A0A087Y5X6_POEFO Loading...

Cadherin 11, type 2, OB-cadherin (osteoblast)

Cadherins are calcium-dependent cell adhesion proteins.

AlphaFold DB , UniProt , Accession A0A087Y5X6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 819 aa.

						>A0A087Y5X6_POEFO|A0A087Y5X6
MAVLIAKRQGFGLLRVLLVLLGVSVLCSVALGTRKGHATLDHRSHRHRHPGHLSLHRHRQRTGKEGQVLHRSKRGWVWNQFFVIEEYTGPDPVLVGRLHSDVDKGDGTIKYILSGEGAGTIFVIDDKTGNIHATKTLDREEQAQYTLTAQAVARDTNEPLEPPSEFIVKVQDINDNPPEFLHGPYYARVPEMSNVGTSVMQVTATDADDPTYGNSARLVYSILQGQPYFSVEPQTGIIRTALPNMDREARQEYDVVIQAKDMGGHMGGLSGTTEVKITLTDVNDNPPKFPQSVYTMSVSEDKVAGEEVGRLKAKDPDMGDNGLVNYRLIDGDGMSMFELSTNSETREAVIKLKKQVDFETKRSYTLKVEGSNPHIDPRFLAWGPYKDEATIKISVEDADEPPVFIASSYTFEVEENAPRGTPVGRVHAKDTDVANNPVRYMIPRYTDVDQFFSISEDGMIITNRPLDRETQPWHNISVSATEIGGHHQDTKVRVNIKVKDVNDNSPEFATNNEVHMCENVAPGKVIETVSAVDKDEMAHRQHFTFSLAPEVAHNQNFSLKDNRDSTASIYVLRKGFSRLTQDVYYLPIEINDNGFPSMSSTNTLTIRVCSCDSKDSILSCNVEPYVLPAGLSTGALIAILACIVILLAIVVLFVALRRQKKEPLIVFEEEDIRENIITYDDEGGGEEDTEAFDIATLQNPDGANGFLPRKDIKPELQYPIRPGVGRPAPNSVDVDDFIKTRIAEADGDPTAPPYDSIQIYGYEGRGSLAGSLSSLESVTTESDLDYDYLQSWGPRFRKLADLYGTKDCSVLDEDDGEDS
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.3	Very low	26.4	Very low	245 Å²	245	152.5 Å²	152.5	100%	1.207	81%	0.812	S	S	*	*				0	140.4	0	-165.2	-175.8	-165.8	0	0	107.1
2	A	28.2	Very low	26.5	Very low	89 Å²	89	145.1 Å²	145.1	74%	0.736	80%	0.799	S	S	*	*			trans	61.8	122.3	-169.3	0	0	0	0	0	114
3	V	25.9	Very low	26.4	Very low	132 Å²	132	144.4 Å²	144.4	80%	0.8	79%	0.792	S	S	*	*				77.3	139.2	57.2	164.3	0	0	0	0	112
4	L	25.8	Very low	26.4	Very low	135 Å²	135	143.1 Å²	143.1	71%	0.707	78%	0.783	S	S	*	*			cis	167.5	132.6	-23.2	-142	75.9	0	0	0	105
5	I	27.4	Very low	26.4	Very low	152 Å²	152	147.9 Å²	147.9	78%	0.779	79%	0.785	S	S	*	*			trans	66.7	150.8	137.2	-82.6	176.4	0	0	0	123.2
6	A	25.1	Very low	26.5	Very low	81 Å²	81	146.1 Å²	146.1	67%	0.669	78%	0.781	S	S	*	*			trans	87.3	105	151.4	0	0	0	0	0	123.8
7	K	27.3	Very low	26.5	Very low	192 Å²	192	145.9 Å²	145.9	84%	0.835	78%	0.779	S	S	*	*				31.3	124.7	112.3	-70.4	179.5	172.3	176.3	0	120.7
8	R	24.7	Very low	26.6	Very low	245 Å²	245	145.6 Å²	145.6	93%	0.925	78%	0.776	S	S	*	*				-145.7	134.6	126.1	-84.9	180	173.9	177.3	-3.5	106.9
9	Q	26.8	Very low	26.8	Very low	159 Å²	159	144.1 Å²	144.1	74%	0.743	77%	0.773	S	S	*	*			cis	84	132.4	31.5	-77.5	-152.5	-25.1	0	0	117.5
10	G	25	Very low	26.9	Very low	75 Å²	75	144 Å²	144	77%	0.773	77%	0.771	S	S	*	*			trans	140.9	85.8	-177.4	0	0	0	0	0	109.8
11	F	25.9	Very low	27	Very low	172 Å²	172	144.6 Å²	144.6	75%	0.754	77%	0.774	S	S	*	*			cis	91.5	114.1	26.4	-133	-58.5	0	0	0	114.2	L13	F11-L13 HydrophobicContact CD1-CD1 3.88Å; F11-L13 HydrophobicContact CE1-CD1 3.84Å
12	G	27.3	Very low	27.1	Very low	64 Å²	64	135.8 Å²	135.8	66%	0.66	75%	0.746	S	S	*	*			trans	146.6	116.6	174.6	0	0	0	0	0	111.1
13	L	25.9	Very low	27.2	Very low	136 Å²	136	138 Å²	138	71%	0.712	75%	0.75	S	S	*	*			cis	73.7	137.9	47.8	-77.7	87	0	0	0	114.7	F11	F11-L13 HydrophobicContact CD1-CD1 3.88Å; F11-L13 HydrophobicContact CE1-CD1 3.84Å
14	L	25.3	Very low	27.4	Very low	127 Å²	127	136.1 Å²	136.1	67%	0.665	74%	0.743	S	S	*	*			cis	-174.3	156.3	-15.6	-163.3	73	0	0	0	111.5
15	R	27	Very low	27.5	Very low	215 Å²	215	135.8 Å²	135.8	81%	0.811	75%	0.746	S	S	*	*			trans	84.8	152.5	138.8	-113.6	-178.5	-161.2	164.6	3.8	123.4
16	V	27.4	Very low	27.4	Very low	118 Å²	118	135.9 Å²	135.9	72%	0.715	75%	0.748	S	S	*	*			trans	78.9	137.2	148.3	156.5	0	0	0	0	118.3
17	L	26.9	Very low	27.4	Very low	144 Å²	144	137.3 Å²	137.3	75%	0.754	75%	0.751	S	S	*	*			cis	-171.8	-167.2	-21.9	-146.6	62.5	0	0	0	106.4
18	L	27.8	Very low	27.2	Very low	139 Å²	139	132.9 Å²	132.9	73%	0.728	74%	0.744	S	S	*	*			cis	-168.6	164.8	5	178.4	54.5	0	0	0	109.6
19	V	30.3	Very low	27.2	Very low	118 Å²	118	127.8 Å²	127.8	72%	0.715	74%	0.74	S	S	*	*			trans	73.7	135	157.3	142.6	0	0	0	0	117.6
20	L	30.5	Very low	27.2	Very low	141 Å²	141	124.3 Å²	124.3	74%	0.738	74%	0.739	S	S	*	*			cis	-165.4	172.9	-15.7	-104.5	176	0	0	0	106.1
21	L	29	Very low	27.2	Very low	157 Å²	157	129.2 Å²	129.2	82%	0.822	75%	0.746	S	S	*	*			cis	-123.7	-170.5	0.5	-76.2	93.1	0	0	0	108.4
22	G	28.8	Very low	27.1	Very low	61 Å²	61	123.7 Å²	123.7	63%	0.629	74%	0.738	S	S	*	*			cis	117.9	138.2	-8.8	0	0	0	0	0	115
23	V	31.4	Very low	27.1	Very low	134 Å²	134	127 Å²	127	81%	0.812	75%	0.745	S	S	*	*			cis	-169.3	152.9	-13.8	99.4	0	0	0	0	111.3
24	S	28.9	Very low	27.3	Very low	94 Å²	94	130.6 Å²	130.6	66%	0.657	75%	0.75	S	S	*	*			trans	47.3	138.8	164.5	63.5	0	0	0	0	121.6
25	V	28.8	Very low	27.4	Very low	128 Å²	128	132.2 Å²	132.2	78%	0.776	75%	0.751	S	S	*	*			cis	90.2	132.3	29.3	177.5	0	0	0	0	115.8
26	L	25.8	Very low	27.5	Very low	154 Å²	154	125 Å²	125	81%	0.806	74%	0.744	S	S	*	*			trans	78.6	105.2	163.6	-81.3	165.6	0	0	0	122.2
27	C	23.6	Very low	27.6	Very low	111 Å²	111	126.8 Å²	126.8	75%	0.75	74%	0.744	S	S	*	*				79.5	158.9	118.4	-136.1	0	0	0	0	123.3
28	S	24.3	Very low	27.7	Very low	98 Å²	98	123.2 Å²	123.2	69%	0.685	74%	0.735	S	S	*	*			trans	83.9	119	153.2	-70.4	0	0	0	0	122.1
29	V	25.4	Very low	27.6	Very low	138 Å²	138	121.9 Å²	121.9	84%	0.836	73%	0.733	S	S	*	*			trans	78.4	131.5	136.1	176	0	0	0	0	118.7
30	A	26.3	Very low	27.5	Very low	86 Å²	86	122.8 Å²	122.8	71%	0.711	73%	0.733	S	S	*	*			trans	-75	150.9	175.4	0	0	0	0	0	113.3
31	L	25.5	Very low	27.3	Very low	179 Å²	179	121.9 Å²	121.9	94%	0.937	73%	0.729	S	S	*	*			trans	-163	130	132.9	-108.6	151.6	0	0	0	111.6
32	G	23.8	Very low	27.2	Very low	56 Å²	56	122.3 Å²	122.3	58%	0.577	73%	0.726	S	S	*	*			trans	-85.3	-156.5	-166.2	0	0	0	0	0	117.6
33	T	27.3	Very low	27	Very low	133 Å²	133	130.7 Å²	130.7	82%	0.816	74%	0.739	S	S	*	*			trans	74.4	150.2	176.7	82.2	0	0	0	0	113.8
34	R	29	Very low	26.7	Very low	212 Å²	212	130 Å²	130	80%	0.8	74%	0.74	S	S	*	*			cis	-166.1	174.6	1.7	-124.3	168.2	-176.2	173.8	-0.4	105.9
35	K	28.1	Very low	26.4	Very low	161 Å²	161	133.5 Å²	133.5	70%	0.7	75%	0.745	S	S	*	*			cis	-165.3	155.6	15.9	-155	169.3	-176.4	-170.9	0	111.1
36	G	28.5	Very low	26.2	Very low	63 Å²	63	138.3 Å²	138.3	65%	0.649	75%	0.75	S	S	*	*			trans	94.6	147.6	143.4	0	0	0	0	0	116.6
37	H	28.8	Very low	26.2	Very low	155 Å²	155	139.5 Å²	139.5	72%	0.718	75%	0.751	S	S	*	*			cis	-162.8	154.3	-9.6	-114.4	-61.9	0	0	0	107.3
38	A	29.2	Very low	26.2	Very low	69 Å²	69	146 Å²	146	57%	0.57	76%	0.759	S	S	*	*			cis	-154.7	138.8	6.3	0	0	0	0	0	109.4
39	T	27.2	Very low	26.3	Very low	111 Å²	111	150 Å²	150	68%	0.681	77%	0.767	S	S	*	*				69.7	141.7	106.5	67.6	0	0	0	0	116.9
40	L	27.1	Very low	26.9	Very low	138 Å²	138	149.6 Å²	149.6	72%	0.723	77%	0.767	S	S	*	*			cis	-160.9	156.9	5.8	-144.5	75.4	0	0	0	111.9
41	D	26.3	Very low	26.8	Very low	121 Å²	121	149 Å²	149	65%	0.647	77%	0.769	S	S	*	*			trans	24.4	160.9	135.2	-70.5	-35.6	0	0	0	123.8
42	H	26.8	Very low	26.9	Very low	167 Å²	167	148.3 Å²	148.3	77%	0.773	76%	0.761	S	S	*	*			cis	-156.2	173.9	4.1	-134.6	33	0	0	0	111.9
43	R	26	Very low	27	Very low	237 Å²	237	153.6 Å²	153.6	89%	0.894	78%	0.775	S	S	*	*			trans	-80.4	136.3	159.8	-77.9	178.3	168	176	-3.6	111.1
44	S	23.9	Very low	26.9	Very low	118 Å²	118	150.8 Å²	150.8	83%	0.825	76%	0.761	S	S	*	*			trans	-161.3	164	147.6	-156.6	0	0	0	0	114.6
45	H	24.1	Very low	26.9	Very low	168 Å²	168	148.9 Å²	148.9	78%	0.778	77%	0.765	S	S	*	*			trans	-63.1	166.6	-169.2	-73.9	-87.3	0	0	0	119.5
46	R	23.1	Very low	26.9	Very low	230 Å²	230	149.4 Å²	149.4	87%	0.868	77%	0.77	S	S	*	*			trans	96.5	136.4	137.9	-92	167.4	-174.5	-174.2	2.6	120.3
47	H	26.4	Very low	26.8	Very low	179 Å²	179	157.7 Å²	157.7	83%	0.829	78%	0.782	S	S	*	*			trans	-30.6	140.5	168	-55.1	-85.9	0	0	0	117.3
48	R	24.1	Very low	26.8	Very low	246 Å²	246	158.8 Å²	158.8	93%	0.928	79%	0.787	S	S	*	*				-174	136.5	108.3	-102.3	167.7	-177.1	-175.5	0.3	113.8
49	H	26.3	Very low	26.8	Very low	184 Å²	184	166 Å²	166	85%	0.852	80%	0.799	S	S	*	*			trans	-71.8	168.9	148.9	-74.7	-61.1	0	0	0	109.5
50	P	36.5	Very low	26.8	Very low	129 Å²	129	167.6 Å²	167.6	84%	0.838	80%	0.799	S	S	*	*			cis	-138.8	-162.5	17	43.5	-24.1	0	0	0	115.1
51	G	26	Very low	27.1	Very low	73 Å²	73	173.3 Å²	173.3	75%	0.753	81%	0.811	S	S	*	*			trans	110.5	98.7	168.5	0	0	0	0	0	113
52	H	26.3	Very low	27.4	Very low	164 Å²	164	173.4 Å²	173.4	76%	0.759	82%	0.816	S	S	*	*			cis	87.2	86.3	28	-161.2	-73.5	0	0	0	115.6
53	L	26.9	Very low	27.7	Very low	168 Å²	168	169.1 Å²	169.1	88%	0.88	82%	0.817	S	S	*	*			trans	-153.2	78.1	163.1	-107.9	158.2	0	0	0	106.9
54	S	25.3	Very low	28	Very low	73 Å²	73	167.4 Å²	167.4	51%	0.51	82%	0.816	S	S	.	*				58	89.1	69.9	87	0	0	0	0	113.6
55	L	28.1	Very low	28.7	Very low	172 Å²	172	171.2 Å²	171.2	90%	0.901	82%	0.821	S	S	*	*			trans	-126.6	82.2	163.7	-135.4	156.4	0	0	0	108.3	R57	L55-R57 PolarHBondContact O-N 3.15Å
56	H	28.1	Very low	29.9	Very low	172 Å²	172	167 Å²	167	80%	0.796	82%	0.823	S	S	*	*			trans	-63.9	129.1	174	-87.2	-53.7	0	0	0	110
57	R	27.5	Very low	30.5	Very low	238 Å²	238	164.7 Å²	164.7	90%	0.898	82%	0.822	S	S	*	*			trans	-127.5	97.1	152.2	-159.7	172.6	-167	176	4.7	109.5	L55 R59	L55-R57 PolarHBondContact O-N 3.15Å; R57-R59 PolarHBondContact O-N 3.08Å
58	H	27.9	Very low	30.9	Very low	177 Å²	177	161.4 Å²	161.4	82%	0.819	81%	0.814	S	S	*	*			trans	-57.7	127.6	167.9	-93.4	-66.7	0	0	0	109.8
59	R	28.3	Very low	31.3	Very low	221 Å²	221	157.7 Å²	157.7	83%	0.834	81%	0.812	S	S	*	*			trans	-144.2	105.7	144.8	-155.1	169.5	-172.6	177.3	0.5	111.2	R57	R57-R59 PolarHBondContact O-N 3.08Å
60	Q	28.9	Very low	31.8	Very low	144 Å²	144	157.2 Å²	157.2	67%	0.673	81%	0.81	S	S	*	*			trans	26.2	118.7	152	-67.2	156.2	-52.7	0	0	118.6	T62	Q60-T62 PolarHBondContact O-N 3.06Å
61	R	32.5	Very low	31.9	Very low	259 Å²	259	156.4 Å²	156.4	98%	0.977	79%	0.79	S	S	*	*			trans	-56.5	115.8	146.3	-89.4	177.9	159.5	178.4	-7.6	108.9
62	T	33.3	Very low	32.6	Very low	122 Å²	122	158 Å²	158	75%	0.748	79%	0.79	S	S	*	*			trans	-132	120.8	155.7	48.1	0	0	0	0	106.7	Q60	Q60-T62 PolarHBondContact O-N 3.06Å
63	G	32.6	Very low	33.2	Very low	77 Å²	77	157.8 Å²	157.8	79%	0.794	79%	0.787	S	S	*	*			trans	-67.7	142.9	-174.2	0	0	0	0	0	112.9
64	K	33.1	Very low	34.1	Very low	201 Å²	201	153.6 Å²	153.6	87%	0.874	76%	0.759	S	S	*	*			trans	-125.9	95.7	143.1	-81	-164.7	172.8	-170.1	0	107.5
65	E	38.4	Very low	35	Very low	199 Å²	199	153 Å²	153	93%	0.93	77%	0.765	S	S	*	*			trans	-65.2	156.2	154.7	-65	168.6	131.6	0	0	108.2
66	G	48.2	Very low	35.6	Very low	80 Å²	80	155.8 Å²	155.8	83%	0.825	76%	0.764	S	S	*	*			trans	83.1	40.8	172.8	0	0	0	0	0	116.4
67	Q	34.9	Very low	36.5	Very low	180 Å²	180	153.1 Å²	153.1	84%	0.841	76%	0.759	S	S	*	*			trans	-111.1	87.2	153.2	-164.1	165.8	10.9	0	0	109.2	L69	Q67-L69 PolarHBondContact O-N 3.29Å
68	V	36.8	Very low	37.7	Very low	110 Å²	110	151.5 Å²	151.5	67%	0.667	75%	0.753	S	S	*	*			trans	-63.5	126.9	172.1	178.4	0	0	0	0	108.2	H70	V68-H70 VanDerWaalsContact C-N 3.3Å; V68-H70 PolarHBondContact O-N 3.44Å
69	L	31.3	Very low	39.5	Very low	169 Å²	169	146.5 Å²	146.5	89%	0.885	73%	0.732	S	S	*	*			trans	-72.8	89.2	168.4	-72.8	171.7	0	0	0	108.3	Q67 R71	Q67-L69 PolarHBondContact O-N 3.29Å; L69-R71 PolarHBondContact O-N 2.91Å
70	H	37.1	Very low	41.9	Very low	173 Å²	173	138.8 Å²	138.8	80%	0.801	71%	0.706	S	S	*	*			trans	-68.5	100.6	171.9	-106.2	-73	0	0	0	109.8	V68	V68-H70 VanDerWaalsContact C-N 3.3Å; V68-H70 PolarHBondContact O-N 3.44Å
71	R	39.1	Very low	44.5	Very low	113 Å²	113	133.6 Å²	133.6	43%	0.426	68%	0.681	S	S	.	*	P	Polyproline II helix	trans	-51.3	134.8	161.7	163.3	174.1	176.6	-146.3	20.6	110.1	L69 R74 D746	L69-R71 PolarHBondContact O-N 2.91Å; R71-R74 VanDerWaalsContact NH1-CZ 3.25Å; R71-R74 VanDerWaalsContact NH2-CZ 3.32Å; R71-D746 IonicContact CZ-OD1 2.71Å; R71-D746 VanDerWaalsContact NH1-CG 3.33Å; R71-D746 IonicContact NH1-OD1 3.21Å; R71-D746 PolarHBondContact NH1-OD1 3.29Å; R71-D746 IonicContact NH1-OD2 3.7Å
72	S	41	Very low	47	Very low	107 Å²	107	126.2 Å²	126.2	75%	0.748	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-63.4	141.4	167.5	41.6	0	0	0	0	110.3
73	K	38.5	Very low	49.6	Very low	159 Å²	159	121 Å²	121	69%	0.691	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-59.7	141.7	-167	-158.6	176.5	179.4	-174.9	0	112.1	G75 D101	K73-G75 PolarHBondContact O-N 3.35Å; K73-D101 WeakPolarHBondContact CE-OD2 3.48Å; K73-D101 IonicContact NZ-OD1 2.71Å; K73-D101 PolarHBondContact NZ-OD1 3.32Å; K73-D101 IonicContact NZ-OD2 3.6Å; K73-D101 PolarHBondContact NZ-OD2 3.01Å
74	R	45.1	Very low	52	Low	79 Å²	79	120.9 Å²	120.9	30%	0.298	61%	0.605	S	S	.	*			trans	-67.5	113.8	-176.6	-155.6	-176.4	-25.3	-118.9	1.8	110	R71 D746 D755	R71-R74 VanDerWaalsContact NH1-CZ 3.25Å; R71-R74 VanDerWaalsContact NH2-CZ 3.32Å; R74-D746 IonicContact CZ-OD1 2.63Å; R74-D746 VanDerWaalsContact CZ-OD1 3.25Å; R74-D746 IonicContact CZ-OD2 3.88Å; R74-D746 IonicContact NH1-OD1 2.63Å; R74-D746 PolarHBondContact NH1-OD1 3Å; R74-D746 VanDerWaalsContact NH2-CG 3.26Å; R74-D746 IonicContact NH2-OD1 2.91Å; R74-D746 PolarHBondContact NH2-OD1 2.73Å; R74-D746 IonicContact NH2-OD2 2.79Å; R74-D746 PolarHBondContact NH2-OD2 2.96Å; R74-D755 VanDerWaalsContact CD-CG 3.43Å; R74-D755 WeakPolarHBondContact CD-OD2 3.37Å; R74-D755 IonicContact CZ-OD1 2.71Å; R74-D755 IonicContact CZ-OD2 3.13Å; R74-D755 IonicContact NE-OD1 3.92Å; R74-D755 IonicContact NE-OD2 2.75Å; R74-D755 PolarHBondContact NE-OD2 2.98Å; R74-D755 VanDerWaalsContact NE-OD2 3.13Å; R74-D755 VanDerWaalsContact NH1-CG 3.27Å; R74-D755 IonicContact NH1-OD1 2.86Å; R74-D755 PolarHBondContact NH1-OD1 3.27Å; R74-D755 IonicContact NH1-OD2 2.81Å; R74-D755 PolarHBondContact NH1-OD2 3.11Å
75	G	43.8	Very low	54.6	Low	62 Å²	62	111.4 Å²	111.4	64%	0.639	56%	0.564	S	S	*	*			trans	-86.4	137.1	176.6	0	0	0	0	0	112.1	K73	K73-G75 PolarHBondContact O-N 3.35Å
76	W	41.8	Very low	56.6	Low	230 Å²	230	106.7 Å²	106.7	87%	0.871	54%	0.542	S	S	*	.			trans	-83.5	115.3	171	-74.2	88.5	0	0	0	109.8	W78	W76-W78 PolarHBondContact O-N 2.93Å
77	V	47	Very low	57.9	Low	116 Å²	116	108.5 Å²	108.5	70%	0.703	52%	0.524	S	S	*	.			trans	-93.2	79.3	179.6	-174.7	0	0	0	0	109.9	N79	V77-N79 VanDerWaalsContact C-N 3.29Å; V77-N79 HydrophobicContact CG1-CB 3.72Å; V77-N79 PolarHBondContact O-N 3.43Å
78	W	52.7	Low	59.1	Low	203 Å²	203	106.6 Å²	106.6	77%	0.769	53%	0.525	S	S	*	.			trans	-86	76.4	158.5	-72.1	92.4	0	0	0	107.9	W76 Q80	W76-W78 PolarHBondContact O-N 2.93Å; W78-Q80 PolarHBondContact O-N 3.49Å
79	N	65.4	Low	60.5	Low	72 Å²	72	102.5 Å²	102.5	39%	0.385	51%	0.505	S	S	.	.			trans	-83.5	9.3	-176.1	65.8	-25	0	0	0	114.2	V77 F166 I167	V77-N79 VanDerWaalsContact C-N 3.29Å; V77-N79 HydrophobicContact CG1-CB 3.72Å; V77-N79 PolarHBondContact O-N 3.43Å; N79-F166 WeakPolarHBondContact O-CA 3.22Å; N79-I167 PolarHBondContact O-N 3.47Å
80	Q	78.6	Confident	62.2	Low	60 Å²	60	99.6 Å²	99.6	28%	0.28	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	122.9	178.9	-64.4	-178.7	26.5	0	0	110.5	W78 F82 I167 K169	W78-Q80 PolarHBondContact O-N 3.49Å; Q80-F82 HydrophobicContact CB-CE2 4.3Å; Q80-F82 HydrophobicContact CB-CZ 4.36Å; Q80-I167 CarbonylContact C-O 3.52Å; Q80-I167 VanDerWaalsContact CA-O 3.28Å; Q80-I167 WeakPolarHBondContact CA-O 3.43Å; Q80-I167 HydrophobicContact CG-CB 4.46Å; Q80-K169 VanDerWaalsContact OE1-CE 3.27Å
81	F	83.9	Confident	63.5	Low	35 Å²	35	97.3 Å²	97.3	15%	0.154	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	161.6	158.1	-63.8	-74.7	0	0	0	109.3	V95 L98 I131 F166 I167 V168 K169	F81-V95 HydrophobicContact CB-CG1 3.8Å; F81-V95 HydrophobicContact CG-CG1 4.23Å; F81-L98 HydrophobicContact CE2-CD2 4.16Å; F81-L98 HydrophobicContact CZ-CD2 3.96Å; F81-I131 HydrophobicContact CE2-CD1 4.4Å; F81-F166 AromaticContact CD2-CD2 3.43Å; F81-F166 HydrophobicContact CD2-CD2 3.43Å; F81-F166 VanDerWaalsContact CD2-CD2 3.43Å; F81-F166 AromaticContact CD2-CE2 3.54Å; F81-F166 HydrophobicContact CD2-CE2 3.54Å; F81-F166 HydrophobicContact CD2-CG 4.28Å; F81-F166 HydrophobicContact CD2-CZ 4.47Å; F81-F166 AromaticContact CE2-CD2 3.64Å; F81-F166 HydrophobicContact CE2-CD2 3.64Å; F81-F166 AromaticContact CE2-CE2 3.68Å; F81-F166 HydrophobicContact CE2-CE2 3.68Å; F81-F166 HydrophobicContact CE2-CG 4.11Å; F81-F166 HydrophobicContact CE2-CZ 4.21Å; F81-I167 PolarHBondContact N-O 3.44Å; F81-V168 HydrophobicContact CB-CG2 4.36Å; F81-K169 PolarHBondContact O-N 3.01Å
82	F	84.4	Confident	65.5	Low	104 Å²	104	95 Å²	95	46%	0.456	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	138	178.7	-64.2	-86	0	0	0	109.8	Q80 K169 Q171	Q80-F82 HydrophobicContact CB-CE2 4.3Å; Q80-F82 HydrophobicContact CB-CZ 4.36Å; F82-K169 WeakPolarHBondContact CA-O 3.33Å; F82-K169 HydrophobicContact CD1-CB 3.86Å; F82-K169 HydrophobicContact CD1-CD 4.46Å; F82-K169 HydrophobicContact CE1-CB 4Å; F82-K169 HydrophobicContact CE1-CD 3.76Å; F82-K169 HydrophobicContact CE1-CG 4.49Å; F82-K169 HydrophobicContact CZ-CD 4.39Å; F82-Q171 HydrophobicContact CB-CG 4.03Å; F82-Q171 HydrophobicContact CD1-CG 3.88Å; F82-Q171 HydrophobicContact CG-CG 4.37Å
83	V	87.1	Confident	67.6	Low	11 Å²	11	91.3 Å²	91.3	7%	0.067	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	129.5	175.1	-175.6	0	0	0	0	107.4	V95 L137 V168 K169 V170 Q171	V83-V95 HydrophobicContact CG2-CB 3.98Å; V83-V95 HydrophobicContact CG2-CG1 3.5Å; V83-V95 HydrophobicContact CG2-CG2 3.56Å; V83-L137 HydrophobicContact CB-CD1 3.89Å; V83-L137 HydrophobicContact CG1-CD1 3.69Å; V83-L137 HydrophobicContact CG2-CD1 4.48Å; V83-V168 HydrophobicContact CB-CG1 4.38Å; V83-V168 HydrophobicContact CG2-CG1 3.6Å; V83-K169 PolarHBondContact N-O 3.02Å; V83-V170 CarbonylContact O-C 3.58Å; V83-V170 VanDerWaalsContact O-CA 3.29Å; V83-V170 WeakPolarHBondContact O-CA 3.5Å; V83-Q171 PolarHBondContact O-N 3.05Å
84	I	84.9	Confident	69.9	Low	76 Å²	76	88.5 Å²	88.5	39%	0.39	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	137	175	-53.9	168.5	0	0	0	108.3	Q171 I173	I84-Q171 HydrophobicContact CG1-CB 4.2Å; I84-I173 HydrophobicContact CG2-CD1 3.61Å; I84-I173 HydrophobicContact CG2-CG1 3.71Å
85	E	87.5	Confident	71.9	Confident	2 Å²	2	85.4 Å²	85.4	1%	0.009	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	172.8	175.5	76.2	-164.3	122.5	0	0	113.5	Y87 L137 R139 V170 Q171 D172 I173	E85-Y87 WeakPolarHBondContact O-CA 3.49Å; E85-Y87 PolarHBondContact O-N 3.3Å; E85-L137 WeakPolarHBondContact CB-O 3.31Å; E85-R139 WeakPolarHBondContact OE2-CB 3.29Å; E85-R139 PolarHBondContact OE2-N 2.88Å; E85-V170 HydrophobicContact CB-CG1 3.59Å; E85-Q171 PolarHBondContact N-O 2.82Å; E85-D172 WeakPolarHBondContact OE1-CA 3.42Å; E85-I173 HydrophobicContact CG-CB 4.06Å; E85-I173 HydrophobicContact CG-CD1 4.39Å; E85-I173 HydrophobicContact CG-CG1 4.11Å; E85-I173 WeakPolarHBondContact O-CD1 3.5Å; E85-I173 PolarHBondContact OE1-N 3.26Å
86	E	80.2	Confident	73.8	Confident	100 Å²	100	83 Å²	83	47%	0.467	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	10.5	176.8	-82.6	-82.4	101	0	0	114.6	T88 L137 I173	E86-T88 PolarHBondContact O-N 2.89Å; E86-L137 PolarHBondContact N-O 2.04Å; E86-I173 HydrophobicContact CB-CD1 4.38Å
87	Y	75.6	Confident	75.9	Confident	118 Å²	118	78.7 Å²	78.7	46%	0.463	40%	0.404	S	S	.	.			trans	-75.3	98.1	-159.3	-179.3	-102.3	0	0	0	112.6	E85 G89 V93	E85-Y87 WeakPolarHBondContact O-CA 3.49Å; E85-Y87 PolarHBondContact O-N 3.3Å; Y87-G89 VanDerWaalsContact CE1-CA 3.49Å; Y87-G89 PolarHBondContact O-N 3.45Å; Y87-V93 HydrophobicContact CD1-CG1 4.01Å; Y87-V93 HydrophobicContact CD1-CG2 3.76Å; Y87-V93 HydrophobicContact CE1-CG1 4.18Å; Y87-V93 HydrophobicContact CE1-CG2 4.21Å
88	T	60.3	Low	77.7	Confident	139 Å²	139	75 Å²	75	85%	0.853	38%	0.38	S	S	*	.			trans	-72.5	25.7	-178.1	50.4	0	0	0	0	115.4	E86	E86-T88 PolarHBondContact O-N 2.89Å
89	G	65.5	Low	79.2	Confident	24 Å²	24	71.1 Å²	71.1	25%	0.247	37%	0.37	C	S	.	.	S	Bend	trans	-77.3	-168.3	178.1	0	0	0	0	0	114.5	Y87 D91	Y87-G89 VanDerWaalsContact CE1-CA 3.49Å; Y87-G89 PolarHBondContact O-N 3.45Å; G89-D91 PolarHBondContact O-N 3.01Å; G89-D91 VanDerWaalsContact O-N 3.13Å
90	P	66.9	Low	80	Confident	109 Å²	109	68.1 Å²	68.1	71%	0.708	35%	0.354	S	S	*	.	S	Bend	trans	-72.4	107.4	-178	29.1	-34	0	0	0	111.8	P92	P90-P92 CarbonylContact O-C 3.54Å
91	D	65.3	Low	80	Confident	124 Å²	124	70.5 Å²	70.5	66%	0.663	37%	0.369	S	S	*	.	S	Bend	trans	-60.1	137.5	172.2	-87.4	-45.8	0	0	0	112.6	G89	G89-D91 PolarHBondContact O-N 3.01Å; G89-D91 VanDerWaalsContact O-N 3.13Å
92	P	80.5	Confident	79.9	Confident	65 Å²	65	71.8 Å²	71.8	42%	0.422	38%	0.38	S	S	.	.	S	Bend	cis	-90.9	140.6	-4.1	37.2	-34.5	0	0	0	112.3	P90 L94 H132 A133 T134	P90-P92 CarbonylContact O-C 3.54Å; P92-L94 PolarHBondContact O-N 2.95Å; P92-H132 HydrophobicContact CB-CB 3.81Å; P92-H132 HydrophobicContact CG-CB 4.04Å; P92-A133 CarbonylContact C-O 3.54Å; P92-A133 WeakPolarHBondContact CA-O 3.5Å; P92-A133 VanDerWaalsContact CB-O 3.31Å; P92-A133 WeakPolarHBondContact CB-O 3.27Å; P92-T134 HydrophobicContact CB-CG2 3.91Å
93	V	84.8	Confident	79.8	Confident	30 Å²	30	67.8 Å²	67.8	18%	0.182	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	122.6	-172	-174.4	0	0	0	0	111.3	Y87 V95 H132 A133	Y87-V93 HydrophobicContact CD1-CG1 4.01Å; Y87-V93 HydrophobicContact CD1-CG2 3.76Å; Y87-V93 HydrophobicContact CE1-CG1 4.18Å; Y87-V93 HydrophobicContact CE1-CG2 4.21Å; V93-V95 PolarHBondContact O-N 3.32Å; V93-H132 CarbonylContact O-C 3.6Å; V93-H132 WeakPolarHBondContact O-CA 3.41Å; V93-H132 WeakPolarHBondContact O-CB 3.46Å; V93-A133 HydrophobicContact CB-CB 4.44Å; V93-A133 PolarHBondContact N-O 3.45Å; V93-A133 PolarHBondContact O-N 3.33Å
94	L	86.3	Confident	79.4	Confident	99 Å²	99	75.3 Å²	75.3	52%	0.518	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	108.1	178.5	-178.1	71.6	0	0	0	111.5	P92 G96 N130	P92-L94 PolarHBondContact O-N 2.95Å; L94-G96 WeakPolarHBondContact CD1-O 3.3Å; L94-N130 HydrophobicContact CD1-CB 3.76Å
95	V	86.6	Confident	78.9	Confident	14 Å²	14	75 Å²	75	9%	0.085	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	-35.6	178.5	178.3	0	0	0	0	111.8	F81 V83 V93 F122 I131 A133 V168	F81-V95 HydrophobicContact CB-CG1 3.8Å; F81-V95 HydrophobicContact CG-CG1 4.23Å; V83-V95 HydrophobicContact CG2-CB 3.98Å; V83-V95 HydrophobicContact CG2-CG1 3.5Å; V83-V95 HydrophobicContact CG2-CG2 3.56Å; V93-V95 PolarHBondContact O-N 3.32Å; V95-F122 HydrophobicContact CG2-CD1 4.07Å; V95-F122 HydrophobicContact CG2-CE1 4.1Å; V95-I131 HydrophobicContact CB-CG2 4.22Å; V95-I131 PolarHBondContact N-O 3.24Å; V95-A133 HydrophobicContact CG2-CB 3.89Å; V95-V168 HydrophobicContact CG1-CG1 4.1Å; V95-V168 HydrophobicContact CG1-CG2 4.14Å
96	G	84.3	Confident	78.6	Confident	13 Å²	13	79.3 Å²	79.3	13%	0.134	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.2	-174.7	-175.3	0	0	0	0	0	112.5	L94 I131	L94-G96 WeakPolarHBondContact CD1-O 3.3Å; G96-I131 PolarHBondContact N-O 2.95Å; G96-I131 PolarHBondContact O-N 3.46Å
97	R	86.4	Confident	78.5	Confident	138 Å²	138	76.1 Å²	76.1	52%	0.521	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	129.4	177.6	-175.9	179.3	-173	-168.3	-3.6	110.8	T128 G129 N130	R97-T128 VanDerWaalsContact CZ-O 3.24Å; R97-T128 PolarHBondContact NE-O 2.99Å; R97-T128 PolarHBondContact NH2-O 3.03Å; R97-G129 WeakPolarHBondContact CA-O 3.03Å; R97-N130 WeakPolarHBondContact CD-OD1 3.47Å; R97-N130 VanDerWaalsContact CG-OD1 3.28Å; R97-N130 WeakPolarHBondContact CG-OD1 3.28Å; R97-N130 PolarHBondContact NE-OD1 3.35Å
98	L	84.1	Confident	79	Confident	39 Å²	39	74.2 Å²	74.2	20%	0.204	43%	0.428	C	S	.	.			trans	-95.1	148.2	168.7	-60.3	-179.9	0	0	0	110.6	F81 I124 G129 I131 A149 F166	F81-L98 HydrophobicContact CE2-CD2 4.16Å; F81-L98 HydrophobicContact CZ-CD2 3.96Å; L98-I124 HydrophobicContact CD1-CD1 4.09Å; L98-G129 PolarHBondContact N-O 2.91Å; L98-I131 HydrophobicContact CD1-CD1 3.84Å; L98-I131 HydrophobicContact CG-CD1 3.89Å; L98-A149 HydrophobicContact CD1-CB 3.15Å; L98-F166 HydrophobicContact CD1-CE1 4.07Å
99	H	84.2	Confident	80.3	Confident	122 Å²	122	67.7 Å²	67.7	57%	0.565	39%	0.389	S	S	*	.			trans	-157.1	130.4	-179.4	-178.7	46.5	0	0	0	109.6	D103 Y111	H99-D103 IonicContact ND1-OD2 3.72Å; H99-Y111 PolarHBondContact ND1-OH 3.03Å
100	S	82.1	Confident	81.4	Confident	8 Å²	8	69.2 Å²	69.2	6%	0.056	39%	0.388	C	S	.	.			trans	-94.3	143.8	168.1	162.7	0	0	0	0	109.1	V102 D103 Y111 E161	S100-V102 PolarHBondContact O-N 3.29Å; S100-V102 WeakPolarHBondContact OG-CB 3.33Å; S100-V102 WeakPolarHBondContact OG-CG2 3.45Å; S100-V102 PolarHBondContact OG-N 3.03Å; S100-V102 VanDerWaalsContact OG-N 3.1Å; S100-D103 WeakPolarHBondContact O-CB 3.35Å; S100-D103 PolarHBondContact O-N 3.35Å; S100-Y111 PolarHBondContact N-OH 2.96Å; S100-E161 WeakPolarHBondContact CB-OE1 3.46Å; S100-E161 PolarHBondContact OG-OE1 3.49Å
101	D	79.9	Confident	82.5	Confident	110 Å²	110	64.4 Å²	64.4	59%	0.588	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	3.3	176	87.6	-29.3	0	0	0	114.1	K73	K73-D101 WeakPolarHBondContact CE-OD2 3.48Å; K73-D101 IonicContact NZ-OD1 2.71Å; K73-D101 PolarHBondContact NZ-OD1 3.32Å; K73-D101 IonicContact NZ-OD2 3.6Å; K73-D101 PolarHBondContact NZ-OD2 3.01Å
102	V	80.6	Confident	83.7	Confident	63 Å²	63	61.2 Å²	61.2	38%	0.382	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-21.5	163.3	-170	0	0	0	0	111.2	S100 K104 I109	S100-V102 PolarHBondContact O-N 3.29Å; S100-V102 WeakPolarHBondContact OG-CB 3.33Å; S100-V102 WeakPolarHBondContact OG-CG2 3.45Å; S100-V102 PolarHBondContact OG-N 3.03Å; S100-V102 VanDerWaalsContact OG-N 3.1Å; V102-K104 PolarHBondContact O-N 3Å; V102-I109 HydrophobicContact CB-CD1 3.83Å; V102-I109 HydrophobicContact CG1-CD1 3.97Å
103	D	82	Confident	84.3	Confident	20 Å²	20	59.2 Å²	59.2	11%	0.107	32%	0.324	C	S	.	.			trans	-74.8	112.4	-178.8	-175.7	3.9	0	0	0	111.8	H99 S100 G105 I109 Y111	H99-D103 IonicContact ND1-OD2 3.72Å; S100-D103 WeakPolarHBondContact O-CB 3.35Å; S100-D103 PolarHBondContact O-N 3.35Å; D103-G105 PolarHBondContact OD1-N 3.42Å; D103-I109 HydrophobicContact CB-CD1 3.92Å; D103-I109 HydrophobicContact CB-CG1 4.4Å; D103-Y111 VanDerWaalsContact CB-OH 3.28Å; D103-Y111 WeakPolarHBondContact CB-OH 3.36Å; D103-Y111 WeakPolarHBondContact OD2-CE2 3.16Å; D103-Y111 PolarHBondContact OD2-OH 3.47Å
104	K	79.3	Confident	84.6	Confident	169 Å²	169	60.5 Å²	60.5	74%	0.735	33%	0.334	S	S	*	.			trans	-91.4	1.7	-179.6	-64.6	164	-166.3	156.4	0	113.1	V102 D106	V102-K104 PolarHBondContact O-N 3Å; K104-D106 PolarHBondContact O-N 3.38Å
105	G	75.2	Confident	84.7	Confident	70 Å²	70	58.2 Å²	58.2	72%	0.722	34%	0.335	S	S	*	.	S	Bend	trans	71.3	12.2	-171.7	0	0	0	0	0	114	D103 G107	D103-G105 PolarHBondContact OD1-N 3.42Å; G105-G107 VanDerWaalsContact C-N 3.29Å
106	D	80.2	Confident	84.9	Confident	91 Å²	91	61.8 Å²	61.8	49%	0.487	35%	0.351	S	S	.	.	S	Bend	trans	-83.6	-3.9	175.6	60.2	17.1	0	0	0	113.2	K104 T108	K104-D106 PolarHBondContact O-N 3.38Å; D106-T108 VanDerWaalsContact C-N 3.33Å; D106-T108 VanDerWaalsContact OD1-CB 3.3Å; D106-T108 WeakPolarHBondContact OD1-CB 3.39Å; D106-T108 VanDerWaalsContact OD1-CG2 3.28Å; D106-T108 WeakPolarHBondContact OD1-CG2 3.39Å; D106-T108 PolarHBondContact OD1-N 3.43Å; D106-T108 PolarHBondContact OD1-OG1 2.93Å
107	G	79.6	Confident	84.9	Confident	33 Å²	33	62 Å²	62	34%	0.34	35%	0.353	S	S	.	.	S	Bend	trans	80.2	6.3	179.6	0	0	0	0	0	114.8	G105 I109 R154	G105-G107 VanDerWaalsContact C-N 3.29Å; G107-I109 VanDerWaalsContact C-N 3.27Å; G107-I109 PolarHBondContact O-N 3.03Å; G107-R154 VanDerWaalsContact O-CD 3.28Å; G107-R154 WeakPolarHBondContact O-CD 3.24Å; G107-R154 PolarHBondContact O-NE 2.98Å
108	T	84.9	Confident	85.1	Confident	78 Å²	78	56.7 Å²	56.7	48%	0.479	34%	0.339	S	S	.	.			trans	-68.5	-23.6	178.2	55.8	0	0	0	0	113.7	D106 R154	D106-T108 VanDerWaalsContact C-N 3.33Å; D106-T108 VanDerWaalsContact OD1-CB 3.3Å; D106-T108 WeakPolarHBondContact OD1-CB 3.39Å; D106-T108 VanDerWaalsContact OD1-CG2 3.28Å; D106-T108 WeakPolarHBondContact OD1-CG2 3.39Å; D106-T108 PolarHBondContact OD1-N 3.43Å; D106-T108 PolarHBondContact OD1-OG1 2.93Å; T108-R154 VanDerWaalsContact O-CB 3.23Å; T108-R154 WeakPolarHBondContact O-CB 3.02Å; T108-R154 PolarHBondContact O-N 3.41Å
109	I	87.7	Confident	85.1	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.015	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	148.9	176	-57	-157.3	0	0	0	110.7	V102 D103 G107 Y111 A151 R154 L160	V102-I109 HydrophobicContact CB-CD1 3.83Å; V102-I109 HydrophobicContact CG1-CD1 3.97Å; D103-I109 HydrophobicContact CB-CD1 3.92Å; D103-I109 HydrophobicContact CB-CG1 4.4Å; G107-I109 VanDerWaalsContact C-N 3.27Å; G107-I109 PolarHBondContact O-N 3.03Å; I109-Y111 HydrophobicContact CG2-CE1 4.49Å; I109-Y111 HydrophobicContact CG2-CE2 4.35Å; I109-A151 HydrophobicContact CG2-CB 4.08Å; I109-R154 PolarHBondContact O-NE 2.84Å; I109-R154 PolarHBondContact O-NH2 3Å; I109-L160 HydrophobicContact CB-CD1 4.42Å; I109-L160 HydrophobicContact CD1-CD1 3.58Å; I109-L160 HydrophobicContact CG1-CD1 3.62Å; I109-L160 HydrophobicContact CG2-CD1 4.4Å
110	K	89.3	Confident	85.2	Confident	55 Å²	55	56 Å²	56	24%	0.239	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129	168.9	178.6	-177	175.7	-164.7	0	109.8	I112 D126 V152 R154	K110-I112 HydrophobicContact CD-CD1 4.44Å; K110-I112 HydrophobicContact CD-CG1 4.39Å; K110-I112 HydrophobicContact CG-CG1 4.3Å; K110-D126 WeakPolarHBondContact CA-O 3.42Å; K110-D126 HydrophobicContact CG-CB 4.05Å; K110-D126 WeakPolarHBondContact CG-OD2 3.48Å; K110-V152 HydrophobicContact CB-CG2 3.98Å; K110-V152 HydrophobicContact CD-CG2 4.38Å; K110-V152 HydrophobicContact CG-CG2 4.4Å; K110-V152 PolarHBondContact N-O 2.93Å; K110-V152 PolarHBondContact O-N 2.88Å; K110-R154 HydrophobicContact CB-CB 4.2Å; K110-R154 HydrophobicContact CB-CG 4.47Å
111	Y	90.1	Very high	85.6	Confident	9 Å²	9	56.8 Å²	56.8	4%	0.035	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	137.2	172.4	-60.7	-83.2	0	0	0	110.4	H99 S100 D103 I109 D126 A151	H99-Y111 PolarHBondContact ND1-OH 3.03Å; S100-Y111 PolarHBondContact N-OH 2.96Å; D103-Y111 VanDerWaalsContact CB-OH 3.28Å; D103-Y111 WeakPolarHBondContact CB-OH 3.36Å; D103-Y111 WeakPolarHBondContact OD2-CE2 3.16Å; D103-Y111 PolarHBondContact OD2-OH 3.47Å; I109-Y111 HydrophobicContact CG2-CE1 4.49Å; I109-Y111 HydrophobicContact CG2-CE2 4.35Å; Y111-D126 PolarHBondContact N-O 2.87Å; Y111-D126 VanDerWaalsContact N-O 3.08Å; Y111-A151 HydrophobicContact CD1-CB 4.31Å; Y111-A151 HydrophobicContact CE1-CB 4.29Å
112	I	90.4	Very high	86.1	Confident	56 Å²	56	51.6 Å²	51.6	29%	0.287	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	139.5	178.9	-59.7	-179.5	0	0	0	108.6	K110 A149 Q150 V152	K110-I112 HydrophobicContact CD-CD1 4.44Å; K110-I112 HydrophobicContact CD-CG1 4.39Å; K110-I112 HydrophobicContact CG-CG1 4.3Å; I112-A149 CarbonylContact O-C 3.52Å; I112-A149 VanDerWaalsContact O-CA 3.29Å; I112-A149 WeakPolarHBondContact O-CA 3.43Å; I112-Q150 PolarHBondContact N-O 3.4Å; I112-Q150 PolarHBondContact O-N 3.28Å; I112-V152 HydrophobicContact CD1-CG1 4.2Å; I112-V152 HydrophobicContact CD1-CG2 3.69Å; I112-V152 HydrophobicContact CG1-CG2 4.29Å
113	L	92	Very high	86.6	Confident	23 Å²	23	51.4 Å²	51.4	12%	0.12	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	141.5	177.1	-174.7	64.5	0	0	0	109.6	A118 F122 I124 I131 L147 A149 F166	L113-A118 HydrophobicContact CG-CB 4.25Å; L113-F122 HydrophobicContact CD2-CB 3.97Å; L113-I124 HydrophobicContact CB-CB 3.99Å; L113-I124 HydrophobicContact CB-CG2 3.58Å; L113-I124 HydrophobicContact CD2-CB 4.33Å; L113-I131 HydrophobicContact CD2-CG2 4.21Å; L113-L147 HydrophobicContact CD1-CB 4.05Å; L113-L147 HydrophobicContact CD1-CD1 4.23Å; L113-L147 HydrophobicContact CD1-CD2 4.05Å; L113-L147 HydrophobicContact CD1-CG 4.35Å; L113-L147 HydrophobicContact CD2-CD1 4.3Å; L113-L147 HydrophobicContact CD2-CD2 4.37Å; L113-L147 HydrophobicContact CG-CD2 4.09Å; L113-A149 HydrophobicContact CD1-CB 4.21Å; L113-F166 HydrophobicContact CD1-CE1 3.96Å; L113-F166 HydrophobicContact CD1-CZ 3.67Å
114	S	90.9	Very high	87.1	Confident	57 Å²	57	51.7 Å²	51.7	40%	0.399	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	163.9	-178.3	61.6	0	0	0	0	110.2	L147 T148	S114-L147 WeakPolarHBondContact O-CA 3.45Å; S114-L147 WeakPolarHBondContact O-CD2 3.45Å; S114-T148 PolarHBondContact N-O 3.04Å; S114-T148 PolarHBondContact O-N 2.8Å; S114-T148 VanDerWaalsContact O-O 3.12Å; S114-T148 PolarHBondContact OG-O 3.4Å
115	G	90	Very high	87.7	Confident	52 Å²	52	46.4 Å²	46.4	54%	0.536	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	108.2	-156.3	-175.3	0	0	0	0	0	112.9	A118	G115-A118 WeakPolarHBondContact O-CB 3.37Å; G115-A118 PolarHBondContact O-N 3.02Å
116	E	89.4	Confident	88.4	Confident	88 Å²	88	45.6 Å²	45.6	41%	0.411	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	126.2	-171.5	-63.1	173.8	153.4	0	0	111.2	A118 Y145 T146 L147	E116-A118 PolarHBondContact O-N 3.34Å; E116-A118 VanDerWaalsContact O-N 3.14Å; E116-Y145 HydrophobicContact CB-CD1 4.23Å; E116-T146 PolarHBondContact N-O 2.87Å; E116-T146 WeakPolarHBondContact OE2-CB 3.29Å; E116-T146 PolarHBondContact OE2-N 2.81Å; E116-T146 PolarHBondContact OE2-OG1 3.48Å; E116-T146 VanDerWaalsContact OE2-OG1 3.12Å; E116-L147 WeakPolarHBondContact O-CD2 3.21Å
117	G	85.5	Confident	88.7	Confident	18 Å²	18	47.8 Å²	47.8	19%	0.186	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	69	1.7	-176.6	0	0	0	0	0	115.8	G119 T120 I121 F122	G117-G119 PolarHBondContact O-N 3.47Å; G117-T120 PolarHBondContact O-N 2.99Å; G117-T120 PolarHBondContact O-OG1 3.05Å; G117-I121 PolarHBondContact O-N 3.26Å; G117-F122 PolarHBondContact O-N 2.97Å
118	A	89.1	Confident	89.1	Confident	27 Å²	27	48.4 Å²	48.4	22%	0.223	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-63.4	125.6	-178.4	0	0	0	0	0	112.1	L113 G115 E116 T120 L147	L113-A118 HydrophobicContact CG-CB 4.25Å; G115-A118 WeakPolarHBondContact O-CB 3.37Å; G115-A118 PolarHBondContact O-N 3.02Å; E116-A118 PolarHBondContact O-N 3.34Å; E116-A118 VanDerWaalsContact O-N 3.14Å; A118-T120 VanDerWaalsContact C-N 3.27Å; A118-T120 PolarHBondContact O-N 3.37Å; A118-L147 HydrophobicContact CB-CD2 3.82Å
119	G	84.5	Confident	89.1	Confident	58 Å²	58	44.7 Å²	44.7	60%	0.598	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	0.1	-179.8	0	0	0	0	0	115.6	G117 F122	G117-G119 PolarHBondContact O-N 3.47Å; G119-F122 PolarHBondContact N-O 2.92Å
120	T	87.4	Confident	89.2	Confident	87 Å²	87	46.4 Å²	46.4	53%	0.534	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.7	-29.7	-179.3	56.4	0	0	0	0	113.9	G117 A118 K135	G117-T120 PolarHBondContact O-N 2.99Å; G117-T120 PolarHBondContact O-OG1 3.05Å; A118-T120 VanDerWaalsContact C-N 3.27Å; A118-T120 PolarHBondContact O-N 3.37Å; T120-K135 WeakPolarHBondContact O-CE 3.43Å
121	I	89.1	Confident	89.2	Confident	26 Å²	26	43.8 Å²	43.8	13%	0.133	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-50.9	172.6	-56.7	177.8	0	0	0	108.3	G117 A133 T134 K135 L137 Y145	G117-I121 PolarHBondContact O-N 3.26Å; I121-A133 CarbonylContact O-C 3.51Å; I121-A133 WeakPolarHBondContact O-CA 3.33Å; I121-T134 PolarHBondContact O-N 3.38Å; I121-T134 PolarHBondContact O-OG1 2.58Å; I121-K135 HydrophobicContact CG1-CD 4.37Å; I121-L137 HydrophobicContact CG2-CD2 3.43Å; I121-L137 VanDerWaalsContact CG2-CD2 3.43Å; I121-Y145 HydrophobicContact CD1-CE1 3.71Å
122	F	91.4	Very high	89.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	118.2	179.9	-58.3	-72.3	0	0	0	111.2	V95 L113 G117 G119 I131 H132 A133 L137 Y145 L147 V168	V95-F122 HydrophobicContact CG2-CD1 4.07Å; V95-F122 HydrophobicContact CG2-CE1 4.1Å; L113-F122 HydrophobicContact CD2-CB 3.97Å; G117-F122 PolarHBondContact O-N 2.97Å; G119-F122 PolarHBondContact N-O 2.92Å; F122-I131 HydrophobicContact CB-CG2 4.22Å; F122-H132 WeakPolarHBondContact CA-O 3.36Å; F122-A133 HydrophobicContact CD1-CB 4.3Å; F122-A133 HydrophobicContact CE1-CB 4.15Å; F122-L137 HydrophobicContact CE1-CD1 4.19Å; F122-L137 HydrophobicContact CZ-CD1 3.92Å; F122-L137 HydrophobicContact CZ-CD2 4.2Å; F122-Y145 AromaticContact CE2-CD1 3.88Å; F122-Y145 HydrophobicContact CE2-CD1 3.88Å; F122-Y145 AromaticContact CE2-CD2 3.76Å; F122-Y145 HydrophobicContact CE2-CD2 3.76Å; F122-Y145 HydrophobicContact CE2-CE1 4.36Å; F122-Y145 HydrophobicContact CE2-CE2 4.28Å; F122-Y145 AromaticContact CE2-CG 3.55Å; F122-Y145 HydrophobicContact CE2-CG 3.55Å; F122-Y145 AromaticContact CZ-CD2 3.89Å; F122-Y145 HydrophobicContact CZ-CD2 3.89Å; F122-Y145 HydrophobicContact CZ-CE2 4.29Å; F122-Y145 HydrophobicContact CZ-CG 4.16Å; F122-L147 HydrophobicContact CB-CD1 4.12Å; F122-L147 HydrophobicContact CD2-CD1 3.88Å; F122-L147 HydrophobicContact CG-CD1 3.99Å; F122-V168 HydrophobicContact CE1-CB 4.4Å; F122-V168 HydrophobicContact CE1-CG1 3.88Å; F122-V168 HydrophobicContact CE1-CG2 4.37Å; F122-V168 HydrophobicContact CZ-CB 4.14Å; F122-V168 HydrophobicContact CZ-CG1 3.84Å; F122-V168 HydrophobicContact CZ-CG2 4.45Å
123	V	91.7	Very high	89.1	Confident	60 Å²	60	42.8 Å²	42.8	36%	0.364	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.9	-179	-179.1	0	0	0	0	109.9	H132 T134	V123-H132 PolarHBondContact N-O 3.31Å; V123-H132 PolarHBondContact O-N 2.78Å; V123-T134 HydrophobicContact CB-CG2 3.94Å; V123-T134 HydrophobicContact CG2-CG2 3.63Å
124	I	91.8	Very high	88.9	Confident	26 Å²	26	44.5 Å²	44.5	13%	0.133	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	134.3	174.5	-163.1	165	0	0	0	111	L98 L113 D126 N130 I131	L98-I124 HydrophobicContact CD1-CD1 4.09Å; L113-I124 HydrophobicContact CB-CB 3.99Å; L113-I124 HydrophobicContact CB-CG2 3.58Å; L113-I124 HydrophobicContact CD2-CB 4.33Å; I124-D126 PolarHBondContact O-N 3.01Å; I124-N130 CarbonylContact C-O 3.56Å; I124-N130 WeakPolarHBondContact CA-O 3.48Å; I124-I131 HydrophobicContact CB-CG1 4.21Å; I124-I131 HydrophobicContact CD1-CD1 4.44Å; I124-I131 HydrophobicContact CD1-CG1 3.87Å; I124-I131 HydrophobicContact CG1-CG1 3.9Å
125	D	90.8	Very high	88.6	Confident	58 Å²	58	47.2 Å²	47.2	31%	0.31	28%	0.279	S	S	.	.			trans	-71.2	115.6	164.8	173.8	-16.8	0	0	0	108.9	K127 T128 G129 N130	D125-K127 PolarHBondContact O-N 3.04Å; D125-K127 VanDerWaalsContact O-N 3.09Å; D125-K127 WeakPolarHBondContact OD1-CB 3.23Å; D125-K127 PolarHBondContact OD1-N 2.96Å; D125-T128 VanDerWaalsContact CB-OG1 3.27Å; D125-T128 WeakPolarHBondContact CB-OG1 3.28Å; D125-T128 PolarHBondContact O-N 2.84Å; D125-T128 PolarHBondContact OD1-N 3.35Å; D125-T128 WeakPolarHBondContact OD2-CB 3.36Å; D125-T128 WeakPolarHBondContact OD2-CG2 3.35Å; D125-T128 PolarHBondContact OD2-OG1 2.9Å; D125-G129 WeakPolarHBondContact O-CA 3.08Å; D125-G129 PolarHBondContact O-N 3.37Å; D125-N130 HydrophobicContact CB-CB 4.42Å; D125-N130 PolarHBondContact N-O 3.19Å
126	D	90.4	Very high	88.5	Confident	53 Å²	53	49.1 Å²	49.1	28%	0.283	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-11.3	-173.6	101.3	-39	0	0	0	114.2	K110 Y111 I124 R154	K110-D126 WeakPolarHBondContact CA-O 3.42Å; K110-D126 HydrophobicContact CG-CB 4.05Å; K110-D126 WeakPolarHBondContact CG-OD2 3.48Å; Y111-D126 PolarHBondContact N-O 2.87Å; Y111-D126 VanDerWaalsContact N-O 3.08Å; I124-D126 PolarHBondContact O-N 3.01Å; D126-R154 VanDerWaalsContact CG-NH1 3.27Å; D126-R154 PolarHBondContact O-NH2 2.79Å; D126-R154 IonicContact OD1-CZ 2.69Å; D126-R154 IonicContact OD1-NH1 2.7Å; D126-R154 PolarHBondContact OD1-NH1 3.1Å; D126-R154 IonicContact OD1-NH2 2.69Å; D126-R154 IonicContact OD2-CZ 3.33Å; D126-R154 IonicContact OD2-NH1 3.53Å; D126-R154 PolarHBondContact OD2-NH1 3.1Å; D126-R154 IonicContact OD2-NH2 2.95Å
127	K	87.3	Confident	88.4	Confident	137 Å²	137	45.4 Å²	45.4	60%	0.596	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-44.8	176	-70	159.7	-169.4	167.6	0	113.1	D125	D125-K127 PolarHBondContact O-N 3.04Å; D125-K127 VanDerWaalsContact O-N 3.09Å; D125-K127 WeakPolarHBondContact OD1-CB 3.23Å; D125-K127 PolarHBondContact OD1-N 2.96Å
128	T	86.8	Confident	88.6	Confident	45 Å²	45	47.9 Å²	47.9	28%	0.276	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-24	-175.8	66.4	0	0	0	0	113	R97 D125 N130	R97-T128 VanDerWaalsContact CZ-O 3.24Å; R97-T128 PolarHBondContact NE-O 2.99Å; R97-T128 PolarHBondContact NH2-O 3.03Å; D125-T128 VanDerWaalsContact CB-OG1 3.27Å; D125-T128 WeakPolarHBondContact CB-OG1 3.28Å; D125-T128 PolarHBondContact O-N 2.84Å; D125-T128 PolarHBondContact OD1-N 3.35Å; D125-T128 WeakPolarHBondContact OD2-CB 3.36Å; D125-T128 WeakPolarHBondContact OD2-CG2 3.35Å; D125-T128 PolarHBondContact OD2-OG1 2.9Å; T128-N130 VanDerWaalsContact C-N 3.25Å; T128-N130 WeakPolarHBondContact OG1-CB 3.33Å; T128-N130 PolarHBondContact OG1-N 3.34Å
129	G	85.8	Confident	88.7	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.267	C	S	.	.			trans	77.8	6.1	-172.4	0	0	0	0	0	114	R97 L98 D125 I131	R97-G129 WeakPolarHBondContact CA-O 3.03Å; L98-G129 PolarHBondContact N-O 2.91Å; D125-G129 WeakPolarHBondContact O-CA 3.08Å; D125-G129 PolarHBondContact O-N 3.37Å; G129-I131 PolarHBondContact O-N 3.49Å
130	N	89.1	Confident	89	Confident	39 Å²	39	48.6 Å²	48.6	21%	0.209	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	125.5	173.9	-71	1.5	0	0	0	110.3	L94 R97 I124 D125 T128 H132	L94-N130 HydrophobicContact CD1-CB 3.76Å; R97-N130 WeakPolarHBondContact CD-OD1 3.47Å; R97-N130 VanDerWaalsContact CG-OD1 3.28Å; R97-N130 WeakPolarHBondContact CG-OD1 3.28Å; R97-N130 PolarHBondContact NE-OD1 3.35Å; I124-N130 CarbonylContact C-O 3.56Å; I124-N130 WeakPolarHBondContact CA-O 3.48Å; D125-N130 HydrophobicContact CB-CB 4.42Å; D125-N130 PolarHBondContact N-O 3.19Å; T128-N130 VanDerWaalsContact C-N 3.25Å; T128-N130 WeakPolarHBondContact OG1-CB 3.33Å; T128-N130 PolarHBondContact OG1-N 3.34Å; N130-H132 VanDerWaalsContact CB-CE1 3.47Å; N130-H132 WeakPolarHBondContact CB-CE1 3.28Å
131	I	89.5	Confident	89.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	127.4	173.1	-58.5	169.4	0	0	0	108.1	F81 V95 G96 L98 L113 F122 I124 G129 F166	F81-I131 HydrophobicContact CE2-CD1 4.4Å; V95-I131 HydrophobicContact CB-CG2 4.22Å; V95-I131 PolarHBondContact N-O 3.24Å; G96-I131 PolarHBondContact N-O 2.95Å; G96-I131 PolarHBondContact O-N 3.46Å; L98-I131 HydrophobicContact CD1-CD1 3.84Å; L98-I131 HydrophobicContact CG-CD1 3.89Å; L113-I131 HydrophobicContact CD2-CG2 4.21Å; F122-I131 HydrophobicContact CB-CG2 4.22Å; I124-I131 HydrophobicContact CB-CG1 4.21Å; I124-I131 HydrophobicContact CD1-CD1 4.44Å; I124-I131 HydrophobicContact CD1-CG1 3.87Å; I124-I131 HydrophobicContact CG1-CG1 3.9Å; G129-I131 PolarHBondContact O-N 3.49Å; I131-F166 HydrophobicContact CD1-CE1 4.44Å; I131-F166 HydrophobicContact CD1-CE2 4.22Å; I131-F166 HydrophobicContact CD1-CZ 3.63Å
132	H	89.7	Confident	89.2	Confident	43 Å²	43	54.1 Å²	54.1	20%	0.199	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	143.5	174.3	-46.5	78.3	0	0	0	110.9	P92 V93 F122 V123 N130	P92-H132 HydrophobicContact CB-CB 3.81Å; P92-H132 HydrophobicContact CG-CB 4.04Å; V93-H132 CarbonylContact O-C 3.6Å; V93-H132 WeakPolarHBondContact O-CA 3.41Å; V93-H132 WeakPolarHBondContact O-CB 3.46Å; F122-H132 WeakPolarHBondContact CA-O 3.36Å; V123-H132 PolarHBondContact N-O 3.31Å; V123-H132 PolarHBondContact O-N 2.78Å; N130-H132 VanDerWaalsContact CB-CE1 3.47Å; N130-H132 WeakPolarHBondContact CB-CE1 3.28Å
133	A	89.9	Confident	89	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.008	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	130.6	163	0	0	0	0	0	108.1	P92 V93 V95 I121 F122	P92-A133 CarbonylContact C-O 3.54Å; P92-A133 WeakPolarHBondContact CA-O 3.5Å; P92-A133 VanDerWaalsContact CB-O 3.31Å; P92-A133 WeakPolarHBondContact CB-O 3.27Å; V93-A133 HydrophobicContact CB-CB 4.44Å; V93-A133 PolarHBondContact N-O 3.45Å; V93-A133 PolarHBondContact O-N 3.33Å; V95-A133 HydrophobicContact CG2-CB 3.89Å; I121-A133 CarbonylContact O-C 3.51Å; I121-A133 WeakPolarHBondContact O-CA 3.33Å; F122-A133 HydrophobicContact CD1-CB 4.3Å; F122-A133 HydrophobicContact CE1-CB 4.15Å
134	T	86.5	Confident	89	Confident	59 Å²	59	57.8 Å²	57.8	36%	0.362	29%	0.294	S	S	.	.			trans	-111.9	20	-177.6	63.1	0	0	0	0	112.6	P92 I121 V123	P92-T134 HydrophobicContact CB-CG2 3.91Å; I121-T134 PolarHBondContact O-N 3.38Å; I121-T134 PolarHBondContact O-OG1 2.58Å; V123-T134 HydrophobicContact CB-CG2 3.94Å; V123-T134 HydrophobicContact CG2-CG2 3.63Å
135	K	85.9	Confident	89	Confident	115 Å²	115	57 Å²	57	50%	0.5	29%	0.289	S	S	.	.	S	Bend	trans	-152.6	159.5	175.7	-63.6	-171.2	-177.7	179.5	0	108.2	T120 I121	T120-K135 WeakPolarHBondContact O-CE 3.43Å; I121-K135 HydrophobicContact CG1-CD 4.37Å
136	T	86.4	Confident	89	Confident	92 Å²	92	56.3 Å²	56.3	56%	0.564	29%	0.288	S	S	*	.			trans	-57.7	152.3	156.5	47.1	0	0	0	0	110.4
137	L	88.6	Confident	89	Confident	9 Å²	9	53.8 Å²	53.8	5%	0.047	27%	0.274	C	S	.	.			trans	-115.3	159.8	170.7	-55.6	-179.6	0	0	0	108.1	V83 E85 E86 I121 F122 Y145 V170	V83-L137 HydrophobicContact CB-CD1 3.89Å; V83-L137 HydrophobicContact CG1-CD1 3.69Å; V83-L137 HydrophobicContact CG2-CD1 4.48Å; E85-L137 WeakPolarHBondContact CB-O 3.31Å; E86-L137 PolarHBondContact N-O 2.04Å; I121-L137 HydrophobicContact CG2-CD2 3.43Å; I121-L137 VanDerWaalsContact CG2-CD2 3.43Å; F122-L137 HydrophobicContact CE1-CD1 4.19Å; F122-L137 HydrophobicContact CZ-CD1 3.92Å; F122-L137 HydrophobicContact CZ-CD2 4.2Å; L137-Y145 HydrophobicContact CD2-CE2 4.25Å; L137-V170 HydrophobicContact CB-CG1 4.37Å; L137-V170 HydrophobicContact CB-CG2 4.24Å; L137-V170 HydrophobicContact CD1-CG2 4.02Å
138	D	89.8	Confident	89.1	Confident	71 Å²	71	49.1 Å²	49.1	38%	0.38	26%	0.257	S	S	.	.			trans	-142.1	123.7	-175.7	166.9	-28.2	0	0	0	105.1	E140 E141 Q142	D138-E140 WeakPolarHBondContact OD1-CA 3.46Å; D138-E140 WeakPolarHBondContact OD1-CB 3.36Å; D138-E140 PolarHBondContact OD1-N 2.94Å; D138-E141 HydrophobicContact CB-CB 4.24Å; D138-E141 PolarHBondContact OD1-N 2.67Å; D138-Q142 PolarHBondContact O-N 3.33Å
139	R	90.9	Very high	89.2	Confident	31 Å²	31	47.4 Å²	47.4	12%	0.117	25%	0.248	C	C	.	.	H	α-helix	trans	-83.3	-26.2	-173.2	-161.9	-163.9	63.1	35.9	-5.1	111.5	E85 A143 V170 D172 A207	E85-R139 WeakPolarHBondContact OE2-CB 3.29Å; E85-R139 PolarHBondContact OE2-N 2.88Å; R139-A143 HydrophobicContact CG-CB 3.65Å; R139-A143 WeakPolarHBondContact O-CA 3.5Å; R139-A143 PolarHBondContact O-N 3.45Å; R139-V170 HydrophobicContact CB-CB 4.25Å; R139-V170 HydrophobicContact CB-CG1 3.78Å; R139-V170 HydrophobicContact CG-CB 4.04Å; R139-V170 HydrophobicContact CG-CG1 4.05Å; R139-D172 IonicContact CZ-OD1 2.81Å; R139-D172 IonicContact NE-OD1 2.73Å; R139-D172 PolarHBondContact NE-OD1 2.03Å; R139-D172 IonicContact NH2-OD1 3Å; R139-D172 PolarHBondContact NH2-OD1 3.38Å; R139-A207 PolarHBondContact NH2-O 2.98Å
140	E	90.5	Very high	89.4	Confident	68 Å²	68	50.3 Å²	50.3	32%	0.318	26%	0.261	S	S	.	.	H	α-helix	trans	-70.4	-39.2	176.1	-75.2	47.5	-107.6	0	0	110.3	D138 A207	D138-E140 WeakPolarHBondContact OD1-CA 3.46Å; D138-E140 WeakPolarHBondContact OD1-CB 3.36Å; D138-E140 PolarHBondContact OD1-N 2.94Å; E140-A207 HydrophobicContact CG-CB 3.87Å; E140-A207 VanDerWaalsContact OE1-O 3.13Å
141	E	90.2	Very high	89.4	Confident	161 Å²	161	48.8 Å²	48.8	75%	0.752	25%	0.254	S	S	*	.	H	α-helix	trans	-71.5	-54.2	168.9	-174.5	175.7	-137.2	0	0	110.7	D138	D138-E141 HydrophobicContact CB-CB 4.24Å; D138-E141 PolarHBondContact OD1-N 2.67Å
142	Q	89.6	Confident	89.4	Confident	69 Å²	69	49 Å²	49	32%	0.322	26%	0.255	S	S	.	.	H	α-helix	trans	-153.4	91.5	-179.7	-174.1	164.9	-3.7	0	0	115	D138 Q144 Y145 V170	D138-Q142 PolarHBondContact O-N 3.33Å; Q142-Q144 VanDerWaalsContact C-N 3.25Å; Q142-Q144 VanDerWaalsContact CG-O 3.28Å; Q142-Q144 WeakPolarHBondContact CG-O 3.27Å; Q142-Q144 PolarHBondContact NE2-O 2.81Å; Q142-Q144 PolarHBondContact O-N 2.81Å; Q142-Q144 VanDerWaalsContact O-N 3.08Å; Q142-Y145 HydrophobicContact CB-CE1 4.33Å; Q142-Y145 HydrophobicContact CB-CE2 4.27Å; Q142-Y145 HydrophobicContact CG-CD1 4.28Å; Q142-Y145 HydrophobicContact CG-CD2 4.4Å; Q142-Y145 HydrophobicContact CG-CE1 3.92Å; Q142-Y145 HydrophobicContact CG-CE2 4.02Å; Q142-Y145 WeakPolarHBondContact O-CE2 3.4Å; Q142-Y145 VanDerWaalsContact OE1-CE1 3.3Å; Q142-V170 WeakPolarHBondContact O-CG2 3.32Å
