A0A087YG64_POEFO Loading...

Sortilin related VPS10 domain containing receptor 1

AlphaFold DB , UniProt , Accession A0A087YG64, Species POEFO (Poecilia formosa, Amazon molly), Gene SORCS1, Length 1,219 aa.

						>A0A087YG64_POEFO|A0A087YG64|SORCS1
MMETRLGCCFFLLFFSEWICLLSLTSILGGTKAEVRCIRQCQQPLVVAVPRERAAPDQAGSDAAPGEEFVGFVEESFSASGDGEDGAAELVASEESSFKLQPRPGENETSGPQGDGDHQKLSHRPPGASGPSPNNASEERGNSFNSTGNADAVAWRVRRSAETWSGFRGEGVEDASVSDQEEFELTSSTFALAGDTAHNQAMVHWSGQNSSVILMLTKYYDFNSGRVTESSLWRSTDYGTTYEKLNEKVGTKSILSYLYVSPNNKRKIMLLTDPEVESSLLISLDEGASYQKHSLGFDILSLLFHPEQEDWILAYSHDQKLYVSVEFGKRWQLVHDNVVPNRFYWSRLGLDKDQGMIHLEITVSDGRSQYITCKLQNCSDGNKGKPFPGFIIPNSLVVQDEYVFIQVSVSGQAVHYVSYKRQAFYPMKLPKYTLPKDLQIISTDENQVVAAIQDWHQNESYNLYMSDYRGLFFTLMLEDVVSTGGPEDNVMIDLYEVAGIKGVFLSNKVVENQVKTYITYNKGRDWHLLQAPTTDLQGNKVYCEQPYCSLHLHLHVSENPYASGNIVSKDTAPGVIIASGVVGPELSSVNVSIFITSDAGNTWREVFQEEYSVFFLNQGGSLVAIRHTPLPIRHIWLSFDEGRNWDKYSFTSSPLYVDGVLGEPGEDILIMTIFGHFSHRSEWQLLKIDFRPIFEKRCTSEDYMTWQLHNEGEVCIMGMKRIFQKLRANVRCVKARDQYISQMSDSCVCTEADFECDYGFERQVDGSCTSAFWFIPSASTQDCITGDSFFNTTGYRKALSNNCTEGSLLKYSPRQQKCPSQAPRGLQLFTSEGTFVATLGRNVTFLVFLEEGLSSMTSITVDFGDGTAISYVNISSIDDGVKHIYNKVGIYQVSATASNHLGFDRVFLYLHVNCHLEQVQLSAPLVVIKDKAVNFTTTLRPSSVGTVTYFWWFDNKTEPVVTLDGAITFTFSREGSHIVTVQALAGNTVHQDQIRVAVYDYFRSHHLVFSSNLDEMNPGVSEWREDIGRVVKTCIVQVTGINEDQLLVKLFPGLPTTAEVFIVPERRSRDGGMNEKWAHLDQVLLSALNQDLIEFTIKPGLQVNVYATRLSPAPLVDGSDSGHSGTAVIMLVSVVLMGLAIFVIYKFKRKIPGMNTYATEKPDKEQEVIPAVTSIAVPNPEGDELTSLDHVDIQLDSKSRGYLPSHTDIKLSDEAPRVF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.9	Very low	25.8	Very low	227 Å²	227	156.7 Å²	156.7	100%	1.118	81%	0.812	S	S	*	*				0	110.9	0	-68.1	161.5	-179.3	0	0	105.2
2	M	23.9	Very low	25.7	Very low	155 Å²	155	156.2 Å²	156.2	76%	0.764	81%	0.81	S	S	*	*				70.4	129.4	82.7	-66.9	169.5	78.7	0	0	111.3
3	E	25.8	Very low	25.6	Very low	152 Å²	152	155.8 Å²	155.8	71%	0.71	81%	0.809	S	S	*	*			cis	-156.3	124.8	-2.7	-99.8	166.8	126.9	0	0	106.8
4	T	29.6	Very low	25.7	Very low	114 Å²	114	157.7 Å²	157.7	70%	0.699	81%	0.808	S	S	*	*				60.2	128.6	89.9	63.7	0	0	0	0	119.4
5	R	30.4	Very low	25.7	Very low	232 Å²	232	161.9 Å²	161.9	88%	0.875	82%	0.819	S	S	*	*			trans	72.1	151.3	162.2	-61.5	-179.1	170.4	-159.4	-3.4	116.1
6	L	27.5	Very low	25.5	Very low	158 Å²	158	158.3 Å²	158.3	83%	0.827	81%	0.813	S	S	*	*			cis	-147.5	178.9	-8.7	-139.6	66.4	0	0	0	106.5
7	G	23.4	Very low	25.5	Very low	63 Å²	63	159.2 Å²	159.2	65%	0.649	81%	0.813	S	S	*	*			cis	-177.3	-160.7	8.4	0	0	0	0	0	111.8
8	C	23	Very low	25.5	Very low	127 Å²	127	164.8 Å²	164.8	86%	0.858	82%	0.823	S	S	*	*			trans	-127.7	169.4	-175.1	-64.4	0	0	0	0	114.2
9	C	23.1	Very low	25.6	Very low	108 Å²	108	164.5 Å²	164.5	73%	0.73	82%	0.822	S	S	*	*			trans	75.7	109.3	159.7	-59.4	0	0	0	0	119.2
10	F	24.4	Very low	25.4	Very low	218 Å²	218	161.8 Å²	161.8	96%	0.956	82%	0.818	S	S	*	*				-138.5	139.7	123.5	-113	-82.4	0	0	0	109.8
11	F	23.4	Very low	25.5	Very low	170 Å²	170	161.8 Å²	161.8	75%	0.746	82%	0.82	S	S	*	*			trans	-91.1	162.9	179.5	-104.5	-98.9	0	0	0	111.3
12	L	24.8	Very low	25.4	Very low	150 Å²	150	159.3 Å²	159.3	79%	0.785	81%	0.81	S	S	*	*			trans	27.8	124.5	150.4	-72.3	162.8	0	0	0	119.4
13	L	24.1	Very low	25.5	Very low	152 Å²	152	156.3 Å²	156.3	80%	0.796	80%	0.804	S	S	*	*				-173.7	173.3	126.4	-102	161.1	0	0	0	111.3
14	F	28.1	Very low	25.5	Very low	182 Å²	182	156.4 Å²	156.4	80%	0.798	81%	0.809	S	S	*	*			trans	69.9	62.9	174.6	-59.7	-74.6	0	0	0	118
15	F	24.9	Very low	25.5	Very low	221 Å²	221	157 Å²	157	97%	0.969	81%	0.813	S	S	*	*			trans	-125.1	76.1	146.6	-123.3	-81.2	0	0	0	109.1
16	S	22.8	Very low	25.3	Very low	104 Å²	104	150.8 Å²	150.8	73%	0.727	81%	0.805	S	S	*	*			trans	-164.3	149	170.7	-170.4	0	0	0	0	110.3
17	E	24.6	Very low	25.4	Very low	174 Å²	174	150.2 Å²	150.2	81%	0.813	80%	0.801	S	S	*	*			trans	64.4	109.3	-177.7	-56.7	-163.6	156	0	0	117.1
18	W	25.8	Very low	25.6	Very low	260 Å²	260	155.2 Å²	155.2	99%	0.985	81%	0.812	S	S	*	*				-163.3	96.8	116.3	-113.8	55.3	0	0	0	108.3
19	I	27.8	Very low	25.7	Very low	158 Å²	158	152.8 Å²	152.8	81%	0.81	81%	0.808	S	S	*	*			trans	-127.3	145.9	178.4	-76.7	178	0	0	0	108.1
20	C	22.6	Very low	25.9	Very low	111 Å²	111	151.6 Å²	151.6	75%	0.75	82%	0.815	S	S	*	*			trans	62.4	91.9	173.5	-74.1	0	0	0	0	116.8
21	L	25.8	Very low	26	Very low	162 Å²	162	148 Å²	148	85%	0.848	81%	0.81	S	S	*	*				169.1	112.9	94.7	-92.5	155.6	0	0	0	113.3
22	L	26.7	Very low	26.2	Very low	175 Å²	175	149.9 Å²	149.9	92%	0.916	82%	0.818	S	S	*	*				-167.7	159.6	124.4	-104.9	164.9	0	0	0	109.4
23	S	26.5	Very low	26.2	Very low	91 Å²	91	146.8 Å²	146.8	64%	0.636	82%	0.815	S	S	*	*			trans	-144.6	168.8	-161.6	55.8	0	0	0	0	113.9
24	L	26.6	Very low	26.2	Very low	155 Å²	155	146.3 Å²	146.3	81%	0.812	81%	0.808	S	S	*	*			trans	83.1	150.2	165.3	-67.9	153.5	0	0	0	119.2
25	T	28.6	Very low	26.2	Very low	127 Å²	127	143.5 Å²	143.5	78%	0.779	81%	0.806	S	S	*	*			trans	63.6	101.5	173.1	51.1	0	0	0	0	116.5
26	S	26.4	Very low	26.1	Very low	101 Å²	101	142.4 Å²	142.4	71%	0.706	80%	0.795	S	S	*	*				89.8	139	68.1	68.1	0	0	0	0	113
27	I	30.4	Very low	26.3	Very low	146 Å²	146	142.6 Å²	142.6	75%	0.749	80%	0.795	S	S	*	*			cis	-157.8	160.4	9.5	-126.6	165.7	0	0	0	111.4
28	L	27	Very low	26.6	Very low	167 Å²	167	141.9 Å²	141.9	87%	0.874	80%	0.796	S	S	*	*			trans	20.7	131.2	168.5	-83.2	67.7	0	0	0	121.7
29	G	26	Very low	27.2	Very low	76 Å²	76	139.5 Å²	139.5	78%	0.784	79%	0.786	S	S	*	*			trans	178.6	43.9	165.4	0	0	0	0	0	114.9	T31	G29-T31 PolarHBondContact O-N 2.93Å
30	G	25.6	Very low	28	Very low	84 Å²	84	138.6 Å²	138.6	87%	0.866	78%	0.779	S	S	*	*			trans	-76.6	116.6	-164.7	0	0	0	0	0	115.9
31	T	27.1	Very low	29.2	Very low	141 Å²	141	134.7 Å²	134.7	87%	0.865	75%	0.752	S	S	*	*			trans	-81.8	137.5	161.1	45.8	0	0	0	0	110.6	G29 A33	G29-T31 PolarHBondContact O-N 2.93Å; T31-A33 PolarHBondContact O-N 3.14Å
32	K	27.1	Very low	29.8	Very low	210 Å²	210	134.6 Å²	134.6	91%	0.913	75%	0.748	S	S	*	*			trans	-75.9	106.5	174.3	-76.2	-177.3	176.6	179.9	0	110.1
33	A	26.2	Very low	30	Very low	86 Å²	86	135 Å²	135	71%	0.711	75%	0.745	S	S	*	*			trans	-80.4	112	158.9	0	0	0	0	0	109.1	T31 V35	T31-A33 PolarHBondContact O-N 3.14Å; A33-V35 VanDerWaalsContact C-N 3.33Å; A33-V35 PolarHBondContact O-N 3.23Å
34	E	24.4	Very low	30.3	Very low	142 Å²	142	136.3 Å²	136.3	66%	0.664	75%	0.751	S	S	*	*			trans	-71.2	91	164.9	-81.7	-160.9	172.1	0	0	109.4	R36	E34-R36 HydrophobicContact CB-CG 4.3Å; E34-R36 PolarHBondContact O-N 2.98Å; E34-R36 IonicContact OE2-CZ 3.11Å; E34-R36 IonicContact OE2-NE 3.06Å; E34-R36 PolarHBondContact OE2-NE 3.06Å; E34-R36 IonicContact OE2-NH2 3.14Å; E34-R36 PolarHBondContact OE2-NH2 2.81Å
35	V	26.4	Very low	30.4	Very low	122 Å²	122	136.9 Å²	136.9	74%	0.739	75%	0.754	S	S	*	*			trans	-71.1	84.4	164.3	-176.9	0	0	0	0	107.9	A33 C37	A33-V35 VanDerWaalsContact C-N 3.33Å; A33-V35 PolarHBondContact O-N 3.23Å; V35-C37 VanDerWaalsContact C-N 3.33Å; V35-C37 PolarHBondContact O-N 3.29Å
36	R	24.3	Very low	30.4	Very low	198 Å²	198	137.5 Å²	137.5	75%	0.747	76%	0.758	S	S	*	*			trans	-71.4	89.7	172.2	-69.1	-171.1	180	-167.3	-0.8	109.3	E34 I38	E34-R36 HydrophobicContact CB-CG 4.3Å; E34-R36 PolarHBondContact O-N 2.98Å; E34-R36 IonicContact OE2-CZ 3.11Å; E34-R36 IonicContact OE2-NE 3.06Å; E34-R36 PolarHBondContact OE2-NE 3.06Å; E34-R36 IonicContact OE2-NH2 3.14Å; E34-R36 PolarHBondContact OE2-NH2 2.81Å; R36-I38 PolarHBondContact O-N 3.22Å
37	C	26.1	Very low	30.5	Very low	109 Å²	109	138.5 Å²	138.5	74%	0.736	76%	0.759	S	S	*	*			trans	-57.3	110.5	167.8	-62.8	0	0	0	0	109.4	V35 R39	V35-C37 VanDerWaalsContact C-N 3.33Å; V35-C37 PolarHBondContact O-N 3.29Å; C37-R39 PolarHBondContact O-N 3.43Å
38	I	31.8	Very low	30.4	Very low	159 Å²	159	136.1 Å²	136.1	82%	0.815	76%	0.761	S	S	*	*			trans	-59.7	127.1	167.8	-60.2	173.6	0	0	0	106.8	R36 Q40	R36-I38 PolarHBondContact O-N 3.22Å; I38-Q40 PolarHBondContact O-N 3.16Å; I38-Q40 VanDerWaalsContact O-N 3.11Å
39	R	38.5	Very low	30.4	Very low	209 Å²	209	134 Å²	134	79%	0.789	76%	0.755	S	S	*	*			trans	-66.1	112	176.4	-76.5	-176.9	172.6	178.6	-1.4	108.9	C37	C37-R39 PolarHBondContact O-N 3.43Å
40	Q	43.8	Very low	30.6	Very low	139 Å²	139	136.3 Å²	136.3	65%	0.65	76%	0.756	S	S	*	*			trans	-61	147.4	169.1	-73.3	-177.1	-57.8	0	0	110.4	I38 Q42	I38-Q40 PolarHBondContact O-N 3.16Å; I38-Q40 VanDerWaalsContact O-N 3.11Å; Q40-Q42 PolarHBondContact O-N 2.92Å
41	C	47.7	Very low	30.7	Very low	30 Å²	30	144.1 Å²	144.1	20%	0.203	76%	0.76	C	S	.	*	S	Bend	trans	-76.1	49.5	-175.9	-60	0	0	0	0	112.9	L839 C914 P941	C41-L839 HydrophobicContact CB-CD2 4.39Å; C41-L839 VanDerWaalsContact SG-CD2 3.54Å; C41-C914 HydrophobicContact CB-CB 4.14Å; C41-C914 WeakPolarHBondContact CB-SG 3.29Å; C41-C914 WeakPolarHBondContact SG-CB 3.38Å; C41-C914 CovalentContact SG-SG 2.05Å; C41-C914 PolarHBondContact SG-SG 3.03Å; C41-P941 HydrophobicContact CB-CB 4.16Å; C41-P941 HydrophobicContact CB-CG 4.15Å
42	Q	38.4	Very low	30.7	Very low	160 Å²	160	145.1 Å²	145.1	75%	0.748	75%	0.754	S	S	*	*			trans	-107	141.1	174.8	-71.5	-170.7	-11.3	0	0	111.6	Q40	Q40-Q42 PolarHBondContact O-N 2.92Å
43	Q	31	Very low	30.7	Very low	182 Å²	182	145.9 Å²	145.9	85%	0.85	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-75.1	141.9	170.1	-69.1	-178.8	-14.4	0	0	110.9	L45	Q43-L45 PolarHBondContact O-N 3.35Å
44	P	32.1	Very low	30.7	Very low	120 Å²	120	146.3 Å²	146.3	78%	0.779	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-69.1	126.3	170.6	28.8	-33.2	0	0	0	110.6	V46	P44-V46 PolarHBondContact O-N 3.33Å
45	L	28.6	Very low	30.8	Very low	166 Å²	166	144 Å²	144	87%	0.869	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-62.8	126.5	171	-94.7	156.1	0	0	0	110.5	Q43 V47	Q43-L45 PolarHBondContact O-N 3.35Å; L45-V47 PolarHBondContact O-N 3.47Å; L45-V47 VanDerWaalsContact O-N 3.09Å
46	V	29.3	Very low	31.5	Very low	141 Å²	141	142.9 Å²	142.9	86%	0.855	76%	0.756	S	S	*	*			trans	-74.3	100.7	179.3	179.9	0	0	0	0	110	P44	P44-V46 PolarHBondContact O-N 3.33Å
47	V	28	Very low	31.6	Very low	122 Å²	122	139.5 Å²	139.5	74%	0.739	75%	0.752	S	S	*	*			trans	-91.5	115.7	168.8	-178.8	0	0	0	0	108.9	L45 V49	L45-V47 PolarHBondContact O-N 3.47Å; L45-V47 VanDerWaalsContact O-N 3.09Å; V47-V49 HydrophobicContact CG1-CG2 4.47Å
48	A	28.1	Very low	31.7	Very low	96 Å²	96	142.3 Å²	142.3	79%	0.793	76%	0.755	S	S	*	*			trans	-80.2	133.1	176.1	0	0	0	0	0	111.3
49	V	28	Very low	31.5	Very low	123 Å²	123	139.8 Å²	139.8	75%	0.745	76%	0.757	S	S	*	*			trans	-129.1	142.7	174.4	-178.9	0	0	0	0	108.8	V47	V47-V49 HydrophobicContact CG1-CG2 4.47Å
50	P	29.7	Very low	30.9	Very low	124 Å²	124	133.6 Å²	133.6	81%	0.805	76%	0.758	S	S	*	*			trans	-74.2	157	-165.8	-19.1	34	0	0	0	115.7
51	R	28.9	Very low	30.1	Very low	248 Å²	248	132 Å²	132	94%	0.936	76%	0.762	S	S	*	*			trans	-74	142.9	165.4	-85.3	175	158.5	166.3	-6.3	111.2
52	E	26.2	Very low	29.1	Very low	161 Å²	161	138.1 Å²	138.1	75%	0.752	79%	0.793	S	S	*	*			trans	-144.5	113.3	143.8	-159.1	157.7	-147.7	0	0	114.4
53	R	26.8	Very low	28.5	Very low	227 Å²	227	135 Å²	135	86%	0.857	80%	0.795	S	S	*	*			trans	44.1	167.4	151.6	-66.7	179	172.4	128.7	-5	121.5
54	A	26.2	Very low	28.4	Very low	94 Å²	94	131 Å²	131	78%	0.777	79%	0.793	S	S	*	*			trans	-153.4	166.8	-162.3	0	0	0	0	0	113.5
55	A	26.3	Very low	29	Very low	95 Å²	95	131.6 Å²	131.6	79%	0.785	80%	0.797	S	S	*	*			trans	71.6	167.2	159.5	0	0	0	0	0	116.1
56	P	42.3	Very low	28.9	Very low	98 Å²	98	127.1 Å²	127.1	64%	0.636	79%	0.791	S	S	*	*			cis	-138.8	-174.3	8.6	44.7	-27.4	0	0	0	117.3
57	D	26.9	Very low	29	Very low	126 Å²	126	128.1 Å²	128.1	67%	0.674	79%	0.786	S	S	*	*			trans	72.4	151.1	148.7	-67.1	-35.4	0	0	0	119.8
58	Q	27.8	Very low	28.8	Very low	169 Å²	169	131.4 Å²	131.4	79%	0.79	79%	0.793	S	S	*	*			cis	-152.6	-178.8	-8.7	-128	158.7	53	0	0	113.1
59	A	27.6	Very low	28.7	Very low	105 Å²	105	134.6 Å²	134.6	87%	0.868	79%	0.79	S	S	*	*			trans	-78.9	168.1	-176.7	0	0	0	0	0	115.2
60	G	25.6	Very low	28.6	Very low	79 Å²	79	135.3 Å²	135.3	81%	0.814	79%	0.794	S	S	*	*			trans	165.2	124.5	162.1	0	0	0	0	0	115.3
61	S	27.6	Very low	28.4	Very low	105 Å²	105	132.3 Å²	132.3	73%	0.734	79%	0.786	S	S	*	*			trans	-82.2	150	166.2	169.5	0	0	0	0	110.5
62	D	25.3	Very low	28.3	Very low	159 Å²	159	130.3 Å²	130.3	85%	0.85	78%	0.784	S	S	*	*				177.1	173.7	118.4	-85	-4.4	0	0	0	112
63	A	26	Very low	28.3	Very low	94 Å²	94	128.8 Å²	128.8	78%	0.777	79%	0.785	S	S	*	*			trans	-134.7	149.9	-153.4	0	0	0	0	0	116.8
64	A	28.3	Very low	28.2	Very low	99 Å²	99	125.6 Å²	125.6	82%	0.818	78%	0.781	S	S	*	*			trans	62.7	173.4	156.6	0	0	0	0	0	117.8
65	P	45.1	Very low	28.2	Very low	133 Å²	133	129.7 Å²	129.7	86%	0.864	78%	0.784	S	S	*	*			cis	-103.1	-170.3	-15.1	41.2	-30.3	0	0	0	110.9
66	G	27	Very low	28	Very low	71 Å²	71	131 Å²	131	73%	0.732	79%	0.787	S	S	*	*			cis	152.8	165	14.2	0	0	0	0	0	106.2
67	E	31.3	Very low	27.3	Very low	162 Å²	162	136.2 Å²	136.2	76%	0.757	80%	0.8	S	S	*	*			cis	-138	171.6	-4.4	-57.3	-179.7	109	0	0	106.4
68	E	24.8	Very low	27.1	Very low	192 Å²	192	135.7 Å²	135.7	90%	0.897	81%	0.806	S	S	*	*				-141	170.8	64.2	-72.1	-174.4	117.5	0	0	114
69	F	25.3	Very low	26.9	Very low	163 Å²	163	131.9 Å²	131.9	72%	0.715	80%	0.803	S	S	*	*			trans	-73.6	151.8	-168.5	-74.9	-114.8	0	0	0	113.8
70	V	26.6	Very low	26.8	Very low	137 Å²	137	132.9 Å²	132.9	83%	0.83	80%	0.804	S	S	*	*			cis	79.8	125.5	34.7	-179.8	0	0	0	0	114
71	G	25.6	Very low	26.7	Very low	62 Å²	62	132.6 Å²	132.6	64%	0.639	80%	0.801	S	S	*	*			cis	169.3	170.2	-7.9	0	0	0	0	0	115.4
72	F	25.6	Very low	26.7	Very low	205 Å²	205	135.8 Å²	135.8	90%	0.899	81%	0.81	S	S	*	*			trans	32.1	139.1	147.5	-83.9	-91	0	0	0	124.1
73	V	26.2	Very low	26.7	Very low	129 Å²	129	131.8 Å²	131.8	78%	0.782	81%	0.806	S	S	*	*				177	164.1	104.8	157.6	0	0	0	0	112.2
74	E	25.8	Very low	27	Very low	161 Å²	161	136 Å²	136	75%	0.752	81%	0.81	S	S	*	*			trans	-70.3	161.3	-161	-62.7	150.9	132.4	0	0	121.8
75	E	24.3	Very low	26.9	Very low	180 Å²	180	139 Å²	139	84%	0.841	81%	0.812	S	S	*	*			trans	37.3	154.3	136.1	-61	-162	146.9	0	0	126.9
76	S	23.5	Very low	26.1	Very low	122 Å²	122	135.8 Å²	135.8	85%	0.853	80%	0.803	S	S	*	*			trans	110.4	155.4	146	78.9	0	0	0	0	119.5
77	F	26.8	Very low	26.2	Very low	207 Å²	207	137.6 Å²	137.6	91%	0.908	81%	0.811	S	S	*	*			trans	-88.7	143.5	-170.7	-79.7	-109.3	0	0	0	113.4
78	S	22.6	Very low	26.1	Very low	116 Å²	116	133.6 Å²	133.6	81%	0.811	81%	0.806	S	S	*	*				171.1	143.9	118.5	46.1	0	0	0	0	116.9
79	A	24.7	Very low	26.4	Very low	88 Å²	88	132.5 Å²	132.5	73%	0.727	80%	0.8	S	S	*	*			trans	31	135.7	146.6	0	0	0	0	0	125.7
80	S	24	Very low	26.6	Very low	127 Å²	127	131.2 Å²	131.2	89%	0.888	80%	0.8	S	S	*	*			trans	74.4	145.5	139	67.4	0	0	0	0	121.8
81	G	24.1	Very low	26.6	Very low	72 Å²	72	130.1 Å²	130.1	74%	0.742	79%	0.794	S	S	*	*			trans	145	54.6	161.6	0	0	0	0	0	120.3
82	D	27.5	Very low	26.7	Very low	172 Å²	172	131.1 Å²	131.1	92%	0.92	80%	0.796	S	S	*	*			trans	26.2	138.6	152.3	-52.5	-20.3	0	0	0	124.8
83	G	26.5	Very low	26.8	Very low	75 Å²	75	125.7 Å²	125.7	77%	0.773	78%	0.784	S	S	*	*			trans	103.7	139.6	144.8	0	0	0	0	0	118.1
84	E	30.7	Very low	26.9	Very low	183 Å²	183	127.9 Å²	127.9	86%	0.855	79%	0.785	S	S	*	*			cis	-161.8	171.5	-12	-153	167.9	-170	0	0	109.9
85	D	27.7	Very low	27.4	Very low	162 Å²	162	129 Å²	129	87%	0.866	79%	0.791	S	S	*	*			trans	61.5	132.7	173.8	-73.3	-24.9	0	0	0	120.3
86	G	28	Very low	27.4	Very low	65 Å²	65	126 Å²	126	67%	0.67	79%	0.79	S	S	*	*			cis	168.7	146.9	-9.6	0	0	0	0	0	115.5
87	A	28.9	Very low	27.6	Very low	110 Å²	110	125.7 Å²	125.7	91%	0.909	79%	0.787	S	S	*	*			trans	63.9	145.6	162.4	0	0	0	0	0	119.1
88	A	29.9	Very low	27.5	Very low	77 Å²	77	125.8 Å²	125.8	64%	0.636	79%	0.787	S	S	*	*			cis	-153.9	135.5	-0.7	0	0	0	0	0	113.1
89	E	29.5	Very low	27.7	Very low	169 Å²	169	129.3 Å²	129.3	79%	0.79	79%	0.788	S	S	*	*				67.1	141.8	124.9	-62.7	-164.5	133.5	0	0	121.6
90	L	29.1	Very low	27.7	Very low	136 Å²	136	131.6 Å²	131.6	71%	0.712	79%	0.788	S	S	*	*			cis	-167	169.8	-2.9	-95.9	160.8	0	0	0	105.5
91	V	27.6	Very low	27.7	Very low	115 Å²	115	133.8 Å²	133.8	70%	0.697	78%	0.784	S	S	*	*			cis	-175	141.9	-36.6	119.2	0	0	0	0	104.8
92	A	27.8	Very low	28.2	Very low	82 Å²	82	136.2 Å²	136.2	68%	0.678	79%	0.786	S	S	*	*				60.6	164.1	70	0	0	0	0	0	113.4
93	S	28.5	Very low	28.1	Very low	92 Å²	92	139.3 Å²	139.3	64%	0.643	79%	0.785	S	S	*	*			cis	-161	-166.7	-21.5	48.5	0	0	0	0	106.2
94	E	28.4	Very low	28.8	Very low	175 Å²	175	142 Å²	142	82%	0.818	79%	0.789	S	S	*	*			cis	-162.1	177.8	7.4	-145.4	148.4	109.6	0	0	109.7
95	E	35.1	Very low	28.6	Very low	185 Å²	185	136.3 Å²	136.3	86%	0.864	78%	0.779	S	S	*	*			trans	-81.5	164.7	166.6	-65	-171.3	120.1	0	0	112.6
96	S	24.4	Very low	28.7	Very low	117 Å²	117	137.7 Å²	137.7	82%	0.818	78%	0.781	S	S	*	*			trans	-164.7	162.6	146.4	55.2	0	0	0	0	112.8
97	S	27.8	Very low	28.7	Very low	114 Å²	114	140.6 Å²	140.6	80%	0.797	78%	0.781	S	S	*	*			trans	-134.1	153.7	174.9	68.5	0	0	0	0	111.7
98	F	24.3	Very low	28.8	Very low	209 Å²	209	142.5 Å²	142.5	92%	0.917	77%	0.771	S	S	*	*			trans	-148.4	165	-179.9	-101	-81.6	0	0	0	112.9
99	K	28.2	Very low	28.7	Very low	190 Å²	190	143.7 Å²	143.7	83%	0.826	77%	0.77	S	S	*	*			trans	-150.2	148.6	-171	-154.1	177.6	-178	171.8	0	113
100	L	23.8	Very low	28.7	Very low	137 Å²	137	140.6 Å²	140.6	72%	0.717	77%	0.768	S	S	*	*			trans	82.8	115.3	165	-74.8	155.5	0	0	0	121.9
101	Q	23.2	Very low	28.4	Very low	173 Å²	173	137.5 Å²	137.5	81%	0.808	77%	0.768	S	S	*	*			trans	69.5	156.3	143	-71.4	-177.7	7.2	0	0	121.3
102	P	35.2	Very low	29.4	Very low	122 Å²	122	137.1 Å²	137.1	79%	0.792	77%	0.768	S	S	*	*			cis	-134.1	-169.2	-24.4	35.5	-14.6	0	0	0	115.8
103	R	26.1	Very low	29.5	Very low	238 Å²	238	141.9 Å²	141.9	90%	0.898	78%	0.777	S	S	*	*			trans	-55.4	174.2	175.9	-79.3	-179.2	174.1	179	-2.2	116.4
104	P	41.1	Very low	29.4	Very low	131 Å²	131	141.2 Å²	141.2	85%	0.851	78%	0.784	S	S	*	*			cis	-145	-171.9	22.3	44.7	-24.6	0	0	0	119.2
105	G	25.4	Very low	29.4	Very low	64 Å²	64	140.7 Å²	140.7	66%	0.66	79%	0.787	S	S	*	*			trans	122.9	104.2	168.5	0	0	0	0	0	112.6
106	E	30.7	Very low	29.1	Very low	191 Å²	191	135.8 Å²	135.8	89%	0.893	79%	0.785	S	S	*	*				61.5	121	76.8	-65.6	-174.1	173.3	0	0	112.5
107	N	28.4	Very low	29.4	Very low	126 Å²	126	136.9 Å²	136.9	67%	0.674	78%	0.782	S	S	*	*			cis	-145.9	177.6	11.3	-113.6	15.3	0	0	0	108.6
108	E	29.7	Very low	29.5	Very low	150 Å²	150	138 Å²	138	70%	0.701	78%	0.775	S	S	*	*			cis	-167.8	-175	12.3	-135.9	175.8	-96.8	0	0	109.1
109	T	28.3	Very low	29.8	Very low	101 Å²	101	135.1 Å²	135.1	62%	0.62	76%	0.764	S	S	*	*			cis	-147.6	161.4	-4.5	-34.2	0	0	0	0	110.1
110	S	29.2	Very low	29.8	Very low	105 Å²	105	134.3 Å²	134.3	73%	0.734	76%	0.76	S	S	*	*			trans	35.1	119.6	152.2	59.8	0	0	0	0	123
111	G	24.3	Very low	30.1	Very low	71 Å²	71	135.3 Å²	135.3	73%	0.732	77%	0.766	S	S	*	*			trans	-90.2	-141.8	139.6	0	0	0	0	0	110.9
112	P	47.9	Very low	30.4	Very low	106 Å²	106	131.9 Å²	131.9	69%	0.688	76%	0.761	S	S	*	*			cis	-144.3	-176.7	-2.8	44.1	-25.7	0	0	0	116.3
113	Q	29.1	Very low	30.2	Very low	183 Å²	183	134 Å²	134	86%	0.855	76%	0.76	S	S	*	*			trans	60.8	146.9	145.8	-78.7	169.8	-63.8	0	0	123.4
114	G	27.5	Very low	30.3	Very low	77 Å²	77	133.6 Å²	133.6	79%	0.794	76%	0.758	S	S	*	*			trans	173.1	82.9	167.3	0	0	0	0	0	114
115	D	28.6	Very low	31	Very low	165 Å²	165	132.6 Å²	132.6	88%	0.882	75%	0.752	S	S	*	*			trans	-75.4	153.1	172.2	-71.8	-66.6	0	0	0	112.8
116	G	27.4	Very low	32	Very low	81 Å²	81	135.8 Å²	135.8	84%	0.835	76%	0.761	S	S	*	*			trans	-175.2	137.4	172.6	0	0	0	0	0	113.4
117	D	30.5	Very low	32	Very low	140 Å²	140	130 Å²	130	75%	0.749	75%	0.753	S	S	*	*			trans	-132.3	167.8	-165	-168.7	-6.4	0	0	0	112.2
118	H	31	Very low	32.2	Very low	139 Å²	139	129.2 Å²	129.2	64%	0.644	76%	0.764	S	S	*	*			trans	105.5	105.1	155.3	-64.1	-4.7	0	0	0	122.8
119	Q	29.9	Very low	32.2	Very low	148 Å²	148	127.7 Å²	127.7	69%	0.692	77%	0.77	S	S	*	*				70.4	120.6	120.3	-59.8	-167.1	28.5	0	0	125.4
120	K	27.9	Very low	32.2	Very low	172 Å²	172	126.2 Å²	126.2	75%	0.748	77%	0.774	S	S	*	*				66.8	114.4	127.3	-72.8	-176.1	173.2	174.5	0	124.5
121	L	31.8	Very low	32.9	Very low	158 Å²	158	127.5 Å²	127.5	83%	0.827	78%	0.78	S	S	*	*				51.2	123.7	121.7	-87.4	155.1	0	0	0	122.5
122	S	28.6	Very low	33.3	Very low	102 Å²	102	129.3 Å²	129.3	71%	0.713	78%	0.782	S	S	*	*				167.5	144.3	106.7	53.1	0	0	0	0	119
123	H	30.8	Very low	33.1	Very low	166 Å²	166	130.4 Å²	130.4	77%	0.769	79%	0.789	S	S	*	*			trans	65.4	116.9	138.8	-71.1	-31.7	0	0	0	128.6
124	R	29.1	Very low	33	Very low	229 Å²	229	128.4 Å²	128.4	86%	0.864	78%	0.784	S	S	*	*				98.3	157.5	117.8	-79.9	-164.6	167.3	-169.3	-2.4	123.9
125	P	54.2	Low	33	Very low	110 Å²	110	132 Å²	132	71%	0.714	79%	0.785	S	S	*	*			trans	-126.5	-169.8	-159.4	46.6	-31.5	0	0	0	115.9
126	P	47.7	Very low	32.9	Very low	131 Å²	131	128.6 Å²	128.6	85%	0.851	78%	0.78	S	S	*	*				-142.7	-178.1	106.1	39.3	-25.4	0	0	0	113.6
127	G	30.8	Very low	32.8	Very low	71 Å²	71	129.8 Å²	129.8	73%	0.732	78%	0.775	S	S	*	*			cis	154.3	146.9	-11.3	0	0	0	0	0	114.8
128	A	33	Very low	32.7	Very low	109 Å²	109	131.6 Å²	131.6	90%	0.901	78%	0.779	S	S	*	*			trans	69.9	152.6	172.6	0	0	0	0	0	118.4
129	S	29.3	Very low	32.4	Very low	118 Å²	118	131.4 Å²	131.4	83%	0.825	78%	0.779	S	S	*	*			cis	-154.8	164.2	-2.5	48	0	0	0	0	113
130	G	27	Very low	32.2	Very low	69 Å²	69	134.9 Å²	134.9	71%	0.711	79%	0.785	S	S	*	*			trans	-82	-162.7	168.9	0	0	0	0	0	114.5
131	P	44.4	Very low	32	Very low	133 Å²	133	130.4 Å²	130.4	86%	0.864	79%	0.788	S	S	*	*			cis	-143.6	-172.2	35.1	44.8	-26.6	0	0	0	117.3
132	S	33.2	Very low	31.7	Very low	108 Å²	108	130.2 Å²	130.2	76%	0.755	79%	0.788	S	S	*	*			trans	-111.8	168	163.2	-46.6	0	0	0	0	111.6
133	P	42.8	Very low	31.6	Very low	129 Å²	129	129.5 Å²	129.5	84%	0.838	78%	0.783	S	S	*	*			trans	-132.6	166.6	147.5	37.3	-24.8	0	0	0	114.6
134	N	28.6	Very low	31.3	Very low	141 Å²	141	131 Å²	131	75%	0.754	79%	0.788	S	S	*	*			trans	-105.7	175.2	-163.9	-51.3	-29	0	0	0	115.5
135	N	26.7	Very low	31.3	Very low	153 Å²	153	127.2 Å²	127.2	82%	0.818	79%	0.785	S	S	*	*			trans	97	128.7	134.8	-81.9	2.2	0	0	0	122.4
136	A	26.1	Very low	29.9	Very low	94 Å²	94	126.9 Å²	126.9	78%	0.777	79%	0.785	S	S	*	*			trans	67.8	151.8	147.8	0	0	0	0	0	117.9
137	S	25.7	Very low	28.8	Very low	105 Å²	105	127 Å²	127	73%	0.734	78%	0.784	S	S	*	*			cis	-142.3	170.6	13.2	-51.3	0	0	0	0	113.6
138	E	27.5	Very low	28.5	Very low	179 Å²	179	127.2 Å²	127.2	84%	0.836	79%	0.786	S	S	*	*			trans	-11.7	155.8	137.7	-68.4	164.3	146.6	0	0	117.7
139	E	25.5	Very low	28.2	Very low	134 Å²	134	130.1 Å²	130.1	63%	0.626	79%	0.786	S	S	*	*			cis	-159.6	167	32.8	-145.8	-177.4	174.5	0	0	115
140	R	24.9	Very low	28.1	Very low	221 Å²	221	128.5 Å²	128.5	83%	0.834	78%	0.78	S	S	*	*			trans	7.6	145.9	154.6	-70.3	163	178.3	156.7	-7.1	121.3
141	G	25.3	Very low	28	Very low	79 Å²	79	132.9 Å²	132.9	81%	0.814	79%	0.787	S	S	*	*			trans	-175.7	55.6	162.9	0	0	0	0	0	119.6
142	N	25.4	Very low	27.2	Very low	154 Å²	154	130.7 Å²	130.7	82%	0.824	78%	0.78	S	S	*	*			trans	-25.5	129.6	170.5	-90.7	20.7	0	0	0	119
143	S	25.6	Very low	26.9	Very low	87 Å²	87	131.1 Å²	131.1	61%	0.608	78%	0.778	S	S	*	*			trans	34.4	138.8	130.7	68.3	0	0	0	0	122
144	F	25.5	Very low	26	Very low	197 Å²	197	129.5 Å²	129.5	86%	0.864	78%	0.776	S	S	*	*				-162.4	151	106.4	-124.5	-91.3	0	0	0	113.5
145	N	27.4	Very low	25.8	Very low	150 Å²	150	133.6 Å²	133.6	80%	0.802	78%	0.781	S	S	*	*			trans	-89.8	148.1	171	-76.3	-18.4	0	0	0	111.4
146	S	25.7	Very low	25.7	Very low	102 Å²	102	138 Å²	138	71%	0.713	79%	0.786	S	S	*	*			trans	-176.5	90	153.8	174	0	0	0	0	109.9
147	T	25.4	Very low	25.7	Very low	134 Å²	134	140.1 Å²	140.1	82%	0.822	79%	0.789	S	S	*	*				53.7	126.9	92.2	62.3	0	0	0	0	116.5
148	G	24.3	Very low	25.6	Very low	76 Å²	76	146 Å²	146	78%	0.784	80%	0.795	S	S	*	*			trans	151.3	83.3	155.4	0	0	0	0	0	119.6
149	N	25.5	Very low	25.6	Very low	169 Å²	169	149.5 Å²	149.5	90%	0.904	80%	0.801	S	S	*	*			trans	55.6	155.1	146.6	-83.6	16.2	0	0	0	125.2
150	A	27.9	Very low	25.6	Very low	84 Å²	84	148.4 Å²	148.4	69%	0.694	81%	0.808	S	S	*	*			trans	-42.2	162.2	159.3	0	0	0	0	0	114.3
151	D	25.3	Very low	25.9	Very low	161 Å²	161	142.8 Å²	142.8	86%	0.861	81%	0.809	S	S	*	*			cis	-157.6	179.6	49.9	-136.6	-37.3	0	0	0	115.8
152	A	27.8	Very low	25.9	Very low	88 Å²	88	147.4 Å²	147.4	73%	0.727	81%	0.809	S	S	*	*			trans	-73.7	149	-164.6	0	0	0	0	0	117.1
153	V	25.2	Very low	26	Very low	116 Å²	116	145.8 Å²	145.8	70%	0.703	81%	0.805	S	S	*	*			trans	-135.3	117.8	157.1	-178.4	0	0	0	0	109.7
154	A	24.8	Very low	26	Very low	96 Å²	96	153.6 Å²	153.6	79%	0.793	82%	0.821	S	S	*	*			trans	-93.6	131.7	177.3	0	0	0	0	0	111.9
155	W	24.1	Very low	26.1	Very low	227 Å²	227	149.1 Å²	149.1	86%	0.86	81%	0.814	S	S	*	*			trans	-112.6	109.3	173.1	-76.6	104.3	0	0	0	111.8
156	R	25.4	Very low	26	Very low	245 Å²	245	145.3 Å²	145.3	93%	0.925	81%	0.811	S	S	*	*			trans	-79.1	127.3	168.1	-63.5	176.8	-179.2	165.2	-1.4	109.4
157	V	26.1	Very low	26	Very low	138 Å²	138	150.3 Å²	150.3	84%	0.836	82%	0.82	S	S	*	*			trans	-113.5	131.1	163.2	-177.9	0	0	0	0	108.6
158	R	23.8	Very low	26.1	Very low	229 Å²	229	155.7 Å²	155.7	86%	0.864	83%	0.825	S	S	*	*			trans	-76.5	140.1	177.5	-79.8	175.4	162.6	163.4	-7.5	110.2
159	R	27.2	Very low	26.5	Very low	253 Å²	253	155.7 Å²	155.7	96%	0.955	83%	0.825	S	S	*	*			trans	-67.5	131.8	157.8	-73.3	-179.1	173.3	173	-3.2	109.2
160	S	25.3	Very low	26.6	Very low	111 Å²	111	157.1 Å²	157.1	78%	0.776	83%	0.826	S	S	*	*			trans	-133.3	133.4	161.3	-65.1	0	0	0	0	106.4
161	A	30.4	Very low	26.7	Very low	103 Å²	103	156.9 Å²	156.9	85%	0.851	83%	0.832	S	S	*	*			trans	-105.5	120	-177.2	0	0	0	0	0	110.3
162	E	26.7	Very low	27	Very low	175 Å²	175	156.2 Å²	156.2	82%	0.818	83%	0.834	S	S	*	*			trans	-133.3	103.9	172.7	-68.8	-166.4	154.7	0	0	111.4
163	T	27.6	Very low	27	Very low	120 Å²	120	160.9 Å²	160.9	74%	0.736	84%	0.84	S	S	*	*			trans	40.5	96.4	130.5	-42.8	0	0	0	0	118.3
164	W	25.2	Very low	27.4	Very low	251 Å²	251	163.4 Å²	163.4	95%	0.951	85%	0.85	S	S	*	*			trans	-95.9	99	159.4	-92.8	47.2	0	0	0	111
165	S	26.5	Very low	27.6	Very low	103 Å²	103	163.4 Å²	163.4	72%	0.72	85%	0.85	S	S	*	*			trans	-144.8	86.1	171.3	63.1	0	0	0	0	110.3
166	G	25.8	Very low	27.8	Very low	71 Å²	71	157.9 Å²	157.9	73%	0.732	85%	0.846	S	S	*	*			trans	171	76.5	-178.5	0	0	0	0	0	116.1
167	F	25.7	Very low	28.1	Very low	206 Å²	206	152 Å²	152	90%	0.904	84%	0.837	S	S	*	*			trans	-128.3	120.8	147	-97.5	-83.4	0	0	0	108.9
168	R	28.3	Very low	28.4	Very low	248 Å²	248	150.2 Å²	150.2	94%	0.936	83%	0.83	S	S	*	*			trans	-121.7	124.4	174	-169.5	-178.7	-169.8	-171.2	3	105.8
169	G	31.8	Very low	28.8	Very low	75 Å²	75	147 Å²	147	77%	0.773	83%	0.831	S	S	*	*			trans	-73.4	155	-165.4	0	0	0	0	0	114.9
170	E	27.9	Very low	29.4	Very low	199 Å²	199	142.5 Å²	142.5	93%	0.93	82%	0.82	S	S	*	*			trans	-113.9	149.1	149.6	-69	-172.8	125.1	0	0	107.5
171	G	30	Very low	30.4	Very low	80 Å²	80	143.6 Å²	143.6	83%	0.825	81%	0.813	S	S	*	*			trans	-84.6	147.3	-165.6	0	0	0	0	0	114.7
172	V	31.2	Very low	31.6	Very low	147 Å²	147	147.4 Å²	147.4	89%	0.891	81%	0.813	S	S	*	*			trans	-122.4	141.2	155.9	179.8	0	0	0	0	106.3
173	E	28.7	Very low	33.5	Very low	185 Å²	185	140.9 Å²	140.9	86%	0.864	78%	0.782	S	S	*	*			trans	-71.3	150.9	-167.4	-60.7	175.1	127.2	0	0	113.1	A175	E173-A175 PolarHBondContact O-N 3.31Å
174	D	33.1	Very low	35.4	Very low	169 Å²	169	143.8 Å²	143.8	90%	0.904	79%	0.787	S	S	*	*			trans	-63.6	95.6	-173.4	-68.5	-67.2	0	0	0	113.7	S176	D174-S176 VanDerWaalsContact C-N 3.3Å; D174-S176 PolarHBondContact O-N 3.37Å; D174-S176 VanDerWaalsContact O-N 3.08Å
175	A	29.1	Very low	38.1	Very low	96 Å²	96	132.5 Å²	132.5	79%	0.793	75%	0.746	S	S	*	*			trans	-80.5	77	165.5	0	0	0	0	0	110.4	E173 V177	E173-A175 PolarHBondContact O-N 3.31Å; A175-V177 PolarHBondContact O-N 2.94Å
176	S	28.4	Very low	40.8	Very low	111 Å²	111	131.6 Å²	131.6	78%	0.776	74%	0.736	S	S	*	*			trans	18.6	90.6	168.5	62.9	0	0	0	0	116.2	D174 S178	D174-S176 VanDerWaalsContact C-N 3.3Å; D174-S176 PolarHBondContact O-N 3.37Å; D174-S176 VanDerWaalsContact O-N 3.08Å; S176-S178 PolarHBondContact O-N 3.17Å
177	V	31.7	Very low	43.7	Very low	122 Å²	122	130.6 Å²	130.6	74%	0.739	72%	0.718	S	S	*	*			trans	-56.4	121.4	161	-179.5	0	0	0	0	107.5	A175 D179	A175-V177 PolarHBondContact O-N 2.94Å; V177-D179 PolarHBondContact O-N 2.84Å
178	S	31.9	Very low	46.6	Very low	100 Å²	100	122.6 Å²	122.6	70%	0.699	69%	0.687	S	S	*	*			trans	-66.2	128.9	167.7	52.7	0	0	0	0	108.4	S176 Q180	S176-S178 PolarHBondContact O-N 3.17Å; S178-Q180 PolarHBondContact O-N 2.8Å
179	D	31.7	Very low	49.5	Very low	163 Å²	163	114.3 Å²	114.3	87%	0.872	66%	0.664	S	S	*	*			trans	-48.6	109.3	-176.3	-58.7	-70.5	0	0	0	111.3	V177 E181	V177-D179 PolarHBondContact O-N 2.84Å; D179-E181 PolarHBondContact O-N 3.18Å
180	Q	40.6	Very low	52.3	Low	158 Å²	158	113.1 Å²	113.1	74%	0.738	64%	0.638	S	S	*	*			trans	-73.9	123.4	164.6	-66.4	-167.4	-70.7	0	0	106.8	S178 E182	S178-Q180 PolarHBondContact O-N 2.8Å; Q180-E182 PolarHBondContact O-N 2.89Å
181	E	46.6	Very low	55.1	Low	133 Å²	133	105 Å²	105	62%	0.621	61%	0.605	S	S	*	*			trans	-58	103.8	168.9	-67.2	-173.3	151.5	0	0	108.2	D179 F183 R731	D179-E181 PolarHBondContact O-N 3.18Å; E181-F183 WeakPolarHBondContact O-CD2 3.32Å; E181-F183 PolarHBondContact O-N 3.41Å; E181-R731 IonicContact OE2-CZ 3.19Å; E181-R731 IonicContact OE2-NH1 2.73Å; E181-R731 PolarHBondContact OE2-NH1 2.92Å; E181-R731 IonicContact OE2-NH2 3.7Å; E181-R731 PolarHBondContact OE2-NH2 2.96Å
182	E	55.7	Low	57.9	Low	184 Å²	184	101.2 Å²	101.2	86%	0.86	57%	0.566	S	S	*	*			trans	-70.4	107.5	179.9	-166.8	167.7	-144.2	0	0	108.5	Q180 E184	Q180-E182 PolarHBondContact O-N 2.89Å; E182-E184 PolarHBondContact O-N 3.09Å
183	F	66.8	Low	60	Low	38 Å²	38	97.5 Å²	97.5	17%	0.167	55%	0.551	C	S	.	*			trans	-60	111.3	-172.2	-65.7	-95.7	0	0	0	111.5	E181 L185 F639 D646 I693	E181-F183 WeakPolarHBondContact O-CD2 3.32Å; E181-F183 PolarHBondContact O-N 3.41Å; F183-L185 HydrophobicContact CB-CG 4.48Å; F183-L185 PolarHBondContact O-N 3.16Å; F183-F639 AromaticContact CE1-CE2 3.74Å; F183-F639 HydrophobicContact CE1-CE2 3.74Å; F183-F639 HydrophobicContact CE1-CZ 4.22Å; F183-F639 HydrophobicContact CZ-CE2 4.15Å; F183-D646 HydrophobicContact CE2-CB 3.64Å; F183-D646 HydrophobicContact CZ-CB 3.77Å; F183-D646 WeakPolarHBondContact CZ-OD2 3.48Å; F183-I693 HydrophobicContact CD1-CD1 3.89Å
184	E	67.7	Low	62	Low	180 Å²	180	91.8 Å²	91.8	84%	0.841	54%	0.541	S	S	*	.			trans	-71.2	61.4	173	-67.8	-161.1	153.5	0	0	112.3	E182	E182-E184 PolarHBondContact O-N 3.09Å
185	L	81.8	Confident	63.9	Low	15 Å²	15	84.6 Å²	84.6	8%	0.079	50%	0.503	C	S	.	.			trans	-81.5	125.9	169	-80.7	171.8	0	0	0	110.5	F183 S187 L637 Y648 D689 F690 I693	F183-L185 HydrophobicContact CB-CG 4.48Å; F183-L185 PolarHBondContact O-N 3.16Å; L185-S187 PolarHBondContact O-N 3.4Å; L185-L637 HydrophobicContact CD1-CD1 3.76Å; L185-Y648 HydrophobicContact CB-CD2 4.34Å; L185-Y648 HydrophobicContact CB-CE1 4.13Å; L185-Y648 HydrophobicContact CB-CE2 3.61Å; L185-Y648 VanDerWaalsContact CB-CZ 3.48Å; L185-Y648 WeakPolarHBondContact CB-OH 3.22Å; L185-Y648 HydrophobicContact CD1-CD1 3.88Å; L185-Y648 HydrophobicContact CD1-CD2 3.9Å; L185-Y648 HydrophobicContact CD1-CE1 3.97Å; L185-Y648 HydrophobicContact CD1-CE2 4Å; L185-Y648 HydrophobicContact CD1-CG 3.84Å; L185-Y648 HydrophobicContact CG-CE2 4.36Å; L185-Y648 PolarHBondContact O-OH 3.18Å; L185-D689 VanDerWaalsContact CD2-O 3.31Å; L185-D689 WeakPolarHBondContact CD2-O 3.47Å; L185-F690 HydrophobicContact CD1-CD1 4.11Å; L185-F690 HydrophobicContact CD1-CE1 4Å; L185-F690 HydrophobicContact CD2-CB 4.33Å; L185-F690 HydrophobicContact CD2-CD1 3.65Å; L185-F690 HydrophobicContact CD2-CE1 4.29Å; L185-F690 HydrophobicContact CD2-CG 4.23Å; L185-I693 HydrophobicContact CD1-CD1 4.02Å; L185-I693 HydrophobicContact CD2-CD1 3.63Å; L185-I693 HydrophobicContact CD2-CG1 3.83Å; L185-I693 HydrophobicContact CG-CD1 3.8Å; L185-I693 HydrophobicContact CG-CG1 4.23Å
186	T	83.1	Confident	65.6	Low	84 Å²	84	83.2 Å²	83.2	52%	0.515	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	108.1	172.4	52.2	0	0	0	0	110.3	D689	T186-D689 PolarHBondContact O-N 3.11Å; T186-D689 VanDerWaalsContact O-N 3.17Å
187	S	85.5	Confident	67.4	Low	49 Å²	49	80.7 Å²	80.7	34%	0.343	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	154.8	166.7	74	0	0	0	0	111.9	L185 F650 K687	L185-S187 PolarHBondContact O-N 3.4Å; S187-F650 PolarHBondContact OG-O 3.32Å; S187-F650 VanDerWaalsContact OG-O 3.12Å; S187-K687 CarbonylContact C-O 3.59Å; S187-K687 VanDerWaalsContact CA-O 3.25Å; S187-K687 WeakPolarHBondContact CA-O 3.24Å
188	S	88	Confident	69.5	Low	38 Å²	38	75.1 Å²	75.1	27%	0.266	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	132.2	176.4	62.1	0	0	0	0	111.3	T240 L686 K687	S188-T240 WeakPolarHBondContact OG-CG2 3.47Å; S188-L686 WeakPolarHBondContact O-CA 3.42Å; S188-K687 PolarHBondContact N-O 2.96Å; S188-K687 PolarHBondContact O-N 3.34Å
189	T	87.9	Confident	72	Confident	74 Å²	74	73.4 Å²	73.4	45%	0.454	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	136.4	178.9	-40.3	0	0	0	0	110.6	L685 L686	T189-L685 CarbonylContact C-O 3.51Å; T189-L685 WeakPolarHBondContact CA-O 3.39Å; T189-L686 HydrophobicContact CG2-CD1 4.45Å
190	F	90	Very high	74.6	Confident	51 Å²	51	68.6 Å²	68.6	22%	0.224	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133.9	171.1	-170.1	-87.6	0	0	0	109.8	L192 T240 T241 Y242 L685	F190-L192 HydrophobicContact CD1-CD2 4.07Å; F190-L192 HydrophobicContact CE1-CD2 4Å; F190-T240 WeakPolarHBondContact CD2-O 3.26Å; F190-T241 HydrophobicContact CD2-CG2 4.43Å; F190-T241 HydrophobicContact CE2-CG2 4.3Å; F190-Y242 HydrophobicContact CB-CD2 4.46Å; F190-Y242 AromaticContact CD1-CD2 3.69Å; F190-Y242 HydrophobicContact CD1-CD2 3.69Å; F190-Y242 HydrophobicContact CD1-CG 4.38Å; F190-Y242 HydrophobicContact CE1-CD2 4.13Å; F190-Y242 HydrophobicContact CE1-CG 4.41Å; F190-Y242 HydrophobicContact CG-CD2 4.11Å; F190-L685 PolarHBondContact N-O 3.14Å; F190-L685 PolarHBondContact O-N 2.93Å
191	A	88.6	Confident	76.8	Confident	28 Å²	28	62 Å²	62	23%	0.231	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	136.4	177	0	0	0	0	0	109.9	A193 E682	A191-A193 PolarHBondContact O-N 3.03Å; A191-E682 HydrophobicContact CB-CG 4.15Å
192	L	87.5	Confident	78.8	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	34%	0.343	C	S	.	.			trans	-76.7	65	176.7	-61.8	-167.2	0	0	0	111.6	F190 G194 D195 M215 T217 W233 Y242 W683 L685	F190-L192 HydrophobicContact CD1-CD2 4.07Å; F190-L192 HydrophobicContact CE1-CD2 4Å; L192-G194 PolarHBondContact O-N 3.35Å; L192-D195 HydrophobicContact CB-CB 4.31Å; L192-D195 WeakPolarHBondContact O-CB 3.44Å; L192-D195 PolarHBondContact O-N 3.35Å; L192-D195 VanDerWaalsContact O-N 3.08Å; L192-M215 HydrophobicContact CD1-CE 4.04Å; L192-M215 HydrophobicContact CD1-SD 3.79Å; L192-T217 HydrophobicContact CD1-CG2 4.04Å; L192-W233 HydrophobicContact CB-CH2 4.08Å; L192-W233 HydrophobicContact CB-CZ2 3.81Å; L192-W233 HydrophobicContact CD1-CD2 4.25Å; L192-W233 HydrophobicContact CD1-CG 4.23Å; L192-W233 HydrophobicContact CD1-CZ2 4.5Å; L192-W233 HydrophobicContact CD2-CD2 3.9Å; L192-W233 HydrophobicContact CD2-CE3 3.93Å; L192-W233 HydrophobicContact CD2-CG 4.31Å; L192-W233 HydrophobicContact CD2-CH2 4.48Å; L192-W233 HydrophobicContact CD2-CZ2 4.49Å; L192-W233 HydrophobicContact CD2-CZ3 4.21Å; L192-W233 HydrophobicContact CG-CZ2 4.49Å; L192-Y242 HydrophobicContact CD2-CG 4.44Å; L192-W683 HydrophobicContact CB-CB 4.39Å; L192-W683 HydrophobicContact CD1-CB 3.92Å; L192-W683 HydrophobicContact CG-CB 4.14Å; L192-W683 PolarHBondContact N-O 3.48Å; L192-L685 HydrophobicContact CD1-CD1 3.99Å; L192-L685 HydrophobicContact CD2-CD1 3.83Å; L192-L685 HydrophobicContact CG-CD1 3.7Å
193	A	76.7	Confident	80.3	Confident	70 Å²	70	48.6 Å²	48.6	58%	0.579	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	123.6	-175.6	0	0	0	0	0	111.9	A191 E682	A191-A193 PolarHBondContact O-N 3.03Å; A193-E682 WeakPolarHBondContact CA-OE2 3.32Å
194	G	70.2	Confident	81.3	Confident	64 Å²	64	48.5 Å²	48.5	66%	0.66	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.5	20.1	-174.8	0	0	0	0	0	114.2	L192 K244	L192-G194 PolarHBondContact O-N 3.35Å; G194-K244 PolarHBondContact O-NZ 2.94Å
195	D	72.9	Confident	82.2	Confident	19 Å²	19	40.7 Å²	40.7	10%	0.102	27%	0.265	C	S	.	.			trans	-86.5	140.2	155.4	-125.9	35.5	0	0	0	110.8	L192 H198 T217 S231 W233 K244	L192-D195 HydrophobicContact CB-CB 4.31Å; L192-D195 WeakPolarHBondContact O-CB 3.44Å; L192-D195 PolarHBondContact O-N 3.35Å; L192-D195 VanDerWaalsContact O-N 3.08Å; D195-H198 IonicContact OD1-CE1 3.69Å; D195-H198 PolarHBondContact OD1-CE1 3.04Å; D195-H198 IonicContact OD1-ND1 2.79Å; D195-H198 IonicContact OD2-CE1 3.82Å; D195-H198 PolarHBondContact OD2-CE1 3.4Å; D195-H198 IonicContact OD2-CG 2.71Å; D195-H198 IonicContact OD2-ND1 2.75Å; D195-H198 PolarHBondContact OD2-ND1 3.46Å; D195-T217 VanDerWaalsContact OD2-CB 3.29Å; D195-T217 WeakPolarHBondContact OD2-CB 3.37Å; D195-T217 PolarHBondContact OD2-OG1 2.89Å; D195-S231 WeakPolarHBondContact OD1-CB 3.41Å; D195-S231 PolarHBondContact OD1-OG 3.49Å; D195-W233 HydrophobicContact CB-CZ2 3.97Å; D195-W233 WeakPolarHBondContact OD1-CZ2 3.49Å; D195-W233 PolarHBondContact OD1-NE1 2.95Å; D195-K244 IonicContact OD1-NZ 2.77Å; D195-K244 PolarHBondContact OD1-NZ 3.17Å
196	T	64.1	Low	82.3	Confident	66 Å²	66	40.2 Å²	40.2	41%	0.405	26%	0.263	S	S	.	.			trans	-68.4	165.2	159.1	41.4	0	0	0	0	109.1	H198 E229	T196-H198 PolarHBondContact O-N 2.98Å; T196-H198 PolarHBondContact O-ND1 2.63Å; T196-H198 VanDerWaalsContact O-ND1 3.12Å; T196-H198 PolarHBondContact OG1-CE1 3.48Å; T196-H198 PolarHBondContact OG1-NE2 2.96Å; T196-E229 VanDerWaalsContact CB-OE2 3.3Å; T196-E229 WeakPolarHBondContact CB-OE2 3.45Å; T196-E229 WeakPolarHBondContact CG2-OE2 3.31Å; T196-E229 PolarHBondContact OG1-OE2 2.9Å
197	A	66.3	Low	81.9	Confident	59 Å²	59	36.4 Å²	36.4	49%	0.488	24%	0.24	S	C	.	.			trans	-75.5	64.3	-177.6	0	0	0	0	0	111.7	N199	A197-N199 PolarHBondContact O-N 3.33Å
198	H	76.8	Confident	81.3	Confident	5 Å²	5	39.7 Å²	39.7	2%	0.023	25%	0.25	C	C	.	.			trans	-55.5	130.8	171.5	-61.8	108.9	0	0	0	109.8	D195 T196 T217 Y219 E229 S231 W683	D195-H198 IonicContact OD1-CE1 3.69Å; D195-H198 PolarHBondContact OD1-CE1 3.04Å; D195-H198 IonicContact OD1-ND1 2.79Å; D195-H198 IonicContact OD2-CE1 3.82Å; D195-H198 PolarHBondContact OD2-CE1 3.4Å; D195-H198 IonicContact OD2-CG 2.71Å; D195-H198 IonicContact OD2-ND1 2.75Å; D195-H198 PolarHBondContact OD2-ND1 3.46Å; T196-H198 PolarHBondContact O-N 2.98Å; T196-H198 PolarHBondContact O-ND1 2.63Å; T196-H198 VanDerWaalsContact O-ND1 3.12Å; T196-H198 PolarHBondContact OG1-CE1 3.48Å; T196-H198 PolarHBondContact OG1-NE2 2.96Å; H198-T217 PolarHBondContact ND1-OG1 2.98Å; H198-Y219 PolarHBondContact CD2-N 3.1Å; H198-E229 PolarHBondContact CD2-O 3.2Å; H198-S231 PolarHBondContact CE1-OG 3.25Å; H198-W683 PolarHBondContact O-NE1 2.88Å
199	N	82.8	Confident	80.6	Confident	63 Å²	63	42.3 Å²	42.3	34%	0.337	26%	0.261	S	S	.	.	S	Bend	trans	-88.4	-6.3	-173.6	62.1	-8.3	0	0	0	114.2	A197 K218 Y219 Y220 F222	A197-N199 PolarHBondContact O-N 3.33Å; N199-K218 PolarHBondContact N-O 3.33Å; N199-K218 PolarHBondContact OD1-O 3.03Å; N199-Y219 WeakPolarHBondContact OD1-CA 3.3Å; N199-Y220 PolarHBondContact ND2-O 3.42Å; N199-Y220 PolarHBondContact OD1-N 3.34Å; N199-F222 WeakPolarHBondContact ND2-CE2 3.36Å
200	Q	86.3	Confident	80.3	Confident	62 Å²	62	39.4 Å²	39.4	29%	0.29	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	151.5	175.3	-69.3	-176.9	-21.2	0	0	111.2	T217 K218	Q200-T217 WeakPolarHBondContact O-CA 3.48Å; Q200-K218 HydrophobicContact CB-CG 3.96Å; Q200-K218 PolarHBondContact N-O 3.49Å; Q200-K218 VanDerWaalsContact N-O 3.1Å; Q200-K218 PolarHBondContact O-N 3.3Å; Q200-K218 VanDerWaalsContact OE1-CE 3.25Å
201	A	87.4	Confident	80.1	Confident	20 Å²	20	38.5 Å²	38.5	17%	0.165	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	145.8	173.1	0	0	0	0	0	111.4	M215 L216 T217 W683	A201-M215 HydrophobicContact CB-CE 3.55Å; A201-L216 CarbonylContact C-O 3.49Å; A201-L216 WeakPolarHBondContact CA-O 3.39Å; A201-T217 HydrophobicContact CB-CG2 4.09Å; A201-W683 HydrophobicContact CB-CD2 4.49Å; A201-W683 HydrophobicContact CB-CH2 4.19Å; A201-W683 HydrophobicContact CB-CZ2 4.06Å; A201-W683 HydrophobicContact CB-CZ3 4.46Å
202	M	88.4	Confident	80.2	Confident	35 Å²	35	37.6 Å²	37.6	17%	0.172	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	126.3	173.4	-71.8	162.9	169.3	0	0	108.4	M215 L216 Y257	M202-M215 CarbonylContact O-C 3.51Å; M202-M215 VanDerWaalsContact O-CA 3.24Å; M202-M215 WeakPolarHBondContact O-CA 3.43Å; M202-L216 HydrophobicContact CB-CB 4.46Å; M202-L216 PolarHBondContact N-O 3.33Å; M202-L216 PolarHBondContact O-N 2.85Å; M202-L216 HydrophobicContact SD-CD2 4.49Å; M202-Y257 HydrophobicContact CE-CD1 3.81Å; M202-Y257 HydrophobicContact CE-CE1 3.53Å; M202-Y257 HydrophobicContact SD-CD1 4.18Å; M202-Y257 HydrophobicContact SD-CE1 4.43Å
203	V	88.1	Confident	80.4	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.006	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	118.8	-172.9	-167.8	0	0	0	0	109.6	I213 M215 Y561 L661 F674	V203-I213 HydrophobicContact CG1-CG2 3.86Å; V203-M215 HydrophobicContact CG2-CE 4.05Å; V203-M215 HydrophobicContact CG2-CG 3.99Å; V203-M215 HydrophobicContact CG2-SD 4.08Å; V203-Y561 HydrophobicContact CB-CE1 4.23Å; V203-Y561 PolarHBondContact N-OH 2.96Å; V203-Y561 PolarHBondContact O-OH 2.99Å; V203-L661 HydrophobicContact CB-CD2 4.02Å; V203-L661 HydrophobicContact CG1-CD2 3.64Å; V203-L661 WeakPolarHBondContact O-CD2 3.4Å; V203-F674 HydrophobicContact CG2-CD1 4.14Å; V203-F674 HydrophobicContact CG2-CE1 4.11Å; V203-F674 HydrophobicContact CG2-CG 4.41Å; V203-F674 HydrophobicContact CG2-CZ 4.35Å
204	H	87.3	Confident	81.1	Confident	36 Å²	36	34.3 Å²	34.3	17%	0.167	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	134.9	-174.8	-64.3	-86.8	0	0	0	112.1	L214 L258 V260	H204-L214 PolarHBondContact N-O 3.34Å; H204-L214 PolarHBondContact O-N 3.22Å; H204-L258 HydrophobicContact CB-CD2 4.06Å; H204-V260 HydrophobicContact CB-CG2 3.85Å
205	W	86.8	Confident	82.1	Confident	16 Å²	16	31.2 Å²	31.2	6%	0.061	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	144.6	167.4	-66.5	89.3	0	0	0	111.2	G207 I213 Y238 G662 E663 P664 I670	W205-G207 PolarHBondContact O-N 3.26Å; W205-I213 HydrophobicContact CD2-CD1 4.2Å; W205-I213 HydrophobicContact CD2-CG1 3.69Å; W205-I213 HydrophobicContact CE3-CD1 4.19Å; W205-I213 HydrophobicContact CE3-CG1 3.52Å; W205-I213 HydrophobicContact CG-CG1 4.44Å; W205-I213 HydrophobicContact CH2-CD1 3.61Å; W205-I213 HydrophobicContact CH2-CG1 3.89Å; W205-I213 HydrophobicContact CZ2-CD1 3.63Å; W205-I213 HydrophobicContact CZ2-CG1 4.06Å; W205-I213 HydrophobicContact CZ3-CD1 3.89Å; W205-I213 HydrophobicContact CZ3-CG1 3.61Å; W205-Y238 AromaticContact CH2-CD1 3.75Å; W205-Y238 HydrophobicContact CH2-CD1 3.75Å; W205-Y238 HydrophobicContact CH2-CG 4.34Å; W205-Y238 AromaticContact CZ3-CD1 3.56Å; W205-Y238 HydrophobicContact CZ3-CD1 3.56Å; W205-Y238 HydrophobicContact CZ3-CE1 4.38Å; W205-Y238 HydrophobicContact CZ3-CG 4.25Å; W205-G662 PolarHBondContact NE1-O 3.49Å; W205-E663 HydrophobicContact CH2-CB 4.5Å; W205-E663 HydrophobicContact CZ2-CB 4.34Å; W205-P664 HydrophobicContact CB-CB 4.29Å; W205-P664 HydrophobicContact CB-CG 3.56Å; W205-P664 HydrophobicContact CD2-CG 4.44Å; W205-P664 VanDerWaalsContact CG-CD 3.41Å; W205-P664 HydrophobicContact CG-CG 3.98Å; W205-I670 HydrophobicContact CH2-CG2 4.39Å
206	S	83	Confident	83	Confident	4 Å²	4	30.3 Å²	30.3	3%	0.028	17%	0.172	C	C	.	.			trans	-81	12.3	175.9	63.9	0	0	0	0	114.9	S210 V212 K265	S206-S210 WeakPolarHBondContact OG-CB 3.28Å; S206-S210 PolarHBondContact OG-OG 3.07Å; S206-S210 VanDerWaalsContact OG-OG 3.09Å; S206-V212 PolarHBondContact N-O 2.96Å; S206-V212 WeakPolarHBondContact OG-CB 3.48Å; S206-V212 PolarHBondContact OG-O 2.95Å; S206-K265 CarbonylContact C-O 3.54Å; S206-K265 CarbonylContact O-C 3.56Å; S206-K265 WeakPolarHBondContact O-CB 3.41Å
207	G	76.3	Confident	84.2	Confident	4 Å²	4	27.2 Å²	27.2	4%	0.041	15%	0.152	C	C	.	.	S	Bend	trans	122.5	178.4	166.3	0	0	0	0	0	116.2	W205 N209 S210 P664	W205-G207 PolarHBondContact O-N 3.26Å; G207-N209 PolarHBondContact O-N 2.75Å; G207-S210 PolarHBondContact O-N 2.77Å; G207-S210 VanDerWaalsContact O-N 3.15Å; G207-P664 VanDerWaalsContact C-CG 3.47Å; G207-P664 WeakPolarHBondContact O-CG 3.38Å
208	Q	71.9	Confident	85.3	Confident	118 Å²	118	24.5 Å²	24.5	55%	0.551	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	128.5	-175.9	-80.2	172.2	-6.9	0	0	111.5	S210 P664	Q208-S210 PolarHBondContact O-N 2.9Å; Q208-P664 WeakPolarHBondContact CG-O 3.46Å
209	N	73.1	Confident	85.8	Confident	93 Å²	93	29 Å²	29	50%	0.497	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	15.3	-178.7	-27	-95	0	0	0	114.9	G207 R736	G207-N209 PolarHBondContact O-N 2.75Å; N209-R736 PolarHBondContact OD1-NH1 2.96Å; N209-R736 PolarHBondContact OD1-NH2 3.15Å
210	S	81.4	Confident	86	Confident	13 Å²	13	28 Å²	28	9%	0.091	14%	0.139	C	C	.	.			trans	-91	140.1	163.7	-178.7	0	0	0	0	111.1	S206 G207 Q208 V212 E286	S206-S210 WeakPolarHBondContact OG-CB 3.28Å; S206-S210 PolarHBondContact OG-OG 3.07Å; S206-S210 VanDerWaalsContact OG-OG 3.09Å; G207-S210 PolarHBondContact O-N 2.77Å; G207-S210 VanDerWaalsContact O-N 3.15Å; Q208-S210 PolarHBondContact O-N 2.9Å; S210-V212 PolarHBondContact O-N 3.45Å; S210-V212 WeakPolarHBondContact OG-CB 3.43Å; S210-V212 PolarHBondContact OG-N 3.43Å; S210-V212 VanDerWaalsContact OG-N 3.07Å; S210-E286 WeakPolarHBondContact CB-OE2 3.43Å; S210-E286 PolarHBondContact OG-OE2 2.93Å
211	S	86.6	Confident	85.9	Confident	33 Å²	33	27 Å²	27	23%	0.231	14%	0.136	C	C	.	.			trans	-81.5	1.6	171.7	62.5	0	0	0	0	113.4	T236 D237 Y238	S211-T236 WeakPolarHBondContact CB-O 3.22Å; S211-T236 CarbonylContact O-C 3.16Å; S211-T236 VanDerWaalsContact O-C 3.24Å; S211-T236 PolarHBondContact OG-O 2.69Å; S211-D237 PolarHBondContact O-N 3.31Å; S211-Y238 VanDerWaalsContact CB-CD2 3.46Å; S211-Y238 PolarHBondContact O-N 3.12Å
212	V	90.7	Very high	85.6	Confident	8 Å²	8	31.7 Å²	31.7	5%	0.048	15%	0.152	C	C	.	.			trans	-98.4	117.7	-169.3	177.9	0	0	0	0	112	S206 S210 R234 S235 T236 E286	S206-V212 PolarHBondContact N-O 2.96Å; S206-V212 WeakPolarHBondContact OG-CB 3.48Å; S206-V212 PolarHBondContact OG-O 2.95Å; S210-V212 PolarHBondContact O-N 3.45Å; S210-V212 WeakPolarHBondContact OG-CB 3.43Å; S210-V212 PolarHBondContact OG-N 3.43Å; S210-V212 VanDerWaalsContact OG-N 3.07Å; V212-R234 HydrophobicContact CG1-CG 4.09Å; V212-S235 VanDerWaalsContact CA-O 3.3Å; V212-S235 WeakPolarHBondContact CA-O 3.15Å; V212-S235 WeakPolarHBondContact CG1-O 3.35Å; V212-T236 HydrophobicContact CG2-CG2 4.12Å; V212-E286 HydrophobicContact CB-CB 4.48Å; V212-E286 HydrophobicContact CG1-CB 4.25Å; V212-E286 WeakPolarHBondContact CG1-O 3.45Å; V212-E286 HydrophobicContact CG2-CB 4.49Å
213	I	90.9	Very high	85.4	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	137	174	-50.1	175.4	0	0	0	108.6	V203 W205 R234 S235 Y242	V203-I213 HydrophobicContact CG1-CG2 3.86Å; W205-I213 HydrophobicContact CD2-CD1 4.2Å; W205-I213 HydrophobicContact CD2-CG1 3.69Å; W205-I213 HydrophobicContact CE3-CD1 4.19Å; W205-I213 HydrophobicContact CE3-CG1 3.52Å; W205-I213 HydrophobicContact CG-CG1 4.44Å; W205-I213 HydrophobicContact CH2-CD1 3.61Å; W205-I213 HydrophobicContact CH2-CG1 3.89Å; W205-I213 HydrophobicContact CZ2-CD1 3.63Å; W205-I213 HydrophobicContact CZ2-CG1 4.06Å; W205-I213 HydrophobicContact CZ3-CD1 3.89Å; W205-I213 HydrophobicContact CZ3-CG1 3.61Å; I213-R234 CarbonylContact O-C 3.56Å; I213-R234 WeakPolarHBondContact O-CA 3.5Å; I213-S235 PolarHBondContact N-O 3.21Å; I213-S235 PolarHBondContact O-N 2.93Å; I213-Y242 HydrophobicContact CB-CE1 4.22Å; I213-Y242 HydrophobicContact CG2-CE1 4.23Å
214	L	91.9	Very high	84.9	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	140.4	173.3	-70.9	139.2	0	0	0	109.6	H204 W233 R234 L258 I268	H204-L214 PolarHBondContact N-O 3.34Å; H204-L214 PolarHBondContact O-N 3.22Å; L214-W233 WeakPolarHBondContact CA-O 3.36Å; L214-R234 HydrophobicContact CD2-CB 4.12Å; L214-R234 HydrophobicContact CD2-CG 4.07Å; L214-R234 HydrophobicContact CG-CG 4.48Å; L214-L258 HydrophobicContact CB-CD1 4.27Å; L214-I268 HydrophobicContact CD1-CD1 3.39Å; L214-I268 HydrophobicContact CD1-CG1 3.92Å
215	M	91.1	Very high	84.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	126.5	177.2	178.1	174.2	-168.9	0	0	110.6	L192 A201 M202 V203 T217 W233 W683 L685	L192-M215 HydrophobicContact CD1-CE 4.04Å; L192-M215 HydrophobicContact CD1-SD 3.79Å; A201-M215 HydrophobicContact CB-CE 3.55Å; M202-M215 CarbonylContact O-C 3.51Å; M202-M215 VanDerWaalsContact O-CA 3.24Å; M202-M215 WeakPolarHBondContact O-CA 3.43Å; V203-M215 HydrophobicContact CG2-CE 4.05Å; V203-M215 HydrophobicContact CG2-CG 3.99Å; V203-M215 HydrophobicContact CG2-SD 4.08Å; M215-T217 HydrophobicContact CE-CG2 3.89Å; M215-T217 HydrophobicContact CG-CG2 4.39Å; M215-W233 HydrophobicContact CB-CB 4.26Å; M215-W233 PolarHBondContact N-O 2.75Å; M215-W233 PolarHBondContact O-N 3.35Å; M215-W683 HydrophobicContact CE-CB 4.48Å; M215-W683 HydrophobicContact CE-CD2 4.45Å; M215-W683 HydrophobicContact CE-CG 4.44Å; M215-L685 HydrophobicContact CE-CD1 4.17Å; M215-L685 HydrophobicContact CE-CD2 4.49Å; M215-L685 HydrophobicContact SD-CD1 3.78Å; M215-L685 HydrophobicContact SD-CD2 3.62Å; M215-L685 HydrophobicContact SD-CG 4.22Å
216	L	91.4	Very high	84.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	112.1	172.6	170	59.3	0	0	0	108.1	A201 M202 S231 L232 L255 L258	A201-L216 CarbonylContact C-O 3.49Å; A201-L216 WeakPolarHBondContact CA-O 3.39Å; M202-L216 HydrophobicContact CB-CB 4.46Å; M202-L216 PolarHBondContact N-O 3.33Å; M202-L216 PolarHBondContact O-N 2.85Å; M202-L216 HydrophobicContact SD-CD2 4.49Å; L216-S231 WeakPolarHBondContact CA-O 3.22Å; L216-L232 HydrophobicContact CB-CD1 4.49Å; L216-L255 HydrophobicContact CD1-CB 3.74Å; L216-L255 HydrophobicContact CD1-CD1 4.01Å; L216-L255 HydrophobicContact CD2-CB 4.26Å; L216-L258 HydrophobicContact CB-CB 4.32Å; L216-L258 HydrophobicContact CB-CD1 4.06Å; L216-L258 HydrophobicContact CD2-CB 4.01Å
217	T	90.3	Very high	84.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	136.8	167.2	52.5	0	0	0	0	109.2	L192 D195 H198 Q200 A201 M215 S230 S231 W683	L192-T217 HydrophobicContact CD1-CG2 4.04Å; D195-T217 VanDerWaalsContact OD2-CB 3.29Å; D195-T217 WeakPolarHBondContact OD2-CB 3.37Å; D195-T217 PolarHBondContact OD2-OG1 2.89Å; H198-T217 PolarHBondContact ND1-OG1 2.98Å; Q200-T217 WeakPolarHBondContact O-CA 3.48Å; A201-T217 HydrophobicContact CB-CG2 4.09Å; M215-T217 HydrophobicContact CE-CG2 3.89Å; M215-T217 HydrophobicContact CG-CG2 4.39Å; T217-S230 CarbonylContact O-C 3.49Å; T217-S230 VanDerWaalsContact O-CA 3.25Å; T217-S230 WeakPolarHBondContact O-CA 3.26Å; T217-S231 PolarHBondContact N-O 3.27Å; T217-S231 PolarHBondContact O-N 2.88Å; T217-S231 WeakPolarHBondContact OG1-CB 3.29Å; T217-S231 PolarHBondContact OG1-O 2.97Å; T217-W683 HydrophobicContact CG2-CG 4.44Å
