Q757-I822 HydrophobicContact CB-CD1 3.81Å; Q757-I822 HydrophobicContact CG-CD1 4.03Å; F769-I822 HydrophobicContact CB-CD1 3.96Å; F769-I822 HydrophobicContact CD1-CD1 3.91Å; F769-I822 HydrophobicContact CD2-CD1 3.09Å; F769-I822 HydrophobicContact CE1-CD1 4.13Å; F769-I822 HydrophobicContact CE2-CD1 3.37Å; F769-I822 HydrophobicContact CG-CD1 3.39Å; F769-I822 HydrophobicContact CZ-CD1 3.89Å; M812-I822 HydrophobicContact CG-CG2 3.46Å; M812-I822 VanDerWaalsContact CG-CG2 3.46Å; M812-I822 HydrophobicContact SD-CG2 4Å; V813-I822 CarbonylContact O-C 3.59Å; V813-I822 WeakPolarHBondContact O-CA 2.98Å; I822-L833 HydrophobicContact CB-CB 4.32Å; I822-L833 PolarHBondContact N-O 2.8Å; I822-L833 PolarHBondContact O-N 2.75Å
823	M	95.8	Very high	91.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	135.3	-175.9	-168	168.4	-160.6	0	0	111.1	F466 V468 I477 M812 V813 L830 F831 V853	F466-M823 HydrophobicContact CB-SD 3.43Å; F466-M823 WeakPolarHBondContact CB-SD 3.48Å; F466-M823 HydrophobicContact CD1-CB 3.84Å; F466-M823 HydrophobicContact CD1-CG 4.47Å; F466-M823 HydrophobicContact CD1-SD 3.77Å; F466-M823 HydrophobicContact CD2-CB 4.32Å; F466-M823 HydrophobicContact CD2-SD 4Å; F466-M823 HydrophobicContact CE1-CB 3.64Å; F466-M823 HydrophobicContact CE2-CB 4.15Å; F466-M823 HydrophobicContact CG-CB 4.18Å; F466-M823 HydrophobicContact CG-SD 3.47Å; F466-M823 WeakPolarHBondContact CG-SD 3.38Å; F466-M823 HydrophobicContact CZ-CB 3.81Å; V468-M823 HydrophobicContact CG2-CE 3.54Å; V468-M823 HydrophobicContact CG2-SD 3.93Å; I477-M823 HydrophobicContact CG1-CE 4.23Å; I477-M823 HydrophobicContact CG2-CE 4.37Å; M812-M823 WeakPolarHBondContact CA-O 3.47Å; V813-M823 PolarHBondContact N-O 3.04Å; V813-M823 PolarHBondContact O-N 2.85Å; M823-L830 HydrophobicContact CE-CB 3.7Å; M823-L830 HydrophobicContact CE-CD1 3.61Å; M823-L830 HydrophobicContact CE-CD2 4.29Å; M823-L830 HydrophobicContact CE-CG 4.05Å; M823-F831 WeakPolarHBondContact CA-O 3.49Å; M823-V853 HydrophobicContact CB-CG1 4.3Å; M823-V853 HydrophobicContact CG-CG1 4.16Å; M823-V853 HydrophobicContact SD-CG1 3.67Å
824	T	95.5	Very high	91.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	131	169.2	-174.1	0	0	0	0	110.4	L794 R810 V811 M812 F831	L794-T824 HydrophobicContact CD1-CG2 4.43Å; R810-T824 WeakPolarHBondContact CG-OG1 3.48Å; R810-T824 PolarHBondContact NE-OG1 3.35Å; V811-T824 WeakPolarHBondContact O-CB 3.49Å; V811-T824 PolarHBondContact O-OG1 2.98Å; M812-T824 HydrophobicContact CE-CG2 4.18Å; T824-F831 HydrophobicContact CG2-CB 4.19Å; T824-F831 PolarHBondContact N-O 3.46Å; T824-F831 PolarHBondContact O-N 3.35Å
825	P	94.3	Very high	91.7	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	174.6	176.8	34.1	-34.6	0	0	0	111.4	R810 V811 L830 G850 N851	R810-P825 PolarHBondContact NE-O 2.97Å; R810-P825 VanDerWaalsContact NE-O 3.07Å; R810-P825 PolarHBondContact NH2-O 2.92Å; V811-P825 HydrophobicContact CG2-CG 3.83Å; V811-P825 VanDerWaalsContact O-CD 3.32Å; V811-P825 WeakPolarHBondContact O-CD 3.39Å; P825-L830 HydrophobicContact CB-CD2 3.88Å; P825-G850 VanDerWaalsContact CB-O 3.25Å; P825-G850 WeakPolarHBondContact CB-O 3.17Å; P825-N851 VanDerWaalsContact CG-OD1 3.3Å; P825-N851 WeakPolarHBondContact CG-OD1 3.4Å