143	A	88.3	Confident	89.4	Confident	45 Å²	45	47.5 Å²	47.5	37%	0.372	25%	0.25	S	S	.	.	S	Bend	trans	-56.5	-22.4	177.7	0	0	0	0	0	117.2	R139 V170	R139-A143 HydrophobicContact CG-CB 3.65Å; R139-A143 WeakPolarHBondContact O-CA 3.5Å; R139-A143 PolarHBondContact O-N 3.45Å; A143-V170 PolarHBondContact O-N 3.49Å
144	Q	91.4	Very high	89.2	Confident	92 Å²	92	51 Å²	51	43%	0.43	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	150.7	176.7	64.8	172.3	20.3	0	0	113.8	Q142 I167 V168 K169	Q142-Q144 VanDerWaalsContact C-N 3.25Å; Q142-Q144 VanDerWaalsContact CG-O 3.28Å; Q142-Q144 WeakPolarHBondContact CG-O 3.27Å; Q142-Q144 PolarHBondContact NE2-O 2.81Å; Q142-Q144 PolarHBondContact O-N 2.81Å; Q142-Q144 VanDerWaalsContact O-N 3.08Å; Q144-I167 HydrophobicContact CB-CG2 3.82Å; Q144-I167 HydrophobicContact CG-CG2 4.47Å; Q144-V168 CarbonylContact C-O 3.52Å; Q144-V168 WeakPolarHBondContact CA-O 3.34Å; Q144-K169 HydrophobicContact CB-CG 4.34Å
145	Y	91.4	Very high	89.2	Confident	8 Å²	8	54.7 Å²	54.7	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	131	179.5	-61.8	-97.2	0	0	0	111	E116 I121 F122 L137 Q142 I167 V168 V170	E116-Y145 HydrophobicContact CB-CD1 4.23Å; I121-Y145 HydrophobicContact CD1-CE1 3.71Å; F122-Y145 AromaticContact CE2-CD1 3.88Å; F122-Y145 HydrophobicContact CE2-CD1 3.88Å; F122-Y145 AromaticContact CE2-CD2 3.76Å; F122-Y145 HydrophobicContact CE2-CD2 3.76Å; F122-Y145 HydrophobicContact CE2-CE1 4.36Å; F122-Y145 HydrophobicContact CE2-CE2 4.28Å; F122-Y145 AromaticContact CE2-CG 3.55Å; F122-Y145 HydrophobicContact CE2-CG 3.55Å; F122-Y145 AromaticContact CZ-CD2 3.89Å; F122-Y145 HydrophobicContact CZ-CD2 3.89Å; F122-Y145 HydrophobicContact CZ-CE2 4.29Å; F122-Y145 HydrophobicContact CZ-CG 4.16Å; L137-Y145 HydrophobicContact CD2-CE2 4.25Å; Q142-Y145 HydrophobicContact CB-CE1 4.33Å; Q142-Y145 HydrophobicContact CB-CE2 4.27Å; Q142-Y145 HydrophobicContact CG-CD1 4.28Å; Q142-Y145 HydrophobicContact CG-CD2 4.4Å; Q142-Y145 HydrophobicContact CG-CE1 3.92Å; Q142-Y145 HydrophobicContact CG-CE2 4.02Å; Q142-Y145 WeakPolarHBondContact O-CE2 3.4Å; Q142-Y145 VanDerWaalsContact OE1-CE1 3.3Å; Y145-I167 CarbonylContact O-C 3.57Å; Y145-I167 WeakPolarHBondContact O-CA 3.25Å; Y145-V168 PolarHBondContact N-O 3.5Å; Y145-V168 PolarHBondContact O-N 2.89Å; Y145-V170 HydrophobicContact CD2-CG2 4.35Å; Y145-V170 HydrophobicContact CE2-CG2 3.93Å
146	T	91.7	Very high	89.2	Confident	45 Å²	45	52.5 Å²	52.5	28%	0.276	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	118.2	179.5	-42.5	0	0	0	0	110.3	E116 E165	E116-T146 PolarHBondContact N-O 2.87Å; E116-T146 WeakPolarHBondContact OE2-CB 3.29Å; E116-T146 PolarHBondContact OE2-N 2.81Å; E116-T146 PolarHBondContact OE2-OG1 3.48Å; E116-T146 VanDerWaalsContact OE2-OG1 3.12Å; T146-E165 HydrophobicContact CG2-CG 4.06Å
147	L	90.1	Very high	89.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.3	-174.1	-76.7	172.8	0	0	0	111.4	L113 S114 E116 A118 F122 E165 F166 V168	L113-L147 HydrophobicContact CD1-CB 4.05Å; L113-L147 HydrophobicContact CD1-CD1 4.23Å; L113-L147 HydrophobicContact CD1-CD2 4.05Å; L113-L147 HydrophobicContact CD1-CG 4.35Å; L113-L147 HydrophobicContact CD2-CD1 4.3Å; L113-L147 HydrophobicContact CD2-CD2 4.37Å; L113-L147 HydrophobicContact CG-CD2 4.09Å; S114-L147 WeakPolarHBondContact O-CA 3.45Å; S114-L147 WeakPolarHBondContact O-CD2 3.45Å; E116-L147 WeakPolarHBondContact O-CD2 3.21Å; A118-L147 HydrophobicContact CB-CD2 3.82Å; F122-L147 HydrophobicContact CB-CD1 4.12Å; F122-L147 HydrophobicContact CD2-CD1 3.88Å; F122-L147 HydrophobicContact CG-CD1 3.99Å; L147-E165 CarbonylContact O-C 3.58Å; L147-E165 WeakPolarHBondContact O-CA 3.49Å; L147-F166 HydrophobicContact CB-CD1 4.45Å; L147-F166 HydrophobicContact CB-CD2 4.2Å; L147-F166 HydrophobicContact CB-CE1 3.94Å; L147-F166 HydrophobicContact CB-CE2 3.68Å; L147-F166 HydrophobicContact CB-CZ 3.54Å; L147-F166 HydrophobicContact CD1-CE2 3.77Å; L147-F166 HydrophobicContact CD1-CZ 3.91Å; L147-F166 HydrophobicContact CG-CE2 4.37Å; L147-F166 HydrophobicContact CG-CZ 4.38Å; L147-F166 PolarHBondContact N-O 3.1Å; L147-F166 PolarHBondContact O-N 3.35Å; L147-V168 HydrophobicContact CD1-CG2 3.78Å
148	T	90.1	Very high	89.1	Confident	39 Å²	39	57.7 Å²	57.7	24%	0.239	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124	172	-67.7	0	0	0	0	109.4	S114 P163 S164	S114-T148 PolarHBondContact N-O 3.04Å; S114-T148 PolarHBondContact O-N 2.8Å; S114-T148 VanDerWaalsContact O-O 3.12Å; S114-T148 PolarHBondContact OG-O 3.4Å; T148-P163 HydrophobicContact CG2-CB 3.77Å; T148-S164 WeakPolarHBondContact CA-O 3.45Å
149	A	88.4	Confident	88.9	Confident	9 Å²	9	58.1 Å²	58.1	7%	0.074	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	155.6	173.7	0	0	0	0	0	112.6	L98 I112 L113 P163 S164 F166	L98-A149 HydrophobicContact CD1-CB 3.15Å; I112-A149 CarbonylContact O-C 3.52Å; I112-A149 VanDerWaalsContact O-CA 3.29Å; I112-A149 WeakPolarHBondContact O-CA 3.43Å; L113-A149 HydrophobicContact CD1-CB 4.21Å; A149-P163 WeakPolarHBondContact O-CA 3.3Å; A149-S164 PolarHBondContact N-O 2.88Å; A149-S164 PolarHBondContact O-N 3.39Å; A149-F166 HydrophobicContact CB-CE1 3.88Å
150	Q	88.8	Confident	88.7	Confident	61 Å²	61	60.1 Å²	60.1	29%	0.285	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	137.3	178.8	-167.5	170.7	42.8	0	0	110.6	I112 V152	I112-Q150 PolarHBondContact N-O 3.4Å; I112-Q150 PolarHBondContact O-N 3.28Å; Q150-V152 HydrophobicContact CG-CG1 3.94Å
151	A	89.8	Confident	88.3	Confident	7 Å²	7	59.9 Å²	59.9	6%	0.058	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	125.9	168.2	0	0	0	0	0	109.3	I109 Y111 L160 E161	I109-A151 HydrophobicContact CG2-CB 4.08Å; Y111-A151 HydrophobicContact CD1-CB 4.31Å; Y111-A151 HydrophobicContact CE1-CB 4.29Å; A151-L160 PolarHBondContact O-N 2.81Å; A151-E161 HydrophobicContact CB-CB 4.2Å; A151-E161 HydrophobicContact CB-CG 3.96Å; A151-E161 PolarHBondContact O-N 2.85Å
152	V	90.6	Very high	88	Confident	3 Å²	3	56.9 Å²	56.9	2%	0.018	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	157.7	-179.3	-52.8	0	0	0	0	111.2	K110 I112 Q150 N157 E158	K110-V152 HydrophobicContact CB-CG2 3.98Å; K110-V152 HydrophobicContact CD-CG2 4.38Å; K110-V152 HydrophobicContact CG-CG2 4.4Å; K110-V152 PolarHBondContact N-O 2.93Å; K110-V152 PolarHBondContact O-N 2.88Å; I112-V152 HydrophobicContact CD1-CG1 4.2Å; I112-V152 HydrophobicContact CD1-CG2 3.69Å; I112-V152 HydrophobicContact CG1-CG2 4.29Å; Q150-V152 HydrophobicContact CG-CG1 3.94Å; V152-N157 HydrophobicContact CG2-CB 4.45Å; V152-E158 CarbonylContact C-O 3.55Å; V152-E158 VanDerWaalsContact CA-O 3.26Å; V152-E158 WeakPolarHBondContact CA-O 2.97Å; V152-E158 WeakPolarHBondContact CB-O 3.42Å
153	A	88.7	Confident	87.8	Confident	12 Å²	12	57.5 Å²	57.5	10%	0.099	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	132.5	169.5	0	0	0	0	0	110	D155 T156 N157 E158 L160	A153-D155 VanDerWaalsContact C-N 3.27Å; A153-D155 PolarHBondContact O-N 2.85Å; A153-T156 WeakPolarHBondContact CB-OG1 3.12Å; A153-N157 WeakPolarHBondContact O-CA 3.33Å; A153-N157 PolarHBondContact O-N 3.43Å; A153-E158 PolarHBondContact N-O 3.27Å; A153-L160 HydrophobicContact CB-CD1 4.21Å; A153-L160 HydrophobicContact CB-CD2 4.28Å; A153-L160 HydrophobicContact CB-CG 4.26Å
154	R	85.6	Confident	87.6	Confident	74 Å²	74	59 Å²	59	28%	0.279	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-25.3	-172.3	-176.9	173.4	-65.5	-82.7	-6.1	113.7	G107 T108 I109 K110 D126	G107-R154 VanDerWaalsContact O-CD 3.28Å; G107-R154 WeakPolarHBondContact O-CD 3.24Å; G107-R154 PolarHBondContact O-NE 2.98Å; T108-R154 VanDerWaalsContact O-CB 3.23Å; T108-R154 WeakPolarHBondContact O-CB 3.02Å; T108-R154 PolarHBondContact O-N 3.41Å; I109-R154 PolarHBondContact O-NE 2.84Å; I109-R154 PolarHBondContact O-NH2 3Å; K110-R154 HydrophobicContact CB-CB 4.2Å; K110-R154 HydrophobicContact CB-CG 4.47Å; D126-R154 VanDerWaalsContact CG-NH1 3.27Å; D126-R154 PolarHBondContact O-NH2 2.79Å; D126-R154 IonicContact OD1-CZ 2.69Å; D126-R154 IonicContact OD1-NH1 2.7Å; D126-R154 PolarHBondContact OD1-NH1 3.1Å; D126-R154 IonicContact OD1-NH2 2.69Å; D126-R154 IonicContact OD2-CZ 3.33Å; D126-R154 IonicContact OD2-NH1 3.53Å; D126-R154 PolarHBondContact OD2-NH1 3.1Å; D126-R154 IonicContact OD2-NH2 2.95Å
155	D	86.1	Confident	87.3	Confident	137 Å²	137	60.8 Å²	60.8	73%	0.733	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-44.9	-178.4	60.5	-23.6	0	0	0	113.2	A153	A153-D155 VanDerWaalsContact C-N 3.27Å; A153-D155 PolarHBondContact O-N 2.85Å
156	T	85.8	Confident	87	Confident	69 Å²	69	60.8 Å²	60.8	42%	0.423	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-20.1	180	68.5	0	0	0	0	114.3	A153 E158	A153-T156 WeakPolarHBondContact CB-OG1 3.12Å; T156-E158 PolarHBondContact O-N 2.91Å; T156-E158 WeakPolarHBondContact OG1-CB 3.32Å; T156-E158 WeakPolarHBondContact OG1-CG 3.26Å; T156-E158 PolarHBondContact OG1-N 2.77Å; T156-E158 PolarHBondContact OG1-OE2 3.23Å
157	N	85.1	Confident	86.9	Confident	84 Å²	84	60.5 Å²	60.5	45%	0.449	33%	0.333	S	S	.	.			trans	56.9	19.9	-165.3	-58.4	-97.3	0	0	0	113.9	V152 A153	V152-N157 HydrophobicContact CG2-CB 4.45Å; A153-N157 WeakPolarHBondContact O-CA 3.33Å; A153-N157 PolarHBondContact O-N 3.43Å
158	E	87.8	Confident	86.8	Confident	127 Å²	127	60.5 Å²	60.5	59%	0.593	33%	0.333	S	S	*	.			trans	-71.4	137	172.2	-70.1	171.1	138.4	0	0	110.7	V152 A153 T156 L160	V152-E158 CarbonylContact C-O 3.55Å; V152-E158 VanDerWaalsContact CA-O 3.26Å; V152-E158 WeakPolarHBondContact CA-O 2.97Å; V152-E158 WeakPolarHBondContact CB-O 3.42Å; A153-E158 PolarHBondContact N-O 3.27Å; T156-E158 PolarHBondContact O-N 2.91Å; T156-E158 WeakPolarHBondContact OG1-CB 3.32Å; T156-E158 WeakPolarHBondContact OG1-CG 3.26Å; T156-E158 PolarHBondContact OG1-N 2.77Å; T156-E158 PolarHBondContact OG1-OE2 3.23Å; E158-L160 PolarHBondContact O-N 2.91Å
159	P	86.2	Confident	86.7	Confident	80 Å²	80	61.7 Å²	61.7	52%	0.519	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-60.5	122.9	176	-25	35.4	0	0	0	112.3
160	L	86.4	Confident	86.8	Confident	72 Å²	72	61.8 Å²	61.8	38%	0.377	33%	0.334	S	S	.	.	S	Bend	trans	-89.8	-27.5	173	-65.4	175.4	0	0	0	111.5	I109 A151 A153 E158	I109-L160 HydrophobicContact CB-CD1 4.42Å; I109-L160 HydrophobicContact CD1-CD1 3.58Å; I109-L160 HydrophobicContact CG1-CD1 3.62Å; I109-L160 HydrophobicContact CG2-CD1 4.4Å; A151-L160 PolarHBondContact O-N 2.81Å; A153-L160 HydrophobicContact CB-CD1 4.21Å; A153-L160 HydrophobicContact CB-CD2 4.28Å; A153-L160 HydrophobicContact CB-CG 4.26Å; E158-L160 PolarHBondContact O-N 2.91Å
161	E	83.5	Confident	86.6	Confident	63 Å²	63	60.9 Å²	60.9	29%	0.294	33%	0.33	S	S	.	.	S	Bend	trans	-125.6	155.2	175.5	-63.1	-71.8	-168.4	0	0	110.1	S100 A151	S100-E161 WeakPolarHBondContact CB-OE1 3.46Å; S100-E161 PolarHBondContact OG-OE1 3.49Å; A151-E161 HydrophobicContact CB-CB 4.2Å; A151-E161 HydrophobicContact CB-CG 3.96Å; A151-E161 PolarHBondContact O-N 2.85Å
162	P	82.8	Confident	86.5	Confident	99 Å²	99	61.1 Å²	61.1	64%	0.643	33%	0.33	S	S	*	.			trans	-60.3	150.2	164.6	28.9	-35.1	0	0	0	110.6
163	P	85	Confident	86.3	Confident	81 Å²	81	64 Å²	64	53%	0.526	35%	0.345	S	S	.	.			trans	-62	139.3	172.4	27.9	-34	0	0	0	110.3	T148 A149	T148-P163 HydrophobicContact CG2-CB 3.77Å; A149-P163 WeakPolarHBondContact O-CA 3.3Å
164	S	83.6	Confident	86.3	Confident	77 Å²	77	65 Å²	65	54%	0.538	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	120.2	-178.5	-166.5	0	0	0	0	110.2	T148 A149	T148-S164 WeakPolarHBondContact CA-O 3.45Å; A149-S164 PolarHBondContact N-O 2.88Å; A149-S164 PolarHBondContact O-N 3.39Å
165	E	86.5	Confident	86.4	Confident	130 Å²	130	64.6 Å²	64.6	61%	0.607	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	139.5	175.4	-172.2	177.5	-101.6	0	0	110.9	T146 L147	T146-E165 HydrophobicContact CG2-CG 4.06Å; L147-E165 CarbonylContact O-C 3.58Å; L147-E165 WeakPolarHBondContact O-CA 3.49Å
166	F	84.9	Confident	86.6	Confident	7 Å²	7	60.3 Å²	60.3	3%	0.031	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	159.6	173.6	65.8	-88.4	0	0	0	109.9	N79 F81 L98 L113 I131 L147 A149 V168	N79-F166 WeakPolarHBondContact O-CA 3.22Å; F81-F166 AromaticContact CD2-CD2 3.43Å; F81-F166 HydrophobicContact CD2-CD2 3.43Å; F81-F166 VanDerWaalsContact CD2-CD2 3.43Å; F81-F166 AromaticContact CD2-CE2 3.54Å; F81-F166 HydrophobicContact CD2-CE2 3.54Å; F81-F166 HydrophobicContact CD2-CG 4.28Å; F81-F166 HydrophobicContact CD2-CZ 4.47Å; F81-F166 AromaticContact CE2-CD2 3.64Å; F81-F166 HydrophobicContact CE2-CD2 3.64Å; F81-F166 AromaticContact CE2-CE2 3.68Å; F81-F166 HydrophobicContact CE2-CE2 3.68Å; F81-F166 HydrophobicContact CE2-CG 4.11Å; F81-F166 HydrophobicContact CE2-CZ 4.21Å; L98-F166 HydrophobicContact CD1-CE1 4.07Å; L113-F166 HydrophobicContact CD1-CE1 3.96Å; L113-F166 HydrophobicContact CD1-CZ 3.67Å; I131-F166 HydrophobicContact CD1-CE1 4.44Å; I131-F166 HydrophobicContact CD1-CE2 4.22Å; I131-F166 HydrophobicContact CD1-CZ 3.63Å; L147-F166 HydrophobicContact CB-CD1 4.45Å; L147-F166 HydrophobicContact CB-CD2 4.2Å; L147-F166 HydrophobicContact CB-CE1 3.94Å; L147-F166 HydrophobicContact CB-CE2 3.68Å; L147-F166 HydrophobicContact CB-CZ 3.54Å; L147-F166 HydrophobicContact CD1-CE2 3.77Å; L147-F166 HydrophobicContact CD1-CZ 3.91Å; L147-F166 HydrophobicContact CG-CE2 4.37Å; L147-F166 HydrophobicContact CG-CZ 4.38Å; L147-F166 PolarHBondContact N-O 3.1Å; L147-F166 PolarHBondContact O-N 3.35Å; A149-F166 HydrophobicContact CB-CE1 3.88Å; F166-V168 HydrophobicContact CD2-CG2 4.3Å; F166-V168 HydrophobicContact CE2-CG2 3.87Å
167	I	88.9	Confident	86.9	Confident	39 Å²	39	60.2 Å²	60.2	20%	0.2	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	138	178	-57.7	172.4	0	0	0	108.1	N79 Q80 F81 Q144 Y145 K169	N79-I167 PolarHBondContact O-N 3.47Å; Q80-I167 CarbonylContact C-O 3.52Å; Q80-I167 VanDerWaalsContact CA-O 3.28Å; Q80-I167 WeakPolarHBondContact CA-O 3.43Å; Q80-I167 HydrophobicContact CG-CB 4.46Å; F81-I167 PolarHBondContact N-O 3.44Å; Q144-I167 HydrophobicContact CB-CG2 3.82Å; Q144-I167 HydrophobicContact CG-CG2 4.47Å; Y145-I167 CarbonylContact O-C 3.57Å; Y145-I167 WeakPolarHBondContact O-CA 3.25Å; I167-K169 HydrophobicContact CG2-CG 4.04Å
168	V	88.9	Confident	87.4	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	115.1	160	-178.4	0	0	0	0	106.6	F81 V83 V95 F122 Q144 Y145 L147 F166	F81-V168 HydrophobicContact CB-CG2 4.36Å; V83-V168 HydrophobicContact CB-CG1 4.38Å; V83-V168 HydrophobicContact CG2-CG1 3.6Å; V95-V168 HydrophobicContact CG1-CG1 4.1Å; V95-V168 HydrophobicContact CG1-CG2 4.14Å; F122-V168 HydrophobicContact CE1-CB 4.4Å; F122-V168 HydrophobicContact CE1-CG1 3.88Å; F122-V168 HydrophobicContact CE1-CG2 4.37Å; F122-V168 HydrophobicContact CZ-CB 4.14Å; F122-V168 HydrophobicContact CZ-CG1 3.84Å; F122-V168 HydrophobicContact CZ-CG2 4.45Å; Q144-V168 CarbonylContact C-O 3.52Å; Q144-V168 WeakPolarHBondContact CA-O 3.34Å; Y145-V168 PolarHBondContact N-O 3.5Å; Y145-V168 PolarHBondContact O-N 2.89Å; L147-V168 HydrophobicContact CD1-CG2 3.78Å; F166-V168 HydrophobicContact CD2-CG2 4.3Å; F166-V168 HydrophobicContact CE2-CG2 3.87Å
169	K	87.8	Confident	87.7	Confident	65 Å²	65	57.1 Å²	57.1	28%	0.283	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	135	171.9	-76.3	-178.8	168.7	175.4	0	109.7	Q80 F81 F82 V83 Q144 I167	Q80-K169 VanDerWaalsContact OE1-CE 3.27Å; F81-K169 PolarHBondContact O-N 3.01Å; F82-K169 WeakPolarHBondContact CA-O 3.33Å; F82-K169 HydrophobicContact CD1-CB 3.86Å; F82-K169 HydrophobicContact CD1-CD 4.46Å; F82-K169 HydrophobicContact CE1-CB 4Å; F82-K169 HydrophobicContact CE1-CD 3.76Å; F82-K169 HydrophobicContact CE1-CG 4.49Å; F82-K169 HydrophobicContact CZ-CD 4.39Å; V83-K169 PolarHBondContact N-O 3.02Å; Q144-K169 HydrophobicContact CB-CG 4.34Å; I167-K169 HydrophobicContact CG2-CG 4.04Å
170	V	89.2	Confident	88.1	Confident	11 Å²	11	54.9 Å²	54.9	7%	0.067	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	135.8	166.7	-174.3	0	0	0	0	107.7	V83 E85 L137 R139 Q142 A143 Y145	V83-V170 CarbonylContact O-C 3.58Å; V83-V170 VanDerWaalsContact O-CA 3.29Å; V83-V170 WeakPolarHBondContact O-CA 3.5Å; E85-V170 HydrophobicContact CB-CG1 3.59Å; L137-V170 HydrophobicContact CB-CG1 4.37Å; L137-V170 HydrophobicContact CB-CG2 4.24Å; L137-V170 HydrophobicContact CD1-CG2 4.02Å; R139-V170 HydrophobicContact CB-CB 4.25Å; R139-V170 HydrophobicContact CB-CG1 3.78Å; R139-V170 HydrophobicContact CG-CB 4.04Å; R139-V170 HydrophobicContact CG-CG1 4.05Å; Q142-V170 WeakPolarHBondContact O-CG2 3.32Å; A143-V170 PolarHBondContact O-N 3.49Å; Y145-V170 HydrophobicContact CD2-CG2 4.35Å; Y145-V170 HydrophobicContact CE2-CG2 3.93Å
171	Q	86.4	Confident	88.1	Confident	41 Å²	41	56 Å²	56	19%	0.192	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	129.3	174.8	-76.9	-174	-22.3	0	0	109.6	F82 V83 I84 E85 Y212	F82-Q171 HydrophobicContact CB-CG 4.03Å; F82-Q171 HydrophobicContact CD1-CG 3.88Å; F82-Q171 HydrophobicContact CG-CG 4.37Å; V83-Q171 PolarHBondContact O-N 3.05Å; I84-Q171 HydrophobicContact CG1-CB 4.2Å; E85-Q171 PolarHBondContact N-O 2.82Å; Q171-Y212 HydrophobicContact CB-CE1 4.27Å; Q171-Y212 PolarHBondContact NE2-OH 2.82Å; Q171-Y212 PolarHBondContact OE1-OH 2.89Å
172	D	86.8	Confident	87.9	Confident	12 Å²	12	59.2 Å²	59.2	6%	0.064	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-63.1	133.7	-173.9	-173.5	91.2	0	0	0	113.5	E85 R139 D209 Y212 S215	E85-D172 WeakPolarHBondContact OE1-CA 3.42Å; R139-D172 IonicContact CZ-OD1 2.81Å; R139-D172 IonicContact NE-OD1 2.73Å; R139-D172 PolarHBondContact NE-OD1 2.03Å; R139-D172 IonicContact NH2-OD1 3Å; R139-D172 PolarHBondContact NH2-OD1 3.38Å; D172-D209 HydrophobicContact CB-CB 3.88Å; D172-D209 VanDerWaalsContact OD1-CB 3.3Å; D172-D209 WeakPolarHBondContact OD1-CB 3.41Å; D172-D209 PolarHBondContact OD1-N 3.21Å; D172-Y212 HydrophobicContact CB-CD1 3.81Å; D172-Y212 HydrophobicContact CB-CG 4.27Å; D172-S215 WeakPolarHBondContact OD2-CB 3.48Å; D172-S215 PolarHBondContact OD2-OG 3.11Å
173	I	86.9	Confident	87.7	Confident	65 Å²	65	57.2 Å²	57.2	33%	0.333	31%	0.313	S	S	.	.			trans	-111.4	145.4	162	-69.8	-174.7	0	0	0	108.2	I84 E85 E86 D175	I84-I173 HydrophobicContact CG2-CD1 3.61Å; I84-I173 HydrophobicContact CG2-CG1 3.71Å; E85-I173 HydrophobicContact CG-CB 4.06Å; E85-I173 HydrophobicContact CG-CD1 4.39Å; E85-I173 HydrophobicContact CG-CG1 4.11Å; E85-I173 WeakPolarHBondContact O-CD1 3.5Å; E85-I173 PolarHBondContact OE1-N 3.26Å; E86-I173 HydrophobicContact CB-CD1 4.38Å; I173-D175 VanDerWaalsContact C-N 3.34Å; I173-D175 HydrophobicContact CG2-CB 4.26Å; I173-D175 PolarHBondContact O-N 3.03Å
174	N	88.3	Confident	87.6	Confident	31 Å²	31	57 Å²	57	17%	0.166	31%	0.311	C	S	.	.			trans	-80.6	75.7	175.1	-168.1	126.5	0	0	0	111	D208 S215 D261 M262	N174-D208 WeakPolarHBondContact CA-OD2 3.41Å; N174-S215 VanDerWaalsContact OD1-CA 3.24Å; N174-S215 WeakPolarHBondContact OD1-CA 3.41Å; N174-S215 WeakPolarHBondContact OD1-CB 3.37Å; N174-S215 PolarHBondContact OD1-O 3.27Å; N174-D261 PolarHBondContact ND2-OD2 2.79Å; N174-M262 HydrophobicContact CB-CG 4.5Å; N174-M262 WeakPolarHBondContact OD1-CG 3.32Å
175	D	87.9	Confident	88.1	Confident	66 Å²	66	54.3 Å²	54.3	35%	0.353	29%	0.29	S	S	.	.			trans	-106.7	-23	-178.4	81.4	-41.6	0	0	0	114.5	I173 L269	I173-D175 VanDerWaalsContact C-N 3.34Å; I173-D175 HydrophobicContact CG2-CB 4.26Å; I173-D175 PolarHBondContact O-N 3.03Å; D175-L269 WeakPolarHBondContact O-CD1 3.4Å
176	N	90.5	Very high	88.5	Confident	48 Å²	48	55.7 Å²	55.7	26%	0.257	29%	0.29	S	S	.	.	S	Bend	trans	-87	131.3	176.5	-59	-84.8	0	0	0	111.7	A207 D208	N176-A207 HydrophobicContact CB-CB 3.83Å; N176-D208 VanDerWaalsContact CB-OD1 3.25Å; N176-D208 WeakPolarHBondContact CB-OD1 3.19Å; N176-D208 PolarHBondContact N-OD1 3.16Å; N176-D208 PolarHBondContact ND2-OD1 2.8Å
177	P	92.6	Very high	89	Confident	66 Å²	66	55.6 Å²	55.6	43%	0.429	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-81.1	148.8	174.3	32.4	-34	0	0	0	111.8	E179 L269	P177-E179 PolarHBondContact O-N 3.41Å; P177-L269 HydrophobicContact CB-CB 4.08Å; P177-L269 HydrophobicContact CB-CD1 4.29Å
178	P	94.6	Very high	89.3	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.019	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-55.9	127.8	173.5	-25.8	31.3	0	0	0	113.3	D206 L218 A259 D261 G271	P178-D206 WeakPolarHBondContact CG-OD2 3.18Å; P178-L218 HydrophobicContact CB-CD2 3.61Å; P178-L218 HydrophobicContact CG-CD2 3.44Å; P178-L218 VanDerWaalsContact CG-CD2 3.44Å; P178-A259 HydrophobicContact CB-CB 4.02Å; P178-D261 HydrophobicContact CG-CB 3.89Å; P178-G271 WeakPolarHBondContact O-CA 3.26Å; P178-G271 PolarHBondContact O-N 3.5Å
179	E	94.3	Very high	89.7	Confident	143 Å²	143	62.9 Å²	62.9	67%	0.668	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	136.4	176	-66.7	-151.4	141.9	0	0	112.4	P177 A204 T205	P177-E179 PolarHBondContact O-N 3.41Å; E179-A204 CarbonylContact O-C 3.59Å; E179-A204 WeakPolarHBondContact O-CA 3.36Å; E179-A204 WeakPolarHBondContact O-CB 3.22Å; E179-T205 PolarHBondContact N-O 2.88Å; E179-T205 PolarHBondContact O-N 3.29Å
180	F	94	Very high	89.9	Confident	34 Å²	34	62.4 Å²	62.4	15%	0.149	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	123.1	175.4	-79.3	-86.6	0	0	0	111.5	H182 Y185 V202 A204 Y220 I257 A259 T273	F180-H182 PolarHBondContact O-N 2.9Å; F180-H182 VanDerWaalsContact O-N 3.11Å; F180-Y185 HydrophobicContact CD1-CE2 4.21Å; F180-V202 HydrophobicContact CD1-CB 4.37Å; F180-V202 HydrophobicContact CE1-CB 4.06Å; F180-V202 HydrophobicContact CE1-CG2 3.87Å; F180-A204 HydrophobicContact CD1-CB 3.87Å; F180-A204 HydrophobicContact CD2-CB 4.26Å; F180-A204 HydrophobicContact CE1-CB 3.94Å; F180-A204 HydrophobicContact CE2-CB 4.32Å; F180-A204 HydrophobicContact CG-CB 4.05Å; F180-A204 HydrophobicContact CZ-CB 4.17Å; F180-Y220 HydrophobicContact CE1-CD1 4.33Å; F180-Y220 AromaticContact CE1-CE1 3.9Å; F180-Y220 HydrophobicContact CE1-CE1 3.9Å; F180-Y220 HydrophobicContact CZ-CD1 4.34Å; F180-Y220 HydrophobicContact CZ-CE1 4.21Å; F180-I257 HydrophobicContact CZ-CB 4.45Å; F180-I257 HydrophobicContact CZ-CG2 4.12Å; F180-A259 HydrophobicContact CE1-CB 4.43Å; F180-A259 HydrophobicContact CE2-CB 3.79Å; F180-A259 HydrophobicContact CZ-CB 3.6Å; F180-T273 HydrophobicContact CB-CG2 4.42Å; F180-T273 HydrophobicContact CD1-CG2 3.53Å; F180-T273 HydrophobicContact CD2-CG2 3.81Å; F180-T273 HydrophobicContact CE1-CG2 3.57Å; F180-T273 HydrophobicContact CE2-CG2 3.85Å; F180-T273 HydrophobicContact CG-CG2 3.65Å; F180-T273 HydrophobicContact CZ-CG2 3.72Å
181	L	86.3	Confident	90.1	Very high	94 Å²	94	61.9 Å²	61.9	49%	0.492	32%	0.316	S	S	.	.	S	Bend	trans	-59	-29.5	-173.7	-70	175.8	0	0	0	114.1	T203 T205	L181-T203 HydrophobicContact CD1-CG2 3.83Å; L181-T203 PolarHBondContact N-O 2.95Å; L181-T203 VanDerWaalsContact N-O 3.12Å; L181-T205 HydrophobicContact CD1-CG2 4.01Å; L181-T205 HydrophobicContact CD2-CG2 3.86Å; L181-T205 VanDerWaalsContact CD2-OG1 3.3Å; L181-T205 WeakPolarHBondContact CD2-OG1 3.37Å; L181-T205 HydrophobicContact CG-CG2 4.03Å
182	H	78.9	Confident	90.2	Very high	132 Å²	132	61.8 Å²	61.8	61%	0.611	32%	0.317	S	S	*	.	S	Bend	trans	-137	145.9	-178.1	-54.8	-29.5	0	0	0	109.4	F180 Y185	F180-H182 PolarHBondContact O-N 2.9Å; F180-H182 VanDerWaalsContact O-N 3.11Å; H182-Y185 HydrophobicContact CB-CE1 3.91Å; H182-Y185 WeakPolarHBondContact O-CE2 3.38Å; H182-Y185 PolarHBondContact O-OH 2.88Å
183	G	79.3	Confident	90.4	Very high	57 Å²	57	62.1 Å²	62.1	59%	0.588	32%	0.32	S	S	*	.			trans	-176.2	149.2	176.1	0	0	0	0	0	112.6
184	P	83.6	Confident	90.7	Very high	75 Å²	75	65.4 Å²	65.4	49%	0.487	34%	0.338	S	S	.	.	S	Bend	cis	-69.8	153.9	-8.6	30.8	-35.9	0	0	0	112.4	Y186	P184-Y186 HydrophobicContact CB-CE2 4.49Å; P184-Y186 HydrophobicContact CG-CE2 3.92Å; P184-Y186 WeakPolarHBondContact CG-OH 3.15Å
185	Y	93.3	Very high	91	Very high	22 Å²	22	67.9 Å²	67.9	9%	0.086	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	145.6	176.3	-70.3	-84.5	0	0	0	111.7	F180 H182 V202 T203 T273 E274 V275 K276	F180-Y185 HydrophobicContact CD1-CE2 4.21Å; H182-Y185 HydrophobicContact CB-CE1 3.91Å; H182-Y185 WeakPolarHBondContact O-CE2 3.38Å; H182-Y185 PolarHBondContact O-OH 2.88Å; Y185-V202 HydrophobicContact CD1-CG1 4.18Å; Y185-V202 HydrophobicContact CD2-CB 4.48Å; Y185-V202 HydrophobicContact CD2-CG1 3.68Å; Y185-V202 HydrophobicContact CE1-CG1 4.12Å; Y185-V202 HydrophobicContact CE2-CB 3.9Å; Y185-V202 HydrophobicContact CE2-CG1 3.59Å; Y185-V202 HydrophobicContact CG-CG1 3.97Å; Y185-T203 PolarHBondContact OH-N 3.5Å; Y185-T203 PolarHBondContact OH-O 2.88Å; Y185-T273 HydrophobicContact CD2-CG2 3.96Å; Y185-T273 HydrophobicContact CE2-CG2 3.86Å; Y185-E274 PolarHBondContact N-O 2.83Å; Y185-V275 HydrophobicContact CD2-CG2 4.16Å; Y185-V275 HydrophobicContact CG-CG2 4.42Å; Y185-V275 WeakPolarHBondContact O-CA 3.27Å; Y185-K276 PolarHBondContact O-N 3.26Å
186	Y	95.5	Very high	91.2	Very high	159 Å²	159	66.3 Å²	66.3	62%	0.624	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126	131.4	172.5	-59	-81.2	0	0	0	110	P184 K276	P184-Y186 HydrophobicContact CB-CE2 4.49Å; P184-Y186 HydrophobicContact CG-CE2 3.92Å; P184-Y186 WeakPolarHBondContact CG-OH 3.15Å; Y186-K276 WeakPolarHBondContact CA-O 3.32Å; Y186-K276 HydrophobicContact CD1-CB 3.94Å; Y186-K276 HydrophobicContact CD1-CD 4.34Å; Y186-K276 HydrophobicContact CD1-CG 4.44Å; Y186-K276 HydrophobicContact CE1-CB 4.16Å; Y186-K276 HydrophobicContact CE1-CD 4.23Å
187	A	95	Very high	91.5	Very high	5 Å²	5	66.2 Å²	66.2	4%	0.041	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	155.9	179.5	0	0	0	0	0	112	V199 M200 K276 I277 T278	A187-V199 HydrophobicContact CB-CG1 3.8Å; A187-M200 HydrophobicContact CB-CB 3.87Å; A187-M200 HydrophobicContact CB-CE 4.17Å; A187-M200 HydrophobicContact CB-CG 4.45Å; A187-K276 PolarHBondContact N-O 2.89Å; A187-I277 HydrophobicContact CB-CG1 4.37Å; A187-I277 WeakPolarHBondContact O-CA 3.43Å; A187-T278 PolarHBondContact O-N 3.34Å
188	R	96.1	Very high	91.6	Very high	187 Å²	187	66.4 Å²	66.4	71%	0.706	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.2	131.7	-178.5	-66.3	-173.6	77.4	-168.4	2.3	109.4	T278 T280	R188-T278 WeakPolarHBondContact CA-O 3.4Å; R188-T280 HydrophobicContact CB-CG2 3.71Å; R188-T280 HydrophobicContact CG-CG2 4.32Å
189	V	95.7	Very high	91.7	Very high	4 Å²	4	67.1 Å²	67.1	2%	0.024	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	138.6	179.1	62.1	0	0	0	0	109.6	T197 V199 F229 T240 I277 T278 L279 T280	V189-T197 HydrophobicContact CG2-CG2 4.14Å; V189-V199 HydrophobicContact CB-CG1 4.19Å; V189-V199 HydrophobicContact CB-CG2 4.11Å; V189-V199 HydrophobicContact CG1-CG1 4.38Å; V189-V199 HydrophobicContact CG1-CG2 4.31Å; V189-V199 HydrophobicContact CG2-CG2 4.07Å; V189-F229 HydrophobicContact CG1-CE1 4.5Å; V189-T240 HydrophobicContact CG2-CG2 4.21Å; V189-I277 HydrophobicContact CG1-CG2 3.96Å; V189-T278 PolarHBondContact N-O 3.45Å; V189-L279 HydrophobicContact CG1-CD2 3.75Å; V189-L279 CarbonylContact O-C 3.56Å; V189-L279 WeakPolarHBondContact O-CA 3.39Å; V189-T280 PolarHBondContact O-N 3.06Å
190	P	92.9	Very high	91.7	Very high	55 Å²	55	63.5 Å²	63.5	36%	0.357	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	141.4	173.6	-24.8	35.2	0	0	0	111.9	S193 T280 V282	P190-S193 VanDerWaalsContact O-CB 3.26Å; P190-S193 WeakPolarHBondContact O-CB 3.48Å; P190-S193 PolarHBondContact O-OG 2.86Å; P190-T280 WeakPolarHBondContact CA-O 3.3Å; P190-T280 VanDerWaalsContact CA-OG1 3.26Å; P190-T280 WeakPolarHBondContact CA-OG1 3.33Å; P190-V282 HydrophobicContact CB-CG2 4.04Å
191	E	93.1	Very high	91.8	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	166.5	166.3	72.8	-167.2	111.2	0	0	112	S193 M245 R247 L279 T280 D281 V282	E191-S193 PolarHBondContact O-N 2.94Å; E191-M245 WeakPolarHBondContact CB-O 3.34Å; E191-R247 VanDerWaalsContact CD-CB 3.5Å; E191-R247 WeakPolarHBondContact OE1-CB 3.38Å; E191-R247 IonicContact OE1-NE 2.82Å; E191-R247 WeakPolarHBondContact OE2-CB 3.02Å; E191-R247 PolarHBondContact OE2-N 2.61Å; E191-L279 HydrophobicContact CB-CB 4.41Å; E191-L279 HydrophobicContact CB-CD1 4.15Å; E191-T280 PolarHBondContact N-O 3.48Å; E191-D281 WeakPolarHBondContact OE1-CA 3.36Å; E191-V282 HydrophobicContact CG-CB 3.79Å; E191-V282 HydrophobicContact CG-CG2 3.93Å; E191-V282 PolarHBondContact OE1-N 2.9Å
192	M	88.8	Confident	92.2	Very high	39 Å²	39	62.2 Å²	62.2	19%	0.192	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	18.1	-167.9	-53.6	-157.9	-177.2	0	0	114.8	N194 M245 D284 F379 W382	M192-N194 PolarHBondContact O-N 3Å; M192-M245 PolarHBondContact N-O 3.47Å; M192-D284 HydrophobicContact CE-CB 3.84Å; M192-D284 VanDerWaalsContact CE-CG 3.42Å; M192-D284 WeakPolarHBondContact CE-OD2 3.32Å; M192-D284 HydrophobicContact SD-CB 4.35Å; M192-F379 HydrophobicContact SD-CE1 3.86Å; M192-W382 HydrophobicContact CE-CH2 4.4Å; M192-W382 HydrophobicContact CE-CZ3 4.16Å; M192-W382 HydrophobicContact SD-CH2 3.65Å; M192-W382 HydrophobicContact SD-CZ3 3.84Å
193	S	91.3	Very high	92.9	Very high	19 Å²	19	58.6 Å²	58.6	13%	0.133	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-59.5	134.4	175.3	-79.1	0	0	0	0	111.5	P190 E191	P190-S193 VanDerWaalsContact O-CB 3.26Å; P190-S193 WeakPolarHBondContact O-CB 3.48Å; P190-S193 PolarHBondContact O-OG 2.86Å; E191-S193 PolarHBondContact O-N 2.94Å
194	N	92.1	Very high	93.6	Very high	134 Å²	134	56.2 Å²	56.2	72%	0.717	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-55.3	144.4	174.9	-69.8	-44.8	0	0	0	111.1	M192 G196 T197 T240	M192-N194 PolarHBondContact O-N 3Å; N194-G196 PolarHBondContact O-N 3.37Å; N194-T197 VanDerWaalsContact O-CB 3.3Å; N194-T197 WeakPolarHBondContact O-CB 3.48Å; N194-T197 PolarHBondContact O-N 2.71Å; N194-T197 PolarHBondContact O-OG1 2.76Å; N194-T240 PolarHBondContact O-OG1 2.97Å
195	V	94.6	Very high	94	Very high	83 Å²	83	55.9 Å²	55.9	50%	0.503	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	135.9	172.6	177.2	0	0	0	0	110.4	P243	V195-P243 HydrophobicContact CG2-CB 3.88Å; V195-P243 HydrophobicContact CG2-CG 4.33Å
196	G	93.8	Very high	94	Very high	34 Å²	34	56.4 Å²	56.4	35%	0.351	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.6	-3	-176	0	0	0	0	0	114.9	N194 S198 R239 T240	N194-G196 PolarHBondContact O-N 3.37Å; G196-S198 PolarHBondContact O-N 3.3Å; G196-R239 PolarHBondContact O-NH1 2.93Å; G196-T240 PolarHBondContact N-O 2.89Å; G196-T240 PolarHBondContact N-OG1 3.47Å
197	T	95.3	Very high	93.8	Very high	46 Å²	46	51.1 Å²	51.1	28%	0.282	29%	0.29	S	S	.	.			trans	-59.4	125.9	174.4	-64.1	0	0	0	0	109.7	V189 N194 R239 T240	V189-T197 HydrophobicContact CG2-CG2 4.14Å; N194-T197 VanDerWaalsContact O-CB 3.3Å; N194-T197 WeakPolarHBondContact O-CB 3.48Å; N194-T197 PolarHBondContact O-N 2.71Å; N194-T197 PolarHBondContact O-OG1 2.76Å; T197-R239 CarbonylContact O-C 3.58Å; T197-R239 WeakPolarHBondContact O-CA 3.12Å; T197-T240 WeakPolarHBondContact CB-OG1 3.36Å; T197-T240 PolarHBondContact N-OG1 3.13Å; T197-T240 VanDerWaalsContact N-OG1 3.12Å; T197-T240 PolarHBondContact O-N 2.94Å
198	S	95.9	Very high	93.6	Very high	70 Å²	70	51.1 Å²	51.1	49%	0.49	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	130.7	179.6	-166.7	0	0	0	0	110.5	G196 I237	G196-S198 PolarHBondContact O-N 3.3Å; S198-I237 WeakPolarHBondContact OG-CG2 3.37Å
199	V	95.9	Very high	93	Very high	18 Å²	18	44.3 Å²	44.3	11%	0.109	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-52.2	-175.2	-179.2	0	0	0	0	111.6	A187 V189 F229 I238 T240 I277	A187-V199 HydrophobicContact CB-CG1 3.8Å; V189-V199 HydrophobicContact CB-CG1 4.19Å; V189-V199 HydrophobicContact CB-CG2 4.11Å; V189-V199 HydrophobicContact CG1-CG1 4.38Å; V189-V199 HydrophobicContact CG1-CG2 4.31Å; V189-V199 HydrophobicContact CG2-CG2 4.07Å; V199-F229 HydrophobicContact CG2-CD1 4.28Å; V199-F229 HydrophobicContact CG2-CE1 4.15Å; V199-I238 PolarHBondContact N-O 3.08Å; V199-T240 HydrophobicContact CG2-CG2 4.17Å; V199-I277 HydrophobicContact CG1-CD1 4.17Å; V199-I277 HydrophobicContact CG1-CG2 3.87Å
200	M	94.6	Very high	92	Very high	67 Å²	67	48.2 Å²	48.2	33%	0.33	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	155.8	-179	-177.4	54	74.6	0	0	109.1	A187 I238	A187-M200 HydrophobicContact CB-CB 3.87Å; A187-M200 HydrophobicContact CB-CE 4.17Å; A187-M200 HydrophobicContact CB-CG 4.45Å; M200-I238 PolarHBondContact O-N 2.93Å
201	Q	94.9	Very high	91.1	Very high	101 Å²	101	51.5 Å²	51.5	47%	0.472	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	127.1	164.9	-172.1	175	3.1	0	0	108.6	T235 I237	Q201-T235 WeakPolarHBondContact CG-O 3.32Å; Q201-T235 PolarHBondContact NE2-O 2.91Å; Q201-I237 HydrophobicContact CB-CG1 4.05Å; Q201-I237 HydrophobicContact CG-CG1 3.8Å
202	V	94.9	Very high	90	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	33%	0.331	C	S	.	.			trans	-100.4	148.9	168.3	-62.4	0	0	0	0	109.6	F180 Y185 Y220 G236 I238 I257 V275	F180-V202 HydrophobicContact CD1-CB 4.37Å; F180-V202 HydrophobicContact CE1-CB 4.06Å; F180-V202 HydrophobicContact CE1-CG2 3.87Å; Y185-V202 HydrophobicContact CD1-CG1 4.18Å; Y185-V202 HydrophobicContact CD2-CB 4.48Å; Y185-V202 HydrophobicContact CD2-CG1 3.68Å; Y185-V202 HydrophobicContact CE1-CG1 4.12Å; Y185-V202 HydrophobicContact CE2-CB 3.9Å; Y185-V202 HydrophobicContact CE2-CG1 3.59Å; Y185-V202 HydrophobicContact CG-CG1 3.97Å; V202-Y220 HydrophobicContact CG2-CD1 4.35Å; V202-Y220 HydrophobicContact CG2-CE1 4.44Å; V202-G236 PolarHBondContact N-O 3.19Å; V202-I238 HydrophobicContact CG1-CD1 4.04Å; V202-I257 HydrophobicContact CG2-CB 4.38Å; V202-I257 HydrophobicContact CG2-CG1 4.28Å; V202-I257 HydrophobicContact CG2-CG2 3.93Å; V202-V275 HydrophobicContact CG1-CG2 3.87Å
203	T	94.4	Very high	88.9	Confident	56 Å²	56	57 Å²	57	34%	0.344	35%	0.348	S	S	.	.			trans	-134.6	119	-177	-52.6	0	0	0	0	109.2	L181 Y185	L181-T203 HydrophobicContact CD1-CG2 3.83Å; L181-T203 PolarHBondContact N-O 2.95Å; L181-T203 VanDerWaalsContact N-O 3.12Å; Y185-T203 PolarHBondContact OH-N 3.5Å; Y185-T203 PolarHBondContact OH-O 2.88Å
204	A	94.1	Very high	87.8	Confident	6 Å²	6	59.9 Å²	59.9	5%	0.05	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	155.2	162.2	0	0	0	0	0	110.2	E179 F180 L218 Y220 A259	E179-A204 CarbonylContact O-C 3.59Å; E179-A204 WeakPolarHBondContact O-CA 3.36Å; E179-A204 WeakPolarHBondContact O-CB 3.22Å; F180-A204 HydrophobicContact CD1-CB 3.87Å; F180-A204 HydrophobicContact CD2-CB 4.26Å; F180-A204 HydrophobicContact CE1-CB 3.94Å; F180-A204 HydrophobicContact CE2-CB 4.32Å; F180-A204 HydrophobicContact CG-CB 4.05Å; F180-A204 HydrophobicContact CZ-CB 4.17Å; A204-L218 HydrophobicContact CB-CD1 3.82Å; A204-L218 WeakPolarHBondContact O-CD1 3.35Å; A204-Y220 HydrophobicContact CB-CE1 4.19Å; A204-Y220 PolarHBondContact N-OH 3.12Å; A204-Y220 PolarHBondContact O-OH 2.82Å; A204-A259 HydrophobicContact CB-CB 3.57Å
205	T	92.8	Very high	87	Confident	69 Å²	69	53.7 Å²	53.7	42%	0.423	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	159.6	170.5	42.9	0	0	0	0	108.9	E179 L181	E179-T205 PolarHBondContact N-O 2.88Å; E179-T205 PolarHBondContact O-N 3.29Å; L181-T205 HydrophobicContact CD1-CG2 4.01Å; L181-T205 HydrophobicContact CD2-CG2 3.86Å; L181-T205 VanDerWaalsContact CD2-OG1 3.3Å; L181-T205 WeakPolarHBondContact CD2-OG1 3.37Å; L181-T205 HydrophobicContact CG-CG2 4.03Å
206	D	93.2	Very high	86.4	Confident	32 Å²	32	50.4 Å²	50.4	17%	0.171	31%	0.31	C	S	.	.			trans	-137.8	148.3	-175.8	-159.3	-45.9	0	0	0	106.3	P178 D208 A216 L218	P178-D206 WeakPolarHBondContact CG-OD2 3.18Å; D206-D208 PolarHBondContact OD1-N 2.95Å; D206-A216 HydrophobicContact CB-CB 3.65Å; D206-L218 HydrophobicContact CB-CD2 4.05Å; D206-L218 HydrophobicContact CB-CG 4.37Å; D206-L218 WeakPolarHBondContact OD2-CD2 3.4Å
207	A	91.4	Very high	86.1	Confident	49 Å²	49	54.2 Å²	54.2	41%	0.405	31%	0.314	S	S	.	.	S	Bend	trans	-90.8	-25.6	-174.9	0	0	0	0	0	112	R139 E140 N176	R139-A207 PolarHBondContact NH2-O 2.98Å; E140-A207 HydrophobicContact CG-CB 3.87Å; E140-A207 VanDerWaalsContact OE1-O 3.13Å; N176-A207 HydrophobicContact CB-CB 3.83Å
208	D	90.3	Very high	86	Confident	5 Å²	5	53.3 Å²	53.3	3%	0.027	31%	0.307	C	S	.	.	S	Bend	trans	-68.3	172.1	-173.9	-55	-9.5	0	0	0	112.5	N174 N176 D206 P210 A216	N174-D208 WeakPolarHBondContact CA-OD2 3.41Å; N176-D208 VanDerWaalsContact CB-OD1 3.25Å; N176-D208 WeakPolarHBondContact CB-OD1 3.19Å; N176-D208 PolarHBondContact N-OD1 3.16Å; N176-D208 PolarHBondContact ND2-OD1 2.8Å; D206-D208 PolarHBondContact OD1-N 2.95Å; D208-P210 VanDerWaalsContact O-CD 3.29Å; D208-P210 WeakPolarHBondContact O-CD 3.33Å; D208-A216 HydrophobicContact CB-CB 4Å; D208-A216 WeakPolarHBondContact O-CB 3.48Å
209	D	84.3	Confident	85.9	Confident	44 Å²	44	51.5 Å²	51.5	24%	0.235	29%	0.293	C	S	.	.			trans	-80.9	117	-175.9	-174.7	-19.4	0	0	0	109	D172 T211 Y212	D172-D209 HydrophobicContact CB-CB 3.88Å; D172-D209 VanDerWaalsContact OD1-CB 3.3Å; D172-D209 WeakPolarHBondContact OD1-CB 3.41Å; D172-D209 PolarHBondContact OD1-N 3.21Å; D209-T211 PolarHBondContact O-N 2.77Å; D209-T211 VanDerWaalsContact O-N 3.14Å; D209-T211 WeakPolarHBondContact OD1-CA 3.27Å; D209-T211 VanDerWaalsContact OD1-CB 3.3Å; D209-T211 WeakPolarHBondContact OD1-CB 3.33Å; D209-T211 PolarHBondContact OD1-N 3.26Å; D209-T211 PolarHBondContact OD1-OG1 3.27Å; D209-T211 PolarHBondContact OD2-OG1 2.98Å; D209-Y212 PolarHBondContact OD1-N 2.76Å
210	P	74.4	Confident	85.9	Confident	86 Å²	86	51.5 Å²	51.5	56%	0.558	29%	0.291	S	S	*	.	S	Bend	trans	-72.2	-5.4	179	30.5	-36.1	0	0	0	113.2	D208 A216	D208-P210 VanDerWaalsContact O-CD 3.29Å; D208-P210 WeakPolarHBondContact O-CD 3.33Å; P210-A216 HydrophobicContact CB-CB 4.18Å
211	T	74.1	Confident	86	Confident	124 Å²	124	50.4 Å²	50.4	76%	0.761	29%	0.29	S	S	*	.	S	Bend	trans	-108.1	-27.2	-177.6	76.8	0	0	0	0	113.9	D209	D209-T211 PolarHBondContact O-N 2.77Å; D209-T211 VanDerWaalsContact O-N 3.14Å; D209-T211 WeakPolarHBondContact OD1-CA 3.27Å; D209-T211 VanDerWaalsContact OD1-CB 3.3Å; D209-T211 WeakPolarHBondContact OD1-CB 3.33Å; D209-T211 PolarHBondContact OD1-N 3.26Å; D209-T211 PolarHBondContact OD1-OG1 3.27Å; D209-T211 PolarHBondContact OD2-OG1 2.98Å
212	Y	68.7	Low	86	Confident	103 Å²	103	46.8 Å²	46.8	40%	0.404	27%	0.274	S	S	.	.	S	Bend	trans	-96	141.4	171.4	-158.2	-99.4	0	0	0	109.7	Q171 D172 D209 N214 S215	Q171-Y212 HydrophobicContact CB-CE1 4.27Å; Q171-Y212 PolarHBondContact NE2-OH 2.82Å; Q171-Y212 PolarHBondContact OE1-OH 2.89Å; D172-Y212 HydrophobicContact CB-CD1 3.81Å; D172-Y212 HydrophobicContact CB-CG 4.27Å; D209-Y212 PolarHBondContact OD1-N 2.76Å; Y212-N214 PolarHBondContact O-N 3.41Å; Y212-S215 PolarHBondContact O-N 3.01Å; Y212-S215 VanDerWaalsContact O-N 3.14Å; Y212-S215 PolarHBondContact O-OG 3.29Å
213	G	65.4	Low	86	Confident	52 Å²	52	51.6 Å²	51.6	54%	0.536	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	-27.1	-178.5	0	0	0	0	0	117.3	S215	G213-S215 VanDerWaalsContact C-N 3.35Å
214	N	69.8	Low	86.1	Confident	78 Å²	78	54 Å²	54	42%	0.417	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	67	26.2	-148.1	-51.9	-108.3	0	0	0	113.1	Y212 R217 M262	Y212-N214 PolarHBondContact O-N 3.41Å; N214-R217 HydrophobicContact CB-CB 3.89Å; N214-R217 WeakPolarHBondContact O-CB 3.3Å; N214-R217 PolarHBondContact O-N 3.05Å; N214-R217 VanDerWaalsContact O-N 3.15Å; N214-M262 WeakPolarHBondContact O-CA 3.4Å
215	S	74.9	Confident	86	Confident	4 Å²	4	54.3 Å²	54.3	3%	0.028	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-71.1	-172.5	-48.9	0	0	0	0	111.2	D172 N174 Y212 G213 R217 D261 M262	D172-S215 WeakPolarHBondContact OD2-CB 3.48Å; D172-S215 PolarHBondContact OD2-OG 3.11Å; N174-S215 VanDerWaalsContact OD1-CA 3.24Å; N174-S215 WeakPolarHBondContact OD1-CA 3.41Å; N174-S215 WeakPolarHBondContact OD1-CB 3.37Å; N174-S215 PolarHBondContact OD1-O 3.27Å; Y212-S215 PolarHBondContact O-N 3.01Å; Y212-S215 VanDerWaalsContact O-N 3.14Å; Y212-S215 PolarHBondContact O-OG 3.29Å; G213-S215 VanDerWaalsContact C-N 3.35Å; S215-R217 PolarHBondContact O-N 3.19Å; S215-D261 WeakPolarHBondContact O-CB 3.26Å; S215-M262 PolarHBondContact O-N 2.79Å
216	A	81.6	Confident	86	Confident	15 Å²	15	56 Å²	56	12%	0.124	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	17	175.6	0	0	0	0	0	115.9	D206 D208 P210 L218	D206-A216 HydrophobicContact CB-CB 3.65Å; D208-A216 HydrophobicContact CB-CB 4Å; D208-A216 WeakPolarHBondContact O-CB 3.48Å; P210-A216 HydrophobicContact CB-CB 4.18Å; A216-L218 PolarHBondContact O-N 2.94Å; A216-L218 VanDerWaalsContact O-N 3.09Å
217	R	88	Confident	86	Confident	114 Å²	114	58.1 Å²	58.1	43%	0.43	33%	0.328	S	S	.	.			trans	-83.9	87.6	179.9	-167.7	-173.4	168.6	179.8	-5.2	111.6	N214 S215 Q234 G263	N214-R217 HydrophobicContact CB-CB 3.89Å; N214-R217 WeakPolarHBondContact O-CB 3.3Å; N214-R217 PolarHBondContact O-N 3.05Å; N214-R217 VanDerWaalsContact O-N 3.15Å; S215-R217 PolarHBondContact O-N 3.19Å; R217-Q234 VanDerWaalsContact NH2-OE1 3.14Å; R217-G263 VanDerWaalsContact O-CA 3.32Å; R217-G263 WeakPolarHBondContact O-CA 3.11Å; R217-G263 PolarHBondContact O-N 3.23Å
218	L	92.4	Very high	86.2	Confident	27 Å²	27	59.1 Å²	59.1	14%	0.141	32%	0.322	C	S	.	.			trans	-64.3	141.3	-178.4	-57.5	-174.5	0	0	0	115.2	P178 A204 D206 A216 Y220 Q234 K260 D261	P178-L218 HydrophobicContact CB-CD2 3.61Å; P178-L218 HydrophobicContact CG-CD2 3.44Å; P178-L218 VanDerWaalsContact CG-CD2 3.44Å; A204-L218 HydrophobicContact CB-CD1 3.82Å; A204-L218 WeakPolarHBondContact O-CD1 3.35Å; D206-L218 HydrophobicContact CB-CD2 4.05Å; D206-L218 HydrophobicContact CB-CG 4.37Å; D206-L218 WeakPolarHBondContact OD2-CD2 3.4Å; A216-L218 PolarHBondContact O-N 2.94Å; A216-L218 VanDerWaalsContact O-N 3.09Å; L218-Y220 HydrophobicContact CB-CE2 4.44Å; L218-Q234 PolarHBondContact O-NE2 2.66Å; L218-K260 CarbonylContact C-O 3.46Å; L218-K260 WeakPolarHBondContact CA-O 3.42Å; L218-D261 HydrophobicContact CD2-CB 4.5Å
219	V	94.3	Very high	86.6	Confident	32 Å²	32	58.9 Å²	58.9	19%	0.194	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	126.5	167.6	178.9	0	0	0	0	109.7	P233 K260 G263	V219-P233 WeakPolarHBondContact CA-O 3.44Å; V219-P233 HydrophobicContact CG1-CB 3.94Å; V219-K260 PolarHBondContact N-O 3.06Å; V219-K260 PolarHBondContact O-N 2.96Å; V219-G263 WeakPolarHBondContact CG2-O 3.4Å
220	Y	95.9	Very high	87.1	Confident	18 Å²	18	58.8 Å²	58.8	7%	0.071	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	137.9	-179.2	-63.1	-90.2	0	0	0	112	F180 V202 A204 L218 P233 I257 Q258 A259	F180-Y220 HydrophobicContact CE1-CD1 4.33Å; F180-Y220 AromaticContact CE1-CE1 3.9Å; F180-Y220 HydrophobicContact CE1-CE1 3.9Å; F180-Y220 HydrophobicContact CZ-CD1 4.34Å; F180-Y220 HydrophobicContact CZ-CE1 4.21Å; V202-Y220 HydrophobicContact CG2-CD1 4.35Å; V202-Y220 HydrophobicContact CG2-CE1 4.44Å; A204-Y220 HydrophobicContact CB-CE1 4.19Å; A204-Y220 PolarHBondContact N-OH 3.12Å; A204-Y220 PolarHBondContact O-OH 2.82Å; L218-Y220 HydrophobicContact CB-CE2 4.44Å; Y220-P233 PolarHBondContact N-O 2.96Å; Y220-P233 WeakPolarHBondContact O-CA 3.25Å; Y220-I257 HydrophobicContact CD1-CG2 4.24Å; Y220-Q258 CarbonylContact C-O 3.41Å; Y220-Q258 WeakPolarHBondContact CA-O 3.49Å; Y220-A259 HydrophobicContact CD1-CB 4.11Å; Y220-A259 HydrophobicContact CE1-CB 3.95Å
221	S	95.9	Very high	88.2	Confident	43 Å²	43	55.6 Å²	55.6	30%	0.301	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	164.9	175.5	88.6	0	0	0	0	112.1	I257 Q258	S221-I257 WeakPolarHBondContact O-CA 3.29Å; S221-I257 WeakPolarHBondContact O-CG2 3.38Å; S221-Q258 PolarHBondContact N-O 2.85Å; S221-Q258 PolarHBondContact O-N 2.98Å; S221-Q258 PolarHBondContact OG-OE1 2.83Å
222	I	96.2	Very high	89.3	Confident	25 Å²	25	53.1 Å²	53.1	13%	0.128	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	118.9	176.8	-58.2	-158.4	0	0	0	109.4	Q224 Q226 F229 V231 V255 I257	I222-Q224 WeakPolarHBondContact CG2-O 3.25Å; I222-Q226 HydrophobicContact CG2-CG 4.31Å; I222-F229 HydrophobicContact CD1-CB 4.23Å; I222-V231 HydrophobicContact CD1-CB 4.08Å; I222-V231 HydrophobicContact CD1-CG1 4.43Å; I222-V231 HydrophobicContact CG1-CB 3.83Å; I222-V231 HydrophobicContact CG1-CG1 3.67Å; I222-V255 HydrophobicContact CD1-CG1 4.24Å; I222-V255 HydrophobicContact CG2-CG1 4.19Å; I222-I257 HydrophobicContact CD1-CD1 3.94Å; I222-I257 HydrophobicContact CG1-CD1 3.73Å
223	L	94.6	Very high	90.5	Very high	102 Å²	102	51.5 Å²	51.5	53%	0.534	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-37.2	173.4	-62.6	179.4	0	0	0	111.9	V256 Q258 T272	L223-V256 HydrophobicContact CB-CB 4.38Å; L223-V256 HydrophobicContact CB-CG1 4.25Å; L223-V256 HydrophobicContact CD1-CG1 4.27Å; L223-V256 PolarHBondContact N-O 2.97Å; L223-Q258 HydrophobicContact CD1-CB 3.95Å; L223-Q258 HydrophobicContact CD1-CG 4.47Å; L223-Q258 HydrophobicContact CD2-CB 4.42Å; L223-Q258 HydrophobicContact CG-CB 3.93Å; L223-T272 HydrophobicContact CD1-CG2 3.73Å
224	Q	95.6	Very high	91.8	Very high	107 Å²	107	54.1 Å²	54.1	50%	0.5	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	137.2	178	-177.1	-179.5	-62.5	0	0	109.4	I222 D254 V255 V256	I222-Q224 WeakPolarHBondContact CG2-O 3.25Å; Q224-D254 PolarHBondContact NE2-O 2.99Å; Q224-V255 CarbonylContact O-C 3.52Å; Q224-V255 VanDerWaalsContact O-CA 3.27Å; Q224-V255 WeakPolarHBondContact O-CA 3.39Å; Q224-V255 WeakPolarHBondContact O-CG1 3.23Å; Q224-V256 HydrophobicContact CB-CB 3.95Å; Q224-V256 HydrophobicContact CB-CG2 3.97Å; Q224-V256 PolarHBondContact N-O 3.41Å; Q224-V256 PolarHBondContact O-N 2.9Å
225	G	91.7	Very high	92.9	Very high	12 Å²	12	52.6 Å²	52.6	12%	0.124	28%	0.276	C	S	.	.	S	Bend	trans	125	-12.2	-177.7	0	0	0	0	0	114.4	Y228 F229	G225-Y228 WeakPolarHBondContact O-CB 3.33Å; G225-Y228 PolarHBondContact O-N 2.61Å; G225-F229 PolarHBondContact O-N 3.49Å
226	Q	92.9	Very high	93.8	Very high	105 Å²	105	52.4 Å²	52.4	49%	0.491	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	145.4	165	-65.8	-56.7	-35.6	0	0	110.7	I222 F229	I222-Q226 HydrophobicContact CG2-CG 4.31Å; Q226-F229 PolarHBondContact NE2-O 3.14Å; Q226-F229 PolarHBondContact OE1-O 2.97Å
227	P	94.4	Very high	94.5	Very high	75 Å²	75	53.1 Å²	53.1	49%	0.487	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	cis	-90	10	-1.9	38.2	-36.9	0	0	0	113.8	A241	P227-A241 WeakPolarHBondContact O-CB 2.96Å
228	Y	95.6	Very high	95	Very high	70 Å²	70	47.7 Å²	47.7	28%	0.275	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-38	-170.2	-58.8	-77	0	0	0	113.2	G225 A241 L242 M245 Y253	G225-Y228 WeakPolarHBondContact O-CB 3.33Å; G225-Y228 PolarHBondContact O-N 2.61Å; Y228-A241 PolarHBondContact O-N 3.32Å; Y228-L242 HydrophobicContact CD1-CB 4.4Å; Y228-L242 HydrophobicContact CD1-CD2 3.57Å; Y228-L242 HydrophobicContact CE1-CD2 3.64Å; Y228-L242 PolarHBondContact O-N 2.94Å; Y228-M245 HydrophobicContact CD1-CE 3.93Å; Y228-M245 HydrophobicContact CD1-SD 4.42Å; Y228-M245 HydrophobicContact CG-CE 4.21Å; Y228-Y253 HydrophobicContact CD1-CD1 4.31Å; Y228-Y253 AromaticContact CD1-CE1 3.49Å; Y228-Y253 HydrophobicContact CD1-CE1 3.49Å; Y228-Y253 VanDerWaalsContact CD1-CE1 3.49Å; Y228-Y253 AromaticContact CD2-CD1 3.88Å; Y228-Y253 HydrophobicContact CD2-CD1 3.88Å; Y228-Y253 AromaticContact CD2-CE1 3.74Å; Y228-Y253 HydrophobicContact CD2-CE1 3.74Å; Y228-Y253 AromaticContact CE1-CE1 3.68Å; Y228-Y253 HydrophobicContact CE1-CE1 3.68Å; Y228-Y253 HydrophobicContact CE2-CD1 4.32Å; Y228-Y253 AromaticContact CE2-CE1 3.92Å; Y228-Y253 HydrophobicContact CE2-CE1 3.92Å; Y228-Y253 AromaticContact CG-CD1 3.87Å; Y228-Y253 HydrophobicContact CG-CD1 3.87Å; Y228-Y253 AromaticContact CG-CE1 3.51Å; Y228-Y253 HydrophobicContact CG-CE1 3.51Å; Y228-Y253 AromaticContact CZ-CE1 3.89Å