218	K	88.7	Confident	84.8	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.009	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	143.4	-178.7	67.3	-177.3	-176.4	176.1	0	112.6	N199 Q200 V227 S256 Y257	N199-K218 PolarHBondContact N-O 3.33Å; N199-K218 PolarHBondContact OD1-O 3.03Å; Q200-K218 HydrophobicContact CB-CG 3.96Å; Q200-K218 PolarHBondContact N-O 3.49Å; Q200-K218 VanDerWaalsContact N-O 3.1Å; Q200-K218 PolarHBondContact O-N 3.3Å; Q200-K218 VanDerWaalsContact OE1-CE 3.25Å; K218-V227 HydrophobicContact CB-CG1 3.91Å; K218-V227 HydrophobicContact CB-CG2 4.49Å; K218-V227 HydrophobicContact CD-CG2 3.96Å; K218-S256 PolarHBondContact NZ-O 2.73Å; K218-Y257 VanDerWaalsContact NZ-CE1 3.32Å; K218-Y257 PolarHBondContact NZ-OH 3.48Å
219	Y	88.1	Confident	85.5	Confident	99 Å²	99	45.7 Å²	45.7	39%	0.388	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	99.5	174.2	-169.4	-81	0	0	0	107.6	H198 N199 V227 T228 E229	H198-Y219 PolarHBondContact CD2-N 3.1Å; N199-Y219 WeakPolarHBondContact OD1-CA 3.3Å; Y219-V227 WeakPolarHBondContact O-CA 3.46Å; Y219-T228 VanDerWaalsContact CD1-OG1 3.29Å; Y219-T228 WeakPolarHBondContact CD1-OG1 3.29Å; Y219-T228 PolarHBondContact O-N 3.49Å; Y219-E229 PolarHBondContact N-O 2.96Å
220	Y	85.4	Confident	86.3	Confident	44 Å²	44	41.6 Å²	41.6	17%	0.173	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	114.7	179.2	-171.7	-98.7	0	0	0	109.6	N199 F222 G225 R226 V227	N199-Y220 PolarHBondContact ND2-O 3.42Å; N199-Y220 PolarHBondContact OD1-N 3.34Å; Y220-F222 AromaticContact CD1-CD1 3.69Å; Y220-F222 HydrophobicContact CD1-CD1 3.69Å; Y220-F222 AromaticContact CD1-CE1 3.79Å; Y220-F222 HydrophobicContact CD1-CE1 3.79Å; Y220-F222 HydrophobicContact CD1-CG 4.14Å; Y220-F222 HydrophobicContact CD1-CZ 4.31Å; Y220-F222 AromaticContact CE1-CD1 3.79Å; Y220-F222 HydrophobicContact CE1-CD1 3.79Å; Y220-F222 HydrophobicContact CE1-CE1 4.17Å; Y220-F222 HydrophobicContact CE1-CG 4.41Å; Y220-F222 PolarHBondContact O-N 2.93Å; Y220-G225 WeakPolarHBondContact CE2-O 3.48Å; Y220-G225 WeakPolarHBondContact OH-CA 3.5Å; Y220-G225 PolarHBondContact OH-O 2.9Å; Y220-R226 WeakPolarHBondContact CA-O 3.45Å; Y220-V227 HydrophobicContact CD2-CG2 4.21Å
221	D	85	Confident	86.7	Confident	41 Å²	41	41.3 Å²	41.3	22%	0.219	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	104	173.1	171.1	31.4	0	0	0	109.9	N223 S224 G225 R226 T228	D221-N223 PolarHBondContact O-N 3.37Å; D221-N223 WeakPolarHBondContact OD1-CB 3.32Å; D221-N223 PolarHBondContact OD1-N 3.24Å; D221-N223 PolarHBondContact OD1-ND2 3.07Å; D221-S224 WeakPolarHBondContact CB-OG 3.15Å; D221-S224 PolarHBondContact O-N 2.67Å; D221-S224 VanDerWaalsContact OD2-CB 3.28Å; D221-S224 WeakPolarHBondContact OD2-CB 3.41Å; D221-S224 PolarHBondContact OD2-N 2.98Å; D221-S224 VanDerWaalsContact OD2-N 3.12Å; D221-S224 PolarHBondContact OD2-OG 2.91Å; D221-G225 PolarHBondContact O-N 3.38Å; D221-R226 PolarHBondContact N-O 3.23Å; D221-T228 HydrophobicContact CB-CG2 4.39Å
222	F	81.8	Confident	86.9	Confident	117 Å²	117	39.7 Å²	39.7	51%	0.513	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-19.4	178.7	-62.2	-79.2	0	0	0	114.5	N199 Y220 K1210	N199-F222 WeakPolarHBondContact ND2-CE2 3.36Å; Y220-F222 AromaticContact CD1-CD1 3.69Å; Y220-F222 HydrophobicContact CD1-CD1 3.69Å; Y220-F222 AromaticContact CD1-CE1 3.79Å; Y220-F222 HydrophobicContact CD1-CE1 3.79Å; Y220-F222 HydrophobicContact CD1-CG 4.14Å; Y220-F222 HydrophobicContact CD1-CZ 4.31Å; Y220-F222 AromaticContact CE1-CD1 3.79Å; Y220-F222 HydrophobicContact CE1-CD1 3.79Å; Y220-F222 HydrophobicContact CE1-CE1 4.17Å; Y220-F222 HydrophobicContact CE1-CG 4.41Å; Y220-F222 PolarHBondContact O-N 2.93Å; F222-K1210 PolarHBondContact O-NZ 3.04Å
223	N	83.9	Confident	87	Confident	151 Å²	151	39.8 Å²	39.8	81%	0.807	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-44.4	178.5	-54.5	-83.6	0	0	0	112	D221	D221-N223 PolarHBondContact O-N 3.37Å; D221-N223 WeakPolarHBondContact OD1-CB 3.32Å; D221-N223 PolarHBondContact OD1-N 3.24Å; D221-N223 PolarHBondContact OD1-ND2 3.07Å
224	S	76.9	Confident	87.1	Confident	56 Å²	56	41.3 Å²	41.3	39%	0.392	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-14.9	178.2	59.4	0	0	0	0	114.3	D221	D221-S224 WeakPolarHBondContact CB-OG 3.15Å; D221-S224 PolarHBondContact O-N 2.67Å; D221-S224 VanDerWaalsContact OD2-CB 3.28Å; D221-S224 WeakPolarHBondContact OD2-CB 3.41Å; D221-S224 PolarHBondContact OD2-N 2.98Å; D221-S224 VanDerWaalsContact OD2-N 3.12Å; D221-S224 PolarHBondContact OD2-OG 2.91Å
225	G	79.7	Confident	87.1	Confident	30 Å²	30	41.3 Å²	41.3	31%	0.309	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	20.8	-179.8	0	0	0	0	0	114.5	Y220 D221	Y220-G225 WeakPolarHBondContact CE2-O 3.48Å; Y220-G225 WeakPolarHBondContact OH-CA 3.5Å; Y220-G225 PolarHBondContact OH-O 2.9Å; D221-G225 PolarHBondContact O-N 3.38Å
226	R	81.9	Confident	87.2	Confident	95 Å²	95	44.9 Å²	44.9	36%	0.358	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	159.4	-165.4	-65.6	165.1	-168	-126.4	-11.9	112.7	Y220 D221 E275	Y220-R226 WeakPolarHBondContact CA-O 3.45Å; D221-R226 PolarHBondContact N-O 3.23Å; R226-E275 IonicContact CZ-OE1 3.45Å; R226-E275 IonicContact CZ-OE2 2.8Å; R226-E275 VanDerWaalsContact CZ-OE2 3.25Å; R226-E275 IonicContact NH1-OE1 2.86Å; R226-E275 IonicContact NH1-OE2 3.89Å; R226-E275 PolarHBondContact NH1-OE2 2.98Å; R226-E275 IonicContact NH2-OE1 3.81Å; R226-E275 PolarHBondContact NH2-OE1 2.85Å; R226-E275 IonicContact NH2-OE2 3.09Å; R226-E275 PolarHBondContact NH2-OE2 2.86Å
227	V	84.9	Confident	87.1	Confident	8 Å²	8	46.6 Å²	46.6	5%	0.048	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	124.6	167	-175.5	0	0	0	0	109.1	K218 Y219 Y220 E229 I254 D273	K218-V227 HydrophobicContact CB-CG1 3.91Å; K218-V227 HydrophobicContact CB-CG2 4.49Å; K218-V227 HydrophobicContact CD-CG2 3.96Å; Y219-V227 WeakPolarHBondContact O-CA 3.46Å; Y220-V227 HydrophobicContact CD2-CG2 4.21Å; V227-E229 WeakPolarHBondContact CG1-O 3.41Å; V227-I254 HydrophobicContact CB-CG2 3.9Å; V227-I254 HydrophobicContact CG1-CG2 3.61Å; V227-D273 PolarHBondContact N-OD2 2.92Å
228	T	84.8	Confident	87	Confident	74 Å²	74	49.2 Å²	49.2	45%	0.454	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-27.1	177.8	63.6	0	0	0	0	113.3	Y219 D221 I254	Y219-T228 VanDerWaalsContact CD1-OG1 3.29Å; Y219-T228 WeakPolarHBondContact CD1-OG1 3.29Å; Y219-T228 PolarHBondContact O-N 3.49Å; D221-T228 HydrophobicContact CB-CG2 4.39Å; T228-I254 WeakPolarHBondContact O-CD1 3.33Å
229	E	87.1	Confident	86.9	Confident	95 Å²	95	49.1 Å²	49.1	44%	0.444	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	145.9	-178.6	-159.2	168	-125.7	0	0	109.4	T196 H198 Y219 V227	T196-E229 VanDerWaalsContact CB-OE2 3.3Å; T196-E229 WeakPolarHBondContact CB-OE2 3.45Å; T196-E229 WeakPolarHBondContact CG2-OE2 3.31Å; T196-E229 PolarHBondContact OG1-OE2 2.9Å; H198-E229 PolarHBondContact CD2-O 3.2Å; Y219-E229 PolarHBondContact N-O 2.96Å; V227-E229 WeakPolarHBondContact CG1-O 3.41Å
230	S	90.1	Very high	87	Confident	7 Å²	7	46.9 Å²	46.9	5%	0.049	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	144.7	-175.2	63.3	0	0	0	0	112.2	T217 N246 L255	T217-S230 CarbonylContact O-C 3.49Å; T217-S230 VanDerWaalsContact O-CA 3.25Å; T217-S230 WeakPolarHBondContact O-CA 3.26Å; S230-N246 PolarHBondContact O-ND2 3.01Å; S230-L255 PolarHBondContact OG-N 3.2Å
231	S	90.1	Very high	87.3	Confident	6 Å²	6	48.5 Å²	48.5	4%	0.042	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	135.6	172.6	-61.9	0	0	0	0	112.9	D195 H198 L216 T217 K244 N246	D195-S231 WeakPolarHBondContact OD1-CB 3.41Å; D195-S231 PolarHBondContact OD1-OG 3.49Å; H198-S231 PolarHBondContact CE1-OG 3.25Å; L216-S231 WeakPolarHBondContact CA-O 3.22Å; T217-S231 PolarHBondContact N-O 3.27Å; T217-S231 PolarHBondContact O-N 2.88Å; T217-S231 WeakPolarHBondContact OG1-CB 3.29Å; T217-S231 PolarHBondContact OG1-O 2.97Å; S231-K244 WeakPolarHBondContact OG-CE 3.42Å; S231-K244 PolarHBondContact OG-NZ 3.32Å; S231-N246 WeakPolarHBondContact CA-OD1 3.45Å
232	L	91.6	Very high	87.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	130.6	174.2	-175.5	69.3	0	0	0	109.4	L216 L245 N246 V249 L255 L258 L270 Y290	L216-L232 HydrophobicContact CB-CD1 4.49Å; L232-L245 HydrophobicContact CB-CB 4.36Å; L232-L245 HydrophobicContact CD2-CB 4.07Å; L232-L245 HydrophobicContact CD2-CD1 4.12Å; L232-L245 HydrophobicContact CG-CB 4.25Å; L232-L245 HydrophobicContact CG-CD1 4.45Å; L232-L245 PolarHBondContact O-N 2.94Å; L232-N246 PolarHBondContact N-OD1 2.97Å; L232-V249 HydrophobicContact CD2-CG2 3.69Å; L232-L255 HydrophobicContact CB-CD1 3.98Å; L232-L258 HydrophobicContact CD1-CD1 3.82Å; L232-L270 HydrophobicContact CD2-CD1 3.74Å; L232-Y290 HydrophobicContact CD2-CE2 3.92Å
233	W	91.4	Very high	88	Confident	9 Å²	9	46.1 Å²	46.1	3%	0.034	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	146.3	-178.6	-60.7	90.2	0	0	0	110.3	L192 D195 L214 M215 Y242 E243 K244	L192-W233 HydrophobicContact CB-CH2 4.08Å; L192-W233 HydrophobicContact CB-CZ2 3.81Å; L192-W233 HydrophobicContact CD1-CD2 4.25Å; L192-W233 HydrophobicContact CD1-CG 4.23Å; L192-W233 HydrophobicContact CD1-CZ2 4.5Å; L192-W233 HydrophobicContact CD2-CD2 3.9Å; L192-W233 HydrophobicContact CD2-CE3 3.93Å; L192-W233 HydrophobicContact CD2-CG 4.31Å; L192-W233 HydrophobicContact CD2-CH2 4.48Å; L192-W233 HydrophobicContact CD2-CZ2 4.49Å; L192-W233 HydrophobicContact CD2-CZ3 4.21Å; L192-W233 HydrophobicContact CG-CZ2 4.49Å; D195-W233 HydrophobicContact CB-CZ2 3.97Å; D195-W233 WeakPolarHBondContact OD1-CZ2 3.49Å; D195-W233 PolarHBondContact OD1-NE1 2.95Å; L214-W233 WeakPolarHBondContact CA-O 3.36Å; M215-W233 HydrophobicContact CB-CB 4.26Å; M215-W233 PolarHBondContact N-O 2.75Å; M215-W233 PolarHBondContact O-N 3.35Å; W233-Y242 HydrophobicContact CB-CD1 4.34Å; W233-E243 CarbonylContact C-O 3.34Å; W233-E243 WeakPolarHBondContact CA-O 3.37Å; W233-K244 HydrophobicContact CD2-CB 4.24Å; W233-K244 HydrophobicContact CD2-CG 4.22Å; W233-K244 HydrophobicContact CE3-CB 3.76Å; W233-K244 HydrophobicContact CE3-CG 4.23Å; W233-K244 HydrophobicContact CH2-CB 4.07Å; W233-K244 HydrophobicContact CH2-CD 3.77Å; W233-K244 HydrophobicContact CH2-CG 4.2Å; W233-K244 HydrophobicContact CZ2-CB 4.48Å; W233-K244 HydrophobicContact CZ2-CD 3.67Å; W233-K244 HydrophobicContact CZ2-CG 4.14Å; W233-K244 HydrophobicContact CZ3-CB 3.68Å; W233-K244 HydrophobicContact CZ3-CD 4.27Å; W233-K244 HydrophobicContact CZ3-CG 4.23Å
234	R	93	Very high	88.3	Confident	33 Å²	33	42.4 Å²	42.4	13%	0.125	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	125	179.6	-177.4	177.7	-177.7	-102.3	4.9	111.8	V212 I213 L214 Y242 E243 L245 E286 G287	V212-R234 HydrophobicContact CG1-CG 4.09Å; I213-R234 CarbonylContact O-C 3.56Å; I213-R234 WeakPolarHBondContact O-CA 3.5Å; L214-R234 HydrophobicContact CD2-CB 4.12Å; L214-R234 HydrophobicContact CD2-CG 4.07Å; L214-R234 HydrophobicContact CG-CG 4.48Å; R234-Y242 WeakPolarHBondContact O-CA 3.43Å; R234-E243 PolarHBondContact N-O 2.72Å; R234-E243 PolarHBondContact O-N 2.74Å; R234-L245 HydrophobicContact CB-CD1 3.57Å; R234-L245 HydrophobicContact CB-CD2 4.39Å; R234-L245 HydrophobicContact CB-CG 3.98Å; R234-L245 HydrophobicContact CG-CD1 4.34Å; R234-E286 VanDerWaalsContact CZ-O 3.25Å; R234-E286 PolarHBondContact NE-O 2.73Å; R234-E286 PolarHBondContact NH2-O 3.33Å; R234-G287 VanDerWaalsContact CD-O 3.29Å; R234-G287 WeakPolarHBondContact CD-O 3.34Å; R234-G287 PolarHBondContact NE-O 3.46Å
235	S	93.1	Very high	88.9	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.007	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	153.6	165.6	163.2	0	0	0	0	110	V212 I213 D237 G239 T241	V212-S235 VanDerWaalsContact CA-O 3.3Å; V212-S235 WeakPolarHBondContact CA-O 3.15Å; V212-S235 WeakPolarHBondContact CG1-O 3.35Å; I213-S235 PolarHBondContact N-O 3.21Å; I213-S235 PolarHBondContact O-N 2.93Å; S235-D237 PolarHBondContact OG-N 3.28Å; S235-D237 PolarHBondContact OG-OD1 2.52Å; S235-G239 WeakPolarHBondContact OG-CA 3.46Å; S235-G239 PolarHBondContact OG-N 2.98Å; S235-T241 WeakPolarHBondContact CA-O 3.47Å; S235-T241 WeakPolarHBondContact CB-O 3.12Å; S235-T241 PolarHBondContact OG-O 2.59Å
236	T	92.1	Very high	89.1	Confident	74 Å²	74	40.5 Å²	40.5	45%	0.454	20%	0.204	S	C	.	.	S	Bend	trans	-126	15.8	168.4	67.5	0	0	0	0	113.1	S211 V212	S211-T236 WeakPolarHBondContact CB-O 3.22Å; S211-T236 CarbonylContact O-C 3.16Å; S211-T236 VanDerWaalsContact O-C 3.24Å; S211-T236 PolarHBondContact OG-O 2.69Å; V212-T236 HydrophobicContact CG2-CG2 4.12Å
237	D	90.5	Very high	89	Confident	37 Å²	37	43.9 Å²	43.9	20%	0.198	22%	0.224	C	C	.	.	S	Bend	trans	-134.9	27.1	-165.3	60.6	5	0	0	0	112.9	S211 S235 G239 T240 T241 K687	S211-D237 PolarHBondContact O-N 3.31Å; S235-D237 PolarHBondContact OG-N 3.28Å; S235-D237 PolarHBondContact OG-OD1 2.52Å; D237-G239 VanDerWaalsContact C-N 3.26Å; D237-G239 PolarHBondContact O-N 3.49Å; D237-G239 PolarHBondContact OD1-N 2.96Å; D237-T240 WeakPolarHBondContact CB-OG1 3.31Å; D237-T240 PolarHBondContact O-OG1 2.94Å; D237-T240 PolarHBondContact OD1-N 3.12Å; D237-T240 PolarHBondContact OD1-OG1 3.42Å; D237-T240 PolarHBondContact OD2-OG1 3.46Å; D237-T241 VanDerWaalsContact CG-N 3.34Å; D237-T241 PolarHBondContact OD1-N 3.32Å; D237-T241 WeakPolarHBondContact OD2-CB 3.5Å; D237-T241 PolarHBondContact OD2-N 3.09Å; D237-T241 PolarHBondContact OD2-OG1 2.9Å; D237-K687 PolarHBondContact O-NZ 3.08Å
238	Y	86.3	Confident	88.8	Confident	54 Å²	54	48.4 Å²	48.4	21%	0.212	24%	0.243	C	C	.	.	S	Bend	trans	57.6	37	-172.5	-54.2	-100.8	0	0	0	112.3	W205 S211 I670 K687	W205-Y238 AromaticContact CH2-CD1 3.75Å; W205-Y238 HydrophobicContact CH2-CD1 3.75Å; W205-Y238 HydrophobicContact CH2-CG 4.34Å; W205-Y238 AromaticContact CZ3-CD1 3.56Å; W205-Y238 HydrophobicContact CZ3-CD1 3.56Å; W205-Y238 HydrophobicContact CZ3-CE1 4.38Å; W205-Y238 HydrophobicContact CZ3-CG 4.25Å; S211-Y238 VanDerWaalsContact CB-CD2 3.46Å; S211-Y238 PolarHBondContact O-N 3.12Å; Y238-I670 HydrophobicContact CD1-CD1 3.49Å; Y238-I670 VanDerWaalsContact CD1-CD1 3.49Å; Y238-I670 HydrophobicContact CD2-CD1 4.42Å; Y238-I670 HydrophobicContact CE1-CD1 4.01Å; Y238-I670 HydrophobicContact CG-CD1 3.74Å; Y238-K687 WeakPolarHBondContact O-CD 3.36Å; Y238-K687 WeakPolarHBondContact O-CE 3.42Å; Y238-K687 WeakPolarHBondContact O-CG 3.21Å
239	G	87.9	Confident	88.5	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.01	22%	0.224	C	C	.	.	S	Bend	trans	85.1	21	173.7	0	0	0	0	0	116.5	S235 D237 Y242	S235-G239 WeakPolarHBondContact OG-CA 3.46Å; S235-G239 PolarHBondContact OG-N 2.98Å; D237-G239 VanDerWaalsContact C-N 3.26Å; D237-G239 PolarHBondContact O-N 3.49Å; D237-G239 PolarHBondContact OD1-N 2.96Å; G239-Y242 WeakPolarHBondContact CA-OH 3.47Å
240	T	88.9	Confident	88	Confident	52 Å²	52	42.2 Å²	42.2	32%	0.319	22%	0.218	S	C	.	.	S	Bend	trans	-80.6	-29.1	171.7	47.3	0	0	0	0	113.1	S188 F190 D237 K687	S188-T240 WeakPolarHBondContact OG-CG2 3.47Å; F190-T240 WeakPolarHBondContact CD2-O 3.26Å; D237-T240 WeakPolarHBondContact CB-OG1 3.31Å; D237-T240 PolarHBondContact O-OG1 2.94Å; D237-T240 PolarHBondContact OD1-N 3.12Å; D237-T240 PolarHBondContact OD1-OG1 3.42Å; D237-T240 PolarHBondContact OD2-OG1 3.46Å; T240-K687 HydrophobicContact CG2-CD 3.58Å
241	T	91.5	Very high	86.9	Confident	78 Å²	78	47.3 Å²	47.3	48%	0.479	25%	0.248	S	C	.	.			trans	-143.3	148.3	174.3	65.1	0	0	0	0	111.6	F190 S235 D237	F190-T241 HydrophobicContact CD2-CG2 4.43Å; F190-T241 HydrophobicContact CE2-CG2 4.3Å; S235-T241 WeakPolarHBondContact CA-O 3.47Å; S235-T241 WeakPolarHBondContact CB-O 3.12Å; S235-T241 PolarHBondContact OG-O 2.59Å; D237-T241 VanDerWaalsContact CG-N 3.34Å; D237-T241 PolarHBondContact OD1-N 3.32Å; D237-T241 WeakPolarHBondContact OD2-CB 3.5Å; D237-T241 PolarHBondContact OD2-N 3.09Å; D237-T241 PolarHBondContact OD2-OG1 2.9Å
242	Y	91.1	Very high	86	Confident	14 Å²	14	55.8 Å²	55.8	6%	0.055	29%	0.285	C	S	.	.			trans	-126.8	130.7	177.9	-68.4	-100.2	0	0	0	111.6	F190 L192 I213 W233 R234 G239 L685	F190-Y242 HydrophobicContact CB-CD2 4.46Å; F190-Y242 AromaticContact CD1-CD2 3.69Å; F190-Y242 HydrophobicContact CD1-CD2 3.69Å; F190-Y242 HydrophobicContact CD1-CG 4.38Å; F190-Y242 HydrophobicContact CE1-CD2 4.13Å; F190-Y242 HydrophobicContact CE1-CG 4.41Å; F190-Y242 HydrophobicContact CG-CD2 4.11Å; L192-Y242 HydrophobicContact CD2-CG 4.44Å; I213-Y242 HydrophobicContact CB-CE1 4.22Å; I213-Y242 HydrophobicContact CG2-CE1 4.23Å; W233-Y242 HydrophobicContact CB-CD1 4.34Å; R234-Y242 WeakPolarHBondContact O-CA 3.43Å; G239-Y242 WeakPolarHBondContact CA-OH 3.47Å; Y242-L685 HydrophobicContact CE1-CD2 4.22Å; Y242-L685 HydrophobicContact CE2-CB 4.22Å; Y242-L685 HydrophobicContact CE2-CD2 3.95Å; Y242-L685 WeakPolarHBondContact OH-CD2 3.41Å
243	E	91.8	Very high	85.6	Confident	94 Å²	94	56.4 Å²	56.4	44%	0.439	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	133.8	171.2	-170.5	-170.3	-162.9	0	0	110.1	W233 R234 L245 K248	W233-E243 CarbonylContact C-O 3.34Å; W233-E243 WeakPolarHBondContact CA-O 3.37Å; R234-E243 PolarHBondContact N-O 2.72Å; R234-E243 PolarHBondContact O-N 2.74Å; E243-L245 HydrophobicContact CB-CD2 4.22Å; E243-L245 HydrophobicContact CG-CD2 3.94Å; E243-L245 VanDerWaalsContact OE2-CD2 3.24Å; E243-L245 WeakPolarHBondContact OE2-CD2 3.49Å; E243-K248 WeakPolarHBondContact OE1-CE 3.48Å; E243-K248 IonicContact OE1-NZ 2.79Å; E243-K248 PolarHBondContact OE1-NZ 2.77Å; E243-K248 IonicContact OE2-NZ 2.65Å; E243-K248 PolarHBondContact OE2-NZ 3.18Å
244	K	90.3	Very high	85.5	Confident	73 Å²	73	57.7 Å²	57.7	32%	0.317	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	122	172.9	-164.5	167.5	-177	137.7	0	110	G194 D195 S231 W233	G194-K244 PolarHBondContact O-NZ 2.94Å; D195-K244 IonicContact OD1-NZ 2.77Å; D195-K244 PolarHBondContact OD1-NZ 3.17Å; S231-K244 WeakPolarHBondContact OG-CE 3.42Å; S231-K244 PolarHBondContact OG-NZ 3.32Å; W233-K244 HydrophobicContact CD2-CB 4.24Å; W233-K244 HydrophobicContact CD2-CG 4.22Å; W233-K244 HydrophobicContact CE3-CB 3.76Å; W233-K244 HydrophobicContact CE3-CG 4.23Å; W233-K244 HydrophobicContact CH2-CB 4.07Å; W233-K244 HydrophobicContact CH2-CD 3.77Å; W233-K244 HydrophobicContact CH2-CG 4.2Å; W233-K244 HydrophobicContact CZ2-CB 4.48Å; W233-K244 HydrophobicContact CZ2-CD 3.67Å; W233-K244 HydrophobicContact CZ2-CG 4.14Å; W233-K244 HydrophobicContact CZ3-CB 3.68Å; W233-K244 HydrophobicContact CZ3-CD 4.27Å; W233-K244 HydrophobicContact CZ3-CG 4.23Å
245	L	88.6	Confident	85.3	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.01	29%	0.291	C	S	.	.			trans	-101.6	-0.4	-169.7	-59.8	-167.1	0	0	0	115.1	L232 R234 E243 E247 K248 V249 Y290	L232-L245 HydrophobicContact CB-CB 4.36Å; L232-L245 HydrophobicContact CD2-CB 4.07Å; L232-L245 HydrophobicContact CD2-CD1 4.12Å; L232-L245 HydrophobicContact CG-CB 4.25Å; L232-L245 HydrophobicContact CG-CD1 4.45Å; L232-L245 PolarHBondContact O-N 2.94Å; R234-L245 HydrophobicContact CB-CD1 3.57Å; R234-L245 HydrophobicContact CB-CD2 4.39Å; R234-L245 HydrophobicContact CB-CG 3.98Å; R234-L245 HydrophobicContact CG-CD1 4.34Å; E243-L245 HydrophobicContact CB-CD2 4.22Å; E243-L245 HydrophobicContact CG-CD2 3.94Å; E243-L245 VanDerWaalsContact OE2-CD2 3.24Å; E243-L245 WeakPolarHBondContact OE2-CD2 3.49Å; L245-E247 PolarHBondContact O-N 2.95Å; L245-K248 HydrophobicContact CD2-CD 4.05Å; L245-K248 PolarHBondContact O-N 2.95Å; L245-V249 PolarHBondContact O-N 2.81Å; L245-Y290 HydrophobicContact CD1-CE2 4.26Å
246	N	84.1	Confident	85.1	Confident	43 Å²	43	56.8 Å²	56.8	23%	0.23	29%	0.294	C	S	.	.	H	α-helix	trans	-47.8	-37.9	-176.9	-72.2	58.1	0	0	0	114.1	S230 S231 L232 K248 V249 G250	S230-N246 PolarHBondContact O-ND2 3.01Å; S231-N246 WeakPolarHBondContact CA-OD1 3.45Å; L232-N246 PolarHBondContact N-OD1 2.97Å; N246-K248 PolarHBondContact O-N 2.88Å; N246-V249 PolarHBondContact O-N 3.01Å; N246-G250 CarbonylContact O-C 3.59Å; N246-G250 PolarHBondContact O-N 2.85Å
247	E	80.8	Confident	85	Confident	167 Å²	167	55 Å²	55	78%	0.78	28%	0.279	S	S	*	.	H	α-helix	trans	-67.5	-32.7	178.2	-60.9	-167	160.6	0	0	113.3	L245 T251	L245-E247 PolarHBondContact O-N 2.95Å; E247-T251 HydrophobicContact CB-CG2 4.44Å; E247-T251 HydrophobicContact CG-CG2 4.14Å
248	K	79.8	Confident	85	Confident	103 Å²	103	53.6 Å²	53.6	45%	0.448	27%	0.272	S	S	.	.	H	α-helix	trans	-78.8	-27	178.4	-52.6	-177.1	-162.3	171.5	0	112.4	E243 L245 N246	E243-K248 WeakPolarHBondContact OE1-CE 3.48Å; E243-K248 IonicContact OE1-NZ 2.79Å; E243-K248 PolarHBondContact OE1-NZ 2.77Å; E243-K248 IonicContact OE2-NZ 2.65Å; E243-K248 PolarHBondContact OE2-NZ 3.18Å; L245-K248 HydrophobicContact CD2-CD 4.05Å; L245-K248 PolarHBondContact O-N 2.95Å; N246-K248 PolarHBondContact O-N 2.88Å
249	V	78.9	Confident	85.2	Confident	9 Å²	9	53.7 Å²	53.7	6%	0.055	27%	0.272	C	S	.	.	H	α-helix	trans	-84.4	-22.5	175.5	176.3	0	0	0	0	112	L232 L245 N246 S253 L255 L281 Y290	L232-V249 HydrophobicContact CD2-CG2 3.69Å; L245-V249 PolarHBondContact O-N 2.81Å; N246-V249 PolarHBondContact O-N 3.01Å; V249-S253 PolarHBondContact O-OG 2.92Å; V249-S253 VanDerWaalsContact O-OG 3.13Å; V249-L255 HydrophobicContact CG1-CD1 4.21Å; V249-L255 HydrophobicContact CG1-CD2 4.03Å; V249-L255 HydrophobicContact CG1-CG 4.4Å; V249-L281 HydrophobicContact CG1-CD1 4.26Å; V249-L281 HydrophobicContact CG1-CD2 3.98Å; V249-Y290 HydrophobicContact CG2-CD2 4.06Å; V249-Y290 HydrophobicContact CG2-CE2 4.37Å
250	G	76.4	Confident	85.2	Confident	30 Å²	30	55 Å²	55	31%	0.309	28%	0.28	S	S	.	.			trans	108	122.9	-179.7	0	0	0	0	0	111.6	N246 K252 S253	N246-G250 CarbonylContact O-C 3.59Å; N246-G250 PolarHBondContact O-N 2.85Å; G250-K252 PolarHBondContact O-N 2.92Å; G250-S253 WeakPolarHBondContact O-CB 3.45Å; G250-S253 PolarHBondContact O-N 2.98Å; G250-S253 PolarHBondContact O-OG 3.06Å
251	T	66.3	Low	85.3	Confident	113 Å²	113	52.6 Å²	52.6	69%	0.693	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	15.5	-168.7	62.2	0	0	0	0	116.2	E247	E247-T251 HydrophobicContact CB-CG2 4.44Å; E247-T251 HydrophobicContact CG-CG2 4.14Å
252	K	72.1	Confident	85	Confident	185 Å²	185	52 Å²	52	80%	0.804	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.8	-5.3	173.4	-68.2	-170.3	175.7	-172.6	0	113.4	G250 I254	G250-K252 PolarHBondContact O-N 2.92Å; K252-I254 PolarHBondContact O-N 2.82Å
253	S	82.8	Confident	84.8	Confident	13 Å²	13	54 Å²	54	9%	0.091	28%	0.275	C	S	.	.			trans	-73.4	112.5	177	-54.3	0	0	0	0	108.6	V249 G250 K292	V249-S253 PolarHBondContact O-OG 2.92Å; V249-S253 VanDerWaalsContact O-OG 3.13Å; G250-S253 WeakPolarHBondContact O-CB 3.45Å; G250-S253 PolarHBondContact O-N 2.98Å; G250-S253 PolarHBondContact O-OG 3.06Å; S253-K292 PolarHBondContact OG-NZ 3.4Å
254	I	88.4	Confident	84.6	Confident	36 Å²	36	51.5 Å²	51.5	19%	0.185	26%	0.264	C	S	.	.			trans	-88.1	125.7	170.3	-66.4	171	0	0	0	107.9	V227 T228 K252 T272 D273 V276	V227-I254 HydrophobicContact CB-CG2 3.9Å; V227-I254 HydrophobicContact CG1-CG2 3.61Å; T228-I254 WeakPolarHBondContact O-CD1 3.33Å; K252-I254 PolarHBondContact O-N 2.82Å; I254-T272 CarbonylContact O-C 3.57Å; I254-T272 WeakPolarHBondContact O-CA 3.4Å; I254-T272 VanDerWaalsContact O-CB 3.25Å; I254-T272 WeakPolarHBondContact O-CB 3.37Å; I254-T272 WeakPolarHBondContact O-CG2 3.18Å; I254-D273 HydrophobicContact CG2-CB 4.11Å; I254-D273 PolarHBondContact O-N 3.16Å; I254-V276 HydrophobicContact CD1-CG1 4.46Å; I254-V276 HydrophobicContact CD1-CG2 4.27Å
255	L	89.5	Confident	84.4	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	134.2	-175.1	-62.2	179.3	0	0	0	111.7	L216 S230 L232 V249 L270 L271 T272 L281	L216-L255 HydrophobicContact CD1-CB 3.74Å; L216-L255 HydrophobicContact CD1-CD1 4.01Å; L216-L255 HydrophobicContact CD2-CB 4.26Å; S230-L255 PolarHBondContact OG-N 3.2Å; L232-L255 HydrophobicContact CB-CD1 3.98Å; V249-L255 HydrophobicContact CG1-CD1 4.21Å; V249-L255 HydrophobicContact CG1-CD2 4.03Å; V249-L255 HydrophobicContact CG1-CG 4.4Å; L255-L270 HydrophobicContact CD1-CD1 4.06Å; L255-L270 HydrophobicContact CD2-CB 4.1Å; L255-L270 HydrophobicContact CD2-CD1 4.32Å; L255-L271 WeakPolarHBondContact CA-O 3.45Å; L255-T272 HydrophobicContact CD2-CG2 4.11Å; L255-L281 HydrophobicContact CD2-CD1 4.1Å
256	S	88.7	Confident	84.3	Confident	10 Å²	10	58.6 Å²	58.6	7%	0.07	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-57.9	178.2	54.3	0	0	0	0	111	K218 L271 T272	K218-S256 PolarHBondContact NZ-O 2.73Å; S256-L271 PolarHBondContact N-O 3.39Å; S256-L271 PolarHBondContact OG-O 2.59Å; S256-T272 PolarHBondContact OG-O 3.43Å; S256-T272 VanDerWaalsContact OG-O 3.04Å
257	Y	89.6	Confident	84.7	Confident	36 Å²	36	57.2 Å²	57.2	14%	0.141	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	132.1	175.7	-25.1	-108.9	0	0	0	116.6	M202 K218 L270 L271 D1213	M202-Y257 HydrophobicContact CE-CD1 3.81Å; M202-Y257 HydrophobicContact CE-CE1 3.53Å; M202-Y257 HydrophobicContact SD-CD1 4.18Å; M202-Y257 HydrophobicContact SD-CE1 4.43Å; K218-Y257 VanDerWaalsContact NZ-CE1 3.32Å; K218-Y257 PolarHBondContact NZ-OH 3.48Å; Y257-L270 WeakPolarHBondContact O-CA 3.44Å; Y257-L271 PolarHBondContact N-O 2.83Å; Y257-L271 PolarHBondContact O-N 2.91Å; Y257-D1213 HydrophobicContact CE1-CB 3.84Å; Y257-D1213 HydrophobicContact CE2-CB 4.29Å; Y257-D1213 VanDerWaalsContact CZ-OD2 3.26Å; Y257-D1213 VanDerWaalsContact OH-CB 3.23Å; Y257-D1213 WeakPolarHBondContact OH-CB 3.15Å; Y257-D1213 PolarHBondContact OH-OD2 3.27Å
258	L	91.3	Very high	85.2	Confident	9 Å²	9	49.2 Å²	49.2	5%	0.047	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	118.5	149	-169.7	151.8	0	0	0	110.4	H204 L214 L216 L232 V260 L270	H204-L258 HydrophobicContact CB-CD2 4.06Å; L214-L258 HydrophobicContact CB-CD1 4.27Å; L216-L258 HydrophobicContact CB-CB 4.32Å; L216-L258 HydrophobicContact CB-CD1 4.06Å; L216-L258 HydrophobicContact CD2-CB 4.01Å; L232-L258 HydrophobicContact CD1-CD1 3.82Å; L258-V260 HydrophobicContact CD2-CG2 4.02Å; L258-L270 HydrophobicContact CB-CD2 3.98Å; L258-L270 HydrophobicContact CD1-CD2 3.73Å; L258-L270 HydrophobicContact CG-CD2 3.57Å
259	Y	90.4	Very high	85.9	Confident	55 Å²	55	44.3 Å²	44.3	22%	0.216	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	137.3	174.5	-59.7	-82.7	0	0	0	110.9	I268 M269 L271 L302 F304	Y259-I268 WeakPolarHBondContact O-CA 3.44Å; Y259-M269 PolarHBondContact N-O 3.46Å; Y259-M269 PolarHBondContact O-N 2.76Å; Y259-L271 HydrophobicContact CE2-CD1 3.8Å; Y259-L271 HydrophobicContact CE2-CG 4.09Å; Y259-L302 HydrophobicContact CD2-CD1 3.86Å; Y259-L302 HydrophobicContact CE2-CD1 3.73Å; Y259-L302 HydrophobicContact CG-CD1 4.41Å; Y259-F304 HydrophobicContact CD1-CE2 4.28Å; Y259-F304 HydrophobicContact CG-CE2 4.41Å; Y259-F304 HydrophobicContact CG-CZ 4.47Å
260	V	88.9	Confident	86.5	Confident	29 Å²	29	43.9 Å²	43.9	18%	0.176	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	128.5	167.8	178.5	0	0	0	0	107.2	H204 L258 K265 I268	H204-V260 HydrophobicContact CB-CG2 3.85Å; L258-V260 HydrophobicContact CD2-CG2 4.02Å; V260-K265 HydrophobicContact CG1-CB 3.72Å; V260-K265 HydrophobicContact CG1-CG 4.09Å; V260-K265 WeakPolarHBondContact CG1-O 3.35Å; V260-I268 HydrophobicContact CG2-CG1 4.33Å
261	S	89.4	Confident	87.2	Confident	2 Å²	2	43 Å²	43	1%	0.014	21%	0.21	C	C	.	.			trans	-60.9	130	179.8	176.3	0	0	0	0	110.9	N263 N264 K265 K267	S261-N263 PolarHBondContact O-N 3.29Å; S261-N264 WeakPolarHBondContact CB-O 3.38Å; S261-N264 CarbonylContact O-C 3.46Å; S261-K265 VanDerWaalsContact O-CA 3.31Å; S261-K265 WeakPolarHBondContact O-CA 3.21Å; S261-K265 VanDerWaalsContact O-CG 3.22Å; S261-K265 WeakPolarHBondContact O-CG 3.45Å; S261-K265 PolarHBondContact O-N 3.31Å; S261-K267 WeakPolarHBondContact CB-O 3.37Å; S261-K267 PolarHBondContact N-O 3.44Å
262	P	86.8	Confident	88.4	Confident	65 Å²	65	38 Å²	38	42%	0.422	18%	0.179	S	C	.	.	S	Bend	trans	-62	-42.3	-177.2	17.2	-25.3	0	0	0	112.4	K265 F304	P262-K265 WeakPolarHBondContact O-CE 3.39Å; P262-F304 HydrophobicContact CG-CB 3.8Å; P262-F304 HydrophobicContact CG-CG 4.23Å
263	N	85.2	Confident	89.1	Confident	57 Å²	57	29.8 Å²	29.8	31%	0.305	14%	0.144	S	C	.	.	S	Bend	trans	-82.2	-39.5	-171.1	-39.5	-0.2	0	0	0	111.3	S261 H305 P306 E307 E309	S261-N263 PolarHBondContact O-N 3.29Å; N263-H305 PolarHBondContact ND2-O 3.2Å; N263-H305 PolarHBondContact OD1-O 2.85Å; N263-P306 VanDerWaalsContact CG-O 3.27Å; N263-P306 PolarHBondContact ND2-O 3.16Å; N263-P306 PolarHBondContact OD1-O 3.41Å; N263-P306 VanDerWaalsContact OD1-O 3.13Å; N263-E307 PolarHBondContact ND2-O 2.88Å; N263-E309 HydrophobicContact CB-CB 4.25Å
264	N	87.7	Confident	89.1	Confident	40 Å²	40	32.3 Å²	32.3	21%	0.214	16%	0.16	C	C	.	.			trans	-131.9	84.8	178.7	-175.7	-11.2	0	0	0	110.1	S261 R266 K267 E309	S261-N264 WeakPolarHBondContact CB-O 3.38Å; S261-N264 CarbonylContact O-C 3.46Å; N264-R266 PolarHBondContact O-N 3.44Å; N264-R266 WeakPolarHBondContact OD1-CB 3.46Å; N264-R266 WeakPolarHBondContact OD1-CG 3.5Å; N264-R266 PolarHBondContact OD1-N 3Å; N264-K267 HydrophobicContact CB-CG 4.41Å; N264-K267 WeakPolarHBondContact O-CB 3.47Å; N264-K267 PolarHBondContact O-N 2.94Å; N264-E309 HydrophobicContact CB-CB 4.03Å; N264-E309 WeakPolarHBondContact CB-OE2 3.47Å; N264-E309 PolarHBondContact ND2-OE2 3.01Å
265	K	86.6	Confident	88.7	Confident	82 Å²	82	36.6 Å²	36.6	36%	0.357	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-5.5	-172.1	-60.2	171.8	-175.1	177.1	0	114.4	S206 V260 S261 P262	S206-K265 CarbonylContact C-O 3.54Å; S206-K265 CarbonylContact O-C 3.56Å; S206-K265 WeakPolarHBondContact O-CB 3.41Å; V260-K265 HydrophobicContact CG1-CB 3.72Å; V260-K265 HydrophobicContact CG1-CG 4.09Å; V260-K265 WeakPolarHBondContact CG1-O 3.35Å; S261-K265 VanDerWaalsContact O-CA 3.31Å; S261-K265 WeakPolarHBondContact O-CA 3.21Å; S261-K265 VanDerWaalsContact O-CG 3.22Å; S261-K265 WeakPolarHBondContact O-CG 3.45Å; S261-K265 PolarHBondContact O-N 3.31Å; P262-K265 WeakPolarHBondContact O-CE 3.39Å
266	R	87.4	Confident	88.3	Confident	143 Å²	143	40.6 Å²	40.6	54%	0.54	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-26.2	167.7	-52.6	-174.8	126.4	142	9.2	113.6	N264 E286	N264-R266 PolarHBondContact O-N 3.44Å; N264-R266 WeakPolarHBondContact OD1-CB 3.46Å; N264-R266 WeakPolarHBondContact OD1-CG 3.5Å; N264-R266 PolarHBondContact OD1-N 3Å; R266-E286 HydrophobicContact CB-CG 3.84Å; R266-E286 HydrophobicContact CG-CG 3.83Å; R266-E286 IonicContact CZ-OE1 3.37Å; R266-E286 VanDerWaalsContact CZ-OE1 3.25Å; R266-E286 IonicContact NE-OE1 3.57Å; R266-E286 PolarHBondContact NE-OE1 2.87Å; R266-E286 IonicContact NH2-OE1 2.72Å; R266-E286 PolarHBondContact NH2-OE1 3.35Å; R266-E286 PolarHBondContact O-N 2.71Å; R266-E286 VanDerWaalsContact O-N 3.12Å
267	K	91.4	Very high	88.1	Confident	13 Å²	13	43.8 Å²	43.8	6%	0.057	22%	0.218	C	C	.	.			trans	-84.4	118.5	176.8	-56	-172.4	-174.1	176.9	0	109.2	S261 N264 S283 L284 E309 D310 F327	S261-K267 WeakPolarHBondContact CB-O 3.37Å; S261-K267 PolarHBondContact N-O 3.44Å; N264-K267 HydrophobicContact CB-CG 4.41Å; N264-K267 WeakPolarHBondContact O-CB 3.47Å; N264-K267 PolarHBondContact O-N 2.94Å; K267-S283 WeakPolarHBondContact CA-O 3.48Å; K267-L284 HydrophobicContact CB-CD2 4.31Å; K267-L284 HydrophobicContact CD-CD2 4Å; K267-L284 HydrophobicContact CG-CD2 3.84Å; K267-E309 WeakPolarHBondContact CE-OE1 3.42Å; K267-E309 PolarHBondContact NZ-O 3.22Å; K267-E309 IonicContact NZ-OE1 2.75Å; K267-E309 PolarHBondContact NZ-OE1 2.84Å; K267-E309 IonicContact NZ-OE2 3.81Å; K267-D310 IonicContact NZ-OD1 4Å; K267-D310 PolarHBondContact NZ-OD1 3.38Å; K267-D310 IonicContact NZ-OD2 3.17Å; K267-D310 PolarHBondContact NZ-OD2 2.87Å; K267-F327 HydrophobicContact CB-CD1 4.31Å; K267-F327 HydrophobicContact CB-CD2 4.45Å; K267-F327 HydrophobicContact CB-CE1 3.73Å; K267-F327 HydrophobicContact CB-CE2 3.91Å; K267-F327 HydrophobicContact CB-CZ 3.52Å; K267-F327 HydrophobicContact CD-CD2 3.95Å; K267-F327 HydrophobicContact CD-CE2 4.14Å; K267-F327 HydrophobicContact CD-CG 4.17Å; K267-F327 HydrophobicContact CD-CZ 4.5Å
268	I	92.3	Very high	88	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140.6	-176.1	-65.9	133.2	0	0	0	108.9	L214 Y259 V260 L270 S283 E286 G287 Y290	L214-I268 HydrophobicContact CD1-CD1 3.39Å; L214-I268 HydrophobicContact CD1-CG1 3.92Å; Y259-I268 WeakPolarHBondContact O-CA 3.44Å; V260-I268 HydrophobicContact CG2-CG1 4.33Å; I268-L270 HydrophobicContact CG2-CD2 4.17Å; I268-S283 PolarHBondContact N-O 3.5Å; I268-S283 PolarHBondContact O-N 2.94Å; I268-E286 VanDerWaalsContact CD1-C 3.41Å; I268-G287 VanDerWaalsContact CD1-N 3.29Å; I268-Y290 HydrophobicContact CG2-CE1 4.35Å
269	M	93.2	Very high	88	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	125.2	-174.2	175.8	172.3	-71	0	0	109.4	Y259 L280 L281 I282 L302 F304 I312 F327	Y259-M269 PolarHBondContact N-O 3.46Å; Y259-M269 PolarHBondContact O-N 2.76Å; M269-L280 HydrophobicContact CE-CD1 4.28Å; M269-L280 HydrophobicContact CE-CD2 4.08Å; M269-L280 HydrophobicContact CG-CD1 3.5Å; M269-L280 VanDerWaalsContact CG-CD1 3.5Å; M269-L280 HydrophobicContact CG-CG 4.33Å; M269-L280 HydrophobicContact SD-CD1 3.78Å; M269-L281 WeakPolarHBondContact CA-O 3.1Å; M269-I282 HydrophobicContact CE-CG1 4.42Å; M269-L302 HydrophobicContact SD-CD1 3.73Å; M269-F304 HydrophobicContact SD-CZ 4.37Å; M269-I312 HydrophobicContact CE-CD1 3.42Å; M269-I312 VanDerWaalsContact CE-CD1 3.42Å; M269-I312 HydrophobicContact SD-CD1 4.17Å; M269-F327 HydrophobicContact CB-CE1 4.05Å; M269-F327 HydrophobicContact CB-CZ 4.32Å; M269-F327 HydrophobicContact CE-CD1 3.81Å; M269-F327 HydrophobicContact CE-CE1 3.76Å; M269-F327 HydrophobicContact CE-CG 4.3Å; M269-F327 HydrophobicContact CE-CZ 4.19Å; M269-F327 WeakPolarHBondContact CE-O 3.38Å
270	L	92.3	Very high	88.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	137	177.3	-46.9	174.8	0	0	0	109.5	L232 L255 Y257 L258 I268 L281 Y290	L232-L270 HydrophobicContact CD2-CD1 3.74Å; L255-L270 HydrophobicContact CD1-CD1 4.06Å; L255-L270 HydrophobicContact CD2-CB 4.1Å; L255-L270 HydrophobicContact CD2-CD1 4.32Å; Y257-L270 WeakPolarHBondContact O-CA 3.44Å; L258-L270 HydrophobicContact CB-CD2 3.98Å; L258-L270 HydrophobicContact CD1-CD2 3.73Å; L258-L270 HydrophobicContact CG-CD2 3.57Å; I268-L270 HydrophobicContact CG2-CD2 4.17Å; L270-L281 HydrophobicContact CB-CB 4.25Å; L270-L281 HydrophobicContact CD1-CB 4.48Å; L270-L281 PolarHBondContact N-O 2.99Å; L270-L281 PolarHBondContact O-N 3.26Å; L270-Y290 HydrophobicContact CD1-CD1 3.96Å; L270-Y290 HydrophobicContact CD1-CE1 3.48Å; L270-Y290 VanDerWaalsContact CD1-CE1 3.48Å; L270-Y290 HydrophobicContact CG-CD1 4.45Å; L270-Y290 HydrophobicContact CG-CE1 3.85Å
271	L	91.9	Very high	88.3	Confident	12 Å²	12	39.5 Å²	39.5	6%	0.063	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	143.1	168.7	-60.3	179.8	0	0	0	109.6	L255 S256 Y257 Y259 L280 I299	L255-L271 WeakPolarHBondContact CA-O 3.45Å; S256-L271 PolarHBondContact N-O 3.39Å; S256-L271 PolarHBondContact OG-O 2.59Å; Y257-L271 PolarHBondContact N-O 2.83Å; Y257-L271 PolarHBondContact O-N 2.91Å; Y259-L271 HydrophobicContact CE2-CD1 3.8Å; Y259-L271 HydrophobicContact CE2-CG 4.09Å; L271-L280 HydrophobicContact CD2-CD1 3.47Å; L271-L280 VanDerWaalsContact CD2-CD1 3.47Å; L271-I299 HydrophobicContact CD1-CB 4.41Å; L271-I299 HydrophobicContact CD1-CG2 4.2Å; L271-I299 HydrophobicContact CD2-CD1 3.97Å
272	T	90.6	Very high	88.5	Confident	7 Å²	7	39.5 Å²	39.5	4%	0.043	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	163.6	166.1	45.5	0	0	0	0	111.6	I254 L255 S256 E277 S279 L281	I254-T272 CarbonylContact O-C 3.57Å; I254-T272 WeakPolarHBondContact O-CA 3.4Å; I254-T272 VanDerWaalsContact O-CB 3.25Å; I254-T272 WeakPolarHBondContact O-CB 3.37Å; I254-T272 WeakPolarHBondContact O-CG2 3.18Å; L255-T272 HydrophobicContact CD2-CG2 4.11Å; S256-T272 PolarHBondContact OG-O 3.43Å; S256-T272 VanDerWaalsContact OG-O 3.04Å; T272-E277 WeakPolarHBondContact CB-O 3.09Å; T272-E277 PolarHBondContact OG1-O 3.49Å; T272-S279 PolarHBondContact N-O 2.87Å; T272-S279 WeakPolarHBondContact OG1-CB 3.33Å; T272-S279 PolarHBondContact OG1-N 2.86Å; T272-S279 VanDerWaalsContact OG1-N 3.13Å; T272-S279 PolarHBondContact OG1-O 2.78Å; T272-S279 VanDerWaalsContact OG1-O 3.05Å; T272-L281 HydrophobicContact CG2-CD1 3.95Å
273	D	86.3	Confident	88.8	Confident	13 Å²	13	36.4 Å²	36.4	7%	0.07	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-69	118.1	172	-168.7	-59.3	0	0	0	109.8	V227 I254 E275 V276 E277	V227-D273 PolarHBondContact N-OD2 2.92Å; I254-D273 HydrophobicContact CG2-CB 4.11Å; I254-D273 PolarHBondContact O-N 3.16Å; D273-E275 VanDerWaalsContact C-N 3.26Å; D273-E275 PolarHBondContact O-N 2.89Å; D273-E275 PolarHBondContact OD1-N 2.86Å; D273-V276 PolarHBondContact O-N 2.93Å; D273-V276 VanDerWaalsContact O-N 3.08Å; D273-E277 PolarHBondContact O-N 2.99Å
274	P	82.9	Confident	89.1	Confident	66 Å²	66	37.4 Å²	37.4	43%	0.429	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-24.7	-167.4	26.9	-35.2	0	0	0	113.5	V276 D298	P274-V276 PolarHBondContact O-N 2.96Å; P274-D298 HydrophobicContact CB-CB 4.23Å; P274-D298 WeakPolarHBondContact CB-OD1 3.24Å
275	E	80.6	Confident	89.3	Confident	126 Å²	126	38.3 Å²	38.3	59%	0.589	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-16	177.1	-73.1	-92.5	-176.6	0	0	112.8	R226 D273	R226-E275 IonicContact CZ-OE1 3.45Å; R226-E275 IonicContact CZ-OE2 2.8Å; R226-E275 VanDerWaalsContact CZ-OE2 3.25Å; R226-E275 IonicContact NH1-OE1 2.86Å; R226-E275 IonicContact NH1-OE2 3.89Å; R226-E275 PolarHBondContact NH1-OE2 2.98Å; R226-E275 IonicContact NH2-OE1 3.81Å; R226-E275 PolarHBondContact NH2-OE1 2.85Å; R226-E275 IonicContact NH2-OE2 3.09Å; R226-E275 PolarHBondContact NH2-OE2 2.86Å; D273-E275 VanDerWaalsContact C-N 3.26Å; D273-E275 PolarHBondContact O-N 2.89Å; D273-E275 PolarHBondContact OD1-N 2.86Å
276	V	81.2	Confident	89.4	Confident	88 Å²	88	35.7 Å²	35.7	53%	0.533	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-47.6	176.9	-178.2	0	0	0	0	110.5	I254 D273 P274	I254-V276 HydrophobicContact CD1-CG1 4.46Å; I254-V276 HydrophobicContact CD1-CG2 4.27Å; D273-V276 PolarHBondContact O-N 2.93Å; D273-V276 VanDerWaalsContact O-N 3.08Å; P274-V276 PolarHBondContact O-N 2.96Å
277	E	84.6	Confident	89.6	Confident	77 Å²	77	28.9 Å²	28.9	36%	0.36	16%	0.156	S	C	.	.			trans	-162.2	117.4	177.7	-170.6	179.8	-171.6	0	0	110.2	T272 D273 S279 K292	T272-E277 WeakPolarHBondContact CB-O 3.09Å; T272-E277 PolarHBondContact OG1-O 3.49Å; D273-E277 PolarHBondContact O-N 2.99Å; E277-S279 PolarHBondContact O-N 2.77Å; E277-K292 VanDerWaalsContact OE1-CE 3.29Å; E277-K292 WeakPolarHBondContact OE1-CE 3.37Å; E277-K292 IonicContact OE1-NZ 3.13Å; E277-K292 PolarHBondContact OE1-NZ 3.44Å; E277-K292 IonicContact OE2-NZ 3.94Å; E277-K292 PolarHBondContact OE2-NZ 3.07Å
278	S	88.1	Confident	89.5	Confident	30 Å²	30	30.4 Å²	30.4	21%	0.21	17%	0.17	C	C	.	.			trans	-77.9	102.4	173.4	-160.8	0	0	0	0	110.3	L295 F297 D298	S278-L295 PolarHBondContact O-N 3Å; S278-L295 VanDerWaalsContact O-N 3.13Å; S278-F297 PolarHBondContact OG-O 3.39Å; S278-D298 WeakPolarHBondContact CB-OD1 3.43Å; S278-D298 PolarHBondContact OG-OD1 3.07Å
279	S	90.7	Very high	89.4	Confident	5 Å²	5	33.2 Å²	33.2	4%	0.035	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	156.7	-173.5	-82.3	0	0	0	0	113.4	T272 E277 H293	T272-S279 PolarHBondContact N-O 2.87Å; T272-S279 WeakPolarHBondContact OG1-CB 3.33Å; T272-S279 PolarHBondContact OG1-N 2.86Å; T272-S279 VanDerWaalsContact OG1-N 3.13Å; T272-S279 PolarHBondContact OG1-O 2.78Å; T272-S279 VanDerWaalsContact OG1-O 3.05Å; E277-S279 PolarHBondContact O-N 2.77Å; S279-H293 WeakPolarHBondContact CA-O 3.27Å
280	L	92.5	Very high	89.3	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.5	-179.2	-169.9	69.6	0	0	0	109	M269 L271 I282 K292 H293 L295 G328 W331	M269-L280 HydrophobicContact CE-CD1 4.28Å; M269-L280 HydrophobicContact CE-CD2 4.08Å; M269-L280 HydrophobicContact CG-CD1 3.5Å; M269-L280 VanDerWaalsContact CG-CD1 3.5Å; M269-L280 HydrophobicContact CG-CG 4.33Å; M269-L280 HydrophobicContact SD-CD1 3.78Å; L271-L280 HydrophobicContact CD2-CD1 3.47Å; L271-L280 VanDerWaalsContact CD2-CD1 3.47Å; L280-I282 HydrophobicContact CD2-CD1 3.92Å; L280-I282 HydrophobicContact CD2-CG1 4.1Å; L280-I282 HydrophobicContact CG-CD1 4.47Å; L280-I282 HydrophobicContact CG-CG1 4.16Å; L280-K292 WeakPolarHBondContact O-CA 3.36Å; L280-H293 HydrophobicContact CB-CB 4.42Å; L280-H293 PolarHBondContact N-O 3.01Å; L280-H293 PolarHBondContact O-N 3.28Å; L280-L295 HydrophobicContact CB-CD1 4.33Å; L280-L295 HydrophobicContact CB-CD2 4.12Å; L280-L295 HydrophobicContact CB-CG 4.23Å; L280-G328 VanDerWaalsContact CD2-O 3.27Å; L280-G328 WeakPolarHBondContact CD2-O 3.24Å; L280-W331 HydrophobicContact CD2-CZ2 4.46Å
281	L	92.6	Very high	89.3	Confident	3 Å²	3	39.6 Å²	39.6	2%	0.016	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	124.6	169	-63.4	107.2	0	0	0	110.8	V249 L255 M269 L270 T272 Y290 Q291 K292	V249-L281 HydrophobicContact CG1-CD1 4.26Å; V249-L281 HydrophobicContact CG1-CD2 3.98Å; L255-L281 HydrophobicContact CD2-CD1 4.1Å; M269-L281 WeakPolarHBondContact CA-O 3.1Å; L270-L281 HydrophobicContact CB-CB 4.25Å; L270-L281 HydrophobicContact CD1-CB 4.48Å; L270-L281 PolarHBondContact N-O 2.99Å; L270-L281 PolarHBondContact O-N 3.26Å; T272-L281 HydrophobicContact CG2-CD1 3.95Å; L281-Y290 HydrophobicContact CB-CD1 4.1Å; L281-Q291 WeakPolarHBondContact CA-O 3.41Å; L281-K292 HydrophobicContact CD2-CB 3.94Å; L281-K292 HydrophobicContact CD2-CD 4.33Å; L281-K292 HydrophobicContact CD2-CG 4.16Å; L281-K292 HydrophobicContact CG-CB 4.17Å; L281-K292 HydrophobicContact CG-CG 4.05Å
282	I	93.8	Very high	89.3	Confident	2 Å²	2	43 Å²	43	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	128.5	-176.6	-62.9	164.6	0	0	0	109.5	M269 L280 L284 Y290 Q291 F327 K329	M269-I282 HydrophobicContact CE-CG1 4.42Å; L280-I282 HydrophobicContact CD2-CD1 3.92Å; L280-I282 HydrophobicContact CD2-CG1 4.1Å; L280-I282 HydrophobicContact CG-CD1 4.47Å; L280-I282 HydrophobicContact CG-CG1 4.16Å; I282-L284 HydrophobicContact CG2-CD2 3.94Å; I282-L284 HydrophobicContact CG2-CG 4.22Å; I282-Y290 WeakPolarHBondContact O-CA 3.38Å; I282-Q291 PolarHBondContact N-O 2.86Å; I282-Q291 PolarHBondContact O-N 3.14Å; I282-F327 WeakPolarHBondContact CD1-O 3.28Å; I282-F327 HydrophobicContact CG2-CD1 3.81Å; I282-F327 HydrophobicContact CG2-CE1 4.28Å; I282-K329 HydrophobicContact CD1-CB 4.5Å; I282-K329 HydrophobicContact CD1-CG 3.6Å
283	S	93	Very high	89.4	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.007	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	144.2	162.7	165	0	0	0	0	109.5	K267 I268 D285 G287 S289	K267-S283 WeakPolarHBondContact CA-O 3.48Å; I268-S283 PolarHBondContact N-O 3.5Å; I268-S283 PolarHBondContact O-N 2.94Å; S283-D285 PolarHBondContact OG-N 3.45Å; S283-D285 PolarHBondContact OG-OD1 3.13Å; S283-G287 VanDerWaalsContact OG-CA 3.24Å; S283-G287 WeakPolarHBondContact OG-CA 3.34Å; S283-G287 PolarHBondContact OG-N 3.41Å; S283-S289 WeakPolarHBondContact CA-O 3.47Å; S283-S289 WeakPolarHBondContact CB-O 2.87Å; S283-S289 PolarHBondContact OG-O 3.25Å
284	L	92.3	Very high	89.6	Confident	77 Å²	77	49.3 Å²	49.3	40%	0.403	27%	0.273	S	S	.	.	S	Bend	trans	-118.9	9.2	174.5	-56.5	175.4	0	0	0	111.6	K267 I282 F327	K267-L284 HydrophobicContact CB-CD2 4.31Å; K267-L284 HydrophobicContact CD-CD2 4Å; K267-L284 HydrophobicContact CG-CD2 3.84Å; I282-L284 HydrophobicContact CG2-CD2 3.94Å; I282-L284 HydrophobicContact CG2-CG 4.22Å; L284-F327 HydrophobicContact CD2-CD1 4.46Å
285	D	91.2	Very high	89.9	Confident	60 Å²	60	47.4 Å²	47.4	32%	0.321	26%	0.259	S	S	.	.	S	Bend	trans	-135.4	39.9	-164.5	62.7	-3.1	0	0	0	111.9	S283 G287 A288 S289	S283-D285 PolarHBondContact OG-N 3.45Å; S283-D285 PolarHBondContact OG-OD1 3.13Å; D285-G287 PolarHBondContact O-N 3.3Å; D285-A288 HydrophobicContact CB-CB 4.4Å; D285-A288 WeakPolarHBondContact O-CB 3.44Å; D285-A288 PolarHBondContact O-N 2.9Å; D285-A288 PolarHBondContact OD1-N 3.13Å; D285-A288 VanDerWaalsContact OD1-N 3.11Å; D285-S289 VanDerWaalsContact CG-N 3.34Å; D285-S289 PolarHBondContact OD1-N 3.26Å; D285-S289 VanDerWaalsContact OD2-CB 3.32Å; D285-S289 WeakPolarHBondContact OD2-CB 3.47Å; D285-S289 PolarHBondContact OD2-N 3.45Å; D285-S289 PolarHBondContact OD2-OG 3.08Å
286	E	89.7	Confident	90.3	Very high	27 Å²	27	45.2 Å²	45.2	13%	0.126	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	35.3	179.9	-60.6	174.4	-138.8	0	0	112	S210 V212 R234 R266 I268	S210-E286 WeakPolarHBondContact CB-OE2 3.43Å; S210-E286 PolarHBondContact OG-OE2 2.93Å; V212-E286 HydrophobicContact CB-CB 4.48Å; V212-E286 HydrophobicContact CG1-CB 4.25Å; V212-E286 WeakPolarHBondContact CG1-O 3.45Å; V212-E286 HydrophobicContact CG2-CB 4.49Å; R234-E286 VanDerWaalsContact CZ-O 3.25Å; R234-E286 PolarHBondContact NE-O 2.73Å; R234-E286 PolarHBondContact NH2-O 3.33Å; R266-E286 HydrophobicContact CB-CG 3.84Å; R266-E286 HydrophobicContact CG-CG 3.83Å; R266-E286 IonicContact CZ-OE1 3.37Å; R266-E286 VanDerWaalsContact CZ-OE1 3.25Å; R266-E286 IonicContact NE-OE1 3.57Å; R266-E286 PolarHBondContact NE-OE1 2.87Å; R266-E286 IonicContact NH2-OE1 2.72Å; R266-E286 PolarHBondContact NH2-OE1 3.35Å; R266-E286 PolarHBondContact O-N 2.71Å; R266-E286 VanDerWaalsContact O-N 3.12Å; I268-E286 VanDerWaalsContact CD1-C 3.41Å
287	G	89.8	Confident	90.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	15.9	177.8	0	0	0	0	0	115.4	R234 I268 S283 D285 Y290	R234-G287 VanDerWaalsContact CD-O 3.29Å; R234-G287 WeakPolarHBondContact CD-O 3.34Å; R234-G287 PolarHBondContact NE-O 3.46Å; I268-G287 VanDerWaalsContact CD1-N 3.29Å; S283-G287 VanDerWaalsContact OG-CA 3.24Å; S283-G287 WeakPolarHBondContact OG-CA 3.34Å; S283-G287 PolarHBondContact OG-N 3.41Å; D285-G287 PolarHBondContact O-N 3.3Å; G287-Y290 WeakPolarHBondContact CA-OH 3.21Å; G287-Y290 WeakPolarHBondContact O-CE2 3.49Å
288	A	89.6	Confident	91	Very high	44 Å²	44	41.9 Å²	41.9	36%	0.364	25%	0.252	S	S	.	.	S	Bend	trans	-77.2	-34.1	178.9	0	0	0	0	0	113	D285	D285-A288 HydrophobicContact CB-CB 4.4Å; D285-A288 WeakPolarHBondContact O-CB 3.44Å; D285-A288 PolarHBondContact O-N 2.9Å; D285-A288 PolarHBondContact OD1-N 3.13Å; D285-A288 VanDerWaalsContact OD1-N 3.11Å
289	S	91.3	Very high	91.1	Very high	59 Å²	59	41.7 Å²	41.7	41%	0.413	25%	0.248	S	C	.	.			trans	-139.6	149.1	173.7	72.6	0	0	0	0	112.2	S283 D285	S283-S289 WeakPolarHBondContact CA-O 3.47Å; S283-S289 WeakPolarHBondContact CB-O 2.87Å; S283-S289 PolarHBondContact OG-O 3.25Å; D285-S289 VanDerWaalsContact CG-N 3.34Å; D285-S289 PolarHBondContact OD1-N 3.26Å; D285-S289 VanDerWaalsContact OD2-CB 3.32Å; D285-S289 WeakPolarHBondContact OD2-CB 3.47Å; D285-S289 PolarHBondContact OD2-N 3.45Å; D285-S289 PolarHBondContact OD2-OG 3.08Å
290	Y	91.6	Very high	90.9	Very high	30 Å²	30	44.4 Å²	44.4	12%	0.118	26%	0.262	C	S	.	.			trans	-124.9	134.4	-176.7	-72.5	-83.9	0	0	0	111.4	L232 L245 V249 I268 L270 L281 I282 G287	L232-Y290 HydrophobicContact CD2-CE2 3.92Å; L245-Y290 HydrophobicContact CD1-CE2 4.26Å; V249-Y290 HydrophobicContact CG2-CD2 4.06Å; V249-Y290 HydrophobicContact CG2-CE2 4.37Å; I268-Y290 HydrophobicContact CG2-CE1 4.35Å; L270-Y290 HydrophobicContact CD1-CD1 3.96Å; L270-Y290 HydrophobicContact CD1-CE1 3.48Å; L270-Y290 VanDerWaalsContact CD1-CE1 3.48Å; L270-Y290 HydrophobicContact CG-CD1 4.45Å; L270-Y290 HydrophobicContact CG-CE1 3.85Å; L281-Y290 HydrophobicContact CB-CD1 4.1Å; I282-Y290 WeakPolarHBondContact O-CA 3.38Å; G287-Y290 WeakPolarHBondContact CA-OH 3.21Å; G287-Y290 WeakPolarHBondContact O-CE2 3.49Å
291	Q	91.9	Very high	90.8	Very high	104 Å²	104	45.5 Å²	45.5	49%	0.486	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	123.4	172.4	-61.6	-178.9	10.1	0	0	108.5	L281 I282 H293	L281-Q291 WeakPolarHBondContact CA-O 3.41Å; I282-Q291 PolarHBondContact N-O 2.86Å; I282-Q291 PolarHBondContact O-N 3.14Å; Q291-H293 PolarHBondContact O-CD2 3.35Å
292	K	91.3	Very high	90.7	Very high	83 Å²	83	45.8 Å²	45.8	36%	0.361	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	129.2	-179	-169.3	171	-167.1	177.7	0	111	S253 E277 L280 L281	S253-K292 PolarHBondContact OG-NZ 3.4Å; E277-K292 VanDerWaalsContact OE1-CE 3.29Å; E277-K292 WeakPolarHBondContact OE1-CE 3.37Å; E277-K292 IonicContact OE1-NZ 3.13Å; E277-K292 PolarHBondContact OE1-NZ 3.44Å; E277-K292 IonicContact OE2-NZ 3.94Å; E277-K292 PolarHBondContact OE2-NZ 3.07Å; L280-K292 WeakPolarHBondContact O-CA 3.36Å; L281-K292 HydrophobicContact CD2-CB 3.94Å; L281-K292 HydrophobicContact CD2-CD 4.33Å; L281-K292 HydrophobicContact CD2-CG 4.16Å; L281-K292 HydrophobicContact CG-CB 4.17Å; L281-K292 HydrophobicContact CG-CG 4.05Å
293	H	91.9	Very high	90.7	Very high	46 Å²	46	48.5 Å²	48.5	21%	0.213	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	122.3	178.3	-64	-96.6	0	0	0	108.9	S279 L280 Q291	S279-H293 WeakPolarHBondContact CA-O 3.27Å; L280-H293 HydrophobicContact CB-CB 4.42Å; L280-H293 PolarHBondContact N-O 3.01Å; L280-H293 PolarHBondContact O-N 3.28Å; Q291-H293 PolarHBondContact O-CD2 3.35Å
294	S	90.4	Very high	90.6	Very high	107 Å²	107	50 Å²	50	75%	0.748	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	132.7	174.4	54.2	0	0	0	0	110.6
295	L	90.3	Very high	90.5	Very high	26 Å²	26	46.3 Å²	46.3	14%	0.136	27%	0.272	C	S	.	.			trans	-90.2	156.5	174.6	-62.5	173.4	0	0	0	110.7	S278 L280 F297 I299	S278-L295 PolarHBondContact O-N 3Å; S278-L295 VanDerWaalsContact O-N 3.13Å; L280-L295 HydrophobicContact CB-CD1 4.33Å; L280-L295 HydrophobicContact CB-CD2 4.12Å; L280-L295 HydrophobicContact CB-CG 4.23Å; L295-F297 WeakPolarHBondContact CB-O 3.38Å; L295-I299 HydrophobicContact CD1-CD1 3.6Å; L295-I299 HydrophobicContact CD1-CG1 4.09Å; L295-I299 HydrophobicContact CD2-CD1 4.28Å
296	G	89.1	Confident	90.3	Very high	81 Å²	81	47.2 Å²	47.2	84%	0.835	28%	0.281	S	S	*	.	S	Bend	trans	-109.9	6.5	175.6	0	0	0	0	0	113.6
297	F	90.7	Very high	90.1	Very high	22 Å²	22	51 Å²	51	10%	0.096	30%	0.299	C	S	.	.	S	Bend	trans	-161.6	156.2	-178	65.6	-86.2	0	0	0	107.7	S278 L295 I299 A314 Y322 W331	S278-F297 PolarHBondContact OG-O 3.39Å; L295-F297 WeakPolarHBondContact CB-O 3.38Å; F297-I299 HydrophobicContact CD2-CG1 4.34Å; F297-I299 HydrophobicContact CE2-CG1 3.71Å; F297-I299 HydrophobicContact CZ-CG1 4.36Å; F297-A314 HydrophobicContact CE2-CB 4.15Å; F297-A314 HydrophobicContact CZ-CB 4.37Å; F297-Y322 HydrophobicContact CB-CE2 4.13Å; F297-Y322 HydrophobicContact CD1-CD1 4.19Å; F297-Y322 HydrophobicContact CD1-CD2 4.17Å; F297-Y322 AromaticContact CD1-CE1 3.99Å; F297-Y322 HydrophobicContact CD1-CE1 3.99Å; F297-Y322 AromaticContact CD1-CE2 3.97Å; F297-Y322 HydrophobicContact CD1-CE2 3.97Å; F297-Y322 HydrophobicContact CD1-CG 4.27Å; F297-Y322 AromaticContact CD1-CZ 3.87Å; F297-Y322 AromaticContact CD2-CD2 3.65Å; F297-Y322 HydrophobicContact CD2-CD2 3.65Å; F297-Y322 AromaticContact CD2-CE2 3.58Å; F297-Y322 HydrophobicContact CD2-CE2 3.58Å; F297-Y322 HydrophobicContact CD2-CG 4.39Å; F297-Y322 AromaticContact CE1-CD1 3.88Å; F297-Y322 HydrophobicContact CE1-CD1 3.88Å; F297-Y322 HydrophobicContact CE1-CD2 4.02Å; F297-Y322 HydrophobicContact CE1-CE1 4.16Å; F297-Y322 HydrophobicContact CE1-CE2 4.29Å; F297-Y322 AromaticContact CE1-CG 3.8Å; F297-Y322 HydrophobicContact CE1-CG 3.8Å; F297-Y322 AromaticContact CE2-CD2 3.45Å; F297-Y322 HydrophobicContact CE2-CD2 3.45Å; F297-Y322 VanDerWaalsContact CE2-CD2 3.45Å; F297-Y322 AromaticContact CE2-CE2 3.91Å; F297-Y322 HydrophobicContact CE2-CE2 3.91Å; F297-Y322 AromaticContact CE2-CG 3.91Å; F297-Y322 HydrophobicContact CE2-CG 3.91Å; F297-Y322 HydrophobicContact CG-CD2 4.01Å; F297-Y322 HydrophobicContact CG-CE1 4.42Å; F297-Y322 AromaticContact CG-CE2 3.61Å; F297-Y322 HydrophobicContact CG-CE2 3.61Å; F297-Y322 AromaticContact CG-CZ 3.84Å; F297-Y322 HydrophobicContact CZ-CD1 4.17Å; F297-Y322 AromaticContact CZ-CD2 3.66Å; F297-Y322 HydrophobicContact CZ-CD2 3.66Å; F297-Y322 HydrophobicContact CZ-CE2 4.26Å; F297-Y322 AromaticContact CZ-CG 3.6Å; F297-Y322 HydrophobicContact CZ-CG 3.6Å; F297-W331 HydrophobicContact CE1-CB 3.78Å; F297-W331 HydrophobicContact CE1-CD2 4.36Å; F297-W331 AromaticContact CE1-CG 3.77Å; F297-W331 HydrophobicContact CE1-CG 3.77Å; F297-W331 HydrophobicContact CZ-CB 4.14Å; F297-W331 AromaticContact CZ-CD2 3.88Å; F297-W331 HydrophobicContact CZ-CD2 3.88Å; F297-W331 HydrophobicContact CZ-CE3 4.3Å; F297-W331 AromaticContact CZ-CG 3.79Å; F297-W331 HydrophobicContact CZ-CG 3.79Å