826	S	92.4	Very high	91.6	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.014	10%	0.096	C	C	.	.			trans	-135.8	-172.9	164.9	70.8	0	0	0	0	107.3	E796 E828 S829	E796-S826 VanDerWaalsContact O-CB 3.3Å; E796-S826 WeakPolarHBondContact O-CB 3.16Å; S826-E828 VanDerWaalsContact C-N 3.25Å; S826-E828 PolarHBondContact O-N 3.14Å; S826-E828 PolarHBondContact OG-N 3.44Å; S826-S829 WeakPolarHBondContact CB-O 3.18Å; S826-S829 PolarHBondContact N-O 3.38Å; S826-S829 PolarHBondContact OG-N 2.93Å; S826-S829 PolarHBondContact OG-O 2.74Å
827	R	89.6	Confident	91.8	Very high	107 Å²	107	23.8 Å²	23.8	40%	0.404	11%	0.107	S	C	.	.	S	Bend	trans	-56.7	-36.3	174.9	-167.1	-180	-177.2	-130.3	6.9	113.9	E796 K849	E796-R827 PolarHBondContact O-N 2.8Å; R827-K849 PolarHBondContact O-N 3.1Å; R827-K849 VanDerWaalsContact O-N 3.11Å
828	E	89.6	Confident	92.1	Very high	84 Å²	84	24 Å²	24	39%	0.393	11%	0.109	S	C	.	.	S	Bend	trans	-133.2	-8.5	-163.8	-64.7	166.7	-165.3	0	0	114.3	S826 D846 V847 L848	S826-E828 VanDerWaalsContact C-N 3.25Å; S826-E828 PolarHBondContact O-N 3.14Å; S826-E828 PolarHBondContact OG-N 3.44Å; E828-D846 PolarHBondContact O-N 2.86Å; E828-V847 CarbonylContact C-O 3.53Å; E828-V847 PolarHBondContact O-N 2.93Å; E828-L848 HydrophobicContact CB-CD2 4.21Å; E828-L848 HydrophobicContact CG-CD2 3.85Å
829	S	92.8	Very high	92.6	Very high	3 Å²	3	27.5 Å²	27.5	2%	0.021	12%	0.123	C	C	.	.			trans	-153.8	157.5	-170.8	-45.6	0	0	0	0	111.4	K795 S826 E843 I844	K795-S829 PolarHBondContact NZ-OG 3.2Å; S826-S829 WeakPolarHBondContact CB-O 3.18Å; S826-S829 PolarHBondContact N-O 3.38Å; S826-S829 PolarHBondContact OG-N 2.93Å; S826-S829 PolarHBondContact OG-O 2.74Å; S829-E843 PolarHBondContact OG-OE1 3.06Å; S829-I844 CarbonylContact C-O 3.45Å; S829-I844 VanDerWaalsContact CA-O 3.29Å; S829-I844 WeakPolarHBondContact CA-O 3.36Å; S829-I844 WeakPolarHBondContact CB-O 3.37Å
830	L	94.6	Very high	93	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	140.9	179.4	-50.6	166.9	0	0	0	109.7	V468 I477 M823 P825 E843 I844 V847	V468-L830 HydrophobicContact CB-CD1 4.44Å; V468-L830 HydrophobicContact CG1-CD1 4.13Å; V468-L830 HydrophobicContact CG1-CD2 3.98Å; V468-L830 HydrophobicContact CG2-CD1 4.06Å; I477-L830 HydrophobicContact CD1-CD1 4.49Å; I477-L830 HydrophobicContact CG1-CD1 4.42Å; M823-L830 HydrophobicContact CE-CB 3.7Å; M823-L830 HydrophobicContact CE-CD1 3.61Å; M823-L830 HydrophobicContact CE-CD2 4.29Å; M823-L830 HydrophobicContact CE-CG 4.05Å; P825-L830 HydrophobicContact CB-CD2 3.88Å; L830-E843 CarbonylContact O-C 3.57Å; L830-E843 WeakPolarHBondContact O-CA 3.27Å; L830-I844 HydrophobicContact CB-CB 4.3Å; L830-I844 PolarHBondContact N-O 3.22Å; L830-I844 PolarHBondContact O-N 3.46Å; L830-V847 HydrophobicContact CD1-CB 3.89Å; L830-V847 HydrophobicContact CD1-CG1 4.01Å; L830-V847 HydrophobicContact CD1-CG2 3.59Å; L830-V847 HydrophobicContact CD2-CB 4.2Å; L830-V847 HydrophobicContact CD2-CG1 4.14Å; L830-V847 HydrophobicContact CG-CB 3.85Å; L830-V847 HydrophobicContact CG-CG1 4.2Å; L830-V847 HydrophobicContact CG-CG2 3.99Å
831	F	95.6	Very high	93.3	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	130.5	179.6	-64.4	-90.1	0	0	0	110.3	S793 L794 K795 M823 T824 L840 E843	S793-F831 WeakPolarHBondContact O-CE1 3.45Å; L794-F831 VanDerWaalsContact C-CE2 3.45Å; L794-F831 VanDerWaalsContact C-CZ 3.48Å; L794-F831 HydrophobicContact CB-CD1 4.46Å; L794-F831 HydrophobicContact CB-CD2 4.33Å; L794-F831 HydrophobicContact CB-CG 4.28Å; L794-F831 HydrophobicContact CD2-CB 3.91Å; L794-F831 HydrophobicContact CD2-CD1 3.68Å; L794-F831 HydrophobicContact CD2-CE1 4.43Å; L794-F831 