229	F	97.1	Very high	95.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	157.3	-178.1	-58.6	-82	0	0	0	112.1	V189 V199 I222 G225 Q226 I238 R239 T240 M245 Y253 V255 I277	V189-F229 HydrophobicContact CG1-CE1 4.5Å; V199-F229 HydrophobicContact CG2-CD1 4.28Å; V199-F229 HydrophobicContact CG2-CE1 4.15Å; I222-F229 HydrophobicContact CD1-CB 4.23Å; G225-F229 PolarHBondContact O-N 3.49Å; Q226-F229 PolarHBondContact NE2-O 3.14Å; Q226-F229 PolarHBondContact OE1-O 2.97Å; F229-I238 HydrophobicContact CB-CG2 4.09Å; F229-I238 HydrophobicContact CD1-CG2 4.27Å; F229-I238 HydrophobicContact CG-CG2 4.42Å; F229-R239 CarbonylContact C-O 3.59Å; F229-R239 VanDerWaalsContact CA-O 3.25Å; F229-R239 WeakPolarHBondContact CA-O 3.16Å; F229-T240 HydrophobicContact CE1-CG2 4.43Å; F229-M245 HydrophobicContact CE1-CE 4.42Å; F229-M245 HydrophobicContact CE2-CE 3.91Å; F229-M245 HydrophobicContact CZ-CE 3.67Å; F229-M245 HydrophobicContact CZ-SD 4.33Å; F229-Y253 HydrophobicContact CE2-CD1 4.17Å; F229-Y253 HydrophobicContact CE2-CD2 4.36Å; F229-Y253 AromaticContact CE2-CG 3.83Å; F229-Y253 HydrophobicContact CE2-CG 3.83Å; F229-Y253 HydrophobicContact CZ-CG 4.41Å; F229-V255 HydrophobicContact CD2-CG2 3.63Å; F229-V255 HydrophobicContact CE2-CG2 4.07Å; F229-V255 HydrophobicContact CG-CG2 4.36Å; F229-I277 HydrophobicContact CD1-CD1 3.83Å; F229-I277 HydrophobicContact CD2-CD1 4.02Å; F229-I277 HydrophobicContact CE1-CD1 3.73Å; F229-I277 HydrophobicContact CE1-CG2 3.94Å; F229-I277 HydrophobicContact CE2-CB 4.4Å; F229-I277 HydrophobicContact CE2-CD1 3.93Å; F229-I277 HydrophobicContact CG-CD1 3.98Å; F229-I277 HydrophobicContact CZ-CB 4.01Å; F229-I277 HydrophobicContact CZ-CD1 3.78Å; F229-I277 HydrophobicContact CZ-CG1 4.48Å; F229-I277 HydrophobicContact CZ-CG2 3.67Å
230	S	96.3	Very high	95.3	Very high	43 Å²	43	48.5 Å²	48.5	30%	0.301	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	158.7	168.3	58.3	0	0	0	0	109.8	I238 R239	S230-I238 CarbonylContact O-C 3.54Å; S230-I238 WeakPolarHBondContact O-CA 3.2Å; S230-R239 PolarHBondContact N-O 3.47Å; S230-R239 PolarHBondContact O-N 2.83Å
231	V	97.1	Very high	95.3	Very high	18 Å²	18	49.1 Å²	49.1	11%	0.109	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139.6	172.1	74.3	0	0	0	0	109.2	I222 P233 I237 I238 I257	I222-V231 HydrophobicContact CD1-CB 4.08Å; I222-V231 HydrophobicContact CD1-CG1 4.43Å; I222-V231 HydrophobicContact CG1-CB 3.83Å; I222-V231 HydrophobicContact CG1-CG1 3.67Å; V231-P233 WeakPolarHBondContact O-CD 3.23Å; V231-I237 WeakPolarHBondContact CA-O 3.34Å; V231-I238 HydrophobicContact CG2-CG1 4.13Å; V231-I257 HydrophobicContact CB-CD1 4.48Å
232	E	96.4	Very high	95.2	Very high	73 Å²	73	50 Å²	50	34%	0.341	26%	0.264	S	S	.	.			trans	-79.5	111.9	176.8	-178.9	164.9	-149	0	0	109.8	Q234 T235 G236 I237 R239	E232-Q234 PolarHBondContact O-N 3.19Å; E232-T235 VanDerWaalsContact CB-OG1 3.27Å; E232-T235 WeakPolarHBondContact CB-OG1 3.49Å; E232-T235 HydrophobicContact CG-CG2 4.19Å; E232-T235 WeakPolarHBondContact CG-OG1 3.25Å; E232-T235 PolarHBondContact O-N 3.3Å; E232-T235 VanDerWaalsContact O-N 3.08Å; E232-T235 PolarHBondContact OE2-OG1 2.69Å; E232-T235 VanDerWaalsContact OE2-OG1 3.12Å; E232-G236 PolarHBondContact O-N 2.91Å; E232-I237 HydrophobicContact CB-CB 4.26Å; E232-I237 PolarHBondContact N-O 2.96Å; E232-R239 IonicContact OE2-CZ 2.97Å; E232-R239 IonicContact OE2-NE 3.51Å; E232-R239 IonicContact OE2-NH2 3.97Å; E232-R239 PolarHBondContact OE2-NH2 2.86Å
233	P	95.1	Very high	94.9	Very high	68 Å²	68	52.3 Å²	52.3	44%	0.442	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-8.9	-159.2	-25	35.4	0	0	0	116.8	V219 Y220 V231	V219-P233 WeakPolarHBondContact CA-O 3.44Å; V219-P233 HydrophobicContact CG1-CB 3.94Å; Y220-P233 PolarHBondContact N-O 2.96Å; Y220-P233 WeakPolarHBondContact O-CA 3.25Å; V231-P233 WeakPolarHBondContact O-CD 3.23Å
234	Q	91.6	Very high	94.6	Very high	108 Å²	108	53.4 Å²	53.4	51%	0.505	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112	-8.6	177.9	-59.2	-68.2	-108.1	0	0	113.3	R217 L218 E232	R217-Q234 VanDerWaalsContact NH2-OE1 3.14Å; L218-Q234 PolarHBondContact O-NE2 2.66Å; E232-Q234 PolarHBondContact O-N 3.19Å
235	T	93.8	Very high	94.6	Very high	46 Å²	46	48.9 Å²	48.9	28%	0.282	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	-18.7	-174.9	64.8	0	0	0	0	113.6	Q201 E232 I237	Q201-T235 WeakPolarHBondContact CG-O 3.32Å; Q201-T235 PolarHBondContact NE2-O 2.91Å; E232-T235 VanDerWaalsContact CB-OG1 3.27Å; E232-T235 WeakPolarHBondContact CB-OG1 3.49Å; E232-T235 HydrophobicContact CG-CG2 4.19Å; E232-T235 WeakPolarHBondContact CG-OG1 3.25Å; E232-T235 PolarHBondContact O-N 3.3Å; E232-T235 VanDerWaalsContact O-N 3.08Å; E232-T235 PolarHBondContact OE2-OG1 2.69Å; E232-T235 VanDerWaalsContact OE2-OG1 3.12Å; T235-I237 PolarHBondContact O-N 3.28Å; T235-I237 WeakPolarHBondContact OG1-CB 3.21Å; T235-I237 WeakPolarHBondContact OG1-CG1 3.02Å; T235-I237 PolarHBondContact OG1-N 3.35Å
236	G	93.6	Very high	94.7	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.275	C	S	.	.			trans	72.4	10.7	-173.2	0	0	0	0	0	113.7	V202 E232 I238	V202-G236 PolarHBondContact N-O 3.19Å; E232-G236 PolarHBondContact O-N 2.91Å; G236-I238 PolarHBondContact O-N 3.46Å
237	I	96.8	Very high	94.8	Very high	29 Å²	29	47.4 Å²	47.4	15%	0.149	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	114.9	178.1	-63.3	171	0	0	0	109.7	S198 Q201 V231 E232 T235 R239	S198-I237 WeakPolarHBondContact OG-CG2 3.37Å; Q201-I237 HydrophobicContact CB-CG1 4.05Å; Q201-I237 HydrophobicContact CG-CG1 3.8Å; V231-I237 WeakPolarHBondContact CA-O 3.34Å; E232-I237 HydrophobicContact CB-CB 4.26Å; E232-I237 PolarHBondContact N-O 2.96Å; T235-I237 PolarHBondContact O-N 3.28Å; T235-I237 WeakPolarHBondContact OG1-CB 3.21Å; T235-I237 WeakPolarHBondContact OG1-CG1 3.02Å; T235-I237 PolarHBondContact OG1-N 3.35Å; I237-R239 HydrophobicContact CG2-CG 4.1Å
238	I	96.9	Very high	94.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	133.5	174.2	-55	171.4	0	0	0	109	V199 M200 V202 F229 S230 V231 G236 I257 V275 I277	V199-I238 PolarHBondContact N-O 3.08Å; M200-I238 PolarHBondContact O-N 2.93Å; V202-I238 HydrophobicContact CG1-CD1 4.04Å; F229-I238 HydrophobicContact CB-CG2 4.09Å; F229-I238 HydrophobicContact CD1-CG2 4.27Å; F229-I238 HydrophobicContact CG-CG2 4.42Å; S230-I238 CarbonylContact O-C 3.54Å; S230-I238 WeakPolarHBondContact O-CA 3.2Å; V231-I238 HydrophobicContact CG2-CG1 4.13Å; G236-I238 PolarHBondContact O-N 3.46Å; I238-I257 HydrophobicContact CD1-CD1 3.83Å; I238-I257 HydrophobicContact CD1-CG1 3.89Å; I238-I257 HydrophobicContact CG1-CD1 4.06Å; I238-I257 HydrophobicContact CG1-CG1 4.48Å; I238-V275 HydrophobicContact CD1-CB 4.32Å; I238-V275 HydrophobicContact CD1-CG1 4.01Å; I238-V275 HydrophobicContact CD1-CG2 3.94Å; I238-I277 HydrophobicContact CG2-CD1 4.15Å
239	R	96.8	Very high	94.7	Very high	73 Å²	73	47.3 Å²	47.3	28%	0.275	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	155.7	-178.5	-58.9	178.6	-175.1	-85	-3	111.4	G196 T197 F229 S230 E232 I237	G196-R239 PolarHBondContact O-NH1 2.93Å; T197-R239 CarbonylContact O-C 3.58Å; T197-R239 WeakPolarHBondContact O-CA 3.12Å; F229-R239 CarbonylContact C-O 3.59Å; F229-R239 VanDerWaalsContact CA-O 3.25Å; F229-R239 WeakPolarHBondContact CA-O 3.16Å; S230-R239 PolarHBondContact N-O 3.47Å; S230-R239 PolarHBondContact O-N 2.83Å; E232-R239 IonicContact OE2-CZ 2.97Å; E232-R239 IonicContact OE2-NE 3.51Å; E232-R239 IonicContact OE2-NH2 3.97Å; E232-R239 PolarHBondContact OE2-NH2 2.86Å; I237-R239 HydrophobicContact CG2-CG 4.1Å
240	T	96.9	Very high	94.6	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.018	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	134.8	166.6	53.8	0	0	0	0	110.4	V189 N194 G196 T197 V199 F229	V189-T240 HydrophobicContact CG2-CG2 4.21Å; N194-T240 PolarHBondContact O-OG1 2.97Å; G196-T240 PolarHBondContact N-O 2.89Å; G196-T240 PolarHBondContact N-OG1 3.47Å; T197-T240 WeakPolarHBondContact CB-OG1 3.36Å; T197-T240 PolarHBondContact N-OG1 3.13Å; T197-T240 VanDerWaalsContact N-OG1 3.12Å; T197-T240 PolarHBondContact O-N 2.94Å; V199-T240 HydrophobicContact CG2-CG2 4.17Å; F229-T240 HydrophobicContact CE1-CG2 4.43Å
241	A	95	Very high	94.5	Very high	32 Å²	32	53.8 Å²	53.8	26%	0.264	29%	0.287	S	S	.	.			trans	-115.8	-30.4	177.9	0	0	0	0	0	112.7	P227 Y228	P227-A241 WeakPolarHBondContact O-CB 2.96Å; Y228-A241 PolarHBondContact O-N 3.32Å
242	L	94.3	Very high	94.5	Very high	62 Å²	62	56.9 Å²	56.9	33%	0.325	30%	0.3	S	S	.	.	S	Bend	trans	-96	133.1	174.9	-163.3	73.8	0	0	0	110.8	Y228 M245	Y228-L242 HydrophobicContact CD1-CB 4.4Å; Y228-L242 HydrophobicContact CD1-CD2 3.57Å; Y228-L242 HydrophobicContact CE1-CD2 3.64Å; Y228-L242 PolarHBondContact O-N 2.94Å; L242-M245 HydrophobicContact CB-CG 4.26Å
243	P	91.3	Very high	94.4	Very high	72 Å²	72	54 Å²	54	47%	0.468	29%	0.286	S	S	.	.	S	Bend	trans	-74	161.7	170.2	32.4	-34.8	0	0	0	110.9	V195 M245	V195-P243 HydrophobicContact CG2-CB 3.88Å; V195-P243 HydrophobicContact CG2-CG 4.33Å; P243-M245 VanDerWaalsContact C-N 3.26Å; P243-M245 PolarHBondContact O-N 3.31Å
244	N	88.4	Confident	94.5	Very high	126 Å²	126	52.9 Å²	52.9	67%	0.674	28%	0.277	S	S	*	.	S	Bend	trans	52.7	42.2	172.3	-53.8	5.3	0	0	0	113.1
245	M	93.9	Very high	94.7	Very high	11 Å²	11	47.8 Å²	47.8	5%	0.054	25%	0.253	C	S	.	.			trans	-65.1	139.3	163.4	-63.4	-177.6	65.3	0	0	108.9	E191 M192 Y228 F229 L242 P243 Y253 L279	E191-M245 WeakPolarHBondContact CB-O 3.34Å; M192-M245 PolarHBondContact N-O 3.47Å; Y228-M245 HydrophobicContact CD1-CE 3.93Å; Y228-M245 HydrophobicContact CD1-SD 4.42Å; Y228-M245 HydrophobicContact CG-CE 4.21Å; F229-M245 HydrophobicContact CE1-CE 4.42Å; F229-M245 HydrophobicContact CE2-CE 3.91Å; F229-M245 HydrophobicContact CZ-CE 3.67Å; F229-M245 HydrophobicContact CZ-SD 4.33Å; L242-M245 HydrophobicContact CB-CG 4.26Å; P243-M245 VanDerWaalsContact C-N 3.26Å; P243-M245 PolarHBondContact O-N 3.31Å; M245-Y253 HydrophobicContact CE-CD1 4.24Å; M245-Y253 HydrophobicContact CE-CD2 3.97Å; M245-Y253 HydrophobicContact CE-CE1 3.78Å; M245-Y253 HydrophobicContact CE-CE2 3.48Å; M245-Y253 VanDerWaalsContact CE-CE2 3.48Å; M245-Y253 HydrophobicContact CE-CG 4.32Å; M245-L279 HydrophobicContact CB-CD1 4.05Å; M245-L279 HydrophobicContact CB-CD2 4.49Å; M245-L279 HydrophobicContact CE-CD2 4.25Å
246	D	93.7	Very high	94.8	Very high	61 Å²	61	47.2 Å²	47.2	33%	0.326	25%	0.249	S	C	.	.			trans	-140.2	124.3	-156.9	159.6	-22.1	0	0	0	107.3	E248 A249 R250	D246-E248 WeakPolarHBondContact OD1-CB 3.42Å; D246-E248 PolarHBondContact OD1-N 2.86Å; D246-A249 HydrophobicContact CB-CB 4.28Å; D246-A249 WeakPolarHBondContact OD1-CB 3.14Å; D246-A249 PolarHBondContact OD1-N 3.25Å; D246-R250 CarbonylContact O-C 3.46Å; D246-R250 PolarHBondContact O-N 2.89Å
247	R	95.4	Very high	94.9	Very high	25 Å²	25	47.2 Å²	47.2	9%	0.094	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-35.3	-171.1	-169.9	-164	64	59.8	-8.2	111.9	E191 A249 R250 Q251 L279 D281 P316	E191-R247 VanDerWaalsContact CD-CB 3.5Å; E191-R247 WeakPolarHBondContact OE1-CB 3.38Å; E191-R247 IonicContact OE1-NE 2.82Å; E191-R247 WeakPolarHBondContact OE2-CB 3.02Å; E191-R247 PolarHBondContact OE2-N 2.61Å; R247-A249 PolarHBondContact O-N 3.33Å; R247-R250 CarbonylContact O-C 3.54Å; R247-R250 PolarHBondContact O-N 3.41Å; R247-Q251 HydrophobicContact CG-CB 3.73Å; R247-Q251 HydrophobicContact CG-CG 3.79Å; R247-Q251 PolarHBondContact O-N 2.77Å; R247-L279 HydrophobicContact CB-CB 4.17Å; R247-L279 HydrophobicContact CB-CD1 4.45Å; R247-L279 HydrophobicContact CG-CB 4.16Å; R247-D281 IonicContact CZ-OD1 2.56Å; R247-D281 IonicContact NE-OD1 3.9Å; R247-D281 PolarHBondContact NE-OD1 2.74Å; R247-D281 IonicContact NH2-OD1 2.84Å; R247-D281 PolarHBondContact NH2-OD1 2.9Å; R247-P316 PolarHBondContact NH2-O 3.08Å
248	E	94.3	Very high	94.8	Very high	64 Å²	64	47.7 Å²	47.7	30%	0.299	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-39.1	175.7	-75.4	47.7	-109.8	0	0	110.4	D246 P316	D246-E248 WeakPolarHBondContact OD1-CB 3.42Å; D246-E248 PolarHBondContact OD1-N 2.86Å; E248-P316 HydrophobicContact CG-CB 3.98Å; E248-P316 HydrophobicContact CG-CG 4.19Å
249	A	94	Very high	94.8	Very high	80 Å²	80	47.7 Å²	47.7	66%	0.661	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-45.9	172.9	0	0	0	0	0	112.2	D246 R247	D246-A249 HydrophobicContact CB-CB 4.28Å; D246-A249 WeakPolarHBondContact OD1-CB 3.14Å; D246-A249 PolarHBondContact OD1-N 3.25Å; R247-A249 PolarHBondContact O-N 3.33Å
250	R	94.7	Very high	94.7	Very high	107 Å²	107	46 Å²	46	40%	0.404	25%	0.245	S	C	.	.			trans	-158.3	106	178.1	-175.6	173.7	173.3	167.6	6.3	114.1	D246 R247 E252 Y253 L279	D246-R250 CarbonylContact O-C 3.46Å; D246-R250 PolarHBondContact O-N 2.89Å; R247-R250 CarbonylContact O-C 3.54Å; R247-R250 PolarHBondContact O-N 3.41Å; R250-E252 PolarHBondContact NE-O 2.91Å; R250-E252 PolarHBondContact NH2-O 3.11Å; R250-Y253 HydrophobicContact CB-CE2 4.42Å; R250-Y253 HydrophobicContact CG-CE1 4.21Å; R250-Y253 HydrophobicContact CG-CE2 4.01Å; R250-Y253 WeakPolarHBondContact O-CE2 3.45Å; R250-L279 WeakPolarHBondContact O-CD1 3.33Å
251	Q	94.7	Very high	94.4	Very high	71 Å²	71	45.8 Å²	45.8	33%	0.332	24%	0.244	S	C	.	.			trans	-74.3	-34.6	178	-178.2	172.8	-30.3	0	0	116	R247 T278 L279	R247-Q251 HydrophobicContact CG-CB 3.73Å; R247-Q251 HydrophobicContact CG-CG 3.79Å; R247-Q251 PolarHBondContact O-N 2.77Å; Q251-T278 HydrophobicContact CG-CG2 3.82Å; Q251-T278 WeakPolarHBondContact O-CA 3.31Å; Q251-L279 PolarHBondContact O-N 2.75Å
252	E	96.3	Very high	94.1	Very high	83 Å²	83	47 Å²	47	39%	0.388	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	138.3	-171.2	-77.1	-170.2	-151.6	0	0	114.8	R250 K276 T278	R250-E252 PolarHBondContact NE-O 2.91Å; R250-E252 PolarHBondContact NH2-O 3.11Å; E252-K276 WeakPolarHBondContact OE2-CD 3.12Å; E252-K276 IonicContact OE2-NZ 2.68Å; E252-K276 PolarHBondContact OE2-NZ 2.94Å; E252-T278 HydrophobicContact CG-CG2 4.21Å
253	Y	95.9	Very high	93.6	Very high	12 Å²	12	45.3 Å²	45.3	5%	0.047	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	119.5	-179.8	-64	-96.2	0	0	0	111.2	Y228 F229 M245 R250 I277 L279	Y228-Y253 HydrophobicContact CD1-CD1 4.31Å; Y228-Y253 AromaticContact CD1-CE1 3.49Å; Y228-Y253 HydrophobicContact CD1-CE1 3.49Å; Y228-Y253 VanDerWaalsContact CD1-CE1 3.49Å; Y228-Y253 AromaticContact CD2-CD1 3.88Å; Y228-Y253 HydrophobicContact CD2-CD1 3.88Å; Y228-Y253 AromaticContact CD2-CE1 3.74Å; Y228-Y253 HydrophobicContact CD2-CE1 3.74Å; Y228-Y253 AromaticContact CE1-CE1 3.68Å; Y228-Y253 HydrophobicContact CE1-CE1 3.68Å; Y228-Y253 HydrophobicContact CE2-CD1 4.32Å; Y228-Y253 AromaticContact CE2-CE1 3.92Å; Y228-Y253 HydrophobicContact CE2-CE1 3.92Å; Y228-Y253 AromaticContact CG-CD1 3.87Å; Y228-Y253 HydrophobicContact CG-CD1 3.87Å; Y228-Y253 AromaticContact CG-CE1 3.51Å; Y228-Y253 HydrophobicContact CG-CE1 3.51Å; Y228-Y253 AromaticContact CZ-CE1 3.89Å; F229-Y253 HydrophobicContact CE2-CD1 4.17Å; F229-Y253 HydrophobicContact CE2-CD2 4.36Å; F229-Y253 AromaticContact CE2-CG 3.83Å; F229-Y253 HydrophobicContact CE2-CG 3.83Å; F229-Y253 HydrophobicContact CZ-CG 4.41Å; M245-Y253 HydrophobicContact CE-CD1 4.24Å; M245-Y253 HydrophobicContact CE-CD2 3.97Å; M245-Y253 HydrophobicContact CE-CE1 3.78Å; M245-Y253 HydrophobicContact CE-CE2 3.48Å; M245-Y253 VanDerWaalsContact CE-CE2 3.48Å; M245-Y253 HydrophobicContact CE-CG 4.32Å; R250-Y253 HydrophobicContact CB-CE2 4.42Å; R250-Y253 HydrophobicContact CG-CE1 4.21Å; R250-Y253 HydrophobicContact CG-CE2 4.01Å; R250-Y253 WeakPolarHBondContact O-CE2 3.45Å; Y253-I277 PolarHBondContact N-O 2.86Å; Y253-I277 PolarHBondContact O-N 3.11Å; Y253-L279 HydrophobicContact CD2-CG 4.43Å; Y253-L279 HydrophobicContact CE2-CD1 3.94Å; Y253-L279 HydrophobicContact CE2-CD2 4.48Å; Y253-L279 HydrophobicContact CE2-CG 3.96Å
254	D	95.6	Very high	93.3	Very high	46 Å²	46	43.4 Å²	43.4	25%	0.246	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	112.1	177.1	-49.8	-51.4	0	0	0	109	Q224 K276	Q224-D254 PolarHBondContact NE2-O 2.99Å; D254-K276 WeakPolarHBondContact OD1-CE 3.2Å; D254-K276 IonicContact OD1-NZ 3.9Å; D254-K276 PolarHBondContact OD1-NZ 3.42Å; D254-K276 IonicContact OD2-NZ 2.68Å
255	V	95.9	Very high	93.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.5	-173.1	179.7	0	0	0	0	109.1	I222 Q224 F229 I257 V275 I277	I222-V255 HydrophobicContact CD1-CG1 4.24Å; I222-V255 HydrophobicContact CG2-CG1 4.19Å; Q224-V255 CarbonylContact O-C 3.52Å; Q224-V255 VanDerWaalsContact O-CA 3.27Å; Q224-V255 WeakPolarHBondContact O-CA 3.39Å; Q224-V255 WeakPolarHBondContact O-CG1 3.23Å; F229-V255 HydrophobicContact CD2-CG2 3.63Å; F229-V255 HydrophobicContact CE2-CG2 4.07Å; F229-V255 HydrophobicContact CG-CG2 4.36Å; V255-I257 HydrophobicContact CG1-CD1 3.68Å; V255-I257 HydrophobicContact CG1-CG1 4.42Å; V255-V275 HydrophobicContact CB-CB 4.37Å; V255-V275 PolarHBondContact N-O 2.9Å; V255-V275 PolarHBondContact O-N 2.95Å; V255-I277 HydrophobicContact CB-CD1 4.34Å; V255-I277 HydrophobicContact CG2-CD1 3.73Å; V255-I277 HydrophobicContact CG2-CG1 4.21Å
256	V	96.1	Very high	92.4	Very high	34 Å²	34	52.4 Å²	52.4	21%	0.206	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115.7	176.3	-179.1	0	0	0	0	108.7	L223 Q224 T273	L223-V256 HydrophobicContact CB-CB 4.38Å; L223-V256 HydrophobicContact CB-CG1 4.25Å; L223-V256 HydrophobicContact CD1-CG1 4.27Å; L223-V256 PolarHBondContact N-O 2.97Å; Q224-V256 HydrophobicContact CB-CB 3.95Å; Q224-V256 HydrophobicContact CB-CG2 3.97Å; Q224-V256 PolarHBondContact N-O 3.41Å; Q224-V256 PolarHBondContact O-N 2.9Å; V256-T273 WeakPolarHBondContact CA-O 3.16Å
257	I	96.1	Very high	91.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	137.7	175.3	-50.2	-61.4	0	0	0	108.7	F180 V202 Y220 S221 I222 V231 I238 V255 T272 T273 V275	F180-I257 HydrophobicContact CZ-CB 4.45Å; F180-I257 HydrophobicContact CZ-CG2 4.12Å; V202-I257 HydrophobicContact CG2-CB 4.38Å; V202-I257 HydrophobicContact CG2-CG1 4.28Å; V202-I257 HydrophobicContact CG2-CG2 3.93Å; Y220-I257 HydrophobicContact CD1-CG2 4.24Å; S221-I257 WeakPolarHBondContact O-CA 3.29Å; S221-I257 WeakPolarHBondContact O-CG2 3.38Å; I222-I257 HydrophobicContact CD1-CD1 3.94Å; I222-I257 HydrophobicContact CG1-CD1 3.73Å; V231-I257 HydrophobicContact CB-CD1 4.48Å; I238-I257 HydrophobicContact CD1-CD1 3.83Å; I238-I257 HydrophobicContact CD1-CG1 3.89Å; I238-I257 HydrophobicContact CG1-CD1 4.06Å; I238-I257 HydrophobicContact CG1-CG1 4.48Å; V255-I257 HydrophobicContact CG1-CD1 3.68Å; V255-I257 HydrophobicContact CG1-CG1 4.42Å; I257-T272 CarbonylContact O-C 3.59Å; I257-T272 VanDerWaalsContact O-CA 3.27Å; I257-T272 WeakPolarHBondContact O-CA 3.46Å; I257-T273 HydrophobicContact CB-CG2 4.17Å; I257-T273 PolarHBondContact N-O 2.89Å; I257-T273 PolarHBondContact O-N 2.6Å; I257-V275 HydrophobicContact CG1-CG2 3.82Å
258	Q	95.6	Very high	91.3	Very high	39 Å²	39	52.1 Å²	52.1	18%	0.182	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	136.7	168.3	-175.5	-178.3	41.5	0	0	109	Y220 S221 L223 S270 G271 T272	Y220-Q258 CarbonylContact C-O 3.41Å; Y220-Q258 WeakPolarHBondContact CA-O 3.49Å; S221-Q258 PolarHBondContact N-O 2.85Å; S221-Q258 PolarHBondContact O-N 2.98Å; S221-Q258 PolarHBondContact OG-OE1 2.83Å; L223-Q258 HydrophobicContact CD1-CB 3.95Å; L223-Q258 HydrophobicContact CD1-CG 4.47Å; L223-Q258 HydrophobicContact CD2-CB 4.42Å; L223-Q258 HydrophobicContact CG-CB 3.93Å; Q258-S270 VanDerWaalsContact NE2-CB 3.28Å; Q258-S270 PolarHBondContact NE2-OG 3Å; Q258-G271 WeakPolarHBondContact CA-O 3.44Å; Q258-G271 WeakPolarHBondContact CG-O 3.34Å; Q258-T272 HydrophobicContact CB-CG2 4.13Å; Q258-T272 HydrophobicContact CG-CG2 4.12Å
259	A	95.8	Very high	91.2	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	127.5	160.5	0	0	0	0	0	107.2	P178 F180 A204 Y220 S270 G271	P178-A259 HydrophobicContact CB-CB 4.02Å; F180-A259 HydrophobicContact CE1-CB 4.43Å; F180-A259 HydrophobicContact CE2-CB 3.79Å; F180-A259 HydrophobicContact CZ-CB 3.6Å; A204-A259 HydrophobicContact CB-CB 3.57Å; Y220-A259 HydrophobicContact CD1-CB 4.11Å; Y220-A259 HydrophobicContact CE1-CB 3.95Å; A259-S270 CarbonylContact O-C 3.43Å; A259-S270 VanDerWaalsContact O-CA 3.22Å; A259-S270 WeakPolarHBondContact O-CA 3.35Å; A259-S270 VanDerWaalsContact O-CB 3.31Å; A259-S270 WeakPolarHBondContact O-CB 3.34Å; A259-G271 PolarHBondContact N-O 2.88Å; A259-G271 PolarHBondContact O-N 2.52Å
260	K	94	Very high	91.2	Very high	37 Å²	37	50.8 Å²	50.8	16%	0.161	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	130.8	177.7	-159.3	177.5	-170.4	-173	0	110.6	L218 V219 H265 M266 G268 L269	L218-K260 CarbonylContact C-O 3.46Å; L218-K260 WeakPolarHBondContact CA-O 3.42Å; V219-K260 PolarHBondContact N-O 3.06Å; V219-K260 PolarHBondContact O-N 2.96Å; K260-H265 WeakPolarHBondContact CE-O 3.27Å; K260-H265 PolarHBondContact NZ-O 3.49Å; K260-M266 PolarHBondContact NZ-O 2.85Å; K260-G268 WeakPolarHBondContact CE-O 3.35Å; K260-G268 PolarHBondContact NZ-O 3.13Å; K260-L269 WeakPolarHBondContact CG-O 3.22Å
261	D	92.3	Very high	91.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.269	C	S	.	.	S	Bend	trans	-70.6	-166.9	174.9	65.3	14.4	0	0	0	112	N174 P178 S215 L218 G263 G264 G268 L269	N174-D261 PolarHBondContact ND2-OD2 2.79Å; P178-D261 HydrophobicContact CG-CB 3.89Å; S215-D261 WeakPolarHBondContact O-CB 3.26Å; L218-D261 HydrophobicContact CD2-CB 4.5Å; D261-G263 PolarHBondContact O-N 2.8Å; D261-G264 WeakPolarHBondContact O-CA 3.34Å; D261-G264 PolarHBondContact O-N 2.79Å; D261-G268 WeakPolarHBondContact OD1-CA 3.4Å; D261-L269 VanDerWaalsContact CG-O 3.32Å; D261-L269 PolarHBondContact N-O 3.07Å; D261-L269 PolarHBondContact OD1-N 3.42Å; D261-L269 VanDerWaalsContact OD1-O 3.12Å; D261-L269 VanDerWaalsContact OD2-CA 3.26Å; D261-L269 WeakPolarHBondContact OD2-CA 3.23Å; D261-L269 WeakPolarHBondContact OD2-CB 3.26Å; D261-L269 PolarHBondContact OD2-N 3.46Å
262	M	87.6	Confident	91.2	Very high	58 Å²	58	46.9 Å²	46.9	29%	0.286	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	50.1	31.1	175.7	-61	-156.5	92.6	0	0	114.6	N174 N214 S215 G264 H265	N174-M262 HydrophobicContact CB-CG 4.5Å; N174-M262 WeakPolarHBondContact OD1-CG 3.32Å; N214-M262 WeakPolarHBondContact O-CA 3.4Å; S215-M262 PolarHBondContact O-N 2.79Å; M262-G264 PolarHBondContact O-N 2.94Å; M262-H265 HydrophobicContact CB-CB 4.34Å; M262-H265 WeakPolarHBondContact O-CB 3.36Å; M262-H265 PolarHBondContact O-CD2 2.88Å; M262-H265 PolarHBondContact O-N 2.93Å
263	G	84.6	Confident	91.1	Very high	25 Å²	25	43.6 Å²	43.6	26%	0.258	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	62.9	23.3	-173.8	0	0	0	0	0	114.3	R217 V219 D261	R217-G263 VanDerWaalsContact O-CA 3.32Å; R217-G263 WeakPolarHBondContact O-CA 3.11Å; R217-G263 PolarHBondContact O-N 3.23Å; V219-G263 WeakPolarHBondContact CG2-O 3.4Å; D261-G263 PolarHBondContact O-N 2.8Å
264	G	84.1	Confident	91.1	Very high	33 Å²	33	47.7 Å²	47.7	34%	0.34	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	79.7	11.7	-176.7	0	0	0	0	0	114.9	D261 M262	D261-G264 WeakPolarHBondContact O-CA 3.34Å; D261-G264 PolarHBondContact O-N 2.79Å; M262-G264 PolarHBondContact O-N 2.94Å
265	H	85.9	Confident	91.1	Very high	136 Å²	136	45.5 Å²	45.5	63%	0.63	27%	0.272	S	S	*	.			trans	-67.7	160.6	-179.3	-74.4	-47.7	0	0	0	113.4	K260 M262 G267 G268	K260-H265 WeakPolarHBondContact CE-O 3.27Å; K260-H265 PolarHBondContact NZ-O 3.49Å; M262-H265 HydrophobicContact CB-CB 4.34Å; M262-H265 WeakPolarHBondContact O-CB 3.36Å; M262-H265 PolarHBondContact O-CD2 2.88Å; M262-H265 PolarHBondContact O-N 2.93Å; H265-G267 VanDerWaalsContact C-N 3.34Å; H265-G267 PolarHBondContact O-N 3.47Å; H265-G268 PolarHBondContact O-N 3.36Å
266	M	78.7	Confident	91.1	Very high	189 Å²	189	48.1 Å²	48.1	93%	0.931	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-35.3	-170.8	-73.1	-166.1	-66.7	0	0	114.1	K260 G268	K260-M266 PolarHBondContact NZ-O 2.85Å; M266-G268 VanDerWaalsContact C-N 3.28Å; M266-G268 PolarHBondContact O-N 3.45Å
267	G	79.5	Confident	91.2	Very high	69 Å²	69	46.5 Å²	46.5	71%	0.711	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-15.9	-179.1	0	0	0	0	0	115.5	H265	H265-G267 VanDerWaalsContact C-N 3.34Å; H265-G267 PolarHBondContact O-N 3.47Å
268	G	86.4	Confident	91.2	Very high	12 Å²	12	47.9 Å²	47.9	12%	0.124	28%	0.282	C	S	.	.			trans	-68.4	159.5	-175.4	0	0	0	0	0	116.2	K260 D261 H265 M266	K260-G268 WeakPolarHBondContact CE-O 3.35Å; K260-G268 PolarHBondContact NZ-O 3.13Å; D261-G268 WeakPolarHBondContact OD1-CA 3.4Å; H265-G268 PolarHBondContact O-N 3.36Å; M266-G268 VanDerWaalsContact C-N 3.28Å; M266-G268 PolarHBondContact O-N 3.45Å
269	L	91.6	Very high	91.3	Very high	66 Å²	66	46.2 Å²	46.2	35%	0.346	27%	0.274	S	S	.	.			trans	-84.1	171.8	170.9	-44.2	174.6	0	0	0	110.8	D175 P177 K260 D261	D175-L269 WeakPolarHBondContact O-CD1 3.4Å; P177-L269 HydrophobicContact CB-CB 4.08Å; P177-L269 HydrophobicContact CB-CD1 4.29Å; K260-L269 WeakPolarHBondContact CG-O 3.22Å; D261-L269 VanDerWaalsContact CG-O 3.32Å; D261-L269 PolarHBondContact N-O 3.07Å; D261-L269 PolarHBondContact OD1-N 3.42Å; D261-L269 VanDerWaalsContact OD1-O 3.12Å; D261-L269 VanDerWaalsContact OD2-CA 3.26Å; D261-L269 WeakPolarHBondContact OD2-CA 3.23Å; D261-L269 WeakPolarHBondContact OD2-CB 3.26Å; D261-L269 PolarHBondContact OD2-N 3.46Å
270	S	94.5	Very high	91.2	Very high	49 Å²	49	47.6 Å²	47.6	34%	0.343	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	135.1	-179.8	71.7	0	0	0	0	114.7	Q258 A259	Q258-S270 VanDerWaalsContact NE2-CB 3.28Å; Q258-S270 PolarHBondContact NE2-OG 3Å; A259-S270 CarbonylContact O-C 3.43Å; A259-S270 VanDerWaalsContact O-CA 3.22Å; A259-S270 WeakPolarHBondContact O-CA 3.35Å; A259-S270 VanDerWaalsContact O-CB 3.31Å; A259-S270 WeakPolarHBondContact O-CB 3.34Å
271	G	94	Very high	91.1	Very high	12 Å²	12	47.4 Å²	47.4	12%	0.124	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	158.6	162.8	0	0	0	0	0	112.9	P178 Q258 A259	P178-G271 WeakPolarHBondContact O-CA 3.26Å; P178-G271 PolarHBondContact O-N 3.5Å; Q258-G271 WeakPolarHBondContact CA-O 3.44Å; Q258-G271 WeakPolarHBondContact CG-O 3.34Å; A259-G271 PolarHBondContact N-O 2.88Å; A259-G271 PolarHBondContact O-N 2.52Å
272	T	94.9	Very high	90.9	Very high	84 Å²	84	47.7 Å²	47.7	52%	0.515	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	149.2	172.2	58.9	0	0	0	0	111.7	L223 I257 Q258	L223-T272 HydrophobicContact CD1-CG2 3.73Å; I257-T272 CarbonylContact O-C 3.59Å; I257-T272 VanDerWaalsContact O-CA 3.27Å; I257-T272 WeakPolarHBondContact O-CA 3.46Å; Q258-T272 HydrophobicContact CB-CG2 4.13Å; Q258-T272 HydrophobicContact CG-CG2 4.12Å
273	T	94.9	Very high	90.9	Very high	15 Å²	15	45 Å²	45	9%	0.092	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	151.5	175.4	-167.9	0	0	0	0	111.3	F180 Y185 V256 I257 V275	F180-T273 HydrophobicContact CB-CG2 4.42Å; F180-T273 HydrophobicContact CD1-CG2 3.53Å; F180-T273 HydrophobicContact CD2-CG2 3.81Å; F180-T273 HydrophobicContact CE1-CG2 3.57Å; F180-T273 HydrophobicContact CE2-CG2 3.85Å; F180-T273 HydrophobicContact CG-CG2 3.65Å; F180-T273 HydrophobicContact CZ-CG2 3.72Å; Y185-T273 HydrophobicContact CD2-CG2 3.96Å; Y185-T273 HydrophobicContact CE2-CG2 3.86Å; V256-T273 WeakPolarHBondContact CA-O 3.16Å; I257-T273 HydrophobicContact CB-CG2 4.17Å; I257-T273 PolarHBondContact N-O 2.89Å; I257-T273 PolarHBondContact O-N 2.6Å; T273-V275 HydrophobicContact CG2-CG2 4.44Å
274	E	95	Very high	90.9	Very high	98 Å²	98	45.1 Å²	45.1	46%	0.458	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	134.2	174.9	-170.4	179.5	-179.8	0	0	110.8	Y185	Y185-E274 PolarHBondContact N-O 2.83Å
275	V	95.7	Very high	91	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	106.7	176.8	-170.3	0	0	0	0	108.1	Y185 V202 I238 V255 I257 T273 I277	Y185-V275 HydrophobicContact CD2-CG2 4.16Å; Y185-V275 HydrophobicContact CG-CG2 4.42Å; Y185-V275 WeakPolarHBondContact O-CA 3.27Å; V202-V275 HydrophobicContact CG1-CG2 3.87Å; I238-V275 HydrophobicContact CD1-CB 4.32Å; I238-V275 HydrophobicContact CD1-CG1 4.01Å; I238-V275 HydrophobicContact CD1-CG2 3.94Å; V255-V275 HydrophobicContact CB-CB 4.37Å; V255-V275 PolarHBondContact N-O 2.9Å; V255-V275 PolarHBondContact O-N 2.95Å; I257-V275 HydrophobicContact CG1-CG2 3.82Å; T273-V275 HydrophobicContact CG2-CG2 4.44Å; V275-I277 HydrophobicContact CG1-CD1 4.39Å; V275-I277 HydrophobicContact CG1-CG1 3.95Å
276	K	96.8	Very high	91.1	Very high	54 Å²	54	40.4 Å²	40.4	24%	0.235	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	116.3	172.3	178.1	173.7	-73.8	-69.1	0	109.3	Y185 Y186 A187 E252 D254	Y185-K276 PolarHBondContact O-N 3.26Å; Y186-K276 WeakPolarHBondContact CA-O 3.32Å; Y186-K276 HydrophobicContact CD1-CB 3.94Å; Y186-K276 HydrophobicContact CD1-CD 4.34Å; Y186-K276 HydrophobicContact CD1-CG 4.44Å; Y186-K276 HydrophobicContact CE1-CB 4.16Å; Y186-K276 HydrophobicContact CE1-CD 4.23Å; A187-K276 PolarHBondContact N-O 2.89Å; E252-K276 WeakPolarHBondContact OE2-CD 3.12Å; E252-K276 IonicContact OE2-NZ 2.68Å; E252-K276 PolarHBondContact OE2-NZ 2.94Å; D254-K276 WeakPolarHBondContact OD1-CE 3.2Å; D254-K276 IonicContact OD1-NZ 3.9Å; D254-K276 PolarHBondContact OD1-NZ 3.42Å; D254-K276 IonicContact OD2-NZ 2.68Å
277	I	96.8	Very high	91.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	120.5	179.8	-49.7	-178.6	0	0	0	109	A187 V189 V199 F229 I238 Y253 V255 V275	A187-I277 HydrophobicContact CB-CG1 4.37Å; A187-I277 WeakPolarHBondContact O-CA 3.43Å; V189-I277 HydrophobicContact CG1-CG2 3.96Å; V199-I277 HydrophobicContact CG1-CD1 4.17Å; V199-I277 HydrophobicContact CG1-CG2 3.87Å; F229-I277 HydrophobicContact CD1-CD1 3.83Å; F229-I277 HydrophobicContact CD2-CD1 4.02Å; F229-I277 HydrophobicContact CE1-CD1 3.73Å; F229-I277 HydrophobicContact CE1-CG2 3.94Å; F229-I277 HydrophobicContact CE2-CB 4.4Å; F229-I277 HydrophobicContact CE2-CD1 3.93Å; F229-I277 HydrophobicContact CG-CD1 3.98Å; F229-I277 HydrophobicContact CZ-CB 4.01Å; F229-I277 HydrophobicContact CZ-CD1 3.78Å; F229-I277 HydrophobicContact CZ-CG1 4.48Å; F229-I277 HydrophobicContact CZ-CG2 3.67Å; I238-I277 HydrophobicContact CG2-CD1 4.15Å; Y253-I277 PolarHBondContact N-O 2.86Å; Y253-I277 PolarHBondContact O-N 3.11Å; V255-I277 HydrophobicContact CB-CD1 4.34Å; V255-I277 HydrophobicContact CG2-CD1 3.73Å; V255-I277 HydrophobicContact CG2-CG1 4.21Å; V275-I277 HydrophobicContact CG1-CD1 4.39Å; V275-I277 HydrophobicContact CG1-CG1 3.95Å
278	T	97.1	Very high	92.5	Very high	29 Å²	29	33 Å²	33	18%	0.178	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126.5	177	-45.6	0	0	0	0	109.8	A187 R188 V189 Q251 E252	A187-T278 PolarHBondContact O-N 3.34Å; R188-T278 WeakPolarHBondContact CA-O 3.4Å; V189-T278 PolarHBondContact N-O 3.45Å; Q251-T278 HydrophobicContact CG-CG2 3.82Å; Q251-T278 WeakPolarHBondContact O-CA 3.31Å; E252-T278 HydrophobicContact CG-CG2 4.21Å
279	L	96.5	Very high	92.9	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.021	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	134.2	169.4	-64	-171.9	0	0	0	109.9	V189 E191 M245 R247 R250 Q251 Y253	V189-L279 HydrophobicContact CG1-CD2 3.75Å; V189-L279 CarbonylContact O-C 3.56Å; V189-L279 WeakPolarHBondContact O-CA 3.39Å; E191-L279 HydrophobicContact CB-CB 4.41Å; E191-L279 HydrophobicContact CB-CD1 4.15Å; M245-L279 HydrophobicContact CB-CD1 4.05Å; M245-L279 HydrophobicContact CB-CD2 4.49Å; M245-L279 HydrophobicContact CE-CD2 4.25Å; R247-L279 HydrophobicContact CB-CB 4.17Å; R247-L279 HydrophobicContact CB-CD1 4.45Å; R247-L279 HydrophobicContact CG-CB 4.16Å; R250-L279 WeakPolarHBondContact O-CD1 3.33Å; Q251-L279 PolarHBondContact O-N 2.75Å; Y253-L279 HydrophobicContact CD2-CG 4.43Å; Y253-L279 HydrophobicContact CE2-CD1 3.94Å; Y253-L279 HydrophobicContact CE2-CD2 4.48Å; Y253-L279 HydrophobicContact CE2-CG 3.96Å
280	T	93.9	Very high	93	Very high	30 Å²	30	34 Å²	34	18%	0.184	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.8	172.1	66.4	0	0	0	0	110.4	R188 V189 P190 E191	R188-T280 HydrophobicContact CB-CG2 3.71Å; R188-T280 HydrophobicContact CG-CG2 4.32Å; V189-T280 PolarHBondContact O-N 3.06Å; P190-T280 WeakPolarHBondContact CA-O 3.3Å; P190-T280 VanDerWaalsContact CA-OG1 3.26Å; P190-T280 WeakPolarHBondContact CA-OG1 3.33Å; E191-T280 PolarHBondContact N-O 3.48Å
281	D	91.5	Very high	93.1	Very high	32 Å²	32	36.9 Å²	36.9	17%	0.171	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-48.2	135.6	-178.7	-165.5	90.7	0	0	0	114.2	E191 R247 M318 N321	E191-D281 WeakPolarHBondContact OE1-CA 3.36Å; R247-D281 IonicContact CZ-OD1 2.56Å; R247-D281 IonicContact NE-OD1 3.9Å; R247-D281 PolarHBondContact NE-OD1 2.74Å; R247-D281 IonicContact NH2-OD1 2.84Å; R247-D281 PolarHBondContact NH2-OD1 2.9Å; D281-M318 HydrophobicContact CB-CB 3.81Å; D281-M318 WeakPolarHBondContact OD1-CA 3.02Å; D281-M318 WeakPolarHBondContact OD1-CB 3.38Å; D281-M318 PolarHBondContact OD1-N 2.65Å; D281-M318 PolarHBondContact OD2-N 3.06Å; D281-M318 VanDerWaalsContact OD2-N 3.16Å; D281-N321 WeakPolarHBondContact OD2-CB 3.43Å; D281-N321 PolarHBondContact OD2-ND2 2.81Å
282	V	88.7	Confident	93.1	Very high	7 Å²	7	40.7 Å²	40.7	4%	0.042	22%	0.223	C	C	.	.			trans	-132.8	134.3	173.6	173.2	0	0	0	0	108.4	P190 E191 D284 F379	P190-V282 HydrophobicContact CB-CG2 4.04Å; E191-V282 HydrophobicContact CG-CB 3.79Å; E191-V282 HydrophobicContact CG-CG2 3.93Å; E191-V282 PolarHBondContact OE1-N 2.9Å; V282-D284 PolarHBondContact O-N 2.86Å; V282-F379 HydrophobicContact CG1-CD2 4.3Å; V282-F379 HydrophobicContact CG1-CE2 3.28Å; V282-F379 HydrophobicContact CG1-CZ 3.63Å
283	N	87.9	Confident	93.2	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	22%	0.216	C	C	.	.			trans	-67.4	99.9	176	-169.7	-33.4	0	0	0	110.7	D317 N321 N372 H374 F379 Y385	N283-D317 WeakPolarHBondContact CA-OD2 3.33Å; N283-N321 HydrophobicContact CB-CB 3.94Å; N283-N321 PolarHBondContact N-ND2 3.16Å; N283-N372 VanDerWaalsContact ND2-CG 3.33Å; N283-N372 PolarHBondContact ND2-OD1 2.66Å; N283-H374 PolarHBondContact ND2-O 3.33Å; N283-F379 WeakPolarHBondContact O-CD2 3.42Å; N283-Y385 WeakPolarHBondContact OD1-CD1 3.38Å; N283-Y385 WeakPolarHBondContact OD1-CE1 3.39Å
284	D	85.1	Confident	93.2	Very high	28 Å²	28	40.1 Å²	40.1	15%	0.15	22%	0.217	C	C	.	.			trans	-122.7	-23.6	174.2	91.8	-71	0	0	0	112.3	M192 V282 D317	M192-D284 HydrophobicContact CE-CB 3.84Å; M192-D284 VanDerWaalsContact CE-CG 3.42Å; M192-D284 WeakPolarHBondContact CE-OD2 3.32Å; M192-D284 HydrophobicContact SD-CB 4.35Å; V282-D284 PolarHBondContact O-N 2.86Å; D284-D317 PolarHBondContact N-OD2 3.26Å; D284-D317 VanDerWaalsContact N-OD2 3.13Å
285	N	86.5	Confident	93.3	Very high	30 Å²	30	41 Å²	41	16%	0.16	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-93.1	123.8	179.9	-71.6	-80.9	0	0	0	112.1	K288 P316 D317	N285-K288 PolarHBondContact OD1-NZ 2.99Å; N285-P316 HydrophobicContact CB-CG 3.51Å; N285-P316 VanDerWaalsContact CG-CG 3.45Å; N285-D317 VanDerWaalsContact CB-OD1 3.29Å; N285-D317 WeakPolarHBondContact CB-OD1 3.24Å; N285-D317 PolarHBondContact N-OD2 3.02Å; N285-D317 VanDerWaalsContact N-OD2 3.11Å; N285-D317 PolarHBondContact ND2-OD1 3.43Å
286	P	88.1	Confident	93.3	Very high	40 Å²	40	42.4 Å²	42.4	26%	0.26	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-70	144.4	166.8	26.9	-30.5	0	0	0	110.3	K288	P286-K288 WeakPolarHBondContact O-CE 3.31Å; P286-K288 WeakPolarHBondContact O-CG 3.41Å; P286-K288 PolarHBondContact O-N 3.29Å
287	P	92.6	Very high	93.3	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-50.7	135.5	166.5	-20.4	24.5	0	0	0	110.8	A313 D315 V324 N372 D387	P287-A313 HydrophobicContact CB-CB 4.04Å; P287-D315 HydrophobicContact CB-CB 4.4Å; P287-D315 WeakPolarHBondContact CD-OD2 3.22Å; P287-D315 HydrophobicContact CG-CB 4.49Å; P287-D315 VanDerWaalsContact CG-OD2 3.31Å; P287-D315 WeakPolarHBondContact CG-OD2 3.49Å; P287-V324 HydrophobicContact CB-CG1 3.97Å; P287-V324 HydrophobicContact CB-CG2 3.82Å; P287-V324 HydrophobicContact CG-CG1 4.18Å; P287-V324 HydrophobicContact CG-CG2 4.06Å; P287-N372 HydrophobicContact CG-CB 4.23Å; P287-D387 WeakPolarHBondContact O-CB 3.38Å
288	K	93.1	Very high	93.2	Very high	103 Å²	103	42 Å²	42	45%	0.448	24%	0.24	S	C	.	.	B	Isolated β-bridge	trans	-126.9	127.1	-179.6	-71.3	149.6	-166.2	158.3	0	111.4	N285 P286 A313 K314	N285-K288 PolarHBondContact OD1-NZ 2.99Å; P286-K288 WeakPolarHBondContact O-CE 3.31Å; P286-K288 WeakPolarHBondContact O-CG 3.41Å; P286-K288 PolarHBondContact O-N 3.29Å; K288-A313 CarbonylContact O-C 3.54Å; K288-A313 WeakPolarHBondContact O-CA 3.42Å; K288-K314 PolarHBondContact N-O 2.93Å; K288-K314 PolarHBondContact O-N 3.44Å
289	F	95.6	Very high	93.2	Very high	15 Å²	15	41.8 Å²	41.8	7%	0.066	24%	0.24	C	C	.	.			trans	-75.2	129.3	171.1	-70.4	-73.3	0	0	0	110.4	Q291 Y294 L311 A313 Y326 V368 D387 A389	F289-Q291 WeakPolarHBondContact CB-O 3.36Å; F289-Q291 PolarHBondContact O-N 3.47Å; F289-Y294 HydrophobicContact CB-CE2 4.27Å; F289-Y294 HydrophobicContact CD1-CE2 4.11Å; F289-Y294 HydrophobicContact CG-CE2 4.41Å; F289-L311 HydrophobicContact CD1-CD1 3.81Å; F289-L311 HydrophobicContact CE1-CD1 3.36Å; F289-L311 HydrophobicContact CE1-CG 4.07Å; F289-L311 HydrophobicContact CZ-CD1 4.07Å; F289-A313 HydrophobicContact CD1-CB 3.76Å; F289-A313 HydrophobicContact CD2-CB 4.43Å; F289-A313 HydrophobicContact CE1-CB 3.75Å; F289-A313 HydrophobicContact CE2-CB 4.44Å; F289-A313 HydrophobicContact CG-CB 4.11Å; F289-A313 HydrophobicContact CZ-CB 4.11Å; F289-Y326 HydrophobicContact CE1-CD1 4.29Å; F289-Y326 AromaticContact CE1-CE1 3.84Å; F289-Y326 HydrophobicContact CE1-CE1 3.84Å; F289-Y326 HydrophobicContact CZ-CD1 4.08Å; F289-Y326 AromaticContact CZ-CE1 3.98Å; F289-Y326 HydrophobicContact CZ-CE1 3.98Å; F289-V368 HydrophobicContact CZ-CG1 4.32Å; F289-V368 HydrophobicContact CZ-CG2 4.35Å; F289-D387 HydrophobicContact CD2-CB 4.12Å; F289-D387 PolarHBondContact N-OD2 2.7Å; F289-A389 HydrophobicContact CB-CB 4.08Å; F289-A389 HydrophobicContact CD1-CB 4.26Å; F289-A389 HydrophobicContact CD2-CB 3.63Å; F289-A389 HydrophobicContact CE2-CB 4.06Å; F289-A389 HydrophobicContact CG-CB 3.74Å
290	P	94.8	Very high	93.1	Very high	84 Å²	84	41.9 Å²	41.9	55%	0.545	24%	0.24	S	C	.	.	S	Bend	trans	-59.8	-15.1	174.7	-27.6	35.8	0	0	0	115.2	Y294 K312 K314	P290-Y294 WeakPolarHBondContact CD-OH 3.33Å; P290-K312 WeakPolarHBondContact CD-O 3.44Å; P290-K314 HydrophobicContact CG-CG 4.45Å
291	Q	94.6	Very high	93	Very high	109 Å²	109	45.7 Å²	45.7	51%	0.509	26%	0.259	S	S	.	.			trans	-140.5	133.5	176.5	-64.1	177.9	-28.3	0	0	109.3	F289 V293 Y294	F289-Q291 WeakPolarHBondContact CB-O 3.36Å; F289-Q291 PolarHBondContact O-N 3.47Å; Q291-V293 VanDerWaalsContact C-N 3.3Å; Q291-Y294 HydrophobicContact CB-CD1 4.47Å; Q291-Y294 HydrophobicContact CB-CE1 4.07Å; Q291-Y294 HydrophobicContact CB-CE2 4.2Å; Q291-Y294 HydrophobicContact CG-CE1 4.48Å; Q291-Y294 WeakPolarHBondContact O-CE2 3.34Å
292	S	94.6	Very high	93.1	Very high	92 Å²	92	46.8 Å²	46.8	64%	0.643	26%	0.262	S	S	*	.	S	Bend	trans	-77.3	-17.5	173.4	55.7	0	0	0	0	113.2	T390	S292-T390 PolarHBondContact O-N 3.01Å
293	V	96.7	Very high	93.4	Very high	62 Å²	62	50.5 Å²	50.5	38%	0.376	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	121.5	173.4	-174.1	0	0	0	0	109.9	Q291 T390 K392	Q291-V293 VanDerWaalsContact C-N 3.3Å; V293-T390 CarbonylContact C-O 3.55Å; V293-T390 VanDerWaalsContact CA-O 3.24Å; V293-T390 WeakPolarHBondContact CA-O 3.49Å; V293-K392 HydrophobicContact CG1-CD 4.1Å; V293-K392 HydrophobicContact CG1-CG 4.31Å
294	Y	96.8	Very high	93.7	Very high	25 Å²	25	53.3 Å²	53.3	10%	0.098	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	137.2	169.6	-67.6	-87.9	0	0	0	109.7	F289 P290 Q291 L311 A389 T390 K392	F289-Y294 HydrophobicContact CB-CE2 4.27Å; F289-Y294 HydrophobicContact CD1-CE2 4.11Å; F289-Y294 HydrophobicContact CG-CE2 4.41Å; P290-Y294 WeakPolarHBondContact CD-OH 3.33Å; Q291-Y294 HydrophobicContact CB-CD1 4.47Å; Q291-Y294 HydrophobicContact CB-CE1 4.07Å; Q291-Y294 HydrophobicContact CB-CE2 4.2Å; Q291-Y294 HydrophobicContact CG-CE1 4.48Å; Q291-Y294 WeakPolarHBondContact O-CE2 3.34Å; Y294-L311 HydrophobicContact CD1-CB 4.26Å; Y294-L311 HydrophobicContact CD2-CB 4.39Å; Y294-L311 HydrophobicContact CD2-CD1 3.92Å; Y294-L311 HydrophobicContact CE1-CB 4Å; Y294-L311 HydrophobicContact CE2-CB 4.13Å; Y294-L311 HydrophobicContact CE2-CD1 3.73Å; Y294-L311 HydrophobicContact CG-CB 4.45Å; Y294-A389 HydrophobicContact CD2-CB 3.95Å; Y294-A389 HydrophobicContact CE2-CB 3.76Å; Y294-T390 PolarHBondContact N-O 2.99Å; Y294-K392 PolarHBondContact O-N 2.78Å
295	T	96.4	Very high	94	Very high	117 Å²	117	54.4 Å²	54.4	72%	0.718	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.4	127.6	172	50.8	0	0	0	0	109.6	K392	T295-K392 WeakPolarHBondContact CA-O 3.05Å; T295-K392 HydrophobicContact CG2-CB 4.41Å
296	M	95.4	Very high	94.4	Very high	28 Å²	28	56.6 Å²	56.6	14%	0.138	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	164.4	177.1	55.8	-172.3	68	0	0	109.9	V308 I350 I391 K392 I393 S394	M296-V308 HydrophobicContact CG-CG1 4.35Å; M296-V308 HydrophobicContact SD-CG1 4Å; M296-I350 HydrophobicContact CE-CD1 3.58Å; M296-I350 HydrophobicContact SD-CD1 3.58Å; M296-I350 VanDerWaalsContact SD-CD1 3.58Å; M296-I391 HydrophobicContact CE-CG2 3.73Å; M296-I391 HydrophobicContact CG-CG2 4.06Å; M296-I391 HydrophobicContact SD-CG2 3.76Å; M296-K392 PolarHBondContact N-O 3.47Å; M296-I393 HydrophobicContact CG-CG1 3.94Å; M296-I393 VanDerWaalsContact O-CA 3.31Å; M296-I393 WeakPolarHBondContact O-CA 3.35Å; M296-I393 HydrophobicContact SD-CG1 4.3Å; M296-S394 PolarHBondContact O-N 3.37Å; M296-S394 PolarHBondContact O-OG 2.58Å
297	S	95.8	Very high	94.8	Very high	45 Å²	45	58.2 Å²	58.2	32%	0.315	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	160.4	176.9	54.9	0	0	0	0	112.6	S394 E396	S297-S394 CarbonylContact C-O 3.58Å; S297-S394 WeakPolarHBondContact CA-O 3.41Å; S297-E396 VanDerWaalsContact CB-CD 3.41Å; S297-E396 WeakPolarHBondContact CB-OE1 3.4Å; S297-E396 VanDerWaalsContact OG-CD 3.3Å; S297-E396 PolarHBondContact OG-OE1 2.88Å
298	V	96.6	Very high	94.9	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.012	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	123.7	177	64.8	0	0	0	0	107.5	K302 V308 F337 L352 V356 I393 S394 V395 E396	V298-K302 HydrophobicContact CG2-CB 4.44Å; V298-K302 HydrophobicContact CG2-CD 3.68Å; V298-V308 HydrophobicContact CB-CG1 3.95Å; V298-V308 HydrophobicContact CB-CG2 4.35Å; V298-V308 HydrophobicContact CG2-CG1 4.37Å; V298-V308 HydrophobicContact CG2-CG2 3.86Å; V298-F337 HydrophobicContact CG1-CE1 4.38Å; V298-F337 HydrophobicContact CG1-CZ 4.35Å; V298-L352 HydrophobicContact CG2-CD1 4.45Å; V298-L352 HydrophobicContact CG2-CD2 4.48Å; V298-V356 HydrophobicContact CG1-CG2 4.04Å; V298-I393 HydrophobicContact CB-CG2 4.21Å; V298-I393 HydrophobicContact CG1-CG2 3.59Å; V298-S394 PolarHBondContact N-O 3.34Å; V298-V395 HydrophobicContact CG1-CG2 4.26Å; V298-V395 CarbonylContact O-C 3.58Å; V298-V395 VanDerWaalsContact O-CA 3.23Å; V298-V395 WeakPolarHBondContact O-CA 3.5Å; V298-E396 PolarHBondContact O-N 2.87Å
299	S	95.1	Very high	95	Very high	24 Å²	24	55 Å²	55	17%	0.168	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	150.9	168.4	-168.4	0	0	0	0	110.2	D301 K302 E396	S299-D301 VanDerWaalsContact C-N 3.31Å; S299-D301 WeakPolarHBondContact CB-OD1 3.28Å; S299-K302 WeakPolarHBondContact O-CB 3.07Å; S299-K302 PolarHBondContact O-N 2.97Å; S299-E396 WeakPolarHBondContact CA-O 3.39Å; S299-E396 PolarHBondContact OG-O 3.05Å
300	E	94.7	Very high	95	Very high	6 Å²	6	59 Å²	59	3%	0.028	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-11.9	-175.6	67.5	-153.8	122.2	0	0	114.6	K302 Q355 V356 F358 V395 D397 A398	E300-K302 PolarHBondContact O-N 2.83Å; E300-Q355 VanDerWaalsContact O-CG 3.32Å; E300-Q355 WeakPolarHBondContact O-CG 3.33Å; E300-Q355 PolarHBondContact O-NE2 2.73Å; E300-V356 HydrophobicContact CB-CG2 4.2Å; E300-F358 VanDerWaalsContact OE1-CB 3.22Å; E300-F358 WeakPolarHBondContact OE1-CB 3.33Å; E300-F358 WeakPolarHBondContact OE2-CB 3.15Å; E300-F358 PolarHBondContact OE2-N 2.91Å; E300-V395 HydrophobicContact CB-CG1 4.13Å; E300-D397 VanDerWaalsContact OE1-CA 3.27Å; E300-D397 WeakPolarHBondContact OE1-CA 2.9Å; E300-A398 HydrophobicContact CG-CB 3.95Å; E300-A398 PolarHBondContact OE1-N 3.46Å
301	D	92.3	Very high	95	Very high	110 Å²	110	55.2 Å²	55.2	59%	0.588	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.8	168.3	77.8	-26.2	0	0	0	112.7	S299 V303 A398	S299-D301 VanDerWaalsContact C-N 3.31Å; S299-D301 WeakPolarHBondContact CB-OD1 3.28Å; D301-V303 PolarHBondContact O-N 2.9Å; D301-A398 HydrophobicContact CB-CB 4.42Å
302	K	94.1	Very high	95	Very high	55 Å²	55	54.3 Å²	54.3	24%	0.239	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-66	130.3	-178.2	-76	176.9	158.4	-80.9	0	112.6	V298 S299 E300 E306 E307 L352	V298-K302 HydrophobicContact CG2-CB 4.44Å; V298-K302 HydrophobicContact CG2-CD 3.68Å; S299-K302 WeakPolarHBondContact O-CB 3.07Å; S299-K302 PolarHBondContact O-N 2.97Å; E300-K302 PolarHBondContact O-N 2.83Å; K302-E306 IonicContact NZ-OE2 3.66Å; K302-E306 PolarHBondContact NZ-OE2 2.93Å; K302-E307 PolarHBondContact NZ-O 2.87Å; K302-L352 HydrophobicContact CB-CD2 3.81Å; K302-L352 WeakPolarHBondContact O-CD2 2.97Å
303	V	94.2	Very high	95	Very high	85 Å²	85	50 Å²	50	52%	0.515	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-83.8	156.4	178.3	-61.6	0	0	0	0	112.7	D301 G305 E306	D301-V303 PolarHBondContact O-N 2.9Å; V303-G305 PolarHBondContact O-N 2.94Å; V303-E306 HydrophobicContact CG2-CG 4.16Å; V303-E306 WeakPolarHBondContact O-CB 3.41Å; V303-E306 PolarHBondContact O-N 3.19Å
304	A	94.1	Very high	94.8	Very high	60 Å²	60	54.3 Å²	54.3	50%	0.496	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	135.6	175.6	0	0	0	0	0	111.7	L352	A304-L352 CarbonylContact C-O 3.53Å; A304-L352 WeakPolarHBondContact CA-O 3.39Å
305	G	92.8	Very high	94.6	Very high	50 Å²	50	54.3 Å²	54.3	52%	0.515	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.8	-20.2	-172.7	0	0	0	0	0	113.8	V303 L352	V303-G305 PolarHBondContact O-N 2.94Å; G305-L352 PolarHBondContact N-O 2.75Å
306	E	94.5	Very high	94.3	Very high	77 Å²	77	51.8 Å²	51.8	36%	0.36	29%	0.286	S	S	.	.			trans	-70.9	154.7	-179.2	-79.3	-160.2	-143.4	0	0	114.5	K302 V303 K351 L352	K302-E306 IonicContact NZ-OE2 3.66Å; K302-E306 PolarHBondContact NZ-OE2 2.93Å; V303-E306 HydrophobicContact CG2-CG 4.16Å; V303-E306 WeakPolarHBondContact O-CB 3.41Å; V303-E306 PolarHBondContact O-N 3.19Å; E306-K351 CarbonylContact O-C 3.57Å; E306-K351 WeakPolarHBondContact O-CA 3.45Å; E306-K351 WeakPolarHBondContact O-CB 3.29Å; E306-L352 PolarHBondContact O-N 2.58Å
307	E	95.5	Very high	94.2	Very high	74 Å²	74	51 Å²	51	35%	0.346	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	134.9	173.2	-174.6	171.5	142.9	0	0	111.1	K302 R310 V349	K302-E307 PolarHBondContact NZ-O 2.87Å; E307-R310 VanDerWaalsContact OE1-CG 3.28Å; E307-R310 WeakPolarHBondContact OE1-CG 3.26Å; E307-R310 IonicContact OE1-CZ 3.89Å; E307-R310 IonicContact OE1-NE 3.2Å; E307-R310 PolarHBondContact OE1-NE 2.99Å; E307-R310 IonicContact OE1-NH2 2.73Å; E307-R310 PolarHBondContact OE1-NH2 3.06Å; E307-R310 IonicContact OE2-CZ 2.58Å; E307-R310 IonicContact OE2-NE 3.49Å; E307-R310 PolarHBondContact OE2-NE 3.49Å; E307-R310 IonicContact OE2-NH2 3.76Å; E307-R310 PolarHBondContact OE2-NH2 2.86Å; E307-V349 HydrophobicContact CB-CG1 4.36Å; E307-V349 HydrophobicContact CG-CG1 3.6Å; E307-V349 WeakPolarHBondContact OE2-CG1 3.27Å
308	V	95.9	Very high	93.9	Very high	19 Å²	19	53 Å²	53	12%	0.115	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-35.9	175.3	177.5	0	0	0	0	110.9	M296 V298 F337 I350 L352 I393	M296-V308 HydrophobicContact CG-CG1 4.35Å; M296-V308 HydrophobicContact SD-CG1 4Å; V298-V308 HydrophobicContact CB-CG1 3.95Å; V298-V308 HydrophobicContact CB-CG2 4.35Å; V298-V308 HydrophobicContact CG2-CG1 4.37Å; V298-V308 HydrophobicContact CG2-CG2 3.86Å; V308-F337 HydrophobicContact CG2-CD1 4.13Å; V308-F337 HydrophobicContact CG2-CE1 4.02Å; V308-I350 HydrophobicContact CB-CG2 4.24Å; V308-I350 PolarHBondContact N-O 2.78Å; V308-L352 HydrophobicContact CG2-CB 4.23Å; V308-I393 HydrophobicContact CG1-CD1 4.37Å; V308-I393 HydrophobicContact CG1-CG2 4.08Å
309	G	94.3	Very high	93.5	Very high	15 Å²	15	55 Å²	55	16%	0.155	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.1	176.7	178.1	0	0	0	0	0	112.7	I350	G309-I350 PolarHBondContact O-N 3.47Å