298	D	89.2	Confident	90.1	Very high	72 Å²	72	54.2 Å²	54.2	39%	0.385	31%	0.314	S	S	.	.			trans	-93.1	133.2	-179	-55	-56.5	0	0	0	111.3	P274 S278 S316	P274-D298 HydrophobicContact CB-CB 4.23Å; P274-D298 WeakPolarHBondContact CB-OD1 3.24Å; S278-D298 WeakPolarHBondContact CB-OD1 3.43Å; S278-D298 PolarHBondContact OG-OD1 3.07Å; D298-S316 VanDerWaalsContact O-CA 3.28Å; D298-S316 WeakPolarHBondContact O-CA 3.45Å; D298-S316 VanDerWaalsContact O-CB 3.22Å; D298-S316 WeakPolarHBondContact O-CB 3.39Å
299	I	90.1	Very high	90.1	Very high	27 Å²	27	55.8 Å²	55.8	14%	0.138	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	121.2	-178.2	-62.7	172.1	0	0	0	108.6	L271 L295 F297 L302 A314 W331	L271-I299 HydrophobicContact CD1-CB 4.41Å; L271-I299 HydrophobicContact CD1-CG2 4.2Å; L271-I299 HydrophobicContact CD2-CD1 3.97Å; L295-I299 HydrophobicContact CD1-CD1 3.6Å; L295-I299 HydrophobicContact CD1-CG1 4.09Å; L295-I299 HydrophobicContact CD2-CD1 4.28Å; F297-I299 HydrophobicContact CD2-CG1 4.34Å; F297-I299 HydrophobicContact CE2-CG1 3.71Å; F297-I299 HydrophobicContact CZ-CG1 4.36Å; I299-L302 HydrophobicContact CD1-CD2 4.34Å; I299-L302 HydrophobicContact CG2-CD2 3.59Å; I299-L302 HydrophobicContact CG2-CG 3.78Å; I299-A314 HydrophobicContact CD1-CB 4.46Å; I299-A314 HydrophobicContact CG1-CB 4.22Å; I299-A314 HydrophobicContact CG2-CB 4.36Å; I299-W331 HydrophobicContact CD1-CZ2 4.29Å
300	L	87.7	Confident	90.1	Very high	61 Å²	61	55.5 Å²	55.5	32%	0.319	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-36.8	172.6	-178.9	64.1	0	0	0	111.7	Y315	L300-Y315 HydrophobicContact CD2-CD1 4.24Å; L300-Y315 HydrophobicContact CD2-CE1 4.28Å; L300-Y315 PolarHBondContact N-O 2.86Å
301	S	88.9	Confident	90.1	Very high	24 Å²	24	56.4 Å²	56.4	17%	0.168	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	151.8	179.4	-177.7	0	0	0	0	112	A314 Y315	S301-A314 WeakPolarHBondContact O-CA 3.49Å; S301-Y315 PolarHBondContact N-O 3.03Å; S301-Y315 PolarHBondContact O-N 2.97Å
302	L	91.9	Very high	90.2	Very high	9 Å²	9	51.5 Å²	51.5	5%	0.047	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.4	-179.6	-69.3	-178.6	0	0	0	111.2	Y259 M269 I299 F304 I312 L313 A314 W331	Y259-L302 HydrophobicContact CD2-CD1 3.86Å; Y259-L302 HydrophobicContact CE2-CD1 3.73Å; Y259-L302 HydrophobicContact CG-CD1 4.41Å; M269-L302 HydrophobicContact SD-CD1 3.73Å; I299-L302 HydrophobicContact CD1-CD2 4.34Å; I299-L302 HydrophobicContact CG2-CD2 3.59Å; I299-L302 HydrophobicContact CG2-CG 3.78Å; L302-F304 HydrophobicContact CB-CE2 4.32Å; L302-I312 HydrophobicContact CB-CG2 4.46Å; L302-I312 HydrophobicContact CD2-CG2 4.02Å; L302-L313 WeakPolarHBondContact CA-O 3.33Å; L302-A314 HydrophobicContact CD2-CB 3.61Å; L302-W331 HydrophobicContact CD2-CH2 4.17Å
303	L	92.4	Very high	90.3	Very high	58 Å²	58	47.5 Å²	47.5	30%	0.304	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	102	172.6	-177.3	65.7	0	0	0	110.3	L313 F343 W345	L303-L313 HydrophobicContact CB-CB 4.35Å; L303-L313 HydrophobicContact CD2-CD1 4.44Å; L303-L313 PolarHBondContact N-O 2.88Å; L303-L313 PolarHBondContact O-N 2.99Å; L303-F343 HydrophobicContact CB-CE2 3.92Å; L303-F343 HydrophobicContact CD2-CD2 3.97Å; L303-F343 HydrophobicContact CD2-CE2 4.1Å; L303-F343 WeakPolarHBondContact CD2-O 3.38Å; L303-W345 PolarHBondContact O-NE1 2.87Å
304	F	92	Very high	90.4	Very high	32 Å²	32	45.3 Å²	45.3	14%	0.14	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	144.8	172.2	-63.9	-91.9	0	0	0	110.6	Y259 P262 M269 L302 I312 F327 W345	Y259-F304 HydrophobicContact CD1-CE2 4.28Å; Y259-F304 HydrophobicContact CG-CE2 4.41Å; Y259-F304 HydrophobicContact CG-CZ 4.47Å; P262-F304 HydrophobicContact CG-CB 3.8Å; P262-F304 HydrophobicContact CG-CG 4.23Å; M269-F304 HydrophobicContact SD-CZ 4.37Å; L302-F304 HydrophobicContact CB-CE2 4.32Å; F304-I312 HydrophobicContact CD1-CD1 4Å; F304-I312 HydrophobicContact CD1-CG1 3.83Å; F304-I312 HydrophobicContact CD1-CG2 4.4Å; F304-I312 HydrophobicContact CE1-CD1 3.62Å; F304-I312 HydrophobicContact CE1-CG1 3.99Å; F304-I312 HydrophobicContact CE1-CG2 4.45Å; F304-I312 HydrophobicContact CZ-CD1 4.47Å; F304-F327 HydrophobicContact CD1-CE2 4.24Å; F304-F327 AromaticContact CE1-CE2 3.76Å; F304-F327 HydrophobicContact CE1-CE2 3.76Å; F304-F327 HydrophobicContact CE1-CZ 4.07Å; F304-W345 PolarHBondContact O-NE1 2.79Å
305	H	90.4	Very high	90.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.227	C	C	.	.			trans	-72	135.5	173.8	-173.5	-63.5	0	0	0	110.3	N263 E307 Q308 W311 W345	N263-H305 PolarHBondContact ND2-O 3.2Å; N263-H305 PolarHBondContact OD1-O 2.85Å; H305-E307 VanDerWaalsContact C-N 3.33Å; H305-E307 PolarHBondContact ND1-N 2.8Å; H305-E307 PolarHBondContact O-N 2.85Å; H305-Q308 HydrophobicContact CB-CB 4.22Å; H305-Q308 PolarHBondContact ND1-N 2.79Å; H305-W311 HydrophobicContact CB-CB 3.73Å; H305-W311 WeakPolarHBondContact CB-O 3.47Å; H305-W311 AromaticContact CD2-CE3 3.63Å; H305-W311 PolarHBondContact N-O 2.99Å; H305-W345 HydrophobicContact CB-CD2 4.13Å; H305-W345 HydrophobicContact CB-CG 4.45Å; H305-W345 HydrophobicContact CB-CH2 4.47Å; H305-W345 HydrophobicContact CB-CZ2 3.86Å; H305-W345 AromaticContact CD2-CD2 3.6Å; H305-W345 AromaticContact CD2-CE3 3.54Å; H305-W345 AromaticContact CD2-CZ3 3.92Å
306	P	86.6	Confident	90.7	Very high	79 Å²	79	39.4 Å²	39.4	51%	0.513	22%	0.22	S	C	.	.	S	Bend	trans	-62.6	-32.5	-174.2	22.2	-34.1	0	0	0	114.8	N263	N263-P306 VanDerWaalsContact CG-O 3.27Å; N263-P306 PolarHBondContact ND2-O 3.16Å; N263-P306 PolarHBondContact OD1-O 3.41Å; N263-P306 VanDerWaalsContact OD1-O 3.13Å
307	E	84.9	Confident	90.5	Very high	107 Å²	107	43.1 Å²	43.1	50%	0.5	22%	0.216	S	C	.	.	S	Bend	trans	-107.4	-47.8	178.1	-61	177.3	-118.6	0	0	114.5	N263 H305 E309 L348	N263-E307 PolarHBondContact ND2-O 2.88Å; H305-E307 VanDerWaalsContact C-N 3.33Å; H305-E307 PolarHBondContact ND1-N 2.8Å; H305-E307 PolarHBondContact O-N 2.85Å; E307-E309 PolarHBondContact O-N 3.03Å; E307-L348 WeakPolarHBondContact OE1-CG 3.11Å; E307-L348 VanDerWaalsContact OE2-CD1 3.27Å; E307-L348 WeakPolarHBondContact OE2-CD1 3.39Å
308	Q	89.3	Confident	90.4	Very high	68 Å²	68	45.9 Å²	45.9	32%	0.318	23%	0.231	S	C	.	.			trans	-76.3	108.9	-175.5	-60.5	-58.2	-41.9	0	0	113.6	H305 D310 W311	H305-Q308 HydrophobicContact CB-CB 4.22Å; H305-Q308 PolarHBondContact ND1-N 2.79Å; Q308-D310 VanDerWaalsContact C-N 3.26Å; Q308-D310 PolarHBondContact O-N 2.85Å; Q308-D310 VanDerWaalsContact O-N 3.1Å; Q308-W311 HydrophobicContact CB-CB 3.96Å; Q308-W311 HydrophobicContact CB-CD2 3.69Å; Q308-W311 HydrophobicContact CB-CE3 4Å; Q308-W311 HydrophobicContact CB-CG 3.7Å; Q308-W311 HydrophobicContact CG-CD2 3.9Å; Q308-W311 HydrophobicContact CG-CE3 3.85Å; Q308-W311 HydrophobicContact CG-CG 4.44Å; Q308-W311 HydrophobicContact CG-CH2 4.26Å; Q308-W311 HydrophobicContact CG-CZ2 4.33Å; Q308-W311 HydrophobicContact CG-CZ3 4.02Å; Q308-W311 PolarHBondContact O-N 2.87Å
309	E	90.1	Very high	90.5	Very high	76 Å²	76	46.7 Å²	46.7	36%	0.355	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-4.8	-170.6	61.5	155.2	-132	0	0	117.4	N263 N264 K267 E307 F327	N263-E309 HydrophobicContact CB-CB 4.25Å; N264-E309 HydrophobicContact CB-CB 4.03Å; N264-E309 WeakPolarHBondContact CB-OE2 3.47Å; N264-E309 PolarHBondContact ND2-OE2 3.01Å; K267-E309 WeakPolarHBondContact CE-OE1 3.42Å; K267-E309 PolarHBondContact NZ-O 3.22Å; K267-E309 IonicContact NZ-OE1 2.75Å; K267-E309 PolarHBondContact NZ-OE1 2.84Å; K267-E309 IonicContact NZ-OE2 3.81Å; E307-E309 PolarHBondContact O-N 3.03Å; E309-F327 WeakPolarHBondContact O-CD2 3.4Å
310	D	91.8	Very high	90.6	Very high	53 Å²	53	48.3 Å²	48.3	28%	0.283	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-2.3	176.5	-76.6	-62	0	0	0	113.2	K267 Q308 V325 F327	K267-D310 IonicContact NZ-OD1 4Å; K267-D310 PolarHBondContact NZ-OD1 3.38Å; K267-D310 IonicContact NZ-OD2 3.17Å; K267-D310 PolarHBondContact NZ-OD2 2.87Å; Q308-D310 VanDerWaalsContact C-N 3.26Å; Q308-D310 PolarHBondContact O-N 2.85Å; Q308-D310 VanDerWaalsContact O-N 3.1Å; D310-V325 CarbonylContact O-C 3.57Å; D310-F327 WeakPolarHBondContact O-CA 3.32Å; D310-F327 PolarHBondContact O-N 3.47Å; D310-F327 WeakPolarHBondContact OD1-CB 3.41Å
311	W	92.3	Very high	90.9	Very high	50 Å²	50	45.4 Å²	45.4	19%	0.189	22%	0.223	C	C	.	.			trans	-100	126.3	-171.4	-67.5	14.5	0	0	0	111.6	H305 Q308 S324 V325 W345 Q354 L375	H305-W311 HydrophobicContact CB-CB 3.73Å; H305-W311 WeakPolarHBondContact CB-O 3.47Å; H305-W311 AromaticContact CD2-CE3 3.63Å; H305-W311 PolarHBondContact N-O 2.99Å; Q308-W311 HydrophobicContact CB-CB 3.96Å; Q308-W311 HydrophobicContact CB-CD2 3.69Å; Q308-W311 HydrophobicContact CB-CE3 4Å; Q308-W311 HydrophobicContact CB-CG 3.7Å; Q308-W311 HydrophobicContact CG-CD2 3.9Å; Q308-W311 HydrophobicContact CG-CE3 3.85Å; Q308-W311 HydrophobicContact CG-CG 4.44Å; Q308-W311 HydrophobicContact CG-CH2 4.26Å; Q308-W311 HydrophobicContact CG-CZ2 4.33Å; Q308-W311 HydrophobicContact CG-CZ3 4.02Å; Q308-W311 PolarHBondContact O-N 2.87Å; W311-S324 WeakPolarHBondContact CA-O 3.38Å; W311-V325 HydrophobicContact CD2-CG1 4.5Å; W311-V325 HydrophobicContact CG-CG1 4.33Å; W311-W345 HydrophobicContact CB-CH2 3.98Å; W311-W345 HydrophobicContact CB-CZ2 4.18Å; W311-W345 HydrophobicContact CE3-CH2 4.41Å; W311-W345 HydrophobicContact CE3-CZ3 4.22Å; W311-Q354 WeakPolarHBondContact CZ3-O 3.49Å; W311-L375 HydrophobicContact CD2-CD2 4.1Å; W311-L375 HydrophobicContact CE3-CD1 4.12Å; W311-L375 HydrophobicContact CE3-CD2 4.01Å; W311-L375 HydrophobicContact CH2-CD2 3.69Å; W311-L375 HydrophobicContact CZ2-CD2 3.74Å; W311-L375 HydrophobicContact CZ3-CD1 4.35Å; W311-L375 HydrophobicContact CZ3-CD2 3.82Å
312	I	93.8	Very high	91	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	134.7	-173.7	-45.5	175.9	0	0	0	109.4	M269 L302 F304 V323 S324 F327 W331	M269-I312 HydrophobicContact CE-CD1 3.42Å; M269-I312 VanDerWaalsContact CE-CD1 3.42Å; M269-I312 HydrophobicContact SD-CD1 4.17Å; L302-I312 HydrophobicContact CB-CG2 4.46Å; L302-I312 HydrophobicContact CD2-CG2 4.02Å; F304-I312 HydrophobicContact CD1-CD1 4Å; F304-I312 HydrophobicContact CD1-CG1 3.83Å; F304-I312 HydrophobicContact CD1-CG2 4.4Å; F304-I312 HydrophobicContact CE1-CD1 3.62Å; F304-I312 HydrophobicContact CE1-CG1 3.99Å; F304-I312 HydrophobicContact CE1-CG2 4.45Å; F304-I312 HydrophobicContact CZ-CD1 4.47Å; I312-V323 WeakPolarHBondContact O-CA 3.34Å; I312-S324 PolarHBondContact N-O 3.4Å; I312-S324 PolarHBondContact O-N 2.91Å; I312-F327 HydrophobicContact CD1-CD2 3.75Å; I312-F327 HydrophobicContact CD1-CE2 4.01Å; I312-F327 HydrophobicContact CD1-CG 4.12Å; I312-F327 HydrophobicContact CG1-CD2 4.41Å; I312-W331 HydrophobicContact CB-CH2 4.14Å; I312-W331 HydrophobicContact CB-CZ3 4.49Å; I312-W331 HydrophobicContact CG2-CH2 4.04Å
313	L	93.6	Very high	91.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	140.4	163.9	-66.1	164.5	0	0	0	109.7	L302 L303 L321 Y322 V323 V334 F343 W345 I357	L302-L313 WeakPolarHBondContact CA-O 3.33Å; L303-L313 HydrophobicContact CB-CB 4.35Å; L303-L313 HydrophobicContact CD2-CD1 4.44Å; L303-L313 PolarHBondContact N-O 2.88Å; L303-L313 PolarHBondContact O-N 2.99Å; L313-L321 HydrophobicContact CB-CD1 4.21Å; L313-L321 HydrophobicContact CD1-CD2 4.32Å; L313-L321 HydrophobicContact CD2-CD2 3.97Å; L313-L321 HydrophobicContact CD2-CG 4.19Å; L313-Y322 CarbonylContact C-O 3.55Å; L313-Y322 VanDerWaalsContact CA-O 3.32Å; L313-Y322 WeakPolarHBondContact CA-O 3.44Å; L313-V323 HydrophobicContact CD2-CB 3.76Å; L313-V323 HydrophobicContact CD2-CG2 3.82Å; L313-V334 HydrophobicContact CD2-CG2 4.29Å; L313-F343 HydrophobicContact CD1-CD2 4.36Å; L313-W345 HydrophobicContact CB-CZ2 4.42Å; L313-W345 HydrophobicContact CD1-CD2 3.88Å; L313-W345 HydrophobicContact CD1-CE3 4.24Å; L313-W345 HydrophobicContact CD1-CG 4.43Å; L313-W345 HydrophobicContact CD1-CH2 4.3Å; L313-W345 HydrophobicContact CD1-CZ2 3.92Å; L313-W345 HydrophobicContact CD1-CZ3 4.43Å; L313-W345 HydrophobicContact CD2-CH2 4.25Å; L313-W345 HydrophobicContact CD2-CZ2 4.38Å; L313-W345 HydrophobicContact CG-CD2 4.42Å; L313-W345 HydrophobicContact CG-CH2 3.88Å; L313-W345 HydrophobicContact CG-CZ2 3.54Å; L313-W345 HydrophobicContact CG-CZ3 4.42Å; L313-I357 HydrophobicContact CD1-CG2 3.79Å; L313-I357 HydrophobicContact CD2-CD1 3.81Å; L313-I357 HydrophobicContact CD2-CG1 4.43Å; L313-I357 HydrophobicContact CD2-CG2 4.42Å
314	A	93.6	Very high	91.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	125.2	173.8	0	0	0	0	0	110.2	F297 I299 S301 L302 Y322 W331	F297-A314 HydrophobicContact CE2-CB 4.15Å; F297-A314 HydrophobicContact CZ-CB 4.37Å; I299-A314 HydrophobicContact CD1-CB 4.46Å; I299-A314 HydrophobicContact CG1-CB 4.22Å; I299-A314 HydrophobicContact CG2-CB 4.36Å; S301-A314 WeakPolarHBondContact O-CA 3.49Å; L302-A314 HydrophobicContact CD2-CB 3.61Å; A314-Y322 PolarHBondContact N-O 2.9Å; A314-Y322 PolarHBondContact O-N 3.41Å; A314-W331 HydrophobicContact CB-CE3 4.02Å; A314-W331 HydrophobicContact CB-CH2 3.61Å; A314-W331 HydrophobicContact CB-CZ2 4.34Å; A314-W331 HydrophobicContact CB-CZ3 3.42Å; A314-W331 VanDerWaalsContact CB-CZ3 3.42Å
315	Y	93.9	Very high	91.1	Very high	9 Å²	9	44.3 Å²	44.3	4%	0.035	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	136.2	173.7	-173.9	-101	0	0	0	109.9	L300 S301 L321 V338 P340 F343	L300-Y315 HydrophobicContact CD2-CD1 4.24Å; L300-Y315 HydrophobicContact CD2-CE1 4.28Å; L300-Y315 PolarHBondContact N-O 2.86Å; S301-Y315 PolarHBondContact N-O 3.03Å; S301-Y315 PolarHBondContact O-N 2.97Å; Y315-L321 HydrophobicContact CD2-CD1 4.23Å; Y315-V338 HydrophobicContact CE2-CB 4.16Å; Y315-V338 HydrophobicContact CE2-CG1 4.25Å; Y315-V338 WeakPolarHBondContact CE2-O 3.27Å; Y315-V338 PolarHBondContact OH-O 3.32Å; Y315-V338 VanDerWaalsContact OH-O 3.11Å; Y315-P340 HydrophobicContact CE1-CB 4.47Å; Y315-P340 WeakPolarHBondContact OH-CG 3.4Å; Y315-F343 HydrophobicContact CD2-CD1 4.29Å; Y315-F343 AromaticContact CD2-CE1 3.77Å; Y315-F343 HydrophobicContact CD2-CE1 3.77Å; Y315-F343 AromaticContact CG-CE1 3.9Å; Y315-F343 HydrophobicContact CG-CE1 3.9Å; Y315-F343 HydrophobicContact CG-CZ 4.3Å
316	S	92.7	Very high	91.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	158.9	-175.7	63.2	0	0	0	0	113.4	D298 D318 Q319 K320	D298-S316 VanDerWaalsContact O-CA 3.28Å; D298-S316 WeakPolarHBondContact O-CA 3.45Å; D298-S316 VanDerWaalsContact O-CB 3.22Å; D298-S316 WeakPolarHBondContact O-CB 3.39Å; S316-D318 WeakPolarHBondContact CB-OD1 3.38Å; S316-D318 PolarHBondContact O-N 3.09Å; S316-D318 VanDerWaalsContact O-N 3.11Å; S316-D318 PolarHBondContact OG-OD1 2.82Å; S316-Q319 PolarHBondContact O-N 3.41Å; S316-K320 PolarHBondContact N-O 2.85Å; S316-K320 WeakPolarHBondContact OG-CB 3.49Å; S316-K320 PolarHBondContact OG-N 3.12Å; S316-K320 PolarHBondContact OG-O 3.07Å
317	H	84.8	Confident	91.5	Very high	159 Å²	159	43.7 Å²	43.7	74%	0.736	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-22.3	179.3	-165.8	-46.6	0	0	0	113.1	Q319	H317-Q319 VanDerWaalsContact C-N 3.3Å; H317-Q319 PolarHBondContact O-N 3.41Å
318	D	88.9	Confident	91.8	Very high	79 Å²	79	38.7 Å²	38.7	42%	0.422	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	26.3	175.1	70.4	-24.2	0	0	0	114.2	S316 K320	S316-D318 WeakPolarHBondContact CB-OD1 3.38Å; S316-D318 PolarHBondContact O-N 3.09Å; S316-D318 VanDerWaalsContact O-N 3.11Å; S316-D318 PolarHBondContact OG-OD1 2.82Å; D318-K320 VanDerWaalsContact C-N 3.3Å; D318-K320 PolarHBondContact O-N 3.11Å; D318-K320 WeakPolarHBondContact OD2-CD 3.24Å; D318-K320 VanDerWaalsContact OD2-CE 3.24Å; D318-K320 WeakPolarHBondContact OD2-CE 3.39Å; D318-K320 IonicContact OD2-NZ 3.61Å; D318-K320 PolarHBondContact OD2-NZ 3.37Å
319	Q	90.4	Very high	91.9	Very high	90 Å²	90	38.7 Å²	38.7	42%	0.421	18%	0.184	S	C	.	.	S	Bend	trans	58.1	34.3	174.2	-54.7	-175.3	-2.7	0	0	114.4	S316 H317 D336 N337 V338	S316-Q319 PolarHBondContact O-N 3.41Å; H317-Q319 VanDerWaalsContact C-N 3.3Å; H317-Q319 PolarHBondContact O-N 3.41Å; Q319-D336 CarbonylContact O-C 3.56Å; Q319-N337 PolarHBondContact O-N 2.94Å; Q319-V338 PolarHBondContact O-N 2.82Å
320	K	92.5	Very high	91.9	Very high	60 Å²	60	42.8 Å²	42.8	26%	0.261	20%	0.196	S	C	.	.			trans	-108.8	149.6	175.4	-68.5	165.9	-167.7	159.9	0	110.4	S316 D318 Y322 L333 D336	S316-K320 PolarHBondContact N-O 2.85Å; S316-K320 WeakPolarHBondContact OG-CB 3.49Å; S316-K320 PolarHBondContact OG-N 3.12Å; S316-K320 PolarHBondContact OG-O 3.07Å; D318-K320 VanDerWaalsContact C-N 3.3Å; D318-K320 PolarHBondContact O-N 3.11Å; D318-K320 WeakPolarHBondContact OD2-CD 3.24Å; D318-K320 VanDerWaalsContact OD2-CE 3.24Å; D318-K320 WeakPolarHBondContact OD2-CE 3.39Å; D318-K320 IonicContact OD2-NZ 3.61Å; D318-K320 PolarHBondContact OD2-NZ 3.37Å; K320-Y322 HydrophobicContact CB-CD2 4.33Å; K320-Y322 HydrophobicContact CB-CE2 3.68Å; K320-Y322 HydrophobicContact CD-CE2 4.46Å; K320-L333 HydrophobicContact CB-CD1 3.75Å; K320-L333 HydrophobicContact CD-CD1 4.09Å; K320-L333 HydrophobicContact CG-CD1 3.99Å; K320-D336 HydrophobicContact CG-CB 3.94Å
321	L	93.5	Very high	91.9	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	123.6	170.4	-165.1	74.6	0	0	0	109.5	L313 Y315 V334 H335 V338 F343 I357 L359	L313-L321 HydrophobicContact CB-CD1 4.21Å; L313-L321 HydrophobicContact CD1-CD2 4.32Å; L313-L321 HydrophobicContact CD2-CD2 3.97Å; L313-L321 HydrophobicContact CD2-CG 4.19Å; Y315-L321 HydrophobicContact CD2-CD1 4.23Å; L321-V334 WeakPolarHBondContact O-CB 3.47Å; L321-V334 PolarHBondContact O-N 3.04Å; L321-H335 PolarHBondContact N-O 3.49Å; L321-V338 HydrophobicContact CB-CB 4.43Å; L321-V338 HydrophobicContact CB-CG1 4.42Å; L321-V338 HydrophobicContact CB-CG2 3.98Å; L321-F343 HydrophobicContact CD1-CB 4.5Å; L321-F343 HydrophobicContact CD1-CD1 4Å; L321-F343 HydrophobicContact CD1-CD2 3.73Å; L321-F343 HydrophobicContact CD1-CE1 4.12Å; L321-F343 HydrophobicContact CD1-CE2 3.86Å; L321-F343 HydrophobicContact CD1-CG 3.82Å; L321-F343 HydrophobicContact CD1-CZ 4.07Å; L321-F343 HydrophobicContact CD2-CB 3.87Å; L321-F343 HydrophobicContact CD2-CD2 4.28Å; L321-F343 HydrophobicContact CD2-CG 4.08Å; L321-I357 HydrophobicContact CD2-CG2 4.28Å; L321-L359 HydrophobicContact CD2-CD2 3.36Å
322	Y	92.5	Very high	91.9	Very high	33 Å²	33	45.1 Å²	45.1	13%	0.129	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	151.4	174.3	-62.7	-93.1	0	0	0	110.1	F297 L313 A314 K320 Q332 L333	F297-Y322 HydrophobicContact CB-CE2 4.13Å; F297-Y322 HydrophobicContact CD1-CD1 4.19Å; F297-Y322 HydrophobicContact CD1-CD2 4.17Å; F297-Y322 AromaticContact CD1-CE1 3.99Å; F297-Y322 HydrophobicContact CD1-CE1 3.99Å; F297-Y322 AromaticContact CD1-CE2 3.97Å; F297-Y322 HydrophobicContact CD1-CE2 3.97Å; F297-Y322 HydrophobicContact CD1-CG 4.27Å; F297-Y322 AromaticContact CD1-CZ 3.87Å; F297-Y322 AromaticContact CD2-CD2 3.65Å; F297-Y322 HydrophobicContact CD2-CD2 3.65Å; F297-Y322 AromaticContact CD2-CE2 3.58Å; F297-Y322 HydrophobicContact CD2-CE2 3.58Å; F297-Y322 HydrophobicContact CD2-CG 4.39Å; F297-Y322 AromaticContact CE1-CD1 3.88Å; F297-Y322 HydrophobicContact CE1-CD1 3.88Å; F297-Y322 HydrophobicContact CE1-CD2 4.02Å; F297-Y322 HydrophobicContact CE1-CE1 4.16Å; F297-Y322 HydrophobicContact CE1-CE2 4.29Å; F297-Y322 AromaticContact CE1-CG 3.8Å; F297-Y322 HydrophobicContact CE1-CG 3.8Å; F297-Y322 AromaticContact CE2-CD2 3.45Å; F297-Y322 HydrophobicContact CE2-CD2 3.45Å; F297-Y322 VanDerWaalsContact CE2-CD2 3.45Å; F297-Y322 AromaticContact CE2-CE2 3.91Å; F297-Y322 HydrophobicContact CE2-CE2 3.91Å; F297-Y322 AromaticContact CE2-CG 3.91Å; F297-Y322 HydrophobicContact CE2-CG 3.91Å; F297-Y322 HydrophobicContact CG-CD2 4.01Å; F297-Y322 HydrophobicContact CG-CE1 4.42Å; F297-Y322 AromaticContact CG-CE2 3.61Å; F297-Y322 HydrophobicContact CG-CE2 3.61Å; F297-Y322 AromaticContact CG-CZ 3.84Å; F297-Y322 HydrophobicContact CZ-CD1 4.17Å; F297-Y322 AromaticContact CZ-CD2 3.66Å; F297-Y322 HydrophobicContact CZ-CD2 3.66Å; F297-Y322 HydrophobicContact CZ-CE2 4.26Å; F297-Y322 AromaticContact CZ-CG 3.6Å; F297-Y322 HydrophobicContact CZ-CG 3.6Å; L313-Y322 CarbonylContact C-O 3.55Å; L313-Y322 VanDerWaalsContact CA-O 3.32Å; L313-Y322 WeakPolarHBondContact CA-O 3.44Å; A314-Y322 PolarHBondContact N-O 2.9Å; A314-Y322 PolarHBondContact O-N 3.41Å; K320-Y322 HydrophobicContact CB-CD2 4.33Å; K320-Y322 HydrophobicContact CB-CE2 3.68Å; K320-Y322 HydrophobicContact CD-CE2 4.46Å; Y322-Q332 CarbonylContact C-O 3.56Å; Y322-Q332 VanDerWaalsContact CA-O 3.23Å; Y322-Q332 WeakPolarHBondContact CA-O 3.48Å; Y322-L333 HydrophobicContact CD1-CB 4.16Å; Y322-L333 HydrophobicContact CD1-CD1 4.22Å; Y322-L333 HydrophobicContact CE1-CB 4.04Å; Y322-L333 HydrophobicContact CE1-CD1 3.89Å; Y322-L333 HydrophobicContact CE2-CD1 4.45Å
323	V	93.1	Very high	91.8	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.024	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	142.4	173.7	67.9	0	0	0	0	110.9	I312 L313 W331 Q332 V334 W345 L375	I312-V323 WeakPolarHBondContact O-CA 3.34Å; L313-V323 HydrophobicContact CD2-CB 3.76Å; L313-V323 HydrophobicContact CD2-CG2 3.82Å; V323-W331 CarbonylContact O-C 3.49Å; V323-W331 WeakPolarHBondContact O-CA 3.14Å; V323-Q332 HydrophobicContact CG1-CB 4.16Å; V323-Q332 PolarHBondContact N-O 2.8Å; V323-Q332 PolarHBondContact O-N 2.88Å; V323-V334 HydrophobicContact CB-CG2 3.62Å; V323-V334 HydrophobicContact CG1-CG2 3.62Å; V323-W345 HydrophobicContact CG2-CH2 4Å; V323-L375 HydrophobicContact CG2-CD1 3.78Å
324	S	92.8	Very high	91.6	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.007	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	141.3	165.2	-166	0	0	0	0	110.1	W311 I312 E326 G328 R330	W311-S324 WeakPolarHBondContact CA-O 3.38Å; I312-S324 PolarHBondContact N-O 3.4Å; I312-S324 PolarHBondContact O-N 2.91Å; S324-E326 PolarHBondContact OG-N 3.43Å; S324-G328 VanDerWaalsContact OG-CA 3.3Å; S324-G328 WeakPolarHBondContact OG-CA 3.45Å; S324-G328 PolarHBondContact OG-N 3.49Å; S324-R330 WeakPolarHBondContact CA-O 3.3Å; S324-R330 WeakPolarHBondContact CB-O 3.43Å; S324-R330 PolarHBondContact OG-O 3.45Å
325	V	92	Very high	91.4	Very high	62 Å²	62	51.5 Å²	51.5	38%	0.376	24%	0.238	S	C	.	.	S	Bend	trans	-116	9.9	170.2	-58.7	0	0	0	0	111.9	D310 W311 L375	D310-V325 CarbonylContact O-C 3.57Å; W311-V325 HydrophobicContact CD2-CG1 4.5Å; W311-V325 HydrophobicContact CG-CG1 4.33Å; V325-L375 HydrophobicContact CG1-CD1 4.4Å; V325-L375 HydrophobicContact CG1-CD2 3.58Å; V325-L375 HydrophobicContact CG1-CG 3.97Å
326	E	92.6	Very high	91.2	Very high	66 Å²	66	54.5 Å²	54.5	31%	0.308	26%	0.255	S	S	.	.	S	Bend	trans	-126.8	35.1	-179.2	-63.1	-178.2	-159	0	0	110.6	S324 G328 K329 R330	S324-E326 PolarHBondContact OG-N 3.43Å; E326-G328 VanDerWaalsContact C-N 3.28Å; E326-G328 PolarHBondContact O-N 2.86Å; E326-K329 HydrophobicContact CB-CB 4.04Å; E326-K329 HydrophobicContact CB-CD 4.46Å; E326-K329 WeakPolarHBondContact O-CB 3.36Å; E326-K329 WeakPolarHBondContact O-CD 3.48Å; E326-K329 WeakPolarHBondContact O-CG 3.37Å; E326-K329 PolarHBondContact O-N 3.45Å; E326-K329 VanDerWaalsContact O-N 3.16Å; E326-R330 WeakPolarHBondContact OE1-CD 3.39Å; E326-R330 IonicContact OE1-CZ 3.85Å; E326-R330 IonicContact OE1-NE 3.25Å; E326-R330 IonicContact OE1-NH1 2.76Å; E326-R330 PolarHBondContact OE1-NH1 2.87Å; E326-R330 IonicContact OE2-CZ 2.71Å; E326-R330 IonicContact OE2-NE 2.78Å; E326-R330 IonicContact OE2-NH1 3.21Å; E326-R330 PolarHBondContact OE2-NH1 3.37Å
327	F	92.3	Very high	91.1	Very high	1 Å²	1	58.1 Å²	58.1	0%	0.004	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	41.8	-177.6	-160.1	-102.3	0	0	0	113.9	K267 M269 I282 L284 F304 E309 D310 I312	K267-F327 HydrophobicContact CB-CD1 4.31Å; K267-F327 HydrophobicContact CB-CD2 4.45Å; K267-F327 HydrophobicContact CB-CE1 3.73Å; K267-F327 HydrophobicContact CB-CE2 3.91Å; K267-F327 HydrophobicContact CB-CZ 3.52Å; K267-F327 HydrophobicContact CD-CD2 3.95Å; K267-F327 HydrophobicContact CD-CE2 4.14Å; K267-F327 HydrophobicContact CD-CG 4.17Å; K267-F327 HydrophobicContact CD-CZ 4.5Å; M269-F327 HydrophobicContact CB-CE1 4.05Å; M269-F327 HydrophobicContact CB-CZ 4.32Å; M269-F327 HydrophobicContact CE-CD1 3.81Å; M269-F327 HydrophobicContact CE-CE1 3.76Å; M269-F327 HydrophobicContact CE-CG 4.3Å; M269-F327 HydrophobicContact CE-CZ 4.19Å; M269-F327 WeakPolarHBondContact CE-O 3.38Å; I282-F327 WeakPolarHBondContact CD1-O 3.28Å; I282-F327 HydrophobicContact CG2-CD1 3.81Å; I282-F327 HydrophobicContact CG2-CE1 4.28Å; L284-F327 HydrophobicContact CD2-CD1 4.46Å; F304-F327 HydrophobicContact CD1-CE2 4.24Å; F304-F327 AromaticContact CE1-CE2 3.76Å; F304-F327 HydrophobicContact CE1-CE2 3.76Å; F304-F327 HydrophobicContact CE1-CZ 4.07Å; E309-F327 WeakPolarHBondContact O-CD2 3.4Å; D310-F327 WeakPolarHBondContact O-CA 3.32Å; D310-F327 PolarHBondContact O-N 3.47Å; D310-F327 WeakPolarHBondContact OD1-CB 3.41Å; I312-F327 HydrophobicContact CD1-CD2 3.75Å; I312-F327 HydrophobicContact CD1-CE2 4.01Å; I312-F327 HydrophobicContact CD1-CG 4.12Å; I312-F327 HydrophobicContact CG1-CD2 4.41Å
328	G	91	Very high	91.5	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.01	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.7	-2.9	177.2	0	0	0	0	0	116	L280 S324 E326 R330 W331	L280-G328 VanDerWaalsContact CD2-O 3.27Å; L280-G328 WeakPolarHBondContact CD2-O 3.24Å; S324-G328 VanDerWaalsContact OG-CA 3.3Å; S324-G328 WeakPolarHBondContact OG-CA 3.45Å; S324-G328 PolarHBondContact OG-N 3.49Å; E326-G328 VanDerWaalsContact C-N 3.28Å; E326-G328 PolarHBondContact O-N 2.86Å; G328-R330 PolarHBondContact O-N 3.13Å; G328-W331 PolarHBondContact O-NE1 2.9Å
329	K	91.3	Very high	91.6	Very high	69 Å²	69	47.4 Å²	47.4	30%	0.3	22%	0.223	S	C	.	.	S	Bend	trans	-63.7	-26.7	177.8	-65.7	173.7	-174.3	170.4	0	113.9	I282 E326	I282-K329 HydrophobicContact CD1-CB 4.5Å; I282-K329 HydrophobicContact CD1-CG 3.6Å; E326-K329 HydrophobicContact CB-CB 4.04Å; E326-K329 HydrophobicContact CB-CD 4.46Å; E326-K329 WeakPolarHBondContact O-CB 3.36Å; E326-K329 WeakPolarHBondContact O-CD 3.48Å; E326-K329 WeakPolarHBondContact O-CG 3.37Å; E326-K329 PolarHBondContact O-N 3.45Å; E326-K329 VanDerWaalsContact O-N 3.16Å
330	R	91.6	Very high	91.5	Very high	162 Å²	162	46.2 Å²	46.2	61%	0.611	22%	0.223	S	C	*	.	S	Bend	trans	-144.7	142.7	178.1	-67.3	-175.8	177.4	140.5	-6.3	109.5	S324 E326 G328	S324-R330 WeakPolarHBondContact CA-O 3.3Å; S324-R330 WeakPolarHBondContact CB-O 3.43Å; S324-R330 PolarHBondContact OG-O 3.45Å; E326-R330 WeakPolarHBondContact OE1-CD 3.39Å; E326-R330 IonicContact OE1-CZ 3.85Å; E326-R330 IonicContact OE1-NE 3.25Å; E326-R330 IonicContact OE1-NH1 2.76Å; E326-R330 PolarHBondContact OE1-NH1 2.87Å; E326-R330 IonicContact OE2-CZ 2.71Å; E326-R330 IonicContact OE2-NE 2.78Å; E326-R330 IonicContact OE2-NH1 3.21Å; E326-R330 PolarHBondContact OE2-NH1 3.37Å; G328-R330 PolarHBondContact O-N 3.13Å
331	W	91.9	Very high	91.1	Very high	48 Å²	48	47.6 Å²	47.6	18%	0.182	23%	0.233	C	C	.	.			trans	-123.5	143.5	180	-64.2	97.4	0	0	0	110.7	L280 F297 I299 L302 I312 A314 V323 G328	L280-W331 HydrophobicContact CD2-CZ2 4.46Å; F297-W331 HydrophobicContact CE1-CB 3.78Å; F297-W331 HydrophobicContact CE1-CD2 4.36Å; F297-W331 AromaticContact CE1-CG 3.77Å; F297-W331 HydrophobicContact CE1-CG 3.77Å; F297-W331 HydrophobicContact CZ-CB 4.14Å; F297-W331 AromaticContact CZ-CD2 3.88Å; F297-W331 HydrophobicContact CZ-CD2 3.88Å; F297-W331 HydrophobicContact CZ-CE3 4.3Å; F297-W331 AromaticContact CZ-CG 3.79Å; F297-W331 HydrophobicContact CZ-CG 3.79Å; I299-W331 HydrophobicContact CD1-CZ2 4.29Å; L302-W331 HydrophobicContact CD2-CH2 4.17Å; I312-W331 HydrophobicContact CB-CH2 4.14Å; I312-W331 HydrophobicContact CB-CZ3 4.49Å; I312-W331 HydrophobicContact CG2-CH2 4.04Å; A314-W331 HydrophobicContact CB-CE3 4.02Å; A314-W331 HydrophobicContact CB-CH2 3.61Å; A314-W331 HydrophobicContact CB-CZ2 4.34Å; A314-W331 HydrophobicContact CB-CZ3 3.42Å; A314-W331 VanDerWaalsContact CB-CZ3 3.42Å; V323-W331 CarbonylContact O-C 3.49Å; V323-W331 WeakPolarHBondContact O-CA 3.14Å; G328-W331 PolarHBondContact O-NE1 2.9Å
332	Q	90.9	Very high	91.1	Very high	103 Å²	103	49.9 Å²	49.9	48%	0.481	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.6	174	-61.2	-178.1	4.9	0	0	108.5	Y322 V323 V334	Y322-Q332 CarbonylContact C-O 3.56Å; Y322-Q332 VanDerWaalsContact CA-O 3.23Å; Y322-Q332 WeakPolarHBondContact CA-O 3.48Å; V323-Q332 HydrophobicContact CG1-CB 4.16Å; V323-Q332 PolarHBondContact N-O 2.8Å; V323-Q332 PolarHBondContact O-N 2.88Å; Q332-V334 PolarHBondContact O-N 2.85Å
333	L	91.3	Very high	91.1	Very high	96 Å²	96	48.8 Å²	48.8	50%	0.503	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	126.5	176.2	179.4	65.3	0	0	0	109.7	K320 Y322	K320-L333 HydrophobicContact CB-CD1 3.75Å; K320-L333 HydrophobicContact CD-CD1 4.09Å; K320-L333 HydrophobicContact CG-CD1 3.99Å; Y322-L333 HydrophobicContact CD1-CB 4.16Å; Y322-L333 HydrophobicContact CD1-CD1 4.22Å; Y322-L333 HydrophobicContact CE1-CB 4.04Å; Y322-L333 HydrophobicContact CE1-CD1 3.89Å; Y322-L333 HydrophobicContact CE2-CD1 4.45Å
334	V	90.2	Very high	91.1	Very high	13 Å²	13	51 Å²	51	8%	0.079	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-54.9	175.5	-175.4	0	0	0	0	110.1	L313 L321 V323 Q332 I357 L359 C373 C378	L313-V334 HydrophobicContact CD2-CG2 4.29Å; L321-V334 WeakPolarHBondContact O-CB 3.47Å; L321-V334 PolarHBondContact O-N 3.04Å; V323-V334 HydrophobicContact CB-CG2 3.62Å; V323-V334 HydrophobicContact CG1-CG2 3.62Å; Q332-V334 PolarHBondContact O-N 2.85Å; V334-I357 HydrophobicContact CG1-CD1 3.81Å; V334-I357 HydrophobicContact CG2-CD1 3.96Å; V334-L359 HydrophobicContact CG1-CD1 4.09Å; V334-C373 HydrophobicContact CG1-CB 3.87Å; V334-C378 WeakPolarHBondContact O-CB 3.47Å
335	H	90.1	Very high	91	Very high	25 Å²	25	51.9 Å²	51.9	12%	0.116	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	157.9	179.7	-149.4	-73.5	0	0	0	110.5	L321 V338 L359 K383	L321-H335 PolarHBondContact N-O 3.49Å; H335-V338 HydrophobicContact CB-CG2 3.97Å; H335-L359 HydrophobicContact CB-CD1 4.01Å; H335-K383 PolarHBondContact NE2-NZ 2.85Å
336	D	89.7	Confident	90.8	Very high	72 Å²	72	48.9 Å²	48.9	39%	0.385	23%	0.231	S	C	.	.	S	Bend	trans	-100.5	172.2	168.8	60.3	8.3	0	0	0	112	Q319 K320 V338	Q319-D336 CarbonylContact O-C 3.56Å; K320-D336 HydrophobicContact CG-CB 3.94Å; D336-V338 PolarHBondContact O-N 2.94Å; D336-V338 VanDerWaalsContact O-N 3.14Å
337	N	90.4	Very high	90.4	Very high	76 Å²	76	51.6 Å²	51.6	41%	0.406	24%	0.239	S	C	.	.	S	Bend	trans	55.6	30.8	178.8	-46.8	-81.6	0	0	0	113.6	Q319 I361 T362	Q319-N337 PolarHBondContact O-N 2.94Å; N337-I361 WeakPolarHBondContact O-CA 3.12Å; N337-T362 PolarHBondContact O-N 2.91Å
338	V	91.8	Very high	89.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	134.4	-179.9	176.9	0	0	0	0	109.1	Y315 Q319 L321 H335 D336 F343 I361	Y315-V338 HydrophobicContact CE2-CB 4.16Å; Y315-V338 HydrophobicContact CE2-CG1 4.25Å; Y315-V338 WeakPolarHBondContact CE2-O 3.27Å; Y315-V338 PolarHBondContact OH-O 3.32Å; Y315-V338 VanDerWaalsContact OH-O 3.11Å; Q319-V338 PolarHBondContact O-N 2.82Å; L321-V338 HydrophobicContact CB-CB 4.43Å; L321-V338 HydrophobicContact CB-CG1 4.42Å; L321-V338 HydrophobicContact CB-CG2 3.98Å; H335-V338 HydrophobicContact CB-CG2 3.97Å; D336-V338 PolarHBondContact O-N 2.94Å; D336-V338 VanDerWaalsContact O-N 3.14Å; V338-F343 HydrophobicContact CG1-CB 4.46Å; V338-F343 HydrophobicContact CG1-CD1 4.18Å; V338-I361 HydrophobicContact CG2-CG2 4.15Å
339	V	91.1	Very high	88.9	Confident	13 Å²	13	58 Å²	58	8%	0.079	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	134.3	-179.5	177.1	0	0	0	0	109.7	N341 R342 E360 T362	V339-N341 PolarHBondContact O-N 2.78Å; V339-R342 HydrophobicContact CB-CB 4.1Å; V339-R342 HydrophobicContact CB-CG 4.3Å; V339-R342 HydrophobicContact CG1-CB 4.13Å; V339-R342 HydrophobicContact CG1-CG 3.77Å; V339-R342 PolarHBondContact O-N 2.05Å; V339-E360 HydrophobicContact CB-CB 4.16Å; V339-E360 HydrophobicContact CB-CG 4.23Å; V339-E360 HydrophobicContact CG2-CB 4.25Å; V339-E360 HydrophobicContact CG2-CG 3.86Å; V339-E360 PolarHBondContact N-O 2.76Å; V339-T362 WeakPolarHBondContact CG2-OG1 3.19Å
340	P	88.3	Confident	88.5	Confident	66 Å²	66	56.7 Å²	56.7	43%	0.429	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.8	136.8	178.5	-25.9	31.7	0	0	0	112.4	Y315 R342	Y315-P340 HydrophobicContact CE1-CB 4.47Å; Y315-P340 WeakPolarHBondContact OH-CG 3.4Å; P340-R342 PolarHBondContact O-N 3.02Å
341	N	85.6	Confident	87.9	Confident	88 Å²	88	50 Å²	50	47%	0.471	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	56.6	8.2	177.2	-57.3	-16.6	0	0	0	116.5	V339	V339-N341 PolarHBondContact O-N 2.78Å
342	R	92.2	Very high	87	Confident	49 Å²	49	57.4 Å²	57.4	19%	0.185	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	48.5	178.9	-61.4	-68.8	169.9	-175.7	-2.4	112.5	V339 P340 E360 N394 L396	V339-R342 HydrophobicContact CB-CB 4.1Å; V339-R342 HydrophobicContact CB-CG 4.3Å; V339-R342 HydrophobicContact CG1-CB 4.13Å; V339-R342 HydrophobicContact CG1-CG 3.77Å; V339-R342 PolarHBondContact O-N 2.05Å; P340-R342 PolarHBondContact O-N 3.02Å; R342-E360 HydrophobicContact CB-CB 3.68Å; R342-E360 HydrophobicContact CG-CB 4.49Å; R342-E360 PolarHBondContact O-N 2.88Å; R342-N394 VanDerWaalsContact CZ-OD1 3.3Å; R342-N394 PolarHBondContact NE-O 2.72Å; R342-N394 PolarHBondContact NE-OD1 3.31Å; R342-N394 PolarHBondContact NH2-O 3.43Å; R342-N394 PolarHBondContact NH2-OD1 3.11Å; R342-L396 WeakPolarHBondContact CD-O 3.39Å; R342-L396 PolarHBondContact NH1-O 2.96Å
343	F	92.6	Very high	86.3	Confident	10 Å²	10	55.5 Å²	55.5	4%	0.044	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	132.3	176.2	54	-92.4	0	0	0	111.1	L303 L313 Y315 L321 V338 H358 L359	L303-F343 HydrophobicContact CB-CE2 3.92Å; L303-F343 HydrophobicContact CD2-CD2 3.97Å; L303-F343 HydrophobicContact CD2-CE2 4.1Å; L303-F343 WeakPolarHBondContact CD2-O 3.38Å; L313-F343 HydrophobicContact CD1-CD2 4.36Å; Y315-F343 HydrophobicContact CD2-CD1 4.29Å; Y315-F343 AromaticContact CD2-CE1 3.77Å; Y315-F343 HydrophobicContact CD2-CE1 3.77Å; Y315-F343 AromaticContact CG-CE1 3.9Å; Y315-F343 HydrophobicContact CG-CE1 3.9Å; Y315-F343 HydrophobicContact CG-CZ 4.3Å; L321-F343 HydrophobicContact CD1-CB 4.5Å; L321-F343 HydrophobicContact CD1-CD1 4Å; L321-F343 HydrophobicContact CD1-CD2 3.73Å; L321-F343 HydrophobicContact CD1-CE1 4.12Å; L321-F343 HydrophobicContact CD1-CE2 3.86Å; L321-F343 HydrophobicContact CD1-CG 3.82Å; L321-F343 HydrophobicContact CD1-CZ 4.07Å; L321-F343 HydrophobicContact CD2-CB 3.87Å; L321-F343 HydrophobicContact CD2-CD2 4.28Å; L321-F343 HydrophobicContact CD2-CG 4.08Å; V338-F343 HydrophobicContact CG1-CB 4.46Å; V338-F343 HydrophobicContact CG1-CD1 4.18Å; F343-H358 CarbonylContact C-O 3.59Å; F343-H358 VanDerWaalsContact CA-O 3.31Å; F343-H358 WeakPolarHBondContact CA-O 3.45Å; F343-L359 HydrophobicContact CB-CD2 3.61Å
344	Y	93.3	Very high	85.2	Confident	50 Å²	50	56.8 Å²	56.8	20%	0.196	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	147	-170.5	-52.1	-90.2	0	0	0	112.2	H358 L396 V398	Y344-H358 PolarHBondContact N-O 3.01Å; Y344-H358 PolarHBondContact O-N 2.87Å; Y344-L396 HydrophobicContact CD2-CD2 4.41Å; Y344-L396 HydrophobicContact CE2-CD2 4.37Å; Y344-L396 HydrophobicContact CE2-CG 4.16Å; Y344-L396 PolarHBondContact OH-O 2.98Å; Y344-V398 HydrophobicContact CD1-CB 4.23Å; Y344-V398 HydrophobicContact CD2-CB 3.79Å; Y344-V398 HydrophobicContact CD2-CG2 3.73Å; Y344-V398 HydrophobicContact CE2-CB 4.4Å; Y344-V398 HydrophobicContact CE2-CG2 4.34Å; Y344-V398 HydrophobicContact CG-CB 3.7Å; Y344-V398 HydrophobicContact CG-CG2 4.13Å
345	W	91.3	Very high	84.5	Confident	19 Å²	19	56.7 Å²	56.7	7%	0.072	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	147.8	172.2	-72.7	114.2	0	0	0	112.1	L303 F304 H305 W311 L313 V323 I357 L375	L303-W345 PolarHBondContact O-NE1 2.87Å; F304-W345 PolarHBondContact O-NE1 2.79Å; H305-W345 HydrophobicContact CB-CD2 4.13Å; H305-W345 HydrophobicContact CB-CG 4.45Å; H305-W345 HydrophobicContact CB-CH2 4.47Å; H305-W345 HydrophobicContact CB-CZ2 3.86Å; H305-W345 AromaticContact CD2-CD2 3.6Å; H305-W345 AromaticContact CD2-CE3 3.54Å; H305-W345 AromaticContact CD2-CZ3 3.92Å; W311-W345 HydrophobicContact CB-CH2 3.98Å; W311-W345 HydrophobicContact CB-CZ2 4.18Å; W311-W345 HydrophobicContact CE3-CH2 4.41Å; W311-W345 HydrophobicContact CE3-CZ3 4.22Å; L313-W345 HydrophobicContact CB-CZ2 4.42Å; L313-W345 HydrophobicContact CD1-CD2 3.88Å; L313-W345 HydrophobicContact CD1-CE3 4.24Å; L313-W345 HydrophobicContact CD1-CG 4.43Å; L313-W345 HydrophobicContact CD1-CH2 4.3Å; L313-W345 HydrophobicContact CD1-CZ2 3.92Å; L313-W345 HydrophobicContact CD1-CZ3 4.43Å; L313-W345 HydrophobicContact CD2-CH2 4.25Å; L313-W345 HydrophobicContact CD2-CZ2 4.38Å; L313-W345 HydrophobicContact CG-CD2 4.42Å; L313-W345 HydrophobicContact CG-CH2 3.88Å; L313-W345 HydrophobicContact CG-CZ2 3.54Å; L313-W345 HydrophobicContact CG-CZ3 4.42Å; V323-W345 HydrophobicContact CG2-CH2 4Å; W345-I357 HydrophobicContact CE3-CG1 4.24Å; W345-I357 HydrophobicContact CZ3-CG1 4.1Å; W345-L375 HydrophobicContact CH2-CD1 4Å; W345-L375 HydrophobicContact CZ3-CD1 3.65Å
346	S	87.8	Confident	84.4	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-65.1	146.6	168	52.8	0	0	0	0	113.1	D351 Q354 M356	S346-D351 WeakPolarHBondContact CA-OD2 3.49Å; S346-Q354 PolarHBondContact OG-O 2.69Å; S346-M356 WeakPolarHBondContact CB-O 3.35Å; S346-M356 PolarHBondContact N-O 2.99Å; S346-M356 PolarHBondContact OG-N 2.74Å; S346-M356 VanDerWaalsContact OG-N 3.13Å; S346-M356 PolarHBondContact OG-O 3.28Å
347	R	83.1	Confident	84.4	Confident	123 Å²	123	53.3 Å²	53.3	46%	0.464	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-93.9	133	172.5	-69.8	-168.4	63.7	142.3	2.3	111.1	L350 D351 D400	R347-L350 HydrophobicContact CB-CB 4.41Å; R347-L350 PolarHBondContact O-N 2.84Å; R347-D351 PolarHBondContact N-OD2 2.87Å; R347-D351 PolarHBondContact O-N 2.86Å; R347-D351 VanDerWaalsContact O-N 3.14Å; R347-D400 IonicContact CZ-OD1 2.74Å; R347-D400 IonicContact NH1-OD1 3.85Å; R347-D400 PolarHBondContact NH1-OD1 3.42Å
348	L	76.5	Confident	84.6	Confident	46 Å²	46	49.8 Å²	49.8	24%	0.241	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	143.3	178.9	-60.3	-159.6	0	0	0	111.4	E307 L350 Q354	E307-L348 WeakPolarHBondContact OE1-CG 3.11Å; E307-L348 VanDerWaalsContact OE2-CD1 3.27Å; E307-L348 WeakPolarHBondContact OE2-CD1 3.39Å; L348-L350 PolarHBondContact O-N 3.42Å; L348-Q354 HydrophobicContact CD2-CB 3.61Å; L348-Q354 HydrophobicContact CD2-CG 3.81Å
349	G	76.1	Confident	84.6	Confident	90 Å²	90	49.8 Å²	49.8	93%	0.928	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	-14.4	-178.1	0	0	0	0	0	115.4
350	L	82	Confident	84.8	Confident	42 Å²	42	49.2 Å²	49.2	22%	0.22	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-50.3	178.9	-169	79.9	0	0	0	112.4	R347 L348 E401 K420 R421	R347-L350 HydrophobicContact CB-CB 4.41Å; R347-L350 PolarHBondContact O-N 2.84Å; L348-L350 PolarHBondContact O-N 3.42Å; L350-E401 HydrophobicContact CD1-CG 4.44Å; L350-K420 HydrophobicContact CD1-CB 4.12Å; L350-K420 HydrophobicContact CD1-CG 3.94Å; L350-R421 HydrophobicContact CD2-CG 4.17Å; L350-R421 HydrophobicContact CG-CG 4.25Å
351	D	80.5	Confident	84.9	Confident	22 Å²	22	46.5 Å²	46.5	12%	0.118	24%	0.239	C	C	.	.	S	Bend	trans	-84.5	146.9	-179.1	-72.7	-67.9	0	0	0	111.6	S346 R347 D353 H358 R421	S346-D351 WeakPolarHBondContact CA-OD2 3.49Å; R347-D351 PolarHBondContact N-OD2 2.87Å; R347-D351 PolarHBondContact O-N 2.86Å; R347-D351 VanDerWaalsContact O-N 3.14Å; D351-D353 VanDerWaalsContact C-N 3.3Å; D351-D353 PolarHBondContact O-N 3.29Å; D351-H358 IonicContact OD1-CE1 2.81Å; D351-H358 PolarHBondContact OD1-CE1 2.89Å; D351-H358 VanDerWaalsContact OD1-CE1 3.29Å; D351-H358 IonicContact OD1-NE2 3.99Å; D351-H358 PolarHBondContact OD1-NE2 2.93Å; D351-H358 IonicContact OD2-NE2 3.96Å; D351-R421 WeakPolarHBondContact OD1-CD 3.48Å; D351-R421 WeakPolarHBondContact OD1-CG 3.22Å; D351-R421 IonicContact OD1-CZ 3.69Å; D351-R421 IonicContact OD1-NE 3.43Å; D351-R421 PolarHBondContact OD1-NE 2.82Å; D351-R421 IonicContact OD1-NH2 3.41Å; D351-R421 IonicContact OD2-CZ 2.73Å; D351-R421 IonicContact OD2-NE 3.29Å; D351-R421 PolarHBondContact OD2-NE 3.33Å; D351-R421 IonicContact OD2-NH2 2.75Å; D351-R421 PolarHBondContact OD2-NH2 3.45Å
352	K	72.1	Confident	85.2	Confident	203 Å²	203	44.9 Å²	44.9	88%	0.883	23%	0.233	S	C	*	.	S	Bend	trans	-64.6	-26.5	-166.9	-66.6	-177.2	-179.1	177	0	115.3
353	D	75.4	Confident	84.9	Confident	63 Å²	63	44.4 Å²	44.4	34%	0.337	24%	0.235	S	C	.	.	S	Bend	trans	-135.2	141.2	174.4	-54.4	-109.2	0	0	0	108.5	D351 G355 M356 K374	D351-D353 VanDerWaalsContact C-N 3.3Å; D351-D353 PolarHBondContact O-N 3.29Å; D353-G355 PolarHBondContact O-N 3.06Å; D353-M356 HydrophobicContact CB-CG 3.88Å; D353-M356 PolarHBondContact O-N 2.89Å; D353-K374 IonicContact OD1-NZ 2.72Å; D353-K374 PolarHBondContact OD1-NZ 3.46Å; D353-K374 WeakPolarHBondContact OD2-CE 3.5Å; D353-K374 IonicContact OD2-NZ 3.4Å; D353-K374 PolarHBondContact OD2-NZ 2.6Å
354	Q	68.2	Low	83.9	Confident	123 Å²	123	49.2 Å²	49.2	58%	0.575	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-10.4	-173.1	-57.9	-169.9	-50.4	0	0	115.3	W311 S346 L348	W311-Q354 WeakPolarHBondContact CZ3-O 3.49Å; S346-Q354 PolarHBondContact OG-O 2.69Å; L348-Q354 HydrophobicContact CD2-CB 3.61Å; L348-Q354 HydrophobicContact CD2-CG 3.81Å
355	G	76.3	Confident	82.7	Confident	10 Å²	10	51.6 Å²	51.6	10%	0.103	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.2	49	-179.8	0	0	0	0	0	111.3	D353 L375	D353-G355 PolarHBondContact O-N 3.06Å; G355-L375 WeakPolarHBondContact O-CB 3.18Å; G355-L375 PolarHBondContact O-N 2.65Å
356	M	87.2	Confident	82	Confident	26 Å²	26	53.1 Å²	53.1	13%	0.128	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	140.9	171	-77.9	-83.3	-85.3	0	0	109.5	S346 D353 T372 C373 K374	S346-M356 WeakPolarHBondContact CB-O 3.35Å; S346-M356 PolarHBondContact N-O 2.99Å; S346-M356 PolarHBondContact OG-N 2.74Å; S346-M356 VanDerWaalsContact OG-N 3.13Å; S346-M356 PolarHBondContact OG-O 3.28Å; D353-M356 HydrophobicContact CB-CG 3.88Å; D353-M356 PolarHBondContact O-N 2.89Å; M356-T372 HydrophobicContact CE-CG2 4.31Å; M356-T372 WeakPolarHBondContact CE-OG1 3.46Å; M356-C373 WeakPolarHBondContact CA-O 3.46Å; M356-K374 HydrophobicContact SD-CG 3.61Å
357	I	91.5	Very high	81.8	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.5	178	-48.3	160.4	0	0	0	107	L313 L321 V334 W345 L359 T372 C373 L375	L313-I357 HydrophobicContact CD1-CG2 3.79Å; L313-I357 HydrophobicContact CD2-CD1 3.81Å; L313-I357 HydrophobicContact CD2-CG1 4.43Å; L313-I357 HydrophobicContact CD2-CG2 4.42Å; L321-I357 HydrophobicContact CD2-CG2 4.28Å; V334-I357 HydrophobicContact CG1-CD1 3.81Å; V334-I357 HydrophobicContact CG2-CD1 3.96Å; W345-I357 HydrophobicContact CE3-CG1 4.24Å; W345-I357 HydrophobicContact CZ3-CG1 4.1Å; I357-L359 HydrophobicContact CG2-CD2 3.6Å; I357-L359 HydrophobicContact CG2-CG 4.17Å; I357-T372 CarbonylContact O-C 3.54Å; I357-T372 VanDerWaalsContact O-CA 3.32Å; I357-T372 WeakPolarHBondContact O-CA 3.33Å; I357-C373 PolarHBondContact N-O 3.19Å; I357-C373 PolarHBondContact O-N 3.21Å; I357-L375 HydrophobicContact CD1-CD1 4.46Å
358	H	92.9	Very high	82.1	Confident	3 Å²	3	50.8 Å²	50.8	1%	0.014	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	126.1	179	-57.2	-105.1	0	0	0	108	F343 Y344 D351 Y370 T372 V398	F343-H358 CarbonylContact C-O 3.59Å; F343-H358 VanDerWaalsContact CA-O 3.31Å; F343-H358 WeakPolarHBondContact CA-O 3.45Å; Y344-H358 PolarHBondContact N-O 3.01Å; Y344-H358 PolarHBondContact O-N 2.87Å; D351-H358 IonicContact OD1-CE1 2.81Å; D351-H358 PolarHBondContact OD1-CE1 2.89Å; D351-H358 VanDerWaalsContact OD1-CE1 3.29Å; D351-H358 IonicContact OD1-NE2 3.99Å; D351-H358 PolarHBondContact OD1-NE2 2.93Å; D351-H358 IonicContact OD2-NE2 3.96Å; H358-Y370 HydrophobicContact CB-CE2 3.99Å; H358-Y370 AromaticContact ND1-CZ 3.9Å; H358-Y370 PolarHBondContact ND1-OH 2.8Å; H358-T372 HydrophobicContact CB-CG2 4.41Å; H358-V398 HydrophobicContact CB-CG2 3.89Å
359	L	92.9	Very high	82.8	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	140	-171.6	-53.8	174.1	0	0	0	111.2	L321 V334 H335 F343 I357 I361 Y370 I371 C373	L321-L359 HydrophobicContact CD2-CD2 3.36Å; V334-L359 HydrophobicContact CG1-CD1 4.09Å; H335-L359 HydrophobicContact CB-CD1 4.01Å; F343-L359 HydrophobicContact CB-CD2 3.61Å; I357-L359 HydrophobicContact CG2-CD2 3.6Å; I357-L359 HydrophobicContact CG2-CG 4.17Å; L359-I361 HydrophobicContact CB-CG2 4.49Å; L359-Y370 WeakPolarHBondContact O-CA 3.39Å; L359-I371 HydrophobicContact CB-CD1 4.35Å; L359-I371 HydrophobicContact CB-CG1 3.79Å; L359-I371 HydrophobicContact CD1-CD1 4.09Å; L359-I371 HydrophobicContact CD1-CG1 4.29Å; L359-I371 HydrophobicContact CG-CG1 4.5Å; L359-I371 PolarHBondContact N-O 2.79Å; L359-I371 PolarHBondContact O-N 2.62Å; L359-C373 HydrophobicContact CD1-CB 4.24Å; L359-C373 VanDerWaalsContact CD1-SG 3.54Å
360	E	94.4	Very high	83.6	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	128.2	155.6	-168.5	-179.5	138.1	0	0	109.8	V339 R342 S368 I391 P393 N394 S395 L396	V339-E360 HydrophobicContact CB-CB 4.16Å; V339-E360 HydrophobicContact CB-CG 4.23Å; V339-E360 HydrophobicContact CG2-CB 4.25Å; V339-E360 HydrophobicContact CG2-CG 3.86Å; V339-E360 PolarHBondContact N-O 2.76Å; R342-E360 HydrophobicContact CB-CB 3.68Å; R342-E360 HydrophobicContact CG-CB 4.49Å; R342-E360 PolarHBondContact O-N 2.88Å; E360-S368 WeakPolarHBondContact OE1-CB 3.44Å; E360-S368 PolarHBondContact OE1-OG 3.21Å; E360-I391 HydrophobicContact CG-CD1 4.06Å; E360-P393 VanDerWaalsContact OE1-CA 3.28Å; E360-P393 WeakPolarHBondContact OE1-CA 3.46Å; E360-N394 PolarHBondContact OE1-N 2.55Å; E360-N394 PolarHBondContact OE2-N 2.69Å; E360-S395 PolarHBondContact OE2-N 2.86Å; E360-S395 VanDerWaalsContact OE2-N 3.08Å; E360-L396 HydrophobicContact CB-CB 4.03Å; E360-L396 HydrophobicContact CB-CD2 4.04Å; E360-L396 PolarHBondContact OE2-N 3.13Å
361	I	91.9	Very high	84	Confident	9 Å²	9	44.1 Å²	44.1	5%	0.046	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	140.2	176.3	54.7	152.3	0	0	0	111.9	N337 V338 L359 S368 Q369 I371	N337-I361 WeakPolarHBondContact O-CA 3.12Å; V338-I361 HydrophobicContact CG2-CG2 4.15Å; L359-I361 HydrophobicContact CB-CG2 4.49Å; I361-S368 CarbonylContact O-C 3.47Å; I361-S368 VanDerWaalsContact O-CA 3.3Å; I361-S368 WeakPolarHBondContact O-CA 3.42Å; I361-Q369 HydrophobicContact CG1-CB 4.21Å; I361-Q369 WeakPolarHBondContact CG1-O 3.46Å; I361-Q369 PolarHBondContact N-O 2.98Å; I361-Q369 PolarHBondContact O-N 2.86Å; I361-I371 HydrophobicContact CD1-CD1 3.91Å; I361-I371 HydrophobicContact CD1-CG2 4.03Å; I361-I371 HydrophobicContact CG1-CD1 3.97Å; I361-I371 HydrophobicContact CG1-CG1 4.21Å; I361-I371 HydrophobicContact CG1-CG2 4.04Å; I361-I371 HydrophobicContact CG2-CD1 3.74Å; I361-I371 HydrophobicContact CG2-CG1 4.29Å
362	T	90.8	Very high	84.5	Confident	54 Å²	54	43.4 Å²	43.4	33%	0.331	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	133.8	172.5	-52.5	0	0	0	0	110.2	N337 V339	N337-T362 PolarHBondContact O-N 2.91Å; V339-T362 WeakPolarHBondContact CG2-OG1 3.19Å
363	V	85.9	Confident	85.3	Confident	39 Å²	39	33.8 Å²	33.8	24%	0.236	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	159	173.4	-173.4	0	0	0	0	109.6	D365 G366 R367 Q369 F390	V363-D365 PolarHBondContact O-N 3.28Å; V363-G366 PolarHBondContact O-N 3.41Å; V363-R367 WeakPolarHBondContact CB-O 3.35Å; V363-R367 PolarHBondContact N-O 3.36Å; V363-Q369 HydrophobicContact CG2-CG 3.99Å; V363-F390 HydrophobicContact CB-CE1 3.98Å; V363-F390 HydrophobicContact CG1-CE1 4.13Å; V363-F390 HydrophobicContact CG2-CE1 3.92Å
364	S	72.2	Confident	85.7	Confident	111 Å²	111	34.6 Å²	34.6	78%	0.776	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-44.9	-21.7	-172.1	55.2	0	0	0	0	117.7
365	D	68.1	Low	86.1	Confident	100 Å²	100	29.8 Å²	29.8	54%	0.535	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	12.9	-173.2	-47.6	-10.6	0	0	0	112.2	V363 R367	V363-D365 PolarHBondContact O-N 3.28Å; D365-R367 VanDerWaalsContact C-N 3.28Å; D365-R367 HydrophobicContact CB-CG 4.36Å; D365-R367 PolarHBondContact O-N 3.14Å; D365-R367 IonicContact OD2-CZ 3.06Å; D365-R367 IonicContact OD2-NE 2.62Å; D365-R367 IonicContact OD2-NH2 3.74Å; D365-R367 PolarHBondContact OD2-NH2 3Å
366	G	76.1	Confident	85.7	Confident	51 Å²	51	37.4 Å²	37.4	53%	0.526	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	17.5	-174.8	0	0	0	0	0	114.2	V363	V363-G366 PolarHBondContact O-N 3.41Å
367	R	82.7	Confident	84.9	Confident	75 Å²	75	39.6 Å²	39.6	28%	0.283	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	140.2	179.3	-59.8	-175.4	-77.6	157.5	-4.2	110.2	V363 D365 F390	V363-R367 WeakPolarHBondContact CB-O 3.35Å; V363-R367 PolarHBondContact N-O 3.36Å; D365-R367 VanDerWaalsContact C-N 3.28Å; D365-R367 HydrophobicContact CB-CG 4.36Å; D365-R367 PolarHBondContact O-N 3.14Å; D365-R367 IonicContact OD2-CZ 3.06Å; D365-R367 IonicContact OD2-NE 2.62Å; D365-R367 IonicContact OD2-NH2 3.74Å; D365-R367 PolarHBondContact OD2-NH2 3Å; R367-F390 HydrophobicContact CB-CD1 3.42Å; R367-F390 VanDerWaalsContact CB-CD1 3.42Å; R367-F390 HydrophobicContact CB-CE1 3.82Å; R367-F390 HydrophobicContact CB-CG 4.2Å; R367-F390 HydrophobicContact CG-CD1 4.44Å; R367-F390 VanDerWaalsContact NH1-CD2 3.34Å
368	S	91	Very high	84.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	154.2	178.9	-76.6	0	0	0	0	113.3	E360 I361 F390 I391 P393	E360-S368 WeakPolarHBondContact OE1-CB 3.44Å; E360-S368 PolarHBondContact OE1-OG 3.21Å; I361-S368 CarbonylContact O-C 3.47Å; I361-S368 VanDerWaalsContact O-CA 3.3Å; I361-S368 WeakPolarHBondContact O-CA 3.42Å; S368-F390 WeakPolarHBondContact O-CA 3.33Å; S368-F390 WeakPolarHBondContact O-CD1 3.42Å; S368-I391 PolarHBondContact N-O 3.42Å; S368-I391 PolarHBondContact O-N 3.13Å; S368-P393 WeakPolarHBondContact OG-CA 3.33Å