HydrophobicContact CD2-CG 3.81Å; L794-F831 WeakPolarHBondContact O-CD2 3.35Å; L794-F831 WeakPolarHBondContact O-CE2 3.33Å; K795-F831 HydrophobicContact CB-CE2 4.13Å; K795-F831 HydrophobicContact CB-CZ 4.04Å; K795-F831 HydrophobicContact CD-CE2 4.49Å; K795-F831 HydrophobicContact CD-CZ 4Å; K795-F831 HydrophobicContact CG-CE2 4.39Å; K795-F831 HydrophobicContact CG-CZ 3.83Å; M823-F831 WeakPolarHBondContact CA-O 3.49Å; T824-F831 HydrophobicContact CG2-CB 4.19Å; T824-F831 PolarHBondContact N-O 3.46Å; T824-F831 PolarHBondContact O-N 3.35Å; F831-L840 HydrophobicContact CB-CD1 4.13Å; F831-L840 HydrophobicContact CD1-CD1 3.77Å; F831-L840 HydrophobicContact CD1-CD2 4.29Å; F831-L840 HydrophobicContact CG-CD1 4.45Å; F831-E843 HydrophobicContact CD1-CB 4.05Å; F831-E843 HydrophobicContact CD1-CG 4.13Å; F831-E843 HydrophobicContact CE1-CB 3.73Å; F831-E843 HydrophobicContact CE1-CG 3.53Å; F831-E843 VanDerWaalsContact CE1-OE2 3.24Å; F831-E843 WeakPolarHBondContact CE1-OE2 3.24Å; F831-E843 HydrophobicContact CE2-CG 4.42Å; F831-E843 HydrophobicContact CZ-CB 4.39Å; F831-E843 HydrophobicContact CZ-CG 3.68Å; F831-E843 WeakPolarHBondContact CZ-OE2 3.42Å
832	I	95.8	Very high	93.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	120.8	173.5	-64	156.8	0	0	0	107.5	I477 P479 Y821 N841 C842 I844	I477-I832 HydrophobicContact CG2-CD1 3.99Å; P479-I832 HydrophobicContact CB-CD1 4.48Å; P479-I832 HydrophobicContact CB-CG2 4.21Å; Y821-I832 HydrophobicContact CD1-CG2 3.71Å; Y821-I832 HydrophobicContact CG-CG2 4.13Å; I832-N841 HydrophobicContact CG2-CB 4.3Å; I832-N841 WeakPolarHBondContact O-CA 3.42Å; I832-N841 WeakPolarHBondContact O-CB 3.43Å; I832-N841 PolarHBondContact O-N 3.22Å; I832-C842 PolarHBondContact N-O 3.41Å; I832-C842 PolarHBondContact O-N 2.97Å; I832-I844 HydrophobicContact CD1-CD1 3.74Å
833	L	95.9	Very high	93.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	141.1	174.5	-49	-175.6	0	0	0	109.3	F769 I791 L794 M812 Y821 I822 K839 L840	F769-L833 HydrophobicContact CD1-CD1 3.89Å; F769-L833 HydrophobicContact CE1-CD1 4.4Å; I791-L833 HydrophobicContact CD1-CD1 4.15Å; I791-L833 HydrophobicContact CG2-CD2 4Å; L794-L833 HydrophobicContact CD2-CD2 4.01Å; M812-L833 HydrophobicContact CE-CD1 4.04Å; Y821-L833 VanDerWaalsContact CA-O 3.29Å; Y821-L833 WeakPolarHBondContact CA-O 3.38Å; I822-L833 HydrophobicContact CB-CB 4.32Å; I822-L833 PolarHBondContact N-O 2.8Å; I822-L833 PolarHBondContact O-N 2.75Å; L833-K839 CarbonylContact C-O 3.6Å; L833-K839 WeakPolarHBondContact CA-O 3.33Å; L833-L840 HydrophobicContact CD2-CB 4.37Å; L833-L840 HydrophobicContact CD2-CD1 4.01Å
834	D	93.6	Very high	93.2	Very high	6 Å²	6	33.7 Å²	33.7	3%	0.032	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	113.5	169.4	-177	-22.5	0	0	0	108.7	Q820 R836 L837 N838 K839 N841	Q820-D834 VanDerWaalsContact NE2-CG 3.32Å; Q820-D834 PolarHBondContact NE2-OD1 3.31Å; Q820-D834 PolarHBondContact NE2-OD2 3.5Å; D834-R836 WeakPolarHBondContact OD1-CA 3.45Å; D834-R836 WeakPolarHBondContact OD1-CB 3.4Å; D834-R836 PolarHBondContact OD1-N 2.71Å; D834-L837 HydrophobicContact CB-CB 4.22Å; D834-L837 PolarHBondContact OD1-N 3.05Å; D834-L837 VanDerWaalsContact OD2-CD1 3.3Å; D834-L837 WeakPolarHBondContact OD2-CD1 3.46Å; D834-L837 WeakPolarHBondContact OD2-CG 3.25Å; D834-N838 VanDerWaalsContact O-CA 3.25Å; D834-N838 WeakPolarHBondContact O-CA 3.45Å; D834-N838 PolarHBondContact O-N 2.79Å; D834-K839 HydrophobicContact CB-CG 4.39Å; D834-K839 PolarHBondContact N-O 2.89Å; D834-K839 PolarHBondContact O-N 3.31Å; D834-N841 HydrophobicContact CB-CB 4.23Å