310	R	95.2	Very high	93.1	Very high	99 Å²	99	59.3 Å²	59.3	37%	0.374	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	152.7	-179.4	-54.4	-168.4	-177.7	-165.1	-2.6	111.9	E307 E347 A348 V349	E307-R310 VanDerWaalsContact OE1-CG 3.28Å; E307-R310 WeakPolarHBondContact OE1-CG 3.26Å; E307-R310 IonicContact OE1-CZ 3.89Å; E307-R310 IonicContact OE1-NE 3.2Å; E307-R310 PolarHBondContact OE1-NE 2.99Å; E307-R310 IonicContact OE1-NH2 2.73Å; E307-R310 PolarHBondContact OE1-NH2 3.06Å; E307-R310 IonicContact OE2-CZ 2.58Å; E307-R310 IonicContact OE2-NE 3.49Å; E307-R310 PolarHBondContact OE2-NE 3.49Å; E307-R310 IonicContact OE2-NH2 3.76Å; E307-R310 PolarHBondContact OE2-NH2 2.86Å; R310-E347 VanDerWaalsContact CD-OE2 3.26Å; R310-E347 WeakPolarHBondContact CD-OE2 3.23Å; R310-E347 IonicContact CZ-OE2 3.8Å; R310-E347 IonicContact NE-OE2 3.65Å; R310-E347 IonicContact NH1-OE2 3.68Å; R310-E347 PolarHBondContact NH1-OE2 2.89Å; R310-A348 VanDerWaalsContact CA-O 3.28Å; R310-A348 WeakPolarHBondContact CA-O 3.21Å; R310-V349 HydrophobicContact CG-CG1 4.49Å; R310-V349 HydrophobicContact CG-CG2 4.2Å
311	L	95	Very high	92.8	Very high	6 Å²	6	60.1 Å²	60.1	3%	0.031	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	161.8	164.2	71.8	159.5	0	0	0	110.8	F289 Y294 A348 I350 V368 I391	F289-L311 HydrophobicContact CD1-CD1 3.81Å; F289-L311 HydrophobicContact CE1-CD1 3.36Å; F289-L311 HydrophobicContact CE1-CG 4.07Å; F289-L311 HydrophobicContact CZ-CD1 4.07Å; Y294-L311 HydrophobicContact CD1-CB 4.26Å; Y294-L311 HydrophobicContact CD2-CB 4.39Å; Y294-L311 HydrophobicContact CD2-CD1 3.92Å; Y294-L311 HydrophobicContact CE1-CB 4Å; Y294-L311 HydrophobicContact CE2-CB 4.13Å; Y294-L311 HydrophobicContact CE2-CD1 3.73Å; Y294-L311 HydrophobicContact CG-CB 4.45Å; L311-A348 HydrophobicContact CD2-CB 3.66Å; L311-A348 HydrophobicContact CG-CB 4.05Å; L311-A348 PolarHBondContact N-O 3Å; L311-A348 PolarHBondContact O-N 3.14Å; L311-I350 HydrophobicContact CD2-CD1 3.81Å; L311-I350 HydrophobicContact CD2-CG1 4.15Å; L311-V368 HydrophobicContact CD1-CG1 3.5Å; L311-V368 VanDerWaalsContact CD1-CG1 3.5Å; L311-V368 HydrophobicContact CD1-CG2 4.47Å; L311-I391 HydrophobicContact CD2-CD1 4.36Å
312	K	94.6	Very high	92.6	Very high	90 Å²	90	55.5 Å²	55.5	39%	0.391	31%	0.313	S	S	.	.			trans	-146.3	121.5	179.8	-172.4	165.4	-176.3	173.1	0	109.7	P290 T345 E347	P290-K312 WeakPolarHBondContact CD-O 3.44Å; K312-T345 PolarHBondContact NZ-O 3.42Å; K312-E347 HydrophobicContact CB-CG 4.27Å; K312-E347 HydrophobicContact CD-CG 3.94Å; K312-E347 HydrophobicContact CG-CG 4.5Å
313	A	94.4	Very high	92.4	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.008	32%	0.315	C	S	.	.			trans	-75.4	145.9	160.4	0	0	0	0	0	108.4	P287 K288 F289 V324 Y326	P287-A313 HydrophobicContact CB-CB 4.04Å; K288-A313 CarbonylContact O-C 3.54Å; K288-A313 WeakPolarHBondContact O-CA 3.42Å; F289-A313 HydrophobicContact CD1-CB 3.76Å; F289-A313 HydrophobicContact CD2-CB 4.43Å; F289-A313 HydrophobicContact CE1-CB 3.75Å; F289-A313 HydrophobicContact CE2-CB 4.44Å; F289-A313 HydrophobicContact CG-CB 4.11Å; F289-A313 HydrophobicContact CZ-CB 4.11Å; A313-V324 HydrophobicContact CB-CG1 4.15Å; A313-V324 HydrophobicContact CB-CG2 4.39Å; A313-Y326 HydrophobicContact CB-CE1 4.02Å; A313-Y326 PolarHBondContact N-OH 2.96Å; A313-Y326 PolarHBondContact O-OH 2.93Å
314	K	92.9	Very high	92.3	Very high	152 Å²	152	52.2 Å²	52.2	66%	0.661	30%	0.295	S	S	*	.	B	Isolated β-bridge	trans	-101.7	129.3	172	-67.2	-173.2	177.9	-174.9	0	108.7	K288 P290	K288-K314 PolarHBondContact N-O 2.93Å; K288-K314 PolarHBondContact O-N 3.44Å; P290-K314 HydrophobicContact CG-CG 4.45Å
315	D	92.3	Very high	92.1	Very high	25 Å²	25	53.5 Å²	53.5	13%	0.134	29%	0.293	C	S	.	.			trans	-121.2	122.7	172.6	-164.3	-33.9	0	0	0	104.5	P287 D317 V324 N372	P287-D315 HydrophobicContact CB-CB 4.4Å; P287-D315 WeakPolarHBondContact CD-OD2 3.22Å; P287-D315 HydrophobicContact CG-CB 4.49Å; P287-D315 VanDerWaalsContact CG-OD2 3.31Å; P287-D315 WeakPolarHBondContact CG-OD2 3.49Å; D315-D317 PolarHBondContact OD1-N 2.91Å; D315-V324 HydrophobicContact CB-CG2 3.76Å; D315-N372 PolarHBondContact OD2-ND2 2.78Å
316	P	91.6	Very high	92.2	Very high	64 Å²	64	51.7 Å²	51.7	42%	0.416	27%	0.271	S	S	.	.			trans	-84.8	-13.8	-173.8	35.5	-34.5	0	0	0	113.2	R247 E248 N285	R247-P316 PolarHBondContact NH2-O 3.08Å; E248-P316 HydrophobicContact CG-CB 3.98Å; E248-P316 HydrophobicContact CG-CG 4.19Å; N285-P316 HydrophobicContact CB-CG 3.51Å; N285-P316 VanDerWaalsContact CG-CG 3.45Å
317	D	91.9	Very high	92.2	Very high	11 Å²	11	54.9 Å²	54.9	6%	0.059	28%	0.28	C	S	.	.	S	Bend	trans	-73.7	169	-173.8	-59.1	3.3	0	0	0	111.1	N283 D284 N285 D315 N321 G322	N283-D317 WeakPolarHBondContact CA-OD2 3.33Å; D284-D317 PolarHBondContact N-OD2 3.26Å; D284-D317 VanDerWaalsContact N-OD2 3.13Å; N285-D317 VanDerWaalsContact CB-OD1 3.29Å; N285-D317 WeakPolarHBondContact CB-OD1 3.24Å; N285-D317 PolarHBondContact N-OD2 3.02Å; N285-D317 VanDerWaalsContact N-OD2 3.11Å; N285-D317 PolarHBondContact ND2-OD1 3.43Å; D315-D317 PolarHBondContact OD1-N 2.91Å; D317-N321 HydrophobicContact CB-CB 3.88Å; D317-G322 WeakPolarHBondContact O-CA 3.39Å
318	M	90.2	Very high	92.2	Very high	89 Å²	89	52.8 Å²	52.8	44%	0.438	27%	0.271	S	S	.	.			trans	-101.2	139.6	-165.7	-160.1	178.2	-62.7	0	0	114	D281 D320 N321	D281-M318 HydrophobicContact CB-CB 3.81Å; D281-M318 WeakPolarHBondContact OD1-CA 3.02Å; D281-M318 WeakPolarHBondContact OD1-CB 3.38Å; D281-M318 PolarHBondContact OD1-N 2.65Å; D281-M318 PolarHBondContact OD2-N 3.06Å; D281-M318 VanDerWaalsContact OD2-N 3.16Å; M318-D320 PolarHBondContact O-N 2.97Å; M318-D320 VanDerWaalsContact O-N 3.13Å; M318-N321 PolarHBondContact O-N 3.03Å; M318-N321 VanDerWaalsContact O-N 3.1Å
319	G	87.9	Confident	92.2	Very high	44 Å²	44	54.5 Å²	54.5	45%	0.454	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.9	-108.9	168.4	0	0	0	0	0	113.3	R346	G319-R346 PolarHBondContact O-NH1 3.35Å
320	D	87	Confident	92.2	Very high	113 Å²	113	57.5 Å²	57.5	60%	0.604	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-29.3	176.2	-69.2	-21.5	0	0	0	111.9	M318 G322 L323	M318-D320 PolarHBondContact O-N 2.97Å; M318-D320 VanDerWaalsContact O-N 3.13Å; D320-G322 PolarHBondContact O-N 3.08Å; D320-L323 VanDerWaalsContact O-CB 3.25Å; D320-L323 WeakPolarHBondContact O-CB 3.32Å; D320-L323 PolarHBondContact O-N 2.96Å
321	N	87.4	Confident	92.1	Very high	24 Å²	24	53.9 Å²	53.9	13%	0.128	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-24	172.6	-66.5	-18.9	0	0	0	111.5	D281 N283 D317 M318 N372 H374	D281-N321 WeakPolarHBondContact OD2-CB 3.43Å; D281-N321 PolarHBondContact OD2-ND2 2.81Å; N283-N321 HydrophobicContact CB-CB 3.94Å; N283-N321 PolarHBondContact N-ND2 3.16Å; D317-N321 HydrophobicContact CB-CB 3.88Å; M318-N321 PolarHBondContact O-N 3.03Å; M318-N321 VanDerWaalsContact O-N 3.1Å; N321-N372 PolarHBondContact O-ND2 3.4Å; N321-H374 PolarHBondContact OD1-CD2 2.84Å; N321-H374 VanDerWaalsContact OD1-CD2 3.27Å
322	G	88.9	Confident	92.1	Very high	12 Å²	12	57.6 Å²	57.6	12%	0.124	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	20.5	171.1	0	0	0	0	0	115.1	D317 D320	D317-G322 WeakPolarHBondContact O-CA 3.39Å; D320-G322 PolarHBondContact O-N 3.08Å
323	L	89.2	Confident	92	Very high	56 Å²	56	53.3 Å²	53.3	29%	0.293	29%	0.286	S	S	.	.			trans	-96.4	104.1	-173.6	-173.8	68.2	0	0	0	112.1	D320 P373	D320-L323 VanDerWaalsContact O-CB 3.25Å; D320-L323 WeakPolarHBondContact O-CB 3.32Å; D320-L323 PolarHBondContact O-N 2.96Å; L323-P373 HydrophobicContact CD2-CG 4.07Å; L323-P373 HydrophobicContact CG-CG 4.43Å; L323-P373 WeakPolarHBondContact O-CD 3.27Å
324	V	91.8	Very high	92	Very high	16 Å²	16	57.8 Å²	57.8	10%	0.097	31%	0.308	C	S	.	.			trans	-83	124	174.1	-163.6	0	0	0	0	112	P287 A313 D315 Y326	P287-V324 HydrophobicContact CB-CG1 3.97Å; P287-V324 HydrophobicContact CB-CG2 3.82Å; P287-V324 HydrophobicContact CG-CG1 4.18Å; P287-V324 HydrophobicContact CG-CG2 4.06Å; A313-V324 HydrophobicContact CB-CG1 4.15Å; A313-V324 HydrophobicContact CB-CG2 4.39Å; D315-V324 HydrophobicContact CB-CG2 3.76Å; V324-Y326 HydrophobicContact CB-CE1 4.26Å; V324-Y326 HydrophobicContact CB-CE2 4.12Å; V324-Y326 HydrophobicContact CG1-CD1 3.98Å; V324-Y326 HydrophobicContact CG1-CE1 3.51Å; V324-Y326 HydrophobicContact CG1-CE2 4.14Å; V324-Y326 HydrophobicContact CG1-CG 4.48Å
325	N	91.8	Very high	92	Very high	86 Å²	86	53.7 Å²	53.7	46%	0.46	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	144.9	163.3	-172.8	20	0	0	0	110.2	G370 S371	N325-G370 CarbonylContact O-C 3.54Å; N325-G370 WeakPolarHBondContact O-CA 3.3Å; N325-S371 PolarHBondContact N-O 2.97Å; N325-S371 PolarHBondContact O-N 3.5Å
326	Y	94.6	Very high	92.1	Very high	13 Å²	13	53.9 Å²	53.9	5%	0.051	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	137.9	-172.3	-62.8	-76.1	0	0	0	112.4	F289 A313 V324 T341 R346 A348 E369	F289-Y326 HydrophobicContact CE1-CD1 4.29Å; F289-Y326 AromaticContact CE1-CE1 3.84Å; F289-Y326 HydrophobicContact CE1-CE1 3.84Å; F289-Y326 HydrophobicContact CZ-CD1 4.08Å; F289-Y326 AromaticContact CZ-CE1 3.98Å; F289-Y326 HydrophobicContact CZ-CE1 3.98Å; A313-Y326 HydrophobicContact CB-CE1 4.02Å; A313-Y326 PolarHBondContact N-OH 2.96Å; A313-Y326 PolarHBondContact O-OH 2.93Å; V324-Y326 HydrophobicContact CB-CE1 4.26Å; V324-Y326 HydrophobicContact CB-CE2 4.12Å; V324-Y326 HydrophobicContact CG1-CD1 3.98Å; V324-Y326 HydrophobicContact CG1-CE1 3.51Å; V324-Y326 HydrophobicContact CG1-CE2 4.14Å; V324-Y326 HydrophobicContact CG1-CG 4.48Å; Y326-T341 HydrophobicContact CD2-CG2 4.28Å; Y326-R346 PolarHBondContact OH-O 3.22Å; Y326-A348 HydrophobicContact CD1-CB 3.97Å; Y326-A348 HydrophobicContact CD2-CB 3.84Å; Y326-A348 HydrophobicContact CE1-CB 4.36Å; Y326-A348 HydrophobicContact CE2-CB 4.24Å; Y326-A348 HydrophobicContact CG-CB 3.68Å; Y326-E369 WeakPolarHBondContact CA-O 3.12Å
327	R	93.8	Very high	92.4	Very high	143 Å²	143	51 Å²	51	54%	0.54	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	135.9	-177	177.7	167.3	63.3	170.7	2	112.4	I329 V368 E369	R327-I329 HydrophobicContact CG-CG2 4.08Å; R327-V368 WeakPolarHBondContact O-CA 3.22Å; R327-E369 IonicContact CZ-OE1 3.63Å; R327-E369 PolarHBondContact N-O 3.24Å; R327-E369 IonicContact NE-OE1 3.22Å; R327-E369 PolarHBondContact NE-OE1 2.68Å; R327-E369 IonicContact NH2-OE1 3.13Å; R327-E369 PolarHBondContact NH2-OE1 3.17Å; R327-E369 IonicContact NH2-OE2 3.15Å; R327-E369 PolarHBondContact O-N 2.89Å
328	L	95.6	Very high	92.5	Very high	30 Å²	30	54.2 Å²	54.2	16%	0.157	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	122.6	163.9	-60.3	179.4	0	0	0	108.8	L339 L366 K367 V368 I391	L328-L339 HydrophobicContact CD1-CB 4.33Å; L328-L339 HydrophobicContact CD2-CD1 3.95Å; L328-L339 HydrophobicContact CG-CB 4.04Å; L328-L339 HydrophobicContact CG-CD1 4.21Å; L328-L366 HydrophobicContact CD1-CD1 4.34Å; L328-L366 HydrophobicContact CD2-CB 4.3Å; L328-L366 HydrophobicContact CD2-CD1 4.17Å; L328-K367 WeakPolarHBondContact CA-O 3.24Å; L328-V368 HydrophobicContact CD2-CB 4.19Å; L328-I391 HydrophobicContact CD2-CD1 4.46Å
329	I	94.9	Very high	92.8	Very high	55 Å²	55	51.8 Å²	51.8	28%	0.282	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	-25.8	-172.8	51.8	161.3	0	0	0	114.1	R327 K367 E369 E388	R327-I329 HydrophobicContact CG-CG2 4.08Å; I329-K367 HydrophobicContact CD1-CB 4.12Å; I329-K367 HydrophobicContact CG1-CB 3.79Å; I329-K367 PolarHBondContact N-O 2.93Å; I329-E369 HydrophobicContact CD1-CB 4.18Å; I329-E369 HydrophobicContact CG1-CB 4.3Å; I329-E369 HydrophobicContact CG2-CB 3.58Å; I329-E369 HydrophobicContact CG2-CG 4.37Å; I329-E388 VanDerWaalsContact CD1-CD 3.48Å; I329-E388 HydrophobicContact CD1-CG 3.87Å; I329-E388 WeakPolarHBondContact CD1-OE2 3.37Å
330	D	94.9	Very high	93	Very high	79 Å²	79	51.5 Å²	51.5	42%	0.422	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	163.9	-175	179.7	25.8	0	0	0	108.8	M334 K367	D330-M334 VanDerWaalsContact C-SD 3.6Å; D330-K367 HydrophobicContact CB-CB 4.17Å; D330-K367 HydrophobicContact CB-CD 4.1Å; D330-K367 HydrophobicContact CB-CG 4.36Å; D330-K367 PolarHBondContact O-N 3.04Å; D330-K367 WeakPolarHBondContact OD2-CE 3.22Å; D330-K367 IonicContact OD2-NZ 2.65Å; D330-K367 PolarHBondContact OD2-NZ 2.86Å
331	G	94.3	Very high	93.3	Very high	22 Å²	22	49.4 Å²	49.4	23%	0.227	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	125.6	157.6	173.5	0	0	0	0	0	115.5	G333 M334 T365	G331-G333 VanDerWaalsContact C-N 3.29Å; G331-G333 PolarHBondContact O-N 3.04Å; G331-M334 WeakPolarHBondContact O-CG 3.35Å; G331-T365 CarbonylContact C-O 3.59Å; G331-T365 WeakPolarHBondContact CA-O 3.45Å
332	D	94.6	Very high	93.4	Very high	84 Å²	84	50.1 Å²	50.1	45%	0.449	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	2.4	-171	72	-4.5	0	0	0	114.2	K361 Y364 T365	D332-K361 PolarHBondContact O-NZ 3.29Å; D332-K361 IonicContact OD1-NZ 3.97Å; D332-K361 IonicContact OD2-NZ 3.02Å; D332-K361 PolarHBondContact OD2-NZ 2.67Å; D332-Y364 WeakPolarHBondContact OD1-CA 3.37Å; D332-T365 PolarHBondContact N-O 3Å; D332-T365 PolarHBondContact OD1-N 2.83Å
333	G	91.9	Very high	93.3	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	0.5	172.5	0	0	0	0	0	114.9	G331 S335 M336 F337	G331-G333 VanDerWaalsContact C-N 3.29Å; G331-G333 PolarHBondContact O-N 3.04Å; G333-S335 PolarHBondContact O-N 3.25Å; G333-M336 PolarHBondContact O-N 2.99Å; G333-F337 WeakPolarHBondContact O-CD2 3.44Å; G333-F337 PolarHBondContact O-N 3.21Å
334	M	93.6	Very high	93.2	Very high	95 Å²	95	60.6 Å²	60.6	47%	0.468	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-15.1	-175.1	-74.6	178.3	64.1	0	0	115	D330 G331 L366	D330-M334 VanDerWaalsContact C-SD 3.6Å; G331-M334 WeakPolarHBondContact O-CG 3.35Å; M334-L366 HydrophobicContact CG-CD2 4.15Å
335	S	93.5	Very high	93	Very high	66 Å²	66	62.1 Å²	62.1	46%	0.462	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-15.5	174.5	53.5	0	0	0	0	114.3	G333	G333-S335 PolarHBondContact O-N 3.25Å
336	M	95.3	Very high	92.8	Very high	30 Å²	30	63.3 Å²	63.3	15%	0.148	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-26.1	-171.7	-53.2	-57.3	-72.2	0	0	112.6	G333 K353 K354 Q355 V356 Y364	G333-M336 PolarHBondContact O-N 2.99Å; M336-K353 WeakPolarHBondContact O-CA 3.28Å; M336-K353 VanDerWaalsContact O-CB 3.3Å; M336-K353 WeakPolarHBondContact O-CB 3.28Å; M336-K353 PolarHBondContact O-N 2.86Å; M336-K354 HydrophobicContact CE-CB 3.96Å; M336-K354 PolarHBondContact O-N 2.91Å; M336-K354 HydrophobicContact SD-CB 4.19Å; M336-K354 HydrophobicContact SD-CD 4.04Å; M336-Q355 WeakPolarHBondContact CE-O 3.26Å; M336-V356 HydrophobicContact CB-CG1 4.41Å; M336-V356 HydrophobicContact CE-CG1 4.02Å; M336-Y364 HydrophobicContact CB-CE1 4.39Å; M336-Y364 HydrophobicContact CG-CE1 3.71Å
337	F	96.4	Very high	92.8	Very high	3 Å²	3	65 Å²	65	1%	0.013	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	156.6	179.2	-55.3	-81.3	0	0	0	111.9	V298 V308 G333 I350 K351 L352 V356 Y364 L366 I393	V298-F337 HydrophobicContact CG1-CE1 4.38Å; V298-F337 HydrophobicContact CG1-CZ 4.35Å; V308-F337 HydrophobicContact CG2-CD1 4.13Å; V308-F337 HydrophobicContact CG2-CE1 4.02Å; G333-F337 WeakPolarHBondContact O-CD2 3.44Å; G333-F337 PolarHBondContact O-N 3.21Å; F337-I350 HydrophobicContact CB-CG2 4.3Å; F337-I350 HydrophobicContact CD1-CG2 4.3Å; F337-K351 CarbonylContact C-O 3.53Å; F337-K351 WeakPolarHBondContact CA-O 3.33Å; F337-L352 HydrophobicContact CD1-CD1 4Å; F337-L352 HydrophobicContact CE1-CD1 3.6Å; F337-L352 HydrophobicContact CZ-CD1 4.32Å; F337-V356 HydrophobicContact CZ-CG1 4.01Å; F337-Y364 HydrophobicContact CE2-CD1 4.22Å; F337-Y364 AromaticContact CE2-CD2 3.73Å; F337-Y364 HydrophobicContact CE2-CD2 3.73Å; F337-Y364 HydrophobicContact CE2-CE2 4.29Å; F337-Y364 AromaticContact CE2-CG 3.69Å; F337-Y364 HydrophobicContact CE2-CG 3.69Å; F337-Y364 HydrophobicContact CZ-CD2 4.05Å; F337-Y364 HydrophobicContact CZ-CE2 4.5Å; F337-Y364 HydrophobicContact CZ-CG 4.44Å; F337-L366 HydrophobicContact CB-CD1 3.99Å; F337-L366 HydrophobicContact CD2-CD1 4.15Å; F337-L366 HydrophobicContact CG-CD1 4.23Å; F337-I393 HydrophobicContact CD1-CD1 3.81Å; F337-I393 HydrophobicContact CD2-CD1 3.9Å; F337-I393 HydrophobicContact CE1-CD1 3.69Å; F337-I393 HydrophobicContact CE1-CG2 4.25Å; F337-I393 HydrophobicContact CE2-CD1 3.81Å; F337-I393 HydrophobicContact CG-CD1 3.92Å; F337-I393 HydrophobicContact CZ-CB 4.35Å; F337-I393 HydrophobicContact CZ-CD1 3.7Å; F337-I393 HydrophobicContact CZ-CG2 3.95Å
338	E	95.6	Very high	92.8	Very high	79 Å²	79	58.1 Å²	58.1	37%	0.369	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	169	168.3	61	-177.9	-147.1	0	0	111.1	I350 K351 K353	E338-I350 WeakPolarHBondContact O-CA 3.17Å; E338-K351 HydrophobicContact CG-CB 4.29Å; E338-K351 PolarHBondContact N-O 3.48Å; E338-K351 PolarHBondContact O-N 2.68Å; E338-K353 HydrophobicContact CB-CB 4.44Å; E338-K353 HydrophobicContact CG-CB 4.2Å; E338-K353 HydrophobicContact CG-CG 4.45Å; E338-K353 IonicContact OE2-NZ 3.92Å; E338-K353 PolarHBondContact OE2-NZ 3.27Å
339	L	95.4	Very high	92.8	Very high	38 Å²	38	57 Å²	57	20%	0.199	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	131.4	-175.5	-168.6	158.5	0	0	0	109	L328 A348 V368	L328-L339 HydrophobicContact CD1-CB 4.33Å; L328-L339 HydrophobicContact CD2-CD1 3.95Å; L328-L339 HydrophobicContact CG-CB 4.04Å; L328-L339 HydrophobicContact CG-CD1 4.21Å; L339-A348 HydrophobicContact CD1-CB 4.04Å; L339-A348 HydrophobicContact CD2-CB 3.91Å; L339-A348 HydrophobicContact CG-CB 4.1Å; L339-V368 HydrophobicContact CD1-CG2 3.59Å
340	S	93.1	Very high	92.9	Very high	37 Å²	37	54.4 Å²	54.4	26%	0.259	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	132.1	176.2	58.4	0	0	0	0	110.2	V349 K351	S340-V349 PolarHBondContact N-O 3.11Å; S340-V349 WeakPolarHBondContact O-CA 2.97Å; S340-V349 WeakPolarHBondContact O-CB 3.31Å; S340-V349 PolarHBondContact O-N 3.27Å; S340-V349 PolarHBondContact OG-O 3.2Å; S340-K351 VanDerWaalsContact OG-CE 3.28Å; S340-K351 WeakPolarHBondContact OG-CE 3.23Å; S340-K351 PolarHBondContact OG-NZ 3.4Å
341	T	91.6	Very high	92.9	Very high	70 Å²	70	53.9 Å²	53.9	43%	0.429	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	128.5	177.4	-51.2	0	0	0	0	110.1	Y326 E347	Y326-T341 HydrophobicContact CD2-CG2 4.28Å; T341-E347 CarbonylContact C-O 3.6Å; T341-E347 WeakPolarHBondContact CA-O 3.08Å
342	N	91.4	Very high	93	Very high	39 Å²	39	52.8 Å²	52.8	21%	0.209	28%	0.28	C	S	.	.			trans	-74.1	124.6	172	-176.8	-49.2	0	0	0	109.9	E344 T345 R346 E347 V349	N342-E344 VanDerWaalsContact C-N 3.33Å; N342-E344 PolarHBondContact O-N 2.81Å; N342-E344 PolarHBondContact OD1-N 2.95Å; N342-T345 VanDerWaalsContact CB-OG1 3.3Å; N342-T345 WeakPolarHBondContact CB-OG1 3.11Å; N342-T345 PolarHBondContact OD1-N 2.63Å; N342-T345 PolarHBondContact OD1-OG1 3.29Å; N342-R346 VanDerWaalsContact O-CA 3.3Å; N342-R346 WeakPolarHBondContact O-CA 3.46Å; N342-R346 PolarHBondContact O-N 2.76Å; N342-E347 HydrophobicContact CB-CB 4.48Å; N342-E347 PolarHBondContact N-O 3.05Å; N342-V349 HydrophobicContact CB-CG2 3.94Å
343	S	86.3	Confident	93	Very high	115 Å²	115	53.6 Å²	53.6	80%	0.804	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-26.2	-176.3	47.9	0	0	0	0	114.7
344	E	86.5	Confident	93.1	Very high	173 Å²	173	59.1 Å²	59.1	81%	0.808	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-51.1	-179.7	-61.7	176.4	177.1	0	0	110.8	N342	N342-E344 VanDerWaalsContact C-N 3.33Å; N342-E344 PolarHBondContact O-N 2.81Å; N342-E344 PolarHBondContact OD1-N 2.95Å
345	T	87.6	Confident	93.1	Very high	47 Å²	47	59.7 Å²	59.7	29%	0.288	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-12.1	-173.4	63.8	0	0	0	0	113.8	K312 N342 E347	K312-T345 PolarHBondContact NZ-O 3.42Å; N342-T345 VanDerWaalsContact CB-OG1 3.3Å; N342-T345 WeakPolarHBondContact CB-OG1 3.11Å; N342-T345 PolarHBondContact OD1-N 2.63Å; N342-T345 PolarHBondContact OD1-OG1 3.29Å; T345-E347 VanDerWaalsContact CB-OE2 3.29Å; T345-E347 WeakPolarHBondContact CB-OE2 3.22Å; T345-E347 PolarHBondContact O-N 2.9Å; T345-E347 WeakPolarHBondContact OG1-CB 3.22Å; T345-E347 VanDerWaalsContact OG1-CG 3.23Å; T345-E347 WeakPolarHBondContact OG1-CG 3.32Å; T345-E347 PolarHBondContact OG1-OE2 2.95Å
346	R	88.2	Confident	93.2	Very high	112 Å²	112	56.8 Å²	56.8	42%	0.423	29%	0.285	S	S	.	.			trans	52.1	37.5	-170.1	-59.1	-174.7	178.9	-165.9	-3.4	112.6	G319 Y326 N342	G319-R346 PolarHBondContact O-NH1 3.35Å; Y326-R346 PolarHBondContact OH-O 3.22Å; N342-R346 VanDerWaalsContact O-CA 3.3Å; N342-R346 WeakPolarHBondContact O-CA 3.46Å; N342-R346 PolarHBondContact O-N 2.76Å
347	E	93.3	Very high	93.1	Very high	47 Å²	47	58.7 Å²	58.7	22%	0.22	30%	0.295	C	S	.	.			trans	-98.3	146.4	177.1	-68.4	168.4	151.9	0	0	111.2	R310 K312 T341 N342 T345 V349	R310-E347 VanDerWaalsContact CD-OE2 3.26Å; R310-E347 WeakPolarHBondContact CD-OE2 3.23Å; R310-E347 IonicContact CZ-OE2 3.8Å; R310-E347 IonicContact NE-OE2 3.65Å; R310-E347 IonicContact NH1-OE2 3.68Å; R310-E347 PolarHBondContact NH1-OE2 2.89Å; K312-E347 HydrophobicContact CB-CG 4.27Å; K312-E347 HydrophobicContact CD-CG 3.94Å; K312-E347 HydrophobicContact CG-CG 4.5Å; T341-E347 CarbonylContact C-O 3.6Å; T341-E347 WeakPolarHBondContact CA-O 3.08Å; N342-E347 HydrophobicContact CB-CB 4.48Å; N342-E347 PolarHBondContact N-O 3.05Å; T345-E347 VanDerWaalsContact CB-OE2 3.29Å; T345-E347 WeakPolarHBondContact CB-OE2 3.22Å; T345-E347 PolarHBondContact O-N 2.9Å; T345-E347 WeakPolarHBondContact OG1-CB 3.22Å; T345-E347 VanDerWaalsContact OG1-CG 3.23Å; T345-E347 WeakPolarHBondContact OG1-CG 3.32Å; T345-E347 PolarHBondContact OG1-OE2 2.95Å; E347-V349 PolarHBondContact O-N 3.42Å
348	A	94.4	Very high	93	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	115.1	162.7	0	0	0	0	0	109.1	R310 L311 Y326 L339	R310-A348 VanDerWaalsContact CA-O 3.28Å; R310-A348 WeakPolarHBondContact CA-O 3.21Å; L311-A348 HydrophobicContact CD2-CB 3.66Å; L311-A348 HydrophobicContact CG-CB 4.05Å; L311-A348 PolarHBondContact N-O 3Å; L311-A348 PolarHBondContact O-N 3.14Å; Y326-A348 HydrophobicContact CD1-CB 3.97Å; Y326-A348 HydrophobicContact CD2-CB 3.84Å; Y326-A348 HydrophobicContact CE1-CB 4.36Å; Y326-A348 HydrophobicContact CE2-CB 4.24Å; Y326-A348 HydrophobicContact CG-CB 3.68Å; L339-A348 HydrophobicContact CD1-CB 4.04Å; L339-A348 HydrophobicContact CD2-CB 3.91Å; L339-A348 HydrophobicContact CG-CB 4.1Å
349	V	96	Very high	92.8	Very high	6 Å²	6	58.9 Å²	58.9	4%	0.036	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	114.5	174.7	-173.9	0	0	0	0	108.5	E307 R310 S340 N342 E347 K351	E307-V349 HydrophobicContact CB-CG1 4.36Å; E307-V349 HydrophobicContact CG-CG1 3.6Å; E307-V349 WeakPolarHBondContact OE2-CG1 3.27Å; R310-V349 HydrophobicContact CG-CG1 4.49Å; R310-V349 HydrophobicContact CG-CG2 4.2Å; S340-V349 PolarHBondContact N-O 3.11Å; S340-V349 WeakPolarHBondContact O-CA 2.97Å; S340-V349 WeakPolarHBondContact O-CB 3.31Å; S340-V349 PolarHBondContact O-N 3.27Å; S340-V349 PolarHBondContact OG-O 3.2Å; N342-V349 HydrophobicContact CB-CG2 3.94Å; E347-V349 PolarHBondContact O-N 3.42Å; V349-K351 HydrophobicContact CG1-CG 4.28Å
350	I	96.3	Very high	92.6	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	129.7	176.5	-59.9	157.6	0	0	0	108.1	M296 V308 G309 L311 F337 E338 I391 I393	M296-I350 HydrophobicContact CE-CD1 3.58Å; M296-I350 HydrophobicContact SD-CD1 3.58Å; M296-I350 VanDerWaalsContact SD-CD1 3.58Å; V308-I350 HydrophobicContact CB-CG2 4.24Å; V308-I350 PolarHBondContact N-O 2.78Å; G309-I350 PolarHBondContact O-N 3.47Å; L311-I350 HydrophobicContact CD2-CD1 3.81Å; L311-I350 HydrophobicContact CD2-CG1 4.15Å; F337-I350 HydrophobicContact CB-CG2 4.3Å; F337-I350 HydrophobicContact CD1-CG2 4.3Å; E338-I350 WeakPolarHBondContact O-CA 3.17Å; I350-I391 HydrophobicContact CD1-CD1 3.56Å; I350-I391 HydrophobicContact CD1-CG1 4.12Å; I350-I391 HydrophobicContact CD1-CG2 4.1Å; I350-I391 HydrophobicContact CG1-CD1 4.35Å; I350-I393 HydrophobicContact CG2-CD1 4.39Å
351	K	95.6	Very high	92.7	Very high	68 Å²	68	63.2 Å²	63.2	30%	0.296	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	152	-178.6	-67.9	-177	177.4	174.8	0	112.2	E306 F337 E338 S340 V349 K353	E306-K351 CarbonylContact O-C 3.57Å; E306-K351 WeakPolarHBondContact O-CA 3.45Å; E306-K351 WeakPolarHBondContact O-CB 3.29Å; F337-K351 CarbonylContact C-O 3.53Å; F337-K351 WeakPolarHBondContact CA-O 3.33Å; E338-K351 HydrophobicContact CG-CB 4.29Å; E338-K351 PolarHBondContact N-O 3.48Å; E338-K351 PolarHBondContact O-N 2.68Å; S340-K351 VanDerWaalsContact OG-CE 3.28Å; S340-K351 WeakPolarHBondContact OG-CE 3.23Å; S340-K351 PolarHBondContact OG-NZ 3.4Å; V349-K351 HydrophobicContact CG1-CG 4.28Å; K351-K353 PolarHBondContact O-N 3.27Å
352	L	96.3	Very high	92.8	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	114.9	177.5	-164	62.7	0	0	0	109.6	V298 K302 A304 G305 E306 V308 F337 K354 V356	V298-L352 HydrophobicContact CG2-CD1 4.45Å; V298-L352 HydrophobicContact CG2-CD2 4.48Å; K302-L352 HydrophobicContact CB-CD2 3.81Å; K302-L352 WeakPolarHBondContact O-CD2 2.97Å; A304-L352 CarbonylContact C-O 3.53Å; A304-L352 WeakPolarHBondContact CA-O 3.39Å; G305-L352 PolarHBondContact N-O 2.75Å; E306-L352 PolarHBondContact O-N 2.58Å; V308-L352 HydrophobicContact CG2-CB 4.23Å; F337-L352 HydrophobicContact CD1-CD1 4Å; F337-L352 HydrophobicContact CE1-CD1 3.6Å; F337-L352 HydrophobicContact CZ-CD1 4.32Å; L352-K354 WeakPolarHBondContact CD1-O 3.29Å; L352-K354 WeakPolarHBondContact CG-O 3.19Å; L352-V356 HydrophobicContact CD1-CG1 4.03Å
353	K	95.1	Very high	93	Very high	101 Å²	101	67.1 Å²	67.1	44%	0.439	33%	0.332	S	S	.	.	S	Bend	trans	-86.2	-27.9	179.2	-167	-174.2	-165.9	84.1	0	112.1	M336 E338 K351	M336-K353 WeakPolarHBondContact O-CA 3.28Å; M336-K353 VanDerWaalsContact O-CB 3.3Å; M336-K353 WeakPolarHBondContact O-CB 3.28Å; M336-K353 PolarHBondContact O-N 2.86Å; E338-K353 HydrophobicContact CB-CB 4.44Å; E338-K353 HydrophobicContact CG-CB 4.2Å; E338-K353 HydrophobicContact CG-CG 4.45Å; E338-K353 IonicContact OE2-NZ 3.92Å; E338-K353 PolarHBondContact OE2-NZ 3.27Å; K351-K353 PolarHBondContact O-N 3.27Å
354	K	94.3	Very high	93.6	Very high	116 Å²	116	62.3 Å²	62.3	50%	0.504	30%	0.296	S	S	.	.	S	Bend	trans	-145.7	145.2	174.6	-61.9	-175.2	-177.8	-176	0	108.1	M336 L352 V356	M336-K354 HydrophobicContact CE-CB 3.96Å; M336-K354 PolarHBondContact O-N 2.91Å; M336-K354 HydrophobicContact SD-CB 4.19Å; M336-K354 HydrophobicContact SD-CD 4.04Å; L352-K354 WeakPolarHBondContact CD1-O 3.29Å; L352-K354 WeakPolarHBondContact CG-O 3.19Å; K354-V356 PolarHBondContact O-N 2.83Å
355	Q	92.9	Very high	94.1	Very high	107 Å²	107	56.8 Å²	56.8	50%	0.5	28%	0.275	S	S	.	.			trans	-51.5	137.3	168.9	-165	174.4	1.4	0	0	109.9	E300 M336	E300-Q355 VanDerWaalsContact O-CG 3.32Å; E300-Q355 WeakPolarHBondContact O-CG 3.33Å; E300-Q355 PolarHBondContact O-NE2 2.73Å; M336-Q355 WeakPolarHBondContact CE-O 3.26Å
356	V	94.9	Very high	94.5	Very high	5 Å²	5	54.5 Å²	54.5	3%	0.03	26%	0.261	C	S	.	.			trans	-91.4	173.2	173.4	-73.4	0	0	0	0	109.9	V298 E300 M336 F337 L352 K354 Y364 V395	V298-V356 HydrophobicContact CG1-CG2 4.04Å; E300-V356 HydrophobicContact CB-CG2 4.2Å; M336-V356 HydrophobicContact CB-CG1 4.41Å; M336-V356 HydrophobicContact CE-CG1 4.02Å; F337-V356 HydrophobicContact CZ-CG1 4.01Å; L352-V356 HydrophobicContact CD1-CG1 4.03Å; K354-V356 PolarHBondContact O-N 2.83Å; V356-Y364 HydrophobicContact CB-CE2 4.37Å; V356-Y364 HydrophobicContact CG1-CE2 3.69Å; V356-V395 HydrophobicContact CB-CG1 4.46Å; V356-V395 HydrophobicContact CB-CG2 4.14Å; V356-V395 HydrophobicContact CG2-CG1 3.86Å; V356-V395 HydrophobicContact CG2-CG2 4.07Å
357	D	93.2	Very high	94.9	Very high	69 Å²	69	52.8 Å²	52.8	37%	0.369	26%	0.256	S	S	.	.			trans	-151.1	114.3	-169.8	158.3	-11.5	0	0	0	105	E359 T360 K361	D357-E359 PolarHBondContact OD1-N 3.25Å; D357-T360 WeakPolarHBondContact OD1-CB 3.28Å; D357-T360 PolarHBondContact OD1-N 2.77Å; D357-T360 PolarHBondContact OD1-OG1 3.48Å; D357-T360 VanDerWaalsContact OD2-CB 3.23Å; D357-T360 WeakPolarHBondContact OD2-CB 3.37Å; D357-T360 PolarHBondContact OD2-OG1 2.82Å; D357-K361 CarbonylContact O-C 3.57Å; D357-K361 PolarHBondContact O-N 3.32Å
358	F	94.4	Very high	95	Very high	23 Å²	23	50.5 Å²	50.5	10%	0.101	25%	0.246	C	C	.	.	H	α-helix	trans	-73.4	-39.9	-171.6	-178.7	-96.5	0	0	0	111.1	E300 T360 K361 R362 V395 D397 V433	E300-F358 VanDerWaalsContact OE1-CB 3.22Å; E300-F358 WeakPolarHBondContact OE1-CB 3.33Å; E300-F358 WeakPolarHBondContact OE2-CB 3.15Å; E300-F358 PolarHBondContact OE2-N 2.91Å; F358-T360 VanDerWaalsContact C-N 3.34Å; F358-T360 PolarHBondContact O-N 3.45Å; F358-K361 CarbonylContact O-C 3.48Å; F358-K361 PolarHBondContact O-N 2.74Å; F358-R362 HydrophobicContact CD1-CG 4.01Å; F358-R362 HydrophobicContact CD2-CB 4.06Å; F358-R362 HydrophobicContact CD2-CG 3.76Å; F358-R362 HydrophobicContact CE1-CG 3.93Å; F358-R362 VanDerWaalsContact CE1-NH2 3.32Å; F358-R362 HydrophobicContact CE2-CB 3.88Å; F358-R362 HydrophobicContact CE2-CG 3.68Å; F358-R362 HydrophobicContact CG-CG 3.92Å; F358-R362 HydrophobicContact CZ-CB 4.36Å; F358-R362 VanDerWaalsContact CZ-CD 3.47Å; F358-R362 HydrophobicContact CZ-CG 3.77Å; F358-R362 WeakPolarHBondContact O-CG 2.91Å; F358-R362 PolarHBondContact O-N 3Å; F358-V395 HydrophobicContact CB-CG1 3.9Å; F358-V395 HydrophobicContact CD2-CB 3.89Å; F358-V395 HydrophobicContact CD2-CG1 3.97Å; F358-V395 WeakPolarHBondContact CD2-O 3.41Å; F358-V395 VanDerWaalsContact CE2-O 3.24Å; F358-V395 WeakPolarHBondContact CE2-O 3.3Å; F358-V395 HydrophobicContact CG-CG1 4.44Å; F358-D397 HydrophobicContact CD1-CB 4.04Å; F358-D397 WeakPolarHBondContact CD1-OD1 3.25Å; F358-D397 HydrophobicContact CD2-CB 4.37Å; F358-D397 HydrophobicContact CE1-CB 3.85Å; F358-D397 VanDerWaalsContact CE1-OD1 3.24Å; F358-D397 WeakPolarHBondContact CE1-OD1 3.31Å; F358-D397 HydrophobicContact CE2-CB 4.21Å; F358-D397 HydrophobicContact CG-CB 4.31Å; F358-D397 HydrophobicContact CZ-CB 3.95Å; F358-V433 HydrophobicContact CD1-CG2 4.49Å; F358-V433 HydrophobicContact CE1-CG2 3.51Å; F358-V433 HydrophobicContact CZ-CG2 4.17Å
359	E	91.5	Very high	95.1	Very high	63 Å²	63	51.1 Å²	51.1	29%	0.294	25%	0.248	S	C	.	.	H	α-helix	trans	-59.1	-43.2	176	-84	30.9	-93.4	0	0	112	D357 R362 T431	D357-E359 PolarHBondContact OD1-N 3.25Å; E359-R362 IonicContact OE1-CZ 2.9Å; E359-R362 IonicContact OE1-NH2 3.6Å; E359-R362 PolarHBondContact OE1-NH2 2.66Å; E359-T431 HydrophobicContact CG-CG2 4.26Å
360	T	92.5	Very high	95	Very high	109 Å²	109	50.8 Å²	50.8	67%	0.669	25%	0.247	S	C	*	.	H	α-helix	trans	-73.8	-46.1	173	-67.9	0	0	0	0	111.2	D357 F358	D357-T360 WeakPolarHBondContact OD1-CB 3.28Å; D357-T360 PolarHBondContact OD1-N 2.77Å; D357-T360 PolarHBondContact OD1-OG1 3.48Å; D357-T360 VanDerWaalsContact OD2-CB 3.23Å; D357-T360 WeakPolarHBondContact OD2-CB 3.37Å; D357-T360 PolarHBondContact OD2-OG1 2.82Å; F358-T360 VanDerWaalsContact C-N 3.34Å; F358-T360 PolarHBondContact O-N 3.45Å
361	K	94.1	Very high	94.7	Very high	57 Å²	57	52 Å²	52	25%	0.248	26%	0.255	C	S	.	.	H	α-helix	trans	-158.9	91.7	-172.9	-169.6	160.2	171.7	179.4	0	116.4	D332 D357 F358 S363 Y364 V395	D332-K361 PolarHBondContact O-NZ 3.29Å; D332-K361 IonicContact OD1-NZ 3.97Å; D332-K361 IonicContact OD2-NZ 3.02Å; D332-K361 PolarHBondContact OD2-NZ 2.67Å; D357-K361 CarbonylContact O-C 3.57Å; D357-K361 PolarHBondContact O-N 3.32Å; F358-K361 CarbonylContact O-C 3.48Å; F358-K361 PolarHBondContact O-N 2.74Å; K361-S363 VanDerWaalsContact C-N 3.25Å; K361-S363 WeakPolarHBondContact CE-O 3.44Å; K361-S363 WeakPolarHBondContact CG-O 3.45Å; K361-S363 PolarHBondContact O-N 2.91Å; K361-Y364 HydrophobicContact CB-CE2 4.4Å; K361-Y364 HydrophobicContact CD-CD1 3.96Å; K361-Y364 HydrophobicContact CD-CE1 3.5Å; K361-Y364 VanDerWaalsContact CD-CE1 3.5Å; K361-Y364 HydrophobicContact CD-CE2 4.41Å; K361-Y364 VanDerWaalsContact CE-CD1 3.43Å; K361-Y364 HydrophobicContact CG-CE1 4.09Å; K361-Y364 HydrophobicContact CG-CE2 4.1Å; K361-V395 WeakPolarHBondContact O-CG2 3.21Å
362	R	94.4	Very high	94.4	Very high	122 Å²	122	49 Å²	49	46%	0.46	24%	0.242	S	C	.	.	S	Bend	trans	-59.4	-11.7	176.1	-53.1	-173.9	175.8	-156.6	-12.9	117.7	F358 E359 V395	F358-R362 HydrophobicContact CD1-CG 4.01Å; F358-R362 HydrophobicContact CD2-CB 4.06Å; F358-R362 HydrophobicContact CD2-CG 3.76Å; F358-R362 HydrophobicContact CE1-CG 3.93Å; F358-R362 VanDerWaalsContact CE1-NH2 3.32Å; F358-R362 HydrophobicContact CE2-CB 3.88Å; F358-R362 HydrophobicContact CE2-CG 3.68Å; F358-R362 HydrophobicContact CG-CG 3.92Å; F358-R362 HydrophobicContact CZ-CB 4.36Å; F358-R362 VanDerWaalsContact CZ-CD 3.47Å; F358-R362 HydrophobicContact CZ-CG 3.77Å; F358-R362 WeakPolarHBondContact O-CG 2.91Å; F358-R362 PolarHBondContact O-N 3Å; E359-R362 IonicContact OE1-CZ 2.9Å; E359-R362 IonicContact OE1-NH2 3.6Å; E359-R362 PolarHBondContact OE1-NH2 2.66Å; R362-V395 PolarHBondContact O-N 2.72Å
363	S	96.3	Very high	93.6	Very high	69 Å²	69	52.8 Å²	52.8	48%	0.483	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162	152.8	176.3	62	0	0	0	0	114.3	K361 I393	K361-S363 VanDerWaalsContact C-N 3.25Å; K361-S363 WeakPolarHBondContact CE-O 3.44Å; K361-S363 WeakPolarHBondContact CG-O 3.45Å; K361-S363 PolarHBondContact O-N 2.91Å; S363-I393 CarbonylContact C-O 3.37Å; S363-I393 VanDerWaalsContact CA-O 3.22Å; S363-I393 WeakPolarHBondContact CA-O 3.44Å; S363-I393 WeakPolarHBondContact CB-O 3.38Å
364	Y	96.9	Very high	92.8	Very high	14 Å²	14	52.4 Å²	52.4	6%	0.055	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	150.9	177.5	-63.3	-93.9	0	0	0	111.2	D332 M336 F337 V356 K361 I393 V395	D332-Y364 WeakPolarHBondContact OD1-CA 3.37Å; M336-Y364 HydrophobicContact CB-CE1 4.39Å; M336-Y364 HydrophobicContact CG-CE1 3.71Å; F337-Y364 HydrophobicContact CE2-CD1 4.22Å; F337-Y364 AromaticContact CE2-CD2 3.73Å; F337-Y364 HydrophobicContact CE2-CD2 3.73Å; F337-Y364 HydrophobicContact CE2-CE2 4.29Å; F337-Y364 AromaticContact CE2-CG 3.69Å; F337-Y364 HydrophobicContact CE2-CG 3.69Å; F337-Y364 HydrophobicContact CZ-CD2 4.05Å; F337-Y364 HydrophobicContact CZ-CE2 4.5Å; F337-Y364 HydrophobicContact CZ-CG 4.44Å; V356-Y364 HydrophobicContact CB-CE2 4.37Å; V356-Y364 HydrophobicContact CG1-CE2 3.69Å; K361-Y364 HydrophobicContact CB-CE2 4.4Å; K361-Y364 HydrophobicContact CD-CD1 3.96Å; K361-Y364 HydrophobicContact CD-CE1 3.5Å; K361-Y364 VanDerWaalsContact CD-CE1 3.5Å; K361-Y364 HydrophobicContact CD-CE2 4.41Å; K361-Y364 VanDerWaalsContact CE-CD1 3.43Å; K361-Y364 HydrophobicContact CG-CE1 4.09Å; K361-Y364 HydrophobicContact CG-CE2 4.1Å; Y364-I393 PolarHBondContact N-O 2.69Å; Y364-I393 PolarHBondContact O-N 3.29Å; Y364-V395 HydrophobicContact CD2-CG2 4.15Å; Y364-V395 HydrophobicContact CE2-CG2 3.89Å
365	T	97	Very high	91.8	Very high	57 Å²	57	51.2 Å²	51.2	35%	0.35	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	126.3	172.8	-57.8	0	0	0	0	109.9	G331 D332 T390 I391	G331-T365 CarbonylContact C-O 3.59Å; G331-T365 WeakPolarHBondContact CA-O 3.45Å; D332-T365 PolarHBondContact N-O 3Å; D332-T365 PolarHBondContact OD1-N 2.83Å; T365-T390 HydrophobicContact CG2-CG2 3.53Å; T365-I391 WeakPolarHBondContact CA-O 3.45Å
366	L	96.9	Very high	90.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	149.6	174.3	-62	170.4	0	0	0	109.7	L328 M334 F337 T390 I391 I393	L328-L366 HydrophobicContact CD1-CD1 4.34Å; L328-L366 HydrophobicContact CD2-CB 4.3Å; L328-L366 HydrophobicContact CD2-CD1 4.17Å; M334-L366 HydrophobicContact CG-CD2 4.15Å; F337-L366 HydrophobicContact CB-CD1 3.99Å; F337-L366 HydrophobicContact CD2-CD1 4.15Å; F337-L366 HydrophobicContact CG-CD1 4.23Å; L366-T390 CarbonylContact O-C 3.52Å; L366-T390 WeakPolarHBondContact O-CA 3.48Å; L366-I391 HydrophobicContact CB-CB 4.27Å; L366-I391 HydrophobicContact CB-CD1 4.24Å; L366-I391 PolarHBondContact N-O 3.46Å; L366-I391 PolarHBondContact O-N 2.91Å; L366-I393 HydrophobicContact CD1-CD1 3.95Å
367	K	96.6	Very high	89.7	Confident	75 Å²	75	51.9 Å²	51.9	33%	0.326	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	134.4	160.2	-64.9	-174.2	-165.9	143.6	0	109.9	L328 I329 D330 A389	L328-K367 WeakPolarHBondContact CA-O 3.24Å; I329-K367 HydrophobicContact CD1-CB 4.12Å; I329-K367 HydrophobicContact CG1-CB 3.79Å; I329-K367 PolarHBondContact N-O 2.93Å; D330-K367 HydrophobicContact CB-CB 4.17Å; D330-K367 HydrophobicContact CB-CD 4.1Å; D330-K367 HydrophobicContact CB-CG 4.36Å; D330-K367 PolarHBondContact O-N 3.04Å; D330-K367 WeakPolarHBondContact OD2-CE 3.22Å; D330-K367 IonicContact OD2-NZ 2.65Å; D330-K367 PolarHBondContact OD2-NZ 2.86Å; K367-A389 WeakPolarHBondContact CA-O 3.35Å
368	V	96.3	Very high	88.6	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.2	178.1	56	0	0	0	0	109.3	F289 L311 R327 L328 L339 E388 A389 I391	F289-V368 HydrophobicContact CZ-CG1 4.32Å; F289-V368 HydrophobicContact CZ-CG2 4.35Å; L311-V368 HydrophobicContact CD1-CG1 3.5Å; L311-V368 VanDerWaalsContact CD1-CG1 3.5Å; L311-V368 HydrophobicContact CD1-CG2 4.47Å; R327-V368 WeakPolarHBondContact O-CA 3.22Å; L328-V368 HydrophobicContact CD2-CB 4.19Å; L339-V368 HydrophobicContact CD1-CG2 3.59Å; V368-E388 WeakPolarHBondContact O-CA 3.3Å; V368-A389 HydrophobicContact CG1-CB 4.03Å; V368-A389 WeakPolarHBondContact CG1-O 3.19Å; V368-A389 PolarHBondContact N-O 3.4Å; V368-A389 PolarHBondContact O-N 3.43Å; V368-I391 HydrophobicContact CB-CD1 3.9Å; V368-I391 HydrophobicContact CG1-CD1 3.55Å; V368-I391 HydrophobicContact CG1-CG1 3.94Å
369	E	94.9	Very high	87.3	Confident	12 Å²	12	54.8 Å²	54.8	6%	0.056	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	129.2	172.9	-179.2	-176.3	65.4	0	0	108.2	Y326 R327 I329 K386 D387 E388	Y326-E369 WeakPolarHBondContact CA-O 3.12Å; R327-E369 IonicContact CZ-OE1 3.63Å; R327-E369 PolarHBondContact N-O 3.24Å; R327-E369 IonicContact NE-OE1 3.22Å; R327-E369 PolarHBondContact NE-OE1 2.68Å; R327-E369 IonicContact NH2-OE1 3.13Å; R327-E369 PolarHBondContact NH2-OE1 3.17Å; R327-E369 IonicContact NH2-OE2 3.15Å; R327-E369 PolarHBondContact O-N 2.89Å; I329-E369 HydrophobicContact CD1-CB 4.18Å; I329-E369 HydrophobicContact CG1-CB 4.3Å; I329-E369 HydrophobicContact CG2-CB 3.58Å; I329-E369 HydrophobicContact CG2-CG 4.37Å; E369-K386 HydrophobicContact CG-CB 4.29Å; E369-K386 HydrophobicContact CG-CD 4.25Å; E369-K386 HydrophobicContact CG-CG 4.39Å; E369-K386 WeakPolarHBondContact OE2-CD 3.23Å; E369-K386 WeakPolarHBondContact OE2-CE 3.4Å; E369-K386 IonicContact OE2-NZ 3.25Å; E369-K386 PolarHBondContact OE2-NZ 2.74Å; E369-D387 WeakPolarHBondContact CA-O 3.39Å; E369-E388 HydrophobicContact CB-CG 4.49Å
370	G	94.1	Very high	86.1	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	116.4	164.7	0	0	0	0	0	107.6	N325 K386 D387	N325-G370 CarbonylContact O-C 3.54Å; N325-G370 WeakPolarHBondContact O-CA 3.3Å; G370-K386 CarbonylContact O-C 3.47Å; G370-K386 WeakPolarHBondContact O-CA 3.37Å; G370-K386 WeakPolarHBondContact O-CB 3.45Å; G370-D387 PolarHBondContact N-O 3.43Å; G370-D387 PolarHBondContact O-N 3.24Å
371	S	91.3	Very high	84.8	Confident	24 Å²	24	56 Å²	56	17%	0.168	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	147.9	-175.8	59.2	0	0	0	0	112.2	N325 Y385	N325-S371 PolarHBondContact N-O 2.97Å; N325-S371 PolarHBondContact O-N 3.5Å; S371-Y385 WeakPolarHBondContact CA-O 3.24Å
372	N	89	Confident	83.1	Confident	6 Å²	6	61.5 Å²	61.5	3%	0.032	32%	0.318	C	S	.	.			trans	-81.5	130.5	172.9	-152.5	-71	0	0	0	109.9	N283 P287 D315 N321 H374 Y385	N283-N372 VanDerWaalsContact ND2-CG 3.33Å; N283-N372 PolarHBondContact ND2-OD1 2.66Å; P287-N372 HydrophobicContact CG-CB 4.23Å; D315-N372 PolarHBondContact OD2-ND2 2.78Å; N321-N372 PolarHBondContact O-ND2 3.4Å; N372-H374 WeakPolarHBondContact OD1-CB 3.5Å; N372-H374 PolarHBondContact OD1-N 2.81Å; N372-H374 PolarHBondContact OD1-O 2.97Å; N372-H374 VanDerWaalsContact OD1-O 3.08Å; N372-Y385 PolarHBondContact N-O 3.03Å
373	P	80	Confident	81.4	Confident	79 Å²	79	57.3 Å²	57.3	51%	0.513	31%	0.313	S	S	.	.	S	Bend	trans	-81.8	-19.2	176.6	34	-33.8	0	0	0	112.2	L323	L323-P373 HydrophobicContact CD2-CG 4.07Å; L323-P373 HydrophobicContact CG-CG 4.43Å; L323-P373 WeakPolarHBondContact O-CD 3.27Å
374	H	78.3	Confident	79.6	Confident	94 Å²	94	58.1 Å²	58.1	44%	0.435	32%	0.317	S	S	.	.			trans	-85.2	139.8	167.1	-155.6	81.6	0	0	0	108.9	N283 N321 N372	N283-H374 PolarHBondContact ND2-O 3.33Å; N321-H374 PolarHBondContact OD1-CD2 2.84Å; N321-H374 VanDerWaalsContact OD1-CD2 3.27Å; N372-H374 WeakPolarHBondContact OD1-CB 3.5Å; N372-H374 PolarHBondContact OD1-N 2.81Å; N372-H374 PolarHBondContact OD1-O 2.97Å; N372-H374 VanDerWaalsContact OD1-O 3.08Å
375	I	71.8	Confident	78.8	Confident	91 Å²	91	58.3 Å²	58.3	47%	0.467	32%	0.318	S	S	.	.			trans	-141.8	107.2	-176.8	-65.6	-179.9	0	0	0	107	P377 L380 Y385	I375-P377 WeakPolarHBondContact O-CD 3.14Å; I375-L380 HydrophobicContact CG2-CD2 3.62Å; I375-L380 HydrophobicContact CG2-CG 4.16Å; I375-Y385 HydrophobicContact CB-CD2 4.45Å; I375-Y385 HydrophobicContact CB-CE2 4.42Å; I375-Y385 HydrophobicContact CG1-CD2 4.21Å; I375-Y385 HydrophobicContact CG2-CD2 4.03Å; I375-Y385 HydrophobicContact CG2-CE2 3.75Å
376	D	71.3	Confident	78.4	Confident	25 Å²	25	58.4 Å²	58.4	13%	0.134	31%	0.313	C	S	.	.			trans	-76.1	124.6	170.6	-170.2	-43.6	0	0	0	109.3	R378 F379 Y385	D376-R378 PolarHBondContact O-N 2.89Å; D376-R378 VanDerWaalsContact O-N 3.13Å; D376-R378 WeakPolarHBondContact OD1-CB 3.1Å; D376-R378 WeakPolarHBondContact OD1-CG 3.49Å; D376-R378 PolarHBondContact OD1-N 2.93Å; D376-R378 IonicContact OD1-NE 3.89Å; D376-R378 PolarHBondContact OD1-NE 3.44Å; D376-R378 VanDerWaalsContact OD1-NE 3.14Å; D376-R378 IonicContact OD2-CZ 3.56Å; D376-R378 IonicContact OD2-NE 2.74Å; D376-R378 PolarHBondContact OD2-NE 2.86Å; D376-R378 IonicContact OD2-NH2 3.48Å; D376-R378 PolarHBondContact OD2-NH2 3.44Å; D376-F379 HydrophobicContact CB-CD2 4.03Å; D376-F379 HydrophobicContact CB-CE2 4.27Å; D376-F379 PolarHBondContact O-N 3.2Å; D376-Y385 PolarHBondContact O-OH 2.9Å
377	P	73.1	Confident	78.2	Confident	101 Å²	101	61 Å²	61	66%	0.656	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-20.4	178.1	-25.8	36.1	0	0	0	115.1	I375 L380	I375-P377 WeakPolarHBondContact O-CD 3.14Å; P377-L380 HydrophobicContact CB-CD1 4.2Å
378	R	69.8	Low	78.1	Confident	137 Å²	137	61.7 Å²	61.7	52%	0.517	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-40.3	-177.6	-65.1	178.7	-70.4	159	-4.2	112.5	D376	D376-R378 PolarHBondContact O-N 2.89Å; D376-R378 VanDerWaalsContact O-N 3.13Å; D376-R378 WeakPolarHBondContact OD1-CB 3.1Å; D376-R378 WeakPolarHBondContact OD1-CG 3.49Å; D376-R378 PolarHBondContact OD1-N 2.93Å; D376-R378 IonicContact OD1-NE 3.89Å; D376-R378 PolarHBondContact OD1-NE 3.44Å; D376-R378 VanDerWaalsContact OD1-NE 3.14Å; D376-R378 IonicContact OD2-CZ 3.56Å; D376-R378 IonicContact OD2-NE 2.74Å; D376-R378 PolarHBondContact OD2-NE 2.86Å; D376-R378 IonicContact OD2-NH2 3.48Å; D376-R378 PolarHBondContact OD2-NH2 3.44Å
379	F	67.8	Low	78.1	Confident	16 Å²	16	61.7 Å²	61.7	7%	0.07	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	10	-176.6	-33.4	-94.6	0	0	0	113.5	M192 V282 N283 D376 A381 W382 Y385	M192-F379 HydrophobicContact SD-CE1 3.86Å; V282-F379 HydrophobicContact CG1-CD2 4.3Å; V282-F379 HydrophobicContact CG1-CE2 3.28Å; V282-F379 HydrophobicContact CG1-CZ 3.63Å; N283-F379 WeakPolarHBondContact O-CD2 3.42Å; D376-F379 HydrophobicContact CB-CD2 4.03Å; D376-F379 HydrophobicContact CB-CE2 4.27Å; D376-F379 PolarHBondContact O-N 3.2Å; F379-A381 PolarHBondContact O-N 2.75Å; F379-W382 HydrophobicContact CB-CD2 4.26Å; F379-W382 HydrophobicContact CB-CE3 4.18Å; F379-W382 HydrophobicContact CB-CG 4.43Å; F379-W382 HydrophobicContact CD1-CD2 4.17Å; F379-W382 AromaticContact CD1-CE3 3.85Å; F379-W382 HydrophobicContact CD1-CE3 3.85Å; F379-W382 AromaticContact CD1-CH2 3.91Å; F379-W382 HydrophobicContact CD1-CH2 3.91Å; F379-W382 HydrophobicContact CD1-CZ2 4.2Å; F379-W382 AromaticContact CD1-CZ3 3.72Å; F379-W382 HydrophobicContact CD1-CZ3 3.72Å; F379-W382 HydrophobicContact CE1-CH2 4.24Å; F379-W382 HydrophobicContact CE1-CZ3 4.3Å; F379-W382 HydrophobicContact CG-CE3 4.42Å; F379-W382 PolarHBondContact O-N 2.88Å; F379-Y385 WeakPolarHBondContact CB-OH 3.47Å
380	L	66	Low	78.2	Confident	103 Å²	103	63 Å²	63	54%	0.539	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.6	-24.5	164.1	-82.9	174.8	0	0	0	113.7	I375 P377	I375-L380 HydrophobicContact CG2-CD2 3.62Å; I375-L380 HydrophobicContact CG2-CG 4.16Å; P377-L380 HydrophobicContact CB-CD1 4.2Å
381	A	64.1	Low	78.4	Confident	93 Å²	93	63 Å²	63	77%	0.769	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-15.2	177.8	0	0	0	0	0	114.4	F379	F379-A381 PolarHBondContact O-N 2.75Å
382	W	60.2	Low	78.7	Confident	173 Å²	173	66.9 Å²	66.9	66%	0.655	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-16.1	-174.2	-69.2	1.7	0	0	0	113.5	M192 F379	M192-W382 HydrophobicContact CE-CH2 4.4Å; M192-W382 HydrophobicContact CE-CZ3 4.16Å; M192-W382 HydrophobicContact SD-CH2 3.65Å; M192-W382 HydrophobicContact SD-CZ3 3.84Å; F379-W382 HydrophobicContact CB-CD2 4.26Å; F379-W382 HydrophobicContact CB-CE3 4.18Å; F379-W382 HydrophobicContact CB-CG 4.43Å; F379-W382 HydrophobicContact CD1-CD2 4.17Å; F379-W382 AromaticContact CD1-CE3 3.85Å; F379-W382 HydrophobicContact CD1-CE3 3.85Å; F379-W382 AromaticContact CD1-CH2 3.91Å; F379-W382 HydrophobicContact CD1-CH2 3.91Å; F379-W382 HydrophobicContact CD1-CZ2 4.2Å; F379-W382 AromaticContact CD1-CZ3 3.72Å; F379-W382 HydrophobicContact CD1-CZ3 3.72Å; F379-W382 HydrophobicContact CE1-CH2 4.24Å; F379-W382 HydrophobicContact CE1-CZ3 4.3Å; F379-W382 HydrophobicContact CG-CE3 4.42Å; F379-W382 PolarHBondContact O-N 2.88Å
383	G	57.8	Low	79.1	Confident	34 Å²	34	66.7 Å²	66.7	35%	0.351	35%	0.353	S	S	.	.			trans	151.4	-176.9	174.8	0	0	0	0	0	111.7
384	P	59.2	Low	79.9	Confident	87 Å²	87	65.6 Å²	65.6	57%	0.565	35%	0.348	S	S	*	.			trans	-75	137.8	166	33.7	-33	0	0	0	109.7	K386	P384-K386 HydrophobicContact CB-CD 3.91Å; P384-K386 HydrophobicContact CB-CG 3.91Å; P384-K386 HydrophobicContact CG-CG 4.2Å; P384-K386 PolarHBondContact O-N 2.84Å
385	Y	80.3	Confident	80.7	Confident	18 Å²	18	61.4 Å²	61.4	7%	0.071	33%	0.329	C	S	.	.	S	Bend	trans	-73.1	55.1	170.8	-59.2	-89.8	0	0	0	111.3	N283 S371 N372 I375 D376 F379	N283-Y385 WeakPolarHBondContact OD1-CD1 3.38Å; N283-Y385 WeakPolarHBondContact OD1-CE1 3.39Å; S371-Y385 WeakPolarHBondContact CA-O 3.24Å; N372-Y385 PolarHBondContact N-O 3.03Å; I375-Y385 HydrophobicContact CB-CD2 4.45Å; I375-Y385 HydrophobicContact CB-CE2 4.42Å; I375-Y385 HydrophobicContact CG1-CD2 4.21Å; I375-Y385 HydrophobicContact CG2-CD2 4.03Å; I375-Y385 HydrophobicContact CG2-CE2 3.75Å; D376-Y385 PolarHBondContact O-OH 2.9Å; F379-Y385 WeakPolarHBondContact CB-OH 3.47Å
386	K	87.9	Confident	81.9	Confident	58 Å²	58	61.7 Å²	61.7	25%	0.252	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	154.2	-177.7	83.9	-157.6	-164.6	76.9	0	112.1	E369 G370 P384 E388	E369-K386 HydrophobicContact CG-CB 4.29Å; E369-K386 HydrophobicContact CG-CD 4.25Å; E369-K386 HydrophobicContact CG-CG 4.39Å; E369-K386 WeakPolarHBondContact OE2-CD 3.23Å; E369-K386 WeakPolarHBondContact OE2-CE 3.4Å; E369-K386 IonicContact OE2-NZ 3.25Å; E369-K386 PolarHBondContact OE2-NZ 2.74Å; G370-K386 CarbonylContact O-C 3.47Å; G370-K386 WeakPolarHBondContact O-CA 3.37Å; G370-K386 WeakPolarHBondContact O-CB 3.45Å; P384-K386 HydrophobicContact CB-CD 3.91Å; P384-K386 HydrophobicContact CB-CG 3.91Å; P384-K386 HydrophobicContact CG-CG 4.2Å; P384-K386 PolarHBondContact O-N 2.84Å; K386-E388 IonicContact NZ-OE1 3.91Å; K386-E388 PolarHBondContact NZ-OE1 2.87Å
387	D	93.1	Very high	82.9	Confident	56 Å²	56	63.4 Å²	63.4	30%	0.299	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	161.3	169.5	-176	28.1	0	0	0	110.3	P287 F289 E369 G370	P287-D387 WeakPolarHBondContact O-CB 3.38Å; F289-D387 HydrophobicContact CD2-CB 4.12Å; F289-D387 PolarHBondContact N-OD2 2.7Å; E369-D387 WeakPolarHBondContact CA-O 3.39Å; G370-D387 PolarHBondContact N-O 3.43Å; G370-D387 PolarHBondContact O-N 3.24Å