369	Q	90.6	Very high	83.2	Confident	28 Å²	28	43.5 Å²	43.5	13%	0.131	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	135.8	166	-69.6	-173	7.9	0	0	110.7	I361 V363 I371 F390	I361-Q369 HydrophobicContact CG1-CB 4.21Å; I361-Q369 WeakPolarHBondContact CG1-O 3.46Å; I361-Q369 PolarHBondContact N-O 2.98Å; I361-Q369 PolarHBondContact O-N 2.86Å; V363-Q369 HydrophobicContact CG2-CG 3.99Å; Q369-I371 HydrophobicContact CB-CG2 4.32Å; Q369-F390 HydrophobicContact CG-CD1 3.69Å; Q369-F390 HydrophobicContact CG-CE1 3.9Å; Q369-F390 HydrophobicContact CG-CG 4.3Å
370	Y	92.8	Very high	82	Confident	9 Å²	9	50 Å²	50	4%	0.035	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	121.9	165.9	168.9	-145.2	0	0	0	109.6	H358 L359 T372 P386 F387 L396 V403 I405 F424	H358-Y370 HydrophobicContact CB-CE2 3.99Å; H358-Y370 AromaticContact ND1-CZ 3.9Å; H358-Y370 PolarHBondContact ND1-OH 2.8Å; L359-Y370 WeakPolarHBondContact O-CA 3.39Å; Y370-T372 HydrophobicContact CE2-CG2 3.94Å; Y370-P386 HydrophobicContact CD1-CB 4.19Å; Y370-P386 HydrophobicContact CD1-CG 4.31Å; Y370-P386 HydrophobicContact CE1-CB 3.58Å; Y370-P386 HydrophobicContact CE1-CG 3.7Å; Y370-P386 HydrophobicContact CE2-CG 4.33Å; Y370-F387 HydrophobicContact CD1-CB 4.47Å; Y370-L396 HydrophobicContact CD1-CD1 4.14Å; Y370-L396 HydrophobicContact CD2-CD1 3.71Å; Y370-L396 HydrophobicContact CD2-CD2 3.66Å; Y370-L396 HydrophobicContact CD2-CG 4.36Å; Y370-L396 HydrophobicContact CE1-CD1 4.38Å; Y370-L396 HydrophobicContact CE2-CD1 4.02Å; Y370-L396 HydrophobicContact CE2-CD2 4.13Å; Y370-L396 HydrophobicContact CG-CD1 3.81Å; Y370-L396 HydrophobicContact CG-CD2 4.38Å; Y370-V403 HydrophobicContact CE1-CG1 3.97Å; Y370-I405 HydrophobicContact CD1-CG2 4.34Å; Y370-F424 HydrophobicContact CD1-CE2 4.22Å; Y370-F424 HydrophobicContact CD1-CZ 4.02Å; Y370-F424 AromaticContact CE1-CE2 3.93Å; Y370-F424 HydrophobicContact CE1-CE2 3.93Å; Y370-F424 AromaticContact CE1-CZ 3.7Å; Y370-F424 HydrophobicContact CE1-CZ 3.7Å
371	I	91.3	Very high	80.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	161	178.4	68.8	169.7	0	0	0	110.7	L359 I361 Q369 K383 G384	L359-I371 HydrophobicContact CB-CD1 4.35Å; L359-I371 HydrophobicContact CB-CG1 3.79Å; L359-I371 HydrophobicContact CD1-CD1 4.09Å; L359-I371 HydrophobicContact CD1-CG1 4.29Å; L359-I371 HydrophobicContact CG-CG1 4.5Å; L359-I371 PolarHBondContact N-O 2.79Å; L359-I371 PolarHBondContact O-N 2.62Å; I361-I371 HydrophobicContact CD1-CD1 3.91Å; I361-I371 HydrophobicContact CD1-CG2 4.03Å; I361-I371 HydrophobicContact CG1-CD1 3.97Å; I361-I371 HydrophobicContact CG1-CG1 4.21Å; I361-I371 HydrophobicContact CG1-CG2 4.04Å; I361-I371 HydrophobicContact CG2-CD1 3.74Å; I361-I371 HydrophobicContact CG2-CG1 4.29Å; Q369-I371 HydrophobicContact CB-CG2 4.32Å; I371-K383 HydrophobicContact CB-CG 4.4Å; I371-K383 HydrophobicContact CD1-CD 4.41Å; I371-G384 CarbonylContact C-O 3.59Å; I371-G384 WeakPolarHBondContact CA-O 3.38Å
372	T	90.4	Very high	79.6	Confident	8 Å²	8	57.1 Å²	57.1	5%	0.049	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	134.6	168.2	47.1	0	0	0	0	111.7	M356 I357 H358 Y370 G384 P386	M356-T372 HydrophobicContact CE-CG2 4.31Å; M356-T372 WeakPolarHBondContact CE-OG1 3.46Å; I357-T372 CarbonylContact O-C 3.54Å; I357-T372 VanDerWaalsContact O-CA 3.32Å; I357-T372 WeakPolarHBondContact O-CA 3.33Å; H358-T372 HydrophobicContact CB-CG2 4.41Å; Y370-T372 HydrophobicContact CE2-CG2 3.94Å; T372-G384 PolarHBondContact N-O 3.13Å; T372-G384 PolarHBondContact O-N 2.58Å; T372-G384 WeakPolarHBondContact OG1-CA 3.29Å; T372-P386 HydrophobicContact CG2-CG 3.81Å
373	C	89	Confident	79.1	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	141.1	-176.6	-73.6	0	0	0	0	110.9	V334 M356 I357 L359 C378	V334-C373 HydrophobicContact CG1-CB 3.87Å; M356-C373 WeakPolarHBondContact CA-O 3.46Å; I357-C373 PolarHBondContact N-O 3.19Å; I357-C373 PolarHBondContact O-N 3.21Å; L359-C373 HydrophobicContact CD1-CB 4.24Å; L359-C373 VanDerWaalsContact CD1-SG 3.54Å; C373-C378 WeakPolarHBondContact CA-SG 3.35Å; C373-C378 HydrophobicContact CB-CB 3.55Å; C373-C378 WeakPolarHBondContact CB-SG 3.35Å; C373-C378 WeakPolarHBondContact SG-CB 3.49Å; C373-C378 CovalentContact SG-SG 2.03Å; C373-C378 PolarHBondContact SG-SG 3.35Å
374	K	84.3	Confident	78.8	Confident	81 Å²	81	55.6 Å²	55.6	35%	0.352	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	136.3	168.7	-66.1	-165.5	179.4	-155.9	0	110.8	D353 M356 Q376 N377	D353-K374 IonicContact OD1-NZ 2.72Å; D353-K374 PolarHBondContact OD1-NZ 3.46Å; D353-K374 WeakPolarHBondContact OD2-CE 3.5Å; D353-K374 IonicContact OD2-NZ 3.4Å; D353-K374 PolarHBondContact OD2-NZ 2.6Å; M356-K374 HydrophobicContact SD-CG 3.61Å; K374-Q376 PolarHBondContact O-N 3.3Å; K374-N377 CarbonylContact O-C 3.58Å; K374-N377 PolarHBondContact O-N 2.9Å
375	L	75.5	Confident	79.4	Confident	22 Å²	22	55.9 Å²	55.9	12%	0.115	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-36.6	-39.9	-176.7	-157.4	74.1	0	0	0	116.3	W311 V323 V325 W345 G355 I357	W311-L375 HydrophobicContact CD2-CD2 4.1Å; W311-L375 HydrophobicContact CE3-CD1 4.12Å; W311-L375 HydrophobicContact CE3-CD2 4.01Å; W311-L375 HydrophobicContact CH2-CD2 3.69Å; W311-L375 HydrophobicContact CZ2-CD2 3.74Å; W311-L375 HydrophobicContact CZ3-CD1 4.35Å; W311-L375 HydrophobicContact CZ3-CD2 3.82Å; V323-L375 HydrophobicContact CG2-CD1 3.78Å; V325-L375 HydrophobicContact CG1-CD1 4.4Å; V325-L375 HydrophobicContact CG1-CD2 3.58Å; V325-L375 HydrophobicContact CG1-CG 3.97Å; W345-L375 HydrophobicContact CH2-CD1 4Å; W345-L375 HydrophobicContact CZ3-CD1 3.65Å; G355-L375 WeakPolarHBondContact O-CB 3.18Å; G355-L375 PolarHBondContact O-N 2.65Å; I357-L375 HydrophobicContact CD1-CD1 4.46Å
376	Q	69.1	Low	80.2	Confident	169 Å²	169	53.7 Å²	53.7	79%	0.79	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-18.5	-172.8	-64.2	-178.2	-5	0	0	114.7	K374	K374-Q376 PolarHBondContact O-N 3.3Å
377	N	68.9	Low	80.6	Confident	73 Å²	73	52.7 Å²	52.7	39%	0.39	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-169.4	111.1	-175.3	-176.3	0.3	0	0	0	112.7	K374 S379 N382	K374-N377 CarbonylContact O-C 3.58Å; K374-N377 PolarHBondContact O-N 2.9Å; N377-S379 PolarHBondContact ND2-OG 3.25Å; N377-S379 WeakPolarHBondContact OD1-CB 3.47Å; N377-S379 PolarHBondContact OD1-N 2.82Å; N377-S379 PolarHBondContact OD1-OG 2.94Å; N377-N382 PolarHBondContact O-ND2 3.32Å
378	C	76.3	Confident	80.2	Confident	22 Å²	22	51.9 Å²	51.9	15%	0.149	30%	0.295	C	S	.	.			trans	-101	49.6	169.2	-152.5	0	0	0	0	114.2	V334 C373	V334-C378 WeakPolarHBondContact O-CB 3.47Å; C373-C378 WeakPolarHBondContact CA-SG 3.35Å; C373-C378 HydrophobicContact CB-CB 3.55Å; C373-C378 WeakPolarHBondContact CB-SG 3.35Å; C373-C378 WeakPolarHBondContact SG-CB 3.49Å; C373-C378 CovalentContact SG-SG 2.03Å; C373-C378 PolarHBondContact SG-SG 3.35Å
379	S	72.6	Confident	79.6	Confident	62 Å²	62	52.8 Å²	52.8	43%	0.434	30%	0.304	S	S	.	.			trans	-65.7	152.5	162.8	-63.6	0	0	0	0	110.8	N377 G381 N382 K383	N377-S379 PolarHBondContact ND2-OG 3.25Å; N377-S379 WeakPolarHBondContact OD1-CB 3.47Å; N377-S379 PolarHBondContact OD1-N 2.82Å; N377-S379 PolarHBondContact OD1-OG 2.94Å; S379-G381 PolarHBondContact O-N 3.33Å; S379-N382 PolarHBondContact O-N 3.48Å; S379-K383 PolarHBondContact O-N 3.21Å; S379-K383 VanDerWaalsContact O-N 3.13Å
380	D	69	Low	79.3	Confident	136 Å²	136	53.3 Å²	53.3	73%	0.727	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-28.3	-179.5	-70	-51.3	0	0	0	114.5	N382 K383	D380-N382 VanDerWaalsContact C-N 3.32Å; D380-N382 PolarHBondContact O-N 3.4Å; D380-K383 IonicContact OD1-NZ 2.69Å
381	G	62.5	Low	79.2	Confident	77 Å²	77	53.2 Å²	53.2	79%	0.794	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-16.4	175.1	0	0	0	0	0	115.6	S379	S379-G381 PolarHBondContact O-N 3.33Å
382	N	71.6	Confident	79.1	Confident	82 Å²	82	55.4 Å²	55.4	44%	0.439	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-5.2	176.8	-71.9	-8.1	0	0	0	112.7	N377 S379 D380 G384	N377-N382 PolarHBondContact O-ND2 3.32Å; S379-N382 PolarHBondContact O-N 3.48Å; D380-N382 VanDerWaalsContact C-N 3.32Å; D380-N382 PolarHBondContact O-N 3.4Å; N382-G384 PolarHBondContact O-N 3.49Å
383	K	80.7	Confident	79	Confident	37 Å²	37	58.1 Å²	58.1	16%	0.161	34%	0.335	C	S	.	.			trans	-80.2	108	-172.9	-178.1	168.4	175.5	168.7	0	110.2	H335 I371 S379 D380	H335-K383 PolarHBondContact NE2-NZ 2.85Å; I371-K383 HydrophobicContact CB-CG 4.4Å; I371-K383 HydrophobicContact CD1-CD 4.41Å; S379-K383 PolarHBondContact O-N 3.21Å; S379-K383 VanDerWaalsContact O-N 3.13Å; D380-K383 IonicContact OD1-NZ 2.69Å
384	G	81.2	Confident	78.9	Confident	24 Å²	24	62.7 Å²	62.7	25%	0.247	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-69.7	143.2	173.5	0	0	0	0	0	111.3	I371 T372 N382	I371-G384 CarbonylContact C-O 3.59Å; I371-G384 WeakPolarHBondContact CA-O 3.38Å; T372-G384 PolarHBondContact N-O 3.13Å; T372-G384 PolarHBondContact O-N 2.58Å; T372-G384 WeakPolarHBondContact OG1-CA 3.29Å; N382-G384 PolarHBondContact O-N 3.49Å
385	K	84.2	Confident	79.2	Confident	117 Å²	117	59.3 Å²	59.3	51%	0.509	35%	0.346	S	S	.	.			trans	-124	86.1	168.7	-65.2	-163.9	178.9	-152.8	0	108.7	F387	K385-F387 PolarHBondContact O-N 3Å
386	P	84.5	Confident	80.1	Confident	55 Å²	55	58.2 Å²	58.2	36%	0.357	34%	0.34	S	S	.	.	S	Bend	trans	-68.9	-22.4	-174.6	-20.2	34.4	0	0	0	113.2	Y370 T372 F424	Y370-P386 HydrophobicContact CD1-CB 4.19Å; Y370-P386 HydrophobicContact CD1-CG 4.31Å; Y370-P386 HydrophobicContact CE1-CB 3.58Å; Y370-P386 HydrophobicContact CE1-CG 3.7Å; Y370-P386 HydrophobicContact CE2-CG 4.33Å; T372-P386 HydrophobicContact CG2-CG 3.81Å; P386-F424 HydrophobicContact CB-CE2 4.28Å
387	F	84.8	Confident	81.2	Confident	29 Å²	29	51.7 Å²	51.7	13%	0.127	31%	0.312	C	S	.	.	S	Bend	trans	-114.6	132.3	166.2	-174	-107.9	0	0	0	109.2	Y370 K385 G389 I391 I405 V407 F424	Y370-F387 HydrophobicContact CD1-CB 4.47Å; K385-F387 PolarHBondContact O-N 3Å; F387-G389 VanDerWaalsContact C-N 3.28Å; F387-G389 PolarHBondContact O-N 3.34Å; F387-I391 HydrophobicContact CD1-CG2 3.9Å; F387-I391 HydrophobicContact CE1-CG2 4.25Å; F387-I405 HydrophobicContact CB-CD1 3.83Å; F387-I405 HydrophobicContact CD1-CD1 3.92Å; F387-I405 HydrophobicContact CD2-CD1 3.56Å; F387-I405 HydrophobicContact CE1-CD1 4.39Å; F387-I405 HydrophobicContact CE2-CD1 4.07Å; F387-I405 HydrophobicContact CG-CD1 3.48Å; F387-I405 VanDerWaalsContact CG-CD1 3.48Å; F387-I405 HydrophobicContact CZ-CD1 4.47Å; F387-V407 HydrophobicContact CE1-CG1 4.48Å; F387-V407 HydrophobicContact CE1-CG2 3.78Å; F387-V407 HydrophobicContact CE2-CG2 4.35Å; F387-V407 HydrophobicContact CZ-CG1 4.3Å; F387-V407 HydrophobicContact CZ-CG2 3.58Å; F387-F424 HydrophobicContact CB-CD2 4.19Å; F387-F424 HydrophobicContact CB-CE2 4.21Å; F387-F424 HydrophobicContact CD2-CB 4.16Å; F387-F424 HydrophobicContact CD2-CD2 4.13Å; F387-F424 HydrophobicContact CD2-CG 4.19Å
388	P	73.3	Confident	82.3	Confident	59 Å²	59	49 Å²	49	38%	0.383	30%	0.297	S	S	.	.	S	Bend	trans	-85.2	9.1	-172.1	34.5	-37.2	0	0	0	114.6	L846 F848	P388-L846 HydrophobicContact CB-CD1 3.69Å; P388-L846 HydrophobicContact CG-CD1 3.9Å; P388-F848 HydrophobicContact CG-CZ 4.36Å
389	G	78.4	Confident	82.9	Confident	18 Å²	18	50.4 Å²	50.4	19%	0.186	30%	0.302	C	S	.	.	S	Bend	trans	-127.5	-172.2	-177	0	0	0	0	0	114.1	F387	F387-G389 VanDerWaalsContact C-N 3.28Å; F387-G389 PolarHBondContact O-N 3.34Å
390	F	85.6	Confident	83.6	Confident	39 Å²	39	49.6 Å²	49.6	17%	0.171	29%	0.293	C	S	.	.			trans	-86.1	150.1	169.1	-71.6	-93.3	0	0	0	110.6	V363 R367 S368 Q369 E832	V363-F390 HydrophobicContact CB-CE1 3.98Å; V363-F390 HydrophobicContact CG1-CE1 4.13Å; V363-F390 HydrophobicContact CG2-CE1 3.92Å; R367-F390 HydrophobicContact CB-CD1 3.42Å; R367-F390 VanDerWaalsContact CB-CD1 3.42Å; R367-F390 HydrophobicContact CB-CE1 3.82Å; R367-F390 HydrophobicContact CB-CG 4.2Å; R367-F390 HydrophobicContact CG-CD1 4.44Å; R367-F390 VanDerWaalsContact NH1-CD2 3.34Å; S368-F390 WeakPolarHBondContact O-CA 3.33Å; S368-F390 WeakPolarHBondContact O-CD1 3.42Å; Q369-F390 HydrophobicContact CG-CD1 3.69Å; Q369-F390 HydrophobicContact CG-CE1 3.9Å; Q369-F390 HydrophobicContact CG-CG 4.3Å; F390-E832 VanDerWaalsContact CE2-O 3.27Å; F390-E832 WeakPolarHBondContact CE2-O 3.4Å
391	I	90.3	Very high	84.6	Confident	7 Å²	7	45 Å²	45	4%	0.036	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-115	161.6	174.3	66.5	170.5	0	0	0	110.4	E360 S368 F387 L396 I405 Q406 V407	E360-I391 HydrophobicContact CG-CD1 4.06Å; S368-I391 PolarHBondContact N-O 3.42Å; S368-I391 PolarHBondContact O-N 3.13Å; F387-I391 HydrophobicContact CD1-CG2 3.9Å; F387-I391 HydrophobicContact CE1-CG2 4.25Å; I391-L396 HydrophobicContact CD1-CB 4.33Å; I391-I405 HydrophobicContact CD1-CG2 4.21Å; I391-I405 HydrophobicContact CG2-CB 4.03Å; I391-I405 HydrophobicContact CG2-CD1 3.98Å; I391-I405 HydrophobicContact CG2-CG1 4.43Å; I391-I405 HydrophobicContact CG2-CG2 4.32Å; I391-Q406 CarbonylContact C-O 3.58Å; I391-Q406 WeakPolarHBondContact CA-O 3.49Å; I391-Q406 WeakPolarHBondContact CB-O 3.24Å; I391-V407 HydrophobicContact CG2-CG2 4.49Å
392	I	88.3	Confident	86	Confident	46 Å²	46	41.4 Å²	41.4	24%	0.236	23%	0.229	C	C	.	.			trans	-66.5	137.6	171.4	-57.9	-174.2	0	0	0	108.1	S395 Q406 A413	I392-S395 VanDerWaalsContact O-CB 3.29Å; I392-S395 WeakPolarHBondContact O-CB 3.38Å; I392-S395 PolarHBondContact O-OG 3.25Å; I392-Q406 HydrophobicContact CB-CB 4.02Å; I392-Q406 HydrophobicContact CD1-CB 4.03Å; I392-Q406 HydrophobicContact CG1-CB 4.14Å; I392-Q406 PolarHBondContact N-O 3.08Å; I392-A413 HydrophobicContact CD1-CB 3.69Å
393	P	88.9	Confident	87.1	Confident	66 Å²	66	37.5 Å²	37.5	43%	0.429	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	148	178.3	-25.6	35.5	0	0	0	113.7	E360 S368 S395	E360-P393 VanDerWaalsContact OE1-CA 3.28Å; E360-P393 WeakPolarHBondContact OE1-CA 3.46Å; S368-P393 WeakPolarHBondContact OG-CA 3.33Å; P393-S395 VanDerWaalsContact C-N 3.3Å; P393-S395 PolarHBondContact O-N 3.3Å
394	N	87.8	Confident	87.8	Confident	95 Å²	95	36.2 Å²	36.2	51%	0.508	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	28.5	-179.2	-164.1	33.4	0	0	0	114	R342 E360	R342-N394 VanDerWaalsContact CZ-OD1 3.3Å; R342-N394 PolarHBondContact NE-O 2.72Å; R342-N394 PolarHBondContact NE-OD1 3.31Å; R342-N394 PolarHBondContact NH2-O 3.43Å; R342-N394 PolarHBondContact NH2-OD1 3.11Å; E360-N394 PolarHBondContact OE1-N 2.55Å; E360-N394 PolarHBondContact OE2-N 2.69Å
395	S	89.9	Confident	88.3	Confident	10 Å²	10	35.2 Å²	35.2	7%	0.07	19%	0.192	C	C	.	.			trans	-113.5	-8.6	-173.4	74.3	0	0	0	0	116	E360 I392 P393 V397 Q406	E360-S395 PolarHBondContact OE2-N 2.86Å; E360-S395 VanDerWaalsContact OE2-N 3.08Å; I392-S395 VanDerWaalsContact O-CB 3.29Å; I392-S395 WeakPolarHBondContact O-CB 3.38Å; I392-S395 PolarHBondContact O-OG 3.25Å; P393-S395 VanDerWaalsContact C-N 3.3Å; P393-S395 PolarHBondContact O-N 3.3Å; S395-V397 PolarHBondContact O-N 2.86Å; S395-Q406 PolarHBondContact OG-N 2.72Å
396	L	94	Very high	88.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.177	C	C	.	.			trans	-70.1	125.8	176.2	-179.4	64	0	0	0	111.6	R342 Y344 E360 Y370 I391 V398 V403 I405	R342-L396 WeakPolarHBondContact CD-O 3.39Å; R342-L396 PolarHBondContact NH1-O 2.96Å; Y344-L396 HydrophobicContact CD2-CD2 4.41Å; Y344-L396 HydrophobicContact CE2-CD2 4.37Å; Y344-L396 HydrophobicContact CE2-CG 4.16Å; Y344-L396 PolarHBondContact OH-O 2.98Å; E360-L396 HydrophobicContact CB-CB 4.03Å; E360-L396 HydrophobicContact CB-CD2 4.04Å; E360-L396 PolarHBondContact OE2-N 3.13Å; Y370-L396 HydrophobicContact CD1-CD1 4.14Å; Y370-L396 HydrophobicContact CD2-CD1 3.71Å; Y370-L396 HydrophobicContact CD2-CD2 3.66Å; Y370-L396 HydrophobicContact CD2-CG 4.36Å; Y370-L396 HydrophobicContact CE1-CD1 4.38Å; Y370-L396 HydrophobicContact CE2-CD1 4.02Å; Y370-L396 HydrophobicContact CE2-CD2 4.13Å; Y370-L396 HydrophobicContact CG-CD1 3.81Å; Y370-L396 HydrophobicContact CG-CD2 4.38Å; I391-L396 HydrophobicContact CD1-CB 4.33Å; L396-V398 HydrophobicContact CD1-CG2 4.13Å; L396-V398 HydrophobicContact CG-CG2 4.36Å; L396-V403 HydrophobicContact CD1-CG1 3.83Å; L396-I405 HydrophobicContact CD1-CG2 3.82Å
397	V	93.3	Very high	88.8	Confident	32 Å²	32	29.8 Å²	29.8	19%	0.194	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	127.1	167	178.7	0	0	0	0	108.9	S395 Q399 V403 F404	S395-V397 PolarHBondContact O-N 2.86Å; V397-Q399 HydrophobicContact CG1-CB 4.4Å; V397-V403 CarbonylContact O-C 3.49Å; V397-V403 WeakPolarHBondContact O-CA 3.26Å; V397-F404 HydrophobicContact CB-CB 4.3Å; V397-F404 HydrophobicContact CB-CD2 4.16Å; V397-F404 HydrophobicContact CG1-CD2 4.14Å; V397-F404 PolarHBondContact N-O 3.4Å; V397-F404 PolarHBondContact O-N 2.8Å
398	V	91.3	Very high	88.8	Confident	15 Å²	15	31.9 Å²	31.9	9%	0.091	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	110.3	172.6	179.3	0	0	0	0	107.7	Y344 H358 L396 V403	Y344-V398 HydrophobicContact CD1-CB 4.23Å; Y344-V398 HydrophobicContact CD2-CB 3.79Å; Y344-V398 HydrophobicContact CD2-CG2 3.73Å; Y344-V398 HydrophobicContact CE2-CB 4.4Å; Y344-V398 HydrophobicContact CE2-CG2 4.34Å; Y344-V398 HydrophobicContact CG-CB 3.7Å; Y344-V398 HydrophobicContact CG-CG2 4.13Å; H358-V398 HydrophobicContact CB-CG2 3.89Å; L396-V398 HydrophobicContact CD1-CG2 4.13Å; L396-V398 HydrophobicContact CG-CG2 4.36Å; V398-V403 HydrophobicContact CG1-CG2 4.29Å; V398-V403 HydrophobicContact CG2-CG1 3.95Å; V398-V403 HydrophobicContact CG2-CG2 4.19Å
399	Q	88.8	Confident	89	Confident	52 Å²	52	31.6 Å²	31.6	24%	0.243	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	127	-178.3	-158	-179.6	-15	0	0	109	V397 E401 Y402 T443	V397-Q399 HydrophobicContact CG1-CB 4.4Å; Q399-E401 PolarHBondContact O-N 2.77Å; Q399-Y402 PolarHBondContact N-O 3.49Å; Q399-Y402 CarbonylContact O-C 3.53Å; Q399-Y402 WeakPolarHBondContact O-CA 3.31Å; Q399-Y402 PolarHBondContact O-N 2.9Å; Q399-T443 HydrophobicContact CB-CG2 4.19Å; Q399-T443 HydrophobicContact CG-CG2 4.37Å; Q399-T443 WeakPolarHBondContact CG-OG1 3.18Å; Q399-T443 PolarHBondContact NE2-OG1 2.92Å
400	D	86.8	Confident	88.8	Confident	45 Å²	45	37 Å²	37	24%	0.241	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	-126.4	-178.4	-53.7	-29.3	0	0	0	113.9	R347 Y402 R421 T443	R347-D400 IonicContact CZ-OD1 2.74Å; R347-D400 IonicContact NH1-OD1 3.85Å; R347-D400 PolarHBondContact NH1-OD1 3.42Å; D400-Y402 PolarHBondContact O-N 3.31Å; D400-R421 PolarHBondContact O-NH1 2.82Å; D400-R421 PolarHBondContact O-NH2 2.81Å; D400-T443 WeakPolarHBondContact OD2-CB 3.25Å; D400-T443 PolarHBondContact OD2-OG1 3.29Å
401	E	89.9	Confident	88.2	Confident	40 Å²	40	38.4 Å²	38.4	19%	0.187	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-7.6	178.5	-56.4	-159.3	129.8	0	0	113.3	L350 Q399 Y419 K420 N446	L350-E401 HydrophobicContact CD1-CG 4.44Å; Q399-E401 PolarHBondContact O-N 2.77Å; E401-Y419 HydrophobicContact CB-CD2 4.06Å; E401-Y419 HydrophobicContact CB-CE2 3.71Å; E401-Y419 HydrophobicContact CG-CE2 4.5Å; E401-Y419 WeakPolarHBondContact OE2-CE2 3.33Å; E401-Y419 PolarHBondContact OE2-OH 2.81Å; E401-K420 HydrophobicContact CB-CG 4.21Å; E401-K420 WeakPolarHBondContact O-CA 3.44Å; E401-K420 PolarHBondContact O-N 3.01Å; E401-K420 WeakPolarHBondContact OE1-CE 3.33Å; E401-K420 IonicContact OE1-NZ 2.83Å; E401-K420 PolarHBondContact OE1-NZ 2.65Å; E401-K420 IonicContact OE2-NZ 3.98Å; E401-K420 PolarHBondContact OE2-NZ 3.49Å; E401-N446 PolarHBondContact OE2-OD1 3.34Å
402	Y	93.2	Very high	87.5	Confident	1 Å²	1	44.6 Å²	44.6	0%	0.004	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	155.4	-170.6	-53	-85.5	0	0	0	112.7	Q399 D400 F404 V417 S418 Y419 R421 T443 N446 V448 Y468	Q399-Y402 PolarHBondContact N-O 3.49Å; Q399-Y402 CarbonylContact O-C 3.53Å; Q399-Y402 WeakPolarHBondContact O-CA 3.31Å; Q399-Y402 PolarHBondContact O-N 2.9Å; D400-Y402 PolarHBondContact O-N 3.31Å; Y402-F404 HydrophobicContact CD1-CZ 4.45Å; Y402-F404 HydrophobicContact CG-CE2 4.45Å; Y402-F404 HydrophobicContact CG-CZ 4.07Å; Y402-V417 HydrophobicContact CD1-CG2 4.07Å; Y402-S418 CarbonylContact C-O 3.58Å; Y402-S418 WeakPolarHBondContact CA-O 3.49Å; Y402-Y419 AromaticContact CD1-CD2 3.71Å; Y402-Y419 HydrophobicContact CD1-CD2 3.71Å; Y402-Y419 AromaticContact CE1-CD2 3.27Å; Y402-Y419 HydrophobicContact CE1-CD2 3.27Å; Y402-Y419 AromaticContact CE1-CE2 3.77Å; Y402-Y419 HydrophobicContact CE1-CE2 3.77Å; Y402-Y419 HydrophobicContact CE1-CG 4.18Å; Y402-Y419 AromaticContact CZ-CD2 3.77Å; Y402-Y419 AromaticContact CZ-CE2 3.76Å; Y402-R421 PolarHBondContact O-NH1 2.86Å; Y402-R421 VanDerWaalsContact O-NH1 3.14Å; Y402-T443 HydrophobicContact CD2-CG2 3.66Å; Y402-T443 HydrophobicContact CE2-CG2 4.3Å; Y402-T443 HydrophobicContact CG-CG2 4.33Å; Y402-N446 WeakPolarHBondContact OH-CA 3.26Å; Y402-N446 PolarHBondContact OH-O 3.12Å; Y402-V448 HydrophobicContact CD1-CG2 3.94Å; Y402-V448 HydrophobicContact CD2-CG2 4.31Å; Y402-V448 HydrophobicContact CE1-CG2 3.85Å; Y402-V448 HydrophobicContact CE2-CG2 4.22Å; Y402-V448 HydrophobicContact CG-CG2 4.19Å; Y402-Y468 PolarHBondContact OH-O 3.04Å
403	V	94.2	Very high	87.3	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	131.4	163.2	-176	0	0	0	0	108	Y370 L396 V397 V398 V417 S418 F424	Y370-V403 HydrophobicContact CE1-CG1 3.97Å; L396-V403 HydrophobicContact CD1-CG1 3.83Å; V397-V403 CarbonylContact O-C 3.49Å; V397-V403 WeakPolarHBondContact O-CA 3.26Å; V398-V403 HydrophobicContact CG1-CG2 4.29Å; V398-V403 HydrophobicContact CG2-CG1 3.95Å; V398-V403 HydrophobicContact CG2-CG2 4.19Å; V403-V417 CarbonylContact O-C 3.54Å; V403-V417 VanDerWaalsContact O-CA 3.32Å; V403-V417 WeakPolarHBondContact O-CA 3.48Å; V403-S418 PolarHBondContact N-O 3.22Å; V403-S418 PolarHBondContact O-N 2.84Å; V403-F424 HydrophobicContact CB-CE1 4.18Å; V403-F424 HydrophobicContact CB-CZ 4.02Å; V403-F424 HydrophobicContact CG1-CE1 4.05Å; V403-F424 HydrophobicContact CG1-CZ 3.75Å
404	F	94.6	Very high	87.2	Confident	10 Å²	10	43.6 Å²	43.6	4%	0.044	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	144.1	177.1	-49.2	-89.1	0	0	0	110.6	V397 Y402 Y416 V417 M427 I440 T443 V448	V397-F404 HydrophobicContact CB-CB 4.3Å; V397-F404 HydrophobicContact CB-CD2 4.16Å; V397-F404 HydrophobicContact CG1-CD2 4.14Å; V397-F404 PolarHBondContact N-O 3.4Å; V397-F404 PolarHBondContact O-N 2.8Å; Y402-F404 HydrophobicContact CD1-CZ 4.45Å; Y402-F404 HydrophobicContact CG-CE2 4.45Å; Y402-F404 HydrophobicContact CG-CZ 4.07Å; F404-Y416 WeakPolarHBondContact CA-O 3.34Å; F404-V417 HydrophobicContact CD1-CB 3.95Å; F404-V417 HydrophobicContact CD1-CG2 3.8Å; F404-V417 HydrophobicContact CE1-CB 4.04Å; F404-V417 HydrophobicContact CE1-CG2 3.5Å; F404-V417 HydrophobicContact CZ-CG2 4.23Å; F404-M427 HydrophobicContact CD1-CE 4.38Å; F404-M427 HydrophobicContact CD1-SD 4Å; F404-I440 HydrophobicContact CD1-CD1 4.06Å; F404-I440 HydrophobicContact CD1-CG1 4.39Å; F404-I440 HydrophobicContact CD2-CD1 4.44Å; F404-I440 HydrophobicContact CD2-CG1 3.94Å; F404-I440 HydrophobicContact CE1-CD1 3.99Å; F404-I440 HydrophobicContact CE2-CD1 4.38Å; F404-I440 HydrophobicContact CE2-CG1 4.07Å; F404-I440 HydrophobicContact CE2-CG2 4.08Å; F404-I440 HydrophobicContact CG-CD1 4.28Å; F404-I440 HydrophobicContact CG-CG1 4.11Å; F404-I440 HydrophobicContact CZ-CD1 4.16Å; F404-I440 HydrophobicContact CZ-CG1 4.35Å; F404-I440 HydrophobicContact CZ-CG2 4.36Å; F404-T443 HydrophobicContact CE2-CG2 4.02Å; F404-T443 HydrophobicContact CZ-CG2 4.17Å; F404-V448 HydrophobicContact CE1-CG1 3.97Å; F404-V448 HydrophobicContact CE1-CG2 4.18Å; F404-V448 HydrophobicContact CZ-CB 4.37Å; F404-V448 HydrophobicContact CZ-CG1 3.63Å; F404-V448 HydrophobicContact CZ-CG2 3.75Å
405	I	93.3	Very high	87.3	Confident	3 Å²	3	40 Å²	40	2%	0.015	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	153.8	174.2	60.1	-179.2	0	0	0	110.2	Y370 F387 I391 L396 V407 Y416 F424	Y370-I405 HydrophobicContact CD1-CG2 4.34Å; F387-I405 HydrophobicContact CB-CD1 3.83Å; F387-I405 HydrophobicContact CD1-CD1 3.92Å; F387-I405 HydrophobicContact CD2-CD1 3.56Å; F387-I405 HydrophobicContact CE1-CD1 4.39Å; F387-I405 HydrophobicContact CE2-CD1 4.07Å; F387-I405 HydrophobicContact CG-CD1 3.48Å; F387-I405 VanDerWaalsContact CG-CD1 3.48Å; F387-I405 HydrophobicContact CZ-CD1 4.47Å; I391-I405 HydrophobicContact CD1-CG2 4.21Å; I391-I405 HydrophobicContact CG2-CB 4.03Å; I391-I405 HydrophobicContact CG2-CD1 3.98Å; I391-I405 HydrophobicContact CG2-CG1 4.43Å; I391-I405 HydrophobicContact CG2-CG2 4.32Å; L396-I405 HydrophobicContact CD1-CG2 3.82Å; I405-V407 HydrophobicContact CD1-CG2 4.39Å; I405-V407 HydrophobicContact CG1-CG2 4.49Å; I405-Y416 PolarHBondContact N-O 2.85Å; I405-Y416 PolarHBondContact O-N 3.13Å; I405-F424 HydrophobicContact CD1-CD1 3.71Å; I405-F424 HydrophobicContact CD1-CD2 4.42Å; I405-F424 HydrophobicContact CD1-CE1 3.73Å; I405-F424 HydrophobicContact CD1-CE2 4.44Å; I405-F424 HydrophobicContact CD1-CG 4.06Å; I405-F424 HydrophobicContact CD1-CZ 4.11Å; I405-F424 HydrophobicContact CG1-CD1 3.9Å; I405-F424 HydrophobicContact CG1-CE1 3.82Å; I405-F424 HydrophobicContact CG2-CE1 4.28Å; I405-F424 HydrophobicContact CG2-CZ 4.48Å
406	Q	91	Very high	87.4	Confident	40 Å²	40	40.7 Å²	40.7	19%	0.187	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	139.8	169.4	-66.6	170.6	-9.8	0	0	111	I391 I392 S395 H415	I391-Q406 CarbonylContact C-O 3.58Å; I391-Q406 WeakPolarHBondContact CA-O 3.49Å; I391-Q406 WeakPolarHBondContact CB-O 3.24Å; I392-Q406 HydrophobicContact CB-CB 4.02Å; I392-Q406 HydrophobicContact CD1-CB 4.03Å; I392-Q406 HydrophobicContact CG1-CB 4.14Å; I392-Q406 PolarHBondContact N-O 3.08Å; S395-Q406 PolarHBondContact OG-N 2.72Å; Q406-H415 WeakPolarHBondContact CG-NE2 3.17Å; Q406-H415 PolarHBondContact NE2-NE2 3.38Å
407	V	88.4	Confident	87.4	Confident	17 Å²	17	40.8 Å²	40.8	10%	0.103	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	129.9	-179.8	-175.6	0	0	0	0	109.1	F387 I391 I405 V409 V414 Y416	F387-V407 HydrophobicContact CE1-CG1 4.48Å; F387-V407 HydrophobicContact CE1-CG2 3.78Å; F387-V407 HydrophobicContact CE2-CG2 4.35Å; F387-V407 HydrophobicContact CZ-CG1 4.3Å; F387-V407 HydrophobicContact CZ-CG2 3.58Å; I391-V407 HydrophobicContact CG2-CG2 4.49Å; I405-V407 HydrophobicContact CD1-CG2 4.39Å; I405-V407 HydrophobicContact CG1-CG2 4.49Å; V407-V409 HydrophobicContact CG1-CG2 4.23Å; V407-V409 PolarHBondContact O-N 2.62Å; V407-V414 PolarHBondContact N-O 3.39Å; V407-V414 PolarHBondContact O-N 2.87Å; V407-Y416 HydrophobicContact CB-CD2 4.13Å; V407-Y416 HydrophobicContact CB-CE2 3.88Å; V407-Y416 HydrophobicContact CG2-CD2 3.72Å; V407-Y416 HydrophobicContact CG2-CE2 3.86Å
408	S	83	Confident	87.3	Confident	74 Å²	74	39.4 Å²	39.4	52%	0.517	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	115.5	175.6	-168.3	0	0	0	0	110.6	Q412	S408-Q412 CarbonylContact C-O 3.57Å; S408-Q412 WeakPolarHBondContact CA-O 3.4Å
409	V	78.5	Confident	87.2	Confident	52 Å²	52	40.2 Å²	40.2	32%	0.315	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	116.9	177.5	-175.4	0	0	0	0	108.1	V407 G411 Q412 V414	V407-V409 HydrophobicContact CG1-CG2 4.23Å; V407-V409 PolarHBondContact O-N 2.62Å; V409-G411 PolarHBondContact O-N 2.88Å; V409-Q412 PolarHBondContact N-O 3.27Å; V409-Q412 PolarHBondContact O-N 2.66Å; V409-V414 HydrophobicContact CB-CG2 3.88Å; V409-V414 HydrophobicContact CG2-CB 4.18Å; V409-V414 HydrophobicContact CG2-CG2 3.8Å
410	S	73.4	Confident	87.1	Confident	131 Å²	131	41.7 Å²	41.7	92%	0.916	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	25.3	-177.7	-57.4	0	0	0	0	115
411	G	73.1	Confident	87.1	Confident	70 Å²	70	41.9 Å²	41.9	72%	0.722	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.7	-2.6	-177	0	0	0	0	0	115.4	V409	V409-G411 PolarHBondContact O-N 2.88Å
412	Q	76.8	Confident	86.8	Confident	136 Å²	136	46.1 Å²	46.1	64%	0.636	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	146.7	172.6	-66.7	-177.7	-33.8	0	0	110.9	S408 V409	S408-Q412 CarbonylContact C-O 3.57Å; S408-Q412 WeakPolarHBondContact CA-O 3.4Å; V409-Q412 PolarHBondContact N-O 3.27Å; V409-Q412 PolarHBondContact O-N 2.66Å
413	A	83.4	Confident	86.2	Confident	49 Å²	49	48.8 Å²	48.8	41%	0.405	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	112.3	175.1	0	0	0	0	0	110.6	I392	I392-A413 HydrophobicContact CD1-CB 3.69Å
414	V	86.8	Confident	85.9	Confident	43 Å²	43	50.2 Å²	50.2	26%	0.261	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	126.8	174.7	-177.2	0	0	0	0	108.8	V407 V409 Y416 P426	V407-V414 PolarHBondContact N-O 3.39Å; V407-V414 PolarHBondContact O-N 2.87Å; V409-V414 HydrophobicContact CB-CG2 3.88Å; V409-V414 HydrophobicContact CG2-CB 4.18Å; V409-V414 HydrophobicContact CG2-CG2 3.8Å; V414-Y416 HydrophobicContact CB-CE2 3.95Å; V414-Y416 HydrophobicContact CG1-CD2 4.08Å; V414-Y416 HydrophobicContact CG1-CE2 3.53Å; V414-P426 HydrophobicContact CG1-CB 4.13Å
415	H	90.4	Very high	85.3	Confident	20 Å²	20	54.4 Å²	54.4	9%	0.093	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	133.6	-179.8	-65.5	74.6	0	0	0	110.2	Q406 P426 M427	Q406-H415 WeakPolarHBondContact CG-NE2 3.17Å; Q406-H415 PolarHBondContact NE2-NE2 3.38Å; H415-P426 WeakPolarHBondContact O-CA 3.28Å; H415-M427 HydrophobicContact CB-CB 4.39Å; H415-M427 HydrophobicContact CB-CG 4.44Å; H415-M427 HydrophobicContact CB-SD 3.58Å; H415-M427 VanDerWaalsContact CB-SD 3.58Å; H415-M427 PolarHBondContact O-N 3.03Å
416	Y	91.2	Very high	85.1	Confident	24 Å²	24	55.6 Å²	55.6	9%	0.094	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	145	177.9	-73.1	-107.8	0	0	0	110.8	F404 I405 V407 V414 F424 Y425 P426	F404-Y416 WeakPolarHBondContact CA-O 3.34Å; I405-Y416 PolarHBondContact N-O 2.85Å; I405-Y416 PolarHBondContact O-N 3.13Å; V407-Y416 HydrophobicContact CB-CD2 4.13Å; V407-Y416 HydrophobicContact CB-CE2 3.88Å; V407-Y416 HydrophobicContact CG2-CD2 3.72Å; V407-Y416 HydrophobicContact CG2-CE2 3.86Å; V414-Y416 HydrophobicContact CB-CE2 3.95Å; V414-Y416 HydrophobicContact CG1-CD2 4.08Å; V414-Y416 HydrophobicContact CG1-CE2 3.53Å; Y416-F424 HydrophobicContact CD1-CB 4.22Å; Y416-Y425 CarbonylContact C-O 3.6Å; Y416-Y425 VanDerWaalsContact CA-O 3.29Å; Y416-Y425 WeakPolarHBondContact CA-O 3.33Å; Y416-Y425 VanDerWaalsContact CD1-C 3.47Å; Y416-P426 HydrophobicContact CD1-CB 4.23Å; Y416-P426 HydrophobicContact CE1-CB 4Å; Y416-P426 HydrophobicContact CE1-CG 4.33Å
417	V	93.7	Very high	85	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.006	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	145.8	173.9	64.6	0	0	0	0	110.6	Y402 V403 F404 F424 Y425 M427 G470 L471	Y402-V417 HydrophobicContact CD1-CG2 4.07Å; V403-V417 CarbonylContact O-C 3.54Å; V403-V417 VanDerWaalsContact O-CA 3.32Å; V403-V417 WeakPolarHBondContact O-CA 3.48Å; F404-V417 HydrophobicContact CD1-CB 3.95Å; F404-V417 HydrophobicContact CD1-CG2 3.8Å; F404-V417 HydrophobicContact CE1-CB 4.04Å; F404-V417 HydrophobicContact CE1-CG2 3.5Å; F404-V417 HydrophobicContact CZ-CG2 4.23Å; V417-F424 WeakPolarHBondContact O-CA 3.37Å; V417-Y425 PolarHBondContact N-O 3.01Å; V417-Y425 PolarHBondContact O-N 2.91Å; V417-M427 HydrophobicContact CB-CG 4.02Å; V417-M427 HydrophobicContact CB-SD 4.39Å; V417-M427 HydrophobicContact CG1-CG 3.95Å; V417-G470 WeakPolarHBondContact CG1-O 3.38Å; V417-L471 HydrophobicContact CG1-CD2 3.43Å; V417-L471 VanDerWaalsContact CG1-CD2 3.43Å; V417-L471 HydrophobicContact CG1-CG 4.26Å
418	S	90.7	Very high	85	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.021	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	113.5	165.9	167.8	0	0	0	0	108.6	Y402 V403 R421 Q422	Y402-S418 CarbonylContact C-O 3.58Å; Y402-S418 WeakPolarHBondContact CA-O 3.49Å; V403-S418 PolarHBondContact N-O 3.22Å; V403-S418 PolarHBondContact O-N 2.84Å; S418-R421 WeakPolarHBondContact OG-CA 3.35Å; S418-Q422 PolarHBondContact OG-N 3.47Å; S418-Q422 PolarHBondContact OG-O 3.48Å
419	Y	89.4	Confident	85.4	Confident	32 Å²	32	54.2 Å²	54.2	13%	0.125	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	137.5	173.9	-178.9	-124.5	0	0	0	110.6	E401 Y402 R421 Q422 Y468 R469	E401-Y419 HydrophobicContact CB-CD2 4.06Å; E401-Y419 HydrophobicContact CB-CE2 3.71Å; E401-Y419 HydrophobicContact CG-CE2 4.5Å; E401-Y419 WeakPolarHBondContact OE2-CE2 3.33Å; E401-Y419 PolarHBondContact OE2-OH 2.81Å; Y402-Y419 AromaticContact CD1-CD2 3.71Å; Y402-Y419 HydrophobicContact CD1-CD2 3.71Å; Y402-Y419 AromaticContact CE1-CD2 3.27Å; Y402-Y419 HydrophobicContact CE1-CD2 3.27Å; Y402-Y419 AromaticContact CE1-CE2 3.77Å; Y402-Y419 HydrophobicContact CE1-CE2 3.77Å; Y402-Y419 HydrophobicContact CE1-CG 4.18Å; Y402-Y419 AromaticContact CZ-CD2 3.77Å; Y402-Y419 AromaticContact CZ-CE2 3.76Å; Y419-R421 PolarHBondContact O-N 2.83Å; Y419-R421 VanDerWaalsContact O-N 3.08Å; Y419-Q422 VanDerWaalsContact O-CB 3.31Å; Y419-Q422 WeakPolarHBondContact O-CB 3.17Å; Y419-Q422 WeakPolarHBondContact O-CG 3.47Å; Y419-Q422 PolarHBondContact O-N 3.43Å; Y419-Y468 HydrophobicContact CE1-CD2 4Å; Y419-Y468 HydrophobicContact CE1-CE2 4.18Å; Y419-R469 HydrophobicContact CD1-CB 4.45Å; Y419-R469 HydrophobicContact CD1-CG 4.17Å
420	K	88.3	Confident	85.9	Confident	84 Å²	84	52.7 Å²	52.7	37%	0.365	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.1	38.3	-176.7	-68.8	-176.4	144.2	79.1	0	113.6	L350 E401 Q422	L350-K420 HydrophobicContact CD1-CB 4.12Å; L350-K420 HydrophobicContact CD1-CG 3.94Å; E401-K420 HydrophobicContact CB-CG 4.21Å; E401-K420 WeakPolarHBondContact O-CA 3.44Å; E401-K420 PolarHBondContact O-N 3.01Å; E401-K420 WeakPolarHBondContact OE1-CE 3.33Å; E401-K420 IonicContact OE1-NZ 2.83Å; E401-K420 PolarHBondContact OE1-NZ 2.65Å; E401-K420 IonicContact OE2-NZ 3.98Å; E401-K420 PolarHBondContact OE2-NZ 3.49Å; K420-Q422 PolarHBondContact O-N 3.18Å
421	R	86.7	Confident	86.3	Confident	49 Å²	49	52.7 Å²	52.7	19%	0.185	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	27.1	-179.4	-44.5	-60.5	-164.5	-114.7	-9.2	114.5	L350 D351 D400 Y402 S418 Y419	L350-R421 HydrophobicContact CD2-CG 4.17Å; L350-R421 HydrophobicContact CG-CG 4.25Å; D351-R421 WeakPolarHBondContact OD1-CD 3.48Å; D351-R421 WeakPolarHBondContact OD1-CG 3.22Å; D351-R421 IonicContact OD1-CZ 3.69Å; D351-R421 IonicContact OD1-NE 3.43Å; D351-R421 PolarHBondContact OD1-NE 2.82Å; D351-R421 IonicContact OD1-NH2 3.41Å; D351-R421 IonicContact OD2-CZ 2.73Å; D351-R421 IonicContact OD2-NE 3.29Å; D351-R421 PolarHBondContact OD2-NE 3.33Å; D351-R421 IonicContact OD2-NH2 2.75Å; D351-R421 PolarHBondContact OD2-NH2 3.45Å; D400-R421 PolarHBondContact O-NH1 2.82Å; D400-R421 PolarHBondContact O-NH2 2.81Å; Y402-R421 PolarHBondContact O-NH1 2.86Å; Y402-R421 VanDerWaalsContact O-NH1 3.14Å; S418-R421 WeakPolarHBondContact OG-CA 3.35Å; Y419-R421 PolarHBondContact O-N 2.83Å; Y419-R421 VanDerWaalsContact O-N 3.08Å
422	Q	83.1	Confident	86.8	Confident	128 Å²	128	55.6 Å²	55.6	60%	0.598	27%	0.269	S	S	*	.			trans	-80.5	-165.8	174.9	-60.3	-175.5	3.6	0	0	111.1	S418 Y419 K420	S418-Q422 PolarHBondContact OG-N 3.47Å; S418-Q422 PolarHBondContact OG-O 3.48Å; Y419-Q422 VanDerWaalsContact O-CB 3.31Å; Y419-Q422 WeakPolarHBondContact O-CB 3.17Å; Y419-Q422 WeakPolarHBondContact O-CG 3.47Å; Y419-Q422 PolarHBondContact O-N 3.43Å; K420-Q422 PolarHBondContact O-N 3.18Å
423	A	80.9	Confident	87.2	Confident	58 Å²	58	50.1 Å²	50.1	48%	0.479	25%	0.245	S	C	.	.			trans	-57	152.6	175.2	0	0	0	0	0	112.1	Y425	A423-Y425 HydrophobicContact CB-CE2 3.88Å; A423-Y425 VanDerWaalsContact O-CD2 3.27Å; A423-Y425 WeakPolarHBondContact O-CD2 3.31Å
424	F	86.2	Confident	87.2	Confident	30 Å²	30	52.2 Å²	52.2	13%	0.132	25%	0.249	C	C	.	.			trans	-83.2	129.7	174	-81.4	-86.3	0	0	0	110.7	Y370 P386 F387 V403 I405 Y416 V417	Y370-F424 HydrophobicContact CD1-CE2 4.22Å; Y370-F424 HydrophobicContact CD1-CZ 4.02Å; Y370-F424 AromaticContact CE1-CE2 3.93Å; Y370-F424 HydrophobicContact CE1-CE2 3.93Å; Y370-F424 AromaticContact CE1-CZ 3.7Å; Y370-F424 HydrophobicContact CE1-CZ 3.7Å; P386-F424 HydrophobicContact CB-CE2 4.28Å; F387-F424 HydrophobicContact CB-CD2 4.19Å; F387-F424 HydrophobicContact CB-CE2 4.21Å; F387-F424 HydrophobicContact CD2-CB 4.16Å; F387-F424 HydrophobicContact CD2-CD2 4.13Å; F387-F424 HydrophobicContact CD2-CG 4.19Å; V403-F424 HydrophobicContact CB-CE1 4.18Å; V403-F424 HydrophobicContact CB-CZ 4.02Å; V403-F424 HydrophobicContact CG1-CE1 4.05Å; V403-F424 HydrophobicContact CG1-CZ 3.75Å; I405-F424 HydrophobicContact CD1-CD1 3.71Å; I405-F424 HydrophobicContact CD1-CD2 4.42Å; I405-F424 HydrophobicContact CD1-CE1 3.73Å; I405-F424 HydrophobicContact CD1-CE2 4.44Å; I405-F424 HydrophobicContact CD1-CG 4.06Å; I405-F424 HydrophobicContact CD1-CZ 4.11Å; I405-F424 HydrophobicContact CG1-CD1 3.9Å; I405-F424 HydrophobicContact CG1-CE1 3.82Å; I405-F424 HydrophobicContact CG2-CE1 4.28Å; I405-F424 HydrophobicContact CG2-CZ 4.48Å; Y416-F424 HydrophobicContact CD1-CB 4.22Å; V417-F424 WeakPolarHBondContact O-CA 3.37Å
425	Y	84.1	Confident	87.1	Confident	99 Å²	99	52.1 Å²	52.1	39%	0.388	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	144.2	177.3	-67.2	-93.3	0	0	0	110.2	Y416 V417 A423 M427 L471	Y416-Y425 CarbonylContact C-O 3.6Å; Y416-Y425 VanDerWaalsContact CA-O 3.29Å; Y416-Y425 WeakPolarHBondContact CA-O 3.33Å; Y416-Y425 VanDerWaalsContact CD1-C 3.47Å; V417-Y425 PolarHBondContact N-O 3.01Å; V417-Y425 PolarHBondContact O-N 2.91Å; A423-Y425 HydrophobicContact CB-CE2 3.88Å; A423-Y425 VanDerWaalsContact O-CD2 3.27Å; A423-Y425 WeakPolarHBondContact O-CD2 3.31Å; Y425-M427 PolarHBondContact O-N 2.95Å; Y425-L471 HydrophobicContact CG-CD2 4.38Å
426	P	87.3	Confident	86.9	Confident	28 Å²	28	56.7 Å²	56.7	18%	0.182	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	131	178.6	29.1	-33.8	0	0	0	110.7	V414 H415 Y416 K428	V414-P426 HydrophobicContact CG1-CB 4.13Å; H415-P426 WeakPolarHBondContact O-CA 3.28Å; Y416-P426 HydrophobicContact CD1-CB 4.23Å; Y416-P426 HydrophobicContact CE1-CB 4Å; Y416-P426 HydrophobicContact CE1-CG 4.33Å; P426-K428 PolarHBondContact O-N 2.86Å
427	M	89.8	Confident	86.6	Confident	19 Å²	19	58.7 Å²	58.7	9%	0.094	28%	0.281	C	S	.	.			trans	-63.4	132.1	179.1	-68.2	161.8	67.6	0	0	110.3	F404 H415 V417 Y425 L429 L438 I440 F473	F404-M427 HydrophobicContact CD1-CE 4.38Å; F404-M427 HydrophobicContact CD1-SD 4Å; H415-M427 HydrophobicContact CB-CB 4.39Å; H415-M427 HydrophobicContact CB-CG 4.44Å; H415-M427 HydrophobicContact CB-SD 3.58Å; H415-M427 VanDerWaalsContact CB-SD 3.58Å; H415-M427 PolarHBondContact O-N 3.03Å; V417-M427 HydrophobicContact CB-CG 4.02Å; V417-M427 HydrophobicContact CB-SD 4.39Å; V417-M427 HydrophobicContact CG1-CG 3.95Å; Y425-M427 PolarHBondContact O-N 2.95Å; M427-L429 PolarHBondContact O-N 2.93Å; M427-L438 HydrophobicContact CE-CD1 4.23Å; M427-L438 HydrophobicContact CE-CD2 4.32Å; M427-I440 HydrophobicContact CE-CD1 4.43Å; M427-F473 HydrophobicContact CB-CE2 4.14Å; M427-F473 HydrophobicContact CE-CD2 4.41Å; M427-F473 HydrophobicContact CE-CE2 3.44Å; M427-F473 VanDerWaalsContact CE-CE2 3.44Å; M427-F473 HydrophobicContact CE-CZ 3.53Å; M427-F473 HydrophobicContact CG-CE2 4.14Å
428	K	88.8	Confident	86.4	Confident	58 Å²	58	59.4 Å²	59.4	25%	0.252	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-96	89.8	-177.5	-55.4	-59.3	-176.8	173.8	0	109.2	P426 L471 F472 F473 Y758 E850	P426-K428 PolarHBondContact O-N 2.86Å; K428-L471 WeakPolarHBondContact CA-O 3.34Å; K428-L471 WeakPolarHBondContact CB-O 3.49Å; K428-L471 PolarHBondContact N-O 3.18Å; K428-F472 HydrophobicContact CB-CD1 3.83Å; K428-F472 HydrophobicContact CB-CE1 4.09Å; K428-F472 HydrophobicContact CG-CD1 4.06Å; K428-F472 HydrophobicContact CG-CE1 3.83Å; K428-F472 HydrophobicContact CG-CZ 4.42Å; K428-F473 PolarHBondContact O-N 2.59Å; K428-F473 VanDerWaalsContact O-N 3.09Å; K428-Y758 HydrophobicContact CB-CE2 4.04Å; K428-Y758 WeakPolarHBondContact O-CE2 3.12Å; K428-E850 IonicContact NZ-OE1 2.84Å; K428-E850 PolarHBondContact NZ-OE1 3.38Å
429	L	90.7	Very high	86.3	Confident	25 Å²	25	61.8 Å²	61.8	13%	0.131	30%	0.296	C	S	.	.			trans	-83.4	161.2	168.6	-54.9	-178.5	0	0	0	110.4	M427 K431 P435 L438 I452 F473 Y758	M427-L429 PolarHBondContact O-N 2.93Å; L429-K431 PolarHBondContact O-N 3.05Å; L429-P435 HydrophobicContact CD1-CG 3.96Å; L429-L438 HydrophobicContact CD1-CD1 4.15Å; L429-I452 HydrophobicContact CD1-CD1 3.89Å; L429-I452 HydrophobicContact CD2-CD1 3.51Å; L429-I452 HydrophobicContact CG-CD1 4.3Å; L429-F473 HydrophobicContact CD2-CB 3.95Å; L429-F473 HydrophobicContact CD2-CD2 3.89Å; L429-F473 HydrophobicContact CD2-CG 3.96Å; L429-Y758 PolarHBondContact O-OH 3.44Å
430	P	88.9	Confident	86.4	Confident	20 Å²	20	61.7 Å²	61.7	13%	0.13	30%	0.297	C	S	.	.			trans	-54.7	137	171.5	-23.9	34	0	0	0	111.7	Y432 T433 Y464 W773	P430-Y432 PolarHBondContact O-N 3.27Å; P430-T433 WeakPolarHBondContact O-CB 3.49Å; P430-T433 PolarHBondContact O-N 2.84Å; P430-Y464 HydrophobicContact CG-CE1 3.75Å; P430-W773 HydrophobicContact CB-CH2 4.11Å; P430-W773 HydrophobicContact CB-CZ2 3.65Å; P430-W773 HydrophobicContact CG-CZ2 4.44Å
431	K	82.9	Confident	86.4	Confident	131 Å²	131	60.2 Å²	60.2	57%	0.57	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-25	-164.2	-177.3	178.1	177.8	-173.8	0	116	L429 W773	L429-K431 PolarHBondContact O-N 3.05Å; K431-W773 HydrophobicContact CB-CB 4.39Å; K431-W773 HydrophobicContact CB-CD2 3.91Å; K431-W773 HydrophobicContact CB-CE3 3.42Å; K431-W773 VanDerWaalsContact CB-CE3 3.42Å; K431-W773 HydrophobicContact CB-CG 4.33Å; K431-W773 HydrophobicContact CB-CZ3 4Å; K431-W773 HydrophobicContact CD-CB 4.47Å
432	Y	83.2	Confident	86.5	Confident	131 Å²	131	58.8 Å²	58.8	51%	0.514	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	0.7	-178.7	-63.1	-58.8	0	0	0	114.2	P430 L434 F772 W773	P430-Y432 PolarHBondContact O-N 3.27Å; Y432-L434 PolarHBondContact O-N 3.03Å; Y432-F772 HydrophobicContact CD2-CE1 4.45Å; Y432-F772 HydrophobicContact CD2-CE2 4.13Å; Y432-F772 AromaticContact CD2-CZ 3.61Å; Y432-F772 HydrophobicContact CD2-CZ 3.61Å; Y432-F772 AromaticContact CE2-CE2 3.6Å; Y432-F772 HydrophobicContact CE2-CE2 3.6Å; Y432-F772 AromaticContact CE2-CZ 3.6Å; Y432-F772 HydrophobicContact CE2-CZ 3.6Å; Y432-W773 HydrophobicContact CD2-CB 3.83Å; Y432-W773 HydrophobicContact CD2-CG 4.28Å; Y432-W773 HydrophobicContact CE2-CB 3.54Å; Y432-W773 HydrophobicContact CE2-CG 4.45Å
433	T	84.6	Confident	86.8	Confident	21 Å²	21	52.9 Å²	52.9	13%	0.129	26%	0.263	C	S	.	.			trans	-71.7	115	164.5	-58.8	0	0	0	0	107.6	P430 P435 I452 D454 Y464	P430-T433 WeakPolarHBondContact O-CB 3.49Å; P430-T433 PolarHBondContact O-N 2.84Å; T433-P435 WeakPolarHBondContact O-CD 3.47Å; T433-I452 HydrophobicContact CG2-CG2 3.89Å; T433-D454 WeakPolarHBondContact CA-OD1 3.35Å; T433-Y464 PolarHBondContact OG1-OH 3Å
434	L	83.3	Confident	86.9	Confident	93 Å²	93	53.6 Å²	53.6	49%	0.487	26%	0.259	S	S	.	.			trans	-108.5	91.6	178.2	-66.5	177.1	0	0	0	107.4	Y432 K436 D454 W455	Y432-L434 PolarHBondContact O-N 3.03Å; L434-K436 PolarHBondContact O-N 3.03Å; L434-K436 VanDerWaalsContact O-N 3.09Å; L434-D454 PolarHBondContact N-OD1 2.96Å; L434-W455 HydrophobicContact CB-CB 4.17Å; L434-W455 HydrophobicContact CB-CG 4.35Å; L434-W455 PolarHBondContact O-N 3.19Å; L434-W455 VanDerWaalsContact O-N 3.13Å
435	P	85.5	Confident	86.5	Confident	40 Å²	40	54.1 Å²	54.1	26%	0.26	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	116.9	-175.5	25.2	-34.7	0	0	0	110.2	L429 T433 I452	L429-P435 HydrophobicContact CD1-CG 3.96Å; T433-P435 WeakPolarHBondContact O-CD 3.47Å; P435-I452 HydrophobicContact CB-CG2 3.82Å
436	K	85.4	Confident	86.4	Confident	117 Å²	117	53.2 Å²	53.2	51%	0.509	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-38.3	165.4	175	-176.9	162.3	-154.3	0	109.8	L434 Q453	L434-K436 PolarHBondContact O-N 3.03Å; L434-K436 VanDerWaalsContact O-N 3.09Å; K436-Q453 HydrophobicContact CD-CG 4.35Å; K436-Q453 VanDerWaalsContact CE-OE1 3.27Å; K436-Q453 PolarHBondContact N-O 3.14Å
437	D	86.2	Confident	86.4	Confident	65 Å²	65	52 Å²	52	35%	0.348	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	158.7	166.8	-168.2	24.6	0	0	0	110.8	Q453	D437-Q453 PolarHBondContact O-N 3.47Å; D437-Q453 VanDerWaalsContact O-N 3.08Å
438	L	89.2	Confident	86.5	Confident	16 Å²	16	51 Å²	51	8%	0.084	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	121.8	178.3	-178.8	157.9	0	0	0	110.4	M427 L429 I440 A451 I452	M427-L438 HydrophobicContact CE-CD1 4.23Å; M427-L438 HydrophobicContact CE-CD2 4.32Å; L429-L438 HydrophobicContact CD1-CD1 4.15Å; L438-I440 HydrophobicContact CD2-CD1 3.83Å; L438-A451 WeakPolarHBondContact CA-O 3.41Å; L438-I452 HydrophobicContact CB-CG1 4.34Å; L438-I452 HydrophobicContact CD1-CD1 3.75Å; L438-I452 HydrophobicContact CD1-CG1 3.85Å; L438-I452 HydrophobicContact CG-CD1 4.32Å; L438-I452 HydrophobicContact CG-CG1 3.86Å
439	Q	88.8	Confident	86.7	Confident	54 Å²	54	48.7 Å²	48.7	25%	0.252	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	136.4	179.9	-167.7	-179.6	19.7	0	0	110.3	I441 A450 A451 V490	Q439-I441 HydrophobicContact CB-CD1 4.18Å; Q439-I441 HydrophobicContact CG-CD1 3.89Å; Q439-A450 CarbonylContact O-C 3.6Å; Q439-A450 VanDerWaalsContact O-CA 3.25Å; Q439-A450 WeakPolarHBondContact O-CA 3.23Å; Q439-A451 PolarHBondContact N-O 2.79Å; Q439-A451 PolarHBondContact O-N 2.86Å; Q439-V490 PolarHBondContact NE2-O 2.03Å; Q439-V490 PolarHBondContact OE1-O 2.92Å
440	I	91.3	Very high	86.8	Confident	29 Å²	29	47.5 Å²	47.5	15%	0.149	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	128.1	169.6	-52.3	-57.4	0	0	0	108	F404 M427 L438 T443 V448 A450	F404-I440 HydrophobicContact CD1-CD1 4.06Å; F404-I440 HydrophobicContact CD1-CG1 4.39Å; F404-I440 HydrophobicContact CD2-CD1 4.44Å; F404-I440 HydrophobicContact CD2-CG1 3.94Å; F404-I440 HydrophobicContact CE1-CD1 3.99Å; F404-I440 HydrophobicContact CE2-CD1 4.38Å; F404-I440 HydrophobicContact CE2-CG1 4.07Å; F404-I440 HydrophobicContact CE2-CG2 4.08Å; F404-I440 HydrophobicContact CG-CD1 4.28Å; F404-I440 HydrophobicContact CG-CG1 4.11Å; F404-I440 HydrophobicContact CZ-CD1 4.16Å; F404-I440 HydrophobicContact CZ-CG1 4.35Å; F404-I440 HydrophobicContact CZ-CG2 4.36Å; M427-I440 HydrophobicContact CE-CD1 4.43Å; L438-I440 HydrophobicContact CD2-CD1 3.83Å; I440-T443 HydrophobicContact CG2-CG2 4.13Å; I440-V448 HydrophobicContact CD1-CG1 3.95Å; I440-V448 HydrophobicContact CG2-CG1 3.98Å; I440-A450 HydrophobicContact CD1-CB 4.14Å
441	I	88.6	Confident	87	Confident	53 Å²	53	46.5 Å²	46.5	27%	0.272	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-42.1	-173	-52.5	-59.9	0	0	0	111.4	Q439 V449 A451 I492 L494	Q439-I441 HydrophobicContact CB-CD1 4.18Å; Q439-I441 HydrophobicContact CG-CD1 3.89Å; I441-V449 HydrophobicContact CB-CG1 4.33Å; I441-V449 PolarHBondContact N-O 3.4Å; I441-A451 HydrophobicContact CD1-CB 3.88Å; I441-A451 HydrophobicContact CG1-CB 3.91Å; I441-I492 HydrophobicContact CD1-CB 4.3Å; I441-I492 HydrophobicContact CD1-CG1 3.9Å; I441-L494 HydrophobicContact CG2-CD2 4.13Å
442	S	87.8	Confident	87.5	Confident	20 Å²	20	40.3 Å²	40.3	14%	0.14	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	150.5	174.8	158.3	0	0	0	0	110.3	D444 V449	S442-D444 VanDerWaalsContact OG-CB 3.31Å; S442-D444 WeakPolarHBondContact OG-CB 3.48Å; S442-D444 PolarHBondContact OG-N 3.36Å; S442-D444 PolarHBondContact OG-OD2 2.94Å; S442-V449 PolarHBondContact N-O 3.37Å; S442-V449 PolarHBondContact O-N 3.37Å
443	T	89.2	Confident	87.8	Confident	3 Å²	3	34.5 Å²	34.5	2%	0.018	18%	0.179	C	C	.	.			trans	-114.1	17.4	172.2	43.6	0	0	0	0	113.1	Q399 D400 Y402 F404 I440 Q447 V448	Q399-T443 HydrophobicContact CB-CG2 4.19Å; Q399-T443 HydrophobicContact CG-CG2 4.37Å; Q399-T443 WeakPolarHBondContact CG-OG1 3.18Å; Q399-T443 PolarHBondContact NE2-OG1 2.92Å; D400-T443 WeakPolarHBondContact OD2-CB 3.25Å; D400-T443 PolarHBondContact OD2-OG1 3.29Å; Y402-T443 HydrophobicContact CD2-CG2 3.66Å; Y402-T443 HydrophobicContact CE2-CG2 4.3Å; Y402-T443 HydrophobicContact CG-CG2 4.33Å; F404-T443 HydrophobicContact CE2-CG2 4.02Å; F404-T443 HydrophobicContact CZ-CG2 4.17Å; I440-T443 HydrophobicContact CG2-CG2 4.13Å; T443-Q447 CarbonylContact C-O 3.6Å; T443-Q447 WeakPolarHBondContact CA-O 3.47Å; T443-V448 HydrophobicContact CG2-CG2 4.43Å
444	D	83.2	Confident	87.9	Confident	74 Å²	74	34.2 Å²	34.2	40%	0.396	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-68.5	148.3	-169.4	-76.7	-79.3	0	0	0	114.9	S442 N446 Q447	S442-D444 VanDerWaalsContact OG-CB 3.31Å; S442-D444 WeakPolarHBondContact OG-CB 3.48Å; S442-D444 PolarHBondContact OG-N 3.36Å; S442-D444 PolarHBondContact OG-OD2 2.94Å; D444-N446 PolarHBondContact O-N 2.92Å; D444-Q447 PolarHBondContact N-O 2.91Å; D444-Q447 PolarHBondContact O-N 3.22Å; D444-Q447 VanDerWaalsContact O-N 3.15Å
445	E	77.6	Confident	87.9	Confident	41 Å²	41	37.9 Å²	37.9	19%	0.192	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	59.7	22.8	178.4	-42	-165.8	132.3	0	0	115.5	K501 K522 S800	E445-K501 VanDerWaalsContact OE1-CD 3.22Å; E445-K501 WeakPolarHBondContact OE1-CD 3.23Å; E445-K501 WeakPolarHBondContact OE1-CE 3.4Å; E445-K501 IonicContact OE1-NZ 3.82Å; E445-K501 PolarHBondContact OE1-NZ 3.49Å; E445-K522 IonicContact OE2-NZ 3.32Å; E445-K522 PolarHBondContact OE2-NZ 3.41Å; E445-S800 WeakPolarHBondContact CB-OG 3.34Å; E445-S800 VanDerWaalsContact CD-OG 3.23Å; E445-S800 VanDerWaalsContact OE2-CB 3.23Å; E445-S800 WeakPolarHBondContact OE2-CB 3.33Å; E445-S800 PolarHBondContact OE2-OG 2.98Å
446	N	82.4	Confident	87.7	Confident	79 Å²	79	41.3 Å²	41.3	42%	0.422	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	64.6	44.9	-171.9	-34.2	-79.6	0	0	0	112.4	E401 Y402 D444 Y468	E401-N446 PolarHBondContact OE2-OD1 3.34Å; Y402-N446 WeakPolarHBondContact OH-CA 3.26Å; Y402-N446 PolarHBondContact OH-O 3.12Å; D444-N446 PolarHBondContact O-N 2.92Å; N446-Y468 VanDerWaalsContact O-CA 3.29Å; N446-Y468 WeakPolarHBondContact O-CA 3.47Å
447	Q	87.3	Confident	87.4	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.009	17%	0.174	C	C	.	.			trans	-137.2	157.8	164.7	-72.8	-172.9	-85.7	0	0	109.7	T443 D444 M465 S466 K522 L799	T443-Q447 CarbonylContact C-O 3.6Å; T443-Q447 WeakPolarHBondContact CA-O 3.47Å; D444-Q447 PolarHBondContact N-O 2.91Å; D444-Q447 PolarHBondContact O-N 3.22Å; D444-Q447 VanDerWaalsContact O-N 3.15Å; Q447-M465 VanDerWaalsContact NE2-CG 3.29Å; Q447-M465 PolarHBondContact NE2-SD 2.98Å; Q447-S466 PolarHBondContact NE2-O 3.17Å; Q447-K522 VanDerWaalsContact OE1-CE 3.27Å; Q447-L799 HydrophobicContact CG-CB 3.95Å; Q447-L799 HydrophobicContact CG-CD1 3.53Å; Q447-L799 HydrophobicContact CG-CG 4.37Å
448	V	92.5	Very high	86.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.19	C	C	.	.			trans	-109.6	122.4	174.4	-170.5	0	0	0	0	108.6	Y402 F404 I440 T443 M465 S466 F473	Y402-V448 HydrophobicContact CD1-CG2 3.94Å; Y402-V448 HydrophobicContact CD2-CG2 4.31Å; Y402-V448 HydrophobicContact CE1-CG2 3.85Å; Y402-V448 HydrophobicContact CE2-CG2 4.22Å; Y402-V448 HydrophobicContact CG-CG2 4.19Å; F404-V448 HydrophobicContact CE1-CG1 3.97Å; F404-V448 HydrophobicContact CE1-CG2 4.18Å; F404-V448 HydrophobicContact CZ-CB 4.37Å; F404-V448 HydrophobicContact CZ-CG1 3.63Å; F404-V448 HydrophobicContact CZ-CG2 3.75Å; I440-V448 HydrophobicContact CD1-CG1 3.95Å; I440-V448 HydrophobicContact CG2-CG1 3.98Å; T443-V448 HydrophobicContact CG2-CG2 4.43Å; V448-M465 WeakPolarHBondContact O-CA 3.39Å; V448-S466 WeakPolarHBondContact CB-OG 3.28Å; V448-S466 PolarHBondContact N-OG 3.36Å; V448-S466 PolarHBondContact O-N 3.04Å; V448-F473 HydrophobicContact CB-CE1 4.14Å; V448-F473 HydrophobicContact CB-CZ 4.07Å; V448-F473 HydrophobicContact CG1-CE1 4.19Å; V448-F473 HydrophobicContact CG1-CZ 4.08Å