835	G	90.8	Very high	93	Very high	1 Å²	1	37 Å²	37	1%	0.01	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-8.7	179.5	0	0	0	0	0	115.2	F760 Q820 N838	F760-G835 VanDerWaalsContact CD2-O 3.29Å; F760-G835 WeakPolarHBondContact CD2-O 3.2Å; Q820-G835 WeakPolarHBondContact O-CA 3.32Å; Q820-G835 PolarHBondContact O-N 2.97Å; G835-N838 PolarHBondContact O-OD1 3.27Å; G835-N838 VanDerWaalsContact O-OD1 3.08Å
836	R	88.5	Confident	92.4	Very high	74 Å²	74	42.8 Å²	42.8	28%	0.279	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-32.5	168.5	-173.9	177.3	-175.6	125	3.4	111.1	E409 F760 Q820 D834	E409-R836 VanDerWaalsContact CD-NH1 3.33Å; E409-R836 IonicContact OE1-CZ 2.88Å; E409-R836 IonicContact OE1-NH1 3.71Å; E409-R836 PolarHBondContact OE1-NH1 3.12Å; E409-R836 VanDerWaalsContact OE1-NH1 3.09Å; E409-R836 IonicContact OE1-NH2 3.39Å; E409-R836 PolarHBondContact OE1-NH2 3.21Å; E409-R836 IonicContact OE2-CZ 3.72Å; E409-R836 IonicContact OE2-NH1 3.25Å; E409-R836 PolarHBondContact OE2-NH1 2.83Å; E409-R836 IonicContact OE2-NH2 3.03Å; E409-R836 PolarHBondContact OE2-NH2 3.21Å; F760-R836 HydrophobicContact CB-CB 4.4Å; F760-R836 HydrophobicContact CB-CG 4.04Å; F760-R836 HydrophobicContact CD1-CB 4.09Å; F760-R836 HydrophobicContact CD1-CG 3.99Å; F760-R836 HydrophobicContact CD2-CB 4.01Å; F760-R836 HydrophobicContact CE1-CB 4.39Å; F760-R836 HydrophobicContact CE2-CB 4.32Å; F760-R836 HydrophobicContact CG-CB 3.9Å; F760-R836 HydrophobicContact CG-CG 3.93Å; Q820-R836 HydrophobicContact CG-CB 4.01Å; D834-R836 WeakPolarHBondContact OD1-CA 3.45Å; D834-R836 WeakPolarHBondContact OD1-CB 3.4Å; D834-R836 PolarHBondContact OD1-N 2.71Å
837	L	90.8	Very high	92.1	Very high	93 Å²	93	42.7 Å²	42.7	49%	0.487	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-2.6	178.7	-59.9	-176.2	0	0	0	114	D834 K839	D834-L837 HydrophobicContact CB-CB 4.22Å; D834-L837 PolarHBondContact OD1-N 3.05Å; D834-L837 VanDerWaalsContact OD2-CD1 3.3Å; D834-L837 WeakPolarHBondContact OD2-CD1 3.46Å; D834-L837 WeakPolarHBondContact OD2-CG 3.25Å; L837-K839 VanDerWaalsContact C-N 3.32Å; L837-K839 HydrophobicContact CB-CD 3.99Å; L837-K839 HydrophobicContact CB-CG 3.82Å; L837-K839 HydrophobicContact CD1-CD 4.43Å; L837-K839 PolarHBondContact O-N 2.96Å
838	N	90.8	Very high	91.9	Very high	31 Å²	31	42.4 Å²	42.4	17%	0.166	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	48.8	180	-60.4	-35.7	0	0	0	112.8	F769 F780 K789 D834 G835	F769-N838 WeakPolarHBondContact CZ-OD1 3.19Å; F780-N838 HydrophobicContact CD1-CB 4.44Å; F780-N838 HydrophobicContact CD2-CB 4.29Å; F780-N838 HydrophobicContact CE1-CB 4.41Å; F780-N838 HydrophobicContact CE2-CB 4.23Å; F780-N838 VanDerWaalsContact CE2-CG 3.44Å; F780-N838 WeakPolarHBondContact CE2-OD1 3.08Å; F780-N838 HydrophobicContact CG-CB 4.37Å; F780-N838 HydrophobicContact CZ-CB 4.3Å; F780-N838 VanDerWaalsContact CZ-CG 3.47Å; F780-N838 VanDerWaalsContact CZ-ND2 3.33Å; F780-N838 WeakPolarHBondContact CZ-ND2 3.07Å; K789-N838 HydrophobicContact CD-CB 4.47Å; K789-N838 WeakPolarHBondContact CE-O 3.44Å; K789-N838 PolarHBondContact NZ-O 3.44Å; D834-N838 VanDerWaalsContact O-CA 3.25Å; D834-N838 WeakPolarHBondContact O-CA 3.45Å; D834-N838 PolarHBondContact O-N 2.79Å; G835-N838 PolarHBondContact O-OD1 3.27Å; G835-N838 VanDerWaalsContact O-OD1 3.08Å