388	E	94.9	Very high	83.7	Confident	88 Å²	88	59.7 Å²	59.7	41%	0.411	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	119.3	-175.1	-71.2	-179.7	-150.6	0	0	111.2	I329 V368 E369 K386	I329-E388 VanDerWaalsContact CD1-CD 3.48Å; I329-E388 HydrophobicContact CD1-CG 3.87Å; I329-E388 WeakPolarHBondContact CD1-OE2 3.37Å; V368-E388 WeakPolarHBondContact O-CA 3.3Å; E369-E388 HydrophobicContact CB-CG 4.49Å; K386-E388 IonicContact NZ-OE1 3.91Å; K386-E388 PolarHBondContact NZ-OE1 2.87Å
389	A	96.3	Very high	84.6	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.008	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	151.3	173.2	0	0	0	0	0	111.6	F289 Y294 K367 V368	F289-A389 HydrophobicContact CB-CB 4.08Å; F289-A389 HydrophobicContact CD1-CB 4.26Å; F289-A389 HydrophobicContact CD2-CB 3.63Å; F289-A389 HydrophobicContact CE2-CB 4.06Å; F289-A389 HydrophobicContact CG-CB 3.74Å; Y294-A389 HydrophobicContact CD2-CB 3.95Å; Y294-A389 HydrophobicContact CE2-CB 3.76Å; K367-A389 WeakPolarHBondContact CA-O 3.35Å; V368-A389 HydrophobicContact CG1-CB 4.03Å; V368-A389 WeakPolarHBondContact CG1-O 3.19Å; V368-A389 PolarHBondContact N-O 3.4Å; V368-A389 PolarHBondContact O-N 3.43Å
390	T	97.1	Very high	85.5	Confident	38 Å²	38	58.8 Å²	58.8	23%	0.233	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	123.6	172.4	-57.9	0	0	0	0	109.8	S292 V293 Y294 T365 L366	S292-T390 PolarHBondContact O-N 3.01Å; V293-T390 CarbonylContact C-O 3.55Å; V293-T390 VanDerWaalsContact CA-O 3.24Å; V293-T390 WeakPolarHBondContact CA-O 3.49Å; Y294-T390 PolarHBondContact N-O 2.99Å; T365-T390 HydrophobicContact CG2-CG2 3.53Å; L366-T390 CarbonylContact O-C 3.52Å; L366-T390 WeakPolarHBondContact O-CA 3.48Å
391	I	97.3	Very high	86.6	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.5	171.5	-55.2	145.2	0	0	0	108.2	M296 L311 L328 I350 T365 L366 V368 I393	M296-I391 HydrophobicContact CE-CG2 3.73Å; M296-I391 HydrophobicContact CG-CG2 4.06Å; M296-I391 HydrophobicContact SD-CG2 3.76Å; L311-I391 HydrophobicContact CD2-CD1 4.36Å; L328-I391 HydrophobicContact CD2-CD1 4.46Å; I350-I391 HydrophobicContact CD1-CD1 3.56Å; I350-I391 HydrophobicContact CD1-CG1 4.12Å; I350-I391 HydrophobicContact CD1-CG2 4.1Å; I350-I391 HydrophobicContact CG1-CD1 4.35Å; T365-I391 WeakPolarHBondContact CA-O 3.45Å; L366-I391 HydrophobicContact CB-CB 4.27Å; L366-I391 HydrophobicContact CB-CD1 4.24Å; L366-I391 PolarHBondContact N-O 3.46Å; L366-I391 PolarHBondContact O-N 2.91Å; V368-I391 HydrophobicContact CB-CD1 3.9Å; V368-I391 HydrophobicContact CG1-CD1 3.55Å; V368-I391 HydrophobicContact CG1-CG1 3.94Å; I391-I393 HydrophobicContact CG2-CD1 4.29Å; I391-I393 HydrophobicContact CG2-CG1 3.74Å
392	K	97	Very high	87.9	Confident	107 Å²	107	51.3 Å²	51.3	47%	0.465	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	120.2	168.4	-66	-178.7	179.1	-178.5	0	108.5	V293 Y294 T295 M296	V293-K392 HydrophobicContact CG1-CD 4.1Å; V293-K392 HydrophobicContact CG1-CG 4.31Å; Y294-K392 PolarHBondContact O-N 2.78Å; T295-K392 WeakPolarHBondContact CA-O 3.05Å; T295-K392 HydrophobicContact CG2-CB 4.41Å; M296-K392 PolarHBondContact N-O 3.47Å
393	I	97.4	Very high	89.5	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	115.8	178.3	-49.1	-178.1	0	0	0	107.2	M296 V298 V308 F337 I350 S363 Y364 L366 I391	M296-I393 HydrophobicContact CG-CG1 3.94Å; M296-I393 VanDerWaalsContact O-CA 3.31Å; M296-I393 WeakPolarHBondContact O-CA 3.35Å; M296-I393 HydrophobicContact SD-CG1 4.3Å; V298-I393 HydrophobicContact CB-CG2 4.21Å; V298-I393 HydrophobicContact CG1-CG2 3.59Å; V308-I393 HydrophobicContact CG1-CD1 4.37Å; V308-I393 HydrophobicContact CG1-CG2 4.08Å; F337-I393 HydrophobicContact CD1-CD1 3.81Å; F337-I393 HydrophobicContact CD2-CD1 3.9Å; F337-I393 HydrophobicContact CE1-CD1 3.69Å; F337-I393 HydrophobicContact CE1-CG2 4.25Å; F337-I393 HydrophobicContact CE2-CD1 3.81Å; F337-I393 HydrophobicContact CG-CD1 3.92Å; F337-I393 HydrophobicContact CZ-CB 4.35Å; F337-I393 HydrophobicContact CZ-CD1 3.7Å; F337-I393 HydrophobicContact CZ-CG2 3.95Å; I350-I393 HydrophobicContact CG2-CD1 4.39Å; S363-I393 CarbonylContact C-O 3.37Å; S363-I393 VanDerWaalsContact CA-O 3.22Å; S363-I393 WeakPolarHBondContact CA-O 3.44Å; S363-I393 WeakPolarHBondContact CB-O 3.38Å; Y364-I393 PolarHBondContact N-O 2.69Å; Y364-I393 PolarHBondContact O-N 3.29Å; L366-I393 HydrophobicContact CD1-CD1 3.95Å; I391-I393 HydrophobicContact CG2-CD1 4.29Å; I391-I393 HydrophobicContact CG2-CG1 3.74Å
394	S	96.7	Very high	91.3	Very high	56 Å²	56	45.8 Å²	45.8	39%	0.392	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	135.8	166.5	48.8	0	0	0	0	109.6	M296 S297 V298	M296-S394 PolarHBondContact O-N 3.37Å; M296-S394 PolarHBondContact O-OG 2.58Å; S297-S394 CarbonylContact C-O 3.58Å; S297-S394 WeakPolarHBondContact CA-O 3.41Å; V298-S394 PolarHBondContact N-O 3.34Å
395	V	96.8	Very high	92.9	Very high	6 Å²	6	47.9 Å²	47.9	4%	0.036	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	142.1	167.6	-173.2	0	0	0	0	107.9	V298 E300 V356 F358 K361 R362 Y364	V298-V395 HydrophobicContact CG1-CG2 4.26Å; V298-V395 CarbonylContact O-C 3.58Å; V298-V395 VanDerWaalsContact O-CA 3.23Å; V298-V395 WeakPolarHBondContact O-CA 3.5Å; E300-V395 HydrophobicContact CB-CG1 4.13Å; V356-V395 HydrophobicContact CB-CG1 4.46Å; V356-V395 HydrophobicContact CB-CG2 4.14Å; V356-V395 HydrophobicContact CG2-CG1 3.86Å; V356-V395 HydrophobicContact CG2-CG2 4.07Å; F358-V395 HydrophobicContact CB-CG1 3.9Å; F358-V395 HydrophobicContact CD2-CB 3.89Å; F358-V395 HydrophobicContact CD2-CG1 3.97Å; F358-V395 WeakPolarHBondContact CD2-O 3.41Å; F358-V395 VanDerWaalsContact CE2-O 3.24Å; F358-V395 WeakPolarHBondContact CE2-O 3.3Å; F358-V395 HydrophobicContact CG-CG1 4.44Å; K361-V395 WeakPolarHBondContact O-CG2 3.21Å; R362-V395 PolarHBondContact O-N 2.72Å; Y364-V395 HydrophobicContact CD2-CG2 4.15Å; Y364-V395 HydrophobicContact CE2-CG2 3.89Å
396	E	95.3	Very high	93.5	Very high	96 Å²	96	48.7 Å²	48.7	45%	0.449	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	114	176.3	-75.1	174.2	177.5	0	0	110.1	S297 V298 S299	S297-E396 VanDerWaalsContact CB-CD 3.41Å; S297-E396 WeakPolarHBondContact CB-OE1 3.4Å; S297-E396 VanDerWaalsContact OG-CD 3.3Å; S297-E396 PolarHBondContact OG-OE1 2.88Å; V298-E396 PolarHBondContact O-N 2.87Å; S299-E396 WeakPolarHBondContact CA-O 3.39Å; S299-E396 PolarHBondContact OG-O 3.05Å
397	D	92.9	Very high	93.8	Very high	62 Å²	62	51.7 Å²	51.7	33%	0.332	29%	0.288	S	S	.	.			trans	-39.4	125	172	-167.7	81.1	0	0	0	111.8	E300 F358 V433	E300-D397 VanDerWaalsContact OE1-CA 3.27Å; E300-D397 WeakPolarHBondContact OE1-CA 2.9Å; F358-D397 HydrophobicContact CD1-CB 4.04Å; F358-D397 WeakPolarHBondContact CD1-OD1 3.25Å; F358-D397 HydrophobicContact CD2-CB 4.37Å; F358-D397 HydrophobicContact CE1-CB 3.85Å; F358-D397 VanDerWaalsContact CE1-OD1 3.24Å; F358-D397 WeakPolarHBondContact CE1-OD1 3.31Å; F358-D397 HydrophobicContact CE2-CB 4.21Å; F358-D397 HydrophobicContact CG-CB 4.31Å; F358-D397 HydrophobicContact CZ-CB 3.95Å; D397-V433 WeakPolarHBondContact OD1-CB 3.15Å; D397-V433 VanDerWaalsContact OD1-CG2 3.22Å; D397-V433 WeakPolarHBondContact OD1-CG2 3.46Å; D397-V433 PolarHBondContact OD1-N 2.93Å; D397-V433 VanDerWaalsContact OD1-N 3.11Å
398	A	90.3	Very high	93.9	Very high	22 Å²	22	51.9 Å²	51.9	18%	0.182	29%	0.294	C	S	.	.			trans	-127.9	150.7	177	0	0	0	0	0	112.5	E300 D301 E400	E300-A398 HydrophobicContact CG-CB 3.95Å; E300-A398 PolarHBondContact OE1-N 3.46Å; D301-A398 HydrophobicContact CB-CB 4.42Å; A398-E400 PolarHBondContact O-N 2.89Å
399	D	87.4	Confident	94	Very high	57 Å²	57	49 Å²	49	31%	0.305	28%	0.28	S	S	.	.			trans	-60.1	99.1	-177	-173	104.6	0	0	0	111.7	D432 H486 Q488	D399-D432 WeakPolarHBondContact CA-OD2 3.42Å; D399-H486 IonicContact OD1-CD2 3.51Å; D399-H486 PolarHBondContact OD1-CD2 3.12Å; D399-H486 WeakPolarHBondContact OD2-CB 3.44Å; D399-H486 IonicContact OD2-CD2 3.35Å; D399-H486 IonicContact OD2-CG 2.81Å; D399-Q488 PolarHBondContact O-NE2 3.06Å; D399-Q488 PolarHBondContact OD2-NE2 2.98Å
400	E	87.1	Confident	94.1	Very high	78 Å²	78	53.1 Å²	53.1	36%	0.364	31%	0.305	S	S	.	.			trans	-104	141.3	177.9	-74.8	-140.6	124.1	0	0	113	A398 D432	A398-E400 PolarHBondContact O-N 2.89Å; E400-D432 PolarHBondContact N-OD2 2.81Å
401	P	89.4	Confident	94.1	Very high	38 Å²	38	52.9 Å²	52.9	25%	0.247	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-72.8	137	-177.3	29.7	-35.7	0	0	0	113.3	V403 Q488 T490	P401-V403 PolarHBondContact O-N 2.99Å; P401-Q488 HydrophobicContact CB-CB 3.73Å; P401-Q488 HydrophobicContact CG-CB 4.49Å; P401-T490 WeakPolarHBondContact CB-OG1 3.16Å; P401-T490 PolarHBondContact O-OG1 2.91Å
402	P	92.3	Very high	94	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-50.1	131	-169.6	-32.6	35.2	0	0	0	116.5	A428 D430 V438 A480 E482 T490	P402-A428 HydrophobicContact CB-CB 4.31Å; P402-D430 HydrophobicContact CG-CB 4.47Å; P402-V438 HydrophobicContact CB-CG1 4.01Å; P402-V438 HydrophobicContact CB-CG2 3.79Å; P402-V438 HydrophobicContact CG-CG1 4.16Å; P402-V438 HydrophobicContact CG-CG2 3.79Å; P402-A480 HydrophobicContact CB-CB 4.37Å; P402-E482 HydrophobicContact CG-CG 3.59Å; P402-T490 WeakPolarHBondContact O-CB 3.26Å; P402-T490 WeakPolarHBondContact O-CG2 3.18Å; P402-T490 PolarHBondContact O-OG1 3.43Å
403	V	92.8	Very high	93.9	Very high	71 Å²	71	53 Å²	53	43%	0.43	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	128.9	-174.9	-174.6	0	0	0	0	111.1	P401 A428 K429 T431	P401-V403 PolarHBondContact O-N 2.99Å; V403-A428 CarbonylContact O-C 3.54Å; V403-A428 WeakPolarHBondContact O-CA 3.39Å; V403-K429 PolarHBondContact N-O 2.89Å; V403-K429 PolarHBondContact O-N 3.42Å; V403-T431 HydrophobicContact CG2-CG2 4.01Å
404	F	95.1	Very high	93.7	Very high	20 Å²	20	58.4 Å²	58.4	9%	0.088	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	139.2	172.5	-74.9	-91.3	0	0	0	111.8	A406 Y409 V426 H427 A428 Y440 V478 A480 T490 V492	F404-A406 PolarHBondContact O-N 2.99Å; F404-A406 VanDerWaalsContact O-N 3.14Å; F404-Y409 HydrophobicContact CD1-CE2 4.06Å; F404-V426 HydrophobicContact CD1-CB 4.4Å; F404-V426 HydrophobicContact CE1-CB 4.16Å; F404-V426 HydrophobicContact CE1-CG2 4.03Å; F404-H427 WeakPolarHBondContact CA-O 3.4Å; F404-A428 HydrophobicContact CD1-CB 3.8Å; F404-A428 HydrophobicContact CD2-CB 4.13Å; F404-A428 HydrophobicContact CE1-CB 3.97Å; F404-A428 HydrophobicContact CE2-CB 4.29Å; F404-A428 HydrophobicContact CG-CB 3.9Å; F404-A428 HydrophobicContact CZ-CB 4.22Å; F404-Y440 HydrophobicContact CE1-CD1 4.25Å; F404-Y440 HydrophobicContact CE1-CE1 4.07Å; F404-Y440 HydrophobicContact CZ-CD1 4.49Å; F404-V478 HydrophobicContact CE1-CG1 4.41Å; F404-V478 HydrophobicContact CZ-CB 4.43Å; F404-V478 HydrophobicContact CZ-CG1 4.19Å; F404-A480 HydrophobicContact CE1-CB 4.39Å; F404-A480 HydrophobicContact CE2-CB 3.58Å; F404-A480 HydrophobicContact CZ-CB 3.5Å; F404-T490 HydrophobicContact CD2-CG2 3.82Å; F404-T490 HydrophobicContact CE2-CG2 4.08Å; F404-V492 HydrophobicContact CB-CB 4.3Å; F404-V492 HydrophobicContact CB-CG2 4.43Å; F404-V492 HydrophobicContact CD1-CB 4.01Å; F404-V492 HydrophobicContact CD1-CG1 3.6Å; F404-V492 HydrophobicContact CD2-CB 3.74Å; F404-V492 HydrophobicContact CD2-CG1 4.07Å; F404-V492 HydrophobicContact CE1-CB 4.22Å; F404-V492 HydrophobicContact CE1-CG1 3.46Å; F404-V492 VanDerWaalsContact CE1-CG1 3.46Å; F404-V492 HydrophobicContact CE2-CB 3.96Å; F404-V492 HydrophobicContact CE2-CG1 3.94Å; F404-V492 HydrophobicContact CG-CB 3.75Å; F404-V492 HydrophobicContact CG-CG1 3.89Å; F404-V492 HydrophobicContact CG-CG2 4.37Å; F404-V492 HydrophobicContact CZ-CB 4.19Å; F404-V492 HydrophobicContact CZ-CG1 3.63Å
405	I	93	Very high	93.4	Very high	132 Å²	132	55.9 Å²	55.9	68%	0.677	31%	0.311	S	S	*	.	S	Bend	trans	-59.6	-27.4	178.5	-70.8	-175.8	0	0	0	112.5	H427	I405-H427 HydrophobicContact CD1-CB 4.22Å; I405-H427 VanDerWaalsContact CD1-CD2 3.44Å; I405-H427 WeakPolarHBondContact CD1-CD2 3.39Å; I405-H427 PolarHBondContact N-O 2.87Å
406	A	94.3	Very high	92.9	Very high	34 Å²	34	60 Å²	60	28%	0.281	33%	0.332	S	S	.	.	S	Bend	trans	-128.2	141.5	175.4	0	0	0	0	0	111.2	F404 S408 Y409 V492	F404-A406 PolarHBondContact O-N 2.99Å; F404-A406 VanDerWaalsContact O-N 3.14Å; A406-S408 PolarHBondContact O-N 2.96Å; A406-Y409 HydrophobicContact CB-CD1 4.47Å; A406-Y409 HydrophobicContact CB-CE1 4.04Å; A406-Y409 HydrophobicContact CB-CE2 4.14Å; A406-V492 WeakPolarHBondContact O-CG2 3.25Å
407	S	93.1	Very high	92.7	Very high	121 Å²	121	55.7 Å²	55.7	85%	0.846	31%	0.313	S	S	*	.	S	Bend	trans	-70.8	-16.8	178.5	53	0	0	0	0	114.1
408	S	96.3	Very high	92.6	Very high	60 Å²	60	57.2 Å²	57.2	42%	0.42	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	150	166.6	59.3	0	0	0	0	110	A406 R493	A406-S408 PolarHBondContact O-N 2.96Å; S408-R493 WeakPolarHBondContact CA-O 3.36Å
409	Y	96.8	Very high	92.7	Very high	28 Å²	28	65.2 Å²	65.2	11%	0.11	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	145.2	172	-64.5	-95	0	0	0	110.3	F404 A406 F411 V426 H427 V492 R493 V494 N495	F404-Y409 HydrophobicContact CD1-CE2 4.06Å; A406-Y409 HydrophobicContact CB-CD1 4.47Å; A406-Y409 HydrophobicContact CB-CE1 4.04Å; A406-Y409 HydrophobicContact CB-CE2 4.14Å; Y409-F411 HydrophobicContact CD1-CE1 4.31Å; Y409-F411 AromaticContact CD1-CZ 3.72Å; Y409-F411 HydrophobicContact CD1-CZ 3.72Å; Y409-F411 HydrophobicContact CG-CE2 4.39Å; Y409-F411 HydrophobicContact CG-CZ 4.03Å; Y409-V426 HydrophobicContact CD1-CG1 4.19Å; Y409-V426 HydrophobicContact CD2-CB 4.2Å; Y409-V426 HydrophobicContact CD2-CG1 3.58Å; Y409-V426 HydrophobicContact CE1-CB 4.46Å; Y409-V426 HydrophobicContact CE1-CG1 4.38Å; Y409-V426 HydrophobicContact CE2-CB 3.87Å; Y409-V426 HydrophobicContact CE2-CG1 3.79Å; Y409-V426 HydrophobicContact CG-CG1 3.8Å; Y409-H427 PolarHBondContact OH-N 2.89Å; Y409-H427 PolarHBondContact OH-O 2.98Å; Y409-V492 HydrophobicContact CD2-CG1 4.05Å; Y409-V492 HydrophobicContact CD2-CG2 3.74Å; Y409-V492 HydrophobicContact CE2-CG1 4.09Å; Y409-V492 HydrophobicContact CE2-CG2 3.88Å; Y409-R493 PolarHBondContact N-O 2.94Å; Y409-V494 HydrophobicContact CD2-CG2 4.47Å; Y409-V494 WeakPolarHBondContact O-CA 3.13Å; Y409-N495 PolarHBondContact O-N 2.66Å
410	T	97.4	Very high	92.9	Very high	87 Å²	87	64.5 Å²	64.5	53%	0.534	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	127.6	169.2	-57.8	0	0	0	0	108.4	W473 N495	T410-W473 HydrophobicContact CG2-CZ3 4.45Å; T410-N495 VanDerWaalsContact CA-O 3.28Å; T410-N495 WeakPolarHBondContact CA-O 3.4Å
411	F	96.9	Very high	93.3	Very high	34 Å²	34	62.6 Å²	62.6	15%	0.149	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	162.9	179.1	-58.5	-50.8	0	0	0	110.4	Y409 V423 V426 I460 V494 N495 K497	Y409-F411 HydrophobicContact CD1-CE1 4.31Å; Y409-F411 AromaticContact CD1-CZ 3.72Å; Y409-F411 HydrophobicContact CD1-CZ 3.72Å; Y409-F411 HydrophobicContact CG-CE2 4.39Å; Y409-F411 HydrophobicContact CG-CZ 4.03Å; F411-V423 HydrophobicContact CB-CG1 3.79Å; F411-V423 HydrophobicContact CD2-CG1 4.47Å; F411-V423 HydrophobicContact CG-CG1 4.46Å; F411-V426 HydrophobicContact CE2-CG1 4.09Å; F411-V426 HydrophobicContact CZ-CG1 4.33Å; F411-I460 HydrophobicContact CD2-CD1 4.49Å; F411-I460 HydrophobicContact CE2-CD1 4.12Å; F411-V494 HydrophobicContact CD2-CG1 3.5Å; F411-V494 VanDerWaalsContact CD2-CG1 3.5Å; F411-V494 HydrophobicContact CE2-CG1 3.65Å; F411-N495 PolarHBondContact N-O 2.92Å; F411-K497 PolarHBondContact O-N 3.13Å
412	E	95.3	Very high	93.6	Very high	101 Å²	101	64.9 Å²	64.9	47%	0.472	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	137.2	178.5	-53.8	-171.2	115.6	0	0	109.8	K497 K499	E412-K497 WeakPolarHBondContact CA-O 3.1Å; E412-K497 HydrophobicContact CG-CB 4.3Å; E412-K499 HydrophobicContact CB-CD 4.15Å; E412-K499 HydrophobicContact CB-CG 4.43Å; E412-K499 WeakPolarHBondContact OE2-CE 3.5Å; E412-K499 IonicContact OE2-NZ 2.76Å; E412-K499 PolarHBondContact OE2-NZ 3.39Å
413	V	95.6	Very high	93.7	Very high	9 Å²	9	65.6 Å²	65.6	6%	0.055	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	140.4	179.8	61.6	0	0	0	0	110	A417 V423 T462 L466 I496 K497 V498 K499	V413-A417 HydrophobicContact CG2-CB 3.71Å; V413-V423 HydrophobicContact CB-CG1 4.29Å; V413-V423 HydrophobicContact CB-CG2 4.24Å; V413-V423 HydrophobicContact CG1-CG1 4.4Å; V413-V423 HydrophobicContact CG1-CG2 4.46Å; V413-V423 HydrophobicContact CG2-CG2 4.14Å; V413-T462 HydrophobicContact CG2-CG2 4.07Å; V413-L466 HydrophobicContact CG1-CD1 3.43Å; V413-L466 VanDerWaalsContact CG1-CD1 3.43Å; V413-L466 HydrophobicContact CG2-CD1 4.3Å; V413-I496 HydrophobicContact CG1-CG2 3.58Å; V413-K497 PolarHBondContact N-O 3.36Å; V413-V498 CarbonylContact O-C 3.57Å; V413-V498 WeakPolarHBondContact O-CA 3.26Å; V413-K499 PolarHBondContact O-N 2.79Å
414	E	92.1	Very high	93.8	Very high	114 Å²	114	62.7 Å²	62.7	53%	0.533	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	143.9	175.3	-70.2	156.1	-165.2	0	0	110.4	A417 K499 V501	E414-A417 WeakPolarHBondContact O-CB 3.04Å; E414-A417 PolarHBondContact O-N 2.79Å; E414-K499 HydrophobicContact CG-CB 4.16Å; E414-V501 HydrophobicContact CB-CG2 4.2Å; E414-V501 HydrophobicContact CG-CG2 4.41Å
415	E	91.1	Very high	93.9	Very high	4 Å²	4	68.5 Å²	68.5	2%	0.019	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-41.1	-173	61.5	-154	112.3	0	0	114.2	A417 L466 R468 V498 K499 D500 V501	E415-A417 PolarHBondContact O-N 3.43Å; E415-L466 HydrophobicContact CB-CB 4.36Å; E415-L466 PolarHBondContact O-N 2.99Å; E415-R468 WeakPolarHBondContact OE2-CA 3.47Å; E415-R468 WeakPolarHBondContact OE2-CB 3.34Å; E415-R468 PolarHBondContact OE2-N 2.79Å; E415-V498 HydrophobicContact CB-CG1 3.52Å; E415-K499 PolarHBondContact N-O 3.38Å; E415-D500 WeakPolarHBondContact OE1-CA 3.38Å; E415-V501 HydrophobicContact CG-CB 4.38Å; E415-V501 HydrophobicContact CG-CG2 4.4Å; E415-V501 PolarHBondContact OE1-N 3.24Å
416	N	87.6	Confident	94	Very high	91 Å²	91	62.2 Å²	62.2	49%	0.487	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	5.5	175.2	71	4.6	0	0	0	113.8
417	A	89.9	Confident	94	Very high	6 Å²	6	64.7 Å²	64.7	5%	0.05	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-55.5	118.6	-176.8	0	0	0	0	0	111.5	V413 E414 E415 T421 T462	V413-A417 HydrophobicContact CG2-CB 3.71Å; E414-A417 WeakPolarHBondContact O-CB 3.04Å; E414-A417 PolarHBondContact O-N 2.79Å; E415-A417 PolarHBondContact O-N 3.43Å; A417-T421 HydrophobicContact CB-CG2 4Å; A417-T462 HydrophobicContact CB-CG2 4.3Å
418	P	91.8	Very high	94	Very high	95 Å²	95	59.1 Å²	59.1	62%	0.617	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-63.6	150.7	-176.7	25.7	-34.2	0	0	0	111.2	G420 T421 T462	P418-G420 PolarHBondContact O-N 3.04Å; P418-T421 WeakPolarHBondContact CD-OG1 3.48Å; P418-T421 WeakPolarHBondContact O-CB 3.39Å; P418-T421 PolarHBondContact O-N 2.87Å; P418-T421 PolarHBondContact O-OG1 2.7Å; P418-T462 PolarHBondContact O-OG1 2.9Å
419	R	91.8	Very high	93.8	Very high	190 Å²	190	60.5 Å²	60.5	72%	0.717	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	124.7	179.7	-175.1	175.7	-172.1	-124.1	-3.7	111.2	N463	R419-N463 WeakPolarHBondContact CD-O 3.26Å; R419-N463 WeakPolarHBondContact CG-O 3.47Å; R419-N463 PolarHBondContact NE-O 2.97Å; R419-N463 PolarHBondContact NE-OD1 2.75Å; R419-N463 PolarHBondContact NH2-OD1 3.17Å
420	G	92.1	Very high	93.5	Very high	42 Å²	42	59.2 Å²	59.2	43%	0.433	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.1	4.4	-175.1	0	0	0	0	0	114.4	P418 T462	P418-G420 PolarHBondContact O-N 3.04Å; G420-T462 PolarHBondContact N-O 2.87Å; G420-T462 PolarHBondContact N-OG1 2.71Å
421	T	94.6	Very high	93.1	Very high	38 Å²	38	57 Å²	57	23%	0.233	29%	0.291	C	S	.	.			trans	-68.4	129.3	177.4	-64.3	0	0	0	0	110.5	A417 P418 V423 I461 T462	A417-T421 HydrophobicContact CB-CG2 4Å; P418-T421 WeakPolarHBondContact CD-OG1 3.48Å; P418-T421 WeakPolarHBondContact O-CB 3.39Å; P418-T421 PolarHBondContact O-N 2.87Å; P418-T421 PolarHBondContact O-OG1 2.7Å; T421-V423 PolarHBondContact O-N 2.81Å; T421-I461 CarbonylContact O-C 3.57Å; T421-I461 VanDerWaalsContact O-CA 3.23Å; T421-I461 WeakPolarHBondContact O-CA 3.38Å; T421-T462 PolarHBondContact N-OG1 2.66Å; T421-T462 VanDerWaalsContact N-OG1 3.11Å; T421-T462 PolarHBondContact O-N 3.11Å
422	P	95.4	Very high	92.7	Very high	85 Å²	85	55.8 Å²	55.8	55%	0.552	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	125.3	177.7	28.8	-33.7	0	0	0	111.6	M459	P422-M459 HydrophobicContact CB-CE 3.7Å; P422-M459 HydrophobicContact CB-CG 4.49Å; P422-M459 HydrophobicContact CB-SD 4.06Å
423	V	95.9	Very high	92.3	Very high	15 Å²	15	55 Å²	55	9%	0.091	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-47.4	-178.6	-180	0	0	0	0	111.3	F411 V413 T421 F452 I460 T462 I496	F411-V423 HydrophobicContact CB-CG1 3.79Å; F411-V423 HydrophobicContact CD2-CG1 4.47Å; F411-V423 HydrophobicContact CG-CG1 4.46Å; V413-V423 HydrophobicContact CB-CG1 4.29Å; V413-V423 HydrophobicContact CB-CG2 4.24Å; V413-V423 HydrophobicContact CG1-CG1 4.4Å; V413-V423 HydrophobicContact CG1-CG2 4.46Å; V413-V423 HydrophobicContact CG2-CG2 4.14Å; T421-V423 PolarHBondContact O-N 2.81Å; V423-F452 HydrophobicContact CG2-CD1 4.17Å; V423-F452 HydrophobicContact CG2-CE1 4.11Å; V423-I460 HydrophobicContact CB-CB 4.5Å; V423-I460 HydrophobicContact CB-CG2 4.31Å; V423-I460 PolarHBondContact N-O 3.13Å; V423-T462 HydrophobicContact CG2-CG2 3.86Å; V423-I496 HydrophobicContact CG1-CD1 4.09Å; V423-I496 HydrophobicContact CG1-CG1 4.12Å; V423-I496 HydrophobicContact CG1-CG2 3.81Å
424	G	94.8	Very high	91.6	Very high	10 Å²	10	57.5 Å²	57.5	10%	0.103	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174	148.7	-178.9	0	0	0	0	0	112.4	M459 I460	G424-M459 WeakPolarHBondContact O-CE 3.41Å; G424-I460 VanDerWaalsContact O-CB 3.31Å; G424-I460 WeakPolarHBondContact O-CB 3.46Å; G424-I460 PolarHBondContact O-N 2.75Å
425	R	95.6	Very high	91.2	Very high	142 Å²	142	56.3 Å²	56.3	54%	0.536	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	127.9	-179.8	-177.8	-175.8	-76.2	144.8	-2.8	110.1	D457 G458 M459	R425-D457 WeakPolarHBondContact CD-O 3.45Å; R425-D457 IonicContact CZ-OD2 3.38Å; R425-D457 VanDerWaalsContact CZ-OD2 3.22Å; R425-D457 PolarHBondContact NE-O 2.9Å; R425-D457 IonicContact NE-OD2 3.66Å; R425-D457 PolarHBondContact NE-OD2 3.06Å; R425-D457 IonicContact NH2-OD2 3.06Å; R425-D457 PolarHBondContact NH2-OD2 2.77Å; R425-G458 WeakPolarHBondContact CA-O 3.44Å; R425-M459 HydrophobicContact CB-CE 4.33Å; R425-M459 HydrophobicContact CB-SD 4.3Å
426	V	96.3	Very high	90.9	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.318	C	S	.	.			trans	-94.4	157.3	165.6	-59.1	0	0	0	0	109.9	F404 Y409 F411 Y440 I454 G458 I460 V478 V494	F404-V426 HydrophobicContact CD1-CB 4.4Å; F404-V426 HydrophobicContact CE1-CB 4.16Å; F404-V426 HydrophobicContact CE1-CG2 4.03Å; Y409-V426 HydrophobicContact CD1-CG1 4.19Å; Y409-V426 HydrophobicContact CD2-CB 4.2Å; Y409-V426 HydrophobicContact CD2-CG1 3.58Å; Y409-V426 HydrophobicContact CE1-CB 4.46Å; Y409-V426 HydrophobicContact CE1-CG1 4.38Å; Y409-V426 HydrophobicContact CE2-CB 3.87Å; Y409-V426 HydrophobicContact CE2-CG1 3.79Å; Y409-V426 HydrophobicContact CG-CG1 3.8Å; F411-V426 HydrophobicContact CE2-CG1 4.09Å; F411-V426 HydrophobicContact CZ-CG1 4.33Å; V426-Y440 HydrophobicContact CG2-CD1 4.15Å; V426-Y440 HydrophobicContact CG2-CE1 4.32Å; V426-I454 HydrophobicContact CG2-CD1 3.85Å; V426-G458 PolarHBondContact N-O 3.47Å; V426-I460 HydrophobicContact CG1-CD1 4.07Å; V426-V478 HydrophobicContact CG2-CB 4.39Å; V426-V478 HydrophobicContact CG2-CG1 4Å; V426-V478 HydrophobicContact CG2-CG2 4.36Å; V426-V494 HydrophobicContact CG1-CG2 3.86Å
427	H	94.6	Very high	91	Very high	87 Å²	87	57.9 Å²	57.9	40%	0.403	32%	0.32	S	S	.	.			trans	-145.1	126.4	178.1	-166.2	86.2	0	0	0	111	F404 I405 Y409	F404-H427 WeakPolarHBondContact CA-O 3.4Å; I405-H427 HydrophobicContact CD1-CB 4.22Å; I405-H427 VanDerWaalsContact CD1-CD2 3.44Å; I405-H427 WeakPolarHBondContact CD1-CD2 3.39Å; I405-H427 PolarHBondContact N-O 2.87Å; Y409-H427 PolarHBondContact OH-N 2.89Å; Y409-H427 PolarHBondContact OH-O 2.98Å
428	A	93.4	Very high	91	Very high	3 Å²	3	58.7 Å²	58.7	3%	0.025	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	150	169.6	0	0	0	0	0	110	P402 V403 F404 V438 Y440 A480	P402-A428 HydrophobicContact CB-CB 4.31Å; V403-A428 CarbonylContact O-C 3.54Å; V403-A428 WeakPolarHBondContact O-CA 3.39Å; F404-A428 HydrophobicContact CD1-CB 3.8Å; F404-A428 HydrophobicContact CD2-CB 4.13Å; F404-A428 HydrophobicContact CE1-CB 3.97Å; F404-A428 HydrophobicContact CE2-CB 4.29Å; F404-A428 HydrophobicContact CG-CB 3.9Å; F404-A428 HydrophobicContact CZ-CB 4.22Å; A428-V438 HydrophobicContact CB-CG1 4.33Å; A428-Y440 HydrophobicContact CB-CE1 3.96Å; A428-Y440 PolarHBondContact N-OH 3.22Å; A428-Y440 PolarHBondContact O-OH 2.82Å; A428-Y440 VanDerWaalsContact O-OH 3.08Å; A428-A480 HydrophobicContact CB-CB 3.79Å
429	K	90.9	Very high	91.1	Very high	90 Å²	90	60.6 Å²	60.6	39%	0.391	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	131.4	176.4	-170.5	-140.2	173.5	-92.8	0	106.6	V403 T431 N435	V403-K429 PolarHBondContact N-O 2.89Å; V403-K429 PolarHBondContact O-N 3.42Å; K429-T431 PolarHBondContact NZ-O 2.92Å; K429-N435 WeakPolarHBondContact CE-OD1 3.18Å; K429-N435 PolarHBondContact NZ-OD1 2.89Å
430	D	90.4	Very high	91.2	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	29%	0.289	C	S	.	.			trans	-53.7	134.6	157.6	170.6	-4.8	0	0	0	108.1	P402 D432 N435 N436 V438	P402-D430 HydrophobicContact CG-CB 4.47Å; D430-D432 VanDerWaalsContact OD1-CB 3.27Å; D430-D432 WeakPolarHBondContact OD1-CB 3.42Å; D430-D432 PolarHBondContact OD1-N 2.99Å; D430-N435 VanDerWaalsContact OD2-CA 3.29Å; D430-N435 WeakPolarHBondContact OD2-CA 3.42Å; D430-N435 PolarHBondContact OD2-N 2.81Å; D430-N436 WeakPolarHBondContact OD2-CA 3.45Å; D430-N436 VanDerWaalsContact OD2-CB 3.26Å; D430-N436 WeakPolarHBondContact OD2-CB 3.1Å; D430-N436 PolarHBondContact OD2-N 2.79Å; D430-V438 HydrophobicContact CB-CG2 4.4Å
431	T	89.6	Confident	91.3	Very high	39 Å²	39	55.5 Å²	55.5	24%	0.239	29%	0.293	C	S	.	.			trans	-79.6	-34.3	-178.3	13.8	0	0	0	0	113.2	E359 V403 K429	E359-T431 HydrophobicContact CG-CG2 4.26Å; V403-T431 HydrophobicContact CG2-CG2 4.01Å; K429-T431 PolarHBondContact NZ-O 2.92Å
432	D	88.7	Confident	91.3	Very high	9 Å²	9	54.8 Å²	54.8	5%	0.048	29%	0.287	C	S	.	.	S	Bend	trans	-73.5	172.4	-154	-47.5	5.9	0	0	0	112.6	D399 E400 D430 A434 N435	D399-D432 WeakPolarHBondContact CA-OD2 3.42Å; E400-D432 PolarHBondContact N-OD2 2.81Å; D430-D432 VanDerWaalsContact OD1-CB 3.27Å; D430-D432 WeakPolarHBondContact OD1-CB 3.42Å; D430-D432 PolarHBondContact OD1-N 2.99Å; D432-A434 PolarHBondContact O-N 2.83Å; D432-N435 PolarHBondContact O-N 2.8Å
433	V	86.1	Confident	91.3	Very high	85 Å²	85	51.2 Å²	51.2	52%	0.515	26%	0.264	S	S	.	.	S	Bend	trans	-62.6	-28.3	175.4	171.4	0	0	0	0	112.7	F358 D397	F358-V433 HydrophobicContact CD1-CG2 4.49Å; F358-V433 HydrophobicContact CE1-CG2 3.51Å; F358-V433 HydrophobicContact CZ-CG2 4.17Å; D397-V433 WeakPolarHBondContact OD1-CB 3.15Å; D397-V433 VanDerWaalsContact OD1-CG2 3.22Å; D397-V433 WeakPolarHBondContact OD1-CG2 3.46Å; D397-V433 PolarHBondContact OD1-N 2.93Å; D397-V433 VanDerWaalsContact OD1-N 3.11Å
434	A	82	Confident	91	Very high	62 Å²	62	59.7 Å²	59.7	51%	0.512	29%	0.294	S	S	.	.	S	Bend	trans	-64.8	-42.7	175.8	0	0	0	0	0	112.2	D432 N436	D432-A434 PolarHBondContact O-N 2.83Å; A434-N436 VanDerWaalsContact C-N 3.31Å; A434-N436 PolarHBondContact O-N 3.28Å
435	N	82.8	Confident	90.8	Very high	89 Å²	89	66.4 Å²	66.4	48%	0.476	32%	0.318	S	S	.	.			trans	50.2	52.6	-177.5	-170.6	108.9	0	0	0	111.1	K429 D430 D432	K429-N435 WeakPolarHBondContact CE-OD1 3.18Å; K429-N435 PolarHBondContact NZ-OD1 2.89Å; D430-N435 VanDerWaalsContact OD2-CA 3.29Å; D430-N435 WeakPolarHBondContact OD2-CA 3.42Å; D430-N435 PolarHBondContact OD2-N 2.81Å; D432-N435 PolarHBondContact O-N 2.8Å
436	N	85.1	Confident	90.6	Very high	45 Å²	45	61.7 Å²	61.7	24%	0.241	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-56.7	144.9	174.6	-66	-36.5	0	0	0	111.7	D430 A434 E482	D430-N436 WeakPolarHBondContact OD2-CA 3.45Å; D430-N436 VanDerWaalsContact OD2-CB 3.26Å; D430-N436 WeakPolarHBondContact OD2-CB 3.1Å; D430-N436 PolarHBondContact OD2-N 2.79Å; A434-N436 VanDerWaalsContact C-N 3.31Å; A434-N436 PolarHBondContact O-N 3.28Å; N436-E482 HydrophobicContact CB-CB 4.23Å; N436-E482 HydrophobicContact CB-CG 3.98Å; N436-E482 PolarHBondContact ND2-OE2 3.43Å
437	P	88.8	Confident	90.4	Very high	82 Å²	82	62.1 Å²	62.1	53%	0.532	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-72.3	134.6	177	26.3	-28.9	0	0	0	111.1	I483	P437-I483 HydrophobicContact CB-CD1 4.39Å; P437-I483 HydrophobicContact CG-CB 4.28Å; P437-I483 WeakPolarHBondContact O-CB 3.42Å; P437-I483 VanDerWaalsContact O-CG1 3.29Å; P437-I483 WeakPolarHBondContact O-CG1 3.43Å; P437-I483 PolarHBondContact O-N 3.33Å
438	V	91.4	Very high	90.2	Very high	23 Å²	23	63.1 Å²	63.1	14%	0.139	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	137.2	-173.5	-175.9	0	0	0	0	111.5	P402 A428 D430 A480	P402-V438 HydrophobicContact CB-CG1 4.01Å; P402-V438 HydrophobicContact CB-CG2 3.79Å; P402-V438 HydrophobicContact CG-CG1 4.16Å; P402-V438 HydrophobicContact CG-CG2 3.79Å; A428-V438 HydrophobicContact CB-CG1 4.33Å; D430-V438 HydrophobicContact CB-CG2 4.4Å; V438-A480 HydrophobicContact CG1-CB 3.78Å
439	R	92.3	Very high	90	Very high	135 Å²	135	66.6 Å²	66.6	51%	0.509	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	139.3	169.1	159.4	171.6	-80.6	-172.7	-5.3	110.4	E456 A480 T481 I483	R439-E456 IonicContact NH2-OE1 3.33Å; R439-A480 WeakPolarHBondContact O-CA 3.34Å; R439-T481 PolarHBondContact N-O 3.48Å; R439-T481 PolarHBondContact O-N 3.48Å; R439-I483 HydrophobicContact CB-CD1 3.98Å; R439-I483 HydrophobicContact CB-CG1 3.76Å
440	Y	94.9	Very high	90.1	Very high	22 Å²	22	66.3 Å²	66.3	9%	0.086	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	150.4	175	-55.2	-85.3	0	0	0	112.6	F404 V426 A428 I454 E456 V478 S479 A480	F404-Y440 HydrophobicContact CE1-CD1 4.25Å; F404-Y440 HydrophobicContact CE1-CE1 4.07Å; F404-Y440 HydrophobicContact CZ-CD1 4.49Å; V426-Y440 HydrophobicContact CG2-CD1 4.15Å; V426-Y440 HydrophobicContact CG2-CE1 4.32Å; A428-Y440 HydrophobicContact CB-CE1 3.96Å; A428-Y440 PolarHBondContact N-OH 3.22Å; A428-Y440 PolarHBondContact O-OH 2.82Å; A428-Y440 VanDerWaalsContact O-OH 3.08Å; Y440-I454 HydrophobicContact CG-CD1 4.32Å; Y440-E456 WeakPolarHBondContact CD2-O 3.46Å; Y440-V478 HydrophobicContact CD1-CG1 4.25Å; Y440-S479 WeakPolarHBondContact CA-O 3.48Å; Y440-A480 HydrophobicContact CD1-CB 4.4Å
441	M	93.8	Very high	90.2	Very high	103 Å²	103	68.3 Å²	68.3	51%	0.507	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	140.1	173.9	177.6	173.4	57.2	0	0	111.1	P443 S479	M441-P443 WeakPolarHBondContact O-CD 3.47Å; M441-S479 PolarHBondContact N-O 3.44Å; M441-S479 PolarHBondContact O-N 3.44Å
442	I	95.6	Very high	90.5	Very high	23 Å²	23	66.8 Å²	66.8	12%	0.118	34%	0.336	C	S	.	.			trans	-88.4	117.4	166	-65.9	165.1	0	0	0	108.3	R444 D447 F452 I454 I476 V478	I442-R444 PolarHBondContact O-N 2.86Å; I442-D447 HydrophobicContact CG2-CB 3.96Å; I442-F452 HydrophobicContact CD1-CB 3.99Å; I442-I454 HydrophobicContact CD1-CB 4.03Å; I442-I454 HydrophobicContact CD1-CG2 4.26Å; I442-I454 HydrophobicContact CG1-CB 4.19Å; I442-I454 HydrophobicContact CG1-CG2 4Å; I442-I476 HydrophobicContact CD1-CD1 4Å; I442-I476 HydrophobicContact CG1-CD1 4.35Å; I442-V478 HydrophobicContact CG1-CG2 4.14Å
443	P	93.7	Very high	90.8	Very high	11 Å²	11	68.3 Å²	68.3	7%	0.071	35%	0.348	C	S	.	.			trans	-68.8	127.1	177.1	-20.1	34.7	0	0	0	111.5	M441 Y445 T446 S477	M441-P443 WeakPolarHBondContact O-CD 3.47Å; P443-Y445 HydrophobicContact CB-CD1 3.78Å; P443-Y445 HydrophobicContact CB-CE1 3.34Å; P443-Y445 HydrophobicContact CG-CE1 4.27Å; P443-Y445 PolarHBondContact O-N 2.94Å; P443-T446 PolarHBondContact O-N 2.96Å; P443-T446 PolarHBondContact O-OG1 2.84Å; P443-S477 WeakPolarHBondContact CD-O 3.11Å; P443-S477 WeakPolarHBondContact CD-OG 3.08Å
444	R	90.5	Very high	91.3	Very high	192 Å²	192	65.9 Å²	65.9	73%	0.725	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-19.3	-176.3	-67.3	-174.5	179.2	-174.8	-0.6	115.4	I442 T446 D447 V448	I442-R444 PolarHBondContact O-N 2.86Å; R444-T446 VanDerWaalsContact C-N 3.31Å; R444-D447 CarbonylContact O-C 3.52Å; R444-V448 WeakPolarHBondContact O-CA 3.34Å; R444-V448 PolarHBondContact O-N 3.02Å
445	Y	90.6	Very high	91.9	Very high	151 Å²	151	64.6 Å²	64.6	59%	0.592	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-13.1	176	66.1	-99.2	0	0	0	113.4	P443	P443-Y445 HydrophobicContact CB-CD1 3.78Å; P443-Y445 HydrophobicContact CB-CE1 3.34Å; P443-Y445 HydrophobicContact CG-CE1 4.27Å; P443-Y445 PolarHBondContact O-N 2.94Å
446	T	92.1	Very high	92.2	Very high	43 Å²	43	67.9 Å²	67.9	26%	0.264	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-13.5	171.8	55.2	0	0	0	0	114.3	P443 R444 S477	P443-T446 PolarHBondContact O-N 2.96Å; P443-T446 PolarHBondContact O-OG1 2.84Å; R444-T446 VanDerWaalsContact C-N 3.31Å; T446-S477 WeakPolarHBondContact CG2-OG 2.96Å; T446-S477 PolarHBondContact OG1-N 2.92Å; T446-S477 PolarHBondContact OG1-OG 2.88Å
447	D	91.4	Very high	92.5	Very high	9 Å²	9	69.4 Å²	69.4	5%	0.048	34%	0.339	C	S	.	.			trans	-138.9	79.9	170.3	-173.8	5.7	0	0	0	108.6	I442 R444 D449 Q450 F451 F452 I476	I442-D447 HydrophobicContact CG2-CB 3.96Å; R444-D447 CarbonylContact O-C 3.52Å; D447-D449 VanDerWaalsContact C-N 3.32Å; D447-Q450 VanDerWaalsContact CG-CA 3.47Å; D447-Q450 PolarHBondContact O-N 2.85Å; D447-Q450 WeakPolarHBondContact OD1-CA 3.35Å; D447-Q450 PolarHBondContact OD1-N 3.43Å; D447-Q450 WeakPolarHBondContact OD2-CA 3.29Å; D447-F451 VanDerWaalsContact CG-N 3.33Å; D447-F451 PolarHBondContact OD1-N 2.69Å; D447-F451 PolarHBondContact OD2-N 3.13Å; D447-F452 PolarHBondContact OD2-N 2.83Å; D447-I476 HydrophobicContact CB-CG2 4.1Å
448	V	89.4	Confident	92.7	Very high	109 Å²	109	65.5 Å²	65.5	66%	0.661	31%	0.314	S	S	*	.	S	Bend	trans	-64.5	-41	-174.1	178.8	0	0	0	0	110.8	R444	R444-V448 WeakPolarHBondContact O-CA 3.34Å; R444-V448 PolarHBondContact O-N 3.02Å
449	D	90.3	Very high	93	Very high	75 Å²	75	66.3 Å²	66.3	40%	0.401	32%	0.317	S	S	.	.	S	Bend	trans	-82.6	-10.1	178.9	-85.6	-72.8	0	0	0	113.8	D447 F451 R464	D447-D449 VanDerWaalsContact C-N 3.32Å; D449-F451 HydrophobicContact CB-CD2 3.72Å; D449-F451 HydrophobicContact CB-CE2 3.49Å; D449-F451 VanDerWaalsContact CB-CE2 3.49Å; D449-F451 HydrophobicContact CB-CZ 4.24Å; D449-R464 PolarHBondContact O-NE 2.79Å; D449-R464 PolarHBondContact O-NH1 2.61Å; D449-R464 PolarHBondContact O-NH2 2.93Å; D449-R464 IonicContact OD1-CZ 2.92Å; D449-R464 IonicContact OD1-NH1 3.73Å; D449-R464 PolarHBondContact OD1-NH1 2.95Å; D449-R464 IonicContact OD1-NH2 3.14Å
450	Q	92.3	Very high	93.2	Very high	85 Å²	85	59.9 Å²	59.9	40%	0.397	29%	0.292	S	S	.	.			trans	60.2	48.2	179.7	-57.4	156	44.9	0	0	110.8	D447 F452 N463	D447-Q450 VanDerWaalsContact CG-CA 3.47Å; D447-Q450 PolarHBondContact O-N 2.85Å; D447-Q450 WeakPolarHBondContact OD1-CA 3.35Å; D447-Q450 PolarHBondContact OD1-N 3.43Å; D447-Q450 WeakPolarHBondContact OD2-CA 3.29Å; Q450-F452 PolarHBondContact O-N 2.72Å; Q450-N463 PolarHBondContact O-ND2 3.44Å
451	F	93.7	Very high	93.2	Very high	43 Å²	43	61.3 Å²	61.3	19%	0.189	30%	0.301	C	S	.	.			trans	-61.5	-28.8	170.8	-76.7	-77.1	0	0	0	112	D447 D449 N463 R464 P465 L466 H474	D447-F451 VanDerWaalsContact CG-N 3.33Å; D447-F451 PolarHBondContact OD1-N 2.69Å; D447-F451 PolarHBondContact OD2-N 3.13Å; D449-F451 HydrophobicContact CB-CD2 3.72Å; D449-F451 HydrophobicContact CB-CE2 3.49Å; D449-F451 VanDerWaalsContact CB-CE2 3.49Å; D449-F451 HydrophobicContact CB-CZ 4.24Å; F451-N463 PolarHBondContact O-N 3.3Å; F451-R464 HydrophobicContact CD1-CB 3.88Å; F451-R464 HydrophobicContact CE1-CB 4.41Å; F451-R464 PolarHBondContact O-N 3.43Å; F451-P465 WeakPolarHBondContact CD1-O 3.48Å; F451-P465 WeakPolarHBondContact CE1-O 3.33Å; F451-L466 HydrophobicContact CB-CD2 4.08Å; F451-L466 HydrophobicContact CD1-CD2 3.69Å; F451-L466 HydrophobicContact CE1-CD2 4.46Å; F451-L466 HydrophobicContact CG-CD2 4.16Å; F451-H474 AromaticContact CD2-CE1 3.76Å; F451-H474 AromaticContact CD2-ND1 3.96Å; F451-H474 AromaticContact CE2-CE1 3.91Å; F451-H474 AromaticContact CG-CE1 3.94Å
452	F	95.8	Very high	93.3	Very high	7 Å²	7	56.5 Å²	56.5	3%	0.031	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	158.6	-177.1	-54.4	-79.6	0	0	0	112.3	V423 I442 D447 Q450 I460 I461 T462 L466 H474 I476 I496	V423-F452 HydrophobicContact CG2-CD1 4.17Å; V423-F452 HydrophobicContact CG2-CE1 4.11Å; I442-F452 HydrophobicContact CD1-CB 3.99Å; D447-F452 PolarHBondContact OD2-N 2.83Å; Q450-F452 PolarHBondContact O-N 2.72Å; F452-I460 HydrophobicContact CB-CG2 4.03Å; F452-I460 HydrophobicContact CD1-CG2 4.17Å; F452-I460 HydrophobicContact CG-CG2 4.37Å; F452-I461 WeakPolarHBondContact CA-O 3.39Å; F452-T462 HydrophobicContact CE1-CG2 4.49Å; F452-L466 HydrophobicContact CE1-CD1 4.18Å; F452-L466 HydrophobicContact CE1-CD2 4.25Å; F452-L466 HydrophobicContact CE2-CD2 4.38Å; F452-L466 HydrophobicContact CZ-CD1 4.18Å; F452-L466 HydrophobicContact CZ-CD2 3.73Å; F452-H474 HydrophobicContact CE2-CB 3.61Å; F452-H474 AromaticContact CE2-CG 3.66Å; F452-H474 AromaticContact CE2-ND1 3.96Å; F452-H474 HydrophobicContact CZ-CB 4.07Å; F452-H474 AromaticContact CZ-CG 4Å; F452-I476 HydrophobicContact CB-CD1 4.32Å; F452-I476 HydrophobicContact CD2-CD1 4.28Å; F452-I476 HydrophobicContact CD2-CG2 4.11Å; F452-I476 HydrophobicContact CE2-CG2 4.48Å; F452-I476 HydrophobicContact CG-CD1 4.36Å; F452-I496 HydrophobicContact CD1-CD1 3.78Å; F452-I496 HydrophobicContact CD2-CD1 4.04Å; F452-I496 HydrophobicContact CE1-CD1 3.61Å; F452-I496 HydrophobicContact CE1-CG2 4.13Å; F452-I496 HydrophobicContact CE2-CD1 3.89Å; F452-I496 HydrophobicContact CG-CD1 4Å; F452-I496 HydrophobicContact CZ-CB 4.35Å; F452-I496 HydrophobicContact CZ-CD1 3.67Å; F452-I496 HydrophobicContact CZ-CG2 3.99Å
453	S	94.6	Very high	93.2	Very high	41 Å²	41	57.1 Å²	57.1	29%	0.287	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	163.5	165.1	59.7	0	0	0	0	110.1	I460 I461	S453-I460 WeakPolarHBondContact O-CA 3.41Å; S453-I461 PolarHBondContact N-O 2.63Å; S453-I461 PolarHBondContact O-N 3.16Å; S453-I461 VanDerWaalsContact OG-CG1 3.22Å; S453-I461 WeakPolarHBondContact OG-CG1 3.4Å
454	I	96.4	Very high	93.1	Very high	34 Å²	34	61.4 Å²	61.4	17%	0.174	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141.9	-176.7	-167.7	162.3	0	0	0	110.7	V426 Y440 I442 M459 I460 V478	V426-I454 HydrophobicContact CG2-CD1 3.85Å; Y440-I454 HydrophobicContact CG-CD1 4.32Å; I442-I454 HydrophobicContact CD1-CB 4.03Å; I442-I454 HydrophobicContact CD1-CG2 4.26Å; I442-I454 HydrophobicContact CG1-CB 4.19Å; I442-I454 HydrophobicContact CG1-CG2 4Å; I454-M459 WeakPolarHBondContact CA-O 3.22Å; I454-I460 HydrophobicContact CD1-CG1 3.92Å; I454-I460 HydrophobicContact CG1-CG1 4.21Å; I454-V478 HydrophobicContact CD1-CG1 3.61Å; I454-V478 HydrophobicContact CD1-CG2 4.05Å
455	S	93.8	Very high	93.1	Very high	35 Å²	35	57 Å²	57	25%	0.245	29%	0.292	C	S	.	.			trans	-88.4	172.9	176.6	67.7	0	0	0	0	112.9	D457 G458 M459	S455-D457 VanDerWaalsContact CB-OD1 3.26Å; S455-D457 WeakPolarHBondContact CB-OD1 3.21Å; S455-D457 PolarHBondContact O-N 3.08Å; S455-D457 VanDerWaalsContact OG-CG 3.32Å; S455-D457 PolarHBondContact OG-N 3.17Å; S455-D457 PolarHBondContact OG-OD1 2.72Å; S455-G458 PolarHBondContact O-N 2.78Å; S455-G458 VanDerWaalsContact O-N 3.13Å; S455-G458 PolarHBondContact OG-N 3.1Å; S455-M459 PolarHBondContact N-O 3.19Å; S455-M459 VanDerWaalsContact N-O 3.07Å; S455-M459 VanDerWaalsContact OG-CB 3.27Å; S455-M459 WeakPolarHBondContact OG-CB 3.49Å; S455-M459 PolarHBondContact OG-N 3.02Å; S455-M459 PolarHBondContact OG-O 2.71Å
456	E	90.8	Very high	93.2	Very high	158 Å²	158	50.4 Å²	50.4	74%	0.738	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-25	174.6	-58.3	-170.6	140.1	0	0	112.8	R439 Y440 G458	R439-E456 IonicContact NH2-OE1 3.33Å; Y440-E456 WeakPolarHBondContact CD2-O 3.46Å; E456-G458 VanDerWaalsContact C-N 3.32Å
457	D	91.1	Very high	93.2	Very high	77 Å²	77	51.7 Å²	51.7	41%	0.412	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	11.6	173.4	73.4	-69.8	0	0	0	114.2	R425 S455 M459	R425-D457 WeakPolarHBondContact CD-O 3.45Å; R425-D457 IonicContact CZ-OD2 3.38Å; R425-D457 VanDerWaalsContact CZ-OD2 3.22Å; R425-D457 PolarHBondContact NE-O 2.9Å; R425-D457 IonicContact NE-OD2 3.66Å; R425-D457 PolarHBondContact NE-OD2 3.06Å; R425-D457 IonicContact NH2-OD2 3.06Å; R425-D457 PolarHBondContact NH2-OD2 2.77Å; S455-D457 VanDerWaalsContact CB-OD1 3.26Å; S455-D457 WeakPolarHBondContact CB-OD1 3.21Å; S455-D457 PolarHBondContact O-N 3.08Å; S455-D457 VanDerWaalsContact OG-CG 3.32Å; S455-D457 PolarHBondContact OG-N 3.17Å; S455-D457 PolarHBondContact OG-OD1 2.72Å; D457-M459 VanDerWaalsContact C-N 3.32Å; D457-M459 PolarHBondContact O-N 2.87Å
458	G	93.1	Very high	93.3	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.274	C	S	.	.			trans	76.9	11.3	176.3	0	0	0	0	0	115.1	R425 V426 S455 E456 I460	R425-G458 WeakPolarHBondContact CA-O 3.44Å; V426-G458 PolarHBondContact N-O 3.47Å; S455-G458 PolarHBondContact O-N 2.78Å; S455-G458 VanDerWaalsContact O-N 3.13Å; S455-G458 PolarHBondContact OG-N 3.1Å; E456-G458 VanDerWaalsContact C-N 3.32Å; G458-I460 PolarHBondContact O-N 2.66Å
459	M	96.3	Very high	93.3	Very high	39 Å²	39	49.9 Å²	49.9	19%	0.192	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	115.4	177.8	-173.5	77	-103	0	0	109.7	P422 G424 R425 I454 S455 D457 I461	P422-M459 HydrophobicContact CB-CE 3.7Å; P422-M459 HydrophobicContact CB-CG 4.49Å; P422-M459 HydrophobicContact CB-SD 4.06Å; G424-M459 WeakPolarHBondContact O-CE 3.41Å; R425-M459 HydrophobicContact CB-CE 4.33Å; R425-M459 HydrophobicContact CB-SD 4.3Å; I454-M459 WeakPolarHBondContact CA-O 3.22Å; S455-M459 PolarHBondContact N-O 3.19Å; S455-M459 VanDerWaalsContact N-O 3.07Å; S455-M459 VanDerWaalsContact OG-CB 3.27Å; S455-M459 WeakPolarHBondContact OG-CB 3.49Å; S455-M459 PolarHBondContact OG-N 3.02Å; S455-M459 PolarHBondContact OG-O 2.71Å; D457-M459 VanDerWaalsContact C-N 3.32Å; D457-M459 PolarHBondContact O-N 2.87Å; M459-I461 HydrophobicContact CG-CG2 4.16Å
460	I	96.9	Very high	93.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	132.4	173	-56.7	169.9	0	0	0	108.9	F411 V423 G424 V426 F452 S453 I454 G458 I476 V478 V494 I496	F411-I460 HydrophobicContact CD2-CD1 4.49Å; F411-I460 HydrophobicContact CE2-CD1 4.12Å; V423-I460 HydrophobicContact CB-CB 4.5Å; V423-I460 HydrophobicContact CB-CG2 4.31Å; V423-I460 PolarHBondContact N-O 3.13Å; G424-I460 VanDerWaalsContact O-CB 3.31Å; G424-I460 WeakPolarHBondContact O-CB 3.46Å; G424-I460 PolarHBondContact O-N 2.75Å; V426-I460 HydrophobicContact CG1-CD1 4.07Å; F452-I460 HydrophobicContact CB-CG2 4.03Å; F452-I460 HydrophobicContact CD1-CG2 4.17Å; F452-I460 HydrophobicContact CG-CG2 4.37Å; S453-I460 WeakPolarHBondContact O-CA 3.41Å; I454-I460 HydrophobicContact CD1-CG1 3.92Å; I454-I460 HydrophobicContact CG1-CG1 4.21Å; G458-I460 PolarHBondContact O-N 2.66Å; I460-I476 HydrophobicContact CD1-CD1 4.45Å; I460-V478 HydrophobicContact CD1-CG2 4.07Å; I460-V494 HydrophobicContact CD1-CG1 3.94Å; I460-V494 HydrophobicContact CD1-CG2 4.25Å; I460-I496 HydrophobicContact CG2-CD1 4.48Å
461	I	95.7	Very high	93.3	Very high	53 Å²	53	51 Å²	51	27%	0.272	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	154.5	178.6	68.3	179.1	0	0	0	111.4	T421 F452 S453 M459	T421-I461 CarbonylContact O-C 3.57Å; T421-I461 VanDerWaalsContact O-CA 3.23Å; T421-I461 WeakPolarHBondContact O-CA 3.38Å; F452-I461 WeakPolarHBondContact CA-O 3.39Å; S453-I461 PolarHBondContact N-O 2.63Å; S453-I461 PolarHBondContact O-N 3.16Å; S453-I461 VanDerWaalsContact OG-CG1 3.22Å; S453-I461 WeakPolarHBondContact OG-CG1 3.4Å; M459-I461 HydrophobicContact CG-CG2 4.16Å
462	T	95.9	Very high	93.2	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.006	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	135.9	172.2	61	0	0	0	0	111.2	V413 A417 P418 G420 T421 V423 F452 L466	V413-T462 HydrophobicContact CG2-CG2 4.07Å; A417-T462 HydrophobicContact CB-CG2 4.3Å; P418-T462 PolarHBondContact O-OG1 2.9Å; G420-T462 PolarHBondContact N-O 2.87Å; G420-T462 PolarHBondContact N-OG1 2.71Å; T421-T462 PolarHBondContact N-OG1 2.66Å; T421-T462 VanDerWaalsContact N-OG1 3.11Å; T421-T462 PolarHBondContact O-N 3.11Å; V423-T462 HydrophobicContact CG2-CG2 3.86Å; F452-T462 HydrophobicContact CE1-CG2 4.49Å; T462-L466 HydrophobicContact CG2-CD1 4.21Å
463	N	93.4	Very high	93.1	Very high	36 Å²	36	56.7 Å²	56.7	19%	0.193	29%	0.292	C	S	.	.	S	Bend	trans	-116.4	-24.8	178.4	179.5	55.3	0	0	0	112.9	R419 Q450 F451	R419-N463 WeakPolarHBondContact CD-O 3.26Å; R419-N463 WeakPolarHBondContact CG-O 3.47Å; R419-N463 PolarHBondContact NE-O 2.97Å; R419-N463 PolarHBondContact NE-OD1 2.75Å; R419-N463 PolarHBondContact NH2-OD1 3.17Å; Q450-N463 PolarHBondContact O-ND2 3.44Å; F451-N463 PolarHBondContact O-N 3.3Å
464	R	91.3	Very high	93.1	Very high	102 Å²	102	55 Å²	55	39%	0.385	28%	0.28	S	S	.	.	S	Bend	trans	-122.7	162.7	166.8	-69	-171.9	178.6	179.8	12.3	109.4	D449 F451	D449-R464 PolarHBondContact O-NE 2.79Å; D449-R464 PolarHBondContact O-NH1 2.61Å; D449-R464 PolarHBondContact O-NH2 2.93Å; D449-R464 IonicContact OD1-CZ 2.92Å; D449-R464 IonicContact OD1-NH1 3.73Å; D449-R464 PolarHBondContact OD1-NH1 2.95Å; D449-R464 IonicContact OD1-NH2 3.14Å; F451-R464 HydrophobicContact CD1-CB 3.88Å; F451-R464 HydrophobicContact CE1-CB 4.41Å; F451-R464 PolarHBondContact O-N 3.43Å
465	P	91	Very high	93	Very high	99 Å²	99	58.3 Å²	58.3	64%	0.643	30%	0.298	S	S	*	.			trans	-58.1	155.3	161.7	28.5	-36.6	0	0	0	110.4	F451	F451-P465 WeakPolarHBondContact CD1-O 3.48Å; F451-P465 WeakPolarHBondContact CE1-O 3.33Å
466	L	92.9	Very high	93.1	Very high	12 Å²	12	56.9 Å²	56.9	6%	0.063	29%	0.288	C	S	.	.			trans	-108.7	167.2	173.2	-57.1	170.4	0	0	0	108.6	V413 E415 F451 F452 T462 V498	V413-L466 HydrophobicContact CG1-CD1 3.43Å; V413-L466 VanDerWaalsContact CG1-CD1 3.43Å; V413-L466 HydrophobicContact CG2-CD1 4.3Å; E415-L466 HydrophobicContact CB-CB 4.36Å; E415-L466 PolarHBondContact O-N 2.99Å; F451-L466 HydrophobicContact CB-CD2 4.08Å; F451-L466 HydrophobicContact CD1-CD2 3.69Å; F451-L466 HydrophobicContact CE1-CD2 4.46Å; F451-L466 HydrophobicContact CG-CD2 4.16Å; F452-L466 HydrophobicContact CE1-CD1 4.18Å; F452-L466 HydrophobicContact CE1-CD2 4.25Å; F452-L466 HydrophobicContact CE2-CD2 4.38Å; F452-L466 HydrophobicContact CZ-CD1 4.18Å; F452-L466 HydrophobicContact CZ-CD2 3.73Å; T462-L466 HydrophobicContact CG2-CD1 4.21Å; L466-V498 HydrophobicContact CB-CG1 4.35Å
467	D	92	Very high	93.3	Very high	70 Å²	70	50 Å²	50	37%	0.374	26%	0.257	S	S	.	.			trans	-156.3	111.3	-173.5	164.3	-16.1	0	0	0	105.6	E469 T470 Q471	D467-E469 PolarHBondContact OD1-N 2.99Å; D467-T470 WeakPolarHBondContact OD1-CB 3.27Å; D467-T470 PolarHBondContact OD1-N 2.93Å; D467-T470 PolarHBondContact OD1-OG1 2.97Å; D467-T470 VanDerWaalsContact OD1-OG1 3.13Å; D467-T470 VanDerWaalsContact OD2-CB 3.32Å; D467-T470 WeakPolarHBondContact OD2-CB 3.5Å; D467-T470 PolarHBondContact OD2-OG1 3.18Å; D467-Q471 CarbonylContact O-C 3.54Å; D467-Q471 PolarHBondContact O-N 2.83Å