449	V	92.1	Very high	86.2	Confident	8 Å²	8	46 Å²	46	5%	0.048	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	122.7	165.9	-177.8	0	0	0	0	107.8	I441 S442 L463 Y464 M476 L494	I441-V449 HydrophobicContact CB-CG1 4.33Å; I441-V449 PolarHBondContact N-O 3.4Å; S442-V449 PolarHBondContact N-O 3.37Å; S442-V449 PolarHBondContact O-N 3.37Å; V449-L463 HydrophobicContact CG1-CD2 4.41Å; V449-Y464 WeakPolarHBondContact CA-O 3.27Å; V449-M476 HydrophobicContact CG1-SD 4.3Å; V449-L494 HydrophobicContact CG1-CD2 4.17Å
450	A	93.3	Very high	86.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	136.3	-179.8	0	0	0	0	0	110.7	Q439 I440 Y464 F473	Q439-A450 CarbonylContact O-C 3.6Å; Q439-A450 VanDerWaalsContact O-CA 3.25Å; Q439-A450 WeakPolarHBondContact O-CA 3.23Å; I440-A450 HydrophobicContact CD1-CB 4.14Å; A450-Y464 PolarHBondContact N-O 3.39Å; A450-Y464 PolarHBondContact O-N 2.6Å; A450-F473 HydrophobicContact CB-CD1 4.47Å; A450-F473 HydrophobicContact CB-CE1 3.92Å
451	A	93.1	Very high	86.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	133	168.5	0	0	0	0	0	108.9	L438 Q439 I441 Y461 L463 I492	L438-A451 WeakPolarHBondContact CA-O 3.41Å; Q439-A451 PolarHBondContact N-O 2.79Å; Q439-A451 PolarHBondContact O-N 2.86Å; I441-A451 HydrophobicContact CD1-CB 3.88Å; I441-A451 HydrophobicContact CG1-CB 3.91Å; A451-Y461 HydrophobicContact CB-CD1 3.88Å; A451-Y461 HydrophobicContact CB-CG 4.42Å; A451-L463 HydrophobicContact CB-CD2 4.01Å; A451-I492 HydrophobicContact CB-CD1 4.17Å; A451-I492 HydrophobicContact CB-CG1 3.83Å; A451-I492 HydrophobicContact CB-CG2 4.46Å
452	I	92.7	Very high	86.4	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	124.4	-178.5	-60.2	-179.4	0	0	0	109.1	L429 T433 P435 L438 N462 Y464	L429-I452 HydrophobicContact CD1-CD1 3.89Å; L429-I452 HydrophobicContact CD2-CD1 3.51Å; L429-I452 HydrophobicContact CG-CD1 4.3Å; T433-I452 HydrophobicContact CG2-CG2 3.89Å; P435-I452 HydrophobicContact CB-CG2 3.82Å; L438-I452 HydrophobicContact CB-CG1 4.34Å; L438-I452 HydrophobicContact CD1-CD1 3.75Å; L438-I452 HydrophobicContact CD1-CG1 3.85Å; L438-I452 HydrophobicContact CG-CD1 4.32Å; L438-I452 HydrophobicContact CG-CG1 3.86Å; I452-N462 PolarHBondContact N-O 3.34Å; I452-N462 PolarHBondContact O-N 3.04Å; I452-Y464 HydrophobicContact CB-CD2 3.98Å; I452-Y464 HydrophobicContact CB-CE2 3.91Å; I452-Y464 HydrophobicContact CD1-CD2 3.58Å; I452-Y464 HydrophobicContact CD1-CE2 3.94Å; I452-Y464 HydrophobicContact CD1-CG 4.19Å; I452-Y464 HydrophobicContact CG1-CD2 3.86Å; I452-Y464 HydrophobicContact CG1-CE2 4.24Å
453	Q	90.6	Very high	86.7	Confident	9 Å²	9	40.5 Å²	40.5	4%	0.042	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	114.7	167.5	-178.4	162	96.1	0	0	108.7	K436 D437 Q457 N458 S460 Y461	K436-Q453 HydrophobicContact CD-CG 4.35Å; K436-Q453 VanDerWaalsContact CE-OE1 3.27Å; K436-Q453 PolarHBondContact N-O 3.14Å; D437-Q453 PolarHBondContact O-N 3.47Å; D437-Q453 VanDerWaalsContact O-N 3.08Å; Q453-Q457 HydrophobicContact CG-CB 3.94Å; Q453-N458 VanDerWaalsContact NE2-C 3.33Å; Q453-N458 PolarHBondContact NE2-O 2.87Å; Q453-S460 PolarHBondContact NE2-O 3.44Å; Q453-Y461 HydrophobicContact CB-CD1 3.85Å; Q453-Y461 HydrophobicContact CB-CD2 4.3Å; Q453-Y461 HydrophobicContact CB-CE1 3.61Å; Q453-Y461 HydrophobicContact CB-CE2 4.09Å; Q453-Y461 HydrophobicContact CB-CG 4.18Å
454	D	86.9	Confident	86.9	Confident	14 Å²	14	40.9 Å²	40.9	8%	0.075	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	156.2	175.2	-167.9	48.8	0	0	0	111.1	T433 L434 H456 Q457	T433-D454 WeakPolarHBondContact CA-OD1 3.35Å; L434-D454 PolarHBondContact N-OD1 2.96Å; D454-H456 PolarHBondContact O-N 2.85Å; D454-H456 IonicContact OD2-CE1 2.75Å; D454-H456 PolarHBondContact OD2-CE1 2.93Å; D454-H456 IonicContact OD2-ND1 2.95Å; D454-H456 PolarHBondContact OD2-ND1 2.99Å; D454-Q457 VanDerWaalsContact N-OE1 3.09Å; D454-Q457 PolarHBondContact O-N 2.79Å
455	W	81.4	Confident	87.3	Confident	170 Å²	170	37.6 Å²	37.6	64%	0.644	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-21.1	-172.3	70.5	-83.1	0	0	0	116.3	L434	L434-W455 HydrophobicContact CB-CB 4.17Å; L434-W455 HydrophobicContact CB-CG 4.35Å; L434-W455 PolarHBondContact O-N 3.19Å; L434-W455 VanDerWaalsContact O-N 3.13Å
456	H	82.2	Confident	88	Confident	112 Å²	112	35.7 Å²	35.7	52%	0.519	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-8.5	-178.3	73.6	-82.4	0	0	0	114.2	D454	D454-H456 PolarHBondContact O-N 2.85Å; D454-H456 IonicContact OD2-CE1 2.75Å; D454-H456 PolarHBondContact OD2-CE1 2.93Å; D454-H456 IonicContact OD2-ND1 2.95Å; D454-H456 PolarHBondContact OD2-ND1 2.99Å
457	Q	79.6	Confident	88.2	Confident	9 Å²	9	32.8 Å²	32.8	4%	0.042	15%	0.153	C	C	.	.			trans	-89.2	143.4	176.9	-72.2	170.8	-45.2	0	0	110.6	Q453 D454 S460 N462 D479	Q453-Q457 HydrophobicContact CG-CB 3.94Å; D454-Q457 VanDerWaalsContact N-OE1 3.09Å; D454-Q457 PolarHBondContact O-N 2.79Å; Q457-S460 PolarHBondContact NE2-OG 2.7Å; Q457-N462 PolarHBondContact NE2-ND2 2.84Å; Q457-N462 PolarHBondContact NE2-OD1 2.84Å; Q457-N462 PolarHBondContact OE1-ND2 2.85Å; Q457-D479 PolarHBondContact NE2-OD1 2.98Å
458	N	72.6	Confident	88.2	Confident	127 Å²	127	38.4 Å²	38.4	68%	0.679	18%	0.175	S	C	*	.	S	Bend	trans	-112.3	-47	178.6	-76.6	-32.5	0	0	0	112.9	Q453	Q453-N458 VanDerWaalsContact NE2-C 3.33Å; Q453-N458 PolarHBondContact NE2-O 2.87Å
459	E	76.5	Confident	88	Confident	162 Å²	162	41 Å²	41	76%	0.757	19%	0.185	S	C	*	.	S	Bend	trans	-122.6	-2.2	-171	-62.6	176.9	176	0	0	112.9	S482	E459-S482 PolarHBondContact O-N 3.47Å; E459-S482 PolarHBondContact O-OG 3Å
460	S	87.3	Confident	87.9	Confident	15 Å²	15	40.7 Å²	40.7	11%	0.105	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	159.4	175.2	65.6	0	0	0	0	112.2	Q453 Q457 D479 V480	Q453-S460 PolarHBondContact NE2-O 3.44Å; Q457-S460 PolarHBondContact NE2-OG 2.7Å; S460-D479 WeakPolarHBondContact CB-OD1 3.44Å; S460-D479 PolarHBondContact OG-OD1 2.9Å; S460-V480 WeakPolarHBondContact CA-O 3.41Å
461	Y	92.9	Very high	87.7	Confident	10 Å²	10	41.2 Å²	41.2	4%	0.039	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	151.8	175.6	-79.7	-112.6	0	0	0	109.9	A451 Q453 D479 V480 V490 I492	A451-Y461 HydrophobicContact CB-CD1 3.88Å; A451-Y461 HydrophobicContact CB-CG 4.42Å; Q453-Y461 HydrophobicContact CB-CD1 3.85Å; Q453-Y461 HydrophobicContact CB-CD2 4.3Å; Q453-Y461 HydrophobicContact CB-CE1 3.61Å; Q453-Y461 HydrophobicContact CB-CE2 4.09Å; Q453-Y461 HydrophobicContact CB-CG 4.18Å; Y461-D479 PolarHBondContact O-N 3.48Å; Y461-V480 PolarHBondContact N-O 2.94Å; Y461-V480 PolarHBondContact O-N 2.85Å; Y461-V490 HydrophobicContact CE2-CG1 3.91Å; Y461-I492 HydrophobicContact CD1-CD1 4.02Å; Y461-I492 HydrophobicContact CD2-CD1 3.74Å; Y461-I492 HydrophobicContact CE1-CD1 4.46Å; Y461-I492 HydrophobicContact CE2-CD1 4.2Å; Y461-I492 HydrophobicContact CG-CD1 3.66Å
462	N	93.5	Very high	87.5	Confident	15 Å²	15	42.6 Å²	42.6	8%	0.08	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	127.1	171.8	-63.1	-27.1	0	0	0	109.3	I452 Q457 Y464 L475 L477 E478 D479	I452-N462 PolarHBondContact N-O 3.34Å; I452-N462 PolarHBondContact O-N 3.04Å; Q457-N462 PolarHBondContact NE2-ND2 2.84Å; Q457-N462 PolarHBondContact NE2-OD1 2.84Å; Q457-N462 PolarHBondContact OE1-ND2 2.85Å; N462-Y464 HydrophobicContact CB-CD2 4.35Å; N462-Y464 HydrophobicContact CB-CE2 3.63Å; N462-Y464 WeakPolarHBondContact O-CD2 3.25Å; N462-L475 HydrophobicContact CB-CD1 4.25Å; N462-L477 CarbonylContact C-O 3.53Å; N462-L477 WeakPolarHBondContact CA-O 3.45Å; N462-E478 VanDerWaalsContact OD1-CA 3.27Å; N462-E478 WeakPolarHBondContact OD1-CA 3.4Å; N462-D479 PolarHBondContact OD1-N 3.49Å
463	L	94.1	Very high	87.4	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	134	173.6	-69.3	176.9	0	0	0	110.5	V449 A451 M476 L477 V480 I492 L494	V449-L463 HydrophobicContact CG1-CD2 4.41Å; A451-L463 HydrophobicContact CB-CD2 4.01Å; L463-M476 HydrophobicContact CB-CB 4.16Å; L463-M476 HydrophobicContact CB-SD 4.16Å; L463-M476 HydrophobicContact CD1-SD 4.37Å; L463-M476 WeakPolarHBondContact O-CB 3.3Å; L463-M476 PolarHBondContact O-N 3.24Å; L463-L477 HydrophobicContact CB-CB 4.33Å; L463-L477 HydrophobicContact CD1-CB 4.35Å; L463-L477 PolarHBondContact N-O 2.99Å; L463-L477 PolarHBondContact O-N 3.45Å; L463-V480 HydrophobicContact CD1-CG2 3.85Å; L463-V480 HydrophobicContact CG-CG2 3.89Å; L463-I492 HydrophobicContact CD2-CG2 4.22Å; L463-L494 HydrophobicContact CD1-CB 4.45Å; L463-L494 HydrophobicContact CD1-CD1 3.93Å; L463-L494 HydrophobicContact CD1-CD2 3.93Å; L463-L494 HydrophobicContact CD1-CG 4.33Å; L463-L494 HydrophobicContact CD2-CD2 4.3Å
464	Y	92.6	Very high	87.4	Confident	11 Å²	11	43.1 Å²	43.1	4%	0.043	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	144.9	175.2	-68.7	-92.2	0	0	0	110.7	P430 T433 V449 A450 I452 N462 F473 T474 L475	P430-Y464 HydrophobicContact CG-CE1 3.75Å; T433-Y464 PolarHBondContact OG1-OH 3Å; V449-Y464 WeakPolarHBondContact CA-O 3.27Å; A450-Y464 PolarHBondContact N-O 3.39Å; A450-Y464 PolarHBondContact O-N 2.6Å; I452-Y464 HydrophobicContact CB-CD2 3.98Å; I452-Y464 HydrophobicContact CB-CE2 3.91Å; I452-Y464 HydrophobicContact CD1-CD2 3.58Å; I452-Y464 HydrophobicContact CD1-CE2 3.94Å; I452-Y464 HydrophobicContact CD1-CG 4.19Å; I452-Y464 HydrophobicContact CG1-CD2 3.86Å; I452-Y464 HydrophobicContact CG1-CE2 4.24Å; N462-Y464 HydrophobicContact CB-CD2 4.35Å; N462-Y464 HydrophobicContact CB-CE2 3.63Å; N462-Y464 WeakPolarHBondContact O-CD2 3.25Å; Y464-F473 HydrophobicContact CD1-CB 4.47Å; Y464-T474 CarbonylContact C-O 3.46Å; Y464-T474 WeakPolarHBondContact CA-O 3.42Å; Y464-L475 HydrophobicContact CD1-CB 4.24Å; Y464-L475 HydrophobicContact CD1-CD1 4.49Å; Y464-L475 HydrophobicContact CE1-CB 3.93Å; Y464-L475 HydrophobicContact CE1-CD1 3.97Å; Y464-L475 HydrophobicContact CE2-CD1 4.42Å
465	M	91.7	Very high	87.6	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.025	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.6	178.2	-179.4	168.6	57.4	0	0	110.6	Q447 V448 T474 M476 K522 E755	Q447-M465 VanDerWaalsContact NE2-CG 3.29Å; Q447-M465 PolarHBondContact NE2-SD 2.98Å; V448-M465 WeakPolarHBondContact O-CA 3.39Å; M465-T474 PolarHBondContact N-O 2.95Å; M465-T474 PolarHBondContact O-N 3.16Å; M465-T474 PolarHBondContact O-OG1 2.89Å; M465-M476 HydrophobicContact CB-CB 4.49Å; M465-K522 WeakPolarHBondContact CE-O 3.09Å; M465-K522 HydrophobicContact SD-CD 4.14Å; M465-K522 HydrophobicContact SD-CG 4.06Å; M465-E755 VanDerWaalsContact CE-OE2 3.22Å; M465-E755 WeakPolarHBondContact CE-OE2 3.5Å
466	S	92.1	Very high	88	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.185	C	C	.	.			trans	-91.9	167.9	-175.1	77.5	0	0	0	0	114.9	Q447 V448 F472	Q447-S466 PolarHBondContact NE2-O 3.17Å; V448-S466 WeakPolarHBondContact CB-OG 3.28Å; V448-S466 PolarHBondContact N-OG 3.36Å; V448-S466 PolarHBondContact O-N 3.04Å; S466-F472 WeakPolarHBondContact CA-O 3.22Å
467	D	88.1	Confident	88.5	Confident	18 Å²	18	34.3 Å²	34.3	10%	0.096	16%	0.164	C	C	.	.			trans	-66.1	173.3	153.1	83.6	-58.6	0	0	0	111.9	R469 G470 L471 F472	D467-R469 PolarHBondContact O-N 2.82Å; D467-R469 VanDerWaalsContact O-N 3.12Å; D467-R469 WeakPolarHBondContact OD2-CB 3.36Å; D467-R469 PolarHBondContact OD2-N 2.87Å; D467-R469 VanDerWaalsContact OD2-N 3.17Å; D467-R469 IonicContact OD2-NE 2.71Å; D467-G470 PolarHBondContact O-N 3.35Å; D467-L471 WeakPolarHBondContact OD1-CA 3.25Å; D467-L471 PolarHBondContact OD1-N 2.86Å; D467-F472 HydrophobicContact CB-CB 4.25Å; D467-F472 PolarHBondContact N-O 2.76Å; D467-F472 VanDerWaalsContact N-O 3.16Å; D467-F472 PolarHBondContact OD1-N 3.44Å
468	Y	87.3	Confident	89.1	Confident	120 Å²	120	38.6 Å²	38.6	47%	0.471	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-21.3	-175.2	75	-83	0	0	0	114.7	Y402 Y419 N446 G470	Y402-Y468 PolarHBondContact OH-O 3.04Å; Y419-Y468 HydrophobicContact CE1-CD2 4Å; Y419-Y468 HydrophobicContact CE1-CE2 4.18Å; N446-Y468 VanDerWaalsContact O-CA 3.29Å; N446-Y468 WeakPolarHBondContact O-CA 3.47Å; Y468-G470 VanDerWaalsContact C-N 3.34Å
469	R	87.5	Confident	90.1	Very high	56 Å²	56	35.1 Å²	35.1	21%	0.211	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-4.2	175.8	-59.5	-168.9	-72.6	166	-2.1	113.7	Y419 D467 L471 D782	Y419-R469 HydrophobicContact CD1-CB 4.45Å; Y419-R469 HydrophobicContact CD1-CG 4.17Å; D467-R469 PolarHBondContact O-N 2.82Å; D467-R469 VanDerWaalsContact O-N 3.12Å; D467-R469 WeakPolarHBondContact OD2-CB 3.36Å; D467-R469 PolarHBondContact OD2-N 2.87Å; D467-R469 VanDerWaalsContact OD2-N 3.17Å; D467-R469 IonicContact OD2-NE 2.71Å; R469-L471 VanDerWaalsContact C-N 3.27Å; R469-L471 HydrophobicContact CB-CB 4.46Å; R469-L471 HydrophobicContact CB-CD1 3.62Å; R469-L471 HydrophobicContact CB-CG 3.75Å; R469-L471 HydrophobicContact CG-CD1 4.39Å; R469-L471 VanDerWaalsContact CZ-CD1 3.47Å; R469-D782 IonicContact CZ-OD2 3.29Å; R469-D782 IonicContact NH1-OD2 3.2Å; R469-D782 PolarHBondContact NH1-OD2 3.04Å; R469-D782 IonicContact NH2-OD2 3.37Å; R469-D782 PolarHBondContact NH2-OD2 2.86Å; R469-D782 VanDerWaalsContact NH2-OD2 3.14Å
470	G	90.1	Very high	90.9	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	72.6	19.2	-174.5	0	0	0	0	0	113.6	V417 D467 Y468 F473	V417-G470 WeakPolarHBondContact CG1-O 3.38Å; D467-G470 PolarHBondContact O-N 3.35Å; Y468-G470 VanDerWaalsContact C-N 3.34Å; G470-F473 WeakPolarHBondContact O-CE2 3.47Å
471	L	88.1	Confident	91.1	Very high	11 Å²	11	27.6 Å²	27.6	6%	0.058	13%	0.13	C	C	.	.			trans	-99.2	-49.5	-171.1	-65.7	171.6	0	0	0	112.6	V417 Y425 K428 D467 R469	V417-L471 HydrophobicContact CG1-CD2 3.43Å; V417-L471 VanDerWaalsContact CG1-CD2 3.43Å; V417-L471 HydrophobicContact CG1-CG 4.26Å; Y425-L471 HydrophobicContact CG-CD2 4.38Å; K428-L471 WeakPolarHBondContact CA-O 3.34Å; K428-L471 WeakPolarHBondContact CB-O 3.49Å; K428-L471 PolarHBondContact N-O 3.18Å; D467-L471 WeakPolarHBondContact OD1-CA 3.25Å; D467-L471 PolarHBondContact OD1-N 2.86Å; R469-L471 VanDerWaalsContact C-N 3.27Å; R469-L471 HydrophobicContact CB-CB 4.46Å; R469-L471 HydrophobicContact CB-CD1 3.62Å; R469-L471 HydrophobicContact CB-CG 3.75Å; R469-L471 HydrophobicContact CG-CD1 4.39Å; R469-L471 VanDerWaalsContact CZ-CD1 3.47Å
472	F	89.3	Confident	90.8	Very high	30 Å²	30	28.3 Å²	28.3	13%	0.132	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-106.6	98.4	-165.2	-69.1	-78.1	0	0	0	111.5	K428 S466 D467 Y758 T780 R796	K428-F472 HydrophobicContact CB-CD1 3.83Å; K428-F472 HydrophobicContact CB-CE1 4.09Å; K428-F472 HydrophobicContact CG-CD1 4.06Å; K428-F472 HydrophobicContact CG-CE1 3.83Å; K428-F472 HydrophobicContact CG-CZ 4.42Å; S466-F472 WeakPolarHBondContact CA-O 3.22Å; D467-F472 HydrophobicContact CB-CB 4.25Å; D467-F472 PolarHBondContact N-O 2.76Å; D467-F472 VanDerWaalsContact N-O 3.16Å; D467-F472 PolarHBondContact OD1-N 3.44Å; F472-Y758 HydrophobicContact CB-CD2 4.39Å; F472-Y758 HydrophobicContact CB-CG 4.19Å; F472-Y758 AromaticContact CD1-CD1 3.7Å; F472-Y758 HydrophobicContact CD1-CD1 3.7Å; F472-Y758 HydrophobicContact CD1-CD2 4.22Å; F472-Y758 HydrophobicContact CD1-CE1 4.14Å; F472-Y758 AromaticContact CD1-CG 3.73Å; F472-Y758 HydrophobicContact CD1-CG 3.73Å; F472-Y758 HydrophobicContact CE1-CD1 4.23Å; F472-Y758 HydrophobicContact CE1-CE1 4.44Å; F472-Y758 HydrophobicContact CG-CG 4.43Å; F472-T780 VanDerWaalsContact CZ-O 3.27Å; F472-T780 WeakPolarHBondContact CZ-O 3.35Å; F472-R796 PolarHBondContact O-NH1 3.44Å
473	F	91.7	Very high	90	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.009	15%	0.15	C	C	.	.			trans	-89.9	128.9	-172.9	-74.5	-89.2	0	0	0	112.8	M427 K428 L429 V448 A450 Y464 G470	M427-F473 HydrophobicContact CB-CE2 4.14Å; M427-F473 HydrophobicContact CE-CD2 4.41Å; M427-F473 HydrophobicContact CE-CE2 3.44Å; M427-F473 VanDerWaalsContact CE-CE2 3.44Å; M427-F473 HydrophobicContact CE-CZ 3.53Å; M427-F473 HydrophobicContact CG-CE2 4.14Å; K428-F473 PolarHBondContact O-N 2.59Å; K428-F473 VanDerWaalsContact O-N 3.09Å; L429-F473 HydrophobicContact CD2-CB 3.95Å; L429-F473 HydrophobicContact CD2-CD2 3.89Å; L429-F473 HydrophobicContact CD2-CG 3.96Å; V448-F473 HydrophobicContact CB-CE1 4.14Å; V448-F473 HydrophobicContact CB-CZ 4.07Å; V448-F473 HydrophobicContact CG1-CE1 4.19Å; V448-F473 HydrophobicContact CG1-CZ 4.08Å; A450-F473 HydrophobicContact CB-CD1 4.47Å; A450-F473 HydrophobicContact CB-CE1 3.92Å; Y464-F473 HydrophobicContact CD1-CB 4.47Å; G470-F473 WeakPolarHBondContact O-CE2 3.47Å
474	T	90.6	Very high	88.8	Confident	18 Å²	18	34.3 Å²	34.3	11%	0.11	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	143.1	175.1	47.8	0	0	0	0	109.8	Y464 M465 R796	Y464-T474 CarbonylContact C-O 3.46Å; Y464-T474 WeakPolarHBondContact CA-O 3.42Å; M465-T474 PolarHBondContact N-O 2.95Å; M465-T474 PolarHBondContact O-N 3.16Å; M465-T474 PolarHBondContact O-OG1 2.89Å; T474-R796 PolarHBondContact OG1-NH2 2.99Å
475	L	90.3	Very high	87.3	Confident	84 Å²	84	35 Å²	35	44%	0.44	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	133	-179.8	-179.4	65.1	0	0	0	110.9	N462 Y464 E478	N462-L475 HydrophobicContact CB-CD1 4.25Å; Y464-L475 HydrophobicContact CD1-CB 4.24Å; Y464-L475 HydrophobicContact CD1-CD1 4.49Å; Y464-L475 HydrophobicContact CE1-CB 3.93Å; Y464-L475 HydrophobicContact CE1-CD1 3.97Å; Y464-L475 HydrophobicContact CE2-CD1 4.42Å; L475-E478 HydrophobicContact CD1-CG 3.93Å; L475-E478 HydrophobicContact CD2-CG 3.71Å; L475-E478 HydrophobicContact CG-CG 4.22Å
476	M	91	Very high	85.6	Confident	13 Å²	13	38.4 Å²	38.4	6%	0.064	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-45.4	-179	-176.4	-164	-172.9	0	0	111.3	V449 L463 M465 F504 W526	V449-M476 HydrophobicContact CG1-SD 4.3Å; L463-M476 HydrophobicContact CB-CB 4.16Å; L463-M476 HydrophobicContact CB-SD 4.16Å; L463-M476 HydrophobicContact CD1-SD 4.37Å; L463-M476 WeakPolarHBondContact O-CB 3.3Å; L463-M476 PolarHBondContact O-N 3.24Å; M465-M476 HydrophobicContact CB-CB 4.49Å; M476-F504 HydrophobicContact CE-CD2 4.44Å; M476-W526 HydrophobicContact CE-CZ2 4.07Å; M476-W526 HydrophobicContact CG-CZ2 4.36Å; M476-W526 PolarHBondContact O-NE1 3.32Å
477	L	92.8	Very high	83.8	Confident	15 Å²	15	43 Å²	43	8%	0.079	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	133.1	176.2	-173.4	58.3	0	0	0	110.3	N462 L463 V480 K508 W526	N462-L477 CarbonylContact C-O 3.53Å; N462-L477 WeakPolarHBondContact CA-O 3.45Å; L463-L477 HydrophobicContact CB-CB 4.33Å; L463-L477 HydrophobicContact CD1-CB 4.35Å; L463-L477 PolarHBondContact N-O 2.99Å; L463-L477 PolarHBondContact O-N 3.45Å; L477-V480 HydrophobicContact CB-CG2 4.06Å; L477-V480 HydrophobicContact CD2-CG2 3.6Å; L477-V480 HydrophobicContact CG-CG2 3.7Å; L477-K508 HydrophobicContact CD1-CD 4.05Å; L477-W526 HydrophobicContact CB-CZ2 4.05Å; L477-W526 HydrophobicContact CD1-CD2 4.3Å; L477-W526 HydrophobicContact CD1-CG 4.14Å; L477-W526 HydrophobicContact CD2-CD2 4.08Å; L477-W526 HydrophobicContact CD2-CE3 4.25Å; L477-W526 HydrophobicContact CD2-CH2 4Å; L477-W526 HydrophobicContact CD2-CZ2 3.81Å; L477-W526 HydrophobicContact CD2-CZ3 4.22Å; L477-W526 HydrophobicContact CG-CZ2 4.46Å
478	E	92.1	Very high	82.3	Confident	98 Å²	98	49.9 Å²	49.9	46%	0.458	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	155.7	176	-42.9	150.8	135.6	0	0	111.2	N462 L475 V480 K508	N462-E478 VanDerWaalsContact OD1-CA 3.27Å; N462-E478 WeakPolarHBondContact OD1-CA 3.4Å; L475-E478 HydrophobicContact CD1-CG 3.93Å; L475-E478 HydrophobicContact CD2-CG 3.71Å; L475-E478 HydrophobicContact CG-CG 4.22Å; E478-V480 PolarHBondContact O-N 3Å; E478-K508 WeakPolarHBondContact O-CD 3.46Å; E478-K508 VanDerWaalsContact O-CE 3.25Å; E478-K508 WeakPolarHBondContact O-CE 3.32Å; E478-K508 WeakPolarHBondContact O-CG 3.14Å; E478-K508 PolarHBondContact O-NZ 2.92Å; E478-K508 IonicContact OE2-NZ 2.62Å; E478-K508 PolarHBondContact OE2-NZ 2.91Å
479	D	92.4	Very high	81.4	Confident	54 Å²	54	48.7 Å²	48.7	29%	0.289	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.8	41.2	172.1	-68.1	-53.6	0	0	0	115.4	Q457 S460 Y461 N462 K508 V509	Q457-D479 PolarHBondContact NE2-OD1 2.98Å; S460-D479 WeakPolarHBondContact CB-OD1 3.44Å; S460-D479 PolarHBondContact OG-OD1 2.9Å; Y461-D479 PolarHBondContact O-N 3.48Å; N462-D479 PolarHBondContact OD1-N 3.49Å; D479-K508 HydrophobicContact CB-CG 4.43Å; D479-K508 CarbonylContact O-C 3.54Å; D479-K508 WeakPolarHBondContact O-CA 3.29Å; D479-V509 HydrophobicContact CB-CB 4.49Å; D479-V509 PolarHBondContact O-N 2.91Å
480	V	93.8	Very high	80.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	139.3	170.3	-179	0	0	0	0	110.1	S460 Y461 L463 L477 E478 I492 S506 N507	S460-V480 WeakPolarHBondContact CA-O 3.41Å; Y461-V480 PolarHBondContact N-O 2.94Å; Y461-V480 PolarHBondContact O-N 2.85Å; L463-V480 HydrophobicContact CD1-CG2 3.85Å; L463-V480 HydrophobicContact CG-CG2 3.89Å; L477-V480 HydrophobicContact CB-CG2 4.06Å; L477-V480 HydrophobicContact CD2-CG2 3.6Å; L477-V480 HydrophobicContact CG-CG2 3.7Å; E478-V480 PolarHBondContact O-N 3Å; V480-I492 HydrophobicContact CB-CG2 4.48Å; V480-I492 HydrophobicContact CG1-CG2 3.65Å; V480-S506 WeakPolarHBondContact CG1-OG 3.49Å; V480-N507 WeakPolarHBondContact CA-O 3.36Å
481	V	90.9	Very high	80.5	Confident	20 Å²	20	51 Å²	51	12%	0.121	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	134.8	177	172.7	0	0	0	0	110.2	T483 D493 N507 V509 V514	V481-T483 HydrophobicContact CG1-CG2 4.32Å; V481-D493 HydrophobicContact CB-CB 4.24Å; V481-D493 PolarHBondContact O-N 3.37Å; V481-D493 VanDerWaalsContact O-N 3.09Å; V481-N507 HydrophobicContact CB-CB 4.29Å; V481-N507 HydrophobicContact CG2-CB 4.13Å; V481-N507 WeakPolarHBondContact CG2-O 3.45Å; V481-N507 PolarHBondContact N-O 3.11Å; V481-V509 HydrophobicContact CG2-CG2 3.71Å; V481-V514 HydrophobicContact CG2-CB 4.44Å; V481-V514 HydrophobicContact CG2-CG1 3.83Å; V481-V514 HydrophobicContact CG2-CG2 3.81Å
482	S	86.8	Confident	80.6	Confident	25 Å²	25	51.5 Å²	51.5	18%	0.175	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	147.2	167.4	68.2	0	0	0	0	110.8	E459 M491	E459-S482 PolarHBondContact O-N 3.47Å; E459-S482 PolarHBondContact O-OG 3Å; S482-M491 CarbonylContact C-O 3.47Å; S482-M491 WeakPolarHBondContact CA-O 3.41Å
483	T	77.2	Confident	80.7	Confident	60 Å²	60	50.9 Å²	50.9	37%	0.368	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	146.2	175.7	57.4	0	0	0	0	110.2	V481 G485 M491	V481-T483 HydrophobicContact CG1-CG2 4.32Å; T483-G485 PolarHBondContact O-N 2.69Å; T483-M491 PolarHBondContact N-O 3.19Å; T483-M491 PolarHBondContact O-N 3.41Å
484	G	68	Low	80.7	Confident	80 Å²	80	52.4 Å²	52.4	83%	0.825	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.9	112.3	175.3	0	0	0	0	0	110.5
485	G	61.1	Low	80.8	Confident	26 Å²	26	52.9 Å²	52.9	27%	0.268	31%	0.307	S	S	.	.			trans	-84.1	-170.1	173.2	0	0	0	0	0	113.1	T483 N489	T483-G485 PolarHBondContact O-N 2.69Å; G485-N489 VanDerWaalsContact CA-O 3.3Å; G485-N489 WeakPolarHBondContact CA-O 3.35Å; G485-N489 PolarHBondContact N-O 2.87Å
486	P	56.9	Low	80.9	Confident	76 Å²	76	51.8 Å²	51.8	49%	0.494	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-60.9	148.5	173	-20.6	33.4	0	0	0	112.3	D488 N489	P486-D488 VanDerWaalsContact C-N 3.34Å; P486-D488 PolarHBondContact O-N 3.32Å; P486-N489 WeakPolarHBondContact O-CB 3.36Å; P486-N489 PolarHBondContact O-N 2.88Å; P486-N489 VanDerWaalsContact O-N 3.16Å; P486-N489 PolarHBondContact O-ND2 2.83Å
487	E	54.3	Low	80.9	Confident	97 Å²	97	51.2 Å²	51.2	45%	0.453	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	54.1	40.4	171.1	-56.7	-172.7	-171.4	0	0	115.3	N489 L1211 S1212	E487-N489 PolarHBondContact O-N 2.73Å; E487-N489 PolarHBondContact O-ND2 2.83Å; E487-L1211 WeakPolarHBondContact OE1-CA 3.45Å; E487-S1212 PolarHBondContact OE1-N 2.77Å
488	D	57.3	Low	80.7	Confident	163 Å²	163	52.1 Å²	52.1	87%	0.872	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	64.9	9.8	179.5	-116.3	9.4	0	0	0	114.7	P486	P486-D488 VanDerWaalsContact C-N 3.34Å; P486-D488 PolarHBondContact O-N 3.32Å
489	N	66.6	Low	80.3	Confident	94 Å²	94	49 Å²	49	50%	0.503	30%	0.302	S	S	.	.			trans	-73.2	128.7	173.8	-63.1	-77.6	0	0	0	110.6	G485 P486 E487	G485-N489 VanDerWaalsContact CA-O 3.3Å; G485-N489 WeakPolarHBondContact CA-O 3.35Å; G485-N489 PolarHBondContact N-O 2.87Å; P486-N489 WeakPolarHBondContact O-CB 3.36Å; P486-N489 PolarHBondContact O-N 2.88Å; P486-N489 VanDerWaalsContact O-N 3.16Å; P486-N489 PolarHBondContact O-ND2 2.83Å; E487-N489 PolarHBondContact O-N 2.73Å; E487-N489 PolarHBondContact O-ND2 2.83Å
490	V	77.1	Confident	80	Confident	34 Å²	34	46.5 Å²	46.5	21%	0.206	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	132.6	174.9	-175.6	0	0	0	0	109.7	Q439 Y461 I492	Q439-V490 PolarHBondContact NE2-O 2.03Å; Q439-V490 PolarHBondContact OE1-O 2.92Å; Y461-V490 HydrophobicContact CE2-CG1 3.91Å; V490-I492 HydrophobicContact CG1-CD1 3.81Å
491	M	83.2	Confident	79.4	Confident	70 Å²	70	51.5 Å²	51.5	35%	0.345	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.9	173.1	-64.5	-65.3	-81.3	0	0	109.2	S482 T483	S482-M491 CarbonylContact C-O 3.47Å; S482-M491 WeakPolarHBondContact CA-O 3.41Å; T483-M491 PolarHBondContact N-O 3.19Å; T483-M491 PolarHBondContact O-N 3.41Å
492	I	89.5	Confident	79	Confident	22 Å²	22	50.6 Å²	50.6	11%	0.113	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	131.4	-178	-54.9	-60.5	0	0	0	109.1	I441 A451 Y461 L463 V480 V490 L494	I441-I492 HydrophobicContact CD1-CB 4.3Å; I441-I492 HydrophobicContact CD1-CG1 3.9Å; A451-I492 HydrophobicContact CB-CD1 4.17Å; A451-I492 HydrophobicContact CB-CG1 3.83Å; A451-I492 HydrophobicContact CB-CG2 4.46Å; Y461-I492 HydrophobicContact CD1-CD1 4.02Å; Y461-I492 HydrophobicContact CD2-CD1 3.74Å; Y461-I492 HydrophobicContact CE1-CD1 4.46Å; Y461-I492 HydrophobicContact CE2-CD1 4.2Å; Y461-I492 HydrophobicContact CG-CD1 3.66Å; L463-I492 HydrophobicContact CD2-CG2 4.22Å; V480-I492 HydrophobicContact CB-CG2 4.48Å; V480-I492 HydrophobicContact CG1-CG2 3.65Å; V490-I492 HydrophobicContact CG1-CD1 3.81Å; I492-L494 VanDerWaalsContact C-N 3.27Å; I492-L494 PolarHBondContact O-N 2.62Å
493	D	90.7	Very high	79.2	Confident	18 Å²	18	49.4 Å²	49.4	10%	0.096	30%	0.296	C	S	.	.			trans	-74.6	78.1	-179.8	-90.4	26.6	0	0	0	111.4	V481 S506 N507 L554	V481-D493 HydrophobicContact CB-CB 4.24Å; V481-D493 PolarHBondContact O-N 3.37Å; V481-D493 VanDerWaalsContact O-N 3.09Å; D493-S506 WeakPolarHBondContact O-CA 3.32Å; D493-S506 WeakPolarHBondContact O-CB 3.47Å; D493-S506 PolarHBondContact O-OG 2.98Å; D493-N507 HydrophobicContact CB-CB 3.81Å; D493-N507 PolarHBondContact O-N 2.87Å; D493-N507 WeakPolarHBondContact OD2-CB 3.21Å; D493-N507 PolarHBondContact OD2-ND2 3.26Å; D493-L554 HydrophobicContact CB-CD1 4.49Å
494	L	92.1	Very high	79.9	Confident	33 Å²	33	47 Å²	47	17%	0.173	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	130.2	172.4	-179.3	67.9	0	0	0	109.6	I441 V449 L463 I492 F504 L505 W526	I441-L494 HydrophobicContact CG2-CD2 4.13Å; V449-L494 HydrophobicContact CG1-CD2 4.17Å; L463-L494 HydrophobicContact CD1-CB 4.45Å; L463-L494 HydrophobicContact CD1-CD1 3.93Å; L463-L494 HydrophobicContact CD1-CD2 3.93Å; L463-L494 HydrophobicContact CD1-CG 4.33Å; L463-L494 HydrophobicContact CD2-CD2 4.3Å; I492-L494 VanDerWaalsContact C-N 3.27Å; I492-L494 PolarHBondContact O-N 2.62Å; L494-F504 HydrophobicContact CD1-CB 3.98Å; L494-F504 HydrophobicContact CD1-CD1 4.03Å; L494-F504 HydrophobicContact CD1-CG 4.34Å; L494-F504 HydrophobicContact CG-CD1 4.29Å; L494-L505 WeakPolarHBondContact CA-O 3.44Å; L494-W526 HydrophobicContact CD1-CH2 4.11Å
495	Y	92.8	Very high	81.3	Confident	28 Å²	28	43.2 Å²	43.2	11%	0.11	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	120.8	-178.8	-176.2	-93.3	0	0	0	111.1	F504 L505 V556 I566 S568	Y495-F504 CarbonylContact O-C 3.56Å; Y495-F504 VanDerWaalsContact O-CA 3.24Å; Y495-F504 WeakPolarHBondContact O-CA 3.3Å; Y495-L505 HydrophobicContact CD1-CD1 4.29Å; Y495-L505 PolarHBondContact N-O 2.77Å; Y495-L505 PolarHBondContact O-N 3.3Å; Y495-V556 HydrophobicContact CD2-CG2 3.67Å; Y495-V556 HydrophobicContact CE2-CG2 3.65Å; Y495-I566 HydrophobicContact CD1-CD1 3.67Å; Y495-I566 HydrophobicContact CD1-CG1 4.19Å; Y495-I566 HydrophobicContact CD2-CD1 4.45Å; Y495-I566 HydrophobicContact CD2-CG1 4.45Å; Y495-I566 HydrophobicContact CD2-CG2 3.6Å; Y495-I566 HydrophobicContact CE1-CD1 3.91Å; Y495-I566 HydrophobicContact CE1-CG1 3.97Å; Y495-I566 HydrophobicContact CE2-CG1 4.26Å; Y495-I566 HydrophobicContact CE2-CG2 3.72Å; Y495-I566 HydrophobicContact CG-CD1 3.97Å; Y495-I566 HydrophobicContact CG-CG1 4.42Å; Y495-I566 HydrophobicContact CG-CG2 4.13Å; Y495-S568 PolarHBondContact OH-N 2.91Å; Y495-S568 PolarHBondContact OH-OG 2.95Å
496	E	91.8	Very high	82.9	Confident	61 Å²	61	42 Å²	42	29%	0.285	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	136	170.5	-171.6	164.7	175	0	0	111.3	A498 F504	E496-A498 PolarHBondContact O-N 2.89Å; E496-F504 HydrophobicContact CB-CD1 3.75Å; E496-F504 HydrophobicContact CB-CE1 3.55Å; E496-F504 HydrophobicContact CB-CZ 4.33Å; E496-F504 HydrophobicContact CG-CD1 4.1Å; E496-F504 HydrophobicContact CG-CE1 3.69Å; E496-F504 HydrophobicContact CG-CZ 3.95Å; E496-F504 WeakPolarHBondContact OE2-CE1 3.39Å; E496-F504 WeakPolarHBondContact OE2-CZ 3.44Å
497	V	91.9	Very high	84.7	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	21%	0.205	C	C	.	.			trans	-82.3	110.9	-179.8	-179.3	0	0	0	0	111.1	G499 I500 V503 L505 I576	V497-G499 PolarHBondContact O-N 3.07Å; V497-I500 PolarHBondContact O-N 2.9Å; V497-I500 VanDerWaalsContact O-N 3.14Å; V497-V503 HydrophobicContact CB-CB 4.11Å; V497-V503 HydrophobicContact CB-CG1 4.16Å; V497-V503 HydrophobicContact CG2-CB 4.17Å; V497-V503 HydrophobicContact CG2-CG1 3.72Å; V497-V503 PolarHBondContact N-O 2.91Å; V497-L505 HydrophobicContact CG2-CD1 3.48Å; V497-L505 VanDerWaalsContact CG2-CD1 3.48Å; V497-I576 HydrophobicContact CB-CD1 4.39Å; V497-I576 HydrophobicContact CG1-CD1 3.74Å; V497-I576 HydrophobicContact CG1-CG1 3.9Å; V497-I576 HydrophobicContact CG2-CD1 3.66Å
498	A	88.8	Confident	86.6	Confident	34 Å²	34	35 Å²	35	28%	0.281	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	136.1	178.7	0	0	0	0	0	111.8	E496 I500 S568	E496-A498 PolarHBondContact O-N 2.89Å; A498-I500 VanDerWaalsContact C-N 3.28Å; A498-I500 PolarHBondContact O-N 3Å; A498-S568 WeakPolarHBondContact CB-OG 3.35Å; A498-S568 PolarHBondContact N-OG 3.33Å; A498-S568 VanDerWaalsContact N-OG 3.07Å
499	G	82.5	Confident	88.2	Confident	34 Å²	34	29.5 Å²	29.5	35%	0.351	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	-14.2	-177.3	0	0	0	0	0	115.9	V497	V497-G499 PolarHBondContact O-N 3.07Å
500	I	86.6	Confident	89.4	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	-131	72.7	-179.7	-46.6	-176.9	0	0	0	111	V497 A498 G502 V503 P573 G574 A599 W706 L708 F723	V497-I500 PolarHBondContact O-N 2.9Å; V497-I500 VanDerWaalsContact O-N 3.14Å; A498-I500 VanDerWaalsContact C-N 3.28Å; A498-I500 PolarHBondContact O-N 3Å; I500-G502 PolarHBondContact O-N 3.06Å; I500-V503 HydrophobicContact CB-CG2 4.21Å; I500-V503 HydrophobicContact CG2-CG2 3.6Å; I500-V503 WeakPolarHBondContact O-CB 3.48Å; I500-V503 WeakPolarHBondContact O-CG2 3.43Å; I500-V503 PolarHBondContact O-N 2.89Å; I500-V503 VanDerWaalsContact O-N 3.15Å; I500-P573 HydrophobicContact CD1-CB 4.19Å; I500-P573 HydrophobicContact CG1-CB 3.91Å; I500-G574 VanDerWaalsContact CD1-N 3.33Å; I500-A599 HydrophobicContact CD1-CB 3.7Å; I500-W706 HydrophobicContact CD1-CH2 3.99Å; I500-W706 HydrophobicContact CD1-CZ3 4.16Å; I500-L708 HydrophobicContact CD1-CD1 4.12Å; I500-L708 HydrophobicContact CG2-CD1 4.44Å; I500-L708 HydrophobicContact CG2-CD2 3.56Å; I500-F723 HydrophobicContact CD1-CE2 4.39Å; I500-F723 HydrophobicContact CG1-CE2 4.42Å; I500-F723 HydrophobicContact CG1-CZ 4.1Å
501	K	82	Confident	89.9	Confident	106 Å²	106	33.8 Å²	33.8	46%	0.461	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-42.2	124.8	175	-68.6	178	145	-62.7	0	113.3	E445 R721	E445-K501 VanDerWaalsContact OE1-CD 3.22Å; E445-K501 WeakPolarHBondContact OE1-CD 3.23Å; E445-K501 WeakPolarHBondContact OE1-CE 3.4Å; E445-K501 IonicContact OE1-NZ 3.82Å; E445-K501 PolarHBondContact OE1-NZ 3.49Å; K501-R721 PolarHBondContact O-NH1 3.33Å; K501-R721 PolarHBondContact O-NH2 2.86Å
502	G	81.8	Confident	90.1	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.01	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.5	0.3	-179.3	0	0	0	0	0	115.6	I500 Y520 K522	I500-G502 PolarHBondContact O-N 3.06Å; G502-Y520 CarbonylContact O-C 3.59Å; G502-K522 WeakPolarHBondContact O-CA 3.4Å; G502-K522 PolarHBondContact O-N 2.91Å
503	V	90.6	Very high	90.2	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.			trans	-102.1	123	173.6	-176.1	0	0	0	0	109.8	V497 I500 I518 T519 Y520	V497-V503 HydrophobicContact CB-CB 4.11Å; V497-V503 HydrophobicContact CB-CG1 4.16Å; V497-V503 HydrophobicContact CG2-CB 4.17Å; V497-V503 HydrophobicContact CG2-CG1 3.72Å; V497-V503 PolarHBondContact N-O 2.91Å; I500-V503 HydrophobicContact CB-CG2 4.21Å; I500-V503 HydrophobicContact CG2-CG2 3.6Å; I500-V503 WeakPolarHBondContact O-CB 3.48Å; I500-V503 WeakPolarHBondContact O-CG2 3.43Å; I500-V503 PolarHBondContact O-N 2.89Å; I500-V503 VanDerWaalsContact O-N 3.15Å; V503-I518 HydrophobicContact CG1-CD1 4.14Å; V503-I518 HydrophobicContact CG1-CG1 4.24Å; V503-T519 VanDerWaalsContact CA-O 3.28Å; V503-T519 WeakPolarHBondContact CA-O 3.03Å; V503-T519 WeakPolarHBondContact CG1-O 3.44Å; V503-Y520 HydrophobicContact CG1-CD1 4.01Å; V503-Y520 HydrophobicContact CG1-CE1 4.23Å; V503-Y520 HydrophobicContact CG2-CD1 3.81Å
504	F	93.3	Very high	90.3	Very high	9 Å²	9	40 Å²	40	4%	0.039	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	150.1	179.1	-57.9	-101.8	0	0	0	111.4	M476 L494 Y495 E496 I518 T519 K522 W526	M476-F504 HydrophobicContact CE-CD2 4.44Å; L494-F504 HydrophobicContact CD1-CB 3.98Å; L494-F504 HydrophobicContact CD1-CD1 4.03Å; L494-F504 HydrophobicContact CD1-CG 4.34Å; L494-F504 HydrophobicContact CG-CD1 4.29Å; Y495-F504 CarbonylContact O-C 3.56Å; Y495-F504 VanDerWaalsContact O-CA 3.24Å; Y495-F504 WeakPolarHBondContact O-CA 3.3Å; E496-F504 HydrophobicContact CB-CD1 3.75Å; E496-F504 HydrophobicContact CB-CE1 3.55Å; E496-F504 HydrophobicContact CB-CZ 4.33Å; E496-F504 HydrophobicContact CG-CD1 4.1Å; E496-F504 HydrophobicContact CG-CE1 3.69Å; E496-F504 HydrophobicContact CG-CZ 3.95Å; E496-F504 WeakPolarHBondContact OE2-CE1 3.39Å; E496-F504 WeakPolarHBondContact OE2-CZ 3.44Å; F504-I518 WeakPolarHBondContact O-CA 3.41Å; F504-I518 WeakPolarHBondContact O-CG1 3.41Å; F504-T519 HydrophobicContact CB-CG2 3.73Å; F504-T519 HydrophobicContact CD2-CG2 4.03Å; F504-T519 HydrophobicContact CG-CG2 4.37Å; F504-T519 PolarHBondContact N-O 3.08Å; F504-T519 VanDerWaalsContact N-O 3.12Å; F504-T519 PolarHBondContact O-N 2.75Å; F504-K522 HydrophobicContact CE2-CG 3.92Å; F504-W526 HydrophobicContact CB-CH2 4.1Å; F504-W526 HydrophobicContact CB-CZ3 4.46Å
505	L	95.8	Very high	90.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	144.4	165.4	-65.7	88.5	0	0	0	109.4	L494 Y495 V497 Y517 I518 L529 L552 L554 I566 I576 W603	L494-L505 WeakPolarHBondContact CA-O 3.44Å; Y495-L505 HydrophobicContact CD1-CD1 4.29Å; Y495-L505 PolarHBondContact N-O 2.77Å; Y495-L505 PolarHBondContact O-N 3.3Å; V497-L505 HydrophobicContact CG2-CD1 3.48Å; V497-L505 VanDerWaalsContact CG2-CD1 3.48Å; L505-Y517 CarbonylContact C-O 3.53Å; L505-Y517 VanDerWaalsContact CA-O 3.31Å; L505-Y517 WeakPolarHBondContact CA-O 3.44Å; L505-I518 HydrophobicContact CD1-CD1 4.25Å; L505-I518 HydrophobicContact CD1-CG1 4.46Å; L505-I518 HydrophobicContact CG-CB 4.36Å; L505-I518 HydrophobicContact CG-CD1 4.21Å; L505-I518 HydrophobicContact CG-CG1 4.14Å; L505-L529 HydrophobicContact CD2-CD1 4.29Å; L505-L529 HydrophobicContact CD2-CD2 4.29Å; L505-L552 HydrophobicContact CD2-CD1 3.82Å; L505-L554 HydrophobicContact CB-CD1 4.18Å; L505-L554 HydrophobicContact CB-CD2 3.89Å; L505-L554 HydrophobicContact CD2-CD2 4.34Å; L505-I566 HydrophobicContact CD2-CD1 4.49Å; L505-I576 HydrophobicContact CD1-CD1 4.33Å; L505-W603 HydrophobicContact CD2-CZ2 4.49Å
506	S	95.8	Very high	90.6	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	148	176.1	-173.6	0	0	0	0	111.8	V480 D493 T516 Y517 L554	V480-S506 WeakPolarHBondContact CG1-OG 3.49Å; D493-S506 WeakPolarHBondContact O-CA 3.32Å; D493-S506 WeakPolarHBondContact O-CB 3.47Å; D493-S506 PolarHBondContact O-OG 2.98Å; S506-T516 WeakPolarHBondContact O-CA 3.11Å; S506-Y517 PolarHBondContact N-O 3.41Å; S506-Y517 PolarHBondContact O-N 3.32Å; S506-L554 VanDerWaalsContact CA-CD1 3.44Å
507	N	94.8	Very high	90.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	118.2	174.7	-75.7	-31.5	0	0	0	109.9	V480 V481 D493 V514 T516 L552 L554	V480-N507 WeakPolarHBondContact CA-O 3.36Å; V481-N507 HydrophobicContact CB-CB 4.29Å; V481-N507 HydrophobicContact CG2-CB 4.13Å; V481-N507 WeakPolarHBondContact CG2-O 3.45Å; V481-N507 PolarHBondContact N-O 3.11Å; D493-N507 HydrophobicContact CB-CB 3.81Å; D493-N507 PolarHBondContact O-N 2.87Å; D493-N507 WeakPolarHBondContact OD2-CB 3.21Å; D493-N507 PolarHBondContact OD2-ND2 3.26Å; N507-V514 HydrophobicContact CB-CG1 3.89Å; N507-T516 VanDerWaalsContact OD1-CA 3.27Å; N507-T516 WeakPolarHBondContact OD1-CA 3.12Å; N507-T516 VanDerWaalsContact OD1-CB 3.23Å; N507-T516 WeakPolarHBondContact OD1-CB 3.42Å; N507-T516 WeakPolarHBondContact OD1-CG2 3.42Å; N507-T516 PolarHBondContact OD1-OG1 2.92Å; N507-L552 PolarHBondContact ND2-O 3.43Å; N507-L552 PolarHBondContact OD1-O 3.21Å; N507-L554 HydrophobicContact CB-CD1 4.41Å
508	K	93.4	Very high	91	Very high	28 Å²	28	37.3 Å²	37.3	12%	0.122	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	142.2	178.1	175	173.6	176.3	126.2	0	110.9	L477 E478 D479 V510 K515 Y517	L477-K508 HydrophobicContact CD1-CD 4.05Å; E478-K508 WeakPolarHBondContact O-CD 3.46Å; E478-K508 VanDerWaalsContact O-CE 3.25Å; E478-K508 WeakPolarHBondContact O-CE 3.32Å; E478-K508 WeakPolarHBondContact O-CG 3.14Å; E478-K508 PolarHBondContact O-NZ 2.92Å; E478-K508 IonicContact OE2-NZ 2.62Å; E478-K508 PolarHBondContact OE2-NZ 2.91Å; D479-K508 HydrophobicContact CB-CG 4.43Å; D479-K508 CarbonylContact O-C 3.54Å; D479-K508 WeakPolarHBondContact O-CA 3.29Å; K508-V510 HydrophobicContact CD-CG2 4Å; K508-V510 HydrophobicContact CG-CG2 3.85Å; K508-K515 PolarHBondContact N-O 2.85Å; K508-K515 PolarHBondContact O-N 2.98Å; K508-Y517 HydrophobicContact CB-CD2 3.98Å; K508-Y517 HydrophobicContact CB-CE2 4Å
509	V	91.9	Very high	91.3	Very high	46 Å²	46	35.7 Å²	35.7	28%	0.279	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	123.4	166.9	-172.5	0	0	0	0	109.5	D479 V481 Q513	D479-V509 HydrophobicContact CB-CB 4.49Å; D479-V509 PolarHBondContact O-N 2.91Å; V481-V509 HydrophobicContact CG2-CG2 3.71Å; V509-Q513 CarbonylContact C-O 3.54Å; V509-Q513 WeakPolarHBondContact CA-O 3.41Å
510	V	90.6	Very high	91.6	Very high	39 Å²	39	34.6 Å²	34.6	24%	0.236	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	119.7	176.2	-175.4	0	0	0	0	108.2	K508 N512 Q513 K515 Y517	K508-V510 HydrophobicContact CD-CG2 4Å; K508-V510 HydrophobicContact CG-CG2 3.85Å; V510-N512 PolarHBondContact O-N 3.22Å; V510-Q513 PolarHBondContact N-O 2.74Å; V510-Q513 WeakPolarHBondContact O-CA 3.02Å; V510-Q513 WeakPolarHBondContact O-CB 3.42Å; V510-Q513 PolarHBondContact O-N 3.07Å; V510-K515 HydrophobicContact CB-CD 4.47Å; V510-Y517 HydrophobicContact CG2-CE2 4.34Å
511	E	87.9	Confident	91.7	Very high	179 Å²	179	36 Å²	36	84%	0.836	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	37.3	-177.8	-59.1	-175	154.4	0	0	113.6	Q513	E511-Q513 PolarHBondContact O-N 3.38Å
512	N	87.3	Confident	91.9	Very high	154 Å²	154	31.4 Å²	31.4	82%	0.824	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.2	15.3	-174	-152.2	105.6	0	0	0	114.5	V510	V510-N512 PolarHBondContact O-N 3.22Å
513	Q	91.4	Very high	92.1	Very high	47 Å²	47	31.5 Å²	31.5	22%	0.22	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	139.8	169.7	-54.6	-162.8	-72.8	0	0	110.6	V509 V510 E511 K515 E585	V509-Q513 CarbonylContact C-O 3.54Å; V509-Q513 WeakPolarHBondContact CA-O 3.41Å; V510-Q513 PolarHBondContact N-O 2.74Å; V510-Q513 WeakPolarHBondContact O-CA 3.02Å; V510-Q513 WeakPolarHBondContact O-CB 3.42Å; V510-Q513 PolarHBondContact O-N 3.07Å; E511-Q513 PolarHBondContact O-N 3.38Å; Q513-K515 VanDerWaalsContact OE1-NZ 3.15Å; Q513-E585 HydrophobicContact CB-CB 4.01Å; Q513-E585 PolarHBondContact NE2-OE2 2.95Å
514	V	93.4	Very high	91.8	Very high	40 Å²	40	34.2 Å²	34.2	24%	0.242	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	124.8	172.9	176.6	0	0	0	0	109.7	V481 N507 E585 L586	V481-V514 HydrophobicContact CG2-CB 4.44Å; V481-V514 HydrophobicContact CG2-CG1 3.83Å; V481-V514 HydrophobicContact CG2-CG2 3.81Å; N507-V514 HydrophobicContact CB-CG1 3.89Å; V514-E585 CarbonylContact O-C 3.52Å; V514-E585 WeakPolarHBondContact O-CA 3.32Å; V514-L586 HydrophobicContact CB-CB 4.07Å; V514-L586 HydrophobicContact CG1-CB 3.85Å; V514-L586 HydrophobicContact CG1-CD2 3.93Å; V514-L586 PolarHBondContact O-N 2.86Å
515	K	95.3	Very high	91.6	Very high	20 Å²	20	35.5 Å²	35.5	9%	0.087	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	131.2	-179.4	-65.9	-178.6	177.6	172.2	0	111.1	K508 V510 Q513 Y517 L528 P584	K508-K515 PolarHBondContact N-O 2.85Å; K508-K515 PolarHBondContact O-N 2.98Å; V510-K515 HydrophobicContact CB-CD 4.47Å; Q513-K515 VanDerWaalsContact OE1-NZ 3.15Å; K515-Y517 HydrophobicContact CB-CE2 3.88Å; K515-Y517 WeakPolarHBondContact O-CD2 3.37Å; K515-L528 HydrophobicContact CB-CD2 4.11Å; K515-P584 WeakPolarHBondContact CE-O 3.46Å
516	T	96.8	Very high	91.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	130.5	176.7	-43.9	0	0	0	0	111.8	S506 N507 L529 H551 L552 L554	S506-T516 WeakPolarHBondContact O-CA 3.11Å; N507-T516 VanDerWaalsContact OD1-CA 3.27Å; N507-T516 WeakPolarHBondContact OD1-CA 3.12Å; N507-T516 VanDerWaalsContact OD1-CB 3.23Å; N507-T516 WeakPolarHBondContact OD1-CB 3.42Å; N507-T516 WeakPolarHBondContact OD1-CG2 3.42Å; N507-T516 PolarHBondContact OD1-OG1 2.92Å; T516-L529 HydrophobicContact CG2-CD1 3.68Å; T516-L529 HydrophobicContact CG2-CG 4.37Å; T516-H551 PolarHBondContact N-ND1 3.24Å; T516-H551 VanDerWaalsContact N-ND1 3.14Å; T516-H551 VanDerWaalsContact OG1-CA 3.29Å; T516-H551 WeakPolarHBondContact OG1-CA 3.07Å; T516-L552 HydrophobicContact CG2-CB 4.28Å; T516-L552 PolarHBondContact OG1-N 3.06Å; T516-L554 HydrophobicContact CG2-CD1 4.41Å; T516-L554 HydrophobicContact CG2-CD2 4.43Å
517	Y	96.1	Very high	91.3	Very high	41 Å²	41	40.8 Å²	40.8	16%	0.161	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	154.1	174.3	-69.7	-99.6	0	0	0	111	L505 S506 K508 V510 K515 W526 H527 L528	L505-Y517 CarbonylContact C-O 3.53Å; L505-Y517 VanDerWaalsContact CA-O 3.31Å; L505-Y517 WeakPolarHBondContact CA-O 3.44Å; S506-Y517 PolarHBondContact N-O 3.41Å; S506-Y517 PolarHBondContact O-N 3.32Å; K508-Y517 HydrophobicContact CB-CD2 3.98Å; K508-Y517 HydrophobicContact CB-CE2 4Å; V510-Y517 HydrophobicContact CG2-CE2 4.34Å; K515-Y517 HydrophobicContact CB-CE2 3.88Å; K515-Y517 WeakPolarHBondContact O-CD2 3.37Å; Y517-W526 HydrophobicContact CD1-CB 4.2Å; Y517-H527 CarbonylContact C-O 3.56Å; Y517-H527 VanDerWaalsContact CA-O 3.25Å; Y517-H527 WeakPolarHBondContact CA-O 3.28Å; Y517-L528 HydrophobicContact CD1-CD2 4.1Å; Y517-L528 HydrophobicContact CD1-CG 4.3Å; Y517-L528 HydrophobicContact CD2-CD2 4.26Å; Y517-L528 HydrophobicContact CE1-CD2 3.66Å; Y517-L528 HydrophobicContact CE1-CG 3.78Å; Y517-L528 HydrophobicContact CE2-CD2 3.82Å; Y517-L528 HydrophobicContact CG-CD2 4.37Å; Y517-L528 VanDerWaalsContact CZ-CD2 3.5Å
518	I	95.9	Very high	91.3	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.026	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	144.9	170.5	-169.1	164.9	0	0	0	110.5	V503 F504 L505 Y520 W526 H527 L529	V503-I518 HydrophobicContact CG1-CD1 4.14Å; V503-I518 HydrophobicContact CG1-CG1 4.24Å; F504-I518 WeakPolarHBondContact O-CA 3.41Å; F504-I518 WeakPolarHBondContact O-CG1 3.41Å; L505-I518 HydrophobicContact CD1-CD1 4.25Å; L505-I518 HydrophobicContact CD1-CG1 4.46Å; L505-I518 HydrophobicContact CG-CB 4.36Å; L505-I518 HydrophobicContact CG-CD1 4.21Å; L505-I518 HydrophobicContact CG-CG1 4.14Å; I518-Y520 HydrophobicContact CD1-CE1 4.25Å; I518-Y520 HydrophobicContact CD1-CE2 4.36Å; I518-Y520 HydrophobicContact CG1-CE2 4.33Å; I518-Y520 HydrophobicContact CG2-CE2 4.11Å; I518-W526 WeakPolarHBondContact O-CA 3.41Å; I518-H527 PolarHBondContact N-O 2.57Å; I518-H527 PolarHBondContact O-N 2.84Å; I518-L529 HydrophobicContact CB-CD2 3.79Å; I518-L529 HydrophobicContact CD1-CD2 4.31Å; I518-L529 HydrophobicContact CG2-CD2 3.75Å
519	T	93.3	Very high	91.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	145.3	169.7	-177.5	0	0	0	0	109.5	V503 F504 N521 G523 D525 W526	V503-T519 VanDerWaalsContact CA-O 3.28Å; V503-T519 WeakPolarHBondContact CA-O 3.03Å; V503-T519 WeakPolarHBondContact CG1-O 3.44Å; F504-T519 HydrophobicContact CB-CG2 3.73Å; F504-T519 HydrophobicContact CD2-CG2 4.03Å; F504-T519 HydrophobicContact CG-CG2 4.37Å; F504-T519 PolarHBondContact N-O 3.08Å; F504-T519 VanDerWaalsContact N-O 3.12Å; F504-T519 PolarHBondContact O-N 2.75Å; T519-N521 PolarHBondContact OG1-N 2.99Å; T519-N521 PolarHBondContact OG1-OD1 3.3Å; T519-N521 VanDerWaalsContact OG1-OD1 3.07Å; T519-G523 WeakPolarHBondContact OG1-CA 3.46Å; T519-G523 PolarHBondContact OG1-N 3.43Å; T519-G523 VanDerWaalsContact OG1-N 3.07Å; T519-D525 WeakPolarHBondContact CA-O 3.37Å; T519-D525 WeakPolarHBondContact CB-O 3.43Å; T519-D525 PolarHBondContact OG1-O 3.49Å; T519-W526 HydrophobicContact CG2-CD2 4.16Å; T519-W526 HydrophobicContact CG2-CE3 3.92Å; T519-W526 HydrophobicContact CG2-CH2 3.67Å; T519-W526 HydrophobicContact CG2-CZ2 3.91Å; T519-W526 HydrophobicContact CG2-CZ3 3.66Å
520	Y	90.8	Very high	91.5	Very high	11 Å²	11	42 Å²	42	4%	0.043	20%	0.204	C	C	.	.	S	Bend	trans	-112.3	-5.6	172.7	-61.2	-90	0	0	0	113	G502 V503 I518 A599 G600 N601 N710 I716	G502-Y520 CarbonylContact O-C 3.59Å; V503-Y520 HydrophobicContact CG1-CD1 4.01Å; V503-Y520 HydrophobicContact CG1-CE1 4.23Å; V503-Y520 HydrophobicContact CG2-CD1 3.81Å; I518-Y520 HydrophobicContact CD1-CE1 4.25Å; I518-Y520 HydrophobicContact CD1-CE2 4.36Å; I518-Y520 HydrophobicContact CG1-CE2 4.33Å; I518-Y520 HydrophobicContact CG2-CE2 4.11Å; Y520-A599 HydrophobicContact CE1-CB 4.42Å; Y520-A599 WeakPolarHBondContact CE1-O 3.48Å; Y520-A599 PolarHBondContact OH-O 2.89Å; Y520-G600 VanDerWaalsContact OH-C 3.3Å; Y520-N601 PolarHBondContact OH-N 2.98Å; Y520-N710 HydrophobicContact CD2-CB 3.93Å; Y520-N710 VanDerWaalsContact CD2-CG 3.44Å; Y520-N710 WeakPolarHBondContact CD2-OD1 3.4Å; Y520-N710 HydrophobicContact CE2-CB 4.32Å; Y520-N710 WeakPolarHBondContact CE2-OD1 3.39Å; Y520-N710 HydrophobicContact CG-CB 4.11Å; Y520-I716 VanDerWaalsContact O-CG2 3.26Å; Y520-I716 WeakPolarHBondContact O-CG2 3.34Å
521	N	86.8	Confident	91.7	Very high	31 Å²	31	41.1 Å²	41.1	17%	0.166	20%	0.2	C	C	.	.	S	Bend	trans	-122.3	45.9	-174.5	65.2	-4.9	0	0	0	112	T519 G523 R524 D525 M717	T519-N521 PolarHBondContact OG1-N 2.99Å; T519-N521 PolarHBondContact OG1-OD1 3.3Å; T519-N521 VanDerWaalsContact OG1-OD1 3.07Å; N521-G523 VanDerWaalsContact C-N 3.26Å; N521-G523 PolarHBondContact O-N 3.21Å; N521-R524 PolarHBondContact O-N 2.63Å; N521-R524 PolarHBondContact OD1-N 2.74Å; N521-D525 PolarHBondContact ND2-OD2 3.41Å; N521-D525 PolarHBondContact OD1-N 2.91Å; N521-D525 PolarHBondContact OD1-O 2.98Å; N521-M717 HydrophobicContact CB-SD 4.42Å
522	K	86.1	Confident	92	Very high	9 Å²	9	32.9 Å²	32.9	4%	0.039	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	34.8	176.2	-148.7	173.3	-174.1	174.6	0	114	E445 Q447 M465 G502 F504 M717	E445-K522 IonicContact OE2-NZ 3.32Å; E445-K522 PolarHBondContact OE2-NZ 3.41Å; Q447-K522 VanDerWaalsContact OE1-CE 3.27Å; M465-K522 WeakPolarHBondContact CE-O 3.09Å; M465-K522 HydrophobicContact SD-CD 4.14Å; M465-K522 HydrophobicContact SD-CG 4.06Å; G502-K522 WeakPolarHBondContact O-CA 3.4Å; G502-K522 PolarHBondContact O-N 2.91Å; F504-K522 HydrophobicContact CE2-CG 3.92Å; K522-M717 HydrophobicContact CB-CE 3.98Å; K522-M717 HydrophobicContact CB-SD 4.27Å; K522-M717 HydrophobicContact CD-CE 4.33Å
523	G	86.6	Confident	92.1	Very high	3 Å²	3	30.7 Å²	30.7	3%	0.031	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.9	13.2	172.8	0	0	0	0	0	116.1	T519 N521 W526	T519-G523 WeakPolarHBondContact OG1-CA 3.46Å; T519-G523 PolarHBondContact OG1-N 3.43Å; T519-G523 VanDerWaalsContact OG1-N 3.07Å; N521-G523 VanDerWaalsContact C-N 3.26Å; N521-G523 PolarHBondContact O-N 3.21Å; G523-W526 PolarHBondContact O-NE1 3.17Å
524	R	85.6	Confident	92.1	Very high	57 Å²	57	31.6 Å²	31.6	22%	0.215	16%	0.163	C	C	.	.	S	Bend	trans	-79.8	-40.6	175.6	-179.9	-160	123.8	140	1	112.9	N521 E751 A752 F754 R762	N521-R524 PolarHBondContact O-N 2.63Å; N521-R524 PolarHBondContact OD1-N 2.74Å; R524-E751 PolarHBondContact NH1-O 3.24Å; R524-A752 PolarHBondContact NH1-O 3.2Å; R524-F754 PolarHBondContact NH1-O 2.84Å; R524-R762 PolarHBondContact O-NH1 2.61Å
525	D	87.8	Confident	91.8	Very high	35 Å²	35	31.6 Å²	31.6	19%	0.187	16%	0.162	C	C	.	.	S	Bend	trans	-125.4	136.3	176.2	-67.9	-81.2	0	0	0	109.5	T519 N521 R762	T519-D525 WeakPolarHBondContact CA-O 3.37Å; T519-D525 WeakPolarHBondContact CB-O 3.43Å; T519-D525 PolarHBondContact OG1-O 3.49Å; N521-D525 PolarHBondContact ND2-OD2 3.41Å; N521-D525 PolarHBondContact OD1-N 2.91Å; N521-D525 PolarHBondContact OD1-O 2.98Å; D525-R762 VanDerWaalsContact CG-NH1 3.31Å; D525-R762 IonicContact OD1-CZ 2.73Å; D525-R762 IonicContact OD1-NH1 2.66Å; D525-R762 PolarHBondContact OD1-NH1 2.9Å; D525-R762 IonicContact OD1-NH2 3.13Å; D525-R762 PolarHBondContact OD1-NH2 2.91Å; D525-R762 IonicContact OD2-NH1 2.75Å; D525-R762 IonicContact OD2-NH2 3.17Å
526	W	92.3	Very high	91.5	Very high	39 Å²	39	33.9 Å²	33.9	15%	0.148	18%	0.175	C	C	.	.			trans	-129.8	134	-175.8	-67.6	91.9	0	0	0	110.5	M476 L477 L494 F504 Y517 I518 T519 G523	M476-W526 HydrophobicContact CE-CZ2 4.07Å; M476-W526 HydrophobicContact CG-CZ2 4.36Å; M476-W526 PolarHBondContact O-NE1 3.32Å; L477-W526 HydrophobicContact CB-CZ2 4.05Å; L477-W526 HydrophobicContact CD1-CD2 4.3Å; L477-W526 HydrophobicContact CD1-CG 4.14Å; L477-W526 HydrophobicContact CD2-CD2 4.08Å; L477-W526 HydrophobicContact CD2-CE3 4.25Å; L477-W526 HydrophobicContact CD2-CH2 4Å; L477-W526 HydrophobicContact CD2-CZ2 3.81Å; L477-W526 HydrophobicContact CD2-CZ3 4.22Å; L477-W526 HydrophobicContact CG-CZ2 4.46Å; L494-W526 HydrophobicContact CD1-CH2 4.11Å; F504-W526 HydrophobicContact CB-CH2 4.1Å; F504-W526 HydrophobicContact CB-CZ3 4.46Å; Y517-W526 HydrophobicContact CD1-CB 4.2Å; I518-W526 WeakPolarHBondContact O-CA 3.41Å; T519-W526 HydrophobicContact CG2-CD2 4.16Å; T519-W526 HydrophobicContact CG2-CE3 3.92Å; T519-W526 HydrophobicContact CG2-CH2 3.67Å; T519-W526 HydrophobicContact CG2-CZ2 3.91Å; T519-W526 HydrophobicContact CG2-CZ3 3.66Å; G523-W526 PolarHBondContact O-NE1 3.17Å