839	K	93.9	Very high	91.5	Very high	92 Å²	92	41 Å²	41	40%	0.4	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	168.7	-173.6	66.7	171.1	-167.1	179.6	0	111.8	L833 D834 L837 N841	L833-K839 CarbonylContact C-O 3.6Å; L833-K839 WeakPolarHBondContact CA-O 3.33Å; D834-K839 HydrophobicContact CB-CG 4.39Å; D834-K839 PolarHBondContact N-O 2.89Å; D834-K839 PolarHBondContact O-N 3.31Å; L837-K839 VanDerWaalsContact C-N 3.32Å; L837-K839 HydrophobicContact CB-CD 3.99Å; L837-K839 HydrophobicContact CB-CG 3.82Å; L837-K839 HydrophobicContact CD1-CD 4.43Å; L837-K839 PolarHBondContact O-N 2.96Å; K839-N841 PolarHBondContact O-N 3.17Å
840	L	94.6	Very high	91	Very high	52 Å²	52	40.9 Å²	40.9	27%	0.272	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	129.1	162.2	178.3	59.4	0	0	0	109.9	I791 L794 F831 L833 C842	I791-L840 HydrophobicContact CG2-CB 4.28Å; L794-L840 HydrophobicContact CD2-CD1 3.97Å; L794-L840 HydrophobicContact CD2-CD2 4.36Å; F831-L840 HydrophobicContact CB-CD1 4.13Å; F831-L840 HydrophobicContact CD1-CD1 3.77Å; F831-L840 HydrophobicContact CD1-CD2 4.29Å; F831-L840 HydrophobicContact CG-CD1 4.45Å; L833-L840 HydrophobicContact CD2-CB 4.37Å; L833-L840 HydrophobicContact CD2-CD1 4.01Å; L840-C842 WeakPolarHBondContact CD1-O 3.33Å
841	N	95.1	Very high	90.7	Very high	56 Å²	56	41.1 Å²	41.1	30%	0.299	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-53.9	170.1	-165.9	43.7	0	0	0	110	C482 I832 D834 K839	C482-N841 PolarHBondContact SG-ND2 3.5Å; I832-N841 HydrophobicContact CG2-CB 4.3Å; I832-N841 WeakPolarHBondContact O-CA 3.42Å; I832-N841 WeakPolarHBondContact O-CB 3.43Å; I832-N841 PolarHBondContact O-N 3.22Å; D834-N841 HydrophobicContact CB-CB 4.23Å; K839-N841 PolarHBondContact O-N 3.17Å
842	C	94.8	Very high	90.6	Very high	20 Å²	20	41.6 Å²	41.6	14%	0.135	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	160.7	-173.7	53.5	0	0	0	0	113	C482 I832 L840	C482-C842 HydrophobicContact CB-CB 3.65Å; C482-C842 WeakPolarHBondContact CB-SG 3.27Å; C482-C842 WeakPolarHBondContact SG-CB 3.48Å; C482-C842 CovalentContact SG-SG 2.02Å; C482-C842 PolarHBondContact SG-SG 2.89Å; I832-C842 PolarHBondContact N-O 3.41Å; I832-C842 PolarHBondContact O-N 2.97Å; L840-C842 WeakPolarHBondContact CD1-O 3.33Å
843	E	95.2	Very high	90.6	Very high	75 Å²	75	42.3 Å²	42.3	35%	0.35	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	140.7	169.8	-177.5	-174.2	133.4	0	0	109.3	K795 S829 L830 F831	K795-E843 WeakPolarHBondContact CE-OE1 3.28Å; K795-E843 WeakPolarHBondContact CE-OE2 3.15Å; K795-E843 IonicContact NZ-OE1 2.68Å; K795-E843 PolarHBondContact NZ-OE1 3.32Å; K795-E843 IonicContact NZ-OE2 3.58Å; S829-E843 PolarHBondContact OG-OE1 3.06Å; L830-E843 CarbonylContact O-C 3.57Å; L830-E843 WeakPolarHBondContact O-CA 3.27Å; F831-E843 HydrophobicContact CD1-CB 4.05Å; F831-E843 HydrophobicContact CD1-CG 4.13Å; F831-E843 HydrophobicContact CE1-CB 3.73Å; F831-E843 HydrophobicContact CE1-CG 3.53Å; F831-E843 VanDerWaalsContact CE1-OE2 3.24Å; F831-E843 WeakPolarHBondContact CE1-OE2 3.24Å; F831-E843 HydrophobicContact CE2-CG 4.42Å; F831-E843 HydrophobicContact CZ-CB 4.39Å; F831-E843 HydrophobicContact CZ-CG 3.68Å; F831-E843 WeakPolarHBondContact CZ-OE2 3.42Å