468	R	91.9	Very high	93.6	Very high	24 Å²	24	46.3 Å²	46.3	9%	0.091	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-34.3	-172	-170.8	-152.9	65.5	91.3	5	111.3	E415 T470 Q471 P472 V498 D500 K534 E536	E415-R468 WeakPolarHBondContact OE2-CA 3.47Å; E415-R468 WeakPolarHBondContact OE2-CB 3.34Å; E415-R468 PolarHBondContact OE2-N 2.79Å; R468-T470 VanDerWaalsContact C-N 3.26Å; R468-T470 PolarHBondContact O-N 3.29Å; R468-Q471 CarbonylContact O-C 3.56Å; R468-Q471 PolarHBondContact O-N 3.27Å; R468-P472 HydrophobicContact CG-CB 3.88Å; R468-P472 VanDerWaalsContact O-CD 3.23Å; R468-P472 WeakPolarHBondContact O-CD 3.34Å; R468-P472 VanDerWaalsContact O-N 3.16Å; R468-V498 HydrophobicContact CB-CB 4.24Å; R468-V498 HydrophobicContact CB-CG1 3.8Å; R468-V498 HydrophobicContact CG-CB 4.17Å; R468-V498 HydrophobicContact CG-CG1 4.21Å; R468-D500 IonicContact CZ-OD1 3.65Å; R468-D500 IonicContact NE-OD1 3.99Å; R468-D500 PolarHBondContact NE-OD1 2.85Å; R468-D500 IonicContact NH2-OD1 3.74Å; R468-K534 PolarHBondContact NH2-O 2.98Å; R468-E536 IonicContact CZ-OE2 3.97Å; R468-E536 IonicContact NH1-OE2 2.79Å; R468-E536 PolarHBondContact NH1-OE2 2.95Å
469	E	90.8	Very high	93.6	Very high	56 Å²	56	46.4 Å²	46.4	26%	0.262	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-34.1	177.4	-69.2	61.4	-118.8	0	0	111.1	D467 K534	D467-E469 PolarHBondContact OD1-N 2.99Å; E469-K534 HydrophobicContact CG-CB 3.61Å; E469-K534 HydrophobicContact CG-CD 4.38Å
470	T	90.5	Very high	93.5	Very high	110 Å²	110	44.5 Å²	44.5	68%	0.675	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-48	170.2	-65.4	0	0	0	0	111.8	D467 R468	D467-T470 WeakPolarHBondContact OD1-CB 3.27Å; D467-T470 PolarHBondContact OD1-N 2.93Å; D467-T470 PolarHBondContact OD1-OG1 2.97Å; D467-T470 VanDerWaalsContact OD1-OG1 3.13Å; D467-T470 VanDerWaalsContact OD2-CB 3.32Å; D467-T470 WeakPolarHBondContact OD2-CB 3.5Å; D467-T470 PolarHBondContact OD2-OG1 3.18Å; R468-T470 VanDerWaalsContact C-N 3.26Å; R468-T470 PolarHBondContact O-N 3.29Å
471	Q	90.9	Very high	93.2	Very high	73 Å²	73	46 Å²	46	34%	0.341	24%	0.238	S	C	.	.			trans	-146.8	96.2	-177.4	-174.2	162.8	3.7	0	0	113.8	D467 R468 W473 H474 V498	D467-Q471 CarbonylContact O-C 3.54Å; D467-Q471 PolarHBondContact O-N 2.83Å; R468-Q471 CarbonylContact O-C 3.56Å; R468-Q471 PolarHBondContact O-N 3.27Å; Q471-W473 VanDerWaalsContact C-N 3.27Å; Q471-W473 WeakPolarHBondContact CG-O 3.02Å; Q471-W473 PolarHBondContact NE2-O 3.18Å; Q471-W473 PolarHBondContact O-N 3.39Å; Q471-H474 PolarHBondContact NE2-ND1 2.9Å; Q471-H474 PolarHBondContact OE1-CE1 2.97Å; Q471-H474 VanDerWaalsContact OE1-CE1 3.31Å; Q471-H474 PolarHBondContact OE1-ND1 2.98Å; Q471-V498 WeakPolarHBondContact O-CG2 3.04Å
472	P	91.6	Very high	93	Very high	54 Å²	54	44.3 Å²	44.3	35%	0.351	23%	0.229	S	C	.	.	S	Bend	trans	-74.2	-13.1	-178.9	27.5	-33.4	0	0	0	114.6	R468 V498	R468-P472 HydrophobicContact CG-CB 3.88Å; R468-P472 VanDerWaalsContact O-CD 3.23Å; R468-P472 WeakPolarHBondContact O-CD 3.34Å; R468-P472 VanDerWaalsContact O-N 3.16Å; P472-V498 PolarHBondContact O-N 3.03Å
473	W	94	Very high	92.4	Very high	116 Å²	116	48.9 Å²	48.9	44%	0.439	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	124.6	-178.3	-70.1	86.7	0	0	0	112	T410 Q471 N495 I496 K497	T410-W473 HydrophobicContact CG2-CZ3 4.45Å; Q471-W473 VanDerWaalsContact C-N 3.27Å; Q471-W473 WeakPolarHBondContact CG-O 3.02Å; Q471-W473 PolarHBondContact NE2-O 3.18Å; Q471-W473 PolarHBondContact O-N 3.39Å; W473-N495 HydrophobicContact CE3-CB 4.48Å; W473-N495 HydrophobicContact CZ3-CB 4.4Å; W473-I496 WeakPolarHBondContact CA-O 3.1Å; W473-K497 HydrophobicContact CD2-CB 4.28Å; W473-K497 HydrophobicContact CD2-CG 4.23Å; W473-K497 HydrophobicContact CE3-CB 3.94Å; W473-K497 HydrophobicContact CE3-CG 4.37Å; W473-K497 HydrophobicContact CH2-CB 3.77Å; W473-K497 HydrophobicContact CH2-CD 4.07Å; W473-K497 HydrophobicContact CH2-CG 3.89Å; W473-K497 HydrophobicContact CZ2-CB 4.1Å; W473-K497 HydrophobicContact CZ2-CD 3.86Å; W473-K497 HydrophobicContact CZ2-CG 3.71Å; W473-K497 HydrophobicContact CZ3-CB 3.67Å; W473-K497 HydrophobicContact CZ3-CG 4.22Å
474	H	94.1	Very high	91.4	Very high	7 Å²	7	51 Å²	51	3%	0.032	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	115.3	169.7	-62.3	-97.3	0	0	0	110.2	F451 F452 Q471 I496	F451-H474 AromaticContact CD2-CE1 3.76Å; F451-H474 AromaticContact CD2-ND1 3.96Å; F451-H474 AromaticContact CE2-CE1 3.91Å; F451-H474 AromaticContact CG-CE1 3.94Å; F452-H474 HydrophobicContact CE2-CB 3.61Å; F452-H474 AromaticContact CE2-CG 3.66Å; F452-H474 AromaticContact CE2-ND1 3.96Å; F452-H474 HydrophobicContact CZ-CB 4.07Å; F452-H474 AromaticContact CZ-CG 4Å; Q471-H474 PolarHBondContact NE2-ND1 2.9Å; Q471-H474 PolarHBondContact OE1-CE1 2.97Å; Q471-H474 VanDerWaalsContact OE1-CE1 3.31Å; Q471-H474 PolarHBondContact OE1-ND1 2.98Å; H474-I496 HydrophobicContact CB-CB 4.35Å; H474-I496 PolarHBondContact N-O 3.45Å; H474-I496 PolarHBondContact O-N 2.8Å
475	N	94.8	Very high	90.3	Very high	102 Å²	102	47.4 Å²	47.4	55%	0.545	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	84	-179	-63.2	-28.3	0	0	0	109.6	N495	N475-N495 PolarHBondContact OD1-OD1 3.14Å
476	I	95.6	Very high	89	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.031	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	165.3	-177.8	70.5	175.5	0	0	0	111.4	I442 D447 F452 I460 V494 I496	I442-I476 HydrophobicContact CD1-CD1 4Å; I442-I476 HydrophobicContact CG1-CD1 4.35Å; D447-I476 HydrophobicContact CB-CG2 4.1Å; F452-I476 HydrophobicContact CB-CD1 4.32Å; F452-I476 HydrophobicContact CD2-CD1 4.28Å; F452-I476 HydrophobicContact CD2-CG2 4.11Å; F452-I476 HydrophobicContact CE2-CG2 4.48Å; F452-I476 HydrophobicContact CG-CD1 4.36Å; I460-I476 HydrophobicContact CD1-CD1 4.45Å; I476-V494 HydrophobicContact CG1-CB 3.88Å; I476-V494 HydrophobicContact CG1-CG1 4.49Å; I476-V494 PolarHBondContact N-O 2.75Å; I476-V494 PolarHBondContact O-N 2.77Å; I476-I496 HydrophobicContact CD1-CD1 3.78Å; I476-I496 HydrophobicContact CG1-CD1 4.24Å
477	S	95.8	Very high	87.8	Confident	13 Å²	13	58 Å²	58	9%	0.091	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	149.2	164.5	65.7	0	0	0	0	110.7	P443 T446 V492	P443-S477 WeakPolarHBondContact CD-O 3.11Å; P443-S477 WeakPolarHBondContact CD-OG 3.08Å; T446-S477 WeakPolarHBondContact CG2-OG 2.96Å; T446-S477 PolarHBondContact OG1-N 2.92Å; T446-S477 PolarHBondContact OG1-OG 2.88Å; S477-V492 VanDerWaalsContact CA-O 3.31Å; S477-V492 WeakPolarHBondContact CA-O 3.46Å
478	V	96.2	Very high	87.1	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.9	165	-178.7	0	0	0	0	108	F404 V426 Y440 I442 I454 I460 K491 V492 V494	F404-V478 HydrophobicContact CE1-CG1 4.41Å; F404-V478 HydrophobicContact CZ-CB 4.43Å; F404-V478 HydrophobicContact CZ-CG1 4.19Å; V426-V478 HydrophobicContact CG2-CB 4.39Å; V426-V478 HydrophobicContact CG2-CG1 4Å; V426-V478 HydrophobicContact CG2-CG2 4.36Å; Y440-V478 HydrophobicContact CD1-CG1 4.25Å; I442-V478 HydrophobicContact CG1-CG2 4.14Å; I454-V478 HydrophobicContact CD1-CG1 3.61Å; I454-V478 HydrophobicContact CD1-CG2 4.05Å; I460-V478 HydrophobicContact CD1-CG2 4.07Å; V478-K491 WeakPolarHBondContact O-CA 3.12Å; V478-V492 HydrophobicContact CB-CG1 4.09Å; V478-V492 PolarHBondContact N-O 3.24Å; V478-V492 PolarHBondContact O-N 3.11Å; V478-V494 HydrophobicContact CG2-CG2 3.82Å
479	S	94.4	Very high	87	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.007	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	141.2	169.6	164	0	0	0	0	109.6	Y440 M441 D489 T490	Y440-S479 WeakPolarHBondContact CA-O 3.48Å; M441-S479 PolarHBondContact N-O 3.44Å; M441-S479 PolarHBondContact O-N 3.44Å; S479-D489 WeakPolarHBondContact CB-OD2 3.34Å; S479-D489 PolarHBondContact OG-OD2 2.93Å; S479-T490 CarbonylContact C-O 3.49Å; S479-T490 VanDerWaalsContact CA-O 3.3Å; S479-T490 WeakPolarHBondContact CA-O 3.27Å
480	A	93.7	Very high	87.1	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.1	169.3	0	0	0	0	0	109.3	P402 F404 A428 V438 R439 Y440 T490	P402-A480 HydrophobicContact CB-CB 4.37Å; F404-A480 HydrophobicContact CE1-CB 4.39Å; F404-A480 HydrophobicContact CE2-CB 3.58Å; F404-A480 HydrophobicContact CZ-CB 3.5Å; A428-A480 HydrophobicContact CB-CB 3.79Å; V438-A480 HydrophobicContact CG1-CB 3.78Å; R439-A480 WeakPolarHBondContact O-CA 3.34Å; Y440-A480 HydrophobicContact CD1-CB 4.4Å; A480-T490 PolarHBondContact N-O 2.91Å; A480-T490 PolarHBondContact O-N 2.89Å; A480-T490 VanDerWaalsContact O-N 3.08Å
481	T	91.1	Very high	87.2	Confident	32 Å²	32	59.2 Å²	59.2	20%	0.196	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	143.4	-178.4	57.6	0	0	0	0	109.2	R439 D489	R439-T481 PolarHBondContact N-O 3.48Å; R439-T481 PolarHBondContact O-N 3.48Å; T481-D489 HydrophobicContact CG2-CB 4.06Å
482	E	90.4	Very high	87.5	Confident	17 Å²	17	56 Å²	56	8%	0.079	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	162.5	173.8	-68.3	154.4	-97.7	0	0	113.6	P402 N436	P402-E482 HydrophobicContact CG-CG 3.59Å; N436-E482 HydrophobicContact CB-CB 4.23Å; N436-E482 HydrophobicContact CB-CG 3.98Å; N436-E482 PolarHBondContact ND2-OE2 3.43Å
483	I	83.1	Confident	87.7	Confident	97 Å²	97	62.5 Å²	62.5	50%	0.497	32%	0.32	S	S	.	.	S	Bend	trans	-107.5	82.1	174.5	-54.6	167.7	0	0	0	108.4	P437 R439	P437-I483 HydrophobicContact CB-CD1 4.39Å; P437-I483 HydrophobicContact CG-CB 4.28Å; P437-I483 WeakPolarHBondContact O-CB 3.42Å; P437-I483 VanDerWaalsContact O-CG1 3.29Å; P437-I483 WeakPolarHBondContact O-CG1 3.43Å; P437-I483 PolarHBondContact O-N 3.33Å; R439-I483 HydrophobicContact CB-CD1 3.98Å; R439-I483 HydrophobicContact CB-CG1 3.76Å
484	G	73.3	Confident	87.9	Confident	81 Å²	81	57 Å²	57	84%	0.835	30%	0.299	S	S	*	.	S	Bend	trans	126.3	-18.3	171.1	0	0	0	0	0	115.8
485	G	67.3	Low	88	Confident	26 Å²	26	58.8 Å²	58.8	27%	0.268	31%	0.309	S	S	.	.	S	Bend	trans	-74.3	-163.9	170.4	0	0	0	0	0	113.2
486	H	65.5	Low	88.1	Confident	134 Å²	134	53.9 Å²	53.9	62%	0.62	28%	0.283	S	S	*	.			trans	-71.7	162.7	175.4	-69.1	-95.2	0	0	0	111.9	D399 Q488	D399-H486 IonicContact OD1-CD2 3.51Å; D399-H486 PolarHBondContact OD1-CD2 3.12Å; D399-H486 WeakPolarHBondContact OD2-CB 3.44Å; D399-H486 IonicContact OD2-CD2 3.35Å; D399-H486 IonicContact OD2-CG 2.81Å; H486-Q488 HydrophobicContact CB-CG 4.37Å; H486-Q488 PolarHBondContact O-N 3.35Å
487	H	66.3	Low	88	Confident	199 Å²	199	56.5 Å²	56.5	92%	0.921	29%	0.294	S	S	*	.	S	Bend	trans	-79	45	-173.5	-73.2	-93.2	0	0	0	113.5
488	Q	78.7	Confident	88	Confident	77 Å²	77	55.9 Å²	55.9	36%	0.36	29%	0.29	S	S	.	.			trans	-85	156	176	-47.6	-160.2	67	0	0	111.2	D399 P401 H486	D399-Q488 PolarHBondContact O-NE2 3.06Å; D399-Q488 PolarHBondContact OD2-NE2 2.98Å; P401-Q488 HydrophobicContact CB-CB 3.73Å; P401-Q488 HydrophobicContact CG-CB 4.49Å; H486-Q488 HydrophobicContact CB-CG 4.37Å; H486-Q488 PolarHBondContact O-N 3.35Å
489	D	88.3	Confident	87.7	Confident	68 Å²	68	59.5 Å²	59.5	36%	0.364	31%	0.305	S	S	.	.			trans	-153.8	96.9	-157.2	152.4	-136	0	0	0	111.9	S479 T481 K491	S479-D489 WeakPolarHBondContact CB-OD2 3.34Å; S479-D489 PolarHBondContact OG-OD2 2.93Å; T481-D489 HydrophobicContact CG2-CB 4.06Å; D489-K491 WeakPolarHBondContact OD1-CE 3.19Å; D489-K491 IonicContact OD1-NZ 3.83Å; D489-K491 PolarHBondContact OD1-NZ 2.62Å; D489-K491 WeakPolarHBondContact OD2-CE 3.3Å; D489-K491 IonicContact OD2-NZ 2.69Å
490	T	92.7	Very high	87.5	Confident	38 Å²	38	61.6 Å²	61.6	23%	0.233	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	141.6	176.3	-64.2	0	0	0	0	110.5	P401 P402 F404 S479 A480	P401-T490 WeakPolarHBondContact CB-OG1 3.16Å; P401-T490 PolarHBondContact O-OG1 2.91Å; P402-T490 WeakPolarHBondContact O-CB 3.26Å; P402-T490 WeakPolarHBondContact O-CG2 3.18Å; P402-T490 PolarHBondContact O-OG1 3.43Å; F404-T490 HydrophobicContact CD2-CG2 3.82Å; F404-T490 HydrophobicContact CE2-CG2 4.08Å; S479-T490 CarbonylContact C-O 3.49Å; S479-T490 VanDerWaalsContact CA-O 3.3Å; S479-T490 WeakPolarHBondContact CA-O 3.27Å; A480-T490 PolarHBondContact N-O 2.91Å; A480-T490 PolarHBondContact O-N 2.89Å; A480-T490 VanDerWaalsContact O-N 3.08Å
491	K	94.4	Very high	87.2	Confident	102 Å²	102	63 Å²	63	44%	0.443	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	125	-178.5	-70.2	164.8	-174.1	133.9	0	113	V478 D489	V478-K491 WeakPolarHBondContact O-CA 3.12Å; D489-K491 WeakPolarHBondContact OD1-CE 3.19Å; D489-K491 IonicContact OD1-NZ 3.83Å; D489-K491 PolarHBondContact OD1-NZ 2.62Å; D489-K491 WeakPolarHBondContact OD2-CE 3.3Å; D489-K491 IonicContact OD2-NZ 2.69Å
492	V	96.4	Very high	87	Confident	6 Å²	6	62 Å²	62	4%	0.036	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	149.4	170.9	73.5	0	0	0	0	111.4	F404 A406 Y409 S477 V478 V494	F404-V492 HydrophobicContact CB-CB 4.3Å; F404-V492 HydrophobicContact CB-CG2 4.43Å; F404-V492 HydrophobicContact CD1-CB 4.01Å; F404-V492 HydrophobicContact CD1-CG1 3.6Å; F404-V492 HydrophobicContact CD2-CB 3.74Å; F404-V492 HydrophobicContact CD2-CG1 4.07Å; F404-V492 HydrophobicContact CE1-CB 4.22Å; F404-V492 HydrophobicContact CE1-CG1 3.46Å; F404-V492 VanDerWaalsContact CE1-CG1 3.46Å; F404-V492 HydrophobicContact CE2-CB 3.96Å; F404-V492 HydrophobicContact CE2-CG1 3.94Å; F404-V492 HydrophobicContact CG-CB 3.75Å; F404-V492 HydrophobicContact CG-CG1 3.89Å; F404-V492 HydrophobicContact CG-CG2 4.37Å; F404-V492 HydrophobicContact CZ-CB 4.19Å; F404-V492 HydrophobicContact CZ-CG1 3.63Å; A406-V492 WeakPolarHBondContact O-CG2 3.25Å; Y409-V492 HydrophobicContact CD2-CG1 4.05Å; Y409-V492 HydrophobicContact CD2-CG2 3.74Å; Y409-V492 HydrophobicContact CE2-CG1 4.09Å; Y409-V492 HydrophobicContact CE2-CG2 3.88Å; S477-V492 VanDerWaalsContact CA-O 3.31Å; S477-V492 WeakPolarHBondContact CA-O 3.46Å; V478-V492 HydrophobicContact CB-CG1 4.09Å; V478-V492 PolarHBondContact N-O 3.24Å; V478-V492 PolarHBondContact O-N 3.11Å; V492-V494 HydrophobicContact CG1-CG2 4.21Å
493	R	96.3	Very high	86.9	Confident	191 Å²	191	65.5 Å²	65.5	72%	0.721	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	133.9	170.3	-66.9	-177.9	-179.9	129.8	1.7	110.4	S408 Y409	S408-R493 WeakPolarHBondContact CA-O 3.36Å; Y409-R493 PolarHBondContact N-O 2.94Å
494	V	97.4	Very high	87.2	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	113.2	174.3	-172.8	0	0	0	0	108.5	Y409 F411 V426 I460 I476 V478 V492 I496	Y409-V494 HydrophobicContact CD2-CG2 4.47Å; Y409-V494 WeakPolarHBondContact O-CA 3.13Å; F411-V494 HydrophobicContact CD2-CG1 3.5Å; F411-V494 VanDerWaalsContact CD2-CG1 3.5Å; F411-V494 HydrophobicContact CE2-CG1 3.65Å; V426-V494 HydrophobicContact CG1-CG2 3.86Å; I460-V494 HydrophobicContact CD1-CG1 3.94Å; I460-V494 HydrophobicContact CD1-CG2 4.25Å; I476-V494 HydrophobicContact CG1-CB 3.88Å; I476-V494 HydrophobicContact CG1-CG1 4.49Å; I476-V494 PolarHBondContact N-O 2.75Å; I476-V494 PolarHBondContact O-N 2.77Å; V478-V494 HydrophobicContact CG2-CG2 3.82Å; V492-V494 HydrophobicContact CG1-CG2 4.21Å; V494-I496 HydrophobicContact CG1-CD1 4.48Å; V494-I496 HydrophobicContact CG1-CG1 4.03Å
495	N	96.5	Very high	87.9	Confident	44 Å²	44	60.8 Å²	60.8	24%	0.235	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	113.8	177.2	-49.2	-45.7	0	0	0	108.2	Y409 T410 F411 W473 N475	Y409-N495 PolarHBondContact O-N 2.66Å; T410-N495 VanDerWaalsContact CA-O 3.28Å; T410-N495 WeakPolarHBondContact CA-O 3.4Å; F411-N495 PolarHBondContact N-O 2.92Å; W473-N495 HydrophobicContact CE3-CB 4.48Å; W473-N495 HydrophobicContact CZ3-CB 4.4Å; N475-N495 PolarHBondContact OD1-OD1 3.14Å
496	I	96.3	Very high	89	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	111.2	179.6	-58.4	170.5	0	0	0	107.2	V413 V423 F452 I460 W473 H474 I476 V494	V413-I496 HydrophobicContact CG1-CG2 3.58Å; V423-I496 HydrophobicContact CG1-CD1 4.09Å; V423-I496 HydrophobicContact CG1-CG1 4.12Å; V423-I496 HydrophobicContact CG1-CG2 3.81Å; F452-I496 HydrophobicContact CD1-CD1 3.78Å; F452-I496 HydrophobicContact CD2-CD1 4.04Å; F452-I496 HydrophobicContact CE1-CD1 3.61Å; F452-I496 HydrophobicContact CE1-CG2 4.13Å; F452-I496 HydrophobicContact CE2-CD1 3.89Å; F452-I496 HydrophobicContact CG-CD1 4Å; F452-I496 HydrophobicContact CZ-CB 4.35Å; F452-I496 HydrophobicContact CZ-CD1 3.67Å; F452-I496 HydrophobicContact CZ-CG2 3.99Å; I460-I496 HydrophobicContact CG2-CD1 4.48Å; W473-I496 WeakPolarHBondContact CA-O 3.1Å; H474-I496 HydrophobicContact CB-CB 4.35Å; H474-I496 PolarHBondContact N-O 3.45Å; H474-I496 PolarHBondContact O-N 2.8Å; I476-I496 HydrophobicContact CD1-CD1 3.78Å; I476-I496 HydrophobicContact CG1-CD1 4.24Å; V494-I496 HydrophobicContact CG1-CD1 4.48Å; V494-I496 HydrophobicContact CG1-CG1 4.03Å
497	K	94.9	Very high	90.2	Very high	60 Å²	60	58 Å²	58	26%	0.261	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	128.1	170.9	-170.6	-171.6	173.3	-169.1	0	108.8	F411 E412 V413 W473	F411-K497 PolarHBondContact O-N 3.13Å; E412-K497 WeakPolarHBondContact CA-O 3.1Å; E412-K497 HydrophobicContact CG-CB 4.3Å; V413-K497 PolarHBondContact N-O 3.36Å; W473-K497 HydrophobicContact CD2-CB 4.28Å; W473-K497 HydrophobicContact CD2-CG 4.23Å; W473-K497 HydrophobicContact CE3-CB 3.94Å; W473-K497 HydrophobicContact CE3-CG 4.37Å; W473-K497 HydrophobicContact CH2-CB 3.77Å; W473-K497 HydrophobicContact CH2-CD 4.07Å; W473-K497 HydrophobicContact CH2-CG 3.89Å; W473-K497 HydrophobicContact CZ2-CB 4.1Å; W473-K497 HydrophobicContact CZ2-CD 3.86Å; W473-K497 HydrophobicContact CZ2-CG 3.71Å; W473-K497 HydrophobicContact CZ3-CB 3.67Å; W473-K497 HydrophobicContact CZ3-CG 4.22Å
498	V	94.1	Very high	91.3	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	133.3	168.2	-170.1	0	0	0	0	108.7	V413 E415 L466 R468 Q471 P472	V413-V498 CarbonylContact O-C 3.57Å; V413-V498 WeakPolarHBondContact O-CA 3.26Å; E415-V498 HydrophobicContact CB-CG1 3.52Å; L466-V498 HydrophobicContact CB-CG1 4.35Å; R468-V498 HydrophobicContact CB-CB 4.24Å; R468-V498 HydrophobicContact CB-CG1 3.8Å; R468-V498 HydrophobicContact CG-CB 4.17Å; R468-V498 HydrophobicContact CG-CG1 4.21Å; Q471-V498 WeakPolarHBondContact O-CG2 3.04Å; P472-V498 PolarHBondContact O-N 3.03Å
499	K	91.6	Very high	91.7	Very high	75 Å²	75	47.9 Å²	47.9	33%	0.326	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	128.3	176.8	-85.9	176.8	172.3	157.1	0	110.2	E412 V413 E414 E415	E412-K499 HydrophobicContact CB-CD 4.15Å; E412-K499 HydrophobicContact CB-CG 4.43Å; E412-K499 WeakPolarHBondContact OE2-CE 3.5Å; E412-K499 IonicContact OE2-NZ 2.76Å; E412-K499 PolarHBondContact OE2-NZ 3.39Å; V413-K499 PolarHBondContact O-N 2.79Å; E414-K499 HydrophobicContact CG-CB 4.16Å; E415-K499 PolarHBondContact N-O 3.38Å
500	D	88.8	Confident	91.4	Very high	45 Å²	45	48 Å²	48	24%	0.241	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-53.4	131.6	173.1	-165.4	73.5	0	0	0	112.6	E415 R468 D535 E536	E415-D500 WeakPolarHBondContact OE1-CA 3.38Å; R468-D500 IonicContact CZ-OD1 3.65Å; R468-D500 IonicContact NE-OD1 3.99Å; R468-D500 PolarHBondContact NE-OD1 2.85Å; R468-D500 IonicContact NH2-OD1 3.74Å; D500-D535 WeakPolarHBondContact OD1-CA 3.03Å; D500-E536 HydrophobicContact CB-CB 4.39Å; D500-E536 PolarHBondContact OD1-N 3.2Å; D500-E536 VanDerWaalsContact OD2-C 3.31Å; D500-E536 PolarHBondContact OD2-N 2.64Å
501	V	88.3	Confident	90.6	Very high	31 Å²	31	53.1 Å²	53.1	19%	0.188	27%	0.269	C	S	.	.			trans	-132.4	137.5	167.9	-176.9	0	0	0	0	108.3	E414 E415 D503	E414-V501 HydrophobicContact CB-CG2 4.2Å; E414-V501 HydrophobicContact CG-CG2 4.41Å; E415-V501 HydrophobicContact CG-CB 4.38Å; E415-V501 HydrophobicContact CG-CG2 4.4Å; E415-V501 PolarHBondContact OE1-N 3.24Å; V501-D503 PolarHBondContact O-N 2.82Å
502	N	87.6	Confident	90.1	Very high	11 Å²	11	51.7 Å²	51.7	6%	0.059	27%	0.266	C	S	.	.	S	Bend	trans	-69	98.3	-178.4	-161.7	98.8	0	0	0	111.3	D535 M537 D592 P596 M598	N502-D535 VanDerWaalsContact CA-OD2 3.25Å; N502-D535 WeakPolarHBondContact CA-OD2 3.32Å; N502-M537 HydrophobicContact CB-CE 3.75Å; N502-M537 WeakPolarHBondContact OD1-CE 3.35Å; N502-D592 PolarHBondContact ND2-OD2 3.18Å; N502-D592 PolarHBondContact OD1-OD2 3.45Å; N502-P596 PolarHBondContact ND2-O 2.71Å; N502-M598 WeakPolarHBondContact ND2-CG 3.32Å
503	D	86.9	Confident	89.8	Confident	90 Å²	90	55.2 Å²	55.2	48%	0.481	28%	0.282	S	S	.	.			trans	-137.4	-21.6	-167.3	139.7	-51.9	0	0	0	112.5	V501 D535 M598	V501-D503 PolarHBondContact O-N 2.82Å; D503-D535 PolarHBondContact N-OD2 3.12Å; D503-M598 WeakPolarHBondContact O-CE 2.85Å
504	N	88.7	Confident	89.4	Confident	26 Å²	26	46.5 Å²	46.5	14%	0.139	25%	0.25	C	C	.	.	S	Bend	trans	-78.2	-179.9	162.4	-71.4	-93.1	0	0	0	110.7	D533 K534 D535 M598	N504-D533 WeakPolarHBondContact CB-OD1 2.83Å; N504-K534 HydrophobicContact CB-CB 4.42Å; N504-K534 PolarHBondContact OD1-NZ 3.34Å; N504-D535 VanDerWaalsContact CB-OD1 3.27Å; N504-D535 WeakPolarHBondContact CB-OD1 3.31Å; N504-D535 PolarHBondContact N-OD2 3.23Å; N504-D535 VanDerWaalsContact N-OD2 3.08Å; N504-D535 PolarHBondContact ND2-OD1 3Å; N504-M598 WeakPolarHBondContact O-CB 3.22Å; N504-M598 VanDerWaalsContact O-CG 3.26Å; N504-M598 WeakPolarHBondContact O-CG 3.15Å
505	S	89.5	Confident	89	Confident	52 Å²	52	50.8 Å²	50.8	36%	0.364	27%	0.27	S	S	.	.			trans	-139.2	145.7	173.8	58.1	0	0	0	0	109.3	E507	S505-E507 PolarHBondContact O-N 2.88Å
506	P	90.4	Very high	88.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.26	C	S	.	.			trans	-70.9	134.8	-165.2	24.6	-34.4	0	0	0	112	A531 V532 D533 F543 I590 D592 S600	P506-A531 HydrophobicContact CB-CB 4.38Å; P506-V532 WeakPolarHBondContact CA-O 3.36Å; P506-D533 VanDerWaalsContact CA-OD2 3.25Å; P506-D533 WeakPolarHBondContact CA-OD2 3.33Å; P506-D533 HydrophobicContact CB-CB 4.39Å; P506-D533 WeakPolarHBondContact CB-OD2 3.38Å; P506-D533 WeakPolarHBondContact CD-OD2 3.13Å; P506-F543 HydrophobicContact CB-CD1 3.64Å; P506-F543 HydrophobicContact CB-CE1 3.62Å; P506-F543 HydrophobicContact CB-CG 4.5Å; P506-F543 HydrophobicContact CB-CZ 4.45Å; P506-F543 HydrophobicContact CG-CD1 4.13Å; P506-F543 HydrophobicContact CG-CE1 4.4Å; P506-I590 HydrophobicContact CB-CG2 3.94Å; P506-I590 HydrophobicContact CG-CB 4.14Å; P506-I590 HydrophobicContact CG-CG2 3.73Å; P506-D592 HydrophobicContact CG-CB 4.31Å; P506-S600 WeakPolarHBondContact O-CB 3.38Å; P506-S600 PolarHBondContact O-OG 3.45Å
507	E	89.9	Confident	88.2	Confident	102 Å²	102	49.4 Å²	49.4	48%	0.477	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	165	178.4	68.6	-177.1	153.1	0	0	113	S505 A509 A531 V532 N602	S505-E507 PolarHBondContact O-N 2.88Å; E507-A509 PolarHBondContact O-N 3.33Å; E507-A531 CarbonylContact O-C 3.53Å; E507-A531 WeakPolarHBondContact O-CA 3.49Å; E507-A531 VanDerWaalsContact O-CB 3.3Å; E507-A531 WeakPolarHBondContact O-CB 3.45Å; E507-V532 HydrophobicContact CG-CG2 3.95Å; E507-V532 PolarHBondContact N-O 2.95Å; E507-V532 PolarHBondContact O-N 2.85Å; E507-N602 WeakPolarHBondContact CA-ND2 3.18Å
508	F	90.3	Very high	87.8	Confident	17 Å²	17	48.8 Å²	48.8	8%	0.075	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	132.6	179	-79	-39.8	0	0	0	111.3	T510 N512 V529 F545 I588 I590 N602 L604	F508-T510 PolarHBondContact O-N 2.83Å; F508-N512 HydrophobicContact CD2-CB 4.5Å; F508-V529 HydrophobicContact CD1-CB 4.08Å; F508-V529 HydrophobicContact CD1-CG2 4.49Å; F508-V529 HydrophobicContact CE1-CB 3.76Å; F508-V529 HydrophobicContact CE1-CG1 4.09Å; F508-V529 HydrophobicContact CE1-CG2 3.76Å; F508-V529 HydrophobicContact CZ-CB 4.45Å; F508-V529 HydrophobicContact CZ-CG1 4.31Å; F508-V529 HydrophobicContact CZ-CG2 4.41Å; F508-F545 HydrophobicContact CE1-CE1 4.43Å; F508-I588 HydrophobicContact CE1-CG2 4.42Å; F508-I588 HydrophobicContact CZ-CB 4.02Å; F508-I588 HydrophobicContact CZ-CD1 4Å; F508-I588 HydrophobicContact CZ-CG2 4.2Å; F508-I590 HydrophobicContact CD1-CD1 3.64Å; F508-I590 HydrophobicContact CE1-CD1 3.62Å; F508-I590 HydrophobicContact CE1-CG1 4.37Å; F508-I590 HydrophobicContact CG-CD1 4.35Å; F508-I590 HydrophobicContact CZ-CD1 4.34Å; F508-N602 HydrophobicContact CD2-CB 3.53Å; F508-N602 HydrophobicContact CE2-CB 3.39Å; F508-N602 HydrophobicContact CG-CB 4.17Å; F508-N602 HydrophobicContact CZ-CB 3.93Å; F508-N602 PolarHBondContact N-ND2 3.37Å; F508-L604 HydrophobicContact CE2-CB 4.4Å
509	A	86.2	Confident	87.3	Confident	46 Å²	46	53 Å²	53	38%	0.38	28%	0.283	S	S	.	.	S	Bend	trans	-72.5	-16	179	0	0	0	0	0	113.8	E507 S530 V532	E507-A509 PolarHBondContact O-N 3.33Å; A509-S530 WeakPolarHBondContact CB-OG 3.25Å; A509-S530 PolarHBondContact N-O 2.84Å; A509-V532 HydrophobicContact CB-CG1 3.8Å; A509-V532 HydrophobicContact CB-CG2 4.4Å
510	T	81.4	Confident	87	Confident	70 Å²	70	49.7 Å²	49.7	43%	0.429	27%	0.27	S	S	.	.	S	Bend	trans	-134.2	161.3	-175.9	53.1	0	0	0	0	110.4	F508 N512	F508-T510 PolarHBondContact O-N 2.83Å; T510-N512 PolarHBondContact O-N 2.93Å
511	N	77.4	Confident	86.8	Confident	146 Å²	146	50 Å²	50	78%	0.781	28%	0.278	S	S	*	.			trans	-51.6	134.9	-176.8	-68.3	-9.6	0	0	0	112.7	E513	N511-E513 PolarHBondContact O-N 2.78Å
512	N	83.9	Confident	86.7	Confident	73 Å²	73	51.1 Å²	51.1	39%	0.39	29%	0.287	S	S	.	.	S	Bend	trans	-69.8	25.4	179.9	-55.1	16.5	0	0	0	114.1	F508 T510 T605	F508-N512 HydrophobicContact CD2-CB 4.5Å; T510-N512 PolarHBondContact O-N 2.93Å; N512-T605 VanDerWaalsContact O-CB 3.28Å; N512-T605 WeakPolarHBondContact O-CB 3.39Å; N512-T605 PolarHBondContact O-N 2.79Å; N512-T605 PolarHBondContact O-OG1 2.93Å
513	E	88.5	Confident	86.5	Confident	79 Å²	79	53.2 Å²	53.2	37%	0.369	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	122.8	-177.1	-172.3	171.5	171.1	0	0	111.7	N511 H515 T605 R607	N511-E513 PolarHBondContact O-N 2.78Å; E513-H515 IonicContact OE1-CE1 3.19Å; E513-H515 PolarHBondContact OE1-CE1 3.01Å; E513-H515 IonicContact OE1-ND1 2.66Å; E513-T605 CarbonylContact C-O 3.5Å; E513-T605 VanDerWaalsContact CA-O 3.31Å; E513-T605 WeakPolarHBondContact CA-O 3.47Å; E513-T605 HydrophobicContact CG-CG2 4.44Å; E513-R607 WeakPolarHBondContact OE1-CD 3.18Å; E513-R607 IonicContact OE1-CZ 3.48Å; E513-R607 IonicContact OE1-NE 2.67Å; E513-R607 PolarHBondContact OE1-NE 3.36Å; E513-R607 IonicContact OE1-NH2 3.38Å; E513-R607 PolarHBondContact OE1-NH2 2.9Å; E513-R607 IonicContact OE2-NH2 3.85Å
514	V	89.4	Confident	86.5	Confident	8 Å²	8	52.9 Å²	52.9	5%	0.048	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	147	174.2	59.8	0	0	0	0	110.7	E527 L604 T605 I606 R607	V514-E527 HydrophobicContact CB-CB 4.25Å; V514-E527 HydrophobicContact CB-CG 4.36Å; V514-E527 HydrophobicContact CG1-CB 4.41Å; V514-E527 HydrophobicContact CG2-CB 4.04Å; V514-E527 HydrophobicContact CG2-CG 4.42Å; V514-L604 HydrophobicContact CB-CD1 4.48Å; V514-L604 HydrophobicContact CG1-CD1 4.03Å; V514-L604 HydrophobicContact CG1-CD2 4.16Å; V514-L604 HydrophobicContact CG1-CG 4.11Å; V514-T605 PolarHBondContact N-O 3.36Å; V514-I606 HydrophobicContact CG1-CB 4.15Å; V514-I606 HydrophobicContact CG1-CG1 3.67Å; V514-I606 HydrophobicContact CG1-CG2 4.25Å; V514-R607 PolarHBondContact O-N 3.12Å
515	H	89.1	Confident	86.6	Confident	90 Å²	90	54.3 Å²	54.3	42%	0.417	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.3	177	-58.4	-33.9	0	0	0	110.9	E513 I617	E513-H515 IonicContact OE1-CE1 3.19Å; E513-H515 PolarHBondContact OE1-CE1 3.01Å; E513-H515 IonicContact OE1-ND1 2.66Å; H515-I617 HydrophobicContact CB-CD1 3.5Å
516	M	89.6	Confident	86.6	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.025	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	138	-174.4	-178.5	-174.5	72.6	0	0	111.1	V520 I526 F557 V571 F576 I606 R607 V608 C609	M516-V520 HydrophobicContact CE-CG1 4.19Å; M516-V520 HydrophobicContact CG-CB 4.27Å; M516-V520 HydrophobicContact CG-CG1 4.11Å; M516-V520 HydrophobicContact CG-CG2 4.42Å; M516-V520 HydrophobicContact SD-CG1 3.85Å; M516-I526 HydrophobicContact CB-CG2 4.49Å; M516-I526 HydrophobicContact CG-CG2 3.81Å; M516-I526 HydrophobicContact SD-CD1 4.12Å; M516-I526 HydrophobicContact SD-CG2 3.81Å; M516-F557 HydrophobicContact CE-CE1 3.97Å; M516-F557 HydrophobicContact CE-CZ 4.03Å; M516-F557 HydrophobicContact SD-CE1 3.75Å; M516-F557 HydrophobicContact SD-CZ 4.37Å; M516-V571 HydrophobicContact SD-CG2 3.67Å; M516-F576 HydrophobicContact CE-CB 4.16Å; M516-F576 HydrophobicContact CE-CD1 3.67Å; M516-F576 HydrophobicContact CE-CD2 3.93Å; M516-F576 HydrophobicContact CE-CE1 3.98Å; M516-F576 HydrophobicContact CE-CE2 4.23Å; M516-F576 HydrophobicContact CE-CG 3.64Å; M516-F576 HydrophobicContact CE-CZ 4.25Å; M516-I606 HydrophobicContact CB-CG2 4.02Å; M516-I606 HydrophobicContact CE-CG2 4.28Å; M516-I606 HydrophobicContact SD-CG2 4.28Å; M516-R607 PolarHBondContact N-O 2.87Å; M516-V608 HydrophobicContact CE-CG2 4.03Å; M516-V608 CarbonylContact O-C 3.58Å; M516-V608 WeakPolarHBondContact O-CA 3.37Å; M516-C609 PolarHBondContact O-N 2.87Å
517	C	86.5	Confident	86.5	Confident	10 Å²	10	56.4 Å²	56.4	7%	0.068	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	139.7	178	-63	0	0	0	0	113.8	N519 V520 C609 C611 D615	C517-N519 WeakPolarHBondContact CB-OD1 3.33Å; C517-N519 PolarHBondContact O-N 2.86Å; C517-V520 VanDerWaalsContact O-CB 3.26Å; C517-V520 WeakPolarHBondContact O-CB 3.3Å; C517-V520 VanDerWaalsContact O-CG1 3.32Å; C517-V520 WeakPolarHBondContact O-CG1 3.45Å; C517-V520 PolarHBondContact O-N 2.83Å; C517-V520 VanDerWaalsContact O-N 3.16Å; C517-C609 WeakPolarHBondContact CA-O 3.3Å; C517-C611 WeakPolarHBondContact CA-SG 3.48Å; C517-C611 HydrophobicContact CB-CB 3.68Å; C517-C611 WeakPolarHBondContact CB-SG 3.35Å; C517-C611 WeakPolarHBondContact SG-CB 3.36Å; C517-C611 CovalentContact SG-SG 2.03Å; C517-C611 PolarHBondContact SG-SG 3.39Å; C517-D615 PolarHBondContact SG-O 3.32Å; C517-D615 VanDerWaalsContact SG-O 3.38Å
518	E	86.1	Confident	86.6	Confident	48 Å²	48	54.5 Å²	54.5	22%	0.224	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-29.6	176.6	63.1	-167.4	154.5	0	0	113.9	V520 V608 C609 S610	E518-V520 VanDerWaalsContact C-N 3.33Å; E518-V520 PolarHBondContact O-N 2.79Å; E518-V608 HydrophobicContact CB-CG1 3.69Å; E518-C609 PolarHBondContact N-O 2.84Å; E518-S610 VanDerWaalsContact OE1-CA 3.28Å; E518-S610 WeakPolarHBondContact OE1-CA 3.35Å; E518-S610 VanDerWaalsContact OE1-CB 3.23Å; E518-S610 WeakPolarHBondContact OE1-CB 3.28Å; E518-S610 PolarHBondContact OE1-OG 2.63Å
519	N	83.3	Confident	86.6	Confident	88 Å²	88	53.9 Å²	53.9	47%	0.471	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	10.7	177.4	66.8	-61.1	0	0	0	114.9	C517 D615	C517-N519 WeakPolarHBondContact CB-OD1 3.33Å; C517-N519 PolarHBondContact O-N 2.86Å; N519-D615 PolarHBondContact ND2-OD1 2.86Å
520	V	85.3	Confident	86.8	Confident	6 Å²	6	53.4 Å²	53.4	4%	0.036	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-55.2	142.5	-172.8	65.1	0	0	0	0	114.3	M516 C517 E518 K524 V571 F576	M516-V520 HydrophobicContact CE-CG1 4.19Å; M516-V520 HydrophobicContact CG-CB 4.27Å; M516-V520 HydrophobicContact CG-CG1 4.11Å; M516-V520 HydrophobicContact CG-CG2 4.42Å; M516-V520 HydrophobicContact SD-CG1 3.85Å; C517-V520 VanDerWaalsContact O-CB 3.26Å; C517-V520 WeakPolarHBondContact O-CB 3.3Å; C517-V520 VanDerWaalsContact O-CG1 3.32Å; C517-V520 WeakPolarHBondContact O-CG1 3.45Å; C517-V520 PolarHBondContact O-N 2.83Å; C517-V520 VanDerWaalsContact O-N 3.16Å; E518-V520 VanDerWaalsContact C-N 3.33Å; E518-V520 PolarHBondContact O-N 2.79Å; V520-K524 HydrophobicContact CG2-CB 4.21Å; V520-K524 HydrophobicContact CG2-CD 3.97Å; V520-V571 HydrophobicContact CG1-CG1 4.09Å; V520-V571 HydrophobicContact CG1-CG2 4.3Å; V520-V571 HydrophobicContact CG2-CG2 3.98Å; V520-F576 HydrophobicContact CG1-CD2 3.95Å; V520-F576 HydrophobicContact CG1-CE2 4.4Å
521	A	84.1	Confident	87.2	Confident	51 Å²	51	50.6 Å²	50.6	42%	0.421	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-84.8	138.3	174.8	0	0	0	0	0	112.1	K524	A521-K524 VanDerWaalsContact O-CB 3.27Å; A521-K524 WeakPolarHBondContact O-CB 3.33Å; A521-K524 PolarHBondContact O-N 3.36Å
522	P	86.8	Confident	87.7	Confident	56 Å²	56	46.8 Å²	46.8	36%	0.364	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	145.8	171.1	-21.2	32.7	0	0	0	111.4	K524 V571 K574	P522-K524 PolarHBondContact O-N 2.88Å; P522-V571 CarbonylContact C-O 3.58Å; P522-V571 WeakPolarHBondContact CA-O 3.44Å; P522-K574 HydrophobicContact CG-CD 4.35Å; P522-K574 HydrophobicContact CG-CG 3.55Å
523	G	83.3	Confident	88	Confident	54 Å²	54	44.4 Å²	44.4	56%	0.557	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	-3.2	-174.8	0	0	0	0	0	114.7	Y570 V571	G523-Y570 WeakPolarHBondContact O-CD1 3.41Å; G523-V571 PolarHBondContact N-O 2.75Å
524	K	87.3	Confident	88	Confident	84 Å²	84	46 Å²	46	37%	0.365	26%	0.264	S	S	.	.			trans	-72.4	136.3	167.3	-159.8	-175.7	-177	-179.2	0	109.2	V520 A521 P522 V571 D615	V520-K524 HydrophobicContact CG2-CB 4.21Å; V520-K524 HydrophobicContact CG2-CD 3.97Å; A521-K524 VanDerWaalsContact O-CB 3.27Å; A521-K524 WeakPolarHBondContact O-CB 3.33Å; A521-K524 PolarHBondContact O-N 3.36Å; P522-K524 PolarHBondContact O-N 2.88Å; K524-V571 PolarHBondContact O-N 2.9Å; K524-D615 IonicContact NZ-OD2 2.88Å; K524-D615 PolarHBondContact NZ-OD2 2.74Å
525	V	89.8	Confident	87.9	Confident	55 Å²	55	45.7 Å²	45.7	33%	0.333	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	135.8	164.9	179.2	0	0	0	0	108.1	E527 I569 Y570	V525-E527 WeakPolarHBondContact CG1-O 3.43Å; V525-I569 CarbonylContact C-O 3.51Å; V525-I569 WeakPolarHBondContact CA-O 3.44Å; V525-Y570 HydrophobicContact CG2-CD1 3.78Å; V525-Y570 HydrophobicContact CG2-CE1 3.31Å; V525-Y570 HydrophobicContact CG2-CE2 4.23Å; V525-Y570 HydrophobicContact CG2-CG 4.43Å
526	I	89.3	Confident	87.4	Confident	29 Å²	29	46.7 Å²	46.7	15%	0.149	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-32.3	176.7	54.1	166.8	0	0	0	113.1	M516 F557 I569 V571 I606	M516-I526 HydrophobicContact CB-CG2 4.49Å; M516-I526 HydrophobicContact CG-CG2 3.81Å; M516-I526 HydrophobicContact SD-CD1 4.12Å; M516-I526 HydrophobicContact SD-CG2 3.81Å; I526-F557 HydrophobicContact CD1-CD1 3.95Å; I526-F557 HydrophobicContact CD1-CE1 3.9Å; I526-I569 HydrophobicContact CD1-CG2 3.86Å; I526-I569 HydrophobicContact CG1-CB 4.08Å; I526-I569 HydrophobicContact CG1-CG2 3.85Å; I526-I569 WeakPolarHBondContact CG1-O 3.38Å; I526-I569 PolarHBondContact N-O 2.88Å; I526-V571 HydrophobicContact CG2-CG2 3.49Å; I526-V571 VanDerWaalsContact CG2-CG2 3.49Å; I526-I606 HydrophobicContact CD1-CD1 3.87Å; I526-I606 HydrophobicContact CD1-CG1 4.18Å; I526-I606 HydrophobicContact CD1-CG2 3.97Å
527	E	89.6	Confident	86.3	Confident	68 Å²	68	49.1 Å²	49.1	32%	0.318	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	153	175.5	-164.9	46.1	-102.1	0	0	109.8	V514 V525 V529 I569	V514-E527 HydrophobicContact CB-CB 4.25Å; V514-E527 HydrophobicContact CB-CG 4.36Å; V514-E527 HydrophobicContact CG1-CB 4.41Å; V514-E527 HydrophobicContact CG2-CB 4.04Å; V514-E527 HydrophobicContact CG2-CG 4.42Å; V525-E527 WeakPolarHBondContact CG1-O 3.43Å; E527-V529 HydrophobicContact CG-CG1 4.05Å; E527-I569 HydrophobicContact CB-CD1 4.44Å; E527-I569 PolarHBondContact O-N 2.99Å
528	T	91.4	Very high	84.8	Confident	62 Å²	62	53.4 Å²	53.4	38%	0.38	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	95.1	167.2	-61.3	0	0	0	0	108.2	A567	T528-A567 CarbonylContact C-O 3.41Å; T528-A567 WeakPolarHBondContact CA-O 3.49Å
529	V	91.1	Very high	83.4	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.018	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	148.4	179.1	-62.5	0	0	0	0	110.7	F508 E527 F545 T566 A567 I569 L604	F508-V529 HydrophobicContact CD1-CB 4.08Å; F508-V529 HydrophobicContact CD1-CG2 4.49Å; F508-V529 HydrophobicContact CE1-CB 3.76Å; F508-V529 HydrophobicContact CE1-CG1 4.09Å; F508-V529 HydrophobicContact CE1-CG2 3.76Å; F508-V529 HydrophobicContact CZ-CB 4.45Å; F508-V529 HydrophobicContact CZ-CG1 4.31Å; F508-V529 HydrophobicContact CZ-CG2 4.41Å; E527-V529 HydrophobicContact CG-CG1 4.05Å; V529-F545 HydrophobicContact CG2-CD1 4.39Å; V529-F545 HydrophobicContact CG2-CE1 4.26Å; V529-T566 CarbonylContact O-C 3.41Å; V529-T566 VanDerWaalsContact O-CA 3.26Å; V529-T566 WeakPolarHBondContact O-CA 3.45Å; V529-T566 WeakPolarHBondContact O-CB 3.4Å; V529-A567 HydrophobicContact CG2-CB 4.05Å; V529-A567 PolarHBondContact N-O 2.81Å; V529-A567 PolarHBondContact O-N 3.06Å; V529-I569 HydrophobicContact CB-CD1 4.36Å; V529-I569 HydrophobicContact CG1-CD1 3.85Å; V529-I569 HydrophobicContact CG2-CD1 3.79Å; V529-L604 HydrophobicContact CG1-CD1 4.39Å; V529-L604 HydrophobicContact CG1-CD2 4.22Å
530	S	90.8	Very high	82.4	Confident	36 Å²	36	65.9 Å²	65.9	25%	0.252	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	161.7	168.8	54.1	0	0	0	0	108.7	A509	A509-S530 WeakPolarHBondContact CB-OG 3.25Å; A509-S530 PolarHBondContact N-O 2.84Å
531	A	88.9	Confident	81.7	Confident	11 Å²	11	68.5 Å²	68.5	9%	0.091	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	161.4	179.1	0	0	0	0	0	111.5	P506 E507 F543 F545 I590	P506-A531 HydrophobicContact CB-CB 4.38Å; E507-A531 CarbonylContact O-C 3.53Å; E507-A531 WeakPolarHBondContact O-CA 3.49Å; E507-A531 VanDerWaalsContact O-CB 3.3Å; E507-A531 WeakPolarHBondContact O-CB 3.45Å; A531-F543 HydrophobicContact CB-CB 4.13Å; A531-F543 HydrophobicContact CB-CD1 4.38Å; A531-F543 HydrophobicContact CB-CD2 3.61Å; A531-F543 HydrophobicContact CB-CE2 4.12Å; A531-F543 HydrophobicContact CB-CG 3.76Å; A531-F543 VanDerWaalsContact O-CE2 3.23Å; A531-F543 WeakPolarHBondContact O-CE2 3.47Å; A531-F545 HydrophobicContact CB-CE1 4.13Å; A531-F545 HydrophobicContact CB-CZ 3.84Å; A531-I590 HydrophobicContact CB-CD1 4.28Å; A531-I590 HydrophobicContact CB-CG2 3.87Å
532	V	88.4	Confident	81.7	Confident	67 Å²	67	69.1 Å²	69.1	41%	0.406	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	150	171.1	-75.8	0	0	0	0	108.6	P506 E507 A509	P506-V532 WeakPolarHBondContact CA-O 3.36Å; E507-V532 HydrophobicContact CG-CG2 3.95Å; E507-V532 PolarHBondContact N-O 2.95Å; E507-V532 PolarHBondContact O-N 2.85Å; A509-V532 HydrophobicContact CB-CG1 3.8Å; A509-V532 HydrophobicContact CB-CG2 4.4Å
533	D	89.5	Confident	81.8	Confident	22 Å²	22	66.8 Å²	66.8	12%	0.118	35%	0.351	C	S	.	.			trans	-135.3	155.7	170.2	-142.5	-34.5	0	0	0	110.1	N504 P506 Q541 F543	N504-D533 WeakPolarHBondContact CB-OD1 2.83Å; P506-D533 VanDerWaalsContact CA-OD2 3.25Å; P506-D533 WeakPolarHBondContact CA-OD2 3.33Å; P506-D533 HydrophobicContact CB-CB 4.39Å; P506-D533 WeakPolarHBondContact CB-OD2 3.38Å; P506-D533 WeakPolarHBondContact CD-OD2 3.13Å; D533-Q541 PolarHBondContact O-NE2 2.89Å; D533-Q541 VanDerWaalsContact O-NE2 3.11Å; D533-F543 HydrophobicContact CB-CE1 3.83Å; D533-F543 HydrophobicContact CB-CZ 3.79Å
534	K	88.1	Confident	82.1	Confident	112 Å²	112	66.9 Å²	66.9	49%	0.487	34%	0.34	S	S	.	.			trans	-85.7	-26.6	-173.1	-53.7	-172.7	-158.3	122.6	0	112.5	R468 E469 N504	R468-K534 PolarHBondContact NH2-O 2.98Å; E469-K534 HydrophobicContact CG-CB 3.61Å; E469-K534 HydrophobicContact CG-CD 4.38Å; N504-K534 HydrophobicContact CB-CB 4.42Å; N504-K534 PolarHBondContact OD1-NZ 3.34Å
535	D	87.8	Confident	82.3	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.011	33%	0.326	C	S	.	.	S	Bend	trans	-71.4	132	-172.5	-56	-3	0	0	0	111.4	D500 N502 D503 N504 M537 Q541	D500-D535 WeakPolarHBondContact OD1-CA 3.03Å; N502-D535 VanDerWaalsContact CA-OD2 3.25Å; N502-D535 WeakPolarHBondContact CA-OD2 3.32Å; D503-D535 PolarHBondContact N-OD2 3.12Å; N504-D535 VanDerWaalsContact CB-OD1 3.27Å; N504-D535 WeakPolarHBondContact CB-OD1 3.31Å; N504-D535 PolarHBondContact N-OD2 3.23Å; N504-D535 VanDerWaalsContact N-OD2 3.08Å; N504-D535 PolarHBondContact ND2-OD1 3Å; D535-M537 VanDerWaalsContact C-N 3.27Å; D535-M537 PolarHBondContact O-N 2.97Å; D535-Q541 PolarHBondContact O-NE2 2.84Å
536	E	78.8	Confident	82.4	Confident	111 Å²	111	63.1 Å²	63.1	52%	0.519	33%	0.325	S	S	.	.			trans	-81.3	63.7	-176.1	-170.1	-170.9	165.5	0	0	112.5	R468 D500 A538	R468-E536 IonicContact CZ-OE2 3.97Å; R468-E536 IonicContact NH1-OE2 2.79Å; R468-E536 PolarHBondContact NH1-OE2 2.95Å; D500-E536 HydrophobicContact CB-CB 4.39Å; D500-E536 PolarHBondContact OD1-N 3.2Å; D500-E536 VanDerWaalsContact OD2-C 3.31Å; D500-E536 PolarHBondContact OD2-N 2.64Å; E536-A538 PolarHBondContact O-N 3.29Å; E536-A538 VanDerWaalsContact O-N 3.16Å
537	M	67	Low	82.5	Confident	57 Å²	57	63.1 Å²	63.1	28%	0.281	33%	0.325	S	S	.	.			trans	-52.7	121	170.1	-78.2	-70.5	161.2	0	0	112	N502 D535 H539 Q541 G594	N502-M537 HydrophobicContact CB-CE 3.75Å; N502-M537 WeakPolarHBondContact OD1-CE 3.35Å; D535-M537 VanDerWaalsContact C-N 3.27Å; D535-M537 PolarHBondContact O-N 2.97Å; M537-H539 CarbonylContact C-O 3.52Å; M537-H539 WeakPolarHBondContact CB-O 3.37Å; M537-H539 PolarHBondContact O-N 2.78Å; M537-H539 VanDerWaalsContact O-O 3.08Å; M537-Q541 HydrophobicContact CB-CG 4Å; M537-Q541 HydrophobicContact CG-CG 4.22Å; M537-G594 VanDerWaalsContact CE-CA 3.48Å
538	A	55.2	Low	82.5	Confident	100 Å²	100	60.1 Å²	60.1	83%	0.826	31%	0.312	S	S	*	.	S	Bend	trans	-63.8	-6.9	178.7	0	0	0	0	0	114.4	E536	E536-A538 PolarHBondContact O-N 3.29Å; E536-A538 VanDerWaalsContact O-N 3.16Å
539	H	56.4	Low	82.2	Confident	161 Å²	161	62 Å²	62	75%	0.745	33%	0.326	S	S	*	.	S	Bend	trans	-129.1	162.4	172.3	-69.5	-7.4	0	0	0	109.1	M537 Q541	M537-H539 CarbonylContact C-O 3.52Å; M537-H539 WeakPolarHBondContact CB-O 3.37Å; M537-H539 PolarHBondContact O-N 2.78Å; M537-H539 VanDerWaalsContact O-O 3.08Å; H539-Q541 PolarHBondContact O-N 2.78Å
540	R	62.8	Low	81.9	Confident	236 Å²	236	70.7 Å²	70.7	89%	0.891	37%	0.366	S	S	*	.			trans	-51.8	116.8	179.6	-84.8	-178.8	-83.1	179.4	-6	111.1	H542	R540-H542 PolarHBondContact O-N 3.45Å
541	Q	70.3	Confident	81.7	Confident	62 Å²	62	70.4 Å²	70.4	29%	0.29	36%	0.363	S	S	.	.			trans	-47.9	129.3	166.7	-68	172.3	-16.9	0	0	109	D533 D535 M537 H539 F543 S565	D533-Q541 PolarHBondContact O-NE2 2.89Å; D533-Q541 VanDerWaalsContact O-NE2 3.11Å; D535-Q541 PolarHBondContact O-NE2 2.84Å; M537-Q541 HydrophobicContact CB-CG 4Å; M537-Q541 HydrophobicContact CG-CG 4.22Å; H539-Q541 PolarHBondContact O-N 2.78Å; Q541-F543 HydrophobicContact CB-CE1 4.24Å; Q541-F543 HydrophobicContact CB-CE2 4.15Å; Q541-F543 HydrophobicContact CB-CZ 3.7Å; Q541-F543 HydrophobicContact CG-CZ 4.26Å; Q541-S565 PolarHBondContact O-OG 3.39Å
542	H	83.2	Confident	81.3	Confident	64 Å²	64	72.4 Å²	72.4	30%	0.296	38%	0.379	S	S	.	.			trans	-128.2	107.7	178.2	-174.1	39	0	0	0	111.1	R540 S565 D592 N593	R540-H542 PolarHBondContact O-N 3.45Å; H542-S565 WeakPolarHBondContact CA-OG 3.5Å; H542-S565 PolarHBondContact ND1-OG 3.09Å; H542-D592 CarbonylContact O-C 3.54Å; H542-N593 HydrophobicContact CB-CB 4.29Å; H542-N593 PolarHBondContact N-OD1 3.21Å; H542-N593 PolarHBondContact O-N 3.31Å; H542-N593 PolarHBondContact O-OD1 2.75Å
543	F	88.9	Confident	80.9	Confident	7 Å²	7	77.8 Å²	77.8	3%	0.031	40%	0.399	C	S	.	.			trans	-90.2	132.9	179.4	-50.7	-59.2	0	0	0	110.3	P506 A531 D533 Q541 F545 S565 I590 D592	P506-F543 HydrophobicContact CB-CD1 3.64Å; P506-F543 HydrophobicContact CB-CE1 3.62Å; P506-F543 HydrophobicContact CB-CG 4.5Å; P506-F543 HydrophobicContact CB-CZ 4.45Å; P506-F543 HydrophobicContact CG-CD1 4.13Å; P506-F543 HydrophobicContact CG-CE1 4.4Å; A531-F543 HydrophobicContact CB-CB 4.13Å; A531-F543 HydrophobicContact CB-CD1 4.38Å; A531-F543 HydrophobicContact CB-CD2 3.61Å; A531-F543 HydrophobicContact CB-CE2 4.12Å; A531-F543 HydrophobicContact CB-CG 3.76Å; A531-F543 VanDerWaalsContact O-CE2 3.23Å; A531-F543 WeakPolarHBondContact O-CE2 3.47Å; D533-F543 HydrophobicContact CB-CE1 3.83Å; D533-F543 HydrophobicContact CB-CZ 3.79Å; Q541-F543 HydrophobicContact CB-CE1 4.24Å; Q541-F543 HydrophobicContact CB-CE2 4.15Å; Q541-F543 HydrophobicContact CB-CZ 3.7Å; Q541-F543 HydrophobicContact CG-CZ 4.26Å; F543-F545 HydrophobicContact CB-CE2 3.74Å; F543-F545 HydrophobicContact CB-CZ 3.9Å; F543-S565 PolarHBondContact N-OG 2.78Å; F543-I590 HydrophobicContact CB-CG2 4.11Å; F543-D592 HydrophobicContact CD1-CB 4.44Å; F543-D592 HydrophobicContact CE1-CB 4.49Å
544	T	90.4	Very high	80.7	Confident	56 Å²	56	78.2 Å²	78.2	34%	0.344	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	141.7	172.3	57.6	0	0	0	0	109.7	D561 N591	T544-D561 WeakPolarHBondContact CA-OD2 3.27Å; T544-N591 PolarHBondContact N-O 3.08Å; T544-N591 PolarHBondContact O-N 3.02Å; T544-N591 PolarHBondContact OG1-O 2.97Å; T544-N591 VanDerWaalsContact OG1-O 3.11Å
545	F	91.9	Very high	80.6	Confident	14 Å²	14	80.5 Å²	80.5	6%	0.061	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	124.9	-170.1	-62.9	-96.9	0	0	0	112.1	F508 V529 A531 F543 L559 D561 A567 I588 E589 I590	F508-F545 HydrophobicContact CE1-CE1 4.43Å; V529-F545 HydrophobicContact CG2-CD1 4.39Å; V529-F545 HydrophobicContact CG2-CE1 4.26Å; A531-F545 HydrophobicContact CB-CE1 4.13Å; A531-F545 HydrophobicContact CB-CZ 3.84Å; F543-F545 HydrophobicContact CB-CE2 3.74Å; F543-F545 HydrophobicContact CB-CZ 3.9Å; F545-L559 HydrophobicContact CB-CD1 4.19Å; F545-L559 HydrophobicContact CB-CD2 3.83Å; F545-L559 VanDerWaalsContact O-CD2 3.25Å; F545-L559 WeakPolarHBondContact O-CD2 3.33Å; F545-D561 PolarHBondContact N-OD2 3.06Å; F545-A567 HydrophobicContact CB-CB 3.63Å; F545-A567 HydrophobicContact CD1-CB 4.03Å; F545-A567 HydrophobicContact CD2-CB 3.83Å; F545-A567 HydrophobicContact CE2-CB 4.49Å; F545-A567 HydrophobicContact CG-CB 3.57Å; F545-I588 HydrophobicContact CD1-CG2 4.08Å; F545-E589 WeakPolarHBondContact CA-O 3.17Å; F545-I590 HydrophobicContact CD1-CG1 4.04Å; F545-I590 HydrophobicContact CD1-CG2 4.18Å; F545-I590 HydrophobicContact CE1-CD1 4.18Å; F545-I590 HydrophobicContact CE1-CG1 4.05Å; F545-I590 HydrophobicContact CE1-CG2 3.86Å; F545-I590 HydrophobicContact CZ-CG2 4.28Å
546	S	91.6	Very high	80.6	Confident	45 Å²	45	81.7 Å²	81.7	32%	0.315	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	155.7	173.8	31.9	0	0	0	0	111.5	I588 E589	S546-I588 CarbonylContact O-C 3.58Å; S546-I588 WeakPolarHBondContact O-CA 3.29Å; S546-E589 PolarHBondContact N-O 2.86Å; S546-E589 PolarHBondContact O-N 2.86Å; S546-E589 WeakPolarHBondContact OG-CB 3.13Å; S546-E589 PolarHBondContact OG-OE2 2.85Å
547	L	90.9	Very high	81.2	Confident	29 Å²	29	76.5 Å²	76.5	15%	0.152	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	130.7	158	-73.2	-173.5	0	0	0	107.8	V551 N554 L559 L586 I588	L547-V551 HydrophobicContact CB-CG2 4.23Å; L547-N554 HydrophobicContact CD1-CB 4.44Å; L547-L559 HydrophobicContact CD2-CB 3.71Å; L547-L559 HydrophobicContact CD2-CD1 4.5Å; L547-L559 HydrophobicContact CG-CB 3.89Å; L547-L586 HydrophobicContact CD2-CD1 3.71Å; L547-L586 HydrophobicContact CD2-CD2 4.24Å; L547-L586 HydrophobicContact CD2-CG 3.99Å; L547-I588 HydrophobicContact CD2-CG1 4.3Å
548	A	89.1	Confident	82.3	Confident	6 Å²	6	75.6 Å²	75.6	5%	0.05	40%	0.396	C	S	.	.			trans	-56.4	148.9	-179.9	0	0	0	0	0	111	E550 V551 A552 P587 T601	A548-E550 PolarHBondContact O-N 3.03Å; A548-V551 HydrophobicContact CB-CG2 4.45Å; A548-V551 CarbonylContact O-C 3.55Å; A548-V551 WeakPolarHBondContact O-CG2 3.19Å; A548-V551 PolarHBondContact O-N 3.05Å; A548-A552 PolarHBondContact O-N 2.74Å; A548-A552 VanDerWaalsContact O-N 3.1Å; A548-P587 HydrophobicContact CB-CB 3.91Å; A548-P587 HydrophobicContact CB-CG 4.2Å; A548-P587 WeakPolarHBondContact CB-O 3.07Å; A548-P587 PolarHBondContact N-O 2.84Å; A548-P587 VanDerWaalsContact N-O 3.1Å; A548-T601 HydrophobicContact CB-CG2 4.01Å
549	P	85.7	Confident	84	Confident	102 Å²	102	72.3 Å²	72.3	66%	0.662	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-52.2	-33.9	-170.1	-31.2	36.2	0	0	0	115.4	V551	P549-V551 VanDerWaalsContact C-N 3.26Å; P549-V551 PolarHBondContact O-N 2.74Å
550	E	85.2	Confident	85.7	Confident	185 Å²	185	69.5 Å²	69.5	86%	0.864	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-62.2	-29.8	176.8	-56.8	-173.2	169.6	0	0	113.7	A548	A548-E550 PolarHBondContact O-N 3.03Å
551	V	86	Confident	87	Confident	29 Å²	29	60.1 Å²	60.1	18%	0.176	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-118.2	12.3	-176.6	-57.7	0	0	0	0	113.2	L547 A548 P549 H553 N554 L586 P587	L547-V551 HydrophobicContact CB-CG2 4.23Å; A548-V551 HydrophobicContact CB-CG2 4.45Å; A548-V551 CarbonylContact O-C 3.55Å; A548-V551 WeakPolarHBondContact O-CG2 3.19Å; A548-V551 PolarHBondContact O-N 3.05Å; P549-V551 VanDerWaalsContact C-N 3.26Å; P549-V551 PolarHBondContact O-N 2.74Å; V551-H553 PolarHBondContact O-N 2.99Å; V551-N554 HydrophobicContact CB-CB 4.45Å; V551-N554 VanDerWaalsContact O-CB 3.25Å; V551-N554 WeakPolarHBondContact O-CB 3.49Å; V551-N554 PolarHBondContact O-N 3.13Å; V551-L586 HydrophobicContact CG2-CD1 4.45Å; V551-P587 HydrophobicContact CG1-CG 3.94Å; V551-P587 HydrophobicContact CG2-CG 3.77Å; V551-P587 WeakPolarHBondContact CG2-O 3.3Å