527	H	92.8	Very high	91	Very high	72 Å²	72	39.7 Å²	39.7	33%	0.333	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	147.5	-175.6	-54	-81.3	0	0	0	110.8	Y517 I518	Y517-H527 CarbonylContact C-O 3.56Å; Y517-H527 VanDerWaalsContact CA-O 3.25Å; Y517-H527 WeakPolarHBondContact CA-O 3.28Å; I518-H527 PolarHBondContact N-O 2.57Å; I518-H527 PolarHBondContact O-N 2.84Å
528	L	95.6	Very high	90.5	Very high	19 Å²	19	40.3 Å²	40.3	10%	0.099	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	143.9	172.7	-72.8	172.3	0	0	0	110	K515 Y517 Q530 Q545 P546	K515-L528 HydrophobicContact CB-CD2 4.11Å; Y517-L528 HydrophobicContact CD1-CD2 4.1Å; Y517-L528 HydrophobicContact CD1-CG 4.3Å; Y517-L528 HydrophobicContact CD2-CD2 4.26Å; Y517-L528 HydrophobicContact CE1-CD2 3.66Å; Y517-L528 HydrophobicContact CE1-CG 3.78Å; Y517-L528 HydrophobicContact CE2-CD2 3.82Å; Y517-L528 HydrophobicContact CG-CD2 4.37Å; Y517-L528 VanDerWaalsContact CZ-CD2 3.5Å; L528-Q530 PolarHBondContact O-N 2.64Å; L528-Q545 VanDerWaalsContact C-NE2 3.33Å; L528-Q545 HydrophobicContact CB-CG 4.43Å; L528-Q545 PolarHBondContact O-NE2 2.69Å; L528-P546 HydrophobicContact CD1-CB 4.18Å
529	L	95.7	Very high	90.2	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-65.7	132.9	175.2	-61.8	174.3	0	0	0	111	L505 T516 I518 Q545 S549 L550 L552 W603	L505-L529 HydrophobicContact CD2-CD1 4.29Å; L505-L529 HydrophobicContact CD2-CD2 4.29Å; T516-L529 HydrophobicContact CG2-CD1 3.68Å; T516-L529 HydrophobicContact CG2-CG 4.37Å; I518-L529 HydrophobicContact CB-CD2 3.79Å; I518-L529 HydrophobicContact CD1-CD2 4.31Å; I518-L529 HydrophobicContact CG2-CD2 3.75Å; L529-Q545 VanDerWaalsContact C-NE2 3.29Å; L529-Q545 PolarHBondContact O-NE2 3.04Å; L529-S549 WeakPolarHBondContact O-CB 3.38Å; L529-L550 HydrophobicContact CB-CB 3.88Å; L529-L550 HydrophobicContact CB-CG 4.44Å; L529-L550 WeakPolarHBondContact CB-O 3.48Å; L529-L550 HydrophobicContact CD1-CD2 4.4Å; L529-L550 HydrophobicContact CD1-CG 4.28Å; L529-L550 PolarHBondContact O-N 2.92Å; L529-L552 HydrophobicContact CD1-CD1 3.52Å; L529-L552 HydrophobicContact CD1-CG 3.73Å; L529-W603 HydrophobicContact CD2-CZ2 4.17Å
530	Q	93.4	Very high	90.1	Very high	81 Å²	81	50.6 Å²	50.6	38%	0.379	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-69.1	133	173.2	-63.6	-60.4	-13.6	0	0	110.1	L528	L528-Q530 PolarHBondContact O-N 2.64Å
531	A	94.2	Very high	90.1	Very high	19 Å²	19	51.9 Å²	51.9	16%	0.157	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-69.9	149.7	175.5	0	0	0	0	0	111.2	C543 V582	A531-C543 HydrophobicContact CB-CB 3.75Å; A531-C543 VanDerWaalsContact CB-SG 3.56Å; A531-V582 HydrophobicContact CB-CG1 3.86Å
532	P	94.5	Very high	90.2	Very high	6 Å²	6	59.5 Å²	59.5	4%	0.039	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-58.9	141.8	171.9	27.5	-36.2	0	0	0	110.4	T534 V541 V582 F594 W603	P532-T534 VanDerWaalsContact C-N 3.3Å; P532-T534 PolarHBondContact O-N 3.41Å; P532-V541 WeakPolarHBondContact O-CB 3.39Å; P532-V582 HydrophobicContact CG-CG2 4.04Å; P532-F594 HydrophobicContact CG-CD1 4.34Å; P532-F594 HydrophobicContact CG-CE1 4.01Å; P532-W603 WeakPolarHBondContact CA-O 3.28Å; P532-W603 WeakPolarHBondContact CB-O 3.38Å
533	T	90.5	Very high	90.5	Very high	109 Å²	109	60.3 Å²	60.3	67%	0.669	31%	0.313	S	S	*	.	S	Bend	trans	-73.2	-23	-178.4	51.5	0	0	0	0	113.3	K540 V541	T533-K540 WeakPolarHBondContact O-CA 3.49Å; T533-V541 PolarHBondContact O-N 3.16Å
534	T	90.9	Very high	90.7	Very high	65 Å²	65	67.2 Å²	67.2	40%	0.399	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-140	149.7	179.5	54.2	0	0	0	0	112.2	P532 N539	P532-T534 VanDerWaalsContact C-N 3.3Å; P532-T534 PolarHBondContact O-N 3.41Å; T534-N539 CarbonylContact C-O 3.36Å; T534-N539 WeakPolarHBondContact CA-O 3.46Å; T534-N539 WeakPolarHBondContact CB-O 3.3Å
535	D	87.9	Confident	90.9	Very high	41 Å²	41	67.8 Å²	67.8	22%	0.219	35%	0.35	C	S	.	.			trans	-79.5	176.6	171.1	67.9	17.3	0	0	0	112.5	Q537 G538 N539 V541	D535-Q537 PolarHBondContact O-N 3.37Å; D535-Q537 VanDerWaalsContact O-N 3.09Å; D535-Q537 VanDerWaalsContact OD1-C 3.27Å; D535-Q537 VanDerWaalsContact OD1-CA 3.29Å; D535-Q537 WeakPolarHBondContact OD1-CA 3.45Å; D535-Q537 WeakPolarHBondContact OD1-CB 3.33Å; D535-Q537 PolarHBondContact OD1-N 2.87Å; D535-G538 PolarHBondContact O-N 2.76Å; D535-G538 PolarHBondContact OD1-N 3.43Å; D535-N539 PolarHBondContact N-O 3.12Å; D535-N539 PolarHBondContact OD1-N 3.1Å; D535-N539 PolarHBondContact OD1-ND2 3.19Å; D535-N539 WeakPolarHBondContact OD2-CB 3.15Å; D535-N539 PolarHBondContact OD2-ND2 2.86Å; D535-V541 HydrophobicContact CB-CG2 4.29Å
536	L	87.3	Confident	91	Very high	67 Å²	67	69.9 Å²	69.9	35%	0.351	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-15.6	174.2	-71.9	-179.4	0	0	0	115.5	E605 Q608	L536-E605 HydrophobicContact CD1-CG 4.16Å; L536-E605 HydrophobicContact CD2-CB 4.17Å; L536-E605 HydrophobicContact CD2-CG 4.18Å; L536-E605 WeakPolarHBondContact CD2-O 3.09Å; L536-E605 HydrophobicContact CG-CB 4.13Å; L536-E605 HydrophobicContact CG-CG 3.78Å; L536-E605 PolarHBondContact N-OE2 3.34Å; L536-Q608 HydrophobicContact CD1-CB 4.43Å; L536-Q608 HydrophobicContact CD1-CG 3.83Å
537	Q	86.8	Confident	90.9	Very high	123 Å²	123	77.2 Å²	77.2	58%	0.575	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-0.6	176.7	-70.7	78.6	67.5	0	0	112.3	D535 N539	D535-Q537 PolarHBondContact O-N 3.37Å; D535-Q537 VanDerWaalsContact O-N 3.09Å; D535-Q537 VanDerWaalsContact OD1-C 3.27Å; D535-Q537 VanDerWaalsContact OD1-CA 3.29Å; D535-Q537 WeakPolarHBondContact OD1-CA 3.45Å; D535-Q537 WeakPolarHBondContact OD1-CB 3.33Å; D535-Q537 PolarHBondContact OD1-N 2.87Å; Q537-N539 VanDerWaalsContact C-N 3.33Å; Q537-N539 WeakPolarHBondContact CB-ND2 3.47Å
538	G	86.2	Confident	90.9	Very high	54 Å²	54	75 Å²	75	56%	0.557	39%	0.386	S	S	*	.	S	Bend	trans	79.6	8.6	-178.2	0	0	0	0	0	114.5	D535	D535-G538 PolarHBondContact O-N 2.76Å; D535-G538 PolarHBondContact OD1-N 3.43Å
539	N	89.9	Confident	90.9	Very high	94 Å²	94	74.2 Å²	74.2	50%	0.503	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-72.9	146.9	172.9	-47.4	-70.5	0	0	0	109.5	T534 D535 Q537 V541	T534-N539 CarbonylContact C-O 3.36Å; T534-N539 WeakPolarHBondContact CA-O 3.46Å; T534-N539 WeakPolarHBondContact CB-O 3.3Å; D535-N539 PolarHBondContact N-O 3.12Å; D535-N539 PolarHBondContact OD1-N 3.1Å; D535-N539 PolarHBondContact OD1-ND2 3.19Å; D535-N539 WeakPolarHBondContact OD2-CB 3.15Å; D535-N539 PolarHBondContact OD2-ND2 2.86Å; Q537-N539 VanDerWaalsContact C-N 3.33Å; Q537-N539 WeakPolarHBondContact CB-ND2 3.47Å; N539-V541 PolarHBondContact O-N 3.49Å
540	K	90.1	Very high	91	Very high	127 Å²	127	74.1 Å²	74.1	55%	0.552	38%	0.382	S	S	*	.	B	Isolated β-bridge	trans	-68.9	127.1	175.3	-170.7	-173.3	175.7	-170.1	0	110.5	T533 Y542	T533-K540 WeakPolarHBondContact O-CA 3.49Å; K540-Y542 HydrophobicContact CB-CE2 4.17Å; K540-Y542 HydrophobicContact CD-CE1 4.27Å; K540-Y542 HydrophobicContact CG-CE2 4.47Å; K540-Y542 VanDerWaalsContact O-CD2 3.26Å; K540-Y542 WeakPolarHBondContact O-CD2 3.44Å; K540-Y542 WeakPolarHBondContact O-CE2 3.16Å
541	V	90.3	Very high	91.1	Very high	38 Å²	38	70.3 Å²	70.3	23%	0.23	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-78.2	133.5	169.4	178.5	0	0	0	0	109.4	P532 T533 D535 N539 C543 V582	P532-V541 WeakPolarHBondContact O-CB 3.39Å; T533-V541 PolarHBondContact O-N 3.16Å; D535-V541 HydrophobicContact CB-CG2 4.29Å; N539-V541 PolarHBondContact O-N 3.49Å; V541-C543 HydrophobicContact CG1-CB 3.89Å; V541-V582 HydrophobicContact CG1-CG1 4.24Å
542	Y	89.4	Confident	91.2	Very high	191 Å²	191	69.4 Å²	69.4	75%	0.749	36%	0.356	S	S	*	.			trans	-107.8	83.6	177.6	-69.2	-93	0	0	0	109.5	K540	K540-Y542 HydrophobicContact CB-CE2 4.17Å; K540-Y542 HydrophobicContact CD-CE1 4.27Å; K540-Y542 HydrophobicContact CG-CE2 4.47Å; K540-Y542 VanDerWaalsContact O-CD2 3.26Å; K540-Y542 WeakPolarHBondContact O-CD2 3.44Å; K540-Y542 WeakPolarHBondContact O-CE2 3.16Å
543	C	92.4	Very high	91	Very high	26 Å²	26	70.7 Å²	70.7	18%	0.176	36%	0.362	C	S	.	.			trans	-136.5	116.8	-177.9	-176.3	0	0	0	0	108	A531 V541 C548 S549 V582	A531-C543 HydrophobicContact CB-CB 3.75Å; A531-C543 VanDerWaalsContact CB-SG 3.56Å; V541-C543 HydrophobicContact CG1-CB 3.89Å; C543-C548 VanDerWaalsContact CA-SG 3.57Å; C543-C548 HydrophobicContact CB-CB 4Å; C543-C548 WeakPolarHBondContact CB-SG 3.27Å; C543-C548 WeakPolarHBondContact SG-CB 3.43Å; C543-C548 CovalentContact SG-SG 2.03Å; C543-C548 PolarHBondContact SG-SG 3.32Å; C543-S549 PolarHBondContact SG-N 2.95Å; C543-V582 HydrophobicContact CB-CG1 3.97Å; C543-V582 WeakPolarHBondContact SG-CG1 3.47Å
544	E	90.9	Very high	91.1	Very high	148 Å²	148	65.9 Å²	65.9	69%	0.692	33%	0.332	S	S	*	.			trans	-126.8	130.6	-175.4	-66.2	-177.5	178.5	0	0	110.3	Y547 C548	E544-Y547 PolarHBondContact O-N 2.72Å; E544-C548 CarbonylContact C-O 3.55Å; E544-C548 PolarHBondContact O-N 3.11Å
545	Q	90.8	Very high	90.6	Very high	69 Å²	69	66.8 Å²	66.8	32%	0.322	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	149.8	179	-64.7	-175.9	-10.6	0	0	110.9	L528 L529 C548	L528-Q545 VanDerWaalsContact C-NE2 3.33Å; L528-Q545 HydrophobicContact CB-CG 4.43Å; L528-Q545 PolarHBondContact O-NE2 2.69Å; L529-Q545 VanDerWaalsContact C-NE2 3.29Å; L529-Q545 PolarHBondContact O-NE2 3.04Å; Q545-C548 WeakPolarHBondContact CA-O 3.35Å; Q545-C548 PolarHBondContact N-O 2.62Å
546	P	89.1	Confident	90.2	Very high	78 Å²	78	68.1 Å²	68.1	51%	0.506	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	cis	-91	4.7	3.4	37.8	-37.2	0	0	0	114.2	L528	L528-P546 HydrophobicContact CD1-CB 4.18Å
547	Y	89.6	Confident	89.2	Confident	194 Å²	194	67.1 Å²	67.1	76%	0.761	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-24.8	-175.3	-58.4	-72.3	0	0	0	113.4	E544 P584	E544-Y547 PolarHBondContact O-N 2.72Å; Y547-P584 WeakPolarHBondContact O-CA 3.49Å; Y547-P584 WeakPolarHBondContact O-CB 3.49Å
548	C	93.8	Very high	88.2	Confident	26 Å²	26	67.7 Å²	67.7	18%	0.176	34%	0.342	C	S	.	.	S	Bend	trans	-141.3	140.7	176.8	-177.6	0	0	0	0	110.3	C543 E544 Q545 G583	C543-C548 VanDerWaalsContact CA-SG 3.57Å; C543-C548 HydrophobicContact CB-CB 4Å; C543-C548 WeakPolarHBondContact CB-SG 3.27Å; C543-C548 WeakPolarHBondContact SG-CB 3.43Å; C543-C548 CovalentContact SG-SG 2.03Å; C543-C548 PolarHBondContact SG-SG 3.32Å; E544-C548 CarbonylContact C-O 3.55Å; E544-C548 PolarHBondContact O-N 3.11Å; Q545-C548 WeakPolarHBondContact CA-O 3.35Å; Q545-C548 PolarHBondContact N-O 2.62Å; C548-G583 WeakPolarHBondContact CA-O 3.45Å
549	S	95.9	Very high	87.5	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.007	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	174.8	-179	24.9	0	0	0	0	110.9	L529 C543 H551 G583	L529-S549 WeakPolarHBondContact O-CB 3.38Å; C543-S549 PolarHBondContact SG-N 2.95Å; S549-H551 PolarHBondContact OG-CE1 3.24Å; S549-H551 PolarHBondContact OG-NE2 2.72Å; S549-H551 VanDerWaalsContact OG-NE2 3.13Å; S549-G583 PolarHBondContact N-O 2.98Å; S549-G583 PolarHBondContact O-N 3.32Å; S549-G583 VanDerWaalsContact O-O 3.12Å
550	L	96.3	Very high	86.5	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	137.4	164.9	175.7	64	0	0	0	109.8	L529 L552 V582 F594 W603	L529-L550 HydrophobicContact CB-CB 3.88Å; L529-L550 HydrophobicContact CB-CG 4.44Å; L529-L550 WeakPolarHBondContact CB-O 3.48Å; L529-L550 HydrophobicContact CD1-CD2 4.4Å; L529-L550 HydrophobicContact CD1-CG 4.28Å; L529-L550 PolarHBondContact O-N 2.92Å; L550-L552 HydrophobicContact CD1-CD2 3.98Å; L550-L552 HydrophobicContact CD2-CD2 4.12Å; L550-L552 HydrophobicContact CG-CD2 3.93Å; L550-L552 HydrophobicContact CG-CG 4.38Å; L550-V582 HydrophobicContact CD1-CG2 3.87Å; L550-F594 HydrophobicContact CD1-CD1 3.97Å; L550-F594 HydrophobicContact CD1-CD2 3.73Å; L550-F594 HydrophobicContact CD1-CE1 4.09Å; L550-F594 HydrophobicContact CD1-CE2 3.86Å; L550-F594 HydrophobicContact CD1-CG 3.79Å; L550-F594 HydrophobicContact CD1-CZ 4.04Å; L550-F594 HydrophobicContact CD2-CB 4.4Å; L550-F594 HydrophobicContact CD2-CG 4.41Å; L550-W603 HydrophobicContact CD2-CB 3.75Å; L550-W603 HydrophobicContact CD2-CD2 3.49Å; L550-W603 VanDerWaalsContact CD2-CD2 3.49Å; L550-W603 HydrophobicContact CD2-CE3 3.89Å; L550-W603 HydrophobicContact CD2-CG 3.41Å; L550-W603 VanDerWaalsContact CD2-CG 3.41Å
551	H	96.1	Very high	85.9	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	135.8	177.9	-63.4	-41.4	0	0	0	110.6	T516 S549 G580 V581 G583 L586	T516-H551 PolarHBondContact N-ND1 3.24Å; T516-H551 VanDerWaalsContact N-ND1 3.14Å; T516-H551 VanDerWaalsContact OG1-CA 3.29Å; T516-H551 WeakPolarHBondContact OG1-CA 3.07Å; S549-H551 PolarHBondContact OG-CE1 3.24Å; S549-H551 PolarHBondContact OG-NE2 2.72Å; S549-H551 VanDerWaalsContact OG-NE2 3.13Å; H551-G580 CarbonylContact O-C 3.58Å; H551-G580 WeakPolarHBondContact O-CA 3.39Å; H551-V581 HydrophobicContact CB-CG1 4.42Å; H551-V581 PolarHBondContact N-O 3.21Å; H551-V581 PolarHBondContact O-N 3.23Å; H551-G583 PolarHBondContact NE2-O 2.85Å; H551-L586 HydrophobicContact CB-CB 4.03Å; H551-L586 HydrophobicContact CB-CD1 3.93Å
552	L	95.6	Very high	85.2	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	145.6	-168.4	-57	178.4	0	0	0	112	L505 N507 T516 L529 L550 L554 A578 S579 F594 W603	L505-L552 HydrophobicContact CD2-CD1 3.82Å; N507-L552 PolarHBondContact ND2-O 3.43Å; N507-L552 PolarHBondContact OD1-O 3.21Å; T516-L552 HydrophobicContact CG2-CB 4.28Å; T516-L552 PolarHBondContact OG1-N 3.06Å; L529-L552 HydrophobicContact CD1-CD1 3.52Å; L529-L552 HydrophobicContact CD1-CG 3.73Å; L550-L552 HydrophobicContact CD1-CD2 3.98Å; L550-L552 HydrophobicContact CD2-CD2 4.12Å; L550-L552 HydrophobicContact CG-CD2 3.93Å; L550-L552 HydrophobicContact CG-CG 4.38Å; L552-L554 HydrophobicContact CB-CD2 4.07Å; L552-L554 PolarHBondContact O-N 2.85Å; L552-A578 HydrophobicContact CB-CB 4.28Å; L552-A578 HydrophobicContact CD1-CB 3.75Å; L552-A578 HydrophobicContact CD2-CB 3.78Å; L552-A578 HydrophobicContact CG-CB 4.14Å; L552-S579 WeakPolarHBondContact CA-O 3.43Å; L552-F594 HydrophobicContact CD2-CD2 4.46Å; L552-W603 HydrophobicContact CD1-CH2 3.66Å; L552-W603 HydrophobicContact CD1-CZ2 4.05Å; L552-W603 HydrophobicContact CD1-CZ3 4.15Å
553	H	92.1	Very high	84.1	Confident	34 Å²	34	54 Å²	54	16%	0.157	28%	0.282	C	S	.	.			trans	-83.9	106.9	170.3	-67.6	-75.8	0	0	0	108.8	H555 N565 S579 S587	H553-H555 VanDerWaalsContact C-N 3.3Å; H553-H555 PolarHBondContact O-N 2.9Å; H553-N565 HydrophobicContact CB-CB 3.87Å; H553-N565 VanDerWaalsContact O-CB 3.25Å; H553-N565 WeakPolarHBondContact O-CB 3.43Å; H553-S579 PolarHBondContact N-O 3.1Å; H553-S587 PolarHBondContact CE1-O 2.9Å; H553-S587 PolarHBondContact NE2-O 2.79Å
554	L	90.9	Very high	83.5	Confident	7 Å²	7	53.8 Å²	53.8	4%	0.037	28%	0.284	C	S	.	.			trans	-85.3	1.6	-170.6	-60	-179.6	0	0	0	114.4	D493 L505 S506 N507 T516 L552 V556 I566	D493-L554 HydrophobicContact CB-CD1 4.49Å; L505-L554 HydrophobicContact CB-CD1 4.18Å; L505-L554 HydrophobicContact CB-CD2 3.89Å; L505-L554 HydrophobicContact CD2-CD2 4.34Å; S506-L554 VanDerWaalsContact CA-CD1 3.44Å; N507-L554 HydrophobicContact CB-CD1 4.41Å; T516-L554 HydrophobicContact CG2-CD1 4.41Å; T516-L554 HydrophobicContact CG2-CD2 4.43Å; L552-L554 HydrophobicContact CB-CD2 4.07Å; L552-L554 PolarHBondContact O-N 2.85Å; L554-V556 PolarHBondContact O-N 2.78Å; L554-I566 HydrophobicContact CD2-CD1 3.69Å; L554-I566 VanDerWaalsContact O-CG2 3.24Å; L554-I566 WeakPolarHBondContact O-CG2 3.12Å
555	H	82.2	Confident	83.3	Confident	84 Å²	84	49.7 Å²	49.7	39%	0.389	27%	0.266	S	S	.	.			trans	-69.6	111.7	-176.6	-174.3	-87.2	0	0	0	113	H553 N565	H553-H555 VanDerWaalsContact C-N 3.3Å; H553-H555 PolarHBondContact O-N 2.9Å; H555-N565 WeakPolarHBondContact O-CB 3.29Å; H555-N565 PolarHBondContact O-N 2.85Å; H555-N565 VanDerWaalsContact O-N 3.17Å
556	V	77.6	Confident	83.3	Confident	70 Å²	70	46.6 Å²	46.6	42%	0.424	25%	0.252	S	S	.	.			trans	-74	142.9	171.6	-174.6	0	0	0	0	109.5	Y495 L554 I566	Y495-V556 HydrophobicContact CD2-CG2 3.67Å; Y495-V556 HydrophobicContact CE2-CG2 3.65Å; L554-V556 PolarHBondContact O-N 2.78Å; V556-I566 HydrophobicContact CG2-CG2 4.26Å
557	S	67.2	Low	83.4	Confident	46 Å²	46	43.9 Å²	43.9	32%	0.322	23%	0.234	S	C	.	.			trans	-91	130.5	175.3	-164.8	0	0	0	0	111.4	N559	S557-N559 VanDerWaalsContact C-N 3.25Å; S557-N559 PolarHBondContact OG-N 3.43Å
558	E	66.8	Low	83.6	Confident	135 Å²	135	34.9 Å²	34.9	63%	0.631	20%	0.199	S	C	*	.	S	Bend	trans	-69.7	-26	170.9	-58.1	177.4	132.1	0	0	111.7	P560	E558-P560 WeakPolarHBondContact O-CD 3.41Å
559	N	69.9	Low	83.3	Confident	69 Å²	69	37.9 Å²	37.9	37%	0.369	21%	0.209	S	C	.	.			trans	-70.2	113.6	-179.8	176.8	-7.3	0	0	0	111	S557 Y561 A562	S557-N559 VanDerWaalsContact C-N 3.25Å; S557-N559 PolarHBondContact OG-N 3.43Å; N559-Y561 PolarHBondContact O-N 3.5Å; N559-Y561 VanDerWaalsContact O-N 3.1Å; N559-Y561 WeakPolarHBondContact OD1-CB 3.23Å; N559-Y561 WeakPolarHBondContact OD1-CD2 3.4Å; N559-Y561 PolarHBondContact OD1-N 2.88Å; N559-A562 PolarHBondContact O-N 2.74Å
560	P	70.3	Confident	82.9	Confident	62 Å²	62	42 Å²	42	40%	0.403	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-6.3	-175.3	31.9	-37.7	0	0	0	114.4	E558	E558-P560 WeakPolarHBondContact O-CD 3.41Å
561	Y	76.7	Confident	82.3	Confident	33 Å²	33	42.4 Å²	42.4	13%	0.129	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-0.8	179.6	-46.2	-63.1	0	0	0	113.6	V203 N559 V660 L661 F674	V203-Y561 HydrophobicContact CB-CE1 4.23Å; V203-Y561 PolarHBondContact N-OH 2.96Å; V203-Y561 PolarHBondContact O-OH 2.99Å; N559-Y561 PolarHBondContact O-N 3.5Å; N559-Y561 VanDerWaalsContact O-N 3.1Å; N559-Y561 WeakPolarHBondContact OD1-CB 3.23Å; N559-Y561 WeakPolarHBondContact OD1-CD2 3.4Å; N559-Y561 PolarHBondContact OD1-N 2.88Å; Y561-V660 WeakPolarHBondContact CA-O 3.07Å; Y561-V660 PolarHBondContact O-N 3.26Å; Y561-V660 VanDerWaalsContact O-N 3.15Å; Y561-L661 HydrophobicContact CD1-CD1 4.31Å; Y561-L661 HydrophobicContact CE1-CD1 4.35Å; Y561-F674 AromaticContact CD1-CE1 3.63Å; Y561-F674 HydrophobicContact CD1-CE1 3.63Å; Y561-F674 AromaticContact CD1-CZ 3.65Å; Y561-F674 HydrophobicContact CD1-CZ 3.65Å; Y561-F674 HydrophobicContact CD2-CZ 4.11Å; Y561-F674 HydrophobicContact CE1-CE1 4.15Å; Y561-F674 HydrophobicContact CE1-CZ 4.12Å; Y561-F674 HydrophobicContact CG-CE1 4.05Å; Y561-F674 AromaticContact CG-CZ 3.63Å; Y561-F674 HydrophobicContact CG-CZ 3.63Å
562	A	75	Confident	81.9	Confident	34 Å²	34	42.7 Å²	42.7	28%	0.281	24%	0.236	S	C	.	.	S	Bend	trans	-126.4	160.7	179.4	0	0	0	0	0	111.3	N559	N559-A562 PolarHBondContact O-N 2.74Å
563	S	66.7	Low	81.6	Confident	19 Å²	19	42.7 Å²	42.7	13%	0.133	24%	0.236	C	C	.	.			trans	-87.6	-10.5	-176.3	-173.1	0	0	0	0	115.1	S612 V613	S563-S612 VanDerWaalsContact CB-CB 3.5Å; S563-S612 PolarHBondContact N-OG 3Å; S563-V613 PolarHBondContact OG-N 3.22Å; S563-V613 PolarHBondContact OG-O 2.66Å
564	G	79.6	Confident	81.4	Confident	21 Å²	21	41.1 Å²	41.1	22%	0.216	23%	0.229	C	C	.	.			trans	68.9	-179.6	-168	0	0	0	0	0	114.3
565	N	86.9	Confident	81.5	Confident	62 Å²	62	41.1 Å²	41.1	33%	0.332	23%	0.229	S	C	.	.	S	Bend	trans	-82.9	-24.2	179.2	-72.6	-22.5	0	0	0	112.8	H553 H555 A578 S579	H553-N565 HydrophobicContact CB-CB 3.87Å; H553-N565 VanDerWaalsContact O-CB 3.25Å; H553-N565 WeakPolarHBondContact O-CB 3.43Å; H555-N565 WeakPolarHBondContact O-CB 3.29Å; H555-N565 PolarHBondContact O-N 2.85Å; H555-N565 VanDerWaalsContact O-N 3.17Å; N565-A578 CarbonylContact O-C 3.57Å; N565-A578 VanDerWaalsContact O-CA 3.24Å; N565-A578 WeakPolarHBondContact O-CA 3.2Å; N565-S579 WeakPolarHBondContact CB-OG 3.32Å; N565-S579 PolarHBondContact O-N 2.92Å; N565-S579 PolarHBondContact O-OG 2.96Å; N565-S579 PolarHBondContact OD1-OG 2.87Å
566	I	91.9	Very high	82.2	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.015	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	139.5	174.4	-176.1	163.7	0	0	0	110.7	Y495 L505 L554 V556 I576 I577 A578	Y495-I566 HydrophobicContact CD1-CD1 3.67Å; Y495-I566 HydrophobicContact CD1-CG1 4.19Å; Y495-I566 HydrophobicContact CD2-CD1 4.45Å; Y495-I566 HydrophobicContact CD2-CG1 4.45Å; Y495-I566 HydrophobicContact CD2-CG2 3.6Å; Y495-I566 HydrophobicContact CE1-CD1 3.91Å; Y495-I566 HydrophobicContact CE1-CG1 3.97Å; Y495-I566 HydrophobicContact CE2-CG1 4.26Å; Y495-I566 HydrophobicContact CE2-CG2 3.72Å; Y495-I566 HydrophobicContact CG-CD1 3.97Å; Y495-I566 HydrophobicContact CG-CG1 4.42Å; Y495-I566 HydrophobicContact CG-CG2 4.13Å; L505-I566 HydrophobicContact CD2-CD1 4.49Å; L554-I566 HydrophobicContact CD2-CD1 3.69Å; L554-I566 VanDerWaalsContact O-CG2 3.24Å; L554-I566 WeakPolarHBondContact O-CG2 3.12Å; V556-I566 HydrophobicContact CG2-CG2 4.26Å; I566-I576 HydrophobicContact CD1-CG2 4.05Å; I566-I576 HydrophobicContact CG1-CG2 4.08Å; I566-I577 CarbonylContact C-O 3.38Å; I566-I577 WeakPolarHBondContact CA-O 3.47Å; I566-A578 HydrophobicContact CB-CB 4.19Å; I566-A578 HydrophobicContact CD1-CB 4.19Å; I566-A578 HydrophobicContact CG1-CB 4.01Å
567	V	91.3	Very high	83	Confident	21 Å²	21	34 Å²	34	13%	0.127	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	139.7	178.7	64.1	0	0	0	0	112.2	I577 F615	V567-I577 HydrophobicContact CG1-CB 3.93Å; V567-I577 HydrophobicContact CG1-CG1 4.4Å; V567-I577 PolarHBondContact N-O 2.9Å; V567-I577 PolarHBondContact O-N 2.88Å; V567-F615 HydrophobicContact CB-CE2 4.47Å; V567-F615 HydrophobicContact CG1-CE2 3.96Å; V567-F615 HydrophobicContact CG2-CD2 4.41Å; V567-F615 HydrophobicContact CG2-CE2 3.85Å
568	S	92.3	Very high	84.3	Confident	5 Å²	5	32 Å²	32	4%	0.035	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	161.8	170	63.3	0	0	0	0	109	Y495 A498	Y495-S568 PolarHBondContact OH-N 2.91Å; Y495-S568 PolarHBondContact OH-OG 2.95Å; A498-S568 WeakPolarHBondContact CB-OG 3.35Å; A498-S568 PolarHBondContact N-OG 3.33Å; A498-S568 VanDerWaalsContact N-OG 3.07Å
569	K	88.3	Confident	85.6	Confident	89 Å²	89	25.8 Å²	25.8	39%	0.387	15%	0.149	S	C	.	.			trans	-139.3	142.7	175.4	-69	-64.1	172.1	-167.5	0	111.3	T571 A572 F615	K569-T571 VanDerWaalsContact C-N 3.27Å; K569-T571 PolarHBondContact O-N 2.81Å; K569-A572 HydrophobicContact CB-CB 4.47Å; K569-A572 CarbonylContact O-C 3.58Å; K569-A572 WeakPolarHBondContact O-CA 3.41Å; K569-A572 PolarHBondContact O-N 2.85Å; K569-F615 HydrophobicContact CB-CD1 4.45Å; K569-F615 HydrophobicContact CG-CD1 4.41Å; K569-F615 HydrophobicContact CG-CD2 3.96Å; K569-F615 HydrophobicContact CG-CE2 4.25Å; K569-F615 HydrophobicContact CG-CG 4.06Å
570	D	86.4	Confident	86.7	Confident	88 Å²	88	22.5 Å²	22.5	47%	0.471	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-32.7	175.4	58.4	-20.8	0	0	0	113.9	A572 P573	D570-A572 PolarHBondContact O-N 2.86Å; D570-P573 WeakPolarHBondContact O-CD 3.46Å
571	T	84.5	Confident	87.9	Confident	8 Å²	8	20.6 Å²	20.6	5%	0.049	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-14.8	170.4	58.1	0	0	0	0	114.9	K569 Q618 E666 K734	K569-T571 VanDerWaalsContact C-N 3.27Å; K569-T571 PolarHBondContact O-N 2.81Å; T571-Q618 WeakPolarHBondContact CB-O 3.43Å; T571-Q618 HydrophobicContact CG2-CB 4.29Å; T571-Q618 VanDerWaalsContact O-O 3.13Å; T571-Q618 PolarHBondContact OG1-O 2.88Å; T571-E666 HydrophobicContact CG2-CB 3.93Å; T571-E666 HydrophobicContact CG2-CG 3.65Å; T571-E666 VanDerWaalsContact CG2-OE2 3.25Å; T571-E666 WeakPolarHBondContact CG2-OE2 3.3Å; T571-K734 PolarHBondContact O-NZ 3.1Å
572	A	88.1	Confident	88.7	Confident	6 Å²	6	21.2 Å²	21.2	5%	0.05	13%	0.126	C	C	.	.	S	Bend	trans	-132.6	54.6	-175.8	0	0	0	0	0	111.7	K569 D570 G574 V575 F615	K569-A572 HydrophobicContact CB-CB 4.47Å; K569-A572 CarbonylContact O-C 3.58Å; K569-A572 WeakPolarHBondContact O-CA 3.41Å; K569-A572 PolarHBondContact O-N 2.85Å; D570-A572 PolarHBondContact O-N 2.86Å; A572-G574 PolarHBondContact O-N 2.83Å; A572-V575 HydrophobicContact CB-CB 4.29Å; A572-V575 HydrophobicContact CB-CG2 4.38Å; A572-V575 WeakPolarHBondContact O-CB 3.24Å; A572-V575 PolarHBondContact O-N 2.82Å; A572-F615 HydrophobicContact CB-CD1 3.87Å; A572-F615 HydrophobicContact CB-CE1 3.71Å
573	P	88.4	Confident	89.6	Confident	1 Å²	1	20 Å²	20	1%	0.006	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	132.7	-171.2	27.8	-34.3	0	0	0	110.8	I500 D570 V575 F723 Y739	I500-P573 HydrophobicContact CD1-CB 4.19Å; I500-P573 HydrophobicContact CG1-CB 3.91Å; D570-P573 WeakPolarHBondContact O-CD 3.46Å; P573-V575 VanDerWaalsContact C-N 3.29Å; P573-F723 HydrophobicContact CB-CD1 3.87Å; P573-F723 HydrophobicContact CB-CE1 3.84Å; P573-F723 HydrophobicContact CB-CG 4.29Å; P573-F723 HydrophobicContact CB-CZ 4.25Å; P573-F723 HydrophobicContact CG-CB 4.16Å; P573-F723 HydrophobicContact CG-CD1 3.47Å; P573-F723 VanDerWaalsContact CG-CD1 3.47Å; P573-F723 HydrophobicContact CG-CE1 3.95Å; P573-F723 HydrophobicContact CG-CG 3.88Å; P573-Y739 WeakPolarHBondContact CD-OH 3.5Å; P573-Y739 HydrophobicContact CG-CE1 4.12Å; P573-Y739 WeakPolarHBondContact CG-OH 3.43Å
574	G	89.1	Confident	90.8	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.01	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.3	-3.8	-177.5	0	0	0	0	0	114.5	I500 A572 S597 D598 A599	I500-G574 VanDerWaalsContact CD1-N 3.33Å; A572-G574 PolarHBondContact O-N 2.83Å; G574-S597 CarbonylContact O-C 3.58Å; G574-S597 WeakPolarHBondContact O-CA 3.44Å; G574-D598 PolarHBondContact O-N 2.9Å; G574-D598 VanDerWaalsContact O-N 3.13Å; G574-A599 PolarHBondContact O-N 2.9Å
575	V	93.2	Very high	91.5	Very high	6 Å²	6	25.3 Å²	25.3	4%	0.036	14%	0.14	C	C	.	.			trans	-90.1	112.8	166.1	-174.9	0	0	0	0	108.9	A572 P573 I577 I595 T596 F615	A572-V575 HydrophobicContact CB-CB 4.29Å; A572-V575 HydrophobicContact CB-CG2 4.38Å; A572-V575 WeakPolarHBondContact O-CB 3.24Å; A572-V575 PolarHBondContact O-N 2.82Å; P573-V575 VanDerWaalsContact C-N 3.29Å; V575-I577 HydrophobicContact CG1-CD1 4.5Å; V575-I577 HydrophobicContact CG1-CG1 4.24Å; V575-I595 HydrophobicContact CG1-CD1 4.09Å; V575-I595 HydrophobicContact CG1-CG1 4.41Å; V575-T596 WeakPolarHBondContact CA-O 3.41Å; V575-F615 HydrophobicContact CB-CE1 4.17Å; V575-F615 HydrophobicContact CG1-CE1 3.84Å; V575-F615 HydrophobicContact CG1-CZ 4.09Å
576	I	95.3	Very high	91.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	130.8	173.9	-40.9	170.7	0	0	0	107	V497 L505 I566 I595 T596 W603	V497-I576 HydrophobicContact CB-CD1 4.39Å; V497-I576 HydrophobicContact CG1-CD1 3.74Å; V497-I576 HydrophobicContact CG1-CG1 3.9Å; V497-I576 HydrophobicContact CG2-CD1 3.66Å; L505-I576 HydrophobicContact CD1-CD1 4.33Å; I566-I576 HydrophobicContact CD1-CG2 4.05Å; I566-I576 HydrophobicContact CG1-CG2 4.08Å; I576-I595 WeakPolarHBondContact O-CA 3.29Å; I576-T596 HydrophobicContact CB-CG2 3.56Å; I576-T596 HydrophobicContact CD1-CG2 3.98Å; I576-T596 HydrophobicContact CG1-CG2 3.79Å; I576-T596 PolarHBondContact N-O 2.83Å; I576-T596 PolarHBondContact O-N 2.84Å; I576-W603 HydrophobicContact CB-CH2 4.18Å; I576-W603 HydrophobicContact CG2-CH2 4.28Å
577	I	94.9	Very high	91.7	Very high	6 Å²	6	25.5 Å²	25.5	3%	0.031	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.8	-179.5	-40.4	-174.6	0	0	0	107.1	I566 V567 V575 I593 F594 I595 V613 F615 L622	I566-I577 CarbonylContact C-O 3.38Å; I566-I577 WeakPolarHBondContact CA-O 3.47Å; V567-I577 HydrophobicContact CG1-CB 3.93Å; V567-I577 HydrophobicContact CG1-CG1 4.4Å; V567-I577 PolarHBondContact N-O 2.9Å; V567-I577 PolarHBondContact O-N 2.88Å; V575-I577 HydrophobicContact CG1-CD1 4.5Å; V575-I577 HydrophobicContact CG1-CG1 4.24Å; I577-I593 HydrophobicContact CG2-CG2 3.78Å; I577-F594 WeakPolarHBondContact CA-O 3.24Å; I577-I595 HydrophobicContact CD1-CD1 3.89Å; I577-I595 HydrophobicContact CG1-CD1 3.78Å; I577-I595 HydrophobicContact CG1-CG1 4.01Å; I577-I595 HydrophobicContact CG2-CB 4.45Å; I577-V613 HydrophobicContact CD1-CB 4.03Å; I577-V613 HydrophobicContact CD1-CG1 3.56Å; I577-V613 HydrophobicContact CG2-CB 4.21Å; I577-V613 HydrophobicContact CG2-CG2 4.12Å; I577-F615 HydrophobicContact CD1-CE2 4.07Å; I577-F615 HydrophobicContact CD1-CZ 3.91Å; I577-F615 HydrophobicContact CG1-CZ 4.17Å; I577-L622 HydrophobicContact CD1-CD1 3.98Å; I577-L622 HydrophobicContact CD1-CD2 4.08Å
578	A	94.8	Very high	91.4	Very high	2 Å²	2	29.5 Å²	29.5	2%	0.017	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	144.5	-174.6	0	0	0	0	0	112.9	L552 N565 I566 F594	L552-A578 HydrophobicContact CB-CB 4.28Å; L552-A578 HydrophobicContact CD1-CB 3.75Å; L552-A578 HydrophobicContact CD2-CB 3.78Å; L552-A578 HydrophobicContact CG-CB 4.14Å; N565-A578 CarbonylContact O-C 3.57Å; N565-A578 VanDerWaalsContact O-CA 3.24Å; N565-A578 WeakPolarHBondContact O-CA 3.2Å; I566-A578 HydrophobicContact CB-CB 4.19Å; I566-A578 HydrophobicContact CD1-CB 4.19Å; I566-A578 HydrophobicContact CG1-CB 4.01Å; A578-F594 PolarHBondContact N-O 2.91Å; A578-F594 PolarHBondContact O-N 2.99Å
579	S	93.5	Very high	91.1	Very high	5 Å²	5	33.9 Å²	33.9	4%	0.035	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	142.6	166.7	69.4	0	0	0	0	110.3	L552 H553 N565 S592	L552-S579 WeakPolarHBondContact CA-O 3.43Å; H553-S579 PolarHBondContact N-O 3.1Å; N565-S579 WeakPolarHBondContact CB-OG 3.32Å; N565-S579 PolarHBondContact O-N 2.92Å; N565-S579 PolarHBondContact O-OG 2.96Å; N565-S579 PolarHBondContact OD1-OG 2.87Å; S579-S592 WeakPolarHBondContact CA-O 3.35Å
580	G	94.1	Very high	90.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.8	-166.3	-173	0	0	0	0	0	114.7	H551 V591 S592	H551-G580 CarbonylContact O-C 3.58Å; H551-G580 WeakPolarHBondContact O-CA 3.39Å; G580-V591 WeakPolarHBondContact O-CA 3.36Å; G580-S592 PolarHBondContact N-O 3.49Å; G580-S592 PolarHBondContact O-N 3.06Å
581	V	94.3	Very high	91.1	Very high	22 Å²	22	33 Å²	33	13%	0.133	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	150.8	178.1	70.8	0	0	0	0	110.2	H551	H551-V581 HydrophobicContact CB-CG1 4.42Å; H551-V581 PolarHBondContact N-O 3.21Å; H551-V581 PolarHBondContact O-N 3.23Å
582	V	94.4	Very high	91.5	Very high	46 Å²	46	33.1 Å²	33.1	28%	0.279	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123.8	171.5	178.5	0	0	0	0	108.4	A531 P532 V541 C543 L550 F594	A531-V582 HydrophobicContact CB-CG1 3.86Å; P532-V582 HydrophobicContact CG-CG2 4.04Å; V541-V582 HydrophobicContact CG1-CG1 4.24Å; C543-V582 HydrophobicContact CB-CG1 3.97Å; C543-V582 WeakPolarHBondContact SG-CG1 3.47Å; L550-V582 HydrophobicContact CD1-CG2 3.87Å; V582-F594 HydrophobicContact CG2-CE1 3.9Å; V582-F594 HydrophobicContact CG2-CZ 3.85Å
583	G	93.4	Very high	91.7	Very high	10 Å²	10	33.2 Å²	33.2	10%	0.103	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.1	-163.7	-173.6	0	0	0	0	0	113.9	C548 S549 H551	C548-G583 WeakPolarHBondContact CA-O 3.45Å; S549-G583 PolarHBondContact N-O 2.98Å; S549-G583 PolarHBondContact O-N 3.32Å; S549-G583 VanDerWaalsContact O-O 3.12Å; H551-G583 PolarHBondContact NE2-O 2.85Å
584	P	92.8	Very high	92.1	Very high	65 Å²	65	33.4 Å²	33.4	42%	0.422	20%	0.201	S	C	.	.	S	Bend	trans	-84.7	-13.7	177.4	35.2	-35.8	0	0	0	113.6	K515 Y547	K515-P584 WeakPolarHBondContact CE-O 3.46Å; Y547-P584 WeakPolarHBondContact O-CA 3.49Å; Y547-P584 WeakPolarHBondContact O-CB 3.49Å
585	E	93.4	Very high	92.4	Very high	85 Å²	85	33.4 Å²	33.4	40%	0.397	20%	0.2	S	C	.	.	S	Bend	trans	-156.4	157.6	-177.3	65.9	-165.7	-170.6	0	0	111	Q513 V514	Q513-E585 HydrophobicContact CB-CB 4.01Å; Q513-E585 PolarHBondContact NE2-OE2 2.95Å; V514-E585 CarbonylContact O-C 3.52Å; V514-E585 WeakPolarHBondContact O-CA 3.32Å
586	L	93	Very high	92.5	Very high	30 Å²	30	33.1 Å²	33.1	16%	0.157	20%	0.199	C	C	.	.			trans	-67.9	135	170.4	-175.2	64.3	0	0	0	110.1	V514 H551	V514-L586 HydrophobicContact CB-CB 4.07Å; V514-L586 HydrophobicContact CG1-CB 3.85Å; V514-L586 HydrophobicContact CG1-CD2 3.93Å; V514-L586 PolarHBondContact O-N 2.86Å; H551-L586 HydrophobicContact CB-CB 4.03Å; H551-L586 HydrophobicContact CB-CD1 3.93Å
587	S	89.7	Confident	92.3	Very high	40 Å²	40	33.6 Å²	33.6	28%	0.28	20%	0.202	S	C	.	.			trans	-143.3	159.9	175.1	84.3	0	0	0	0	112.5	H553 V589	H553-S587 PolarHBondContact CE1-O 2.9Å; H553-S587 PolarHBondContact NE2-O 2.79Å; S587-V589 VanDerWaalsContact C-N 3.32Å; S587-V589 PolarHBondContact OG-O 2.9Å
588	S	85.3	Confident	92.2	Very high	105 Å²	105	34.3 Å²	34.3	73%	0.734	21%	0.206	S	C	*	.	S	Bend	trans	-91.7	18.1	177.7	-42.7	0	0	0	0	113.3
589	V	85.4	Confident	92.1	Very high	96 Å²	96	34.2 Å²	34.2	58%	0.582	21%	0.205	S	C	*	.	S	Bend	trans	-123.5	136.5	-175.6	-176.3	0	0	0	0	109.4	S587 V591	S587-V589 VanDerWaalsContact C-N 3.32Å; S587-V589 PolarHBondContact OG-O 2.9Å; V589-V591 VanDerWaalsContact C-N 3.32Å; V589-V591 PolarHBondContact O-N 2.93Å
590	N	84.8	Confident	92	Very high	143 Å²	143	34.1 Å²	34.1	77%	0.765	21%	0.205	S	C	*	.	S	Bend	trans	55.3	45.5	-175	-53.2	-26.9	0	0	0	112.7	S592	N590-S592 PolarHBondContact O-N 3.08Å
591	V	90.1	Very high	91.9	Very high	17 Å²	17	35.3 Å²	35.3	10%	0.103	21%	0.212	C	C	.	.			trans	-67.2	129.3	176.5	-177.6	0	0	0	0	109.9	G580 V589 E609	G580-V591 WeakPolarHBondContact O-CA 3.36Å; V589-V591 VanDerWaalsContact C-N 3.32Å; V589-V591 PolarHBondContact O-N 2.93Å; V591-E609 WeakPolarHBondContact O-CA 3.28Å; V591-E609 PolarHBondContact O-N 3.32Å
592	S	92.8	Very high	91.9	Very high	10 Å²	10	38 Å²	38	7%	0.07	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	157.6	172.1	-74.5	0	0	0	0	110.1	S579 G580 N590 F594 E605 F607 Q608	S579-S592 WeakPolarHBondContact CA-O 3.35Å; G580-S592 PolarHBondContact N-O 3.49Å; G580-S592 PolarHBondContact O-N 3.06Å; N590-S592 PolarHBondContact O-N 3.08Å; S592-F594 WeakPolarHBondContact O-CD2 3.2Å; S592-F594 WeakPolarHBondContact O-CE2 3.33Å; S592-E605 VanDerWaalsContact CB-OE1 3.31Å; S592-E605 WeakPolarHBondContact CB-OE1 3.23Å; S592-E605 PolarHBondContact OG-OE1 2.86Å; S592-F607 CarbonylContact C-O 3.12Å; S592-F607 VanDerWaalsContact CA-O 3.3Å; S592-F607 WeakPolarHBondContact CA-O 3.37Å; S592-F607 VanDerWaalsContact CB-O 3.27Å; S592-F607 WeakPolarHBondContact CB-O 3.42Å; S592-Q608 WeakPolarHBondContact OG-CG 3.47Å
593	I	93.8	Very high	91.9	Very high	7 Å²	7	36.4 Å²	36.4	4%	0.036	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	126.9	170.2	-53.8	-54	0	0	0	109.7	I577 V606 F607	I577-I593 HydrophobicContact CG2-CG2 3.78Å; I593-V606 HydrophobicContact CB-CG2 4.14Å; I593-V606 HydrophobicContact CG2-CG2 3.83Å; I593-V606 WeakPolarHBondContact O-CG2 3.33Å; I593-V606 PolarHBondContact O-N 2.73Å; I593-F607 HydrophobicContact CB-CB 4.27Å; I593-F607 HydrophobicContact CB-CD2 4.48Å; I593-F607 HydrophobicContact CG1-CB 4.33Å; I593-F607 PolarHBondContact N-O 3.17Å
594	F	95.1	Very high	91.9	Very high	6 Å²	6	38.1 Å²	38.1	3%	0.026	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	151	174.8	-59.5	-88	0	0	0	110.5	P532 L550 L552 I577 A578 V582 S592 W603 R604 E605	P532-F594 HydrophobicContact CG-CD1 4.34Å; P532-F594 HydrophobicContact CG-CE1 4.01Å; L550-F594 HydrophobicContact CD1-CD1 3.97Å; L550-F594 HydrophobicContact CD1-CD2 3.73Å; L550-F594 HydrophobicContact CD1-CE1 4.09Å; L550-F594 HydrophobicContact CD1-CE2 3.86Å; L550-F594 HydrophobicContact CD1-CG 3.79Å; L550-F594 HydrophobicContact CD1-CZ 4.04Å; L550-F594 HydrophobicContact CD2-CB 4.4Å; L550-F594 HydrophobicContact CD2-CG 4.41Å; L552-F594 HydrophobicContact CD2-CD2 4.46Å; I577-F594 WeakPolarHBondContact CA-O 3.24Å; A578-F594 PolarHBondContact N-O 2.91Å; A578-F594 PolarHBondContact O-N 2.99Å; V582-F594 HydrophobicContact CG2-CE1 3.9Å; V582-F594 HydrophobicContact CG2-CZ 3.85Å; S592-F594 WeakPolarHBondContact O-CD2 3.2Å; S592-F594 WeakPolarHBondContact O-CE2 3.33Å; F594-W603 HydrophobicContact CB-CE3 3.99Å; F594-W603 HydrophobicContact CB-CZ3 4.5Å; F594-R604 CarbonylContact C-O 3.5Å; F594-R604 VanDerWaalsContact CA-O 3.28Å; F594-R604 WeakPolarHBondContact CA-O 3.3Å; F594-E605 HydrophobicContact CD1-CB 4.03Å; F594-E605 HydrophobicContact CD1-CG 4.38Å; F594-E605 HydrophobicContact CE1-CB 3.76Å; F594-E605 HydrophobicContact CE1-CG 3.88Å; F594-E605 HydrophobicContact CZ-CG 4.27Å
595	I	95.5	Very high	91.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	140.5	176.3	-177.6	166.2	0	0	0	110.5	V575 I576 I577 R604 V606 L622 E641	V575-I595 HydrophobicContact CG1-CD1 4.09Å; V575-I595 HydrophobicContact CG1-CG1 4.41Å; I576-I595 WeakPolarHBondContact O-CA 3.29Å; I577-I595 HydrophobicContact CD1-CD1 3.89Å; I577-I595 HydrophobicContact CG1-CD1 3.78Å; I577-I595 HydrophobicContact CG1-CG1 4.01Å; I577-I595 HydrophobicContact CG2-CB 4.45Å; I595-R604 HydrophobicContact CG2-CG 3.52Å; I595-R604 PolarHBondContact N-O 3.14Å; I595-R604 WeakPolarHBondContact O-CG 3.24Å; I595-R604 PolarHBondContact O-N 3.03Å; I595-V606 HydrophobicContact CG2-CB 4.39Å; I595-V606 HydrophobicContact CG2-CG1 3.49Å; I595-V606 VanDerWaalsContact CG2-CG1 3.49Å; I595-V606 HydrophobicContact CG2-CG2 3.98Å; I595-L622 HydrophobicContact CD1-CD1 3.65Å; I595-E641 VanDerWaalsContact CD1-O 3.31Å; I595-E641 WeakPolarHBondContact CD1-O 3.43Å
596	T	95.2	Very high	91.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	153.7	165	173.7	0	0	0	0	109.6	V575 I576 D598 G600 T602 W603	V575-T596 WeakPolarHBondContact CA-O 3.41Å; I576-T596 HydrophobicContact CB-CG2 3.56Å; I576-T596 HydrophobicContact CD1-CG2 3.98Å; I576-T596 HydrophobicContact CG1-CG2 3.79Å; I576-T596 PolarHBondContact N-O 2.83Å; I576-T596 PolarHBondContact O-N 2.84Å; T596-D598 PolarHBondContact OG1-N 2.85Å; T596-D598 PolarHBondContact OG1-OD1 3Å; T596-G600 PolarHBondContact OG1-N 3.26Å; T596-T602 WeakPolarHBondContact CA-O 3.48Å; T596-T602 WeakPolarHBondContact CB-O 3.38Å; T596-T602 PolarHBondContact OG1-O 2.95Å; T596-W603 HydrophobicContact CG2-CD2 4.23Å; T596-W603 HydrophobicContact CG2-CE3 4.07Å; T596-W603 HydrophobicContact CG2-CH2 3.61Å; T596-W603 HydrophobicContact CG2-CZ2 3.77Å; T596-W603 HydrophobicContact CG2-CZ3 3.77Å
597	S	92.3	Very high	91.9	Very high	11 Å²	11	32.4 Å²	32.4	8%	0.077	19%	0.188	C	C	.	.	S	Bend	trans	-120.6	3.3	175.4	36.9	0	0	0	0	112.7	G574 R604 E641 K725	G574-S597 CarbonylContact O-C 3.58Å; G574-S597 WeakPolarHBondContact O-CA 3.44Å; S597-R604 PolarHBondContact OG-NH1 3.02Å; S597-R604 PolarHBondContact OG-NH2 2.9Å; S597-E641 WeakPolarHBondContact CB-OE2 3.45Å; S597-K725 PolarHBondContact O-NZ 2.96Å
598	D	91.6	Very high	91.7	Very high	20 Å²	20	35 Å²	35	11%	0.107	20%	0.196	C	C	.	.	S	Bend	trans	-138.5	35.4	-172.4	59.5	10.4	0	0	0	112.2	G574 T596 G600 N601 T602 W706	G574-D598 PolarHBondContact O-N 2.9Å; G574-D598 VanDerWaalsContact O-N 3.13Å; T596-D598 PolarHBondContact OG1-N 2.85Å; T596-D598 PolarHBondContact OG1-OD1 3Å; D598-G600 VanDerWaalsContact C-N 3.27Å; D598-G600 PolarHBondContact O-N 2.98Å; D598-N601 PolarHBondContact O-ND2 2.88Å; D598-N601 PolarHBondContact OD1-N 2.82Å; D598-T602 PolarHBondContact OD1-N 2.76Å; D598-T602 PolarHBondContact OD1-OG1 3.46Å; D598-T602 WeakPolarHBondContact OD2-CB 3.5Å; D598-T602 WeakPolarHBondContact OD2-CG2 3.31Å; D598-T602 PolarHBondContact OD2-N 2.77Å; D598-T602 PolarHBondContact OD2-OG1 2.64Å; D598-W706 VanDerWaalsContact CA-CZ2 3.48Å; D598-W706 HydrophobicContact CB-CZ2 4.04Å
599	A	92.8	Very high	91.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	20.9	177.1	0	0	0	0	0	116.2	I500 Y520 G574 W706 L708	I500-A599 HydrophobicContact CD1-CB 3.7Å; Y520-A599 HydrophobicContact CE1-CB 4.42Å; Y520-A599 WeakPolarHBondContact CE1-O 3.48Å; Y520-A599 PolarHBondContact OH-O 2.89Å; G574-A599 PolarHBondContact O-N 2.9Å; A599-W706 HydrophobicContact CB-CH2 4.04Å; A599-L708 HydrophobicContact CB-CD1 3.8Å
600	G	93.1	Very high	91.7	Very high	4 Å²	4	34.2 Å²	34.2	4%	0.041	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	107.9	3.4	174.4	0	0	0	0	0	115.1	Y520 T596 D598 W603	Y520-G600 VanDerWaalsContact OH-C 3.3Å; T596-G600 PolarHBondContact OG1-N 3.26Å; D598-G600 VanDerWaalsContact C-N 3.27Å; D598-G600 PolarHBondContact O-N 2.98Å; G600-W603 PolarHBondContact O-NE1 3.03Å; G600-W603 VanDerWaalsContact O-NE1 3.08Å
601	N	91.8	Very high	91.9	Very high	25 Å²	25	29 Å²	29	13%	0.134	14%	0.144	C	C	.	.	S	Bend	trans	-69.1	-42.4	173.5	-72.1	-99.8	0	0	0	111.1	Y520 D598 H709 E711	Y520-N601 PolarHBondContact OH-N 2.98Å; D598-N601 PolarHBondContact O-ND2 2.88Å; D598-N601 PolarHBondContact OD1-N 2.82Å; N601-H709 PolarHBondContact ND2-O 3.02Å; N601-H709 PolarHBondContact OD1-CE1 3.13Å; N601-H709 PolarHBondContact OD1-ND1 3.05Å; N601-H709 PolarHBondContact OD1-O 2.84Å; N601-E711 PolarHBondContact OD1-N 2.91Å; N601-E711 VanDerWaalsContact OD1-N 3.15Å
602	T	92.8	Very high	91.9	Very high	77 Å²	77	29.1 Å²	29.1	47%	0.472	15%	0.145	S	C	.	.	S	Bend	trans	-128	135.5	173.8	68.4	0	0	0	0	112	T596 D598	T596-T602 WeakPolarHBondContact CA-O 3.48Å; T596-T602 WeakPolarHBondContact CB-O 3.38Å; T596-T602 PolarHBondContact OG1-O 2.95Å; D598-T602 PolarHBondContact OD1-N 2.76Å; D598-T602 PolarHBondContact OD1-OG1 3.46Å; D598-T602 WeakPolarHBondContact OD2-CB 3.5Å; D598-T602 WeakPolarHBondContact OD2-CG2 3.31Å; D598-T602 PolarHBondContact OD2-N 2.77Å; D598-T602 PolarHBondContact OD2-OG1 2.64Å
603	W	94.8	Very high	91.8	Very high	13 Å²	13	28.8 Å²	28.8	5%	0.049	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	148.3	177.8	-66.4	88.8	0	0	0	110.4	L505 L529 P532 L550 L552 I576 F594 T596 G600	L505-W603 HydrophobicContact CD2-CZ2 4.49Å; L529-W603 HydrophobicContact CD2-CZ2 4.17Å; P532-W603 WeakPolarHBondContact CA-O 3.28Å; P532-W603 WeakPolarHBondContact CB-O 3.38Å; L550-W603 HydrophobicContact CD2-CB 3.75Å; L550-W603 HydrophobicContact CD2-CD2 3.49Å; L550-W603 VanDerWaalsContact CD2-CD2 3.49Å; L550-W603 HydrophobicContact CD2-CE3 3.89Å; L550-W603 HydrophobicContact CD2-CG 3.41Å; L550-W603 VanDerWaalsContact CD2-CG 3.41Å; L552-W603 HydrophobicContact CD1-CH2 3.66Å; L552-W603 HydrophobicContact CD1-CZ2 4.05Å; L552-W603 HydrophobicContact CD1-CZ3 4.15Å; I576-W603 HydrophobicContact CB-CH2 4.18Å; I576-W603 HydrophobicContact CG2-CH2 4.28Å; F594-W603 HydrophobicContact CB-CE3 3.99Å; F594-W603 HydrophobicContact CB-CZ3 4.5Å; T596-W603 HydrophobicContact CG2-CD2 4.23Å; T596-W603 HydrophobicContact CG2-CE3 4.07Å; T596-W603 HydrophobicContact CG2-CH2 3.61Å; T596-W603 HydrophobicContact CG2-CZ2 3.77Å; T596-W603 HydrophobicContact CG2-CZ3 3.77Å; G600-W603 PolarHBondContact O-NE1 3.03Å; G600-W603 VanDerWaalsContact O-NE1 3.08Å
604	R	93.6	Very high	91.6	Very high	47 Å²	47	30.2 Å²	30.2	18%	0.177	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	141.9	169.7	57.6	-177	168	-78.6	-0	109.8	F594 I595 S597 V606 E641 G642	F594-R604 CarbonylContact C-O 3.5Å; F594-R604 VanDerWaalsContact CA-O 3.28Å; F594-R604 WeakPolarHBondContact CA-O 3.3Å; I595-R604 HydrophobicContact CG2-CG 3.52Å; I595-R604 PolarHBondContact N-O 3.14Å; I595-R604 WeakPolarHBondContact O-CG 3.24Å; I595-R604 PolarHBondContact O-N 3.03Å; S597-R604 PolarHBondContact OG-NH1 3.02Å; S597-R604 PolarHBondContact OG-NH2 2.9Å; R604-V606 HydrophobicContact CG-CG1 4.39Å; R604-E641 PolarHBondContact NH2-O 3.43Å; R604-G642 PolarHBondContact NE-O 2.9Å
605	E	93.6	Very high	91.4	Very high	29 Å²	29	30.8 Å²	30.8	14%	0.136	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	141.8	164.3	-163.2	-178.9	-167.1	0	0	108.5	L536 S592 F594 Q608	L536-E605 HydrophobicContact CD1-CG 4.16Å; L536-E605 HydrophobicContact CD2-CB 4.17Å; L536-E605 HydrophobicContact CD2-CG 4.18Å; L536-E605 WeakPolarHBondContact CD2-O 3.09Å; L536-E605 HydrophobicContact CG-CB 4.13Å; L536-E605 HydrophobicContact CG-CG 3.78Å; L536-E605 PolarHBondContact N-OE2 3.34Å; S592-E605 VanDerWaalsContact CB-OE1 3.31Å; S592-E605 WeakPolarHBondContact CB-OE1 3.23Å; S592-E605 PolarHBondContact OG-OE1 2.86Å; F594-E605 HydrophobicContact CD1-CB 4.03Å; F594-E605 HydrophobicContact CD1-CG 4.38Å; F594-E605 HydrophobicContact CE1-CB 3.76Å; F594-E605 HydrophobicContact CE1-CG 3.88Å; F594-E605 HydrophobicContact CZ-CG 4.27Å; E605-Q608 VanDerWaalsContact OE1-CG 3.26Å; E605-Q608 WeakPolarHBondContact OE1-CG 3.35Å; E605-Q608 PolarHBondContact OE1-NE2 3.43Å
606	V	93.6	Very high	91.1	Very high	15 Å²	15	31 Å²	31	9%	0.091	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	-31.3	175.2	-78.5	0	0	0	0	114	I593 I595 R604 G642	I593-V606 HydrophobicContact CB-CG2 4.14Å; I593-V606 HydrophobicContact CG2-CG2 3.83Å; I593-V606 WeakPolarHBondContact O-CG2 3.33Å; I593-V606 PolarHBondContact O-N 2.73Å; I595-V606 HydrophobicContact CG2-CB 4.39Å; I595-V606 HydrophobicContact CG2-CG1 3.49Å; I595-V606 VanDerWaalsContact CG2-CG1 3.49Å; I595-V606 HydrophobicContact CG2-CG2 3.98Å; R604-V606 HydrophobicContact CG-CG1 4.39Å; V606-G642 WeakPolarHBondContact CG1-O 3.33Å
607	F	92.1	Very high	90.7	Very high	16 Å²	16	31 Å²	31	7%	0.07	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	139.5	174.1	-60.9	-73.6	0	0	0	110.8	S592 I593 Y611 A624 W636 W645	S592-F607 CarbonylContact C-O 3.12Å; S592-F607 VanDerWaalsContact CA-O 3.3Å; S592-F607 WeakPolarHBondContact CA-O 3.37Å; S592-F607 VanDerWaalsContact CB-O 3.27Å; S592-F607 WeakPolarHBondContact CB-O 3.42Å; I593-F607 HydrophobicContact CB-CB 4.27Å; I593-F607 HydrophobicContact CB-CD2 4.48Å; I593-F607 HydrophobicContact CG1-CB 4.33Å; I593-F607 PolarHBondContact N-O 3.17Å; F607-Y611 HydrophobicContact CB-CD2 3.48Å; F607-Y611 VanDerWaalsContact CB-CD2 3.48Å; F607-Y611 HydrophobicContact CB-CE2 3.65Å; F607-Y611 HydrophobicContact CB-CG 4.2Å; F607-Y611 HydrophobicContact CD1-CD1 4.35Å; F607-Y611 HydrophobicContact CD1-CD2 4.19Å; F607-Y611 HydrophobicContact CD1-CE1 4.09Å; F607-Y611 AromaticContact CD1-CE2 3.92Å; F607-Y611 HydrophobicContact CD1-CE2 3.92Å; F607-Y611 HydrophobicContact CD1-CG 4.42Å; F607-Y611 AromaticContact CD1-CZ 3.87Å; F607-Y611 HydrophobicContact CD2-CD1 4.37Å; F607-Y611 HydrophobicContact CD2-CD2 4.18Å; F607-Y611 HydrophobicContact CD2-CG 4.02Å; F607-Y611 HydrophobicContact CE1-CD1 4.5Å; F607-Y611 HydrophobicContact CE1-CE1 4.25Å; F607-Y611 HydrophobicContact CG-CD1 4.29Å; F607-Y611 AromaticContact CG-CD2 3.69Å; F607-Y611 HydrophobicContact CG-CD2 3.69Å; F607-Y611 HydrophobicContact CG-CE1 4.43Å; F607-Y611 AromaticContact CG-CE2 3.86Å; F607-Y611 HydrophobicContact CG-CE2 3.86Å; F607-Y611 AromaticContact CG-CG 3.95Å; F607-Y611 HydrophobicContact CG-CG 3.95Å; F607-A624 HydrophobicContact CD2-CB 4.35Å; F607-A624 HydrophobicContact CE2-CB 3.43Å; F607-A624 VanDerWaalsContact CE2-CB 3.43Å; F607-A624 HydrophobicContact CZ-CB 3.74Å; F607-W636 HydrophobicContact CE1-CB 4.43Å; F607-W636 AromaticContact CE1-CD1 3.74Å; F607-W636 HydrophobicContact CE1-CD2 4.14Å; F607-W636 AromaticContact CE1-CG 3.89Å; F607-W636 HydrophobicContact CE1-CG 3.89Å; F607-W636 AromaticContact CE1-NE1 3.88Å; F607-W636 HydrophobicContact CZ-CB 3.98Å; F607-W636 AromaticContact CZ-CD1 3.98Å; F607-W636 AromaticContact CZ-CG 3.94Å; F607-W636 HydrophobicContact CZ-CG 3.94Å; F607-W645 HydrophobicContact CE2-CD2 4.04Å; F607-W645 AromaticContact CE2-CE2 3.81Å; F607-W645 HydrophobicContact CE2-CE3 4.36Å; F607-W645 HydrophobicContact CE2-CH2 4.23Å; F607-W645 AromaticContact CE2-CZ2 3.91Å; F607-W645 HydrophobicContact CE2-CZ2 3.91Å; F607-W645 HydrophobicContact CE2-CZ3 4.45Å; F607-W645 HydrophobicContact CZ-CB 4.47Å; F607-W645 AromaticContact CZ-CD2 3.66Å; F607-W645 HydrophobicContact CZ-CD2 3.66Å; F607-W645 AromaticContact CZ-CE2 3.91Å; F607-W645 AromaticContact CZ-CE3 3.97Å; F607-W645 HydrophobicContact CZ-CE3 3.97Å; F607-W645 AromaticContact CZ-CG 3.91Å; F607-W645 HydrophobicContact CZ-CG 3.91Å; F607-W645 HydrophobicContact CZ-CZ2 4.39Å; F607-W645 HydrophobicContact CZ-CZ3 4.45Å
608	Q	86.6	Confident	90.2	Very high	94 Å²	94	30.6 Å²	30.6	44%	0.439	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	142.3	158.8	-75.1	160.2	6	0	0	107.9	L536 S592 E605	L536-Q608 HydrophobicContact CD1-CB 4.43Å; L536-Q608 HydrophobicContact CD1-CG 3.83Å; S592-Q608 WeakPolarHBondContact OG-CG 3.47Å; E605-Q608 VanDerWaalsContact OE1-CG 3.26Å; E605-Q608 WeakPolarHBondContact OE1-CG 3.35Å; E605-Q608 PolarHBondContact OE1-NE2 3.43Å
609	E	85.2	Confident	89.9	Confident	96 Å²	96	30.4 Å²	30.4	45%	0.449	15%	0.152	S	C	.	.	S	Bend	trans	71.3	170.8	-162.6	-47	176	-166.2	0	0	115	V591 R626	V591-E609 WeakPolarHBondContact O-CA 3.28Å; V591-E609 PolarHBondContact O-N 3.32Å; E609-R626 IonicContact OE1-CZ 3.83Å; E609-R626 IonicContact OE1-NH2 3.77Å; E609-R626 PolarHBondContact OE1-NH2 3.12Å; E609-R626 IonicContact OE2-CZ 3.44Å; E609-R626 IonicContact OE2-NE 2.81Å; E609-R626 PolarHBondContact OE2-NE 2.6Å; E609-R626 IonicContact OE2-NH2 3.49Å; E609-R626 PolarHBondContact OE2-NH2 3.09Å
610	E	84.5	Confident	89.6	Confident	88 Å²	88	31 Å²	31	41%	0.411	16%	0.159	S	C	.	.			trans	-78.8	129.4	-175.8	-66.1	168.8	-174.2	0	0	113.1	H627	E610-H627 HydrophobicContact CB-CB 4.13Å; E610-H627 PolarHBondContact O-N 2.94Å; E610-H627 IonicContact OE2-CD2 3.61Å
611	Y	89.8	Confident	89.4	Confident	35 Å²	35	31 Å²	31	14%	0.137	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	134.2	172.2	-73.9	-110.6	0	0	0	109.5	F607 A624 I625 R626 W636	F607-Y611 HydrophobicContact CB-CD2 3.48Å; F607-Y611 VanDerWaalsContact CB-CD2 3.48Å; F607-Y611 HydrophobicContact CB-CE2 3.65Å; F607-Y611 HydrophobicContact CB-CG 4.2Å; F607-Y611 HydrophobicContact CD1-CD1 4.35Å; F607-Y611 HydrophobicContact CD1-CD2 4.19Å; F607-Y611 HydrophobicContact CD1-CE1 4.09Å; F607-Y611 AromaticContact CD1-CE2 3.92Å; F607-Y611 HydrophobicContact CD1-CE2 3.92Å; F607-Y611 HydrophobicContact CD1-CG 4.42Å; F607-Y611 AromaticContact CD1-CZ 3.87Å; F607-Y611 HydrophobicContact CD2-CD1 4.37Å; F607-Y611 HydrophobicContact CD2-CD2 4.18Å; F607-Y611 HydrophobicContact CD2-CG 4.02Å; F607-Y611 HydrophobicContact CE1-CD1 4.5Å; F607-Y611 HydrophobicContact CE1-CE1 4.25Å; F607-Y611 HydrophobicContact CG-CD1 4.29Å; F607-Y611 AromaticContact CG-CD2 3.69Å; F607-Y611 HydrophobicContact CG-CD2 3.69Å; F607-Y611 HydrophobicContact CG-CE1 4.43Å; F607-Y611 AromaticContact CG-CE2 3.86Å; F607-Y611 HydrophobicContact CG-CE2 3.86Å; F607-Y611 AromaticContact CG-CG 3.95Å; F607-Y611 HydrophobicContact CG-CG 3.95Å; Y611-A624 HydrophobicContact CD1-CB 4.17Å; Y611-I625 CarbonylContact C-O 3.56Å; Y611-I625 WeakPolarHBondContact CA-O 3.45Å; Y611-R626 VanDerWaalsContact CD1-CA 3.44Å; Y611-R626 HydrophobicContact CD1-CB 3.9Å; Y611-R626 VanDerWaalsContact CD1-N 3.33Å; Y611-R626 HydrophobicContact CE1-CB 3.49Å; Y611-R626 VanDerWaalsContact CE1-CB 3.49Å; Y611-R626 HydrophobicContact CE1-CG 4.04Å; Y611-R626 HydrophobicContact CE2-CB 4.34Å; Y611-R626 HydrophobicContact CE2-CG 4Å; Y611-R626 HydrophobicContact CG-CB 4.46Å; Y611-W636 AromaticContact CE1-CD1 3.61Å; Y611-W636 AromaticContact CE1-NE1 3.59Å
612	S	89	Confident	89.5	Confident	18 Å²	18	30 Å²	30	13%	0.126	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	131.4	164.6	-80.3	0	0	0	0	109.4	S563 A624 I625	S563-S612 VanDerWaalsContact CB-CB 3.5Å; S563-S612 PolarHBondContact N-OG 3Å; S612-A624 WeakPolarHBondContact O-CA 3.29Å; S612-I625 PolarHBondContact N-O 2.86Å; S612-I625 PolarHBondContact O-N 2.68Å
613	V	90.6	Very high	89.5	Confident	4 Å²	4	26.3 Å²	26.3	2%	0.024	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	111	-173.8	-168.2	0	0	0	0	111.5	S563 I577 L622 V623 A624 W645	S563-V613 PolarHBondContact OG-N 3.22Å; S563-V613 PolarHBondContact OG-O 2.66Å; I577-V613 HydrophobicContact CD1-CB 4.03Å; I577-V613 HydrophobicContact CD1-CG1 3.56Å; I577-V613 HydrophobicContact CG2-CB 4.21Å; I577-V613 HydrophobicContact CG2-CG2 4.12Å; V613-L622 HydrophobicContact CG1-CB 4.3Å; V613-V623 CarbonylContact C-O 3.58Å; V613-V623 WeakPolarHBondContact CA-O 3.3Å; V613-A624 HydrophobicContact CG1-CB 4.38Å; V613-A624 HydrophobicContact CG2-CB 3.93Å; V613-W645 HydrophobicContact CG1-CH2 3.96Å