844	I	93.5	Very high	90.5	Very high	11 Å²	11	42.7 Å²	42.7	6%	0.056	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	118	170.9	-59.7	173.1	0	0	0	107.6	I477 C482 I484 S829 L830 I832	I477-I844 HydrophobicContact CD1-CD1 4.26Å; I477-I844 HydrophobicContact CG2-CD1 3.38Å; C482-I844 WeakPolarHBondContact O-CD1 3.28Å; C482-I844 WeakPolarHBondContact O-CG1 3.49Å; I484-I844 HydrophobicContact CD1-CG2 4.26Å; I484-I844 HydrophobicContact CG1-CG2 4.22Å; S829-I844 CarbonylContact C-O 3.45Å; S829-I844 VanDerWaalsContact CA-O 3.29Å; S829-I844 WeakPolarHBondContact CA-O 3.36Å; S829-I844 WeakPolarHBondContact CB-O 3.37Å; L830-I844 HydrophobicContact CB-CB 4.3Å; L830-I844 PolarHBondContact N-O 3.22Å; L830-I844 PolarHBondContact O-N 3.46Å; I832-I844 HydrophobicContact CD1-CD1 3.74Å
845	T	91.3	Very high	90.5	Very high	70 Å²	70	43.4 Å²	43.4	43%	0.429	22%	0.22	S	C	.	.			trans	-79.9	174.5	-176.8	58.1	0	0	0	0	112.4	V847	T845-V847 VanDerWaalsContact C-N 3.34Å; T845-V847 PolarHBondContact O-N 3.19Å
846	D	81.4	Confident	90.6	Very high	122 Å²	122	43.4 Å²	43.4	65%	0.652	22%	0.219	S	C	*	.			trans	60.2	39.9	166.9	-48.2	-67.1	0	0	0	114	K475 E828	K475-D846 PolarHBondContact NZ-O 3.13Å; E828-D846 PolarHBondContact O-N 2.86Å
847	V	85.3	Confident	90.2	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.			trans	-127.1	77.8	169.4	-165.8	0	0	0	0	109.2	V468 Y470 K475 E828 L830 T845 K849	V468-V847 HydrophobicContact CG1-CG1 4.19Å; Y470-V847 HydrophobicContact CD1-CG1 4.05Å; Y470-V847 HydrophobicContact CD2-CG1 3.86Å; Y470-V847 HydrophobicContact CE2-CG1 4.41Å; Y470-V847 HydrophobicContact CG-CG1 3.68Å; K475-V847 HydrophobicContact CD-CG2 3.69Å; E828-V847 CarbonylContact C-O 3.53Å; E828-V847 PolarHBondContact O-N 2.93Å; L830-V847 HydrophobicContact CD1-CB 3.89Å; L830-V847 HydrophobicContact CD1-CG1 4.01Å; L830-V847 HydrophobicContact CD1-CG2 3.59Å; L830-V847 HydrophobicContact CD2-CB 4.2Å; L830-V847 HydrophobicContact CD2-CG1 4.14Å; L830-V847 HydrophobicContact CG-CB 3.85Å; L830-V847 HydrophobicContact CG-CG1 4.2Å; L830-V847 HydrophobicContact CG-CG2 3.99Å; T845-V847 VanDerWaalsContact C-N 3.34Å; T845-V847 PolarHBondContact O-N 3.19Å; V847-K849 PolarHBondContact O-N 3.17Å
848	L	85.6	Confident	88.9	Confident	100 Å²	100	39.7 Å²	39.7	52%	0.524	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	125.1	173.6	-59.4	175.8	0	0	0	109.8	E828 G850	E828-L848 HydrophobicContact CB-CD2 4.21Å; E828-L848 HydrophobicContact CG-CD2 3.85Å; L848-G850 PolarHBondContact O-N 3.28Å
849	K	82.7	Confident	86.7	Confident	56 Å²	56	41.8 Å²	41.8	24%	0.243	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	39.2	174.7	-63.8	167.6	168.8	-174.6	0	116.6	E471 I798 W803 R827 V847 N851	E471-K849 VanDerWaalsContact CD-CD 3.45Å; E471-K849 HydrophobicContact CG-CB 4.39Å; E471-K849 HydrophobicContact CG-CD 3.98Å; E471-K849 WeakPolarHBondContact OE1-CD 3.4Å; E471-K849 WeakPolarHBondContact OE1-CE 3.38Å; E471-K849 IonicContact OE1-NZ 3.16Å; E471-K849 PolarHBondContact OE1-NZ 2.68Å; I798-K849 HydrophobicContact CD1-CB 4.11Å; I798-K849 HydrophobicContact CD1-CG 4.12Å; W803-K849 HydrophobicContact CE3-CB 4.42Å; W803-K849 HydrophobicContact CZ3-CB 4.19Å; R827-K849 PolarHBondContact O-N 3.1Å; R827-K849 VanDerWaalsContact O-N 3.11Å; V847-K849 PolarHBondContact O-N 3.17Å; K849-N851 PolarHBondContact O-N 3.23Å
850	G	82	Confident	86.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.214	C	C	.	.			trans	-72.8	50.7	172.9	0	0	0	0	0	115.3	P825 L848 V852	P825-G850 VanDerWaalsContact CB-O 3.25Å; P825-G850 WeakPolarHBondContact CB-O 3.17Å; L848-G850 PolarHBondContact O-N 3.28Å; G850-V852 VanDerWaalsContact C-N 3.35Å; G850-V852 PolarHBondContact O-N 3.16Å