552	A	79.3	Confident	87.9	Confident	53 Å²	53	59.1 Å²	59.1	44%	0.438	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-21.2	179	0	0	0	0	0	114.3	A548	A548-A552 PolarHBondContact O-N 2.74Å; A548-A552 VanDerWaalsContact O-N 3.1Å
553	H	81.6	Confident	87.9	Confident	180 Å²	180	66.3 Å²	66.3	83%	0.833	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	33.9	175.9	-65.8	84.1	0	0	0	112.9	V551 Q555	V551-H553 PolarHBondContact O-N 2.99Å; H553-Q555 PolarHBondContact O-N 2.92Å
554	N	84.8	Confident	87.7	Confident	32 Å²	32	70.7 Å²	70.7	17%	0.171	36%	0.362	C	S	.	.			trans	-60.1	129.2	179.7	-167.8	-29	0	0	0	111.9	L547 V551 N556 F557 L572 L586	L547-N554 HydrophobicContact CD1-CB 4.44Å; V551-N554 HydrophobicContact CB-CB 4.45Å; V551-N554 VanDerWaalsContact O-CB 3.25Å; V551-N554 WeakPolarHBondContact O-CB 3.49Å; V551-N554 PolarHBondContact O-N 3.13Å; N554-N556 VanDerWaalsContact OD1-CB 3.29Å; N554-N556 WeakPolarHBondContact OD1-CB 3.35Å; N554-N556 PolarHBondContact OD1-N 2.73Å; N554-F557 WeakPolarHBondContact CB-O 3.24Å; N554-F557 PolarHBondContact OD1-N 3.04Å; N554-L572 VanDerWaalsContact O-CD1 3.27Å; N554-L572 WeakPolarHBondContact O-CD1 3.01Å; N554-L586 VanDerWaalsContact ND2-CD1 3.32Å; N554-L586 WeakPolarHBondContact ND2-CD1 3.48Å
555	Q	85	Confident	87.5	Confident	160 Å²	160	69.2 Å²	69.2	75%	0.748	35%	0.354	S	S	*	.	S	Bend	trans	-90.2	-5.8	-179.1	-60.6	-177.5	9.6	0	0	113.6	H553	H553-Q555 PolarHBondContact O-N 2.92Å
556	N	88.1	Confident	87.4	Confident	27 Å²	27	70 Å²	70	14%	0.144	36%	0.36	C	S	.	.	S	Bend	trans	-101.4	-42.9	-173.5	-52.9	-20.8	0	0	0	110.8	N554 L572 R573 F576 Y584	N554-N556 VanDerWaalsContact OD1-CB 3.29Å; N554-N556 WeakPolarHBondContact OD1-CB 3.35Å; N554-N556 PolarHBondContact OD1-N 2.73Å; N556-L572 PolarHBondContact O-N 2.9Å; N556-R573 WeakPolarHBondContact OD1-CD 3.39Å; N556-R573 PolarHBondContact OD1-NE 2.9Å; N556-R573 VanDerWaalsContact OD1-NE 3.1Å; N556-R573 PolarHBondContact OD1-NH1 2.95Å; N556-F576 HydrophobicContact CB-CE1 4.14Å; N556-F576 HydrophobicContact CB-CZ 4.02Å; N556-Y584 WeakPolarHBondContact ND2-CE1 3.29Å
557	F	91.3	Very high	87.4	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.009	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	149.1	-174.5	-51.1	-72.4	0	0	0	110.9	M516 I526 N554 I569 Y570 V571 F576 Y584 L586 I606	M516-F557 HydrophobicContact CE-CE1 3.97Å; M516-F557 HydrophobicContact CE-CZ 4.03Å; M516-F557 HydrophobicContact SD-CE1 3.75Å; M516-F557 HydrophobicContact SD-CZ 4.37Å; I526-F557 HydrophobicContact CD1-CD1 3.95Å; I526-F557 HydrophobicContact CD1-CE1 3.9Å; N554-F557 WeakPolarHBondContact CB-O 3.24Å; N554-F557 PolarHBondContact OD1-N 3.04Å; F557-I569 HydrophobicContact CB-CG2 4.28Å; F557-Y570 CarbonylContact C-O 3.57Å; F557-Y570 VanDerWaalsContact CA-O 3.22Å; F557-Y570 WeakPolarHBondContact CA-O 3.34Å; F557-V571 HydrophobicContact CD1-CG2 4.35Å; F557-V571 HydrophobicContact CE1-CG2 4.31Å; F557-F576 HydrophobicContact CE1-CE1 4.11Å; F557-F576 AromaticContact CE1-CZ 3.93Å; F557-F576 HydrophobicContact CE1-CZ 3.93Å; F557-F576 HydrophobicContact CE2-CE1 4.22Å; F557-F576 HydrophobicContact CZ-CD1 4.49Å; F557-F576 AromaticContact CZ-CE1 3.58Å; F557-F576 HydrophobicContact CZ-CE1 3.58Å; F557-F576 AromaticContact CZ-CZ 3.87Å; F557-F576 HydrophobicContact CZ-CZ 3.87Å; F557-Y584 AromaticContact CE2-CD1 3.92Å; F557-Y584 HydrophobicContact CE2-CD1 3.92Å; F557-Y584 AromaticContact CE2-CG 3.84Å; F557-Y584 HydrophobicContact CE2-CG 3.84Å; F557-Y584 HydrophobicContact CZ-CG 4.22Å; F557-L586 HydrophobicContact CB-CD1 4.39Å; F557-L586 HydrophobicContact CB-CD2 4.16Å; F557-I606 HydrophobicContact CD1-CD1 4.01Å; F557-I606 HydrophobicContact CD2-CD1 3.75Å; F557-I606 HydrophobicContact CE1-CD1 3.93Å; F557-I606 HydrophobicContact CE1-CG2 4.2Å; F557-I606 HydrophobicContact CE2-CD1 3.66Å; F557-I606 HydrophobicContact CG-CD1 3.93Å; F557-I606 HydrophobicContact CZ-CB 4.36Å; F557-I606 HydrophobicContact CZ-CD1 3.76Å; F557-I606 HydrophobicContact CZ-CG2 3.91Å
558	S	90.6	Very high	87.4	Confident	38 Å²	38	66.9 Å²	66.9	27%	0.266	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	151.2	164.5	56.5	0	0	0	0	110.5	Y570	S558-Y570 PolarHBondContact N-O 3.24Å; S558-Y570 PolarHBondContact O-N 2.77Å
559	L	92	Very high	87.6	Confident	30 Å²	30	66.6 Å²	66.6	16%	0.157	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	145	169.9	-178.6	146.5	0	0	0	109.4	F545 L547 A567 I588	F545-L559 HydrophobicContact CB-CD1 4.19Å; F545-L559 HydrophobicContact CB-CD2 3.83Å; F545-L559 VanDerWaalsContact O-CD2 3.25Å; F545-L559 WeakPolarHBondContact O-CD2 3.33Å; L547-L559 HydrophobicContact CD2-CB 3.71Å; L547-L559 HydrophobicContact CD2-CD1 4.5Å; L547-L559 HydrophobicContact CG-CB 3.89Å; L559-A567 HydrophobicContact CD1-CB 3.99Å; L559-A567 HydrophobicContact CD2-CB 4.02Å; L559-A567 HydrophobicContact CG-CB 3.98Å; L559-I588 HydrophobicContact CD1-CB 4.33Å; L559-I588 HydrophobicContact CD1-CD1 3.76Å; L559-I588 HydrophobicContact CD1-CG1 3.74Å; L559-I588 HydrophobicContact CD1-CG2 3.66Å
560	K	91.4	Very high	87.9	Confident	103 Å²	103	64.7 Å²	64.7	45%	0.448	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	114.4	168.4	-179.9	-159.7	157.8	-114.1	0	109	N562 A567 S568 Y570	K560-N562 PolarHBondContact NZ-OD1 3.28Å; K560-N562 PolarHBondContact O-N 2.84Å; K560-A567 WeakPolarHBondContact O-CA 3.34Å; K560-S568 PolarHBondContact N-O 3.08Å; K560-S568 PolarHBondContact O-N 3.12Å; K560-Y570 HydrophobicContact CB-CD2 4.17Å; K560-Y570 HydrophobicContact CB-CE2 3.73Å; K560-Y570 HydrophobicContact CD-CE2 3.95Å; K560-Y570 HydrophobicContact CG-CE2 4.49Å
561	D	90.1	Very high	88.1	Confident	39 Å²	39	55.9 Å²	55.9	21%	0.209	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	126.9	165.6	-167.9	-45.1	0	0	0	110	T544 F545 R563	T544-D561 WeakPolarHBondContact CA-OD2 3.27Å; F545-D561 PolarHBondContact N-OD2 3.06Å; D561-R563 WeakPolarHBondContact OD1-CA 3.2Å; D561-R563 PolarHBondContact OD1-N 3.37Å
562	N	89.6	Confident	88.2	Confident	40 Å²	40	58.6 Å²	58.6	21%	0.214	29%	0.29	C	S	.	.			trans	-87.2	-10.9	-179.7	-67.7	-33.7	0	0	0	113	K560 D564 T566 S568	K560-N562 PolarHBondContact NZ-OD1 3.28Å; K560-N562 PolarHBondContact O-N 2.84Å; N562-D564 VanDerWaalsContact C-N 3.28Å; N562-D564 WeakPolarHBondContact CB-OD1 3.37Å; N562-T566 WeakPolarHBondContact CB-O 3.32Å; N562-T566 PolarHBondContact N-O 3.47Å; N562-T566 PolarHBondContact ND2-OG1 3.28Å; N562-S568 VanDerWaalsContact CG-OG 3.3Å; N562-S568 PolarHBondContact ND2-OG 3.38Å; N562-S568 PolarHBondContact OD1-OG 3.27Å
563	R	83.3	Confident	88.6	Confident	215 Å²	215	60.4 Å²	60.4	81%	0.811	29%	0.286	S	S	*	.	S	Bend	trans	65.1	23.2	-175.8	-53.1	-178.1	178.1	-171	-3.5	115.2	D561	D561-R563 WeakPolarHBondContact OD1-CA 3.2Å; D561-R563 PolarHBondContact OD1-N 3.37Å
564	D	84.9	Confident	88.6	Confident	99 Å²	99	59.2 Å²	59.2	53%	0.529	28%	0.278	S	S	.	.	S	Bend	trans	-123.4	22.9	176.2	59	10.7	0	0	0	112	N562 T566	N562-D564 VanDerWaalsContact C-N 3.28Å; N562-D564 WeakPolarHBondContact CB-OD1 3.37Å; D564-T566 PolarHBondContact O-N 2.89Å; D564-T566 WeakPolarHBondContact OD1-CB 3.33Å; D564-T566 PolarHBondContact OD1-N 2.8Å; D564-T566 PolarHBondContact OD1-OG1 3.37Å
565	S	84.6	Confident	88.4	Confident	25 Å²	25	60.7 Å²	60.7	18%	0.175	30%	0.301	C	S	.	.	S	Bend	trans	65.9	21.1	-170.6	-52.9	0	0	0	0	114.5	Q541 H542 F543	Q541-S565 PolarHBondContact O-OG 3.39Å; H542-S565 WeakPolarHBondContact CA-OG 3.5Å; H542-S565 PolarHBondContact ND1-OG 3.09Å; F543-S565 PolarHBondContact N-OG 2.78Å
566	T	89.9	Confident	88.4	Confident	30 Å²	30	53.4 Å²	53.4	18%	0.184	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	159.7	168.2	79.3	0	0	0	0	112	V529 N562 D564	V529-T566 CarbonylContact O-C 3.41Å; V529-T566 VanDerWaalsContact O-CA 3.26Å; V529-T566 WeakPolarHBondContact O-CA 3.45Å; V529-T566 WeakPolarHBondContact O-CB 3.4Å; N562-T566 WeakPolarHBondContact CB-O 3.32Å; N562-T566 PolarHBondContact N-O 3.47Å; N562-T566 PolarHBondContact ND2-OG1 3.28Å; D564-T566 PolarHBondContact O-N 2.89Å; D564-T566 WeakPolarHBondContact OD1-CB 3.33Å; D564-T566 PolarHBondContact OD1-N 2.8Å; D564-T566 PolarHBondContact OD1-OG1 3.37Å
567	A	91.5	Very high	88.1	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	133.2	173.2	0	0	0	0	0	111.9	T528 V529 F545 L559 K560	T528-A567 CarbonylContact C-O 3.41Å; T528-A567 WeakPolarHBondContact CA-O 3.49Å; V529-A567 HydrophobicContact CG2-CB 4.05Å; V529-A567 PolarHBondContact N-O 2.81Å; V529-A567 PolarHBondContact O-N 3.06Å; F545-A567 HydrophobicContact CB-CB 3.63Å; F545-A567 HydrophobicContact CD1-CB 4.03Å; F545-A567 HydrophobicContact CD2-CB 3.83Å; F545-A567 HydrophobicContact CE2-CB 4.49Å; F545-A567 HydrophobicContact CG-CB 3.57Å; L559-A567 HydrophobicContact CD1-CB 3.99Å; L559-A567 HydrophobicContact CD2-CB 4.02Å; L559-A567 HydrophobicContact CG-CB 3.98Å; K560-A567 WeakPolarHBondContact O-CA 3.34Å
568	S	92.6	Very high	87.6	Confident	9 Å²	9	56.5 Å²	56.5	6%	0.063	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	126.9	177.8	-50.6	0	0	0	0	110.3	K560 N562	K560-S568 PolarHBondContact N-O 3.08Å; K560-S568 PolarHBondContact O-N 3.12Å; N562-S568 VanDerWaalsContact CG-OG 3.3Å; N562-S568 PolarHBondContact ND2-OG 3.38Å; N562-S568 PolarHBondContact OD1-OG 3.27Å
569	I	92.3	Very high	86.9	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	125.4	173.6	-61.8	78.3	0	0	0	109.1	V525 I526 E527 V529 F557 L586 I588 L604	V525-I569 CarbonylContact C-O 3.51Å; V525-I569 WeakPolarHBondContact CA-O 3.44Å; I526-I569 HydrophobicContact CD1-CG2 3.86Å; I526-I569 HydrophobicContact CG1-CB 4.08Å; I526-I569 HydrophobicContact CG1-CG2 3.85Å; I526-I569 WeakPolarHBondContact CG1-O 3.38Å; I526-I569 PolarHBondContact N-O 2.88Å; E527-I569 HydrophobicContact CB-CD1 4.44Å; E527-I569 PolarHBondContact O-N 2.99Å; V529-I569 HydrophobicContact CB-CD1 4.36Å; V529-I569 HydrophobicContact CG1-CD1 3.85Å; V529-I569 HydrophobicContact CG2-CD1 3.79Å; F557-I569 HydrophobicContact CB-CG2 4.28Å; I569-L586 HydrophobicContact CG1-CD2 4.22Å; I569-L586 HydrophobicContact CG2-CD2 3.8Å; I569-I588 HydrophobicContact CD1-CD1 4.27Å; I569-I588 HydrophobicContact CG1-CD1 4.19Å; I569-L604 HydrophobicContact CD1-CD2 3.93Å; I569-L604 HydrophobicContact CG1-CD2 3.9Å
570	Y	91.3	Very high	86.4	Confident	62 Å²	62	65.6 Å²	65.6	24%	0.243	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	148.3	-177.9	-69.1	-93.5	0	0	0	112.2	G523 V525 F557 S558 K560	G523-Y570 WeakPolarHBondContact O-CD1 3.41Å; V525-Y570 HydrophobicContact CG2-CD1 3.78Å; V525-Y570 HydrophobicContact CG2-CE1 3.31Å; V525-Y570 HydrophobicContact CG2-CE2 4.23Å; V525-Y570 HydrophobicContact CG2-CG 4.43Å; F557-Y570 CarbonylContact C-O 3.57Å; F557-Y570 VanDerWaalsContact CA-O 3.22Å; F557-Y570 WeakPolarHBondContact CA-O 3.34Å; S558-Y570 PolarHBondContact N-O 3.24Å; S558-Y570 PolarHBondContact O-N 2.77Å; K560-Y570 HydrophobicContact CB-CD2 4.17Å; K560-Y570 HydrophobicContact CB-CE2 3.73Å; K560-Y570 HydrophobicContact CD-CE2 3.95Å; K560-Y570 HydrophobicContact CG-CE2 4.49Å
571	V	90.6	Very high	86	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.006	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	130.4	172.9	-175.7	0	0	0	0	111.2	M516 V520 P522 G523 K524 I526 F557 R573 F576	M516-V571 HydrophobicContact SD-CG2 3.67Å; V520-V571 HydrophobicContact CG1-CG1 4.09Å; V520-V571 HydrophobicContact CG1-CG2 4.3Å; V520-V571 HydrophobicContact CG2-CG2 3.98Å; P522-V571 CarbonylContact C-O 3.58Å; P522-V571 WeakPolarHBondContact CA-O 3.44Å; G523-V571 PolarHBondContact N-O 2.75Å; K524-V571 PolarHBondContact O-N 2.9Å; I526-V571 HydrophobicContact CG2-CG2 3.49Å; I526-V571 VanDerWaalsContact CG2-CG2 3.49Å; F557-V571 HydrophobicContact CD1-CG2 4.35Å; F557-V571 HydrophobicContact CE1-CG2 4.31Å; V571-R573 VanDerWaalsContact CG1-O 3.3Å; V571-R573 WeakPolarHBondContact CG1-O 3.28Å; V571-F576 HydrophobicContact CG1-CD2 4.42Å; V571-F576 HydrophobicContact CG1-CE2 3.5Å; V571-F576 VanDerWaalsContact CG1-CE2 3.5Å; V571-F576 HydrophobicContact CG1-CZ 4.1Å
572	L	88.4	Confident	85.7	Confident	86 Å²	86	65.8 Å²	65.8	45%	0.45	33%	0.334	S	S	.	.			trans	-95.9	-30.3	-179.7	-67	177.6	0	0	0	114.4	N554 N556	N554-L572 VanDerWaalsContact O-CD1 3.27Å; N554-L572 WeakPolarHBondContact O-CD1 3.01Å; N556-L572 PolarHBondContact O-N 2.9Å
573	R	86.3	Confident	85.7	Confident	90 Å²	90	64.7 Å²	64.7	34%	0.34	33%	0.328	S	S	.	.			trans	-121.8	170.5	-172.4	76	-179	-168.1	175.9	1.6	113.7	N556 V571 F576 Y584	N556-R573 WeakPolarHBondContact OD1-CD 3.39Å; N556-R573 PolarHBondContact OD1-NE 2.9Å; N556-R573 VanDerWaalsContact OD1-NE 3.1Å; N556-R573 PolarHBondContact OD1-NH1 2.95Å; V571-R573 VanDerWaalsContact CG1-O 3.3Å; V571-R573 WeakPolarHBondContact CG1-O 3.28Å; R573-F576 HydrophobicContact CG-CE2 3.63Å; R573-F576 HydrophobicContact CG-CZ 3.68Å; R573-F576 WeakPolarHBondContact O-CE2 3.37Å; R573-Y584 PolarHBondContact NH2-OH 3.14Å
574	K	81.5	Confident	86	Confident	156 Å²	156	54.9 Å²	54.9	68%	0.678	29%	0.291	S	S	*	.	S	Bend	trans	-105.3	167.7	167.4	-70.2	-171.8	177.3	-175.2	0	110.5	P522	P522-K574 HydrophobicContact CG-CD 4.35Å; P522-K574 HydrophobicContact CG-CG 3.55Å
575	G	80.8	Confident	86.3	Confident	63 Å²	63	57.2 Å²	57.2	65%	0.649	29%	0.294	S	S	*	.			trans	84.9	33.7	171	0	0	0	0	0	114.4
576	F	85.8	Confident	86.6	Confident	7 Å²	7	56 Å²	56	3%	0.031	29%	0.286	C	S	.	.			trans	-67.2	143.4	161.7	-65.2	-89	0	0	0	108.9	M516 V520 N556 F557 V571 R573 Y584 V608	M516-F576 HydrophobicContact CE-CB 4.16Å; M516-F576 HydrophobicContact CE-CD1 3.67Å; M516-F576 HydrophobicContact CE-CD2 3.93Å; M516-F576 HydrophobicContact CE-CE1 3.98Å; M516-F576 HydrophobicContact CE-CE2 4.23Å; M516-F576 HydrophobicContact CE-CG 3.64Å; M516-F576 HydrophobicContact CE-CZ 4.25Å; V520-F576 HydrophobicContact CG1-CD2 3.95Å; V520-F576 HydrophobicContact CG1-CE2 4.4Å; N556-F576 HydrophobicContact CB-CE1 4.14Å; N556-F576 HydrophobicContact CB-CZ 4.02Å; F557-F576 HydrophobicContact CE1-CE1 4.11Å; F557-F576 AromaticContact CE1-CZ 3.93Å; F557-F576 HydrophobicContact CE1-CZ 3.93Å; F557-F576 HydrophobicContact CE2-CE1 4.22Å; F557-F576 HydrophobicContact CZ-CD1 4.49Å; F557-F576 AromaticContact CZ-CE1 3.58Å; F557-F576 HydrophobicContact CZ-CE1 3.58Å; F557-F576 AromaticContact CZ-CZ 3.87Å; F557-F576 HydrophobicContact CZ-CZ 3.87Å; V571-F576 HydrophobicContact CG1-CD2 4.42Å; V571-F576 HydrophobicContact CG1-CE2 3.5Å; V571-F576 VanDerWaalsContact CG1-CE2 3.5Å; V571-F576 HydrophobicContact CG1-CZ 4.1Å; R573-F576 HydrophobicContact CG-CE2 3.63Å; R573-F576 HydrophobicContact CG-CZ 3.68Å; R573-F576 WeakPolarHBondContact O-CE2 3.37Å; F576-Y584 HydrophobicContact CD1-CD2 4.46Å; F576-Y584 HydrophobicContact CD1-CE1 4.4Å; F576-Y584 AromaticContact CD1-CE2 3.69Å; F576-Y584 HydrophobicContact CD1-CE2 3.69Å; F576-Y584 AromaticContact CD1-CZ 3.63Å; F576-Y584 HydrophobicContact CE1-CE1 4.09Å; F576-Y584 HydrophobicContact CE1-CE2 4.07Å; F576-Y584 AromaticContact CE1-CZ 3.78Å; F576-V608 HydrophobicContact CB-CG1 4.12Å; F576-V608 HydrophobicContact CB-CG2 4.17Å; F576-V608 HydrophobicContact CD1-CG2 4.28Å
577	S	81.4	Confident	86.7	Confident	30 Å²	30	55.5 Å²	55.5	21%	0.21	28%	0.283	C	S	.	.			trans	-152.8	130.9	172.7	-177.2	0	0	0	0	110.1	L579 T580 Q581	S577-L579 PolarHBondContact O-N 2.88Å; S577-L579 PolarHBondContact OG-N 3.29Å; S577-T580 PolarHBondContact O-N 3.3Å; S577-T580 PolarHBondContact O-OG1 3.4Å; S577-Q581 CarbonylContact O-C 3.55Å; S577-Q581 PolarHBondContact O-N 3.24Å; S577-Q581 VanDerWaalsContact O-O 3.11Å
578	R	80.1	Confident	86.7	Confident	64 Å²	64	55.5 Å²	55.5	24%	0.242	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-11	174.7	64.3	180	173.3	140.9	-2.8	114.2	D582 V608 S610 N621 V622	R578-D582 HydrophobicContact CB-CB 4.37Å; R578-V608 HydrophobicContact CB-CG1 4.42Å; R578-V608 WeakPolarHBondContact CB-O 3.31Å; R578-S610 PolarHBondContact NH2-OG 2.87Å; R578-N621 PolarHBondContact NH1-O 3Å; R578-V622 HydrophobicContact CB-CG2 4.28Å; R578-V622 VanDerWaalsContact O-CG2 3.29Å; R578-V622 WeakPolarHBondContact O-CG2 3.28Å
579	L	75.9	Confident	86.7	Confident	140 Å²	140	57.8 Å²	57.8	73%	0.733	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-14.3	175.8	-60.9	178	0	0	0	113.6	S577	S577-L579 PolarHBondContact O-N 2.88Å; S577-L579 PolarHBondContact OG-N 3.29Å
580	T	82.1	Confident	86.7	Confident	118 Å²	118	57.8 Å²	57.8	72%	0.724	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.9	-38.2	178.8	57.1	0	0	0	0	112.5	S577	S577-T580 PolarHBondContact O-N 3.3Å; S577-T580 PolarHBondContact O-OG1 3.4Å
581	Q	83.4	Confident	86.6	Confident	81 Å²	81	57 Å²	57	38%	0.379	29%	0.292	S	S	.	.			trans	-156.6	110.6	169.2	-177.8	171.7	1.6	0	0	109	S577 V583 Y584	S577-Q581 CarbonylContact O-C 3.55Å; S577-Q581 PolarHBondContact O-N 3.24Å; S577-Q581 VanDerWaalsContact O-O 3.11Å; Q581-V583 VanDerWaalsContact CG-O 3.28Å; Q581-V583 WeakPolarHBondContact CG-O 3.11Å; Q581-V583 PolarHBondContact NE2-O 3.32Å; Q581-Y584 HydrophobicContact CB-CE2 4.02Å; Q581-Y584 VanDerWaalsContact CD-CZ 3.45Å; Q581-Y584 HydrophobicContact CG-CD2 4.14Å; Q581-Y584 HydrophobicContact CG-CE1 4.18Å; Q581-Y584 HydrophobicContact CG-CE2 3.67Å; Q581-Y584 WeakPolarHBondContact O-CE2 3.4Å
582	D	82.9	Confident	86.5	Confident	66 Å²	66	57.2 Å²	57.2	35%	0.353	29%	0.294	S	S	.	.	S	Bend	trans	-84.6	-29.3	-179.4	66	-36.9	0	0	0	113.2	R578 R607 V608 V622	R578-D582 HydrophobicContact CB-CB 4.37Å; D582-R607 CarbonylContact O-C 3.52Å; D582-R607 WeakPolarHBondContact O-CA 3.45Å; D582-V608 PolarHBondContact O-N 2.82Å; D582-V622 HydrophobicContact CB-CG2 4.18Å
583	V	89.3	Confident	86.4	Confident	16 Å²	16	56.7 Å²	56.7	10%	0.097	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	134.4	178.6	-171.2	0	0	0	0	112	Q581 Y585 T605 R607	Q581-V583 VanDerWaalsContact CG-O 3.28Å; Q581-V583 WeakPolarHBondContact CG-O 3.11Å; Q581-V583 PolarHBondContact NE2-O 3.32Å; V583-Y585 HydrophobicContact CG1-CD1 4.42Å; V583-Y585 HydrophobicContact CG1-CE1 3.82Å; V583-Y585 HydrophobicContact CG1-CE2 4.07Å; V583-T605 HydrophobicContact CG1-CG2 3.55Å; V583-R607 HydrophobicContact CG2-CG 4.23Å
584	Y	89.9	Confident	86.1	Confident	9 Å²	9	53 Å²	53	4%	0.035	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	139.9	168.5	-66.1	-102.6	0	0	0	109.8	N556 F557 R573 F576 Q581 I606 V608	N556-Y584 WeakPolarHBondContact ND2-CE1 3.29Å; F557-Y584 AromaticContact CE2-CD1 3.92Å; F557-Y584 HydrophobicContact CE2-CD1 3.92Å; F557-Y584 AromaticContact CE2-CG 3.84Å; F557-Y584 HydrophobicContact CE2-CG 3.84Å; F557-Y584 HydrophobicContact CZ-CG 4.22Å; R573-Y584 PolarHBondContact NH2-OH 3.14Å; F576-Y584 HydrophobicContact CD1-CD2 4.46Å; F576-Y584 HydrophobicContact CD1-CE1 4.4Å; F576-Y584 AromaticContact CD1-CE2 3.69Å; F576-Y584 HydrophobicContact CD1-CE2 3.69Å; F576-Y584 AromaticContact CD1-CZ 3.63Å; F576-Y584 HydrophobicContact CE1-CE1 4.09Å; F576-Y584 HydrophobicContact CE1-CE2 4.07Å; F576-Y584 AromaticContact CE1-CZ 3.78Å; Q581-Y584 HydrophobicContact CB-CE2 4.02Å; Q581-Y584 VanDerWaalsContact CD-CZ 3.45Å; Q581-Y584 HydrophobicContact CG-CD2 4.14Å; Q581-Y584 HydrophobicContact CG-CE1 4.18Å; Q581-Y584 HydrophobicContact CG-CE2 3.67Å; Q581-Y584 WeakPolarHBondContact O-CE2 3.4Å; Y584-I606 PolarHBondContact N-O 3.34Å; Y584-I606 PolarHBondContact O-N 2.74Å; Y584-V608 HydrophobicContact CD2-CG2 3.96Å; Y584-V608 HydrophobicContact CE2-CG2 3.66Å
585	Y	90.9	Very high	85.9	Confident	149 Å²	149	54.7 Å²	54.7	58%	0.584	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	127.3	175.2	-60.6	-70.6	0	0	0	109	V583 T603 T605	V583-Y585 HydrophobicContact CG1-CD1 4.42Å; V583-Y585 HydrophobicContact CG1-CE1 3.82Å; V583-Y585 HydrophobicContact CG1-CE2 4.07Å; Y585-T603 HydrophobicContact CD1-CG2 3.92Å; Y585-T603 HydrophobicContact CG-CG2 4.26Å; Y585-T605 HydrophobicContact CD1-CG2 4.28Å; Y585-T605 HydrophobicContact CE1-CG2 3.91Å
586	L	91.3	Very high	86	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	90.7	179.6	-171.5	67.5	0	0	0	109.1	L547 V551 N554 F557 I569 I588 L604 I606	L547-L586 HydrophobicContact CD2-CD1 3.71Å; L547-L586 HydrophobicContact CD2-CD2 4.24Å; L547-L586 HydrophobicContact CD2-CG 3.99Å; V551-L586 HydrophobicContact CG2-CD1 4.45Å; N554-L586 VanDerWaalsContact ND2-CD1 3.32Å; N554-L586 WeakPolarHBondContact ND2-CD1 3.48Å; F557-L586 HydrophobicContact CB-CD1 4.39Å; F557-L586 HydrophobicContact CB-CD2 4.16Å; I569-L586 HydrophobicContact CG1-CD2 4.22Å; I569-L586 HydrophobicContact CG2-CD2 3.8Å; L586-I588 HydrophobicContact CD2-CD1 4.21Å; L586-I588 HydrophobicContact CD2-CG1 4.45Å; L586-I588 HydrophobicContact CG-CD1 4.42Å; L586-I588 HydrophobicContact CG-CG1 4.23Å; L586-I588 PolarHBondContact O-N 2.93Å; L586-L604 HydrophobicContact CB-CB 4.42Å; L586-L604 PolarHBondContact N-O 3.21Å; L586-L604 PolarHBondContact O-N 3.06Å; L586-I606 HydrophobicContact CB-CD1 4.09Å; L586-I606 HydrophobicContact CD2-CD1 4.05Å
587	P	92.1	Very high	86	Confident	18 Å²	18	58.3 Å²	58.3	12%	0.117	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	118.8	172.4	25.3	-31.1	0	0	0	110.1	A548 V551 T601	A548-P587 HydrophobicContact CB-CB 3.91Å; A548-P587 HydrophobicContact CB-CG 4.2Å; A548-P587 WeakPolarHBondContact CB-O 3.07Å; A548-P587 PolarHBondContact N-O 2.84Å; A548-P587 VanDerWaalsContact N-O 3.1Å; V551-P587 HydrophobicContact CG1-CG 3.94Å; V551-P587 HydrophobicContact CG2-CG 3.77Å; V551-P587 WeakPolarHBondContact CG2-O 3.3Å; P587-T601 HydrophobicContact CB-CG2 3.82Å
588	I	91.6	Very high	86.4	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	125.1	178.3	-68.7	165.2	0	0	0	106.5	F508 F545 S546 L547 L559 I569 L586 I590 T601 N602 L604	F508-I588 HydrophobicContact CE1-CG2 4.42Å; F508-I588 HydrophobicContact CZ-CB 4.02Å; F508-I588 HydrophobicContact CZ-CD1 4Å; F508-I588 HydrophobicContact CZ-CG2 4.2Å; F545-I588 HydrophobicContact CD1-CG2 4.08Å; S546-I588 CarbonylContact O-C 3.58Å; S546-I588 WeakPolarHBondContact O-CA 3.29Å; L547-I588 HydrophobicContact CD2-CG1 4.3Å; L559-I588 HydrophobicContact CD1-CB 4.33Å; L559-I588 HydrophobicContact CD1-CD1 3.76Å; L559-I588 HydrophobicContact CD1-CG1 3.74Å; L559-I588 HydrophobicContact CD1-CG2 3.66Å; I569-I588 HydrophobicContact CD1-CD1 4.27Å; I569-I588 HydrophobicContact CG1-CD1 4.19Å; L586-I588 HydrophobicContact CD2-CD1 4.21Å; L586-I588 HydrophobicContact CD2-CG1 4.45Å; L586-I588 HydrophobicContact CG-CD1 4.42Å; L586-I588 HydrophobicContact CG-CG1 4.23Å; L586-I588 PolarHBondContact O-N 2.93Å; I588-I590 HydrophobicContact CG2-CG1 4.32Å; I588-T601 CarbonylContact O-C 3.46Å; I588-T601 WeakPolarHBondContact O-CA 3.33Å; I588-N602 PolarHBondContact N-O 3.15Å; I588-N602 PolarHBondContact O-N 2.7Å; I588-L604 HydrophobicContact CD1-CB 4.04Å; I588-L604 HydrophobicContact CD1-CD2 4.28Å
589	E	92.5	Very high	87	Confident	57 Å²	57	59.8 Å²	59.8	27%	0.266	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	132.2	173.1	175.2	-178.7	-140.6	0	0	108.2	F545 S546 S600	F545-E589 WeakPolarHBondContact CA-O 3.17Å; S546-E589 PolarHBondContact N-O 2.86Å; S546-E589 PolarHBondContact O-N 2.86Å; S546-E589 WeakPolarHBondContact OG-CB 3.13Å; S546-E589 PolarHBondContact OG-OE2 2.85Å; E589-S600 WeakPolarHBondContact CA-O 3.33Å
590	I	91.8	Very high	87.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	122	-179.7	-44.2	175.9	0	0	0	106.6	P506 F508 A531 F543 F545 I588 S599 S600 N602	P506-I590 HydrophobicContact CB-CG2 3.94Å; P506-I590 HydrophobicContact CG-CB 4.14Å; P506-I590 HydrophobicContact CG-CG2 3.73Å; F508-I590 HydrophobicContact CD1-CD1 3.64Å; F508-I590 HydrophobicContact CE1-CD1 3.62Å; F508-I590 HydrophobicContact CE1-CG1 4.37Å; F508-I590 HydrophobicContact CG-CD1 4.35Å; F508-I590 HydrophobicContact CZ-CD1 4.34Å; A531-I590 HydrophobicContact CB-CD1 4.28Å; A531-I590 HydrophobicContact CB-CG2 3.87Å; F543-I590 HydrophobicContact CB-CG2 4.11Å; F545-I590 HydrophobicContact CD1-CG1 4.04Å; F545-I590 HydrophobicContact CD1-CG2 4.18Å; F545-I590 HydrophobicContact CE1-CD1 4.18Å; F545-I590 HydrophobicContact CE1-CG1 4.05Å; F545-I590 HydrophobicContact CE1-CG2 3.86Å; F545-I590 HydrophobicContact CZ-CG2 4.28Å; I588-I590 HydrophobicContact CG2-CG1 4.32Å; I590-S599 CarbonylContact O-C 3.59Å; I590-S599 WeakPolarHBondContact O-CA 3.35Å; I590-S599 VanDerWaalsContact O-CB 3.32Å; I590-S599 WeakPolarHBondContact O-CB 3.27Å; I590-S600 PolarHBondContact N-O 3.14Å; I590-S600 PolarHBondContact O-N 2.58Å; I590-N602 HydrophobicContact CD1-CB 4.23Å
591	N	90.2	Very high	88.2	Confident	45 Å²	45	52 Å²	52	24%	0.241	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134.1	177.1	-171.8	107.7	0	0	0	109.4	T544	T544-N591 PolarHBondContact N-O 3.08Å; T544-N591 PolarHBondContact O-N 3.02Å; T544-N591 PolarHBondContact OG1-O 2.97Å; T544-N591 VanDerWaalsContact OG1-O 3.11Å
592	D	89.2	Confident	88.5	Confident	7 Å²	7	49.7 Å²	49.7	4%	0.037	27%	0.266	C	S	.	.			trans	-73.4	-166.2	177.9	68.1	35.8	0	0	0	113.1	N502 P506 H542 F543 G594 S597 M598	N502-D592 PolarHBondContact ND2-OD2 3.18Å; N502-D592 PolarHBondContact OD1-OD2 3.45Å; P506-D592 HydrophobicContact CG-CB 4.31Å; H542-D592 CarbonylContact O-C 3.54Å; F543-D592 HydrophobicContact CD1-CB 4.44Å; F543-D592 HydrophobicContact CE1-CB 4.49Å; D592-G594 PolarHBondContact OD1-N 2.81Å; D592-S597 WeakPolarHBondContact OD1-CA 3.41Å; D592-S597 WeakPolarHBondContact OD1-CB 3.33Å; D592-M598 VanDerWaalsContact CG-N 3.31Å; D592-M598 PolarHBondContact N-O 3.39Å; D592-M598 VanDerWaalsContact N-O 3.12Å; D592-M598 PolarHBondContact OD1-N 2.76Å; D592-M598 WeakPolarHBondContact OD2-CA 3.42Å; D592-M598 VanDerWaalsContact OD2-CB 3.32Å; D592-M598 WeakPolarHBondContact OD2-CB 3.19Å; D592-M598 PolarHBondContact OD2-N 3.14Å
593	N	85.4	Confident	88.9	Confident	74 Å²	74	49.2 Å²	49.2	40%	0.396	27%	0.265	S	S	.	.	S	Bend	trans	-123.1	24.9	169.8	70.5	-57	0	0	0	113	H542	H542-N593 HydrophobicContact CB-CB 4.29Å; H542-N593 PolarHBondContact N-OD1 3.21Å; H542-N593 PolarHBondContact O-N 3.31Å; H542-N593 PolarHBondContact O-OD1 2.75Å
594	G	79.9	Confident	89	Confident	13 Å²	13	48.5 Å²	48.5	13%	0.134	26%	0.261	C	S	.	.			trans	-79.7	-176.3	-179.4	0	0	0	0	0	114.1	M537 D592 S597	M537-G594 VanDerWaalsContact CE-CA 3.48Å; D592-G594 PolarHBondContact OD1-N 2.81Å; G594-S597 PolarHBondContact O-N 3.06Å
595	F	76.6	Confident	89.1	Confident	192 Å²	192	49.3 Å²	49.3	84%	0.842	27%	0.267	S	S	*	.	S	Bend	trans	-145.1	112.6	174.9	-171.7	-92.2	0	0	0	111.6
596	P	84.3	Confident	89.1	Confident	80 Å²	80	42.2 Å²	42.2	52%	0.519	24%	0.239	S	C	.	.	S	Bend	cis	-61	146.7	-7.5	30.3	-36	0	0	0	111.1	N502	N502-P596 PolarHBondContact ND2-O 2.71Å
597	S	86.1	Confident	89	Confident	65 Å²	65	46.5 Å²	46.5	46%	0.455	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-77.2	131.3	177.5	59.3	0	0	0	0	110.9	D592 G594	D592-S597 WeakPolarHBondContact OD1-CA 3.41Å; D592-S597 WeakPolarHBondContact OD1-CB 3.33Å; G594-S597 PolarHBondContact O-N 3.06Å
598	M	89.8	Confident	88.9	Confident	66 Å²	66	45.6 Å²	45.6	33%	0.325	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-101.7	151.7	178.5	-64.9	-75.8	-86.8	0	0	110.5	N502 D503 N504 D592	N502-M598 WeakPolarHBondContact ND2-CG 3.32Å; D503-M598 WeakPolarHBondContact O-CE 2.85Å; N504-M598 WeakPolarHBondContact O-CB 3.22Å; N504-M598 VanDerWaalsContact O-CG 3.26Å; N504-M598 WeakPolarHBondContact O-CG 3.15Å; D592-M598 VanDerWaalsContact CG-N 3.31Å; D592-M598 PolarHBondContact N-O 3.39Å; D592-M598 VanDerWaalsContact N-O 3.12Å; D592-M598 PolarHBondContact OD1-N 2.76Å; D592-M598 WeakPolarHBondContact OD2-CA 3.42Å; D592-M598 VanDerWaalsContact OD2-CB 3.32Å; D592-M598 WeakPolarHBondContact OD2-CB 3.19Å; D592-M598 PolarHBondContact OD2-N 3.14Å
599	S	91.2	Very high	88.6	Confident	60 Å²	60	45.6 Å²	45.6	42%	0.42	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	149	176.4	70.9	0	0	0	0	112.8	I590	I590-S599 CarbonylContact O-C 3.59Å; I590-S599 WeakPolarHBondContact O-CA 3.35Å; I590-S599 VanDerWaalsContact O-CB 3.32Å; I590-S599 WeakPolarHBondContact O-CB 3.27Å
600	S	91.9	Very high	88.2	Confident	16 Å²	16	44.1 Å²	44.1	11%	0.112	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	167.5	175.3	77.9	0	0	0	0	110.4	P506 E589 I590	P506-S600 WeakPolarHBondContact O-CB 3.38Å; P506-S600 PolarHBondContact O-OG 3.45Å; E589-S600 WeakPolarHBondContact CA-O 3.33Å; I590-S600 PolarHBondContact N-O 3.14Å; I590-S600 PolarHBondContact O-N 2.58Å
601	T	91.9	Very high	87.8	Confident	79 Å²	79	45 Å²	45	49%	0.485	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	99.1	170.8	-63.6	0	0	0	0	109.7	A548 P587 I588	A548-T601 HydrophobicContact CB-CG2 4.01Å; P587-T601 HydrophobicContact CB-CG2 3.82Å; I588-T601 CarbonylContact O-C 3.46Å; I588-T601 WeakPolarHBondContact O-CA 3.33Å
602	N	90.7	Very high	87.2	Confident	32 Å²	32	44.8 Å²	44.8	17%	0.171	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	130.1	-176.1	-68.9	-15.6	0	0	0	110.7	E507 F508 I588 I590	E507-N602 WeakPolarHBondContact CA-ND2 3.18Å; F508-N602 HydrophobicContact CD2-CB 3.53Å; F508-N602 HydrophobicContact CE2-CB 3.39Å; F508-N602 HydrophobicContact CG-CB 4.17Å; F508-N602 HydrophobicContact CZ-CB 3.93Å; F508-N602 PolarHBondContact N-ND2 3.37Å; I588-N602 PolarHBondContact N-O 3.15Å; I588-N602 PolarHBondContact O-N 2.7Å; I590-N602 HydrophobicContact CD1-CB 4.23Å
603	T	91.1	Very high	86.4	Confident	55 Å²	55	50.3 Å²	50.3	34%	0.337	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	110	-176.5	-62.8	0	0	0	0	111	Y585	Y585-T603 HydrophobicContact CD1-CG2 3.92Å; Y585-T603 HydrophobicContact CG-CG2 4.26Å
604	L	91.8	Very high	85.8	Confident	1 Å²	1	55 Å²	55	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	121.8	169.2	-179.3	64.9	0	0	0	109.5	F508 V514 V529 I569 L586 I588 I606	F508-L604 HydrophobicContact CE2-CB 4.4Å; V514-L604 HydrophobicContact CB-CD1 4.48Å; V514-L604 HydrophobicContact CG1-CD1 4.03Å; V514-L604 HydrophobicContact CG1-CD2 4.16Å; V514-L604 HydrophobicContact CG1-CG 4.11Å; V529-L604 HydrophobicContact CG1-CD1 4.39Å; V529-L604 HydrophobicContact CG1-CD2 4.22Å; I569-L604 HydrophobicContact CD1-CD2 3.93Å; I569-L604 HydrophobicContact CG1-CD2 3.9Å; L586-L604 HydrophobicContact CB-CB 4.42Å; L586-L604 PolarHBondContact N-O 3.21Å; L586-L604 PolarHBondContact O-N 3.06Å; I588-L604 HydrophobicContact CD1-CB 4.04Å; I588-L604 HydrophobicContact CD1-CD2 4.28Å; L604-I606 HydrophobicContact CD2-CG1 4.35Å; L604-I606 HydrophobicContact CG-CG1 4.22Å
605	T	91.8	Very high	85.4	Confident	26 Å²	26	57.4 Å²	57.4	16%	0.16	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	111.3	178.8	-55.7	0	0	0	0	109.2	N512 E513 V514 V583 Y585	N512-T605 VanDerWaalsContact O-CB 3.28Å; N512-T605 WeakPolarHBondContact O-CB 3.39Å; N512-T605 PolarHBondContact O-N 2.79Å; N512-T605 PolarHBondContact O-OG1 2.93Å; E513-T605 CarbonylContact C-O 3.5Å; E513-T605 VanDerWaalsContact CA-O 3.31Å; E513-T605 WeakPolarHBondContact CA-O 3.47Å; E513-T605 HydrophobicContact CG-CG2 4.44Å; V514-T605 PolarHBondContact N-O 3.36Å; V583-T605 HydrophobicContact CG1-CG2 3.55Å; Y585-T605 HydrophobicContact CD1-CG2 4.28Å; Y585-T605 HydrophobicContact CE1-CG2 3.91Å
606	I	90.7	Very high	85.4	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	106.6	-178.7	-55.5	162.7	0	0	0	108	V514 M516 I526 F557 Y584 L586 L604	V514-I606 HydrophobicContact CG1-CB 4.15Å; V514-I606 HydrophobicContact CG1-CG1 3.67Å; V514-I606 HydrophobicContact CG1-CG2 4.25Å; M516-I606 HydrophobicContact CB-CG2 4.02Å; M516-I606 HydrophobicContact CE-CG2 4.28Å; M516-I606 HydrophobicContact SD-CG2 4.28Å; I526-I606 HydrophobicContact CD1-CD1 3.87Å; I526-I606 HydrophobicContact CD1-CG1 4.18Å; I526-I606 HydrophobicContact CD1-CG2 3.97Å; F557-I606 HydrophobicContact CD1-CD1 4.01Å; F557-I606 HydrophobicContact CD2-CD1 3.75Å; F557-I606 HydrophobicContact CE1-CD1 3.93Å; F557-I606 HydrophobicContact CE1-CG2 4.2Å; F557-I606 HydrophobicContact CE2-CD1 3.66Å; F557-I606 HydrophobicContact CG-CD1 3.93Å; F557-I606 HydrophobicContact CZ-CB 4.36Å; F557-I606 HydrophobicContact CZ-CD1 3.76Å; F557-I606 HydrophobicContact CZ-CG2 3.91Å; Y584-I606 PolarHBondContact N-O 3.34Å; Y584-I606 PolarHBondContact O-N 2.74Å; L586-I606 HydrophobicContact CB-CD1 4.09Å; L586-I606 HydrophobicContact CD2-CD1 4.05Å; L604-I606 HydrophobicContact CD2-CG1 4.35Å; L604-I606 HydrophobicContact CG-CG1 4.22Å
607	R	89.4	Confident	85.3	Confident	90 Å²	90	51.1 Å²	51.1	34%	0.34	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	136.2	172.6	-65.2	-145	-159.2	-124.3	-3.4	111.9	E513 V514 M516 D582 V583	E513-R607 WeakPolarHBondContact OE1-CD 3.18Å; E513-R607 IonicContact OE1-CZ 3.48Å; E513-R607 IonicContact OE1-NE 2.67Å; E513-R607 PolarHBondContact OE1-NE 3.36Å; E513-R607 IonicContact OE1-NH2 3.38Å; E513-R607 PolarHBondContact OE1-NH2 2.9Å; E513-R607 IonicContact OE2-NH2 3.85Å; V514-R607 PolarHBondContact O-N 3.12Å; M516-R607 PolarHBondContact N-O 2.87Å; D582-R607 CarbonylContact O-C 3.52Å; D582-R607 WeakPolarHBondContact O-CA 3.45Å; V583-R607 HydrophobicContact CG2-CG 4.23Å
608	V	88.6	Confident	84.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	119.4	171.3	-175.7	0	0	0	0	109.3	M516 E518 F576 R578 D582 Y584	M516-V608 HydrophobicContact CE-CG2 4.03Å; M516-V608 CarbonylContact O-C 3.58Å; M516-V608 WeakPolarHBondContact O-CA 3.37Å; E518-V608 HydrophobicContact CB-CG1 3.69Å; F576-V608 HydrophobicContact CB-CG1 4.12Å; F576-V608 HydrophobicContact CB-CG2 4.17Å; F576-V608 HydrophobicContact CD1-CG2 4.28Å; R578-V608 HydrophobicContact CB-CG1 4.42Å; R578-V608 WeakPolarHBondContact CB-O 3.31Å; D582-V608 PolarHBondContact O-N 2.82Å; Y584-V608 HydrophobicContact CD2-CG2 3.96Å; Y584-V608 HydrophobicContact CE2-CG2 3.66Å
609	C	86.3	Confident	84.3	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	157	-178.8	-46.9	0	0	0	0	111	M516 C517 E518 I617 C620	M516-C609 PolarHBondContact O-N 2.87Å; C517-C609 WeakPolarHBondContact CA-O 3.3Å; E518-C609 PolarHBondContact N-O 2.84Å; C609-I617 HydrophobicContact CB-CG1 4.48Å; C609-I617 HydrophobicContact CB-CG2 3.73Å; C609-C620 HydrophobicContact CB-CB 3.91Å; C609-C620 WeakPolarHBondContact CB-SG 3.14Å; C609-C620 VanDerWaalsContact SG-CA 3.56Å; C609-C620 WeakPolarHBondContact SG-CB 3.46Å; C609-C620 CovalentContact SG-SG 2.04Å; C609-C620 PolarHBondContact SG-SG 2.78Å
610	S	83.3	Confident	83.6	Confident	25 Å²	25	50.6 Å²	50.6	18%	0.175	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	142.4	169.7	-147.9	0	0	0	0	110	E518 R578 L618 S619	E518-S610 VanDerWaalsContact OE1-CA 3.28Å; E518-S610 WeakPolarHBondContact OE1-CA 3.35Å; E518-S610 VanDerWaalsContact OE1-CB 3.23Å; E518-S610 WeakPolarHBondContact OE1-CB 3.28Å; E518-S610 PolarHBondContact OE1-OG 2.63Å; R578-S610 PolarHBondContact NH2-OG 2.87Å; S610-L618 PolarHBondContact O-N 2.73Å; S610-S619 PolarHBondContact N-O 3.32Å; S610-S619 PolarHBondContact O-N 2.84Å
611	C	82.9	Confident	82.6	Confident	19 Å²	19	55.1 Å²	55.1	13%	0.128	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	160.4	-173	-67.5	0	0	0	0	113	C517 S616	C517-C611 WeakPolarHBondContact CA-SG 3.48Å; C517-C611 HydrophobicContact CB-CB 3.68Å; C517-C611 WeakPolarHBondContact CB-SG 3.35Å; C517-C611 WeakPolarHBondContact SG-CB 3.36Å; C517-C611 CovalentContact SG-SG 2.03Å; C517-C611 PolarHBondContact SG-SG 3.39Å; C611-S616 CarbonylContact C-O 3.53Å; C611-S616 WeakPolarHBondContact CA-O 3.46Å; C611-S616 VanDerWaalsContact CB-O 3.24Å; C611-S616 WeakPolarHBondContact CB-O 3.29Å
612	D	78.1	Confident	81.1	Confident	41 Å²	41	54.8 Å²	54.8	22%	0.219	30%	0.304	C	S	.	.			trans	-80.6	179	175.5	96.7	-51.8	0	0	0	112.5	K614 D615 S616 L618	D612-K614 VanDerWaalsContact CG-N 3.29Å; D612-K614 PolarHBondContact O-N 2.66Å; D612-K614 WeakPolarHBondContact OD1-CA 3.47Å; D612-K614 WeakPolarHBondContact OD1-CB 3.5Å; D612-K614 PolarHBondContact OD1-N 2.9Å; D612-K614 PolarHBondContact OD2-N 3.35Å; D612-D615 PolarHBondContact O-N 2.99Å; D612-D615 PolarHBondContact OD1-N 3.22Å; D612-S616 PolarHBondContact N-O 2.93Å; D612-S616 WeakPolarHBondContact OD1-CB 3.44Å; D612-S616 PolarHBondContact OD1-N 3.34Å; D612-S616 PolarHBondContact OD1-OG 2.79Å; D612-L618 HydrophobicContact CB-CD1 4Å; D612-L618 HydrophobicContact CB-CD2 4.18Å; D612-L618 HydrophobicContact CB-CG 4.15Å
613	S	72	Confident	79.2	Confident	122 Å²	122	60.9 Å²	60.9	85%	0.853	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	5.3	176.3	54.6	0	0	0	0	115.7
614	K	74.2	Confident	77	Confident	174 Å²	174	63.1 Å²	63.1	76%	0.757	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.5	17.7	177.7	-58.7	176.7	-179.5	174.2	0	112.3	D612 S616	D612-K614 VanDerWaalsContact CG-N 3.29Å; D612-K614 PolarHBondContact O-N 2.66Å; D612-K614 WeakPolarHBondContact OD1-CA 3.47Å; D612-K614 WeakPolarHBondContact OD1-CB 3.5Å; D612-K614 PolarHBondContact OD1-N 2.9Å; D612-K614 PolarHBondContact OD2-N 3.35Å; K614-S616 PolarHBondContact O-N 3.34Å
615	D	70	Confident	74.5	Confident	63 Å²	63	74.3 Å²	74.3	34%	0.337	39%	0.391	S	S	.	.	S	Bend	trans	58.6	25.5	-174.1	-73.5	-0.7	0	0	0	113.9	C517 N519 K524 D612	C517-D615 PolarHBondContact SG-O 3.32Å; C517-D615 VanDerWaalsContact SG-O 3.38Å; N519-D615 PolarHBondContact ND2-OD1 2.86Å; K524-D615 IonicContact NZ-OD2 2.88Å; K524-D615 PolarHBondContact NZ-OD2 2.74Å; D612-D615 PolarHBondContact O-N 2.99Å; D612-D615 PolarHBondContact OD1-N 3.22Å
616	S	76.9	Confident	72.1	Confident	61 Å²	61	78.7 Å²	78.7	43%	0.427	42%	0.417	S	S	.	.			trans	-93.2	138.5	173	71.3	0	0	0	0	111.8	C611 D612 K614 L618	C611-S616 CarbonylContact C-O 3.53Å; C611-S616 WeakPolarHBondContact CA-O 3.46Å; C611-S616 VanDerWaalsContact CB-O 3.24Å; C611-S616 WeakPolarHBondContact CB-O 3.29Å; D612-S616 PolarHBondContact N-O 2.93Å; D612-S616 WeakPolarHBondContact OD1-CB 3.44Å; D612-S616 PolarHBondContact OD1-N 3.34Å; D612-S616 PolarHBondContact OD1-OG 2.79Å; K614-S616 PolarHBondContact O-N 3.34Å; S616-L618 PolarHBondContact O-N 3.2Å
617	I	82.1	Confident	69.9	Low	79 Å²	79	85.6 Å²	85.6	41%	0.405	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	126	-171.8	-65.2	152.3	0	0	0	111	H515 C609	H515-I617 HydrophobicContact CB-CD1 3.5Å; C609-I617 HydrophobicContact CB-CG1 4.48Å; C609-I617 HydrophobicContact CB-CG2 3.73Å
618	L	78	Confident	67.7	Low	118 Å²	118	87.3 Å²	87.3	62%	0.618	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	-45.1	178.8	-65.8	175.1	0	0	0	112.5	S610 D612 S616	S610-L618 PolarHBondContact O-N 2.73Å; D612-L618 HydrophobicContact CB-CD1 4Å; D612-L618 HydrophobicContact CB-CD2 4.18Å; D612-L618 HydrophobicContact CB-CG 4.15Å; S616-L618 PolarHBondContact O-N 3.2Å
619	S	77.8	Confident	66	Low	36 Å²	36	91.6 Å²	91.6	25%	0.252	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	130.6	176.2	-178.7	0	0	0	0	112.1	S610 N621	S610-S619 PolarHBondContact N-O 3.32Å; S610-S619 PolarHBondContact O-N 2.84Å; S619-N621 PolarHBondContact OG-N 2.76Å
620	C	75.3	Confident	64.5	Low	26 Å²	26	95 Å²	95	18%	0.176	55%	0.547	C	S	.	.			trans	-95	-7.5	172.9	-59.8	0	0	0	0	113.2	C609	C609-C620 HydrophobicContact CB-CB 3.91Å; C609-C620 WeakPolarHBondContact CB-SG 3.14Å; C609-C620 VanDerWaalsContact SG-CA 3.56Å; C609-C620 WeakPolarHBondContact SG-CB 3.46Å; C609-C620 CovalentContact SG-SG 2.04Å; C609-C620 PolarHBondContact SG-SG 2.78Å
621	N	71.8	Confident	63.1	Low	111 Å²	111	99.6 Å²	99.6	59%	0.594	57%	0.568	S	S	*	*			trans	-84.5	136.3	-178.7	-69	-17.6	0	0	0	110.6	R578 S619	R578-N621 PolarHBondContact NH1-O 3Å; S619-N621 PolarHBondContact OG-N 2.76Å
622	V	60.6	Low	62.4	Low	71 Å²	71	102.9 Å²	102.9	43%	0.43	59%	0.592	S	S	.	*			trans	-89.1	102.4	160	-171.7	0	0	0	0	106.1	R578 D582 P624	R578-V622 HydrophobicContact CB-CG2 4.28Å; R578-V622 VanDerWaalsContact O-CG2 3.29Å; R578-V622 WeakPolarHBondContact O-CG2 3.28Å; D582-V622 HydrophobicContact CB-CG2 4.18Å; V622-P624 WeakPolarHBondContact O-CD 3.45Å
623	E	50.8	Low	61.6	Low	161 Å²	161	106.1 Å²	106.1	75%	0.752	61%	0.613	S	S	*	*			trans	-73	113	-175.4	-66.4	178.2	157.3	0	0	110.8
624	P	44	Very low	61.4	Low	101 Å²	101	102.1 Å²	102.1	66%	0.656	59%	0.592	S	S	*	*			trans	-71.1	150.2	167.5	32.3	-34.1	0	0	0	109.4	V622 V626	V622-P624 WeakPolarHBondContact O-CD 3.45Å; P624-V626 HydrophobicContact CG-CG2 4.13Å; P624-V626 WeakPolarHBondContact O-CG2 3.47Å; P624-V626 PolarHBondContact O-N 3.08Å
625	Y	40.2	Very low	60.9	Low	237 Å²	237	95.8 Å²	95.8	93%	0.929	57%	0.571	S	S	*	*			trans	-74.7	86.6	-179.6	-141.4	-93.6	0	0	0	110.5	L627	Y625-L627 PolarHBondContact O-N 2.9Å
626	V	41.4	Very low	60.9	Low	118 Å²	118	97.3 Å²	97.3	72%	0.715	58%	0.579	S	S	*	*			trans	-76.1	109.9	-172.3	-170.1	0	0	0	0	111.4	P624	P624-V626 HydrophobicContact CG-CG2 4.13Å; P624-V626 WeakPolarHBondContact O-CG2 3.47Å; P624-V626 PolarHBondContact O-N 3.08Å
627	L	43.5	Very low	60.8	Low	144 Å²	144	99.9 Å²	99.9	75%	0.754	59%	0.587	S	S	*	*			trans	-64.2	142	163.7	-74.7	167.7	0	0	0	110	Y625 A629	Y625-L627 PolarHBondContact O-N 2.9Å; L627-A629 PolarHBondContact O-N 2.93Å
628	P	43.6	Very low	60.3	Low	126 Å²	126	98.7 Å²	98.7	82%	0.818	59%	0.589	S	S	*	*			trans	-69.7	89.9	-175.1	28.3	-35.3	0	0	0	112	G630	P628-G630 PolarHBondContact O-N 2.87Å; P628-G630 VanDerWaalsContact O-N 3.15Å
629	A	52.5	Low	60.3	Low	91 Å²	91	97.2 Å²	97.2	75%	0.752	58%	0.58	S	S	*	*			trans	-72.3	100.9	172.6	0	0	0	0	0	110.1	L627	L627-A629 PolarHBondContact O-N 2.93Å
630	G	55	Low	60.4	Low	71 Å²	71	100.5 Å²	100.5	73%	0.732	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-61.8	136.7	171.9	0	0	0	0	0	111.2	P628 S632	P628-G630 PolarHBondContact O-N 2.87Å; P628-G630 VanDerWaalsContact O-N 3.15Å; G630-S632 PolarHBondContact O-N 2.93Å
631	L	55.4	Low	60.6	Low	121 Å²	121	101.5 Å²	101.5	63%	0.634	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-58	128.3	177	-92.5	72.6	0	0	0	110.5	A635 I639	L631-A635 HydrophobicContact CD2-CB 4.28Å; L631-I639 HydrophobicContact CD2-CD1 4.43Å
632	S	67.8	Low	61	Low	88 Å²	88	100 Å²	100	62%	0.615	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-57.2	141	168.5	176.6	0	0	0	0	110.4	G630 G634 A635	G630-S632 PolarHBondContact O-N 2.93Å; S632-G634 PolarHBondContact O-N 3.49Å; S632-G634 VanDerWaalsContact O-N 3.08Å; S632-A635 WeakPolarHBondContact O-CB 3.28Å; S632-A635 PolarHBondContact O-N 2.79Å
633	T	61.7	Low	62.1	Low	109 Å²	109	100.6 Å²	100.6	67%	0.669	60%	0.602	S	S	*	*	H	α-helix	trans	-56.6	-27.9	-178.7	47.9	0	0	0	0	113.1	A635 L636 I637	T633-A635 VanDerWaalsContact C-N 3.33Å; T633-A635 PolarHBondContact O-N 2.84Å; T633-L636 WeakPolarHBondContact O-CB 3.14Å; T633-L636 PolarHBondContact O-N 2.87Å; T633-I637 WeakPolarHBondContact O-CG1 3.26Å; T633-I637 PolarHBondContact O-N 3.06Å
634	G	67.4	Low	63.6	Low	39 Å²	39	97.4 Å²	97.4	40%	0.402	59%	0.593	S	S	.	*	H	α-helix	trans	-61.7	-35.3	173.1	0	0	0	0	0	114	S632 I637 A638	S632-G634 PolarHBondContact O-N 3.49Å; S632-G634 VanDerWaalsContact O-N 3.08Å; G634-I637 PolarHBondContact O-N 2.91Å; G634-A638 WeakPolarHBondContact O-CB 3.23Å; G634-A638 PolarHBondContact O-N 2.84Å
635	A	64.1	Low	65.3	Low	40 Å²	40	97.5 Å²	97.5	33%	0.331	59%	0.587	S	S	.	*	H	α-helix	trans	-70	-38.6	176.3	0	0	0	0	0	111.5	L631 S632 T633 I637 A638 I639	L631-A635 HydrophobicContact CD2-CB 4.28Å; S632-A635 WeakPolarHBondContact O-CB 3.28Å; S632-A635 PolarHBondContact O-N 2.79Å; T633-A635 VanDerWaalsContact C-N 3.33Å; T633-A635 PolarHBondContact O-N 2.84Å; A635-I637 VanDerWaalsContact C-N 3.34Å; A635-I637 PolarHBondContact O-N 2.82Å; A635-A638 PolarHBondContact O-N 2.88Å; A635-I639 WeakPolarHBondContact O-CD1 3.39Å; A635-I639 VanDerWaalsContact O-CG1 3.27Å; A635-I639 WeakPolarHBondContact O-CG1 3.46Å; A635-I639 PolarHBondContact O-N 2.87Å
636	L	68.2	Low	67.3	Low	96 Å²	96	91.4 Å²	91.4	50%	0.503	57%	0.57	S	S	.	*	H	α-helix	trans	-62.3	-40.6	174	-110.1	165.3	0	0	0	112.1	T633 L640	T633-L636 WeakPolarHBondContact O-CB 3.14Å; T633-L636 PolarHBondContact O-N 2.87Å; L636-L640 WeakPolarHBondContact O-CB 3.48Å; L636-L640 PolarHBondContact O-N 3.09Å
637	I	74.7	Confident	69.1	Low	115 Å²	115	90.8 Å²	90.8	59%	0.59	56%	0.562	S	S	*	*	H	α-helix	trans	-66.4	-42.7	175.2	-67	164.4	0	0	0	111.1	T633 G634 A635 L640 A641	T633-I637 WeakPolarHBondContact O-CG1 3.26Å; T633-I637 PolarHBondContact O-N 3.06Å; G634-I637 PolarHBondContact O-N 2.91Å; A635-I637 VanDerWaalsContact C-N 3.34Å; A635-I637 PolarHBondContact O-N 2.82Å; I637-L640 PolarHBondContact O-N 3.34Å; I637-A641 PolarHBondContact O-N 3.45Å
638	A	71.9	Confident	70.7	Confident	53 Å²	53	86.9 Å²	86.9	44%	0.438	55%	0.551	S	S	.	*	H	α-helix	trans	-63.1	-42.4	176.9	0	0	0	0	0	112.5	G634 A635 A641 C642	G634-A638 WeakPolarHBondContact O-CB 3.23Å; G634-A638 PolarHBondContact O-N 2.84Å; A635-A638 PolarHBondContact O-N 2.88Å; A638-A641 PolarHBondContact O-N 3.19Å; A638-C642 PolarHBondContact O-N 3.45Å; A638-C642 PolarHBondContact O-SG 2.77Å
639	I	77.7	Confident	72.3	Confident	87 Å²	87	85.7 Å²	85.7	45%	0.446	54%	0.536	S	S	.	.	H	α-helix	trans	-62.5	-44.6	175.6	-69.4	163.7	0	0	0	110.7	L631 A635 A641 C642 I643	L631-I639 HydrophobicContact CD2-CD1 4.43Å; A635-I639 WeakPolarHBondContact O-CD1 3.39Å; A635-I639 VanDerWaalsContact O-CG1 3.27Å; A635-I639 WeakPolarHBondContact O-CG1 3.46Å; A635-I639 PolarHBondContact O-N 2.87Å; I639-A641 PolarHBondContact O-N 2.86Å; I639-C642 PolarHBondContact O-N 2.92Å; I639-I643 HydrophobicContact CG2-CD1 3.82Å; I639-I643 VanDerWaalsContact O-CG1 3.3Å; I639-I643 WeakPolarHBondContact O-CG1 3.44Å; I639-I643 PolarHBondContact O-N 3.22Å
640	L	80.4	Confident	73.3	Confident	105 Å²	105	85.2 Å²	85.2	55%	0.55	52%	0.524	S	S	.	.	H	α-helix	trans	-60.1	-42.8	174.7	-92	161.7	0	0	0	112.6	L636 I637 I643 V644	L636-L640 WeakPolarHBondContact O-CB 3.48Å; L636-L640 PolarHBondContact O-N 3.09Å; I637-L640 PolarHBondContact O-N 3.34Å; L640-I643 PolarHBondContact O-N 3.32Å; L640-V644 WeakPolarHBondContact O-CG2 3.43Å; L640-V644 PolarHBondContact O-N 2.99Å
641	A	79.3	Confident	74.3	Confident	48 Å²	48	86.7 Å²	86.7	40%	0.397	52%	0.519	S	S	.	.	H	α-helix	trans	-61.8	-45.4	176.7	0	0	0	0	0	112	I637 A638 I639 I643 V644 I645	I637-A641 PolarHBondContact O-N 3.45Å; A638-A641 PolarHBondContact O-N 3.19Å; I639-A641 PolarHBondContact O-N 2.86Å; A641-I643 VanDerWaalsContact C-N 3.34Å; A641-I643 PolarHBondContact O-N 2.85Å; A641-V644 PolarHBondContact O-N 3.41Å; A641-I645 WeakPolarHBondContact O-CG1 3.34Å; A641-I645 PolarHBondContact O-N 2.89Å
642	C	81.1	Confident	75	Confident	78 Å²	78	86.5 Å²	86.5	53%	0.527	52%	0.518	S	S	.	.	H	α-helix	trans	-61.7	-38.9	175.7	-71.7	0	0	0	0	112.8	A638 I639 I645 L646	A638-C642 PolarHBondContact O-N 3.45Å; A638-C642 PolarHBondContact O-SG 2.77Å; I639-C642 PolarHBondContact O-N 2.92Å; C642-I645 PolarHBondContact O-N 2.63Å; C642-L646 WeakPolarHBondContact O-CB 3.28Å; C642-L646 PolarHBondContact O-N 3.3Å
643	I	82.4	Confident	74.8	Confident	85 Å²	85	87.9 Å²	87.9	44%	0.436	51%	0.513	S	S	.	.	H	α-helix	trans	-65.2	-42.1	176.5	-69.6	165.7	0	0	0	111.2	I639 L640 A641 L646 L647	I639-I643 HydrophobicContact CG2-CD1 3.82Å; I639-I643 VanDerWaalsContact O-CG1 3.3Å; I639-I643 WeakPolarHBondContact O-CG1 3.44Å; I639-I643 PolarHBondContact O-N 3.22Å; L640-I643 PolarHBondContact O-N 3.32Å; A641-I643 VanDerWaalsContact C-N 3.34Å; A641-I643 PolarHBondContact O-N 2.85Å; I643-L646 PolarHBondContact O-N 2.86Å; I643-L647 HydrophobicContact CG2-CD1 4.1Å; I643-L647 WeakPolarHBondContact O-CG 3.28Å; I643-L647 PolarHBondContact O-N 2.91Å
644	V	82.3	Confident	74.9	Confident	94 Å²	94	87.4 Å²	87.4	57%	0.57	51%	0.51	S	S	*	.	H	α-helix	trans	-64.9	-40.6	176.6	171.4	0	0	0	0	111.6	L640 A641 L647 A648	L640-V644 WeakPolarHBondContact O-CG2 3.43Å; L640-V644 PolarHBondContact O-N 2.99Å; A641-V644 PolarHBondContact O-N 3.41Å; V644-L647 PolarHBondContact O-N 2.83Å; V644-A648 PolarHBondContact O-N 2.92Å