614	F	90	Very high	89.4	Confident	37 Å²	37	25.7 Å²	25.7	16%	0.162	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	140.7	-175.6	-57.6	-84.5	0	0	0	111.4	L622 V623 I625 V660 M671	F614-L622 WeakPolarHBondContact O-CA 3.16Å; F614-V623 PolarHBondContact N-O 3.03Å; F614-V623 PolarHBondContact O-N 2.88Å; F614-I625 HydrophobicContact CD2-CD1 4.42Å; F614-I625 HydrophobicContact CE2-CD1 4.3Å; F614-V660 HydrophobicContact CD2-CG1 4.24Å; F614-V660 HydrophobicContact CE1-CB 4.42Å; F614-V660 HydrophobicContact CE1-CG1 4.44Å; F614-V660 HydrophobicContact CE2-CB 3.91Å; F614-V660 HydrophobicContact CE2-CG1 3.83Å; F614-V660 HydrophobicContact CE2-CG2 4.16Å; F614-V660 HydrophobicContact CZ-CB 3.7Å; F614-V660 HydrophobicContact CZ-CG1 3.94Å; F614-V660 HydrophobicContact CZ-CG2 4.28Å; F614-M671 HydrophobicContact CB-CE 4.06Å; F614-M671 HydrophobicContact CD2-CE 4.46Å; F614-M671 HydrophobicContact CG-CE 4.41Å
615	F	90	Very high	89.4	Confident	18 Å²	18	23.8 Å²	23.8	8%	0.079	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	129.3	174.1	-67.2	-106.7	0	0	0	109.5	V567 K569 A572 V575 I577 L622	V567-F615 HydrophobicContact CB-CE2 4.47Å; V567-F615 HydrophobicContact CG1-CE2 3.96Å; V567-F615 HydrophobicContact CG2-CD2 4.41Å; V567-F615 HydrophobicContact CG2-CE2 3.85Å; K569-F615 HydrophobicContact CB-CD1 4.45Å; K569-F615 HydrophobicContact CG-CD1 4.41Å; K569-F615 HydrophobicContact CG-CD2 3.96Å; K569-F615 HydrophobicContact CG-CE2 4.25Å; K569-F615 HydrophobicContact CG-CG 4.06Å; A572-F615 HydrophobicContact CB-CD1 3.87Å; A572-F615 HydrophobicContact CB-CE1 3.71Å; V575-F615 HydrophobicContact CB-CE1 4.17Å; V575-F615 HydrophobicContact CG1-CE1 3.84Å; V575-F615 HydrophobicContact CG1-CZ 4.09Å; I577-F615 HydrophobicContact CD1-CE2 4.07Å; I577-F615 HydrophobicContact CD1-CZ 3.91Å; I577-F615 HydrophobicContact CG1-CZ 4.17Å; F615-L622 HydrophobicContact CD1-CD2 3.69Å; F615-L622 HydrophobicContact CE1-CD2 3.9Å; F615-L622 HydrophobicContact CG-CD2 4.03Å; F615-L622 HydrophobicContact CZ-CD2 4.41Å
616	L	89.3	Confident	89.2	Confident	3 Å²	3	26.6 Å²	26.6	2%	0.016	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	157.2	170.8	-66.1	-173.6	0	0	0	110.8	Q618 G619 G620 S621 V623 I668 M671 F690	L616-Q618 PolarHBondContact O-N 2.71Å; L616-G619 CarbonylContact O-C 3.55Å; L616-G619 VanDerWaalsContact O-CA 3.26Å; L616-G619 WeakPolarHBondContact O-CA 3.37Å; L616-G619 PolarHBondContact O-N 3.39Å; L616-G620 PolarHBondContact O-N 2.73Å; L616-S621 PolarHBondContact N-O 3.39Å; L616-S621 PolarHBondContact O-N 3.28Å; L616-V623 HydrophobicContact CD1-CG2 3.38Å; L616-V623 HydrophobicContact CG-CG2 3.75Å; L616-I668 CarbonylContact C-O 3.6Å; L616-I668 WeakPolarHBondContact CA-O 3.46Å; L616-I668 WeakPolarHBondContact CB-O 3.33Å; L616-I668 HydrophobicContact CD2-CB 4.04Å; L616-I668 HydrophobicContact CD2-CG2 3.66Å; L616-I668 VanDerWaalsContact CD2-O 3.3Å; L616-I668 WeakPolarHBondContact CD2-O 3.24Å; L616-M671 HydrophobicContact CD2-CE 4.03Å; L616-F690 HydrophobicContact CD1-CB 4.27Å; L616-F690 HydrophobicContact CD1-CD1 3.81Å; L616-F690 HydrophobicContact CD1-CD2 3.59Å; L616-F690 HydrophobicContact CD1-CE1 3.99Å; L616-F690 HydrophobicContact CD1-CE2 3.77Å; L616-F690 HydrophobicContact CD1-CG 3.61Å; L616-F690 HydrophobicContact CD1-CZ 3.96Å; L616-F690 HydrophobicContact CD2-CD2 4.32Å; L616-F690 HydrophobicContact CD2-CE2 4.36Å
617	N	87.3	Confident	88.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	54	169.2	-177.3	22.7	0	0	0	111.8	G619 G620 I668 L669 F694 C732 V733 K734	N617-G619 PolarHBondContact O-N 3.06Å; N617-G620 PolarHBondContact O-N 3.07Å; N617-I668 PolarHBondContact N-O 3.01Å; N617-L669 HydrophobicContact CB-CD2 3.86Å; N617-F694 HydrophobicContact CB-CE2 4.46Å; N617-F694 HydrophobicContact CB-CZ 4.23Å; N617-F694 WeakPolarHBondContact ND2-CE1 3.35Å; N617-C732 PolarHBondContact ND2-O 2.94Å; N617-V733 WeakPolarHBondContact OD1-CA 3.16Å; N617-K734 PolarHBondContact OD1-N 2.94Å
618	Q	83	Confident	88.4	Confident	4 Å²	4	32.4 Å²	32.4	2%	0.019	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	35.1	-173.3	-52.5	178.2	2.2	0	0	113.2	T571 L616 G620 E666 D667 K734	T571-Q618 WeakPolarHBondContact CB-O 3.43Å; T571-Q618 HydrophobicContact CG2-CB 4.29Å; T571-Q618 VanDerWaalsContact O-O 3.13Å; T571-Q618 PolarHBondContact OG1-O 2.88Å; L616-Q618 PolarHBondContact O-N 2.71Å; Q618-G620 VanDerWaalsContact C-N 3.3Å; Q618-G620 PolarHBondContact O-N 3.37Å; Q618-E666 VanDerWaalsContact CA-O 3.32Å; Q618-E666 WeakPolarHBondContact CA-O 3.33Å; Q618-E666 HydrophobicContact CG-CB 4.12Å; Q618-E666 PolarHBondContact N-O 2.83Å; Q618-D667 WeakPolarHBondContact CG-OD1 3.44Å; Q618-D667 PolarHBondContact NE2-OD1 2.85Å; Q618-K734 HydrophobicContact CB-CB 4.31Å; Q618-K734 HydrophobicContact CB-CD 3.95Å; Q618-K734 HydrophobicContact CG-CB 4.32Å; Q618-K734 PolarHBondContact O-NZ 3.04Å; Q618-K734 VanDerWaalsContact OE1-CE 3.23Å
619	G	85	Confident	88.3	Confident	16 Å²	16	33.3 Å²	33.3	17%	0.165	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	16.6	-174.5	0	0	0	0	0	115.8	L616 N617 S621	L616-G619 CarbonylContact O-C 3.55Å; L616-G619 VanDerWaalsContact O-CA 3.26Å; L616-G619 WeakPolarHBondContact O-CA 3.37Å; L616-G619 PolarHBondContact O-N 3.39Å; N617-G619 PolarHBondContact O-N 3.06Å; G619-S621 PolarHBondContact O-N 3.05Å
620	G	85.3	Confident	88.5	Confident	13 Å²	13	34 Å²	34	13%	0.134	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-11.9	166.8	0	0	0	0	0	113.4	L616 N617 Q618	L616-G620 PolarHBondContact O-N 2.73Å; N617-G620 PolarHBondContact O-N 3.07Å; Q618-G620 VanDerWaalsContact C-N 3.3Å; Q618-G620 PolarHBondContact O-N 3.37Å
621	S	90.5	Very high	88.8	Confident	3 Å²	3	32 Å²	32	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	158.7	174	-52.3	0	0	0	0	110.9	L616 G619 S638 F639 F694	L616-S621 PolarHBondContact N-O 3.39Å; L616-S621 PolarHBondContact O-N 3.28Å; G619-S621 PolarHBondContact O-N 3.05Å; S621-S638 CarbonylContact C-O 3.59Å; S621-S638 VanDerWaalsContact CA-O 3.25Å; S621-S638 WeakPolarHBondContact CA-O 3.39Å; S621-S638 WeakPolarHBondContact CB-O 3.4Å; S621-F639 VanDerWaalsContact OG-CD1 3.31Å; S621-F639 WeakPolarHBondContact OG-CD1 3.4Å; S621-F694 WeakPolarHBondContact OG-CZ 3.35Å
622	L	92.9	Very high	89	Confident	3 Å²	3	31.4 Å²	31.4	2%	0.016	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	149	-178.8	-57.7	176.2	0	0	0	111.3	I577 I595 V613 F614 F615 L637 S638 W645	I577-L622 HydrophobicContact CD1-CD1 3.98Å; I577-L622 HydrophobicContact CD1-CD2 4.08Å; I595-L622 HydrophobicContact CD1-CD1 3.65Å; V613-L622 HydrophobicContact CG1-CB 4.3Å; F614-L622 WeakPolarHBondContact O-CA 3.16Å; F615-L622 HydrophobicContact CD1-CD2 3.69Å; F615-L622 HydrophobicContact CE1-CD2 3.9Å; F615-L622 HydrophobicContact CG-CD2 4.03Å; F615-L622 HydrophobicContact CZ-CD2 4.41Å; L622-L637 CarbonylContact O-C 3.59Å; L622-L637 WeakPolarHBondContact O-CA 3.21Å; L622-S638 PolarHBondContact N-O 2.81Å; L622-S638 PolarHBondContact O-N 3.13Å; L622-W645 HydrophobicContact CB-CH2 3.73Å; L622-W645 HydrophobicContact CB-CZ3 4.1Å; L622-W645 HydrophobicContact CD1-CH2 4.22Å; L622-W645 HydrophobicContact CD1-CZ2 4.44Å
623	V	93.2	Very high	89.1	Confident	1 Å²	1	36 Å²	36	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	122.4	172.7	178.7	0	0	0	0	110	V613 F614 L616 I625 I635 W636 L637 M671 F690	V613-V623 CarbonylContact C-O 3.58Å; V613-V623 WeakPolarHBondContact CA-O 3.3Å; F614-V623 PolarHBondContact N-O 3.03Å; F614-V623 PolarHBondContact O-N 2.88Å; L616-V623 HydrophobicContact CD1-CG2 3.38Å; L616-V623 HydrophobicContact CG-CG2 3.75Å; V623-I625 HydrophobicContact CG1-CD1 4.27Å; V623-I625 HydrophobicContact CG1-CG1 4.07Å; V623-I635 HydrophobicContact CG1-CB 4.23Å; V623-I635 HydrophobicContact CG1-CD1 3.96Å; V623-W636 CarbonylContact C-O 3.59Å; V623-W636 VanDerWaalsContact CA-O 3.28Å; V623-W636 WeakPolarHBondContact CA-O 3.49Å; V623-L637 HydrophobicContact CG1-CD2 4.25Å; V623-L637 HydrophobicContact CG2-CD2 3.76Å; V623-M671 HydrophobicContact CB-CE 3.97Å; V623-M671 HydrophobicContact CG1-CE 3.97Å; V623-M671 HydrophobicContact CG1-SD 4.4Å; V623-M671 HydrophobicContact CG2-CE 4.13Å; V623-F690 HydrophobicContact CG2-CE1 4.31Å; V623-F690 HydrophobicContact CG2-CZ 4.07Å
624	A	93.3	Very high	89.1	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.2	176.6	0	0	0	0	0	111.9	F607 Y611 S612 V613 W636 W645	F607-A624 HydrophobicContact CD2-CB 4.35Å; F607-A624 HydrophobicContact CE2-CB 3.43Å; F607-A624 VanDerWaalsContact CE2-CB 3.43Å; F607-A624 HydrophobicContact CZ-CB 3.74Å; Y611-A624 HydrophobicContact CD1-CB 4.17Å; S612-A624 WeakPolarHBondContact O-CA 3.29Å; V613-A624 HydrophobicContact CG1-CB 4.38Å; V613-A624 HydrophobicContact CG2-CB 3.93Å; A624-W636 HydrophobicContact CB-CB 4.27Å; A624-W636 PolarHBondContact N-O 3.42Å; A624-W636 PolarHBondContact O-N 3.1Å; A624-W645 HydrophobicContact CB-CE3 4.31Å; A624-W645 HydrophobicContact CB-CH2 3.91Å; A624-W645 HydrophobicContact CB-CZ3 3.68Å
625	I	91.7	Very high	89.2	Confident	7 Å²	7	36.8 Å²	36.8	4%	0.036	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	122.3	-177.1	-50.9	-170.4	0	0	0	108.2	Y611 S612 F614 V623 H627 I632 I635 V660 M671 I673	Y611-I625 CarbonylContact C-O 3.56Å; Y611-I625 WeakPolarHBondContact CA-O 3.45Å; S612-I625 PolarHBondContact N-O 2.86Å; S612-I625 PolarHBondContact O-N 2.68Å; F614-I625 HydrophobicContact CD2-CD1 4.42Å; F614-I625 HydrophobicContact CE2-CD1 4.3Å; V623-I625 HydrophobicContact CG1-CD1 4.27Å; V623-I625 HydrophobicContact CG1-CG1 4.07Å; I625-H627 PolarHBondContact O-N 2.81Å; I625-I632 HydrophobicContact CG2-CD1 3.77Å; I625-I635 HydrophobicContact CD1-CG2 3.71Å; I625-I635 HydrophobicContact CG1-CB 4.3Å; I625-I635 HydrophobicContact CG1-CG2 3.64Å; I625-I635 HydrophobicContact CG2-CG2 4.45Å; I625-V660 HydrophobicContact CD1-CG1 4.12Å; I625-V660 HydrophobicContact CD1-CG2 3.91Å; I625-M671 HydrophobicContact CD1-SD 4Å; I625-I673 HydrophobicContact CD1-CD1 4.05Å; I625-I673 HydrophobicContact CD1-CG1 4.47Å
626	R	89.8	Confident	89.4	Confident	87 Å²	87	39.4 Å²	39.4	33%	0.328	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	126.7	-175.2	-169.1	177.6	-179.4	-173.2	1.9	110.2	E609 Y611 T628	E609-R626 IonicContact OE1-CZ 3.83Å; E609-R626 IonicContact OE1-NH2 3.77Å; E609-R626 PolarHBondContact OE1-NH2 3.12Å; E609-R626 IonicContact OE2-CZ 3.44Å; E609-R626 IonicContact OE2-NE 2.81Å; E609-R626 PolarHBondContact OE2-NE 2.6Å; E609-R626 IonicContact OE2-NH2 3.49Å; E609-R626 PolarHBondContact OE2-NH2 3.09Å; Y611-R626 VanDerWaalsContact CD1-CA 3.44Å; Y611-R626 HydrophobicContact CD1-CB 3.9Å; Y611-R626 VanDerWaalsContact CD1-N 3.33Å; Y611-R626 HydrophobicContact CE1-CB 3.49Å; Y611-R626 VanDerWaalsContact CE1-CB 3.49Å; Y611-R626 HydrophobicContact CE1-CG 4.04Å; Y611-R626 HydrophobicContact CE2-CB 4.34Å; Y611-R626 HydrophobicContact CE2-CG 4Å; Y611-R626 HydrophobicContact CG-CB 4.46Å; R626-T628 HydrophobicContact CB-CG2 4.3Å; R626-T628 HydrophobicContact CG-CG2 3.96Å; R626-T628 PolarHBondContact O-N 2.9Å
627	H	84.7	Confident	89.6	Confident	121 Å²	121	39.4 Å²	39.4	56%	0.56	20%	0.2	S	C	*	.			trans	-82.5	110.1	172.2	-166.4	66.1	0	0	0	108.3	E610 I625	E610-H627 HydrophobicContact CB-CB 4.13Å; E610-H627 PolarHBondContact O-N 2.94Å; E610-H627 IonicContact OE2-CD2 3.61Å; I625-H627 PolarHBondContact O-N 2.81Å
628	T	84.9	Confident	89.9	Confident	33 Å²	33	39.4 Å²	39.4	20%	0.202	20%	0.2	C	C	.	.			trans	-159.5	142.6	-174.3	-178.6	0	0	0	0	112.3	R626 L630 I632	R626-T628 HydrophobicContact CB-CG2 4.3Å; R626-T628 HydrophobicContact CG-CG2 3.96Å; R626-T628 PolarHBondContact O-N 2.9Å; T628-L630 WeakPolarHBondContact CG2-O 3.35Å; T628-L630 PolarHBondContact O-N 2.88Å; T628-L630 PolarHBondContact OG1-N 2.91Å; T628-I632 HydrophobicContact CG2-CG2 3.65Å
629	P	84.8	Confident	90.2	Very high	112 Å²	112	39.8 Å²	39.8	73%	0.727	20%	0.202	S	C	*	.	S	Bend	trans	-75.9	7.1	172.9	33.3	-37.7	0	0	0	113.4	Y656	P629-Y656 WeakPolarHBondContact O-CE1 3.4Å
630	L	89.5	Confident	90.5	Very high	110 Å²	110	39.4 Å²	39.4	58%	0.576	20%	0.196	S	C	*	.	S	Bend	trans	-100.8	143.1	176.3	-59.4	179.5	0	0	0	110.2	T628 I632	T628-L630 WeakPolarHBondContact CG2-O 3.35Å; T628-L630 PolarHBondContact O-N 2.88Å; T628-L630 PolarHBondContact OG1-N 2.91Å; L630-I632 PolarHBondContact O-N 3.35Å
631	P	90.9	Very high	90.7	Very high	46 Å²	46	40.5 Å²	40.5	30%	0.299	20%	0.197	S	C	.	.			trans	-73.1	130.5	-175	30.9	-34.8	0	0	0	111.2	P654 L655 Y656	P631-P654 HydrophobicContact CB-CB 4.03Å; P631-P654 HydrophobicContact CG-CB 4.41Å; P631-L655 CarbonylContact C-O 3.57Å; P631-L655 VanDerWaalsContact CA-O 3.27Å; P631-L655 WeakPolarHBondContact CA-O 3.46Å; P631-Y656 HydrophobicContact CB-CD1 4.27Å; P631-Y656 HydrophobicContact CB-CD2 3.88Å; P631-Y656 HydrophobicContact CB-CE1 4.27Å; P631-Y656 HydrophobicContact CB-CE2 3.86Å; P631-Y656 HydrophobicContact CB-CG 4.08Å; P631-Y656 HydrophobicContact CG-CE1 4.24Å; P631-Y656 HydrophobicContact CG-CE2 4.01Å
632	I	92.6	Very high	90.7	Very high	23 Å²	23	40.3 Å²	40.3	12%	0.118	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-113.2	160.4	-175.3	60	169.2	0	0	0	112.2	I625 T628 L630 F650 P654 L655 V657	I625-I632 HydrophobicContact CG2-CD1 3.77Å; T628-I632 HydrophobicContact CG2-CG2 3.65Å; L630-I632 PolarHBondContact O-N 3.35Å; I632-F650 HydrophobicContact CG1-CZ 4.35Å; I632-P654 CarbonylContact O-C 3.45Å; I632-P654 WeakPolarHBondContact O-CA 3.19Å; I632-L655 PolarHBondContact N-O 3.42Å; I632-L655 PolarHBondContact O-N 2.87Å; I632-V657 HydrophobicContact CD1-CG2 3.99Å; I632-V657 HydrophobicContact CG1-CG2 3.82Å
633	R	90.9	Very high	90.5	Very high	115 Å²	115	47.4 Å²	47.4	43%	0.434	22%	0.223	S	C	.	.			trans	-137.6	6.1	176.5	61.4	173.9	164.7	-156.5	-9.2	114.6	S649 F650 T651 P654	R633-S649 CarbonylContact O-C 3.56Å; R633-S649 WeakPolarHBondContact O-CA 3.48Å; R633-S649 PolarHBondContact O-OG 3.28Å; R633-F650 WeakPolarHBondContact O-CD1 3.42Å; R633-F650 PolarHBondContact O-N 2.98Å; R633-T651 HydrophobicContact CB-CG2 3.53Å; R633-P654 HydrophobicContact CB-CB 4.42Å
634	H	91.2	Very high	90.4	Very high	57 Å²	57	52.2 Å²	52.2	26%	0.264	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	145.6	-175.3	-53.6	-63.9	0	0	0	110.7	K647 Y648 S649 F650	H634-K647 HydrophobicContact CB-CG 4.25Å; H634-K647 WeakPolarHBondContact CD2-CE 3.47Å; H634-Y648 CarbonylContact C-O 3.52Å; H634-Y648 WeakPolarHBondContact CA-O 3.37Å; H634-S649 PolarHBondContact CE1-OG 2.83Å; H634-S649 PolarHBondContact ND1-OG 2.86Å; H634-F650 VanDerWaalsContact N-CE1 3.32Å
635	I	92.9	Very high	90.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	159.9	164.2	60.5	176.8	0	0	0	108.7	V623 I625 L637 Y648 F650 I673 I688 F690	V623-I635 HydrophobicContact CG1-CB 4.23Å; V623-I635 HydrophobicContact CG1-CD1 3.96Å; I625-I635 HydrophobicContact CD1-CG2 3.71Å; I625-I635 HydrophobicContact CG1-CB 4.3Å; I625-I635 HydrophobicContact CG1-CG2 3.64Å; I625-I635 HydrophobicContact CG2-CG2 4.45Å; I635-L637 HydrophobicContact CD1-CD2 3.77Å; I635-L637 HydrophobicContact CG1-CD2 4.09Å; I635-Y648 HydrophobicContact CD1-CD1 4.05Å; I635-Y648 HydrophobicContact CG1-CD1 3.98Å; I635-Y648 PolarHBondContact N-O 2.6Å; I635-Y648 PolarHBondContact O-N 2.88Å; I635-F650 HydrophobicContact CG2-CD1 3.71Å; I635-F650 HydrophobicContact CG2-CE1 3.98Å; I635-I673 HydrophobicContact CG2-CD1 4.13Å; I635-I688 HydrophobicContact CD1-CD1 3.65Å; I635-F690 HydrophobicContact CD1-CE1 4.42Å; I635-F690 HydrophobicContact CD1-CZ 4.11Å
636	W	94.1	Very high	90.4	Very high	73 Å²	73	56.2 Å²	56.2	28%	0.277	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	141	171.5	-57.6	96.4	0	0	0	110.2	F607 Y611 V623 A624 W645 D646 K647	F607-W636 HydrophobicContact CE1-CB 4.43Å; F607-W636 AromaticContact CE1-CD1 3.74Å; F607-W636 HydrophobicContact CE1-CD2 4.14Å; F607-W636 AromaticContact CE1-CG 3.89Å; F607-W636 HydrophobicContact CE1-CG 3.89Å; F607-W636 AromaticContact CE1-NE1 3.88Å; F607-W636 HydrophobicContact CZ-CB 3.98Å; F607-W636 AromaticContact CZ-CD1 3.98Å; F607-W636 AromaticContact CZ-CG 3.94Å; F607-W636 HydrophobicContact CZ-CG 3.94Å; Y611-W636 AromaticContact CE1-CD1 3.61Å; Y611-W636 AromaticContact CE1-NE1 3.59Å; V623-W636 CarbonylContact C-O 3.59Å; V623-W636 VanDerWaalsContact CA-O 3.28Å; V623-W636 WeakPolarHBondContact CA-O 3.49Å; A624-W636 HydrophobicContact CB-CB 4.27Å; A624-W636 PolarHBondContact N-O 3.42Å; A624-W636 PolarHBondContact O-N 3.1Å; W636-W645 HydrophobicContact CB-CB 4.47Å; W636-W645 HydrophobicContact CB-CE3 3.78Å; W636-W645 HydrophobicContact CB-CZ3 4.44Å; W636-W645 HydrophobicContact CE3-CB 4.16Å; W636-D646 CarbonylContact C-O 3.55Å; W636-D646 VanDerWaalsContact CA-O 3.27Å; W636-D646 WeakPolarHBondContact CA-O 3.31Å; W636-K647 HydrophobicContact CD2-CB 4.48Å; W636-K647 HydrophobicContact CD2-CG 4.46Å; W636-K647 HydrophobicContact CE3-CB 3.76Å; W636-K647 HydrophobicContact CE3-CG 4.18Å; W636-K647 HydrophobicContact CH2-CB 4.24Å; W636-K647 HydrophobicContact CH2-CD 4.01Å; W636-K647 HydrophobicContact CH2-CG 4.25Å; W636-K647 HydrophobicContact CZ2-CD 4.34Å; W636-K647 HydrophobicContact CZ3-CB 3.64Å; W636-K647 HydrophobicContact CZ3-CD 4.26Å; W636-K647 HydrophobicContact CZ3-CG 4.09Å
637	L	93.1	Very high	90.5	Very high	3 Å²	3	57.4 Å²	57.4	2%	0.016	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	145.2	-178.9	-50.3	179.7	0	0	0	109.4	L185 L622 V623 I635 F639 W645 D646 F690	L185-L637 HydrophobicContact CD1-CD1 3.76Å; L622-L637 CarbonylContact O-C 3.59Å; L622-L637 WeakPolarHBondContact O-CA 3.21Å; V623-L637 HydrophobicContact CG1-CD2 4.25Å; V623-L637 HydrophobicContact CG2-CD2 3.76Å; I635-L637 HydrophobicContact CD1-CD2 3.77Å; I635-L637 HydrophobicContact CG1-CD2 4.09Å; L637-F639 HydrophobicContact CB-CE2 4Å; L637-F639 HydrophobicContact CB-CZ 4.17Å; L637-F639 HydrophobicContact CD1-CZ 4.4Å; L637-W645 CarbonylContact O-C 3.58Å; L637-W645 WeakPolarHBondContact O-CA 3.31Å; L637-D646 PolarHBondContact N-O 3.28Å; L637-D646 PolarHBondContact O-N 3.25Å; L637-F690 HydrophobicContact CD2-CE1 3.74Å; L637-F690 HydrophobicContact CD2-CZ 4.4Å
638	S	93.3	Very high	90.8	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	137.6	171.5	-176.7	0	0	0	0	112.5	S621 L622 D640 G642 N644	S621-S638 CarbonylContact C-O 3.59Å; S621-S638 VanDerWaalsContact CA-O 3.25Å; S621-S638 WeakPolarHBondContact CA-O 3.39Å; S621-S638 WeakPolarHBondContact CB-O 3.4Å; L622-S638 PolarHBondContact N-O 2.81Å; L622-S638 PolarHBondContact O-N 3.13Å; S638-D640 PolarHBondContact OG-OD1 3.34Å; S638-G642 WeakPolarHBondContact OG-CA 3.4Å; S638-G642 PolarHBondContact OG-N 3.06Å; S638-N644 WeakPolarHBondContact CB-O 3.37Å; S638-N644 PolarHBondContact OG-O 2.85Å
639	F	90.6	Very high	91.1	Very high	13 Å²	13	54.1 Å²	54.1	6%	0.057	26%	0.263	C	S	.	.	S	Bend	trans	-117.6	12	-177.8	-53.7	-81.6	0	0	0	112.4	F183 S621 L637 I693 F694 N729	F183-F639 AromaticContact CE1-CE2 3.74Å; F183-F639 HydrophobicContact CE1-CE2 3.74Å; F183-F639 HydrophobicContact CE1-CZ 4.22Å; F183-F639 HydrophobicContact CZ-CE2 4.15Å; S621-F639 VanDerWaalsContact OG-CD1 3.31Å; S621-F639 WeakPolarHBondContact OG-CD1 3.4Å; L637-F639 HydrophobicContact CB-CE2 4Å; L637-F639 HydrophobicContact CB-CZ 4.17Å; L637-F639 HydrophobicContact CD1-CZ 4.4Å; F639-I693 HydrophobicContact CE1-CD1 4.4Å; F639-I693 HydrophobicContact CE1-CG2 3.79Å; F639-I693 HydrophobicContact CZ-CD1 3.87Å; F639-I693 HydrophobicContact CZ-CG2 4.07Å; F639-F694 HydrophobicContact CD1-CE1 4.41Å; F639-F694 HydrophobicContact CD1-CZ 4.48Å; F639-F694 HydrophobicContact CE1-CE1 4.34Å; F639-F694 HydrophobicContact CE1-CZ 4.07Å; F639-N729 PolarHBondContact O-N 2.83Å
640	D	89.9	Confident	91.2	Very high	8 Å²	8	48.9 Å²	48.9	4%	0.043	23%	0.228	C	C	.	.	S	Bend	trans	-136	34.8	-178	67.1	2.1	0	0	0	113.3	S638 G642 R643 N644 A728	S638-D640 PolarHBondContact OG-OD1 3.34Å; D640-G642 VanDerWaalsContact C-N 3.29Å; D640-G642 PolarHBondContact O-N 3.29Å; D640-R643 WeakPolarHBondContact O-CD 3.37Å; D640-R643 WeakPolarHBondContact O-CG 3.44Å; D640-R643 PolarHBondContact OD1-N 2.82Å; D640-N644 PolarHBondContact OD1-N 3.27Å; D640-N644 PolarHBondContact OD2-N 3.37Å; D640-N644 PolarHBondContact OD2-ND2 2.63Å; D640-A728 HydrophobicContact CB-CB 3.7Å
641	E	90.3	Very high	91.1	Very high	35 Å²	35	44.2 Å²	44.2	16%	0.164	21%	0.205	C	C	.	.	S	Bend	trans	64.2	27.4	-177.6	-47.8	-178.5	164.5	0	0	113.4	I595 S597 R604 K725	I595-E641 VanDerWaalsContact CD1-O 3.31Å; I595-E641 WeakPolarHBondContact CD1-O 3.43Å; S597-E641 WeakPolarHBondContact CB-OE2 3.45Å; R604-E641 PolarHBondContact NH2-O 3.43Å; E641-K725 WeakPolarHBondContact OE1-CE 3.37Å; E641-K725 IonicContact OE1-NZ 2.72Å; E641-K725 PolarHBondContact OE1-NZ 2.97Å; E641-K725 IonicContact OE2-NZ 3.51Å; E641-K725 PolarHBondContact OE2-NZ 2.91Å
642	G	90.1	Very high	90.8	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.225	C	C	.	.	S	Bend	trans	79.3	43.9	179.1	0	0	0	0	0	113.1	R604 V606 S638 D640	R604-G642 PolarHBondContact NE-O 2.9Å; V606-G642 WeakPolarHBondContact CG1-O 3.33Å; S638-G642 WeakPolarHBondContact OG-CA 3.4Å; S638-G642 PolarHBondContact OG-N 3.06Å; D640-G642 VanDerWaalsContact C-N 3.29Å; D640-G642 PolarHBondContact O-N 3.29Å
643	R	89.2	Confident	90.6	Very high	151 Å²	151	48.6 Å²	48.6	57%	0.57	24%	0.238	S	C	*	.	S	Bend	trans	-99.4	-40.3	167.3	-58.5	167.6	178	-165	-1.7	110.7	D640	D640-R643 WeakPolarHBondContact O-CD 3.37Å; D640-R643 WeakPolarHBondContact O-CG 3.44Å; D640-R643 PolarHBondContact OD1-N 2.82Å
644	N	91	Very high	90.5	Very high	103 Å²	103	45.9 Å²	45.9	55%	0.551	24%	0.236	S	C	*	.	S	Bend	trans	-114.3	148.7	168.2	-65	-78.8	0	0	0	109.9	S638 D640	S638-N644 WeakPolarHBondContact CB-O 3.37Å; S638-N644 PolarHBondContact OG-O 2.85Å; D640-N644 PolarHBondContact OD1-N 3.27Å; D640-N644 PolarHBondContact OD2-N 3.37Å; D640-N644 PolarHBondContact OD2-ND2 2.63Å
645	W	92.4	Very high	90.5	Very high	41 Å²	41	43.3 Å²	43.3	16%	0.155	22%	0.224	C	C	.	.			trans	-133.5	111.5	-177.9	-71.1	97.5	0	0	0	111.2	F607 V613 L622 A624 W636 L637	F607-W645 HydrophobicContact CE2-CD2 4.04Å; F607-W645 AromaticContact CE2-CE2 3.81Å; F607-W645 HydrophobicContact CE2-CE3 4.36Å; F607-W645 HydrophobicContact CE2-CH2 4.23Å; F607-W645 AromaticContact CE2-CZ2 3.91Å; F607-W645 HydrophobicContact CE2-CZ2 3.91Å; F607-W645 HydrophobicContact CE2-CZ3 4.45Å; F607-W645 HydrophobicContact CZ-CB 4.47Å; F607-W645 AromaticContact CZ-CD2 3.66Å; F607-W645 HydrophobicContact CZ-CD2 3.66Å; F607-W645 AromaticContact CZ-CE2 3.91Å; F607-W645 AromaticContact CZ-CE3 3.97Å; F607-W645 HydrophobicContact CZ-CE3 3.97Å; F607-W645 AromaticContact CZ-CG 3.91Å; F607-W645 HydrophobicContact CZ-CG 3.91Å; F607-W645 HydrophobicContact CZ-CZ2 4.39Å; F607-W645 HydrophobicContact CZ-CZ3 4.45Å; V613-W645 HydrophobicContact CG1-CH2 3.96Å; L622-W645 HydrophobicContact CB-CH2 3.73Å; L622-W645 HydrophobicContact CB-CZ3 4.1Å; L622-W645 HydrophobicContact CD1-CH2 4.22Å; L622-W645 HydrophobicContact CD1-CZ2 4.44Å; A624-W645 HydrophobicContact CB-CE3 4.31Å; A624-W645 HydrophobicContact CB-CH2 3.91Å; A624-W645 HydrophobicContact CB-CZ3 3.68Å; W636-W645 HydrophobicContact CB-CB 4.47Å; W636-W645 HydrophobicContact CB-CE3 3.78Å; W636-W645 HydrophobicContact CB-CZ3 4.44Å; W636-W645 HydrophobicContact CE3-CB 4.16Å; L637-W645 CarbonylContact O-C 3.58Å; L637-W645 WeakPolarHBondContact O-CA 3.31Å
646	D	91.5	Very high	90.4	Very high	49 Å²	49	46.4 Å²	46.4	26%	0.262	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	142.5	178.9	-68.6	-55.5	0	0	0	111.3	F183 W636 L637	F183-D646 HydrophobicContact CE2-CB 3.64Å; F183-D646 HydrophobicContact CZ-CB 3.77Å; F183-D646 WeakPolarHBondContact CZ-OD2 3.48Å; W636-D646 CarbonylContact C-O 3.55Å; W636-D646 VanDerWaalsContact CA-O 3.27Å; W636-D646 WeakPolarHBondContact CA-O 3.31Å; L637-D646 PolarHBondContact N-O 3.28Å; L637-D646 PolarHBondContact O-N 3.25Å
647	K	91.9	Very high	90.2	Very high	113 Å²	113	44.8 Å²	44.8	49%	0.491	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	111	-172.7	-169.3	-176	173.2	-169.5	0	112.1	H634 W636	H634-K647 HydrophobicContact CB-CG 4.25Å; H634-K647 WeakPolarHBondContact CD2-CE 3.47Å; W636-K647 HydrophobicContact CD2-CB 4.48Å; W636-K647 HydrophobicContact CD2-CG 4.46Å; W636-K647 HydrophobicContact CE3-CB 3.76Å; W636-K647 HydrophobicContact CE3-CG 4.18Å; W636-K647 HydrophobicContact CH2-CB 4.24Å; W636-K647 HydrophobicContact CH2-CD 4.01Å; W636-K647 HydrophobicContact CH2-CG 4.25Å; W636-K647 HydrophobicContact CZ2-CD 4.34Å; W636-K647 HydrophobicContact CZ3-CB 3.64Å; W636-K647 HydrophobicContact CZ3-CD 4.26Å; W636-K647 HydrophobicContact CZ3-CG 4.09Å
648	Y	91.1	Very high	90	Very high	26 Å²	26	48.2 Å²	48.2	10%	0.102	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	142.2	177	177	-110.8	0	0	0	112	L185 H634 I635 F650 I688	L185-Y648 HydrophobicContact CB-CD2 4.34Å; L185-Y648 HydrophobicContact CB-CE1 4.13Å; L185-Y648 HydrophobicContact CB-CE2 3.61Å; L185-Y648 VanDerWaalsContact CB-CZ 3.48Å; L185-Y648 WeakPolarHBondContact CB-OH 3.22Å; L185-Y648 HydrophobicContact CD1-CD1 3.88Å; L185-Y648 HydrophobicContact CD1-CD2 3.9Å; L185-Y648 HydrophobicContact CD1-CE1 3.97Å; L185-Y648 HydrophobicContact CD1-CE2 4Å; L185-Y648 HydrophobicContact CD1-CG 3.84Å; L185-Y648 HydrophobicContact CG-CE2 4.36Å; L185-Y648 PolarHBondContact O-OH 3.18Å; H634-Y648 CarbonylContact C-O 3.52Å; H634-Y648 WeakPolarHBondContact CA-O 3.37Å; I635-Y648 HydrophobicContact CD1-CD1 4.05Å; I635-Y648 HydrophobicContact CG1-CD1 3.98Å; I635-Y648 PolarHBondContact N-O 2.6Å; I635-Y648 PolarHBondContact O-N 2.88Å; Y648-F650 HydrophobicContact CD1-CB 4.17Å; Y648-F650 HydrophobicContact CE1-CB 3.92Å; Y648-I688 HydrophobicContact CE1-CG2 4.37Å
649	S	90.9	Very high	89.7	Confident	59 Å²	59	48.4 Å²	48.4	41%	0.413	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	97.1	177.5	-159.3	0	0	0	0	110.7	R633 H634 T651	R633-S649 CarbonylContact O-C 3.56Å; R633-S649 WeakPolarHBondContact O-CA 3.48Å; R633-S649 PolarHBondContact O-OG 3.28Å; H634-S649 PolarHBondContact CE1-OG 2.83Å; H634-S649 PolarHBondContact ND1-OG 2.86Å; S649-T651 VanDerWaalsContact C-N 3.35Å; S649-T651 PolarHBondContact O-N 3.06Å; S649-T651 PolarHBondContact OG-O 3.09Å
650	F	88	Confident	89.6	Confident	1 Å²	1	48.2 Å²	48.2	0%	0.004	25%	0.254	C	S	.	.			trans	-74.1	-23.8	-170.8	67.1	-100.3	0	0	0	114.4	S187 I632 R633 H634 I635 Y648 L655 V657 I673 L686 I688	S187-F650 PolarHBondContact OG-O 3.32Å; S187-F650 VanDerWaalsContact OG-O 3.12Å; I632-F650 HydrophobicContact CG1-CZ 4.35Å; R633-F650 WeakPolarHBondContact O-CD1 3.42Å; R633-F650 PolarHBondContact O-N 2.98Å; H634-F650 VanDerWaalsContact N-CE1 3.32Å; I635-F650 HydrophobicContact CG2-CD1 3.71Å; I635-F650 HydrophobicContact CG2-CE1 3.98Å; Y648-F650 HydrophobicContact CD1-CB 4.17Å; Y648-F650 HydrophobicContact CE1-CB 3.92Å; F650-L655 HydrophobicContact CE2-CD2 4.38Å; F650-V657 HydrophobicContact CZ-CG2 4.36Å; F650-I673 HydrophobicContact CD1-CD1 4.4Å; F650-I673 HydrophobicContact CD2-CD1 4.33Å; F650-I673 HydrophobicContact CE1-CD1 4.39Å; F650-I673 HydrophobicContact CE2-CD1 4.34Å; F650-I673 HydrophobicContact CG-CD1 4.35Å; F650-I673 HydrophobicContact CZ-CD1 4.37Å; F650-L686 HydrophobicContact CB-CD2 4.05Å; F650-L686 HydrophobicContact CD2-CD1 3.75Å; F650-L686 HydrophobicContact CD2-CD2 3.54Å; F650-L686 HydrophobicContact CD2-CG 4.26Å; F650-L686 HydrophobicContact CE2-CD1 4.36Å; F650-L686 HydrophobicContact CE2-CD2 4.35Å; F650-L686 HydrophobicContact CG-CD2 4.17Å; F650-I688 HydrophobicContact CB-CD1 3.71Å; F650-I688 HydrophobicContact CB-CG1 4.47Å; F650-I688 HydrophobicContact CG-CD1 4.46Å
651	T	87	Confident	89.4	Confident	13 Å²	13	49 Å²	49	8%	0.08	26%	0.259	C	S	.	.			trans	-138.7	152.9	-179.5	175	0	0	0	0	110.9	R633 S649 S653	R633-T651 HydrophobicContact CB-CG2 3.53Å; S649-T651 VanDerWaalsContact C-N 3.35Å; S649-T651 PolarHBondContact O-N 3.06Å; S649-T651 PolarHBondContact OG-O 3.09Å; T651-S653 WeakPolarHBondContact CG2-O 3.45Å; T651-S653 PolarHBondContact OG1-N 2.99Å; T651-S653 VanDerWaalsContact OG1-N 3.15Å; T651-S653 PolarHBondContact OG1-O 2.85Å
652	S	85.4	Confident	89.3	Confident	104 Å²	104	48.3 Å²	48.3	73%	0.727	26%	0.26	S	S	*	.	S	Bend	trans	-71.7	-34.1	170.3	57.7	0	0	0	0	112.6
653	S	87.4	Confident	89	Confident	57 Å²	57	49.7 Å²	49.7	40%	0.399	27%	0.267	S	S	.	.	S	Bend	trans	-118.2	128	-170.8	-63.5	0	0	0	0	110	T651	T651-S653 WeakPolarHBondContact CG2-O 3.45Å; T651-S653 PolarHBondContact OG1-N 2.99Å; T651-S653 VanDerWaalsContact OG1-N 3.15Å; T651-S653 PolarHBondContact OG1-O 2.85Å
654	P	90.2	Very high	88.5	Confident	58 Å²	58	44 Å²	44	38%	0.377	25%	0.25	S	C	.	.			trans	-66.3	138.7	-172.8	30	-36.2	0	0	0	111.7	P631 I632 R633	P631-P654 HydrophobicContact CB-CB 4.03Å; P631-P654 HydrophobicContact CG-CB 4.41Å; I632-P654 CarbonylContact O-C 3.45Å; I632-P654 WeakPolarHBondContact O-CA 3.19Å; R633-P654 HydrophobicContact CB-CB 4.42Å
655	L	91	Very high	87.7	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-118.8	135.3	-169.9	-173.5	74.3	0	0	0	109.4	P631 I632 F650 V657 I673 H676 F677 Q684	P631-L655 CarbonylContact C-O 3.57Å; P631-L655 VanDerWaalsContact CA-O 3.27Å; P631-L655 WeakPolarHBondContact CA-O 3.46Å; I632-L655 PolarHBondContact N-O 3.42Å; I632-L655 PolarHBondContact O-N 2.87Å; F650-L655 HydrophobicContact CE2-CD2 4.38Å; L655-V657 HydrophobicContact CD2-CG2 4.36Å; L655-V657 PolarHBondContact O-N 3.07Å; L655-I673 HydrophobicContact CD2-CG2 4.42Å; L655-H676 VanDerWaalsContact CD1-C 3.49Å; L655-H676 WeakPolarHBondContact CD1-O 3.32Å; L655-F677 HydrophobicContact CB-CE1 4.45Å; L655-F677 HydrophobicContact CD1-CD1 3.7Å; L655-F677 HydrophobicContact CD1-CE1 3.73Å; L655-F677 HydrophobicContact CD1-CG 4.3Å; L655-F677 HydrophobicContact CD1-CZ 4.37Å; L655-Q684 HydrophobicContact CD1-CB 3.83Å; L655-Q684 HydrophobicContact CD1-CG 3.95Å
656	Y	90.8	Very high	86.6	Confident	65 Å²	65	43.9 Å²	43.9	26%	0.255	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	115.2	162.9	-64.7	-92.5	0	0	0	107.1	P629 P631 G675 H676	P629-Y656 WeakPolarHBondContact O-CE1 3.4Å; P631-Y656 HydrophobicContact CB-CD1 4.27Å; P631-Y656 HydrophobicContact CB-CD2 3.88Å; P631-Y656 HydrophobicContact CB-CE1 4.27Å; P631-Y656 HydrophobicContact CB-CE2 3.86Å; P631-Y656 HydrophobicContact CB-CG 4.08Å; P631-Y656 HydrophobicContact CG-CE1 4.24Å; P631-Y656 HydrophobicContact CG-CE2 4.01Å; Y656-G675 CarbonylContact O-C 3.53Å; Y656-G675 WeakPolarHBondContact O-CA 3.46Å; Y656-H676 WeakPolarHBondContact CB-NE2 3.06Å; Y656-H676 WeakPolarHBondContact CB-O 3.49Å; Y656-H676 AromaticContact CD2-CD2 3.87Å; Y656-H676 WeakPolarHBondContact CD2-O 3.4Å; Y656-H676 AromaticContact CG-CD2 3.96Å; Y656-H676 AromaticContact CG-NE2 3.74Å; Y656-H676 PolarHBondContact N-O 2.98Å; Y656-H676 PolarHBondContact O-N 2.82Å
657	V	89.7	Confident	85.8	Confident	40 Å²	40	43 Å²	43	24%	0.242	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	114.9	-177.9	174.9	0	0	0	0	108.7	I632 F650 L655 V660 I673	I632-V657 HydrophobicContact CD1-CG2 3.99Å; I632-V657 HydrophobicContact CG1-CG2 3.82Å; F650-V657 HydrophobicContact CZ-CG2 4.36Å; L655-V657 HydrophobicContact CD2-CG2 4.36Å; L655-V657 PolarHBondContact O-N 3.07Å; V657-V660 HydrophobicContact CG1-CG2 4.08Å; V657-I673 HydrophobicContact CB-CG2 4.34Å; V657-I673 HydrophobicContact CG1-CG2 3.7Å; V657-I673 HydrophobicContact CG2-CG2 3.74Å
658	D	87.8	Confident	85.4	Confident	74 Å²	74	39.5 Å²	39.5	40%	0.396	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-24.5	178.1	-60.5	-59.9	0	0	0	111.6	F674 G675 H676 W683	D658-F674 HydrophobicContact CB-CD2 4.27Å; D658-F674 HydrophobicContact CB-CE2 4.24Å; D658-F674 PolarHBondContact N-O 2.87Å; D658-G675 VanDerWaalsContact OD2-CA 3.3Å; D658-G675 WeakPolarHBondContact OD2-CA 3.43Å; D658-H676 IonicContact OD1-CE1 3.52Å; D658-H676 PolarHBondContact OD1-CE1 2.95Å; D658-H676 IonicContact OD1-ND1 3.51Å; D658-H676 PolarHBondContact OD1-ND1 2.83Å; D658-H676 IonicContact OD2-CE1 3.47Å; D658-H676 PolarHBondContact OD2-CE1 2.93Å; D658-H676 IonicContact OD2-CG 2.69Å; D658-H676 IonicContact OD2-ND1 2.7Å; D658-H676 PolarHBondContact OD2-ND1 3.45Å; D658-W683 HydrophobicContact CB-CH2 4.35Å; D658-W683 HydrophobicContact CB-CZ3 3.96Å; D658-W683 WeakPolarHBondContact OD2-CZ3 3.3Å
659	G	88.4	Confident	85.3	Confident	5 Å²	5	39 Å²	39	5%	0.052	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.3	169.6	176.5	0	0	0	0	0	114.8	F674	G659-F674 PolarHBondContact N-O 2.85Å; G659-F674 WeakPolarHBondContact O-CD1 3.39Å; G659-F674 PolarHBondContact O-N 3.41Å
660	V	88.4	Confident	85.2	Confident	8 Å²	8	36.2 Å²	36.2	5%	0.048	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	135.5	-174.7	-176.6	0	0	0	0	109.4	Y561 F614 I625 V657 M671 I673	Y561-V660 WeakPolarHBondContact CA-O 3.07Å; Y561-V660 PolarHBondContact O-N 3.26Å; Y561-V660 VanDerWaalsContact O-N 3.15Å; F614-V660 HydrophobicContact CD2-CG1 4.24Å; F614-V660 HydrophobicContact CE1-CB 4.42Å; F614-V660 HydrophobicContact CE1-CG1 4.44Å; F614-V660 HydrophobicContact CE2-CB 3.91Å; F614-V660 HydrophobicContact CE2-CG1 3.83Å; F614-V660 HydrophobicContact CE2-CG2 4.16Å; F614-V660 HydrophobicContact CZ-CB 3.7Å; F614-V660 HydrophobicContact CZ-CG1 3.94Å; F614-V660 HydrophobicContact CZ-CG2 4.28Å; I625-V660 HydrophobicContact CD1-CG1 4.12Å; I625-V660 HydrophobicContact CD1-CG2 3.91Å; V657-V660 HydrophobicContact CG1-CG2 4.08Å; V660-M671 HydrophobicContact CG1-CE 4.49Å; V660-M671 HydrophobicContact CG1-CG 3.63Å; V660-M671 HydrophobicContact CG1-SD 3.5Å; V660-M671 VanDerWaalsContact CG1-SD 3.5Å; V660-I673 HydrophobicContact CG1-CG1 4.42Å; V660-I673 HydrophobicContact CG2-CG1 4.44Å
661	L	85.9	Confident	85.3	Confident	26 Å²	26	36.3 Å²	36.3	14%	0.136	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	118.7	-176.5	-171.6	67.6	0	0	0	111.5	V203 Y561 T672	V203-L661 HydrophobicContact CB-CD2 4.02Å; V203-L661 HydrophobicContact CG1-CD2 3.64Å; V203-L661 WeakPolarHBondContact O-CD2 3.4Å; Y561-L661 HydrophobicContact CD1-CD1 4.31Å; Y561-L661 HydrophobicContact CE1-CD1 4.35Å; L661-T672 PolarHBondContact N-O 2.85Å; L661-T672 PolarHBondContact O-N 3.22Å
662	G	86.5	Confident	85.4	Confident	19 Å²	19	35.7 Å²	35.7	20%	0.196	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	161.3	171.8	0	0	0	0	0	113.2	W205	W205-G662 PolarHBondContact NE1-O 3.49Å
663	E	84.8	Confident	85.7	Confident	29 Å²	29	30.8 Å²	30.8	14%	0.136	18%	0.18	C	C	.	.			trans	-54.9	136.9	164.4	-171.6	176.1	178.8	0	0	110.6	W205 G665 I670	W205-E663 HydrophobicContact CH2-CB 4.5Å; W205-E663 HydrophobicContact CZ2-CB 4.34Å; E663-G665 PolarHBondContact O-N 3.16Å; E663-G665 VanDerWaalsContact O-N 3.13Å; E663-I670 HydrophobicContact CB-CB 4.5Å; E663-I670 PolarHBondContact N-O 3.04Å
664	P	78.4	Confident	85.8	Confident	33 Å²	33	28.5 Å²	28.5	21%	0.214	16%	0.163	C	C	.	.	S	Bend	trans	-75.1	108	-170.8	30.4	-38.2	0	0	0	111.5	W205 G207 Q208	W205-P664 HydrophobicContact CB-CB 4.29Å; W205-P664 HydrophobicContact CB-CG 3.56Å; W205-P664 HydrophobicContact CD2-CG 4.44Å; W205-P664 VanDerWaalsContact CG-CD 3.41Å; W205-P664 HydrophobicContact CG-CG 3.98Å; G207-P664 VanDerWaalsContact C-CG 3.47Å; G207-P664 WeakPolarHBondContact O-CG 3.38Å; Q208-P664 WeakPolarHBondContact CG-O 3.46Å
665	G	74.3	Confident	85.8	Confident	35 Å²	35	25.7 Å²	25.7	36%	0.361	15%	0.145	S	C	.	.	S	Bend	trans	152.4	-165.4	178.3	0	0	0	0	0	110.5	E663 I668	E663-G665 PolarHBondContact O-N 3.16Å; E663-G665 VanDerWaalsContact O-N 3.13Å; G665-I668 WeakPolarHBondContact O-CG1 3.21Å
666	E	69	Low	85.7	Confident	105 Å²	105	26.7 Å²	26.7	49%	0.491	15%	0.149	S	C	.	.	S	Bend	trans	-92	-28	177.8	-69.2	152.4	-125	0	0	112.5	T571 Q618 I668	T571-E666 HydrophobicContact CG2-CB 3.93Å; T571-E666 HydrophobicContact CG2-CG 3.65Å; T571-E666 VanDerWaalsContact CG2-OE2 3.25Å; T571-E666 WeakPolarHBondContact CG2-OE2 3.3Å; Q618-E666 VanDerWaalsContact CA-O 3.32Å; Q618-E666 WeakPolarHBondContact CA-O 3.33Å; Q618-E666 HydrophobicContact CG-CB 4.12Å; Q618-E666 PolarHBondContact N-O 2.83Å; E666-I668 PolarHBondContact O-N 3Å
667	D	75.6	Confident	85.5	Confident	30 Å²	30	27.4 Å²	27.4	16%	0.16	15%	0.154	C	C	.	.			trans	-79.1	44.4	178.5	-50.4	-39.1	0	0	0	112.4	Q618 L669 R736	Q618-D667 WeakPolarHBondContact CG-OD1 3.44Å; Q618-D667 PolarHBondContact NE2-OD1 2.85Å; D667-L669 WeakPolarHBondContact O-CG 3.45Å; D667-L669 PolarHBondContact O-N 3.42Å; D667-R736 IonicContact OD2-CZ 2.72Å; D667-R736 IonicContact OD2-NE 2.72Å; D667-R736 PolarHBondContact OD2-NE 3.28Å; D667-R736 IonicContact OD2-NH2 2.69Å; D667-R736 PolarHBondContact OD2-NH2 3.28Å
668	I	83.3	Confident	85.1	Confident	40 Å²	40	28.5 Å²	28.5	21%	0.205	16%	0.163	C	C	.	.			trans	-61.9	108.3	-176.6	-48.7	-172.9	0	0	0	108.7	L616 N617 G665 E666	L616-I668 CarbonylContact C-O 3.6Å; L616-I668 WeakPolarHBondContact CA-O 3.46Å; L616-I668 WeakPolarHBondContact CB-O 3.33Å; L616-I668 HydrophobicContact CD2-CB 4.04Å; L616-I668 HydrophobicContact CD2-CG2 3.66Å; L616-I668 VanDerWaalsContact CD2-O 3.3Å; L616-I668 WeakPolarHBondContact CD2-O 3.24Å; N617-I668 PolarHBondContact N-O 3.01Å; G665-I668 WeakPolarHBondContact O-CG1 3.21Å; E666-I668 PolarHBondContact O-N 3Å
669	L	87.7	Confident	84.4	Confident	17 Å²	17	31.8 Å²	31.8	9%	0.089	18%	0.176	C	C	.	.			trans	-129.1	-7.5	179.9	-70.7	174.7	0	0	0	112.3	N617 D667 F690 R691 F694 V733	N617-L669 HydrophobicContact CB-CD2 3.86Å; D667-L669 WeakPolarHBondContact O-CG 3.45Å; D667-L669 PolarHBondContact O-N 3.42Å; L669-F690 WeakPolarHBondContact O-CB 3.43Å; L669-F690 PolarHBondContact O-N 3.34Å; L669-R691 HydrophobicContact CB-CG 3.89Å; L669-R691 HydrophobicContact CD1-CG 4.24Å; L669-F694 HydrophobicContact CD2-CD2 3.54Å; L669-F694 HydrophobicContact CD2-CE2 3.64Å; L669-F694 HydrophobicContact CD2-CG 4.46Å; L669-V733 HydrophobicContact CD1-CG1 4.21Å; L669-V733 HydrophobicContact CD1-CG2 4.4Å
670	I	89.2	Confident	83.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	134.4	170.3	-59.9	173.1	0	0	0	107.8	W205 Y238 E663 K687 I688	W205-I670 HydrophobicContact CH2-CG2 4.39Å; Y238-I670 HydrophobicContact CD1-CD1 3.49Å; Y238-I670 VanDerWaalsContact CD1-CD1 3.49Å; Y238-I670 HydrophobicContact CD2-CD1 4.42Å; Y238-I670 HydrophobicContact CE1-CD1 4.01Å; Y238-I670 HydrophobicContact CG-CD1 3.74Å; E663-I670 HydrophobicContact CB-CB 4.5Å; E663-I670 PolarHBondContact N-O 3.04Å; I670-K687 HydrophobicContact CG2-CG 3.92Å; I670-I688 WeakPolarHBondContact CA-O 3.43Å
671	M	90.3	Very high	83.3	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	135.9	178.1	-173.9	-175.7	-67.8	0	0	109.5	F614 L616 V623 I625 V660 I673 K687 I688 F690	F614-M671 HydrophobicContact CB-CE 4.06Å; F614-M671 HydrophobicContact CD2-CE 4.46Å; F614-M671 HydrophobicContact CG-CE 4.41Å; L616-M671 HydrophobicContact CD2-CE 4.03Å; V623-M671 HydrophobicContact CB-CE 3.97Å; V623-M671 HydrophobicContact CG1-CE 3.97Å; V623-M671 HydrophobicContact CG1-SD 4.4Å; V623-M671 HydrophobicContact CG2-CE 4.13Å; I625-M671 HydrophobicContact CD1-SD 4Å; V660-M671 HydrophobicContact CG1-CE 4.49Å; V660-M671 HydrophobicContact CG1-CG 3.63Å; V660-M671 HydrophobicContact CG1-SD 3.5Å; V660-M671 VanDerWaalsContact CG1-SD 3.5Å; M671-I673 HydrophobicContact SD-CG1 4.47Å; M671-K687 CarbonylContact O-C 3.45Å; M671-K687 WeakPolarHBondContact O-CA 3.44Å; M671-I688 PolarHBondContact N-O 3.35Å; M671-I688 PolarHBondContact O-N 3.17Å; M671-F690 HydrophobicContact CB-CE2 3.83Å; M671-F690 HydrophobicContact CE-CE2 4.36Å
672	T	90.1	Very high	83.2	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	113.6	172.8	-54.8	0	0	0	0	108.8	L661 L685 L686	L661-T672 PolarHBondContact N-O 2.85Å; L661-T672 PolarHBondContact O-N 3.22Å; T672-L685 HydrophobicContact CG2-CB 4.41Å; T672-L685 HydrophobicContact CG2-CD2 4.24Å; T672-L686 CarbonylContact C-O 3.55Å; T672-L686 WeakPolarHBondContact CA-O 3.41Å
673	I	91.3	Very high	83.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	130.5	168.3	-56.8	179	0	0	0	106.8	I625 I635 F650 L655 V657 V660 M671 L686 I688	I625-I673 HydrophobicContact CD1-CD1 4.05Å; I625-I673 HydrophobicContact CD1-CG1 4.47Å; I635-I673 HydrophobicContact CG2-CD1 4.13Å; F650-I673 HydrophobicContact CD1-CD1 4.4Å; F650-I673 HydrophobicContact CD2-CD1 4.33Å; F650-I673 HydrophobicContact CE1-CD1 4.39Å; F650-I673 HydrophobicContact CE2-CD1 4.34Å; F650-I673 HydrophobicContact CG-CD1 4.35Å; F650-I673 HydrophobicContact CZ-CD1 4.37Å; L655-I673 HydrophobicContact CD2-CG2 4.42Å; V657-I673 HydrophobicContact CB-CG2 4.34Å; V657-I673 HydrophobicContact CG1-CG2 3.7Å; V657-I673 HydrophobicContact CG2-CG2 3.74Å; V660-I673 HydrophobicContact CG1-CG1 4.42Å; V660-I673 HydrophobicContact CG2-CG1 4.44Å; M671-I673 HydrophobicContact SD-CG1 4.47Å; I673-L686 HydrophobicContact CB-CD2 4.49Å; I673-L686 HydrophobicContact CD1-CD2 4.38Å; I673-L686 PolarHBondContact N-O 2.92Å; I673-L686 PolarHBondContact O-N 3.34Å; I673-I688 HydrophobicContact CD1-CD1 3.85Å
674	F	90	Very high	83.6	Confident	9 Å²	9	45.7 Å²	45.7	4%	0.039	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	148.4	174.3	62.8	-92.8	0	0	0	111.4	V203 Y561 D658 G659 W683 Q684 L685	V203-F674 HydrophobicContact CG2-CD1 4.14Å; V203-F674 HydrophobicContact CG2-CE1 4.11Å; V203-F674 HydrophobicContact CG2-CG 4.41Å; V203-F674 HydrophobicContact CG2-CZ 4.35Å; Y561-F674 AromaticContact CD1-CE1 3.63Å; Y561-F674 HydrophobicContact CD1-CE1 3.63Å; Y561-F674 AromaticContact CD1-CZ 3.65Å; Y561-F674 HydrophobicContact CD1-CZ 3.65Å; Y561-F674 HydrophobicContact CD2-CZ 4.11Å; Y561-F674 HydrophobicContact CE1-CE1 4.15Å; Y561-F674 HydrophobicContact CE1-CZ 4.12Å; Y561-F674 HydrophobicContact CG-CE1 4.05Å; Y561-F674 AromaticContact CG-CZ 3.63Å; Y561-F674 HydrophobicContact CG-CZ 3.63Å; D658-F674 HydrophobicContact CB-CD2 4.27Å; D658-F674 HydrophobicContact CB-CE2 4.24Å; D658-F674 PolarHBondContact N-O 2.87Å; G659-F674 PolarHBondContact N-O 2.85Å; G659-F674 WeakPolarHBondContact O-CD1 3.39Å; G659-F674 PolarHBondContact O-N 3.41Å; F674-W683 HydrophobicContact CD2-CZ3 4.14Å; F674-Q684 WeakPolarHBondContact CA-O 3.17Å; F674-L685 HydrophobicContact CB-CG 4.17Å
675	G	90.1	Very high	84.1	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.8	-164.7	-168.5	0	0	0	0	0	114	Y656 D658 Q684	Y656-G675 CarbonylContact O-C 3.53Å; Y656-G675 WeakPolarHBondContact O-CA 3.46Å; D658-G675 VanDerWaalsContact OD2-CA 3.3Å; D658-G675 WeakPolarHBondContact OD2-CA 3.43Å; G675-Q684 PolarHBondContact N-O 3.39Å; G675-Q684 PolarHBondContact O-N 3.1Å
676	H	87.6	Confident	84.9	Confident	22 Å²	22	42.5 Å²	42.5	10%	0.102	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	152.5	177.6	56.5	-93.1	0	0	0	112.3	L655 Y656 D658 S678 H679	L655-H676 VanDerWaalsContact CD1-C 3.49Å; L655-H676 WeakPolarHBondContact CD1-O 3.32Å; Y656-H676 WeakPolarHBondContact CB-NE2 3.06Å; Y656-H676 WeakPolarHBondContact CB-O 3.49Å; Y656-H676 AromaticContact CD2-CD2 3.87Å; Y656-H676 WeakPolarHBondContact CD2-O 3.4Å; Y656-H676 AromaticContact CG-CD2 3.96Å; Y656-H676 AromaticContact CG-NE2 3.74Å; Y656-H676 PolarHBondContact N-O 2.98Å; Y656-H676 PolarHBondContact O-N 2.82Å; D658-H676 IonicContact OD1-CE1 3.52Å; D658-H676 PolarHBondContact OD1-CE1 2.95Å; D658-H676 IonicContact OD1-ND1 3.51Å; D658-H676 PolarHBondContact OD1-ND1 2.83Å; D658-H676 IonicContact OD2-CE1 3.47Å; D658-H676 PolarHBondContact OD2-CE1 2.93Å; D658-H676 IonicContact OD2-CG 2.69Å; D658-H676 IonicContact OD2-ND1 2.7Å; D658-H676 PolarHBondContact OD2-ND1 3.45Å; H676-S678 PolarHBondContact CD2-O 3.37Å; H676-H679 AromaticContact CD2-ND1 3.74Å; H676-H679 AromaticContact CE1-ND1 3.83Å; H676-H679 AromaticContact NE2-CE1 3.54Å; H676-H679 AromaticContact NE2-ND1 2.88Å; H676-H679 PolarHBondContact NE2-ND1 2.71Å
677	F	86.7	Confident	86	Confident	81 Å²	81	38.3 Å²	38.3	36%	0.355	18%	0.179	S	C	.	.	S	Bend	trans	-82.3	-20.6	173.9	-68.5	-52.3	0	0	0	112.5	L655 S681 Q684	L655-F677 HydrophobicContact CB-CE1 4.45Å; L655-F677 HydrophobicContact CD1-CD1 3.7Å; L655-F677 HydrophobicContact CD1-CE1 3.73Å; L655-F677 HydrophobicContact CD1-CG 4.3Å; L655-F677 HydrophobicContact CD1-CZ 4.37Å; F677-S681 PolarHBondContact N-OG 2.88Å; F677-Q684 HydrophobicContact CD2-CG 3.64Å; F677-Q684 VanDerWaalsContact CE2-CD 3.44Å; F677-Q684 HydrophobicContact CE2-CG 3.59Å; F677-Q684 VanDerWaalsContact CE2-OE1 3.25Å; F677-Q684 HydrophobicContact CG-CG 4.24Å; F677-Q684 HydrophobicContact CZ-CG 4.14Å
678	S	81.5	Confident	86.8	Confident	62 Å²	62	36.9 Å²	36.9	43%	0.434	17%	0.172	S	C	.	.	S	Bend	trans	-160.9	155.5	173.8	-173.5	0	0	0	0	109.1	H676 R680 S681	H676-S678 PolarHBondContact CD2-O 3.37Å; S678-R680 PolarHBondContact O-N 3.2Å; S678-S681 PolarHBondContact N-OG 2.96Å; S678-S681 VanDerWaalsContact N-OG 3.14Å; S678-S681 PolarHBondContact O-N 3.44Å; S678-S681 PolarHBondContact O-OG 3.16Å
679	H	72.4	Confident	87.1	Confident	144 Å²	144	35.8 Å²	35.8	67%	0.667	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	15.3	177	-44.5	-48.4	0	0	0	114.8	H676	H676-H679 AromaticContact CD2-ND1 3.74Å; H676-H679 AromaticContact CE1-ND1 3.83Å; H676-H679 AromaticContact NE2-CE1 3.54Å; H676-H679 AromaticContact NE2-ND1 2.88Å; H676-H679 PolarHBondContact NE2-ND1 2.71Å
680	R	76	Confident	87.2	Confident	230 Å²	230	35 Å²	35	87%	0.868	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-139.4	3.9	174.3	-60.2	-174	-178.2	-174.7	0.3	113	S678	S678-R680 PolarHBondContact O-N 3.2Å
681	S	78.4	Confident	87.2	Confident	35 Å²	35	40.4 Å²	40.4	25%	0.245	18%	0.183	C	C	.	.	S	Bend	trans	-83.9	158.4	171.1	66.5	0	0	0	0	110.1	F677 S678	F677-S681 PolarHBondContact N-OG 2.88Å; S678-S681 PolarHBondContact N-OG 2.96Å; S678-S681 VanDerWaalsContact N-OG 3.14Å; S678-S681 PolarHBondContact O-N 3.44Å; S678-S681 PolarHBondContact O-OG 3.16Å
682	E	84.6	Confident	87.1	Confident	75 Å²	75	43.3 Å²	43.3	35%	0.35	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-60.6	154.1	164.1	68.8	-146.7	165.9	0	0	111.6	A191 A193 Q684	A191-E682 HydrophobicContact CB-CG 4.15Å; A193-E682 WeakPolarHBondContact CA-OE2 3.32Å; E682-Q684 VanDerWaalsContact CG-NE2 3.34Å; E682-Q684 PolarHBondContact O-NE2 3.27Å
683	W	88.6	Confident	87	Confident	27 Å²	27	44.1 Å²	44.1	10%	0.102	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-59.5	137	176.1	-72.3	93.5	0	0	0	111.3	L192 H198 A201 M215 T217 D658 F674	L192-W683 HydrophobicContact CB-CB 4.39Å; L192-W683 HydrophobicContact CD1-CB 3.92Å; L192-W683 HydrophobicContact CG-CB 4.14Å; L192-W683 PolarHBondContact N-O 3.48Å; H198-W683 PolarHBondContact O-NE1 2.88Å; A201-W683 HydrophobicContact CB-CD2 4.49Å; A201-W683 HydrophobicContact CB-CH2 4.19Å; A201-W683 HydrophobicContact CB-CZ2 4.06Å; A201-W683 HydrophobicContact CB-CZ3 4.46Å; M215-W683 HydrophobicContact CE-CB 4.48Å; M215-W683 HydrophobicContact CE-CD2 4.45Å; M215-W683 HydrophobicContact CE-CG 4.44Å; T217-W683 HydrophobicContact CG2-CG 4.44Å; D658-W683 HydrophobicContact CB-CH2 4.35Å; D658-W683 HydrophobicContact CB-CZ3 3.96Å; D658-W683 WeakPolarHBondContact OD2-CZ3 3.3Å; F674-W683 HydrophobicContact CD2-CZ3 4.14Å
684	Q	89.6	Confident	86.7	Confident	11 Å²	11	44.5 Å²	44.5	5%	0.051	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.9	176.9	-53	-61.1	-56.9	0	0	108.7	L655 F674 G675 F677 E682	L655-Q684 HydrophobicContact CD1-CB 3.83Å; L655-Q684 HydrophobicContact CD1-CG 3.95Å; F674-Q684 WeakPolarHBondContact CA-O 3.17Å; G675-Q684 PolarHBondContact N-O 3.39Å; G675-Q684 PolarHBondContact O-N 3.1Å; F677-Q684 HydrophobicContact CD2-CG 3.64Å; F677-Q684 VanDerWaalsContact CE2-CD 3.44Å; F677-Q684 HydrophobicContact CE2-CG 3.59Å; F677-Q684 VanDerWaalsContact CE2-OE1 3.25Å; F677-Q684 HydrophobicContact CG-CG 4.24Å; F677-Q684 HydrophobicContact CZ-CG 4.14Å; E682-Q684 VanDerWaalsContact CG-NE2 3.34Å; E682-Q684 PolarHBondContact O-NE2 3.27Å
685	L	90.3	Very high	86	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131.4	172.6	-69.5	91.8	0	0	0	108.7	T189 F190 L192 M215 Y242 T672 F674	T189-L685 CarbonylContact C-O 3.51Å; T189-L685 WeakPolarHBondContact CA-O 3.39Å; F190-L685 PolarHBondContact N-O 3.14Å; F190-L685 PolarHBondContact O-N 2.93Å; L192-L685 HydrophobicContact CD1-CD1 3.99Å; L192-L685 HydrophobicContact CD2-CD1 3.83Å; L192-L685 HydrophobicContact CG-CD1 3.7Å; M215-L685 HydrophobicContact CE-CD1 4.17Å; M215-L685 HydrophobicContact CE-CD2 4.49Å; M215-L685 HydrophobicContact SD-CD1 3.78Å; M215-L685 HydrophobicContact SD-CD2 3.62Å; M215-L685 HydrophobicContact SD-CG 4.22Å; Y242-L685 HydrophobicContact CE1-CD2 4.22Å; Y242-L685 HydrophobicContact CE2-CB 4.22Å; Y242-L685 HydrophobicContact CE2-CD2 3.95Å; Y242-L685 WeakPolarHBondContact OH-CD2 3.41Å; T672-L685 HydrophobicContact CG2-CB 4.41Å; T672-L685 HydrophobicContact CG2-CD2 4.24Å; F674-L685 HydrophobicContact CB-CG 4.17Å
686	L	90.6	Very high	85.8	Confident	2 Å²	2	58 Å²	58	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	110.8	-175.8	-175.6	137.3	0	0	0	109.6	S188 T189 F650 T672 I673 I688	S188-L686 WeakPolarHBondContact O-CA 3.42Å; T189-L686 HydrophobicContact CG2-CD1 4.45Å; F650-L686 HydrophobicContact CB-CD2 4.05Å; F650-L686 HydrophobicContact CD2-CD1 3.75Å; F650-L686 HydrophobicContact CD2-CD2 3.54Å; F650-L686 HydrophobicContact CD2-CG 4.26Å; F650-L686 HydrophobicContact CE2-CD1 4.36Å; F650-L686 HydrophobicContact CE2-CD2 4.35Å; F650-L686 HydrophobicContact CG-CD2 4.17Å; T672-L686 CarbonylContact C-O 3.55Å; T672-L686 WeakPolarHBondContact CA-O 3.41Å; I673-L686 HydrophobicContact CB-CD2 4.49Å; I673-L686 HydrophobicContact CD1-CD2 4.38Å; I673-L686 PolarHBondContact N-O 2.92Å; I673-L686 PolarHBondContact O-N 3.34Å; L686-I688 HydrophobicContact CD2-CD1 3.97Å; L686-I688 HydrophobicContact CD2-CG1 3.57Å
687	K	91.9	Very high	85.7	Confident	17 Å²	17	66.8 Å²	66.8	7%	0.074	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	134.7	173.5	179.5	-165.2	-172.1	174	0	109.3	S187 S188 D237 Y238 T240 I670 M671	S187-K687 CarbonylContact C-O 3.59Å; S187-K687 VanDerWaalsContact CA-O 3.25Å; S187-K687 WeakPolarHBondContact CA-O 3.24Å; S188-K687 PolarHBondContact N-O 2.96Å; S188-K687 PolarHBondContact O-N 3.34Å; D237-K687 PolarHBondContact O-NZ 3.08Å; Y238-K687 WeakPolarHBondContact O-CD 3.36Å; Y238-K687 WeakPolarHBondContact O-CE 3.42Å; Y238-K687 WeakPolarHBondContact O-CG 3.21Å; T240-K687 HydrophobicContact CG2-CD 3.58Å; I670-K687 HydrophobicContact CG2-CG 3.92Å; M671-K687 CarbonylContact O-C 3.45Å; M671-K687 WeakPolarHBondContact O-CA 3.44Å