851	N	86.9	Confident	86	Confident	4 Å²	4	38.6 Å²	38.6	2%	0.021	21%	0.211	C	C	.	.			trans	-83	-2.7	-170.4	-113.6	17.8	0	0	0	115.5	I798 W803 N809 V811 P825 K849	I798-N851 HydrophobicContact CD1-CB 3.96Å; I798-N851 WeakPolarHBondContact CD1-OD1 3.47Å; W803-N851 HydrophobicContact CD2-CB 3.9Å; W803-N851 HydrophobicContact CE3-CB 4.5Å; W803-N851 HydrophobicContact CG-CB 4.19Å; W803-N851 HydrophobicContact CZ2-CB 4.06Å; N809-N851 PolarHBondContact O-ND2 3.17Å; N809-N851 PolarHBondContact O-OD1 3.01Å; V811-N851 WeakPolarHBondContact CG2-O 3.41Å; P825-N851 VanDerWaalsContact CG-OD1 3.3Å; P825-N851 WeakPolarHBondContact CG-OD1 3.4Å; K849-N851 PolarHBondContact O-N 3.23Å
852	V	94.1	Very high	85.5	Confident	10 Å²	10	37.6 Å²	37.6	6%	0.061	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	118.1	172.3	174.2	0	0	0	0	108	F469 W515 S516 A518 W803 G850	F469-V852 HydrophobicContact CB-CB 4.11Å; F469-V852 HydrophobicContact CB-CG1 4.19Å; F469-V852 HydrophobicContact CD2-CG1 3.9Å; F469-V852 HydrophobicContact CG-CG1 4.3Å; F469-V852 PolarHBondContact N-O 2.98Å; W515-V852 HydrophobicContact CB-CG2 4.28Å; S516-V852 WeakPolarHBondContact O-CG2 3.47Å; A518-V852 HydrophobicContact CB-CG1 3.59Å; W803-V852 HydrophobicContact CZ2-CG2 3.97Å; G850-V852 VanDerWaalsContact C-N 3.35Å; G850-V852 PolarHBondContact O-N 3.16Å
853	V	95.2	Very high	84.9	Confident	15 Å²	15	38.6 Å²	38.6	9%	0.091	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	137.1	-173.6	179.5	0	0	0	0	109	F466 Y467 V468 V811 V813 M823	F466-V853 HydrophobicContact CD1-CG1 3.98Å; Y467-V853 CarbonylContact O-C 3.58Å; Y467-V853 WeakPolarHBondContact O-CA 3.22Å; V468-V853 HydrophobicContact CG1-CG2 4.34Å; V468-V853 HydrophobicContact CG2-CG2 4.33Å; V811-V853 HydrophobicContact CG2-CG2 4.29Å; V813-V853 HydrophobicContact CB-CG1 4.15Å; V813-V853 HydrophobicContact CG2-CB 3.97Å; V813-V853 HydrophobicContact CG2-CG1 4.04Å; M823-V853 HydrophobicContact CB-CG1 4.3Å; M823-V853 HydrophobicContact CG-CG1 4.16Å; M823-V853 HydrophobicContact SD-CG1 3.67Å
854	V	95.2	Very high	84.3	Confident	9 Å²	9	36.4 Å²	36.4	6%	0.055	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	140	177.2	174.4	0	0	0	0	109.7	F466 Y467 F469 A518 N520 I526 V856	F466-V854 WeakPolarHBondContact CA-O 3.45Å; Y467-V854 PolarHBondContact N-O 3.03Å; Y467-V854 PolarHBondContact O-N 2.69Å; F469-V854 HydrophobicContact CE2-CB 4.48Å; F469-V854 HydrophobicContact CE2-CG2 4.25Å; A518-V854 HydrophobicContact CB-CG2 3.37Å; N520-V854 HydrophobicContact CB-CG1 3.75Å; I526-V854 HydrophobicContact CG2-CB 4.46Å; I526-V854 HydrophobicContact CG2-CG1 4.25Å; I526-V854 HydrophobicContact CG2-CG2 4.23Å; V854-V856 HydrophobicContact CG1-CG2 4.43Å
855	W	94.2	Very high	83.6	Confident	21 Å²	21	38.1 Å²	38.1	8%	0.08	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	139.3	166.6	176.1	-106.8	0	0	0	111.5	N464 F466 P479 N520 V813 S815 G857	N464-W855 VanDerWaalsContact C-CZ3 3.49Å; N464-W855 HydrophobicContact CB-CH2 3.72Å; N464-W855 HydrophobicContact CB-CZ2 3.76Å; N464-W855 WeakPolarHBondContact O-CH2 3.26Å; N464-W855 WeakPolarHBondContact OD1-CZ2 3.16Å; F466-W855 HydrophobicContact CD1-CB 4.36Å; F466-W855 AromaticContact CD1-CE3 3.78Å; F466-W855 HydrophobicContact CD1-CE3 3.78Å; F466-W855 AromaticContact CD2-CE3 3.79Å; F466-W855 HydrophobicContact CD2-CE3 3.79Å; F466-W855 