645	I	81.4	Confident	74.6	Confident	103 Å²	103	89 Å²	89	53%	0.528	52%	0.519	S	S	.	.	H	α-helix	trans	-65.2	-43.5	176.1	-68.1	165.6	0	0	0	111	A641 C642 L647 A648 I649	A641-I645 WeakPolarHBondContact O-CG1 3.34Å; A641-I645 PolarHBondContact O-N 2.89Å; C642-I645 PolarHBondContact O-N 2.63Å; I645-L647 PolarHBondContact O-N 3.36Å; I645-A648 PolarHBondContact O-N 3.08Å; I645-I649 HydrophobicContact CG2-CD1 3.99Å; I645-I649 WeakPolarHBondContact O-CG1 3.33Å; I645-I649 PolarHBondContact O-N 3.28Å
646	L	80.4	Confident	74.5	Confident	109 Å²	109	93.3 Å²	93.3	57%	0.571	54%	0.535	S	S	*	.	H	α-helix	trans	-60.9	-42.2	174.6	-86.8	164.4	0	0	0	112.3	C642 I643 A648 I649 V650	C642-L646 WeakPolarHBondContact O-CB 3.28Å; C642-L646 PolarHBondContact O-N 3.3Å; I643-L646 PolarHBondContact O-N 2.86Å; L646-A648 PolarHBondContact O-N 3.17Å; L646-I649 PolarHBondContact O-N 2.92Å; L646-V650 WeakPolarHBondContact O-CG2 3.49Å; L646-V650 PolarHBondContact O-N 3.2Å
647	L	80.2	Confident	73.8	Confident	105 Å²	105	97.7 Å²	97.7	55%	0.55	55%	0.545	S	S	.	.	H	α-helix	trans	-62.9	-39.8	175.8	-76.1	167.7	0	0	0	112.2	I643 V644 I645 V650 V651	I643-L647 HydrophobicContact CG2-CD1 4.1Å; I643-L647 WeakPolarHBondContact O-CG 3.28Å; I643-L647 PolarHBondContact O-N 2.91Å; V644-L647 PolarHBondContact O-N 2.83Å; I645-L647 PolarHBondContact O-N 3.36Å; L647-V650 PolarHBondContact O-N 3.37Å; L647-V651 WeakPolarHBondContact O-CG2 3.37Å; L647-V651 PolarHBondContact O-N 3.33Å
648	A	77.1	Confident	72.5	Confident	62 Å²	62	103 Å²	103	51%	0.512	56%	0.558	S	S	.	*	H	α-helix	trans	-62.6	-42.2	174.5	0	0	0	0	0	112.2	V644 I645 L646 V651 L652	V644-A648 PolarHBondContact O-N 2.92Å; I645-A648 PolarHBondContact O-N 3.08Å; L646-A648 PolarHBondContact O-N 3.17Å; A648-V651 PolarHBondContact O-N 3.18Å; A648-L652 PolarHBondContact O-N 2.98Å
649	I	77.1	Confident	71.3	Confident	100 Å²	100	109 Å²	109	51%	0.513	58%	0.577	S	S	.	*	H	α-helix	trans	-64	-41.9	175.7	-66.9	165.3	0	0	0	111	I645 L646 L652 F653	I645-I649 HydrophobicContact CG2-CD1 3.99Å; I645-I649 WeakPolarHBondContact O-CG1 3.33Å; I645-I649 PolarHBondContact O-N 3.28Å; L646-I649 PolarHBondContact O-N 2.92Å; I649-L652 WeakPolarHBondContact O-CB 3.3Å; I649-L652 PolarHBondContact O-N 2.61Å; I649-F653 WeakPolarHBondContact O-CB 3.21Å; I649-F653 PolarHBondContact O-N 2.89Å
650	V	73.4	Confident	69.6	Low	81 Å²	81	114.2 Å²	114.2	49%	0.491	60%	0.596	S	S	.	*	H	α-helix	trans	-63.8	-42.8	176.6	169.4	0	0	0	0	111.6	L646 L647 L652 F653 V654	L646-V650 WeakPolarHBondContact O-CG2 3.49Å; L646-V650 PolarHBondContact O-N 3.2Å; L647-V650 PolarHBondContact O-N 3.37Å; V650-L652 PolarHBondContact O-N 3.38Å; V650-F653 PolarHBondContact O-N 3.34Å; V650-V654 HydrophobicContact CG1-CG2 4.46Å; V650-V654 WeakPolarHBondContact O-CG2 3.49Å; V650-V654 PolarHBondContact O-N 3.1Å
651	V	75.4	Confident	67.3	Low	102 Å²	102	117.8 Å²	117.8	62%	0.618	61%	0.607	S	S	*	*	H	α-helix	trans	-62.9	-41.9	175.9	170.9	0	0	0	0	111.3	L647 A648 F653 V654 A655	L647-V651 WeakPolarHBondContact O-CG2 3.37Å; L647-V651 PolarHBondContact O-N 3.33Å; A648-V651 PolarHBondContact O-N 3.18Å; V651-F653 VanDerWaalsContact C-N 3.33Å; V651-F653 PolarHBondContact O-N 3.42Å; V651-V654 PolarHBondContact O-N 3.26Å; V651-A655 PolarHBondContact O-N 3.27Å
652	L	70	Confident	65.6	Low	118 Å²	118	124 Å²	124	62%	0.618	63%	0.628	S	S	*	*	H	α-helix	trans	-59.7	-43.7	174.2	-161.9	85.9	0	0	0	111.4	A648 I649 V650 A655 L656	A648-L652 PolarHBondContact O-N 2.98Å; I649-L652 WeakPolarHBondContact O-CB 3.3Å; I649-L652 PolarHBondContact O-N 2.61Å; V650-L652 PolarHBondContact O-N 3.38Å; L652-A655 PolarHBondContact O-N 3.24Å; L652-L656 HydrophobicContact CD2-CD1 4.3Å; L652-L656 HydrophobicContact CG-CD1 4.14Å; L652-L656 WeakPolarHBondContact O-CG 3.42Å; L652-L656 PolarHBondContact O-N 3.24Å
653	F	64.6	Low	64	Low	116 Å²	116	125.5 Å²	125.5	51%	0.509	64%	0.637	S	S	.	*	H	α-helix	trans	-68.6	-35.2	-179.8	-160.3	-109.8	0	0	0	112.9	I649 V650 V651 L656 R657	I649-F653 WeakPolarHBondContact O-CB 3.21Å; I649-F653 PolarHBondContact O-N 2.89Å; V650-F653 PolarHBondContact O-N 3.34Å; V651-F653 VanDerWaalsContact C-N 3.33Å; V651-F653 PolarHBondContact O-N 3.42Å; F653-L656 PolarHBondContact O-N 3.11Å; F653-R657 HydrophobicContact CE1-CG 4.42Å; F653-R657 WeakPolarHBondContact O-CB 3.43Å; F653-R657 PolarHBondContact O-N 3.04Å
654	V	64.3	Low	61.6	Low	100 Å²	100	129 Å²	129	61%	0.606	66%	0.656	S	S	*	*	H	α-helix	trans	-67.9	-39.3	173.4	169.1	0	0	0	0	111.4	V650 V651	V650-V654 HydrophobicContact CG1-CG2 4.46Å; V650-V654 WeakPolarHBondContact O-CG2 3.49Å; V650-V654 PolarHBondContact O-N 3.1Å; V651-V654 PolarHBondContact O-N 3.26Å
655	A	61.2	Low	59.1	Low	71 Å²	71	132 Å²	132	59%	0.587	67%	0.667	S	S	*	*	H	α-helix	trans	-63.4	-45.4	173.9	0	0	0	0	0	111.7	V651 L652 R657 R658	V651-A655 PolarHBondContact O-N 3.27Å; L652-A655 PolarHBondContact O-N 3.24Å; A655-R657 PolarHBondContact O-N 2.83Å; A655-R658 PolarHBondContact O-N 3.2Å
656	L	60.7	Low	56.6	Low	131 Å²	131	132.2 Å²	132.2	69%	0.686	67%	0.673	S	S	*	*	H	α-helix	trans	-72.8	-24	-177.8	-69.4	169.4	0	0	0	114.1	L652 F653 R658	L652-L656 HydrophobicContact CD2-CD1 4.3Å; L652-L656 HydrophobicContact CG-CD1 4.14Å; L652-L656 WeakPolarHBondContact O-CG 3.42Å; L652-L656 PolarHBondContact O-N 3.24Å; F653-L656 PolarHBondContact O-N 3.11Å; L656-R658 VanDerWaalsContact C-N 3.31Å; L656-R658 PolarHBondContact O-N 3.45Å
657	R	53.4	Low	54.2	Low	189 Å²	189	135.2 Å²	135.2	71%	0.713	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-2.5	176.6	-83.7	-165.6	171.1	-148.4	-1.2	115.1	F653 A655 Q659	F653-R657 HydrophobicContact CE1-CG 4.42Å; F653-R657 WeakPolarHBondContact O-CB 3.43Å; F653-R657 PolarHBondContact O-N 3.04Å; A655-R657 PolarHBondContact O-N 2.83Å; R657-Q659 PolarHBondContact O-N 3.14Å; R657-Q659 VanDerWaalsContact O-N 3.14Å
658	R	48.7	Very low	51.9	Low	227 Å²	227	137.8 Å²	137.8	86%	0.857	69%	0.691	S	S	*	*	S	Bend	trans	-79.7	13.3	-173.2	-140.7	179.8	-173	-166.1	1.1	115.8	A655 L656	A655-R658 PolarHBondContact O-N 3.2Å; L656-R658 VanDerWaalsContact C-N 3.31Å; L656-R658 PolarHBondContact O-N 3.45Å
659	Q	46.8	Very low	49.8	Very low	179 Å²	179	143.1 Å²	143.1	84%	0.836	71%	0.705	S	S	*	*	S	Bend	trans	-137.5	87	172.7	-72.3	-166.1	-10.6	0	0	113.4	R657	R657-Q659 PolarHBondContact O-N 3.14Å; R657-Q659 VanDerWaalsContact O-N 3.14Å
660	K	41.9	Very low	47.5	Very low	195 Å²	195	145.6 Å²	145.6	85%	0.848	71%	0.714	S	S	*	*			trans	179.9	147.5	131.1	-104.5	172.8	179.5	-180	0	113.9
661	K	31	Very low	45.6	Very low	180 Å²	180	150 Å²	150	78%	0.783	74%	0.735	S	S	*	*			trans	79.5	117.9	171.5	-57.4	174.7	-179.2	-170.7	0	115.3
662	E	44.9	Very low	43.4	Very low	179 Å²	179	151.1 Å²	151.1	84%	0.836	74%	0.737	S	S	*	*				60.3	137	69.8	-70.5	166.5	-141.6	0	0	112.5
663	P	46	Very low	41.5	Very low	109 Å²	109	155.1 Å²	155.1	71%	0.708	74%	0.743	S	S	*	*				-156.2	174.8	53.4	44.5	-24	0	0	0	120.3
664	L	32.5	Very low	39.9	Very low	159 Å²	159	155.6 Å²	155.6	83%	0.832	75%	0.747	S	S	*	*			trans	43.8	121.6	138.7	-68.2	165.6	0	0	0	123.1
665	I	29.4	Very low	38.1	Very low	157 Å²	157	157.8 Å²	157.8	81%	0.805	76%	0.755	S	S	*	*				168.1	134.7	115	-86.8	156.7	0	0	0	114.2
666	V	28.7	Very low	36.7	Very low	107 Å²	107	160.5 Å²	160.5	65%	0.648	76%	0.759	S	S	*	*			trans	-4.7	135.8	157.6	-172.9	0	0	0	0	121.3
667	F	30.7	Very low	35.2	Very low	173 Å²	173	160 Å²	160	76%	0.759	76%	0.756	S	S	*	*				176.4	123.8	117.5	-85.3	-68.1	0	0	0	106.6
668	E	33.1	Very low	34.1	Very low	159 Å²	159	155.9 Å²	155.9	74%	0.743	75%	0.751	S	S	*	*				85	149.2	68.9	-151.1	164.8	-125.7	0	0	112.6
669	E	31.1	Very low	33.3	Very low	173 Å²	173	154 Å²	154	81%	0.808	75%	0.746	S	S	*	*			trans	62.4	153.6	-177.3	-67	173.5	-169.6	0	0	117.2
670	E	30.8	Very low	32.5	Very low	152 Å²	152	151 Å²	151	71%	0.71	74%	0.736	S	S	*	*			cis	-163.9	133.5	-42.1	-129.1	-178.6	-171.9	0	0	106	I672	E670-I672 HydrophobicContact CB-CD1 4.31Å; E670-I672 HydrophobicContact CB-CG1 4.11Å; E670-I672 PolarHBondContact O-N 2.94Å
671	D	33.4	Very low	31.9	Very low	173 Å²	173	148.3 Å²	148.3	93%	0.925	73%	0.731	S	S	*	*			trans	-89.1	93.1	-174.7	-159.9	2.2	0	0	0	110.8
672	I	28.7	Very low	32.1	Very low	127 Å²	127	148.7 Å²	148.7	65%	0.651	74%	0.735	S	S	*	*			trans	-140.9	124.7	-179.7	5	172.1	0	0	0	112.3	E670	E670-I672 HydrophobicContact CB-CD1 4.31Å; E670-I672 HydrophobicContact CB-CG1 4.11Å; E670-I672 PolarHBondContact O-N 2.94Å
673	R	29	Very low	31.4	Very low	201 Å²	201	143.7 Å²	143.7	76%	0.758	73%	0.732	S	S	*	*			trans	140.2	142.4	153.6	-81.2	-175.4	-167.4	-81.7	-8.1	110
674	E	31.4	Very low	30.6	Very low	126 Å²	126	142.7 Å²	142.7	59%	0.589	74%	0.741	S	S	*	*			cis	-156.8	126.7	-21	-113.6	153.3	-179.4	0	0	102.3
675	N	27	Very low	30.4	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	74%	0.736	S	S	*	*				68.3	174.9	78.2	-157.6	6.9	0	0	0	112.9
676	I	31.5	Very low	30.4	Very low	129 Å²	129	140.2 Å²	140.2	66%	0.662	74%	0.74	S	S	*	*			trans	76.4	127.2	170.8	-64.4	166.4	0	0	0	114.3
677	I	29.7	Very low	30.4	Very low	121 Å²	121	143.2 Å²	143.2	62%	0.621	75%	0.748	S	S	*	*			cis	-150.9	124	-4.8	-114.7	178.2	0	0	0	106.6	Y679	I677-Y679 HydrophobicContact CG2-CD2 4.32Å; I677-Y679 HydrophobicContact CG2-CE2 4.44Å
678	T	30.2	Very low	30.3	Very low	101 Å²	101	141.7 Å²	141.7	62%	0.62	75%	0.747	S	S	*	*				50.6	140.9	94.9	76.5	0	0	0	0	117.8
679	Y	31.8	Very low	30.1	Very low	187 Å²	187	141 Å²	141	73%	0.733	75%	0.754	S	S	*	*				174	103	128.1	-100.3	-78.1	0	0	0	103.9	I677	I677-Y679 HydrophobicContact CG2-CD2 4.32Å; I677-Y679 HydrophobicContact CG2-CE2 4.44Å
680	D	29.3	Very low	30.2	Very low	118 Å²	118	141.2 Å²	141.2	63%	0.631	76%	0.755	S	S	*	*				70.3	135.4	93.8	-56.2	0.2	0	0	0	110
681	D	29.4	Very low	30	Very low	138 Å²	138	138.9 Å²	138.9	74%	0.738	76%	0.762	S	S	*	*			cis	-152.7	178.6	46.4	-114.7	-43.7	0	0	0	113.2
682	E	35.7	Very low	29.7	Very low	187 Å²	187	139 Å²	139	87%	0.874	75%	0.754	S	S	*	*			trans	32	144.2	150.9	-60.4	-177.3	160.2	0	0	121.1
683	G	29.6	Very low	29.7	Very low	75 Å²	75	140.6 Å²	140.6	77%	0.773	76%	0.764	S	S	*	*			cis	154.4	128.3	11.1	0	0	0	0	0	107.1
684	G	29.4	Very low	29.8	Very low	88 Å²	88	137.6 Å²	137.6	91%	0.907	76%	0.762	S	S	*	*			trans	-87.3	174.2	-164.9	0	0	0	0	0	115.9
685	G	29.4	Very low	29.8	Very low	69 Å²	69	136 Å²	136	71%	0.711	77%	0.77	S	S	*	*			trans	129.4	99.2	148.8	0	0	0	0	0	118.8
686	E	29.4	Very low	30.1	Very low	194 Å²	194	135.2 Å²	135.2	91%	0.907	77%	0.771	S	S	*	*				64.3	166.1	128.1	-63.6	-176.2	145	0	0	123.7
687	E	27.2	Very low	30.1	Very low	171 Å²	171	136.9 Å²	136.9	80%	0.799	78%	0.78	S	S	*	*			trans	70.5	106.3	165.5	-68.7	-174.3	163.4	0	0	122.3
688	D	29	Very low	30.1	Very low	140 Å²	140	140.7 Å²	140.7	75%	0.749	80%	0.795	S	S	*	*				54.7	125.6	121.3	-64.1	16.1	0	0	0	122.7
689	T	30.1	Very low	30.3	Very low	145 Å²	145	142.9 Å²	142.9	89%	0.89	80%	0.803	S	S	*	*				-173	147.6	100.4	21.8	0	0	0	0	113.2
690	E	31.4	Very low	30.8	Very low	177 Å²	177	138.3 Å²	138.3	83%	0.827	80%	0.796	S	S	*	*			trans	-92.4	150.2	173.5	-60.3	-177.2	148.6	0	0	112.3
691	A	27.3	Very low	30.9	Very low	103 Å²	103	140.4 Å²	140.4	85%	0.851	81%	0.808	S	S	*	*			trans	-149.5	142.5	161.7	0	0	0	0	0	111.7
692	F	27.5	Very low	30.9	Very low	176 Å²	176	137.9 Å²	137.9	77%	0.772	81%	0.814	S	S	*	*			trans	-97.1	155.6	-177.2	-70.6	-113.3	0	0	0	111.8
693	D	27.9	Very low	30.6	Very low	161 Å²	161	133.2 Å²	133.2	86%	0.861	81%	0.807	S	S	*	*				-154.8	166.2	108.5	-148.7	-5.3	0	0	0	112.5
694	I	31.5	Very low	30.7	Very low	138 Å²	138	137.8 Å²	137.8	71%	0.708	81%	0.814	S	S	*	*			trans	-123.5	132.4	-172.3	-71.9	171.8	0	0	0	110.9
695	A	31.9	Very low	30.7	Very low	91 Å²	91	137.3 Å²	137.3	75%	0.752	81%	0.809	S	S	*	*			trans	-139.3	95	168.2	0	0	0	0	0	113.6
696	T	32.9	Very low	30.6	Very low	131 Å²	131	144.1 Å²	144.1	80%	0.804	82%	0.819	S	S	*	*			trans	52.1	89.3	146.7	52.5	0	0	0	0	120.8
697	L	31.4	Very low	30.8	Very low	163 Å²	163	142.1 Å²	142.1	85%	0.853	81%	0.814	S	S	*	*			trans	-23.5	147.2	133.6	-69.2	155.4	0	0	0	116.6
698	Q	30.6	Very low	31.4	Very low	201 Å²	201	139 Å²	139	94%	0.939	81%	0.809	S	S	*	*				-154.9	165.5	106.4	-111.5	-179.3	6.5	0	0	113.3
699	N	33.2	Very low	31.1	Very low	147 Å²	147	143 Å²	143	79%	0.786	81%	0.813	S	S	*	*			trans	-124.6	160	-157.6	-150.8	56.7	0	0	0	111.6
700	P	43.5	Very low	31	Very low	91 Å²	91	143.7 Å²	143.7	59%	0.591	80%	0.804	S	S	*	*			trans	-100.4	-168.3	-165.8	40.7	-37.4	0	0	0	115.5
701	D	30.5	Very low	30.7	Very low	163 Å²	163	141.2 Å²	141.2	87%	0.872	80%	0.797	S	S	*	*			trans	83.2	136	159.3	-59.3	-28.5	0	0	0	121.1
702	G	29.9	Very low	30.8	Very low	85 Å²	85	144 Å²	144	88%	0.876	80%	0.795	S	S	*	*			trans	153.2	92.6	171.3	0	0	0	0	0	114.1
703	A	29.6	Very low	31.1	Very low	88 Å²	88	145.2 Å²	145.2	73%	0.727	80%	0.8	S	S	*	*			trans	-106.7	158.1	-174.3	0	0	0	0	0	115.3
704	N	30.4	Very low	31.5	Very low	172 Å²	172	142.6 Å²	142.6	92%	0.92	79%	0.792	S	S	*	*			trans	74.9	121.5	162.8	-59.8	-28.8	0	0	0	120.1
705	G	29.3	Very low	31.2	Very low	77 Å²	77	142.4 Å²	142.4	79%	0.794	79%	0.788	S	S	*	*			trans	175.8	130.4	165.8	0	0	0	0	0	111.8
706	F	28.8	Very low	31	Very low	212 Å²	212	145 Å²	145	93%	0.93	79%	0.789	S	S	*	*			trans	-94	159	-169.8	-98.3	-101.1	0	0	0	115.6
707	L	33.8	Very low	30.8	Very low	153 Å²	153	146 Å²	146	80%	0.801	78%	0.784	S	S	*	*			trans	-45.3	166.8	168	-67.5	166.5	0	0	0	114.8
708	P	39.2	Very low	30.7	Very low	106 Å²	106	147.7 Å²	147.7	69%	0.688	78%	0.781	S	S	*	*			cis	-154.7	178.4	31.1	45.6	-24.8	0	0	0	121.1
709	R	23.4	Very low	30.7	Very low	223 Å²	223	143.9 Å²	143.9	84%	0.842	77%	0.774	S	S	*	*			trans	81.7	136.5	142.9	-89.9	-178.6	-144.7	-137	7.4	123.2
710	K	26.4	Very low	30.3	Very low	160 Å²	160	144.7 Å²	144.7	70%	0.696	78%	0.776	S	S	*	*			trans	97.6	106.2	135.5	-84.5	-149.8	156.9	-163.8	0	122.9
711	D	26.3	Very low	29.5	Very low	125 Å²	125	151.5 Å²	151.5	67%	0.668	79%	0.79	S	S	*	*				32.6	109.4	118.5	-25.1	-29.5	0	0	0	120
712	I	29.3	Very low	29.7	Very low	161 Å²	161	149.7 Å²	149.7	83%	0.826	79%	0.787	S	S	*	*			trans	-141.1	109.5	133.2	-70.3	98.5	0	0	0	110.4
713	K	33	Very low	29.6	Very low	201 Å²	201	149.2 Å²	149.2	87%	0.874	78%	0.782	S	S	*	*			trans	-115	146.9	130.8	-84	-174.7	178.5	179.7	0	104.4
714	P	36.5	Very low	29.6	Very low	106 Å²	106	152.3 Å²	152.3	69%	0.688	79%	0.791	S	S	*	*				-128.5	-155.2	53.4	31.5	-7.6	0	0	0	110.2
715	E	25.6	Very low	29.6	Very low	134 Å²	134	147.6 Å²	147.6	63%	0.626	78%	0.783	S	S	*	*			cis	-165.2	149.8	21.5	-167.4	162.3	-133.3	0	0	112.9	Q717	E715-Q717 HydrophobicContact CG-CG 3.97Å; E715-Q717 PolarHBondContact OE1-NE2 3.03Å
716	L	28.3	Very low	29.6	Very low	147 Å²	147	154.8 Å²	154.8	77%	0.77	79%	0.787	S	S	*	*			trans	-150.5	88.9	160.3	-114	171.9	0	0	0	109.5	Y718	L716-Y718 HydrophobicContact CD2-CE2 4.28Å
717	Q	27.6	Very low	30.2	Very low	150 Å²	150	150.6 Å²	150.6	70%	0.701	78%	0.781	S	S	*	*			trans	-86.8	138	171.2	-61.6	-174.8	20.2	0	0	110.2	E715	E715-Q717 HydrophobicContact CG-CG 3.97Å; E715-Q717 PolarHBondContact OE1-NE2 3.03Å
718	Y	29	Very low	29.9	Very low	200 Å²	200	147.9 Å²	147.9	78%	0.784	78%	0.78	S	S	*	*			trans	-104.9	145.8	162.1	-79.8	-82.9	0	0	0	110.4	L716	L716-Y718 HydrophobicContact CD2-CE2 4.28Å
719	P	31.1	Very low	30.2	Very low	121 Å²	121	148.3 Å²	148.3	79%	0.786	78%	0.783	S	S	*	*			trans	-85.1	144.4	-160.6	32.4	-36.7	0	0	0	114.7
720	I	25.1	Very low	30.7	Very low	163 Å²	163	145.2 Å²	145.2	84%	0.836	78%	0.783	S	S	*	*			trans	-73.3	143.9	170.5	-63.2	169.6	0	0	0	110.6
721	R	27.6	Very low	31.3	Very low	234 Å²	234	143.2 Å²	143.2	88%	0.883	79%	0.789	S	S	*	*			trans	-119.6	152.4	159.2	-82.9	-169.8	174.1	-166.7	0.3	111.1
722	P	33	Very low	32.1	Very low	126 Å²	126	142.2 Å²	142.2	82%	0.818	79%	0.788	S	S	*	*			trans	-97.3	123.6	-159.2	34.8	-32.8	0	0	0	115.5
723	G	29.5	Very low	33.3	Very low	74 Å²	74	139.3 Å²	139.3	76%	0.763	77%	0.774	S	S	*	*				64.9	109	126.7	0	0	0	0	0	121.2
724	V	29.5	Very low	34.1	Very low	153 Å²	153	133 Å²	133	93%	0.927	75%	0.752	S	S	*	*			trans	-142	135.8	147.2	-177	0	0	0	0	109.2
725	G	29.1	Very low	34.6	Very low	73 Å²	73	131.8 Å²	131.8	75%	0.753	74%	0.74	S	S	*	*			trans	78.8	115	148.5	0	0	0	0	0	120.5
726	R	29	Very low	35.9	Very low	229 Å²	229	130.4 Å²	130.4	86%	0.864	74%	0.737	S	S	*	*			trans	-136.4	161.3	143.8	-89.4	-169.1	177.6	-164.4	-0.1	106.9
727	P	41.6	Very low	37.3	Very low	123 Å²	123	127.9 Å²	127.9	80%	0.799	72%	0.72	S	S	*	*			cis	-127.7	169.9	-4.1	40	-25.8	0	0	0	114.5
728	A	28.1	Very low	38.5	Very low	96 Å²	96	123.8 Å²	123.8	79%	0.793	70%	0.702	S	S	*	*			trans	-150	140.3	145.5	0	0	0	0	0	108.4
729	P	44.8	Very low	39.8	Very low	116 Å²	116	119.9 Å²	119.9	75%	0.753	69%	0.689	S	S	*	*			trans	-92.8	136	179.1	34.8	-31.5	0	0	0	112
730	N	33.8	Very low	41.2	Very low	158 Å²	158	117.3 Å²	117.3	85%	0.845	67%	0.671	S	S	*	*			trans	-171	164.4	147.5	-98.3	-16.5	0	0	0	109.4
731	S	39.3	Very low	42.8	Very low	117 Å²	117	114.5 Å²	114.5	82%	0.818	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-60.9	132.2	176.6	49.1	0	0	0	0	112
732	V	43.8	Very low	44.4	Very low	105 Å²	105	106 Å²	106	64%	0.636	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-84.1	125.6	167.7	-178.9	0	0	0	0	108.1
733	D	53.7	Low	45.8	Very low	100 Å²	100	103.4 Å²	103.4	54%	0.535	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-76.9	134.3	177	-163.1	-25.5	0	0	0	110.6	D735 D736 F737	D733-D735 VanDerWaalsContact C-N 3.28Å; D733-D735 WeakPolarHBondContact OD1-CB 3.3Å; D733-D735 PolarHBondContact OD1-N 2.89Å; D733-D736 HydrophobicContact CB-CB 4.22Å; D733-D736 PolarHBondContact O-N 2.75Å; D733-F737 PolarHBondContact O-N 3.46Å; D733-F737 VanDerWaalsContact O-N 3.15Å
734	V	50	Low	47.3	Very low	69 Å²	69	104.8 Å²	104.8	42%	0.418	60%	0.597	S	S	.	*	H	α-helix	trans	-68.5	-31.8	177.4	179.9	0	0	0	0	110.6	F737 I738 L772	V734-F737 PolarHBondContact O-N 2.88Å; V734-I738 HydrophobicContact CG1-CD1 3.82Å; V734-I738 HydrophobicContact CG1-CG1 4.38Å; V734-I738 WeakPolarHBondContact O-CB 3.4Å; V734-I738 VanDerWaalsContact O-CG1 3.3Å; V734-I738 WeakPolarHBondContact O-CG1 3.39Å; V734-I738 PolarHBondContact O-N 3.28Å; V734-L772 HydrophobicContact CG1-CD1 4.19Å
735	D	47.3	Very low	48.7	Very low	80 Å²	80	98.7 Å²	98.7	43%	0.428	56%	0.563	S	S	.	*	H	α-helix	trans	-63.7	-43.7	176.2	-180	40.1	0	0	0	111.5	D733 I738 K739	D733-D735 VanDerWaalsContact C-N 3.28Å; D733-D735 WeakPolarHBondContact OD1-CB 3.3Å; D733-D735 PolarHBondContact OD1-N 2.89Å; D735-I738 PolarHBondContact O-N 2.59Å; D735-K739 WeakPolarHBondContact O-CB 3.09Å; D735-K739 WeakPolarHBondContact O-CD 3.47Å; D735-K739 VanDerWaalsContact O-CG 3.26Å; D735-K739 WeakPolarHBondContact O-CG 3.44Å; D735-K739 PolarHBondContact O-N 2.84Å; D735-K739 WeakPolarHBondContact OD1-CE 3.49Å; D735-K739 IonicContact OD1-NZ 2.66Å; D735-K739 PolarHBondContact OD1-NZ 3.28Å; D735-K739 IonicContact OD2-NZ 2.61Å; D735-K739 PolarHBondContact OD2-NZ 3.09Å
736	D	53.8	Low	50.1	Low	105 Å²	105	99 Å²	99	56%	0.561	55%	0.547	S	S	*	.	H	α-helix	trans	-72.1	-35.8	178.9	-159.6	48	0	0	0	112.2	D733 T740	D733-D736 HydrophobicContact CB-CB 4.22Å; D733-D736 PolarHBondContact O-N 2.75Å; D736-T740 WeakPolarHBondContact O-CB 3.47Å; D736-T740 PolarHBondContact O-N 2.95Å; D736-T740 PolarHBondContact O-OG1 3.23Å
737	F	56	Low	51.4	Low	94 Å²	94	91.1 Å²	91.1	41%	0.412	54%	0.537	S	S	.	.	H	α-helix	trans	-61.1	-49.1	171.2	178.3	-98.1	0	0	0	111.8	D733 V734 T740 R741	D733-F737 PolarHBondContact O-N 3.46Å; D733-F737 VanDerWaalsContact O-N 3.15Å; V734-F737 PolarHBondContact O-N 2.88Å; F737-T740 PolarHBondContact O-N 3.31Å; F737-R741 HydrophobicContact CE1-CG 4.25Å; F737-R741 HydrophobicContact CE2-CG 4.42Å; F737-R741 HydrophobicContact CZ-CG 4.17Å; F737-R741 WeakPolarHBondContact O-CG 3.33Å; F737-R741 PolarHBondContact O-N 3.23Å
738	I	52.8	Low	52.2	Low	64 Å²	64	89 Å²	89	33%	0.328	52%	0.519	S	S	.	.	H	α-helix	trans	-64.5	-45.7	179.5	-71	171.7	0	0	0	110.7	V734 D735 T740 R741 I742	V734-I738 HydrophobicContact CG1-CD1 3.82Å; V734-I738 HydrophobicContact CG1-CG1 4.38Å; V734-I738 WeakPolarHBondContact O-CB 3.4Å; V734-I738 VanDerWaalsContact O-CG1 3.3Å; V734-I738 WeakPolarHBondContact O-CG1 3.39Å; V734-I738 PolarHBondContact O-N 3.28Å; D735-I738 PolarHBondContact O-N 2.59Å; I738-T740 VanDerWaalsContact C-N 3.34Å; I738-T740 PolarHBondContact O-N 2.56Å; I738-R741 PolarHBondContact O-N 3.2Å; I738-I742 HydrophobicContact CG2-CD1 3.68Å; I738-I742 HydrophobicContact CG2-CG1 4.37Å; I738-I742 WeakPolarHBondContact O-CG1 3.36Å; I738-I742 PolarHBondContact O-N 3.06Å
739	K	57.6	Low	53.4	Low	117 Å²	117	90.7 Å²	90.7	51%	0.509	52%	0.522	S	S	.	.	H	α-helix	trans	-58.4	-44.2	176.5	-78.2	165.3	175.8	163.8	0	112.5	D735 I742 A743	D735-K739 WeakPolarHBondContact O-CB 3.09Å; D735-K739 WeakPolarHBondContact O-CD 3.47Å; D735-K739 VanDerWaalsContact O-CG 3.26Å; D735-K739 WeakPolarHBondContact O-CG 3.44Å; D735-K739 PolarHBondContact O-N 2.84Å; D735-K739 WeakPolarHBondContact OD1-CE 3.49Å; D735-K739 IonicContact OD1-NZ 2.66Å; D735-K739 PolarHBondContact OD1-NZ 3.28Å; D735-K739 IonicContact OD2-NZ 2.61Å; D735-K739 PolarHBondContact OD2-NZ 3.09Å; K739-I742 PolarHBondContact O-N 3.24Å; K739-A743 WeakPolarHBondContact O-CB 3.33Å; K739-A743 PolarHBondContact O-N 3.15Å
740	T	59.3	Low	53.7	Low	67 Å²	67	90.9 Å²	90.9	41%	0.411	52%	0.521	S	S	.	.	H	α-helix	trans	-62.3	-45.4	176.8	-58.6	0	0	0	0	110.9	D736 F737 I738 I742 A743 E744	D736-T740 WeakPolarHBondContact O-CB 3.47Å; D736-T740 PolarHBondContact O-N 2.95Å; D736-T740 PolarHBondContact O-OG1 3.23Å; F737-T740 PolarHBondContact O-N 3.31Å; I738-T740 VanDerWaalsContact C-N 3.34Å; I738-T740 PolarHBondContact O-N 2.56Å; T740-I742 PolarHBondContact O-N 3.02Å; T740-A743 PolarHBondContact O-N 3.39Å; T740-E744 WeakPolarHBondContact O-CG 3.34Å; T740-E744 PolarHBondContact O-N 2.86Å
741	R	60.1	Low	54.6	Low	104 Å²	104	85.4 Å²	85.4	39%	0.392	50%	0.498	S	S	.	.	H	α-helix	trans	-67.6	-34.3	179.1	-71.3	-53.1	-156.6	169.2	9.9	114.3	F737 I738 E744 A745 Y760	F737-R741 HydrophobicContact CE1-CG 4.25Å; F737-R741 HydrophobicContact CE2-CG 4.42Å; F737-R741 HydrophobicContact CZ-CG 4.17Å; F737-R741 WeakPolarHBondContact O-CG 3.33Å; F737-R741 PolarHBondContact O-N 3.23Å; I738-R741 PolarHBondContact O-N 3.2Å; R741-E744 WeakPolarHBondContact CD-OE2 3.39Å; R741-E744 IonicContact CZ-OE2 3.58Å; R741-E744 IonicContact NE-OE2 3.75Å; R741-E744 IonicContact NH1-OE2 2.69Å; R741-E744 PolarHBondContact NH1-OE2 3.47Å; R741-A745 WeakPolarHBondContact O-CB 3.46Å; R741-A745 PolarHBondContact O-N 3.03Å; R741-Y760 HydrophobicContact CB-CD1 3.76Å; R741-Y760 HydrophobicContact CB-CE1 3.89Å
742	I	60.5	Low	55	Low	56 Å²	56	82.7 Å²	82.7	29%	0.287	48%	0.478	S	S	.	.	H	α-helix	trans	-65.4	-42.9	172.6	-68.3	167.3	0	0	0	110.1	I738 K739 T740 A745 D746 Y760	I738-I742 HydrophobicContact CG2-CD1 3.68Å; I738-I742 HydrophobicContact CG2-CG1 4.37Å; I738-I742 WeakPolarHBondContact O-CG1 3.36Å; I738-I742 PolarHBondContact O-N 3.06Å; K739-I742 PolarHBondContact O-N 3.24Å; T740-I742 PolarHBondContact O-N 3.02Å; I742-A745 PolarHBondContact O-N 3.1Å; I742-D746 WeakPolarHBondContact O-CB 3.45Å; I742-D746 PolarHBondContact O-N 3.08Å; I742-Y760 HydrophobicContact CG1-CE1 4.36Å
743	A	62.5	Low	54.9	Low	71 Å²	71	83.3 Å²	83.3	59%	0.587	48%	0.484	S	S	*	.	H	α-helix	trans	-67.2	-34.1	177.8	0	0	0	0	0	113.4	K739 T740	K739-A743 WeakPolarHBondContact O-CB 3.33Å; K739-A743 PolarHBondContact O-N 3.15Å; T740-A743 PolarHBondContact O-N 3.39Å
744	E	61.7	Low	54.5	Low	104 Å²	104	85.4 Å²	85.4	49%	0.486	49%	0.485	S	S	.	.	H	α-helix	trans	-67.3	-48.5	171.5	-73.7	-179.5	159.9	0	0	111.7	T740 R741 D746 G747 D748	T740-E744 WeakPolarHBondContact O-CG 3.34Å; T740-E744 PolarHBondContact O-N 2.86Å; R741-E744 WeakPolarHBondContact CD-OE2 3.39Å; R741-E744 IonicContact CZ-OE2 3.58Å; R741-E744 IonicContact NE-OE2 3.75Å; R741-E744 IonicContact NH1-OE2 2.69Å; R741-E744 PolarHBondContact NH1-OE2 3.47Å; E744-D746 PolarHBondContact O-N 3.13Å; E744-G747 PolarHBondContact O-N 3.3Å; E744-G747 VanDerWaalsContact O-N 3.08Å; E744-D748 PolarHBondContact O-N 3.16Å
745	A	58.2	Low	54.2	Low	24 Å²	24	85.1 Å²	85.1	20%	0.198	48%	0.481	C	S	.	.	H	α-helix	trans	-64.7	-39.3	-178.7	0	0	0	0	0	112.7	R741 I742 G747 D748	R741-A745 WeakPolarHBondContact O-CB 3.46Å; R741-A745 PolarHBondContact O-N 3.03Å; I742-A745 PolarHBondContact O-N 3.1Å; A745-G747 PolarHBondContact O-N 3.41Å; A745-G747 VanDerWaalsContact O-N 3.15Å; A745-D748 PolarHBondContact O-N 2.89Å; A745-D748 VanDerWaalsContact O-N 3.15Å
746	D	58.7	Low	54	Low	80 Å²	80	83.2 Å²	83.2	43%	0.428	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-9.3	175.5	-74.6	-8.1	0	0	0	113.2	R71 R74 I742 E744	R71-D746 IonicContact CZ-OD1 2.71Å; R71-D746 VanDerWaalsContact NH1-CG 3.33Å; R71-D746 IonicContact NH1-OD1 3.21Å; R71-D746 PolarHBondContact NH1-OD1 3.29Å; R71-D746 IonicContact NH1-OD2 3.7Å; R74-D746 IonicContact CZ-OD1 2.63Å; R74-D746 VanDerWaalsContact CZ-OD1 3.25Å; R74-D746 IonicContact CZ-OD2 3.88Å; R74-D746 IonicContact NH1-OD1 2.63Å; R74-D746 PolarHBondContact NH1-OD1 3Å; R74-D746 VanDerWaalsContact NH2-CG 3.26Å; R74-D746 IonicContact NH2-OD1 2.91Å; R74-D746 PolarHBondContact NH2-OD1 2.73Å; R74-D746 IonicContact NH2-OD2 2.79Å; R74-D746 PolarHBondContact NH2-OD2 2.96Å; I742-D746 WeakPolarHBondContact O-CB 3.45Å; I742-D746 PolarHBondContact O-N 3.08Å; E744-D746 PolarHBondContact O-N 3.13Å
747	G	55.1	Low	53.4	Low	63 Å²	63	85.7 Å²	85.7	65%	0.649	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-9.4	172.9	0	0	0	0	0	115.5	E744 A745 P749	E744-G747 PolarHBondContact O-N 3.3Å; E744-G747 VanDerWaalsContact O-N 3.08Å; A745-G747 PolarHBondContact O-N 3.41Å; A745-G747 VanDerWaalsContact O-N 3.15Å; G747-P749 WeakPolarHBondContact O-CD 3.22Å
748	D	59.3	Low	52.6	Low	79 Å²	79	89.5 Å²	89.5	42%	0.422	51%	0.505	S	S	.	.			trans	-97.6	111.1	-176.3	-170.2	-21.2	0	0	0	111.8	E744 A745 T750 A751	E744-D748 PolarHBondContact O-N 3.16Å; A745-D748 PolarHBondContact O-N 2.89Å; A745-D748 VanDerWaalsContact O-N 3.15Å; D748-T750 PolarHBondContact O-N 3.16Å; D748-T750 VanDerWaalsContact O-N 3.12Å; D748-T750 WeakPolarHBondContact OD1-CA 3.45Å; D748-T750 WeakPolarHBondContact OD1-CB 3.4Å; D748-T750 PolarHBondContact OD1-N 3.33Å; D748-T750 PolarHBondContact OD1-OG1 3.18Å; D748-T750 PolarHBondContact OD2-OG1 2.63Å; D748-A751 HydrophobicContact CB-CB 4.25Å; D748-A751 WeakPolarHBondContact O-CB 2.98Å; D748-A751 PolarHBondContact O-N 2.95Å
749	P	53.4	Low	52.2	Low	132 Å²	132	90 Å²	90	86%	0.857	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	1.8	178.7	33.4	-37.2	0	0	0	114.1	G747	G747-P749 WeakPolarHBondContact O-CD 3.22Å
750	T	50	Low	51.8	Low	119 Å²	119	86.9 Å²	86.9	73%	0.73	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-3.3	174.3	68.2	0	0	0	0	113.6	D748	D748-T750 PolarHBondContact O-N 3.16Å; D748-T750 VanDerWaalsContact O-N 3.12Å; D748-T750 WeakPolarHBondContact OD1-CA 3.45Å; D748-T750 WeakPolarHBondContact OD1-CB 3.4Å; D748-T750 PolarHBondContact OD1-N 3.33Å; D748-T750 PolarHBondContact OD1-OG1 3.18Å; D748-T750 PolarHBondContact OD2-OG1 2.63Å
751	A	53.2	Low	51.2	Low	43 Å²	43	86 Å²	86	36%	0.355	50%	0.497	S	S	.	.	S	Bend	trans	-64.6	149	172.9	0	0	0	0	0	111.7	D748	D748-A751 HydrophobicContact CB-CB 4.25Å; D748-A751 WeakPolarHBondContact O-CB 2.98Å; D748-A751 PolarHBondContact O-N 2.95Å
752	P	47.3	Very low	50.1	Low	61 Å²	61	90.5 Å²	90.5	40%	0.396	52%	0.515	S	S	.	.			trans	-57.8	152.2	171.9	-23	34.1	0	0	0	112	Y754 I759	P752-Y754 HydrophobicContact CB-CD1 4.23Å; P752-Y754 HydrophobicContact CB-CD2 4.49Å; P752-Y754 HydrophobicContact CB-CE1 3.93Å; P752-Y754 HydrophobicContact CB-CE2 4.21Å; P752-Y754 HydrophobicContact CB-CG 4.49Å; P752-Y754 PolarHBondContact O-N 3.26Å; P752-I759 HydrophobicContact CG-CD1 4.24Å
753	P	43.3	Very low	49.4	Very low	118 Å²	118	94.7 Å²	94.7	77%	0.766	53%	0.534	S	S	*	.	S	Bend	trans	-71.5	2	-179.5	29.3	-34.4	0	0	0	114.3
754	Y	45.5	Very low	48.2	Very low	144 Å²	144	93.1 Å²	93.1	57%	0.565	52%	0.524	S	S	*	.	S	Bend	trans	-132.6	149.5	-178.9	57.1	-94.5	0	0	0	110.5	P752	P752-Y754 HydrophobicContact CB-CD1 4.23Å; P752-Y754 HydrophobicContact CB-CD2 4.49Å; P752-Y754 HydrophobicContact CB-CE1 3.93Å; P752-Y754 HydrophobicContact CB-CE2 4.21Å; P752-Y754 HydrophobicContact CB-CG 4.49Å; P752-Y754 PolarHBondContact O-N 3.26Å
755	D	43.6	Very low	47.2	Very low	63 Å²	63	100.7 Å²	100.7	34%	0.337	55%	0.549	S	S	.	.			trans	-89.4	141.3	173.5	-58.6	-6.4	0	0	0	108.9	R74 Y760	R74-D755 VanDerWaalsContact CD-CG 3.43Å; R74-D755 WeakPolarHBondContact CD-OD2 3.37Å; R74-D755 IonicContact CZ-OD1 2.71Å; R74-D755 IonicContact CZ-OD2 3.13Å; R74-D755 IonicContact NE-OD1 3.92Å; R74-D755 IonicContact NE-OD2 2.75Å; R74-D755 PolarHBondContact NE-OD2 2.98Å; R74-D755 VanDerWaalsContact NE-OD2 3.13Å; R74-D755 VanDerWaalsContact NH1-CG 3.27Å; R74-D755 IonicContact NH1-OD1 2.86Å; R74-D755 PolarHBondContact NH1-OD1 3.27Å; R74-D755 IonicContact NH1-OD2 2.81Å; R74-D755 PolarHBondContact NH1-OD2 3.11Å; D755-Y760 HydrophobicContact CB-CE2 4.23Å
756	S	41.9	Very low	46.8	Very low	39 Å²	39	102.8 Å²	102.8	27%	0.273	57%	0.572	S	S	.	*			trans	-138.2	154.8	170.6	90.8	0	0	0	0	110.9	Q758 I759	S756-Q758 PolarHBondContact O-N 2.99Å; S756-Q758 VanDerWaalsContact O-N 3.16Å; S756-Q758 PolarHBondContact OG-N 2.71Å; S756-I759 WeakPolarHBondContact O-CB 3.27Å; S756-I759 PolarHBondContact O-N 3.23Å
757	I	41	Very low	45.8	Very low	157 Å²	157	103.2 Å²	103.2	81%	0.805	58%	0.582	S	S	*	*	H	α-helix	trans	-57.7	-30.4	178.6	-99.4	171.9	0	0	0	112.1	I759 Y760 G761	I757-I759 PolarHBondContact O-N 2.81Å; I757-Y760 PolarHBondContact O-N 2.66Å; I757-G761 PolarHBondContact O-N 2.86Å
758	Q	40.5	Very low	45.1	Very low	175 Å²	175	108.4 Å²	108.4	82%	0.818	59%	0.593	S	S	*	*	H	α-helix	trans	-69.3	-16.2	177	-63.8	175.5	-15.3	0	0	113.8	S756	S756-Q758 PolarHBondContact O-N 2.99Å; S756-Q758 VanDerWaalsContact O-N 3.16Å; S756-Q758 PolarHBondContact OG-N 2.71Å
759	I	43.7	Very low	44.2	Very low	73 Å²	73	106.8 Å²	106.8	37%	0.374	59%	0.591	S	S	.	*	H	α-helix	trans	-80	-27.3	174.3	-61.6	176	0	0	0	110.9	P752 S756 I757	P752-I759 HydrophobicContact CG-CD1 4.24Å; S756-I759 WeakPolarHBondContact O-CB 3.27Å; S756-I759 PolarHBondContact O-N 3.23Å; I757-I759 PolarHBondContact O-N 2.81Å
760	Y	49.9	Very low	43.7	Very low	52 Å²	52	104 Å²	104	20%	0.204	59%	0.587	C	S	.	*	H	α-helix	trans	-102	-25.2	-178.3	-56.4	-62.2	0	0	0	113.7	R741 I742 D755 I757 Y762	R741-Y760 HydrophobicContact CB-CD1 3.76Å; R741-Y760 HydrophobicContact CB-CE1 3.89Å; I742-Y760 HydrophobicContact CG1-CE1 4.36Å; D755-Y760 HydrophobicContact CB-CE2 4.23Å; I757-Y760 PolarHBondContact O-N 2.66Å; Y760-Y762 PolarHBondContact O-N 2.79Å
761	G	46	Very low	43.4	Very low	49 Å²	49	101 Å²	101	51%	0.505	57%	0.57	S	S	.	*			trans	-79.4	99.1	171.2	0	0	0	0	0	112.3	I757	I757-G761 PolarHBondContact O-N 2.86Å
762	Y	37.4	Very low	42.9	Very low	198 Å²	198	104.7 Å²	104.7	78%	0.776	58%	0.584	S	S	*	*			trans	-130.6	111.6	173.8	-177.2	-94.9	0	0	0	112.7	Y760 G764	Y760-Y762 PolarHBondContact O-N 2.79Å; Y762-G764 PolarHBondContact O-N 3.5Å
763	E	45.3	Very low	42.6	Very low	144 Å²	144	104.7 Å²	104.7	67%	0.673	59%	0.585	S	S	*	*			trans	-84.8	75.4	-176.4	-61.5	-166.9	161.2	0	0	112.8	S773	E763-S773 WeakPolarHBondContact OE1-CB 3.42Å; E763-S773 PolarHBondContact OE1-OG 3.48Å
764	G	37.2	Very low	42.7	Very low	38 Å²	38	102.5 Å²	102.5	39%	0.392	57%	0.573	S	S	.	*			trans	-76.7	121.7	168.4	0	0	0	0	0	112.1	Y762 G766	Y762-G764 PolarHBondContact O-N 3.5Å; G764-G766 PolarHBondContact O-N 3.46Å
765	R	41.2	Very low	42.3	Very low	264 Å²	264	102.2 Å²	102.2	100%	0.996	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.8	112.1	178.2	-74.6	-175.9	174	-175.4	-2.2	112.2
766	G	48.4	Very low	42.1	Very low	67 Å²	67	108 Å²	108	69%	0.691	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	120.7	14.7	168.4	0	0	0	0	0	117.3	G764	G764-G766 PolarHBondContact O-N 3.46Å
767	S	37.6	Very low	41.8	Very low	90 Å²	90	109.6 Å²	109.6	63%	0.629	62%	0.616	S	S	*	*			trans	-61.8	144.2	163.5	-174.4	0	0	0	0	111	A769	S767-A769 PolarHBondContact OG-N 2.91Å; S767-A769 PolarHBondContact OG-O 2.91Å
768	L	42.4	Very low	41.8	Very low	171 Å²	171	108.9 Å²	108.9	90%	0.895	62%	0.619	S	S	*	*			trans	-112.6	-1.1	171.3	-89.2	161.3	0	0	0	112.7
769	A	39.8	Very low	41.5	Very low	46 Å²	46	106 Å²	106	38%	0.38	61%	0.613	S	S	.	*	S	Bend	trans	-92.1	139.8	162	0	0	0	0	0	108.5	S767	S767-A769 PolarHBondContact OG-N 2.91Å; S767-A769 PolarHBondContact OG-O 2.91Å
770	G	43.3	Very low	41.4	Very low	74 Å²	74	108.4 Å²	108.4	76%	0.763	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-59.2	147.8	-177.3	0	0	0	0	0	112.8
771	S	42.5	Very low	41.1	Very low	54 Å²	54	115.3 Å²	115.3	38%	0.378	67%	0.666	S	S	.	*	P	Polyproline II helix	trans	-79.1	142.8	-179.6	-166.2	0	0	0	0	111.1	S773 S774	S771-S773 PolarHBondContact O-N 2.95Å; S771-S773 WeakPolarHBondContact OG-CB 3.34Å; S771-S773 PolarHBondContact OG-N 3.41Å; S771-S773 VanDerWaalsContact OG-N 3.16Å; S771-S773 PolarHBondContact OG-OG 2.97Å; S771-S774 VanDerWaalsContact O-CB 3.27Å; S771-S774 WeakPolarHBondContact O-CB 3.35Å; S771-S774 PolarHBondContact O-N 3.32Å; S771-S774 VanDerWaalsContact O-N 3.11Å; S771-S774 PolarHBondContact O-OG 3.48Å
772	L	42.7	Very low	40.7	Very low	122 Å²	122	117 Å²	117	64%	0.639	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-68.1	-15.6	166.1	-72.2	168.3	0	0	0	112	V734 S774	V734-L772 HydrophobicContact CG1-CD1 4.19Å; L772-S774 PolarHBondContact O-N 2.63Å
773	S	40.8	Very low	41	Very low	61 Å²	61	115.7 Å²	115.7	43%	0.427	68%	0.676	S	S	.	*	G	3₁₀ helix	trans	-66.4	-14.3	168.1	-35.9	0	0	0	0	113.6	E763 S771 L775	E763-S773 WeakPolarHBondContact OE1-CB 3.42Å; E763-S773 PolarHBondContact OE1-OG 3.48Å; S771-S773 PolarHBondContact O-N 2.95Å; S771-S773 WeakPolarHBondContact OG-CB 3.34Å; S771-S773 PolarHBondContact OG-N 3.41Å; S771-S773 VanDerWaalsContact OG-N 3.16Å; S771-S773 PolarHBondContact OG-OG 2.97Å; S773-L775 PolarHBondContact O-N 3.04Å
774	S	45.2	Very low	41.1	Very low	72 Å²	72	114.3 Å²	114.3	50%	0.503	67%	0.673	S	S	.	*	G	3₁₀ helix	trans	-78.7	8.3	-174.1	-60.1	0	0	0	0	114.6	S771 L772 S777	S771-S774 VanDerWaalsContact O-CB 3.27Å; S771-S774 WeakPolarHBondContact O-CB 3.35Å; S771-S774 PolarHBondContact O-N 3.32Å; S771-S774 VanDerWaalsContact O-N 3.11Å; S771-S774 PolarHBondContact O-OG 3.48Å; L772-S774 PolarHBondContact O-N 2.63Å; S774-S777 PolarHBondContact O-OG 2.95Å
775	L	38.7	Very low	41.8	Very low	138 Å²	138	118 Å²	118	72%	0.723	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-91.5	-10	179.3	-75.3	166.6	0	0	0	114.4	S773	S773-L775 PolarHBondContact O-N 3.04Å
776	E	38.8	Very low	42.5	Very low	184 Å²	184	108.7 Å²	108.7	86%	0.86	65%	0.649	S	S	*	*	S	Bend	trans	-110.2	-3.1	175.9	-66.8	-171.1	144.6	0	0	113.6	V778	E776-V778 PolarHBondContact O-N 2.93Å
777	S	34.5	Very low	42.8	Very low	73 Å²	73	109 Å²	109	51%	0.51	64%	0.635	S	S	.	*			trans	-79.6	88	178.6	56.5	0	0	0	0	111.6	S774 T779	S774-S777 PolarHBondContact O-OG 2.95Å; S777-T779 VanDerWaalsContact C-N 3.28Å; S777-T779 PolarHBondContact O-N 2.98Å
778	V	41.3	Very low	43.9	Very low	142 Å²	142	110.4 Å²	110.4	86%	0.861	63%	0.627	S	S	*	*			trans	-68.7	85.3	169.6	-175.1	0	0	0	0	109.9	E776	E776-V778 PolarHBondContact O-N 2.93Å
779	T	34.4	Very low	44.2	Very low	114 Å²	114	103.3 Å²	103.3	70%	0.699	59%	0.59	S	S	*	*			trans	-105.1	120.3	163.7	52.3	0	0	0	0	108.9	S777	S777-T779 VanDerWaalsContact C-N 3.28Å; S777-T779 PolarHBondContact O-N 2.98Å
780	T	42.6	Very low	45	Very low	124 Å²	124	106.8 Å²	106.8	76%	0.761	60%	0.598	S	S	*	*	S	Bend	trans	-63.5	154.1	-175	48.6	0	0	0	0	113.8
781	E	42.9	Very low	45.3	Very low	197 Å²	197	107.8 Å²	107.8	92%	0.921	59%	0.594	S	S	*	*	S	Bend	trans	70.1	60.6	169.6	-57.8	-172.7	158.2	0	0	116.9
782	S	38.1	Very low	45.6	Very low	84 Å²	84	112.3 Å²	112.3	59%	0.587	60%	0.602	S	S	*	*			trans	-153.7	124.8	148.2	62.9	0	0	0	0	110.6	L784	S782-L784 PolarHBondContact O-N 3.15Å
783	D	43.2	Very low	46	Very low	171 Å²	171	107.9 Å²	107.9	91%	0.914	59%	0.586	S	S	*	*			trans	-64.9	121.1	175.6	-59.7	-55.4	0	0	0	110.3	D785	D783-D785 PolarHBondContact O-N 2.78Å
784	L	48.3	Very low	46.4	Very low	114 Å²	114	110.6 Å²	110.6	60%	0.597	60%	0.603	S	S	*	*			trans	-93	100	-179	-68	174.4	0	0	0	109.6	S782 Y786	S782-L784 PolarHBondContact O-N 3.15Å; L784-Y786 HydrophobicContact CB-CD2 4.45Å; L784-Y786 HydrophobicContact CB-CE2 3.68Å; L784-Y786 WeakPolarHBondContact CD1-OH 3.26Å; L784-Y786 WeakPolarHBondContact O-CD2 3.01Å; L784-Y786 VanDerWaalsContact O-CE2 3.3Å; L784-Y786 WeakPolarHBondContact O-CE2 3.42Å; L784-Y786 PolarHBondContact O-N 3.46Å
785	D	51.6	Low	46.3	Very low	116 Å²	116	118.2 Å²	118.2	62%	0.62	62%	0.62	S	S	*	*			trans	-72	120.1	171.5	177.1	6.7	0	0	0	110.7	D783 D787 Y788	D783-D785 PolarHBondContact O-N 2.78Å; D785-D787 WeakPolarHBondContact OD1-CB 3.3Å; D785-D787 PolarHBondContact OD1-N 2.67Å; D785-Y788 WeakPolarHBondContact O-CD1 3.46Å; D785-Y788 WeakPolarHBondContact O-CE1 3.36Å
786	Y	55.2	Low	46.6	Very low	68 Å²	68	115.9 Å²	115.9	27%	0.267	60%	0.604	S	S	.	*			trans	-105.1	-0.2	179.3	-66.9	-74.9	0	0	0	114	L784 Y788 L789 Y803	L784-Y786 HydrophobicContact CB-CD2 4.45Å; L784-Y786 HydrophobicContact CB-CE2 3.68Å; L784-Y786 WeakPolarHBondContact CD1-OH 3.26Å; L784-Y786 WeakPolarHBondContact O-CD2 3.01Å; L784-Y786 VanDerWaalsContact O-CE2 3.3Å; L784-Y786 WeakPolarHBondContact O-CE2 3.42Å; L784-Y786 PolarHBondContact O-N 3.46Å; Y786-Y788 PolarHBondContact O-N 3.12Å; Y786-Y788 VanDerWaalsContact O-N 3.15Å; Y786-L789 HydrophobicContact CD1-CD1 4.27Å; Y786-L789 WeakPolarHBondContact O-CB 3.38Å; Y786-L789 WeakPolarHBondContact O-CG 3.42Å; Y786-L789 PolarHBondContact O-N 3.49Å; Y786-L789 VanDerWaalsContact O-N 3.08Å; Y786-Y803 WeakPolarHBondContact CD2-O 3.32Å
787	D	56	Low	47.3	Very low	74 Å²	74	114.8 Å²	114.8	40%	0.396	59%	0.593	S	S	.	*	G	3₁₀ helix	trans	-66.4	-21.1	-173.2	-101	-10.8	0	0	0	113.5	D785 L789 Q790	D785-D787 WeakPolarHBondContact OD1-CB 3.3Å; D785-D787 PolarHBondContact OD1-N 2.67Å; D787-L789 PolarHBondContact O-N 2.94Å; D787-L789 VanDerWaalsContact O-N 3.1Å; D787-Q790 WeakPolarHBondContact O-CB 3.46Å; D787-Q790 WeakPolarHBondContact O-CG 3.42Å; D787-Q790 PolarHBondContact O-N 3.08Å; D787-Q790 PolarHBondContact OD1-NE2 2.99Å
788	Y	58.7	Low	48.1	Very low	120 Å²	120	119.6 Å²	119.6	47%	0.471	60%	0.604	S	S	.	*	G	3₁₀ helix	trans	-57.7	-25.6	173.3	74.5	-90.7	0	0	0	113	D785 Y786 Q790 S791 W792	D785-Y788 WeakPolarHBondContact O-CD1 3.46Å; D785-Y788 WeakPolarHBondContact O-CE1 3.36Å; Y786-Y788 PolarHBondContact O-N 3.12Å; Y786-Y788 VanDerWaalsContact O-N 3.15Å; Y788-Q790 PolarHBondContact O-N 3.49Å; Y788-S791 WeakPolarHBondContact O-CB 3.48Å; Y788-S791 PolarHBondContact O-N 3.07Å; Y788-S791 PolarHBondContact O-OG 3.25Å; Y788-W792 HydrophobicContact CD2-CZ2 4.06Å; Y788-W792 HydrophobicContact CE2-CH2 4.11Å; Y788-W792 AromaticContact CE2-CZ2 3.67Å; Y788-W792 HydrophobicContact CE2-CZ2 3.67Å
789	L	50.2	Low	48.3	Very low	22 Å²	22	116.8 Å²	116.8	12%	0.115	58%	0.584	C	S	.	*	G	3₁₀ helix	trans	-62.8	-23.4	176.5	-64.5	176.4	0	0	0	112.9	Y786 D787 S791 W792 A800	Y786-L789 HydrophobicContact CD1-CD1 4.27Å; Y786-L789 WeakPolarHBondContact O-CB 3.38Å; Y786-L789 WeakPolarHBondContact O-CG 3.42Å; Y786-L789 PolarHBondContact O-N 3.49Å; Y786-L789 VanDerWaalsContact O-N 3.08Å; D787-L789 PolarHBondContact O-N 2.94Å; D787-L789 VanDerWaalsContact O-N 3.1Å; L789-S791 PolarHBondContact O-N 3.4Å; L789-W792 HydrophobicContact CD2-CD2 4.26Å; L789-W792 HydrophobicContact CD2-CE3 3.96Å; L789-W792 HydrophobicContact CD2-CH2 4.42Å; L789-W792 HydrophobicContact CD2-CZ3 4.04Å; L789-W792 PolarHBondContact O-N 3.15Å; L789-A800 HydrophobicContact CB-CB 4.03Å
790	Q	56.5	Low	49.3	Very low	119 Å²	119	111.6 Å²	111.6	56%	0.556	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-60.6	-27.9	173.7	-60.9	-169.9	37.7	0	0	112.1	D787 Y788 A800	D787-Q790 WeakPolarHBondContact O-CB 3.46Å; D787-Q790 WeakPolarHBondContact O-CG 3.42Å; D787-Q790 PolarHBondContact O-N 3.08Å; D787-Q790 PolarHBondContact OD1-NE2 2.99Å; Y788-Q790 PolarHBondContact O-N 3.49Å; Q790-A800 HydrophobicContact CG-CB 3.77Å
791	S	49.1	Very low	50.1	Low	95 Å²	95	110.2 Å²	110.2	66%	0.664	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-77.4	-16.3	-179	72.6	0	0	0	0	114.3	Y788 L789 G793	Y788-S791 WeakPolarHBondContact O-CB 3.48Å; Y788-S791 PolarHBondContact O-N 3.07Å; Y788-S791 PolarHBondContact O-OG 3.25Å; L789-S791 PolarHBondContact O-N 3.4Å; S791-G793 PolarHBondContact O-N 2.69Å
792	W	48.1	Very low	50.2	Low	148 Å²	148	106.4 Å²	106.4	56%	0.561	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-82.3	5.3	-174.7	-66.2	9.6	0	0	0	113.7	Y788 L789 F796	Y788-W792 HydrophobicContact CD2-CZ2 4.06Å; Y788-W792 HydrophobicContact CE2-CH2 4.11Å; Y788-W792 AromaticContact CE2-CZ2 3.67Å; Y788-W792 HydrophobicContact CE2-CZ2 3.67Å; L789-W792 HydrophobicContact CD2-CD2 4.26Å; L789-W792 HydrophobicContact CD2-CE3 3.96Å; L789-W792 HydrophobicContact CD2-CH2 4.42Å; L789-W792 HydrophobicContact CD2-CZ3 4.04Å; L789-W792 PolarHBondContact O-N 3.15Å; W792-F796 HydrophobicContact CB-CB 4.29Å; W792-F796 HydrophobicContact CB-CD2 3.79Å; W792-F796 HydrophobicContact CB-CE2 4.48Å; W792-F796 HydrophobicContact CB-CG 4.21Å; W792-F796 WeakPolarHBondContact O-CD2 3.37Å
793	G	51.9	Low	50.8	Low	29 Å²	29	108.7 Å²	108.7	30%	0.299	52%	0.523	S	S	.	.			trans	92.7	175.8	171.7	0	0	0	0	0	114.7	S791 R795 F796	S791-G793 PolarHBondContact O-N 2.69Å; G793-R795 PolarHBondContact O-N 2.93Å; G793-F796 PolarHBondContact O-N 3.01Å; G793-F796 VanDerWaalsContact O-N 3.09Å
794	P	48.8	Very low	51.3	Low	119 Å²	119	101.5 Å²	101.5	77%	0.773	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-12.9	-159.1	24.3	-35.1	0	0	0	115.6
795	R	43.5	Very low	51.4	Low	232 Å²	232	101.9 Å²	101.9	88%	0.875	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-28.6	176.5	-66.8	-174.3	176.9	-164.5	-2.3	113.3	G793	G793-R795 PolarHBondContact O-N 2.93Å
796	F	45.3	Very low	51	Low	88 Å²	88	103.9 Å²	103.9	39%	0.386	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-5.1	179.9	-61.9	-78.4	0	0	0	113.1	W792 G793 K798 L799 A800	W792-F796 HydrophobicContact CB-CB 4.29Å; W792-F796 HydrophobicContact CB-CD2 3.79Å; W792-F796 HydrophobicContact CB-CE2 4.48Å; W792-F796 HydrophobicContact CB-CG 4.21Å; W792-F796 WeakPolarHBondContact O-CD2 3.37Å; G793-F796 PolarHBondContact O-N 3.01Å; G793-F796 VanDerWaalsContact O-N 3.09Å; F796-K798 VanDerWaalsContact C-N 3.28Å; F796-K798 PolarHBondContact O-N 3.41Å; F796-L799 HydrophobicContact CD1-CD1 4.23Å; F796-L799 WeakPolarHBondContact O-CB 3.49Å; F796-L799 PolarHBondContact O-N 3.15Å; F796-A800 PolarHBondContact O-N 3.04Å; F796-A800 VanDerWaalsContact O-N 3.11Å
797	R	53.8	Low	50.4	Low	162 Å²	162	108 Å²	108	61%	0.611	53%	0.526	S	S	*	.	H	α-helix	trans	-53.3	-43.1	179	-160.2	-179.3	-160.5	138.1	11.6	112.9	L799 A800 D801	R797-L799 PolarHBondContact O-N 3.22Å; R797-A800 PolarHBondContact O-N 2.78Å; R797-D801 WeakPolarHBondContact O-CB 3.46Å; R797-D801 PolarHBondContact O-N 2.97Å
798	K	49.8	Very low	49.3	Very low	173 Å²	173	110.5 Å²	110.5	75%	0.752	55%	0.548	S	S	*	.	H	α-helix	trans	-69.7	-13.2	179.1	-154.4	-174.1	178.4	-170.2	0	114	F796	F796-K798 VanDerWaalsContact C-N 3.28Å; F796-K798 PolarHBondContact O-N 3.41Å
799	L	45.7	Very low	48	Very low	84 Å²	84	109.8 Å²	109.8	44%	0.44	56%	0.561	S	S	.	*	H	α-helix	trans	-87.1	-44.7	169.5	-90.7	151.4	0	0	0	110.5	F796 R797 D801 L802 Y803	F796-L799 HydrophobicContact CD1-CD1 4.23Å; F796-L799 WeakPolarHBondContact O-CB 3.49Å; F796-L799 PolarHBondContact O-N 3.15Å; R797-L799 PolarHBondContact O-N 3.22Å; L799-D801 VanDerWaalsContact C-N 3.33Å; L799-D801 PolarHBondContact O-N 3.45Å; L799-L802 PolarHBondContact O-N 3.43Å; L799-L802 VanDerWaalsContact O-N 3.08Å; L799-Y803 HydrophobicContact CD2-CD2 4.09Å; L799-Y803 HydrophobicContact CD2-CE2 3.87Å; L799-Y803 WeakPolarHBondContact O-CD2 3.19Å; L799-Y803 PolarHBondContact O-N 3.22Å; L799-Y803 VanDerWaalsContact O-N 3.14Å
800	A	56.3	Low	47.3	Very low	5 Å²	5	114.9 Å²	114.9	4%	0.041	59%	0.592	C	S	.	*	H	α-helix	trans	-59.6	-42.2	173	0	0	0	0	0	112.2	L789 Q790 F796 R797 L802 G804	L789-A800 HydrophobicContact CB-CB 4.03Å; Q790-A800 HydrophobicContact CG-CB 3.77Å; F796-A800 PolarHBondContact O-N 3.04Å; F796-A800 VanDerWaalsContact O-N 3.11Å; R797-A800 PolarHBondContact O-N 2.78Å; A800-L802 PolarHBondContact O-N 2.73Å; A800-L802 VanDerWaalsContact O-N 3.17Å; A800-G804 WeakPolarHBondContact O-CA 3.42Å; A800-G804 PolarHBondContact O-N 3.33Å
801	D	58.2	Low	46.1	Very low	95 Å²	95	116.4 Å²	116.4	51%	0.508	60%	0.603	S	S	.	*	H	α-helix	trans	-64.5	-14.5	175.4	-77.5	-49.1	0	0	0	114.1	R797 L799 K806	R797-D801 WeakPolarHBondContact O-CB 3.46Å; R797-D801 PolarHBondContact O-N 2.97Å; L799-D801 VanDerWaalsContact C-N 3.33Å; L799-D801 PolarHBondContact O-N 3.45Å; D801-K806 IonicContact OD1-NZ 2.72Å
802	L	46.6	Very low	45.3	Very low	117 Å²	117	118.4 Å²	118.4	61%	0.613	61%	0.606	S	S	*	*	H	α-helix	trans	-103.3	-29.1	-176.1	-143.8	92.3	0	0	0	113.7	L799 A800	L799-L802 PolarHBondContact O-N 3.43Å; L799-L802 VanDerWaalsContact O-N 3.08Å; A800-L802 PolarHBondContact O-N 2.73Å; A800-L802 VanDerWaalsContact O-N 3.17Å
803	Y	49.6	Very low	44.5	Very low	131 Å²	131	121 Å²	121	51%	0.514	63%	0.625	S	S	.	*	H	α-helix	trans	-120	-9.1	-175.8	-63.8	-77.8	0	0	0	113.9	Y786 L799	Y786-Y803 WeakPolarHBondContact CD2-O 3.32Å; L799-Y803 HydrophobicContact CD2-CD2 4.09Å; L799-Y803 HydrophobicContact CD2-CE2 3.87Å; L799-Y803 WeakPolarHBondContact O-CD2 3.19Å; L799-Y803 PolarHBondContact O-N 3.22Å; L799-Y803 VanDerWaalsContact O-N 3.14Å
804	G	55	Low	43.8	Very low	20 Å²	20	127.3 Å²	127.3	21%	0.206	65%	0.652	C	S	.	*	S	Bend	trans	-74.9	133.4	172	0	0	0	0	0	112	A800 K806	A800-G804 WeakPolarHBondContact O-CA 3.42Å; A800-G804 PolarHBondContact O-N 3.33Å; G804-K806 PolarHBondContact O-N 3.42Å
805	T	48.8	Very low	43.2	Very low	122 Å²	122	129.3 Å²	129.3	75%	0.748	66%	0.656	S	S	*	*			trans	-71.7	105	-178.4	45.2	0	0	0	0	111.8
806	K	44.6	Very low	42.7	Very low	158 Å²	158	121.7 Å²	121.7	69%	0.687	65%	0.65	S	S	*	*			trans	-85.8	106.6	165.8	-82.5	174.9	179.7	148.5	0	110.2	D801 G804 C808	D801-K806 IonicContact OD1-NZ 2.72Å; G804-K806 PolarHBondContact O-N 3.42Å; K806-C808 PolarHBondContact O-N 3.21Å
807	D	42.3	Very low	42.4	Very low	154 Å²	154	127.2 Å²	127.2	82%	0.824	68%	0.677	S	S	*	*			trans	-57.7	119.7	168.4	-75.6	-43.1	0	0	0	110.6
808	C	32.9	Very low	41.6	Very low	128 Å²	128	127 Å²	127	87%	0.865	69%	0.687	S	S	*	*			trans	-141.9	73.5	173.7	-83.7	0	0	0	0	109.9	K806	K806-C808 PolarHBondContact O-N 3.21Å
809	S	32	Very low	40.7	Very low	105 Å²	105	127.6 Å²	127.6	73%	0.734	71%	0.714	S	S	*	*			trans	-133.3	149.1	164	65.5	0	0	0	0	107.3
810	V	33.8	Very low	40.4	Very low	128 Å²	128	129.8 Å²	129.8	78%	0.776	73%	0.727	S	S	*	*			cis	-135.7	135.1	12	174.5	0	0	0	0	109.9
811	L	31.9	Very low	39.6	Very low	152 Å²	152	136.3 Å²	136.3	80%	0.796	76%	0.763	S	S	*	*			trans	-159.7	134.2	158.6	-69	-178.3	0	0	0	105.2
812	D	32.3	Very low	38.5	Very low	136 Å²	136	138.6 Å²	138.6	73%	0.727	78%	0.778	S	S	*	*			cis	-143.5	153	-11.8	-73.5	-54.5	0	0	0	107.2
813	E	31.9	Very low	38.1	Very low	203 Å²	203	139.9 Å²	139.9	95%	0.949	79%	0.787	S	S	*	*			trans	-120.9	133.5	156	-82.6	-169.2	147.5	0	0	107.8
814	D	36.7	Very low	37.4	Very low	161 Å²	161	140.4 Å²	140.4	86%	0.861	80%	0.804	S	S	*	*			trans	-95.6	158.4	-167	-160.4	5.6	0	0	0	112.3
815	D	37	Very low	36.2	Very low	161 Å²	161	148.5 Å²	148.5	86%	0.861	84%	0.844	S	S	*	*			trans	-74.3	153.9	178.3	-78.8	-53.5	0	0	0	112.1
816	G	33.1	Very low	35.3	Very low	72 Å²	72	150.4 Å²	150.4	74%	0.742	85%	0.851	S	S	*	*			trans	-179.9	92.4	173.5	0	0	0	0	0	117
817	E	38.5	Very low	34.6	Very low	205 Å²	205	149.8 Å²	149.8	96%	0.958	86%	0.864	S	S	*	*			trans	72.1	121.9	176	-52.1	-172.5	159.9	0	0	114.4
818	D	36.8	Very low	33.9	Very low	156 Å²	156	149.4 Å²	149.4	83%	0.834	87%	0.867	S	S	*	*			cis	-136.3	158.8	34.7	-160.5	1.4	0	0	0	113.8
819	S	30.1	Very low	34	Very low	186 Å²	186	151.4 Å²	151.4	100%	1.301	87%	0.867	S	S	*	*			trans	70.5	0	179.3	70.8	0	0	0	0	121

Retrieved 819 of 819 residues in 712.8 ms (Link to these results)

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