AromaticContact CD2-CZ3 3.72Å; F466-W855 HydrophobicContact CD2-CZ3 3.72Å; F466-W855 HydrophobicContact CE1-CB 4.2Å; F466-W855 HydrophobicContact CE1-CD2 4.45Å; F466-W855 AromaticContact CE1-CE3 3.71Å; F466-W855 HydrophobicContact CE1-CE3 3.71Å; F466-W855 HydrophobicContact CE1-CZ3 4.46Å; F466-W855 AromaticContact CE2-CE3 3.73Å; F466-W855 HydrophobicContact CE2-CE3 3.73Å; F466-W855 AromaticContact CE2-CZ3 3.63Å; F466-W855 HydrophobicContact CE2-CZ3 3.63Å; F466-W855 AromaticContact CG-CE3 3.81Å; F466-W855 HydrophobicContact CG-CE3 3.81Å; F466-W855 HydrophobicContact CG-CZ3 4.19Å; F466-W855 AromaticContact CZ-CE3 3.69Å; F466-W855 HydrophobicContact CZ-CE3 3.69Å; F466-W855 HydrophobicContact CZ-CZ3 4.02Å; P479-W855 HydrophobicContact CG-CH2 4.29Å; P479-W855 HydrophobicContact CG-CZ3 4.04Å; N520-W855 PolarHBondContact ND2-O 2.68Å; V813-W855 HydrophobicContact CG1-CB 4.31Å; S815-W855 VanDerWaalsContact C-CD1 3.46Å; S815-W855 VanDerWaalsContact C-CE2 3.42Å; S815-W855 VanDerWaalsContact C-NE1 3.26Å; S815-W855 VanDerWaalsContact CA-CD2 3.41Å; S815-W855 VanDerWaalsContact CB-CE2 3.47Å; S815-W855 VanDerWaalsContact CB-CZ3 3.49Å; S815-W855 VanDerWaalsContact O-CE2 3.24Å; S815-W855 WeakPolarHBondContact O-CZ2 3.25Å; S815-W855 PolarHBondContact O-NE1 2.98Å; S815-W855 VanDerWaalsContact O-NE1 3.09Å; W855-G857 PolarHBondContact NE1-O 3.2Å; W855-G857 VanDerWaalsContact NE1-O 3.17Å
856	V	91.1	Very high	83.1	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	127.6	171.6	168.5	0	0	0	0	108.5	N464 M465 Y467 I526 I541 V854	N464-V856 CarbonylContact C-O 3.55Å; N464-V856 WeakPolarHBondContact CA-O 3.42Å; N464-V856 PolarHBondContact N-O 2.89Å; M465-V856 PolarHBondContact N-O 3.4Å; M465-V856 PolarHBondContact O-N 3.09Å; Y467-V856 HydrophobicContact CD2-CB 4.07Å; Y467-V856 HydrophobicContact CD2-CG2 3.72Å; Y467-V856 HydrophobicContact CE2-CB 3.87Å; Y467-V856 HydrophobicContact CE2-CG1 4.28Å; Y467-V856 HydrophobicContact CE2-CG2 3.77Å; I526-V856 HydrophobicContact CD1-CG2 3.79Å; I526-V856 HydrophobicContact CG1-CG2 3.97Å; I541-V856 HydrophobicContact CD1-CB 4.28Å; I541-V856 HydrophobicContact CD1-CG1 3.66Å; I541-V856 HydrophobicContact CD1-CG2 3.57Å; I541-V856 HydrophobicContact CG1-CG1 4.16Å; I541-V856 HydrophobicContact CG1-CG2 4.16Å; I541-V856 HydrophobicContact CG2-CG1 3.66Å; V854-V856 HydrophobicContact CG1-CG2 4.43Å
857	G	80.4	Confident	83.2	Confident	2 Å²	2	29.2 Å²	29.2	2%	0.021	16%	0.16	C	C	.	.	S	Bend	trans	137.5	154.4	-166.9	0	0	0	0	0	110.4	D523 W855 S859	D523-G857 PolarHBondContact OD1-N 3.12Å; W855-G857 PolarHBondContact NE1-O 3.2Å; W855-G857 VanDerWaalsContact NE1-O 3.17Å; G857-S859 WeakPolarHBondContact O-CB 3.25Å; G857-S859 PolarHBondContact O-N 2.82Å
858	D	63	Low	83.1	Confident	86 Å²	86	31.6 Å²	31.6	46%	0.46	17%	0.174	S	C	.	.			trans	-48.4	117.9	-159.1	-49.9	-65.8	0	0	0	113.8	Y358	Y358-D858 WeakPolarHBondContact CE2-OD2 3.36Å
859	S	46.5	Very low	82.8	Confident	75 Å²	75	25.4 Å²	25.4	52%	0.524	14%	0.142	S	C	.	.			trans	-126.8	0	-157	69.2	0	0	0	0	117.2	D523 K563 G857	D523-S859 PolarHBondContact OD2-OG 3.16Å; K563-S859 VanDerWaalsContact NZ-C 3.26Å; K563-S859 PolarHBondContact NZ-O 3.35Å; K563-S859 PolarHBondContact NZ-OG 2.64Å; G857-S859 WeakPolarHBondContact O-CB 3.25Å; G857-S859 PolarHBondContact O-N 2.82Å

Retrieved 859 of 859 residues in 192.8 ms (Link to these results)

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