688	I	91.9	Very high	85.8	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128	165.5	-49.1	179.6	0	0	0	107.2	I635 Y648 F650 I670 M671 I673 L686 F690	I635-I688 HydrophobicContact CD1-CD1 3.65Å; Y648-I688 HydrophobicContact CE1-CG2 4.37Å; F650-I688 HydrophobicContact CB-CD1 3.71Å; F650-I688 HydrophobicContact CB-CG1 4.47Å; F650-I688 HydrophobicContact CG-CD1 4.46Å; I670-I688 WeakPolarHBondContact CA-O 3.43Å; M671-I688 PolarHBondContact N-O 3.35Å; M671-I688 PolarHBondContact O-N 3.17Å; I673-I688 HydrophobicContact CD1-CD1 3.85Å; L686-I688 HydrophobicContact CD2-CD1 3.97Å; L686-I688 HydrophobicContact CD2-CG1 3.57Å; I688-F690 HydrophobicContact CB-CE2 4.03Å; I688-F690 HydrophobicContact CB-CZ 4.12Å; I688-F690 HydrophobicContact CG2-CD1 4.4Å; I688-F690 HydrophobicContact CG2-CD2 4.31Å; I688-F690 HydrophobicContact CG2-CE1 3.88Å; I688-F690 HydrophobicContact CG2-CE2 3.79Å; I688-F690 HydrophobicContact CG2-CZ 3.55Å
689	D	90.8	Very high	86	Confident	16 Å²	16	63.9 Å²	63.9	9%	0.086	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	111.7	178.6	-172.5	-17	0	0	0	109	L185 T186 R691 P692	L185-D689 VanDerWaalsContact CD2-O 3.31Å; L185-D689 WeakPolarHBondContact CD2-O 3.47Å; T186-D689 PolarHBondContact O-N 3.11Å; T186-D689 VanDerWaalsContact O-N 3.17Å; D689-R691 VanDerWaalsContact OD1-CB 3.25Å; D689-R691 WeakPolarHBondContact OD1-CB 3.25Å; D689-R691 WeakPolarHBondContact OD1-CG 3.28Å; D689-R691 IonicContact OD1-CZ 3.25Å; D689-R691 PolarHBondContact OD1-N 3.27Å; D689-R691 VanDerWaalsContact OD1-N 3.14Å; D689-R691 IonicContact OD1-NE 3.43Å; D689-R691 PolarHBondContact OD1-NE 3.07Å; D689-R691 IonicContact OD1-NH2 2.71Å; D689-R691 IonicContact OD2-CZ 2.68Å; D689-R691 IonicContact OD2-NE 3.76Å; D689-R691 PolarHBondContact OD2-NE 3.48Å; D689-R691 IonicContact OD2-NH2 2.88Å; D689-R691 PolarHBondContact OD2-NH2 3.15Å; D689-P692 WeakPolarHBondContact O-CD 3.27Å
690	F	90.3	Very high	86.5	Confident	2 Å²	2	62 Å²	62	1%	0.009	29%	0.29	C	S	.	.			trans	-88.1	-6.4	-175.9	-63	-84.3	0	0	0	113.3	L185 L616 V623 I635 L637 L669 M671 I688 P692 I693 F694	L185-F690 HydrophobicContact CD1-CD1 4.11Å; L185-F690 HydrophobicContact CD1-CE1 4Å; L185-F690 HydrophobicContact CD2-CB 4.33Å; L185-F690 HydrophobicContact CD2-CD1 3.65Å; L185-F690 HydrophobicContact CD2-CE1 4.29Å; L185-F690 HydrophobicContact CD2-CG 4.23Å; L616-F690 HydrophobicContact CD1-CB 4.27Å; L616-F690 HydrophobicContact CD1-CD1 3.81Å; L616-F690 HydrophobicContact CD1-CD2 3.59Å; L616-F690 HydrophobicContact CD1-CE1 3.99Å; L616-F690 HydrophobicContact CD1-CE2 3.77Å; L616-F690 HydrophobicContact CD1-CG 3.61Å; L616-F690 HydrophobicContact CD1-CZ 3.96Å; L616-F690 HydrophobicContact CD2-CD2 4.32Å; L616-F690 HydrophobicContact CD2-CE2 4.36Å; V623-F690 HydrophobicContact CG2-CE1 4.31Å; V623-F690 HydrophobicContact CG2-CZ 4.07Å; I635-F690 HydrophobicContact CD1-CE1 4.42Å; I635-F690 HydrophobicContact CD1-CZ 4.11Å; L637-F690 HydrophobicContact CD2-CE1 3.74Å; L637-F690 HydrophobicContact CD2-CZ 4.4Å; L669-F690 WeakPolarHBondContact O-CB 3.43Å; L669-F690 PolarHBondContact O-N 3.34Å; M671-F690 HydrophobicContact CB-CE2 3.83Å; M671-F690 HydrophobicContact CE-CE2 4.36Å; I688-F690 HydrophobicContact CB-CE2 4.03Å; I688-F690 HydrophobicContact CB-CZ 4.12Å; I688-F690 HydrophobicContact CG2-CD1 4.4Å; I688-F690 HydrophobicContact CG2-CD2 4.31Å; I688-F690 HydrophobicContact CG2-CE1 3.88Å; I688-F690 HydrophobicContact CG2-CE2 3.79Å; I688-F690 HydrophobicContact CG2-CZ 3.55Å; F690-P692 VanDerWaalsContact C-N 3.32Å; F690-I693 PolarHBondContact O-N 3.4Å; F690-F694 HydrophobicContact CB-CE2 4.1Å; F690-F694 VanDerWaalsContact O-CD2 3.29Å; F690-F694 WeakPolarHBondContact O-CD2 3.39Å
691	R	88.2	Confident	87	Confident	113 Å²	113	58.2 Å²	58.2	43%	0.426	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-56.5	-33.4	-178.3	-60.9	177.9	-65	179.4	5.9	114.3	L669 D689 I693 F694	L669-R691 HydrophobicContact CB-CG 3.89Å; L669-R691 HydrophobicContact CD1-CG 4.24Å; D689-R691 VanDerWaalsContact OD1-CB 3.25Å; D689-R691 WeakPolarHBondContact OD1-CB 3.25Å; D689-R691 WeakPolarHBondContact OD1-CG 3.28Å; D689-R691 IonicContact OD1-CZ 3.25Å; D689-R691 PolarHBondContact OD1-N 3.27Å; D689-R691 VanDerWaalsContact OD1-N 3.14Å; D689-R691 IonicContact OD1-NE 3.43Å; D689-R691 PolarHBondContact OD1-NE 3.07Å; D689-R691 IonicContact OD1-NH2 2.71Å; D689-R691 IonicContact OD2-CZ 2.68Å; D689-R691 IonicContact OD2-NE 3.76Å; D689-R691 PolarHBondContact OD2-NE 3.48Å; D689-R691 IonicContact OD2-NH2 2.88Å; D689-R691 PolarHBondContact OD2-NH2 3.15Å; R691-I693 PolarHBondContact O-N 2.93Å; R691-F694 PolarHBondContact O-N 2.74Å; R691-F694 VanDerWaalsContact O-N 3.12Å
692	P	88.8	Confident	87.5	Confident	62 Å²	62	58.3 Å²	58.3	40%	0.403	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-58.6	-29	174.2	-26.8	36.8	0	0	0	114.8	D689 F690 F694	D689-P692 WeakPolarHBondContact O-CD 3.27Å; F690-P692 VanDerWaalsContact C-N 3.32Å; P692-F694 VanDerWaalsContact C-N 3.34Å
693	I	87.2	Confident	87.6	Confident	19 Å²	19	55.5 Å²	55.5	10%	0.097	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-72.5	-29.7	177.9	-61.3	-174.6	0	0	0	111.3	F183 L185 F639 F690 R691 R731	F183-I693 HydrophobicContact CD1-CD1 3.89Å; L185-I693 HydrophobicContact CD1-CD1 4.02Å; L185-I693 HydrophobicContact CD2-CD1 3.63Å; L185-I693 HydrophobicContact CD2-CG1 3.83Å; L185-I693 HydrophobicContact CG-CD1 3.8Å; L185-I693 HydrophobicContact CG-CG1 4.23Å; F639-I693 HydrophobicContact CE1-CD1 4.4Å; F639-I693 HydrophobicContact CE1-CG2 3.79Å; F639-I693 HydrophobicContact CZ-CD1 3.87Å; F639-I693 HydrophobicContact CZ-CG2 4.07Å; F690-I693 PolarHBondContact O-N 3.4Å; R691-I693 PolarHBondContact O-N 2.93Å; I693-R731 HydrophobicContact CG2-CB 4.35Å; I693-R731 HydrophobicContact CG2-CG 4.17Å
694	F	85.8	Confident	87.5	Confident	7 Å²	7	57.9 Å²	57.9	3%	0.031	28%	0.28	C	S	.	.			trans	-107.5	62.2	-171.5	-53.6	-76	0	0	0	112	N617 S621 F639 L669 F690 R691 P692 K696 V733	N617-F694 HydrophobicContact CB-CE2 4.46Å; N617-F694 HydrophobicContact CB-CZ 4.23Å; N617-F694 WeakPolarHBondContact ND2-CE1 3.35Å; S621-F694 WeakPolarHBondContact OG-CZ 3.35Å; F639-F694 HydrophobicContact CD1-CE1 4.41Å; F639-F694 HydrophobicContact CD1-CZ 4.48Å; F639-F694 HydrophobicContact CE1-CE1 4.34Å; F639-F694 HydrophobicContact CE1-CZ 4.07Å; L669-F694 HydrophobicContact CD2-CD2 3.54Å; L669-F694 HydrophobicContact CD2-CE2 3.64Å; L669-F694 HydrophobicContact CD2-CG 4.46Å; F690-F694 HydrophobicContact CB-CE2 4.1Å; F690-F694 VanDerWaalsContact O-CD2 3.29Å; F690-F694 WeakPolarHBondContact O-CD2 3.39Å; R691-F694 PolarHBondContact O-N 2.74Å; R691-F694 VanDerWaalsContact O-N 3.12Å; P692-F694 VanDerWaalsContact C-N 3.34Å; F694-K696 PolarHBondContact O-N 3.28Å; F694-V733 HydrophobicContact CB-CG2 3.47Å; F694-V733 VanDerWaalsContact CB-CG2 3.47Å; F694-V733 HydrophobicContact CG-CG2 4.42Å; F694-V733 WeakPolarHBondContact O-CG2 3.39Å
695	E	74.3	Confident	87.5	Confident	155 Å²	155	62.2 Å²	62.2	72%	0.724	31%	0.307	S	S	*	.			trans	-53.7	-27.5	-176.3	-61.7	-173.1	145.1	0	0	115.5
696	K	86	Confident	87.5	Confident	138 Å²	138	64 Å²	64	60%	0.6	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	152.4	-165.6	-68.1	158.8	-166.9	141.8	0	110.6	F694 C732 V733	F694-K696 PolarHBondContact O-N 3.28Å; K696-C732 CarbonylContact O-C 3.47Å; K696-C732 WeakPolarHBondContact O-CA 3.44Å; K696-C732 WeakPolarHBondContact O-CB 3.08Å; K696-V733 PolarHBondContact O-N 2.95Å
697	R	86.8	Confident	87.4	Confident	206 Å²	206	67.5 Å²	67.5	78%	0.777	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	144.9	166.9	-68.6	-176	176.5	-163.5	-3.7	109.9	V733	R697-V733 WeakPolarHBondContact CA-O 3.15Å
698	C	87.4	Confident	87.3	Confident	11 Å²	11	66.7 Å²	66.7	7%	0.074	33%	0.327	C	S	.	.			trans	-65.4	146.5	176.5	-55.7	0	0	0	0	111.7	D702 Y703 C732 V733	C698-D702 HydrophobicContact CB-CB 4.41Å; C698-Y703 HydrophobicContact CB-CE2 3.82Å; C698-Y703 WeakPolarHBondContact CB-OH 3.35Å; C698-C732 WeakPolarHBondContact CA-SG 3.44Å; C698-C732 HydrophobicContact CB-CB 4.01Å; C698-C732 WeakPolarHBondContact CB-SG 3.35Å; C698-C732 WeakPolarHBondContact SG-CB 3.47Å; C698-C732 PolarHBondContact SG-O 2.81Å; C698-C732 VanDerWaalsContact SG-O 3.36Å; C698-C732 CovalentContact SG-SG 2.04Å; C698-C732 PolarHBondContact SG-SG 2.81Å; C698-V733 PolarHBondContact N-O 3.13Å; C698-V733 VanDerWaalsContact SG-C 3.5Å; C698-V733 PolarHBondContact SG-O 2.85Å; C698-V733 VanDerWaalsContact SG-O 3.35Å
699	T	86.7	Confident	87.2	Confident	71 Å²	71	69.6 Å²	69.6	44%	0.436	34%	0.34	S	S	.	.			trans	-112.9	168	175.4	72.2	0	0	0	0	110.1	E701 D702 Y703	T699-E701 PolarHBondContact O-N 3.32Å; T699-E701 VanDerWaalsContact O-N 3.1Å; T699-E701 PolarHBondContact OG1-N 3.14Å; T699-D702 WeakPolarHBondContact CA-OD2 3.42Å; T699-D702 WeakPolarHBondContact CB-OD2 3.45Å; T699-D702 PolarHBondContact N-OD2 2.81Å; T699-D702 WeakPolarHBondContact O-CB 3.49Å; T699-D702 PolarHBondContact O-N 3.42Å; T699-D702 PolarHBondContact OG1-OD2 2.89Å; T699-Y703 WeakPolarHBondContact O-CD2 3.34Å; T699-Y703 WeakPolarHBondContact O-CE2 3.35Å
700	S	82.9	Confident	87	Confident	105 Å²	105	70.2 Å²	70.2	73%	0.734	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-19.7	175.8	50	0	0	0	0	114.1
701	E	86.3	Confident	86.6	Confident	150 Å²	150	77 Å²	77	70%	0.701	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-18.2	176.8	-63.3	-173.2	-167.9	0	0	113	T699 Y703 R727	T699-E701 PolarHBondContact O-N 3.32Å; T699-E701 VanDerWaalsContact O-N 3.1Å; T699-E701 PolarHBondContact OG1-N 3.14Å; E701-Y703 VanDerWaalsContact C-N 3.33Å; E701-R727 PolarHBondContact O-NE 2.89Å; E701-R727 PolarHBondContact O-NH1 2.82Å; E701-R727 VanDerWaalsContact O-NH1 3.08Å; E701-R727 PolarHBondContact O-NH2 3.08Å
702	D	88.1	Confident	86.3	Confident	37 Å²	37	74.1 Å²	74.1	20%	0.198	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-16.1	179.9	-63.9	-60.9	0	0	0	112.9	C698 T699 L726 R727 V730	C698-D702 HydrophobicContact CB-CB 4.41Å; T699-D702 WeakPolarHBondContact CA-OD2 3.42Å; T699-D702 WeakPolarHBondContact CB-OD2 3.45Å; T699-D702 PolarHBondContact N-OD2 2.81Å; T699-D702 WeakPolarHBondContact O-CB 3.49Å; T699-D702 PolarHBondContact O-N 3.42Å; T699-D702 PolarHBondContact OG1-OD2 2.89Å; D702-L726 HydrophobicContact CB-CD1 4.06Å; D702-R727 WeakPolarHBondContact O-CB 3.48Å; D702-R727 VanDerWaalsContact O-CG 3.27Å; D702-R727 WeakPolarHBondContact O-CG 3.34Å; D702-R727 PolarHBondContact O-N 2.92Å; D702-V730 HydrophobicContact CB-CG1 4Å; D702-V730 WeakPolarHBondContact OD1-CG1 3.39Å
703	Y	86.7	Confident	86.2	Confident	16 Å²	16	77.5 Å²	77.5	6%	0.063	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	161.7	-178.9	-63.5	-82.8	0	0	0	113.2	C698 T699 E701 Q724 K725 L726 R727	C698-Y703 HydrophobicContact CB-CE2 3.82Å; C698-Y703 WeakPolarHBondContact CB-OH 3.35Å; T699-Y703 WeakPolarHBondContact O-CD2 3.34Å; T699-Y703 WeakPolarHBondContact O-CE2 3.35Å; E701-Y703 VanDerWaalsContact C-N 3.33Å; Y703-Q724 HydrophobicContact CD1-CB 4.37Å; Y703-K725 CarbonylContact C-O 3.55Å; Y703-K725 WeakPolarHBondContact CA-O 3.32Å; Y703-L726 HydrophobicContact CD1-CD1 4.37Å; Y703-L726 HydrophobicContact CE1-CD1 4.24Å; Y703-R727 PolarHBondContact O-NE 2.66Å; Y703-R727 PolarHBondContact O-NH2 3.23Å
704	M	88.2	Confident	86.2	Confident	78 Å²	78	79.1 Å²	79.1	38%	0.384	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	145.3	167.6	61.1	178.5	-174.3	0	0	109.8	K725 R727	M704-K725 HydrophobicContact CE-CB 4.07Å; M704-K725 HydrophobicContact CG-CB 4.37Å; M704-K725 PolarHBondContact N-O 2.81Å; M704-K725 PolarHBondContact O-N 2.91Å; M704-R727 HydrophobicContact CB-CG 4.09Å; M704-R727 HydrophobicContact CG-CG 4.27Å
705	T	88.3	Confident	86.3	Confident	102 Å²	102	80.7 Å²	80.7	63%	0.626	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	120.3	173.9	49.9	0	0	0	0	110.3	I722 F723	T705-I722 HydrophobicContact CG2-CG2 4.1Å; T705-F723 WeakPolarHBondContact CA-O 3.12Å
706	W	89.6	Confident	86.9	Confident	37 Å²	37	73.9 Å²	73.9	14%	0.14	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135.8	166.4	169.4	62.6	0	0	0	109.5	I500 D598 A599 L708 I722 F723 K725	I500-W706 HydrophobicContact CD1-CH2 3.99Å; I500-W706 HydrophobicContact CD1-CZ3 4.16Å; D598-W706 VanDerWaalsContact CA-CZ2 3.48Å; D598-W706 HydrophobicContact CB-CZ2 4.04Å; A599-W706 HydrophobicContact CB-CH2 4.04Å; W706-L708 HydrophobicContact CH2-CB 4.41Å; W706-L708 HydrophobicContact CH2-CD1 3.58Å; W706-L708 HydrophobicContact CZ2-CD1 3.84Å; W706-I722 WeakPolarHBondContact O-CA 3.16Å; W706-F723 HydrophobicContact CE3-CB 4.09Å; W706-F723 AromaticContact CE3-CD2 3.84Å; W706-F723 HydrophobicContact CE3-CD2 3.84Å; W706-F723 HydrophobicContact CE3-CG 4.33Å; W706-F723 AromaticContact CZ3-CD2 3.68Å; W706-F723 HydrophobicContact CZ3-CD2 3.68Å; W706-F723 HydrophobicContact CZ3-CE2 4.2Å; W706-F723 HydrophobicContact CZ3-CG 4.38Å; W706-F723 PolarHBondContact N-O 2.95Å; W706-F723 PolarHBondContact O-N 3.25Å; W706-K725 HydrophobicContact CB-CD 3.7Å; W706-K725 HydrophobicContact CB-CG 3.91Å; W706-K725 HydrophobicContact CD2-CD 4.09Å; W706-K725 HydrophobicContact CE3-CD 3.91Å; W706-K725 HydrophobicContact CE3-CG 4.46Å; W706-K725 HydrophobicContact CG-CD 4.02Å
707	Q	88.9	Confident	86.9	Confident	75 Å²	75	67.7 Å²	67.7	35%	0.35	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	127.4	176.8	-178.3	170.2	9.1	0	0	109.1	V714 I722	Q707-V714 HydrophobicContact CG-CG1 4.47Å; Q707-I722 HydrophobicContact CB-CG1 4.48Å; Q707-I722 HydrophobicContact CG-CG1 4.33Å
708	L	89.6	Confident	86.9	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	32%	0.318	C	S	.	.			trans	-67.5	137.1	175.3	-178.1	68.2	0	0	0	110.2	I500 A599 W706 I716 R721 F723	I500-L708 HydrophobicContact CD1-CD1 4.12Å; I500-L708 HydrophobicContact CG2-CD1 4.44Å; I500-L708 HydrophobicContact CG2-CD2 3.56Å; A599-L708 HydrophobicContact CB-CD1 3.8Å; W706-L708 HydrophobicContact CH2-CB 4.41Å; W706-L708 HydrophobicContact CH2-CD1 3.58Å; W706-L708 HydrophobicContact CZ2-CD1 3.84Å; L708-I716 HydrophobicContact CD2-CD1 3.87Å; L708-I716 HydrophobicContact CD2-CG2 4.43Å; L708-I716 HydrophobicContact CG-CD1 3.73Å; L708-R721 HydrophobicContact CB-CB 4.23Å; L708-R721 HydrophobicContact CD2-CB 4.36Å; L708-R721 PolarHBondContact N-O 3.2Å; L708-F723 HydrophobicContact CB-CE2 4.2Å
709	H	90.2	Very high	86.8	Confident	60 Å²	60	58.3 Å²	58.3	28%	0.278	32%	0.319	S	S	.	.			trans	-144.2	164.9	171.3	62	64.4	0	0	0	111.6	N601 E713 V714	N601-H709 PolarHBondContact ND2-O 3.02Å; N601-H709 PolarHBondContact OD1-CE1 3.13Å; N601-H709 PolarHBondContact OD1-ND1 3.05Å; N601-H709 PolarHBondContact OD1-O 2.84Å; H709-E713 CarbonylContact C-O 3.51Å; H709-E713 WeakPolarHBondContact CA-O 3.27Å; H709-E713 WeakPolarHBondContact CB-O 3.45Å; H709-V714 HydrophobicContact CB-CG1 4.26Å
710	N	86.8	Confident	86.9	Confident	30 Å²	30	58.6 Å²	58.6	16%	0.16	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-121.8	112.2	164.1	176.6	39.4	0	0	0	107.9	Y520 G712 E713 I716	Y520-N710 HydrophobicContact CD2-CB 3.93Å; Y520-N710 VanDerWaalsContact CD2-CG 3.44Å; Y520-N710 WeakPolarHBondContact CD2-OD1 3.4Å; Y520-N710 HydrophobicContact CE2-CB 4.32Å; Y520-N710 WeakPolarHBondContact CE2-OD1 3.39Å; Y520-N710 HydrophobicContact CG-CB 4.11Å; N710-G712 PolarHBondContact O-N 3.32Å; N710-E713 PolarHBondContact N-O 2.64Å; N710-E713 WeakPolarHBondContact O-CB 3.39Å; N710-E713 PolarHBondContact O-N 3.45Å; N710-I716 HydrophobicContact CB-CD1 4.23Å
711	E	81.5	Confident	87.1	Confident	144 Å²	144	55.6 Å²	55.6	67%	0.673	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	20.4	-177.6	-56.2	-162.6	146.1	0	0	115.6	N601	N601-E711 PolarHBondContact OD1-N 2.91Å; N601-E711 VanDerWaalsContact OD1-N 3.15Å
712	G	82.1	Confident	87.1	Confident	53 Å²	53	50.5 Å²	50.5	55%	0.546	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	105	-11.9	-176.1	0	0	0	0	0	115	N710 V714	N710-G712 PolarHBondContact O-N 3.32Å; G712-V714 PolarHBondContact O-N 2.9Å
713	E	86.3	Confident	87	Confident	132 Å²	132	49.3 Å²	49.3	62%	0.617	26%	0.257	S	S	*	.	B	Isolated β-bridge	trans	-73.6	115.5	169.2	-63.2	-156.3	142.7	0	0	110.5	H709 N710	H709-E713 CarbonylContact C-O 3.51Å; H709-E713 WeakPolarHBondContact CA-O 3.27Å; H709-E713 WeakPolarHBondContact CB-O 3.45Å; N710-E713 PolarHBondContact N-O 2.64Å; N710-E713 WeakPolarHBondContact O-CB 3.39Å; N710-E713 PolarHBondContact O-N 3.45Å
714	V	87	Confident	86.9	Confident	54 Å²	54	51.5 Å²	51.5	33%	0.327	27%	0.268	S	S	.	.			trans	-93.8	2.7	-174.2	-61.9	0	0	0	0	114.7	Q707 H709 G712	Q707-V714 HydrophobicContact CG-CG1 4.47Å; H709-V714 HydrophobicContact CB-CG1 4.26Å; G712-V714 PolarHBondContact O-N 2.9Å
715	C	87.8	Confident	86.7	Confident	39 Å²	39	48.4 Å²	48.4	26%	0.264	25%	0.253	S	S	.	.			trans	-110.9	110.1	178.2	-173.3	0	0	0	0	109.7	C747	C715-C747 HydrophobicContact CB-CB 4.17Å; C715-C747 WeakPolarHBondContact CB-SG 3.3Å; C715-C747 WeakPolarHBondContact SG-CB 3.27Å; C715-C747 CovalentContact SG-SG 2.02Å; C715-C747 PolarHBondContact SG-SG 2.99Å
716	I	87.1	Confident	86.7	Confident	12 Å²	12	44.4 Å²	44.4	6%	0.062	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-126.6	128	-176.6	-73.1	159.8	0	0	0	108.2	Y520 L708 N710 G718 M719	Y520-I716 VanDerWaalsContact O-CG2 3.26Å; Y520-I716 WeakPolarHBondContact O-CG2 3.34Å; L708-I716 HydrophobicContact CD2-CD1 3.87Å; L708-I716 HydrophobicContact CD2-CG2 4.43Å; L708-I716 HydrophobicContact CG-CD1 3.73Å; N710-I716 HydrophobicContact CB-CD1 4.23Å; I716-G718 PolarHBondContact O-N 3.4Å; I716-M719 PolarHBondContact N-O 3.05Å; I716-M719 PolarHBondContact O-N 3.19Å; I716-M719 VanDerWaalsContact O-N 3.13Å; I716-M719 VanDerWaalsContact O-O 3.12Å
717	M	86.5	Confident	86.6	Confident	9 Å²	9	48.5 Å²	48.5	4%	0.044	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	41.2	-171	-60.2	-61.9	-75.5	0	0	112.7	N521 K522 M719 A798 L799 N801 N802	N521-M717 HydrophobicContact CB-SD 4.42Å; K522-M717 HydrophobicContact CB-CE 3.98Å; K522-M717 HydrophobicContact CB-SD 4.27Å; K522-M717 HydrophobicContact CD-CE 4.33Å; M717-M719 VanDerWaalsContact C-N 3.26Å; M717-M719 PolarHBondContact O-N 2.89Å; M717-A798 HydrophobicContact CE-CB 4.17Å; M717-L799 VanDerWaalsContact CE-O 3.23Å; M717-L799 WeakPolarHBondContact CE-O 3.34Å; M717-N801 VanDerWaalsContact C-CG 3.45Å; M717-N801 VanDerWaalsContact C-ND2 3.26Å; M717-N801 WeakPolarHBondContact CA-ND2 3.31Å; M717-N801 HydrophobicContact CE-CB 4.34Å; M717-N801 WeakPolarHBondContact O-CA 3.44Å; M717-N802 PolarHBondContact O-N 3.12Å
718	G	86.8	Confident	86.4	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	8.3	178.6	0	0	0	0	0	116.3	I716 C747 D753 N801 C803	I716-G718 PolarHBondContact O-N 3.4Å; G718-C747 VanDerWaalsContact C-SG 3.57Å; G718-C747 WeakPolarHBondContact O-CB 3.5Å; G718-C747 PolarHBondContact O-N 2.99Å; G718-C747 PolarHBondContact O-SG 3.46Å; G718-D753 WeakPolarHBondContact CA-OD1 3.33Å; G718-D753 PolarHBondContact N-OD1 2.85Å; G718-D753 VanDerWaalsContact N-OD1 3.13Å; G718-N801 WeakPolarHBondContact CA-OD1 3.45Å; G718-N801 PolarHBondContact N-ND2 2.68Å; G718-C803 WeakPolarHBondContact O-CA 3.3Å; G718-C803 PolarHBondContact O-N 3.48Å
719	M	86.4	Confident	86.1	Confident	20 Å²	20	52.1 Å²	52.1	10%	0.099	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	150.1	-179.8	-62	-176	75.3	0	0	112.6	I716 M717 R721 M743 N802	I716-M719 PolarHBondContact N-O 3.05Å; I716-M719 PolarHBondContact O-N 3.19Å; I716-M719 VanDerWaalsContact O-N 3.13Å; I716-M719 VanDerWaalsContact O-O 3.12Å; M717-M719 VanDerWaalsContact C-N 3.26Å; M717-M719 PolarHBondContact O-N 2.89Å; M719-R721 HydrophobicContact CB-CG 4.41Å; M719-M743 HydrophobicContact CE-CB 4.03Å; M719-M743 HydrophobicContact CE-CG 4.15Å; M719-M743 HydrophobicContact CE-SD 4.03Å; M719-N802 HydrophobicContact CG-CB 3.65Å; M719-N802 HydrophobicContact SD-CB 3.69Å
720	K	88.3	Confident	86	Confident	76 Å²	76	50.9 Å²	50.9	33%	0.33	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.1	160.5	-68.2	166.8	-171.8	165.7	0	108.8	S744	K720-S744 WeakPolarHBondContact CB-OG 3.4Å; K720-S744 PolarHBondContact O-N 2.82Å; K720-S744 PolarHBondContact O-OG 3.37Å
721	R	86.1	Confident	86	Confident	42 Å²	42	54.3 Å²	54.3	16%	0.158	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	122.3	-179.2	-62	179.1	-177.7	170.3	-3	110.3	K501 L708 M719 F723	K501-R721 PolarHBondContact O-NH1 3.33Å; K501-R721 PolarHBondContact O-NH2 2.86Å; L708-R721 HydrophobicContact CB-CB 4.23Å; L708-R721 HydrophobicContact CD2-CB 4.36Å; L708-R721 PolarHBondContact N-O 3.2Å; M719-R721 HydrophobicContact CB-CG 4.41Å; R721-F723 HydrophobicContact CB-CE2 3.9Å; R721-F723 HydrophobicContact CB-CZ 4.27Å
722	I	87.1	Confident	86.3	Confident	44 Å²	44	47.6 Å²	47.6	23%	0.226	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.4	177.5	-55.7	177.3	0	0	0	108.1	T705 W706 Q707 Q742	T705-I722 HydrophobicContact CG2-CG2 4.1Å; W706-I722 WeakPolarHBondContact O-CA 3.16Å; Q707-I722 HydrophobicContact CB-CG1 4.48Å; Q707-I722 HydrophobicContact CG-CG1 4.33Å; I722-Q742 PolarHBondContact O-N 2.85Å; I722-Q742 VanDerWaalsContact O-N 3.11Å
723	F	85.6	Confident	86.5	Confident	11 Å²	11	46.7 Å²	46.7	5%	0.048	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146.7	-178.9	-62.1	-83.1	0	0	0	110.2	I500 P573 T705 W706 L708 R721	I500-F723 HydrophobicContact CD1-CE2 4.39Å; I500-F723 HydrophobicContact CG1-CE2 4.42Å; I500-F723 HydrophobicContact CG1-CZ 4.1Å; P573-F723 HydrophobicContact CB-CD1 3.87Å; P573-F723 HydrophobicContact CB-CE1 3.84Å; P573-F723 HydrophobicContact CB-CG 4.29Å; P573-F723 HydrophobicContact CB-CZ 4.25Å; P573-F723 HydrophobicContact CG-CB 4.16Å; P573-F723 HydrophobicContact CG-CD1 3.47Å; P573-F723 VanDerWaalsContact CG-CD1 3.47Å; P573-F723 HydrophobicContact CG-CE1 3.95Å; P573-F723 HydrophobicContact CG-CG 3.88Å; T705-F723 WeakPolarHBondContact CA-O 3.12Å; W706-F723 HydrophobicContact CE3-CB 4.09Å; W706-F723 AromaticContact CE3-CD2 3.84Å; W706-F723 HydrophobicContact CE3-CD2 3.84Å; W706-F723 HydrophobicContact CE3-CG 4.33Å; W706-F723 AromaticContact CZ3-CD2 3.68Å; W706-F723 HydrophobicContact CZ3-CD2 3.68Å; W706-F723 HydrophobicContact CZ3-CE2 4.2Å; W706-F723 HydrophobicContact CZ3-CG 4.38Å; W706-F723 PolarHBondContact N-O 2.95Å; W706-F723 PolarHBondContact O-N 3.25Å; L708-F723 HydrophobicContact CB-CE2 4.2Å; R721-F723 HydrophobicContact CB-CE2 3.9Å; R721-F723 HydrophobicContact CB-CZ 4.27Å
724	Q	84.3	Confident	86.2	Confident	63 Å²	63	41.1 Å²	41.1	29%	0.294	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	116.3	171.6	-61.6	-172.2	9.8	0	0	108.9	Y703 Y739	Y703-Q724 HydrophobicContact CD1-CB 4.37Å; Q724-Y739 PolarHBondContact O-OH 2.82Å; Q724-Y739 VanDerWaalsContact O-OH 3.09Å
725	K	85.6	Confident	85.5	Confident	13 Å²	13	39.6 Å²	39.6	6%	0.057	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	152	174.8	-51.4	-165.6	89.3	-164.2	0	109.2	S597 E641 Y703 M704 W706	S597-K725 PolarHBondContact O-NZ 2.96Å; E641-K725 WeakPolarHBondContact OE1-CE 3.37Å; E641-K725 IonicContact OE1-NZ 2.72Å; E641-K725 PolarHBondContact OE1-NZ 2.97Å; E641-K725 IonicContact OE2-NZ 3.51Å; E641-K725 PolarHBondContact OE2-NZ 2.91Å; Y703-K725 CarbonylContact C-O 3.55Å; Y703-K725 WeakPolarHBondContact CA-O 3.32Å; M704-K725 HydrophobicContact CE-CB 4.07Å; M704-K725 HydrophobicContact CG-CB 4.37Å; M704-K725 PolarHBondContact N-O 2.81Å; M704-K725 PolarHBondContact O-N 2.91Å; W706-K725 HydrophobicContact CB-CD 3.7Å; W706-K725 HydrophobicContact CB-CG 3.91Å; W706-K725 HydrophobicContact CD2-CD 4.09Å; W706-K725 HydrophobicContact CE3-CD 3.91Å; W706-K725 HydrophobicContact CE3-CG 4.46Å; W706-K725 HydrophobicContact CG-CD 4.02Å
726	L	86.3	Confident	84.3	Confident	18 Å²	18	44.5 Å²	44.5	9%	0.094	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	145	175.3	-166.6	65.2	0	0	0	109.5	D702 Y703 V730	D702-L726 HydrophobicContact CB-CD1 4.06Å; Y703-L726 HydrophobicContact CD1-CD1 4.37Å; Y703-L726 HydrophobicContact CE1-CD1 4.24Å; L726-V730 HydrophobicContact CD1-CB 4.3Å; L726-V730 HydrophobicContact CD1-CG1 4.37Å; L726-V730 HydrophobicContact CD2-CB 4.43Å; L726-V730 WeakPolarHBondContact CD2-O 3.29Å; L726-V730 HydrophobicContact CG-CB 4.2Å
727	R	87.8	Confident	82.9	Confident	123 Å²	123	50.8 Å²	50.8	46%	0.464	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-69	144.4	171.6	-68.7	172.6	-168.6	-176.8	10.4	110	E701 D702 Y703 M704 N729 V730	E701-R727 PolarHBondContact O-NE 2.89Å; E701-R727 PolarHBondContact O-NH1 2.82Å; E701-R727 VanDerWaalsContact O-NH1 3.08Å; E701-R727 PolarHBondContact O-NH2 3.08Å; D702-R727 WeakPolarHBondContact O-CB 3.48Å; D702-R727 VanDerWaalsContact O-CG 3.27Å; D702-R727 WeakPolarHBondContact O-CG 3.34Å; D702-R727 PolarHBondContact O-N 2.92Å; Y703-R727 PolarHBondContact O-NE 2.66Å; Y703-R727 PolarHBondContact O-NH2 3.23Å; M704-R727 HydrophobicContact CB-CG 4.09Å; M704-R727 HydrophobicContact CG-CG 4.27Å; R727-N729 PolarHBondContact O-N 3.28Å; R727-V730 HydrophobicContact CB-CG2 3.8Å; R727-V730 WeakPolarHBondContact O-CG2 3.45Å; R727-V730 PolarHBondContact O-N 2.91Å
728	A	86.3	Confident	81.3	Confident	52 Å²	52	55 Å²	55	43%	0.43	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	137.5	178.4	0	0	0	0	0	112	D640 V730	D640-A728 HydrophobicContact CB-CB 3.7Å; A728-V730 PolarHBondContact O-N 3.05Å
729	N	82.9	Confident	79.8	Confident	100 Å²	100	58.5 Å²	58.5	54%	0.535	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	9.7	179.1	-56.1	-31.9	0	0	0	116.2	F639 R727 R731	F639-N729 PolarHBondContact O-N 2.83Å; R727-N729 PolarHBondContact O-N 3.28Å; N729-R731 PolarHBondContact O-N 2.9Å
730	V	86.9	Confident	78.3	Confident	33 Å²	33	63.4 Å²	63.4	20%	0.2	30%	0.303	C	S	.	.			trans	-77.5	119.7	171.8	-176.1	0	0	0	0	110.3	D702 L726 R727 A728 C732	D702-V730 HydrophobicContact CB-CG1 4Å; D702-V730 WeakPolarHBondContact OD1-CG1 3.39Å; L726-V730 HydrophobicContact CD1-CB 4.3Å; L726-V730 HydrophobicContact CD1-CG1 4.37Å; L726-V730 HydrophobicContact CD2-CB 4.43Å; L726-V730 WeakPolarHBondContact CD2-O 3.29Å; L726-V730 HydrophobicContact CG-CB 4.2Å; R727-V730 HydrophobicContact CB-CG2 3.8Å; R727-V730 WeakPolarHBondContact O-CG2 3.45Å; R727-V730 PolarHBondContact O-N 2.91Å; A728-V730 PolarHBondContact O-N 3.05Å; V730-C732 HydrophobicContact CG1-CB 4.31Å; V730-C732 VanDerWaalsContact CG1-SG 3.6Å; V730-C732 PolarHBondContact O-N 3.36Å
731	R	87	Confident	76.7	Confident	102 Å²	102	62.1 Å²	62.1	39%	0.385	30%	0.304	S	S	.	.			trans	-97.4	79.2	-179	-61.1	174.9	-179.3	160	0.6	110.5	E181 I693 N729	E181-R731 IonicContact OE2-CZ 3.19Å; E181-R731 IonicContact OE2-NH1 2.73Å; E181-R731 PolarHBondContact OE2-NH1 2.92Å; E181-R731 IonicContact OE2-NH2 3.7Å; E181-R731 PolarHBondContact OE2-NH2 2.96Å; I693-R731 HydrophobicContact CG2-CB 4.35Å; I693-R731 HydrophobicContact CG2-CG 4.17Å; N729-R731 PolarHBondContact O-N 2.9Å
732	C	87.9	Confident	75.2	Confident	4 Å²	4	65.5 Å²	65.5	3%	0.027	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	152.7	177.6	63.6	0	0	0	0	113.3	N617 K696 C698 V730	N617-C732 PolarHBondContact ND2-O 2.94Å; K696-C732 CarbonylContact O-C 3.47Å; K696-C732 WeakPolarHBondContact O-CA 3.44Å; K696-C732 WeakPolarHBondContact O-CB 3.08Å; C698-C732 WeakPolarHBondContact CA-SG 3.44Å; C698-C732 HydrophobicContact CB-CB 4.01Å; C698-C732 WeakPolarHBondContact CB-SG 3.35Å; C698-C732 WeakPolarHBondContact SG-CB 3.47Å; C698-C732 PolarHBondContact SG-O 2.81Å; C698-C732 VanDerWaalsContact SG-O 3.36Å; C698-C732 CovalentContact SG-SG 2.04Å; C698-C732 PolarHBondContact SG-SG 2.81Å; V730-C732 HydrophobicContact CG1-CB 4.31Å; V730-C732 VanDerWaalsContact CG1-SG 3.6Å; V730-C732 PolarHBondContact O-N 3.36Å
733	V	86.8	Confident	73.7	Confident	33 Å²	33	70.1 Å²	70.1	20%	0.2	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	124.3	174.2	-173.5	0	0	0	0	110.1	N617 L669 F694 K696 R697 C698	N617-V733 WeakPolarHBondContact OD1-CA 3.16Å; L669-V733 HydrophobicContact CD1-CG1 4.21Å; L669-V733 HydrophobicContact CD1-CG2 4.4Å; F694-V733 HydrophobicContact CB-CG2 3.47Å; F694-V733 VanDerWaalsContact CB-CG2 3.47Å; F694-V733 HydrophobicContact CG-CG2 4.42Å; F694-V733 WeakPolarHBondContact O-CG2 3.39Å; K696-V733 PolarHBondContact O-N 2.95Å; R697-V733 WeakPolarHBondContact CA-O 3.15Å; C698-V733 PolarHBondContact N-O 3.13Å; C698-V733 VanDerWaalsContact SG-C 3.5Å; C698-V733 PolarHBondContact SG-O 2.85Å; C698-V733 VanDerWaalsContact SG-O 3.35Å
734	K	80.6	Confident	72.6	Confident	16 Å²	16	71 Å²	71	7%	0.07	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-66.1	147.3	173.6	-75.3	178.7	54.4	-172.3	0	110.6	T571 N617 Q618	T571-K734 PolarHBondContact O-NZ 3.1Å; N617-K734 PolarHBondContact OD1-N 2.94Å; Q618-K734 HydrophobicContact CB-CB 4.31Å; Q618-K734 HydrophobicContact CB-CD 3.95Å; Q618-K734 HydrophobicContact CG-CB 4.32Å; Q618-K734 PolarHBondContact O-NZ 3.04Å; Q618-K734 VanDerWaalsContact OE1-CE 3.23Å
735	A	71.8	Confident	72.1	Confident	21 Å²	21	73.9 Å²	73.9	17%	0.174	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-91.6	130.7	177.6	0	0	0	0	0	111.2	D737 Q738	A735-D737 PolarHBondContact O-N 3.41Å; A735-D737 VanDerWaalsContact O-N 3.13Å; A735-Q738 HydrophobicContact CB-CB 4.32Å; A735-Q738 HydrophobicContact CB-CG 4.12Å; A735-Q738 PolarHBondContact O-N 3.34Å
736	R	62.7	Low	72.1	Confident	142 Å²	142	75.6 Å²	75.6	54%	0.536	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-46.4	-42.2	176.1	-69.6	-177.9	178.4	169.2	2.5	113.1	N209 D667 Q738	N209-R736 PolarHBondContact OD1-NH1 2.96Å; N209-R736 PolarHBondContact OD1-NH2 3.15Å; D667-R736 IonicContact OD2-CZ 2.72Å; D667-R736 IonicContact OD2-NE 2.72Å; D667-R736 PolarHBondContact OD2-NE 3.28Å; D667-R736 IonicContact OD2-NH2 2.69Å; D667-R736 PolarHBondContact OD2-NH2 3.28Å; R736-Q738 PolarHBondContact O-N 2.83Å
737	D	58	Low	72.2	Confident	144 Å²	144	75.4 Å²	75.4	77%	0.77	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-90.4	1.9	-165.5	-33.8	-54.8	0	0	0	113.6	A735	A735-D737 PolarHBondContact O-N 3.41Å; A735-D737 VanDerWaalsContact O-N 3.13Å
738	Q	53.1	Low	72.3	Confident	99 Å²	99	73.9 Å²	73.9	46%	0.463	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-106.8	1.7	-172.8	-72.9	-174.1	-20.1	0	0	114.6	A735 R736 I740	A735-Q738 HydrophobicContact CB-CB 4.32Å; A735-Q738 HydrophobicContact CB-CG 4.12Å; A735-Q738 PolarHBondContact O-N 3.34Å; R736-Q738 PolarHBondContact O-N 2.83Å; Q738-I740 PolarHBondContact O-N 2.82Å
739	Y	54.6	Low	72.3	Confident	73 Å²	73	72 Å²	72	29%	0.286	37%	0.37	S	S	.	.			trans	-79.4	49.4	-178.7	-135.1	-101.8	0	0	0	114.6	P573 Q724 S741	P573-Y739 WeakPolarHBondContact CD-OH 3.5Å; P573-Y739 HydrophobicContact CG-CE1 4.12Å; P573-Y739 WeakPolarHBondContact CG-OH 3.43Å; Q724-Y739 PolarHBondContact O-OH 2.82Å; Q724-Y739 VanDerWaalsContact O-OH 3.09Å; Y739-S741 PolarHBondContact O-N 2.89Å
740	I	53.8	Low	72.4	Confident	122 Å²	122	70.3 Å²	70.3	63%	0.626	36%	0.363	S	S	*	.			trans	-78.2	106.6	170.2	-58.9	175	0	0	0	107.7	Q738 Q742	Q738-I740 PolarHBondContact O-N 2.82Å; I740-Q742 PolarHBondContact O-N 2.87Å; I740-Q742 VanDerWaalsContact O-N 3.1Å
741	S	54.9	Low	72.1	Confident	49 Å²	49	72.6 Å²	72.6	34%	0.343	37%	0.372	S	S	.	.			trans	-61.4	113.4	158.5	55.7	0	0	0	0	107.2	Y739 M743	Y739-S741 PolarHBondContact O-N 2.89Å; S741-M743 PolarHBondContact O-N 3.38Å
742	Q	54.7	Low	71.9	Confident	114 Å²	114	69.9 Å²	69.9	53%	0.533	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	80.5	-170.7	-164.2	168	5.4	0	0	108.2	I722 I740 S744	I722-Q742 PolarHBondContact O-N 2.85Å; I722-Q742 VanDerWaalsContact O-N 3.11Å; I740-Q742 PolarHBondContact O-N 2.87Å; I740-Q742 VanDerWaalsContact O-N 3.1Å; Q742-S744 PolarHBondContact O-N 2.87Å
743	M	57	Low	71.8	Confident	141 Å²	141	70 Å²	70	70%	0.695	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-51.6	111.6	177.4	-65.8	-173.3	-176.3	0	0	109	M719 S741	M719-M743 HydrophobicContact CE-CB 4.03Å; M719-M743 HydrophobicContact CE-CG 4.15Å; M719-M743 HydrophobicContact CE-SD 4.03Å; S741-M743 PolarHBondContact O-N 3.38Å
744	S	61.2	Low	71.8	Confident	28 Å²	28	69.5 Å²	69.5	20%	0.196	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	175.2	176.2	68.4	0	0	0	0	110.2	K720 Q742 S746	K720-S744 WeakPolarHBondContact CB-OG 3.4Å; K720-S744 PolarHBondContact O-N 2.82Å; K720-S744 PolarHBondContact O-OG 3.37Å; Q742-S744 PolarHBondContact O-N 2.87Å; S744-S746 PolarHBondContact O-N 2.88Å
745	D	74.8	Confident	72.1	Confident	125 Å²	125	69.4 Å²	69.4	67%	0.668	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-49.6	134.8	-165.9	-45.8	-61.9	0	0	0	113.7	C747	D745-C747 PolarHBondContact O-N 3.08Å
746	S	85.8	Confident	72.9	Confident	49 Å²	49	69.2 Å²	69.2	34%	0.343	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.7	138.4	165.8	-74.9	0	0	0	0	110.6	S744 N802	S744-S746 PolarHBondContact O-N 2.88Å; S746-N802 VanDerWaalsContact CB-O 3.27Å; S746-N802 WeakPolarHBondContact CB-O 3.09Å; S746-N802 PolarHBondContact OG-O 3.09Å
747	C	88.3	Confident	74.2	Confident	13 Å²	13	63.8 Å²	63.8	9%	0.088	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-72.2	167	173	-47.3	0	0	0	0	111	C715 G718 D745 C803 T804	C715-C747 HydrophobicContact CB-CB 4.17Å; C715-C747 WeakPolarHBondContact CB-SG 3.3Å; C715-C747 WeakPolarHBondContact SG-CB 3.27Å; C715-C747 CovalentContact SG-SG 2.02Å; C715-C747 PolarHBondContact SG-SG 2.99Å; G718-C747 VanDerWaalsContact C-SG 3.57Å; G718-C747 WeakPolarHBondContact O-CB 3.5Å; G718-C747 PolarHBondContact O-N 2.99Å; G718-C747 PolarHBondContact O-SG 3.46Å; D745-C747 PolarHBondContact O-N 3.08Å; C747-C803 WeakPolarHBondContact O-CA 3.31Å; C747-T804 PolarHBondContact O-N 2.84Å; C747-T804 PolarHBondContact O-OG1 3.15Å
748	V	88.6	Confident	75.7	Confident	92 Å²	92	58.4 Å²	58.4	56%	0.558	31%	0.314	S	S	*	.	B	Isolated β-bridge	trans	-75.9	137	158.9	-179.4	0	0	0	0	108	T750 G806	V748-T750 PolarHBondContact O-N 3.21Å; V748-G806 VanDerWaalsContact CG1-CA 3.44Å
749	C	86.9	Confident	77.4	Confident	13 Å²	13	53.9 Å²	53.9	9%	0.088	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-59.5	135.8	178.4	-61	0	0	0	0	112.8	F754 C803 T804 L808	C749-F754 HydrophobicContact CB-CE2 4.11Å; C749-F754 HydrophobicContact CB-CZ 4.45Å; C749-C803 WeakPolarHBondContact CA-SG 3.44Å; C749-C803 HydrophobicContact CB-CB 3.87Å; C749-C803 WeakPolarHBondContact CB-SG 3.45Å; C749-C803 WeakPolarHBondContact SG-CB 3.11Å; C749-C803 PolarHBondContact SG-O 2.66Å; C749-C803 CovalentContact SG-SG 2.03Å; C749-C803 PolarHBondContact SG-SG 3.21Å; C749-T804 PolarHBondContact N-O 2.88Å; C749-T804 PolarHBondContact SG-O 3Å; C749-L808 WeakPolarHBondContact O-CD1 3.38Å
750	T	84.6	Confident	79	Confident	63 Å²	63	51.7 Å²	51.7	39%	0.387	29%	0.287	S	S	.	.			trans	-115.4	179	179.8	69.7	0	0	0	0	110.8	V748 A752 D753 F754	V748-T750 PolarHBondContact O-N 3.21Å; T750-A752 PolarHBondContact O-N 3.06Å; T750-A752 WeakPolarHBondContact OG1-CB 3.45Å; T750-A752 PolarHBondContact OG1-N 3.31Å; T750-A752 VanDerWaalsContact OG1-N 3.11Å; T750-D753 WeakPolarHBondContact CB-OD2 3.31Å; T750-D753 PolarHBondContact N-OD2 3Å; T750-D753 PolarHBondContact O-N 3.34Å; T750-D753 PolarHBondContact OG1-OD2 2.85Å; T750-F754 VanDerWaalsContact O-CD2 3.26Å; T750-F754 WeakPolarHBondContact O-CD2 3.18Å; T750-F754 WeakPolarHBondContact O-CE2 3.3Å
751	E	82.1	Confident	80.7	Confident	82 Å²	82	49.9 Å²	49.9	38%	0.383	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-67.5	-18.4	169.9	-174.8	155.9	-138	0	0	112.6	R524 D753 K810 Y811	R524-E751 PolarHBondContact NH1-O 3.24Å; E751-D753 VanDerWaalsContact C-N 3.29Å; E751-D753 PolarHBondContact O-N 3.3Å; E751-K810 IonicContact OE1-NZ 2.65Å; E751-K810 PolarHBondContact OE1-NZ 3.18Å; E751-Y811 HydrophobicContact CG-CE1 3.98Å; E751-Y811 WeakPolarHBondContact CG-OH 3.06Å; E751-Y811 WeakPolarHBondContact OE1-CE1 3.27Å; E751-Y811 PolarHBondContact OE1-OH 2.99Å; E751-Y811 PolarHBondContact OE2-OH 3.12Å
752	A	80.9	Confident	82.2	Confident	44 Å²	44	52.6 Å²	52.6	36%	0.364	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-73.3	-18.5	176.6	0	0	0	0	0	113.6	R524 T750	R524-A752 PolarHBondContact NH1-O 3.2Å; T750-A752 PolarHBondContact O-N 3.06Å; T750-A752 WeakPolarHBondContact OG1-CB 3.45Å; T750-A752 PolarHBondContact OG1-N 3.31Å; T750-A752 VanDerWaalsContact OG1-N 3.11Å
753	D	86.4	Confident	83.8	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.032	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-88	-2.3	-175.4	-60.3	-71.5	0	0	0	114.3	G718 T750 E751 A798 N801	G718-D753 WeakPolarHBondContact CA-OD1 3.33Å; G718-D753 PolarHBondContact N-OD1 2.85Å; G718-D753 VanDerWaalsContact N-OD1 3.13Å; T750-D753 WeakPolarHBondContact CB-OD2 3.31Å; T750-D753 PolarHBondContact N-OD2 3Å; T750-D753 PolarHBondContact O-N 3.34Å; T750-D753 PolarHBondContact OG1-OD2 2.85Å; E751-D753 VanDerWaalsContact C-N 3.29Å; E751-D753 PolarHBondContact O-N 3.3Å; D753-A798 PolarHBondContact O-N 2.88Å; D753-N801 WeakPolarHBondContact CB-ND2 3.45Å; D753-N801 PolarHBondContact OD1-ND2 2.71Å; D753-N801 PolarHBondContact OD1-OD1 3.45Å
754	F	86.4	Confident	85.1	Confident	24 Å²	24	52 Å²	52	11%	0.105	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	128.1	-178.3	-63.1	-92.1	0	0	0	112	R524 C749 T750 R796 K797 Y811	R524-F754 PolarHBondContact NH1-O 2.84Å; C749-F754 HydrophobicContact CB-CE2 4.11Å; C749-F754 HydrophobicContact CB-CZ 4.45Å; T750-F754 VanDerWaalsContact O-CD2 3.26Å; T750-F754 WeakPolarHBondContact O-CD2 3.18Å; T750-F754 WeakPolarHBondContact O-CE2 3.3Å; F754-R796 CarbonylContact C-O 3.24Å; F754-R796 VanDerWaalsContact CA-O 3.26Å; F754-R796 WeakPolarHBondContact CA-O 3.14Å; F754-K797 HydrophobicContact CD1-CB 4.14Å; F754-K797 HydrophobicContact CE1-CB 4.06Å; F754-K797 HydrophobicContact CE1-CG 4.34Å; F754-Y811 HydrophobicContact CB-CD1 4.44Å; F754-Y811 HydrophobicContact CD1-CG 4.41Å; F754-Y811 HydrophobicContact CD2-CD1 4.44Å; F754-Y811 HydrophobicContact CD2-CD2 4.09Å; F754-Y811 AromaticContact CD2-CG 3.86Å; F754-Y811 HydrophobicContact CD2-CG 3.86Å; F754-Y811 HydrophobicContact CE2-CD2 4.05Å; F754-Y811 HydrophobicContact CE2-CG 4.11Å; F754-Y811 HydrophobicContact CG-CD1 4.4Å; F754-Y811 HydrophobicContact CG-CG 4.04Å; F754-Y811 HydrophobicContact CZ-CG 4.5Å
755	E	87.6	Confident	86.1	Confident	13 Å²	13	56.8 Å²	56.8	6%	0.061	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	166.3	173.2	61.4	-171.7	-157.6	0	0	111.2	M465 Y795 R796	M465-E755 VanDerWaalsContact CE-OE2 3.22Å; M465-E755 WeakPolarHBondContact CE-OE2 3.5Å; E755-Y795 CarbonylContact O-C 3.58Å; E755-Y795 VanDerWaalsContact O-CA 3.3Å; E755-Y795 WeakPolarHBondContact O-CA 3.49Å; E755-R796 HydrophobicContact CG-CG 3.65Å; E755-R796 PolarHBondContact N-O 2.9Å; E755-R796 PolarHBondContact O-N 3.43Å; E755-R796 IonicContact OE1-CZ 2.82Å; E755-R796 IonicContact OE1-NE 3.72Å; E755-R796 PolarHBondContact OE1-NE 2.74Å; E755-R796 IonicContact OE1-NH2 2.64Å; E755-R796 PolarHBondContact OE1-NH2 2.94Å
756	C	89.4	Confident	86.3	Confident	18 Å²	18	52 Å²	52	12%	0.122	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	138.9	173.9	-57.6	0	0	0	0	110.4	F760 C768 G794	C756-F760 HydrophobicContact CB-CB 4.21Å; C756-C768 WeakPolarHBondContact CA-SG 3.45Å; C756-C768 HydrophobicContact CB-CB 3.74Å; C756-C768 WeakPolarHBondContact CB-SG 3.43Å; C756-C768 WeakPolarHBondContact SG-CB 3.3Å; C756-C768 CovalentContact SG-SG 2.04Å; C756-C768 PolarHBondContact SG-SG 3.48Å; C756-G794 WeakPolarHBondContact CA-O 3.37Å
757	D	89.5	Confident	86.4	Confident	27 Å²	27	50.8 Å²	50.8	14%	0.144	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-80.9	168.4	179	-160.3	3.5	0	0	0	111.8	G759 F760 T792 G794 R796	D757-G759 PolarHBondContact O-N 2.77Å; D757-F760 HydrophobicContact CB-CD2 4.24Å; D757-F760 WeakPolarHBondContact O-CB 3.22Å; D757-F760 PolarHBondContact O-N 2.64Å; D757-T792 WeakPolarHBondContact CB-OG1 3.37Å; D757-T792 WeakPolarHBondContact OD2-CB 3.33Å; D757-T792 PolarHBondContact OD2-OG1 2.84Å; D757-G794 PolarHBondContact N-O 3.29Å; D757-R796 HydrophobicContact CB-CB 4.38Å; D757-R796 HydrophobicContact CB-CG 4.45Å; D757-R796 WeakPolarHBondContact OD1-CD 3.07Å; D757-R796 IonicContact OD1-NH1 3.87Å
758	Y	89.2	Confident	86.5	Confident	31 Å²	31	50.8 Å²	50.8	12%	0.122	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	128.5	-179.8	171.1	-94.2	0	0	0	112	K428 L429 F472 W773 F774	K428-Y758 HydrophobicContact CB-CE2 4.04Å; K428-Y758 WeakPolarHBondContact O-CE2 3.12Å; L429-Y758 PolarHBondContact O-OH 3.44Å; F472-Y758 HydrophobicContact CB-CD2 4.39Å; F472-Y758 HydrophobicContact CB-CG 4.19Å; F472-Y758 AromaticContact CD1-CD1 3.7Å; F472-Y758 HydrophobicContact CD1-CD1 3.7Å; F472-Y758 HydrophobicContact CD1-CD2 4.22Å; F472-Y758 HydrophobicContact CD1-CE1 4.14Å; F472-Y758 AromaticContact CD1-CG 3.73Å; F472-Y758 HydrophobicContact CD1-CG 3.73Å; F472-Y758 HydrophobicContact CE1-CD1 4.23Å; F472-Y758 HydrophobicContact CE1-CE1 4.44Å; F472-Y758 HydrophobicContact CG-CG 4.43Å; Y758-W773 HydrophobicContact CE1-CH2 4.45Å; Y758-W773 HydrophobicContact CE1-CZ3 4.48Å; Y758-W773 HydrophobicContact CE2-CH2 4.09Å; Y758-W773 AromaticContact CZ-CH2 3.94Å; Y758-F774 AromaticContact CD1-CE2 3.95Å; Y758-F774 HydrophobicContact CD1-CE2 3.95Å; Y758-F774 HydrophobicContact CD1-CZ 4.47Å; Y758-F774 HydrophobicContact CE1-CD2 4.27Å; Y758-F774 AromaticContact CE1-CE2 3.85Å; Y758-F774 HydrophobicContact CE1-CE2 3.85Å
759	G	88.2	Confident	86.6	Confident	5 Å²	5	49.1 Å²	49.1	5%	0.052	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	5.9	-174.8	0	0	0	0	0	115	D757 A771 F774	D757-G759 PolarHBondContact O-N 2.77Å; G759-A771 WeakPolarHBondContact O-CB 3.44Å; G759-A771 PolarHBondContact O-N 2.95Å; G759-F774 VanDerWaalsContact CA-CG 3.48Å; G759-F774 WeakPolarHBondContact O-CB 3.43Å; G759-F774 WeakPolarHBondContact O-CD1 3.34Å
760	F	89.6	Confident	86.7	Confident	26 Å²	26	50.7 Å²	50.7	11%	0.114	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	136.8	172.2	-64.1	-104.5	0	0	0	110.8	C756 D757 C768 T769 S770 F774 P776 T792 G794	C756-F760 HydrophobicContact CB-CB 4.21Å; D757-F760 HydrophobicContact CB-CD2 4.24Å; D757-F760 WeakPolarHBondContact O-CB 3.22Å; D757-F760 PolarHBondContact O-N 2.64Å; F760-C768 HydrophobicContact CB-CB 4.29Å; F760-T769 CarbonylContact C-O 3.57Å; F760-T769 VanDerWaalsContact CA-O 3.26Å; F760-T769 WeakPolarHBondContact CA-O 3.31Å; F760-T769 VanDerWaalsContact CD1-C 3.46Å; F760-S770 VanDerWaalsContact CD1-N 3.34Å; F760-F774 HydrophobicContact CD2-CD1 4.45Å; F760-F774 HydrophobicContact CD2-CE1 4.21Å; F760-F774 HydrophobicContact CE2-CD1 4.14Å; F760-F774 AromaticContact CE2-CE1 3.62Å; F760-F774 HydrophobicContact CE2-CE1 3.62Å; F760-F774 HydrophobicContact CZ-CE1 4.27Å; F760-P776 HydrophobicContact CE1-CG 4.13Å; F760-P776 HydrophobicContact CE2-CG 4.24Å; F760-P776 HydrophobicContact CZ-CB 4.04Å; F760-P776 HydrophobicContact CZ-CG 3.51Å; F760-T792 HydrophobicContact CE2-CG2 3.75Å; F760-T792 HydrophobicContact CZ-CG2 4.11Å; F760-G794 VanDerWaalsContact CG-CA 3.47Å; F760-G794 VanDerWaalsContact CZ-CA 3.46Å
761	E	88.5	Confident	86.9	Confident	84 Å²	84	47.9 Å²	47.9	39%	0.393	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	137.3	-177.7	-74.4	160	-170.4	0	0	109.2	Q763 T769 A771 W773	E761-Q763 PolarHBondContact O-NE2 3.13Å; E761-T769 PolarHBondContact N-O 2.98Å; E761-T769 PolarHBondContact O-N 2.62Å; E761-T769 VanDerWaalsContact O-N 3.07Å; E761-A771 HydrophobicContact CG-CB 3.92Å; E761-A771 WeakPolarHBondContact OE1-CB 3.15Å; E761-W773 PolarHBondContact OE1-NE1 3.35Å
762	R	87.5	Confident	87.3	Confident	106 Å²	106	52 Å²	52	40%	0.4	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	124.7	-177	-167.6	175.7	175.6	-160.4	-5.2	110.7	R524 D525	R524-R762 PolarHBondContact O-NH1 2.61Å; D525-R762 VanDerWaalsContact CG-NH1 3.31Å; D525-R762 IonicContact OD1-CZ 2.73Å; D525-R762 IonicContact OD1-NH1 2.66Å; D525-R762 PolarHBondContact OD1-NH1 2.9Å; D525-R762 IonicContact OD1-NH2 3.13Å; D525-R762 PolarHBondContact OD1-NH2 2.91Å; D525-R762 IonicContact OD2-NH1 2.75Å; D525-R762 IonicContact OD2-NH2 3.17Å
763	Q	88.1	Confident	87.5	Confident	84 Å²	84	51.5 Å²	51.5	39%	0.393	27%	0.27	S	S	.	.			trans	-87	166.8	179.1	-59.5	-54.5	-61	0	0	111.8	E761 D765 G766 S767 T769	E761-Q763 PolarHBondContact O-NE2 3.13Å; Q763-D765 WeakPolarHBondContact CB-OD1 3.32Å; Q763-D765 PolarHBondContact O-N 3.23Å; Q763-G766 WeakPolarHBondContact O-CA 3.49Å; Q763-G766 PolarHBondContact O-N 3.34Å; Q763-S767 PolarHBondContact N-O 3.35Å; Q763-T769 HydrophobicContact CG-CG2 3.72Å; Q763-T769 VanDerWaalsContact CG-OG1 3.24Å; Q763-T769 WeakPolarHBondContact CG-OG1 3.49Å; Q763-T769 PolarHBondContact NE2-OG1 2.96Å; Q763-T769 VanDerWaalsContact NE2-OG1 3.09Å
764	V	83.4	Confident	87.4	Confident	158 Å²	158	52.3 Å²	52.3	96%	0.958	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-22.9	-179.3	-176.6	0	0	0	0	112.9	G766	V764-G766 PolarHBondContact O-N 2.89Å
765	D	81.4	Confident	87.1	Confident	129 Å²	129	57.4 Å²	57.4	69%	0.69	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	3.5	172.5	73.3	-10.9	0	0	0	113.7	Q763 S767	Q763-D765 WeakPolarHBondContact CB-OD1 3.32Å; Q763-D765 PolarHBondContact O-N 3.23Å; D765-S767 VanDerWaalsContact C-N 3.3Å; D765-S767 PolarHBondContact O-N 2.97Å; D765-S767 VanDerWaalsContact OD1-CB 3.23Å; D765-S767 WeakPolarHBondContact OD1-CB 3.19Å; D765-S767 PolarHBondContact OD1-N 2.98Å; D765-S767 PolarHBondContact OD1-OG 3.5Å; D765-S767 PolarHBondContact OD2-OG 2.87Å
766	G	81.1	Confident	86.3	Confident	25 Å²	25	59.8 Å²	59.8	26%	0.258	32%	0.316	S	S	.	.	S	Bend	trans	83.9	-6.8	-177.3	0	0	0	0	0	114.8	Q763 V764	Q763-G766 WeakPolarHBondContact O-CA 3.49Å; Q763-G766 PolarHBondContact O-N 3.34Å; V764-G766 PolarHBondContact O-N 2.89Å
767	S	87.8	Confident	85	Confident	24 Å²	24	60.9 Å²	60.9	17%	0.168	32%	0.324	C	S	.	.			trans	-78.3	146.5	-178.4	73.2	0	0	0	0	112.8	Q763 D765	Q763-S767 PolarHBondContact N-O 3.35Å; D765-S767 VanDerWaalsContact C-N 3.3Å; D765-S767 PolarHBondContact O-N 2.97Å; D765-S767 VanDerWaalsContact OD1-CB 3.23Å; D765-S767 WeakPolarHBondContact OD1-CB 3.19Å; D765-S767 PolarHBondContact OD1-N 2.98Å; D765-S767 PolarHBondContact OD1-OG 3.5Å; D765-S767 PolarHBondContact OD2-OG 2.87Å
768	C	89.8	Confident	83.1	Confident	13 Å²	13	60.6 Å²	60.6	9%	0.088	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	122.9	171.3	-58	0	0	0	0	109.7	C756 F760 G794 Y795	C756-C768 WeakPolarHBondContact CA-SG 3.45Å; C756-C768 HydrophobicContact CB-CB 3.74Å; C756-C768 WeakPolarHBondContact CB-SG 3.43Å; C756-C768 WeakPolarHBondContact SG-CB 3.3Å; C756-C768 CovalentContact SG-SG 2.04Å; C756-C768 PolarHBondContact SG-SG 3.48Å; F760-C768 HydrophobicContact CB-CB 4.29Å; C768-G794 VanDerWaalsContact CB-O 3.23Å; C768-G794 WeakPolarHBondContact CB-O 3.44Å; C768-Y795 HydrophobicContact CB-CD1 4.02Å; C768-Y795 HydrophobicContact CB-CD2 4.46Å; C768-Y795 HydrophobicContact CB-CE1 3.7Å; C768-Y795 HydrophobicContact CB-CE2 4.12Å; C768-Y795 HydrophobicContact CB-CG 4.4Å; C768-Y795 PolarHBondContact N-OH 3.33Å; C768-Y795 VanDerWaalsContact SG-CD1 3.57Å; C768-Y795 WeakPolarHBondContact SG-CE1 3.34Å
769	T	90.8	Very high	81.1	Confident	57 Å²	57	60.8 Å²	60.8	35%	0.35	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	150.8	176.5	58.2	0	0	0	0	110.7	F760 E761 Q763 A771	F760-T769 CarbonylContact C-O 3.57Å; F760-T769 VanDerWaalsContact CA-O 3.26Å; F760-T769 WeakPolarHBondContact CA-O 3.31Å; F760-T769 VanDerWaalsContact CD1-C 3.46Å; E761-T769 PolarHBondContact N-O 2.98Å; E761-T769 PolarHBondContact O-N 2.62Å; E761-T769 VanDerWaalsContact O-N 3.07Å; Q763-T769 HydrophobicContact CG-CG2 3.72Å; Q763-T769 VanDerWaalsContact CG-OG1 3.24Å; Q763-T769 WeakPolarHBondContact CG-OG1 3.49Å; Q763-T769 PolarHBondContact NE2-OG1 2.96Å; Q763-T769 VanDerWaalsContact NE2-OG1 3.09Å; T769-A771 PolarHBondContact O-N 3.12Å
770	S	89.4	Confident	79.3	Confident	46 Å²	46	63 Å²	63	32%	0.322	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	127.4	177.7	-173.1	0	0	0	0	110.3	F760 F774 P776	F760-S770 VanDerWaalsContact CD1-N 3.34Å; S770-F774 PolarHBondContact OG-O 2.94Å; S770-P776 WeakPolarHBondContact OG-CD 3.25Å
771	A	88.8	Confident	77.7	Confident	3 Å²	3	65.2 Å²	65.2	3%	0.025	36%	0.355	C	S	.	.			trans	-58.9	151	172.3	0	0	0	0	0	110.9	G759 E761 T769 W773 F774	G759-A771 WeakPolarHBondContact O-CB 3.44Å; G759-A771 PolarHBondContact O-N 2.95Å; E761-A771 HydrophobicContact CG-CB 3.92Å; E761-A771 WeakPolarHBondContact OE1-CB 3.15Å; T769-A771 PolarHBondContact O-N 3.12Å; A771-W773 HydrophobicContact CB-CD2 4.2Å; A771-W773 HydrophobicContact CB-CG 4.19Å; A771-W773 HydrophobicContact CB-CZ2 4.19Å; A771-W773 PolarHBondContact O-N 2.82Å; A771-F774 HydrophobicContact CB-CB 4.24Å; A771-F774 PolarHBondContact O-N 2.84Å
772	F	88.9	Confident	76	Confident	168 Å²	168	65.7 Å²	65.7	74%	0.737	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-22.2	-176.6	80.2	-85.2	0	0	0	114	Y432	Y432-F772 HydrophobicContact CD2-CE1 4.45Å; Y432-F772 HydrophobicContact CD2-CE2 4.13Å; Y432-F772 AromaticContact CD2-CZ 3.61Å; Y432-F772 HydrophobicContact CD2-CZ 3.61Å; Y432-F772 AromaticContact CE2-CE2 3.6Å; Y432-F772 HydrophobicContact CE2-CE2 3.6Å; Y432-F772 AromaticContact CE2-CZ 3.6Å; Y432-F772 HydrophobicContact CE2-CZ 3.6Å
773	W	86.2	Confident	74.7	Confident	35 Å²	35	61.5 Å²	61.5	13%	0.133	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-11.8	-178.8	60.1	-97.6	0	0	0	113.5	P430 K431 Y432 Y758 E761 A771	P430-W773 HydrophobicContact CB-CH2 4.11Å; P430-W773 HydrophobicContact CB-CZ2 3.65Å; P430-W773 HydrophobicContact CG-CZ2 4.44Å; K431-W773 HydrophobicContact CB-CB 4.39Å; K431-W773 HydrophobicContact CB-CD2 3.91Å; K431-W773 HydrophobicContact CB-CE3 3.42Å; K431-W773 VanDerWaalsContact CB-CE3 3.42Å; K431-W773 HydrophobicContact CB-CG 4.33Å; K431-W773 HydrophobicContact CB-CZ3 4Å; K431-W773 HydrophobicContact CD-CB 4.47Å; Y432-W773 HydrophobicContact CD2-CB 3.83Å; Y432-W773 HydrophobicContact CD2-CG 4.28Å; Y432-W773 HydrophobicContact CE2-CB 3.54Å; Y432-W773 HydrophobicContact CE2-CG 4.45Å; Y758-W773 HydrophobicContact CE1-CH2 4.45Å; Y758-W773 HydrophobicContact CE1-CZ3 4.48Å; Y758-W773 HydrophobicContact CE2-CH2 4.09Å; Y758-W773 AromaticContact CZ-CH2 3.94Å; E761-W773 PolarHBondContact OE1-NE1 3.35Å; A771-W773 HydrophobicContact CB-CD2 4.2Å; A771-W773 HydrophobicContact CB-CG 4.19Å; A771-W773 HydrophobicContact CB-CZ2 4.19Å; A771-W773 PolarHBondContact O-N 2.82Å
774	F	84.1	Confident	73.4	Confident	22 Å²	22	62.3 Å²	62.3	10%	0.096	35%	0.353	C	S	.	.			trans	-105.5	146.5	-176.9	-171.3	-109.6	0	0	0	111.3	Y758 G759 F760 S770 A771 P776 T780	Y758-F774 AromaticContact CD1-CE2 3.95Å; Y758-F774 HydrophobicContact CD1-CE2 3.95Å; Y758-F774 HydrophobicContact CD1-CZ 4.47Å; Y758-F774 HydrophobicContact CE1-CD2 4.27Å; Y758-F774 AromaticContact CE1-CE2 3.85Å; Y758-F774 HydrophobicContact CE1-CE2 3.85Å; G759-F774 VanDerWaalsContact CA-CG 3.48Å; G759-F774 WeakPolarHBondContact O-CB 3.43Å; G759-F774 WeakPolarHBondContact O-CD1 3.34Å; F760-F774 HydrophobicContact CD2-CD1 4.45Å; F760-F774 HydrophobicContact CD2-CE1 4.21Å; F760-F774 HydrophobicContact CE2-CD1 4.14Å; F760-F774 AromaticContact CE2-CE1 3.62Å; F760-F774 HydrophobicContact CE2-CE1 3.62Å; F760-F774 HydrophobicContact CZ-CE1 4.27Å; S770-F774 PolarHBondContact OG-O 2.94Å; A771-F774 HydrophobicContact CB-CB 4.24Å; A771-F774 PolarHBondContact O-N 2.84Å; F774-P776 HydrophobicContact CD1-CG 3.96Å; F774-P776 HydrophobicContact CE1-CB 4.13Å; F774-P776 HydrophobicContact CE1-CG 3.85Å; F774-T780 HydrophobicContact CE2-CG2 3.99Å; F774-T780 HydrophobicContact CZ-CG2 4.2Å
775	I	79.9	Confident	72	Confident	131 Å²	131	57.1 Å²	57.1	67%	0.672	32%	0.322	S	S	*	.			trans	-131.1	108.2	174.2	-59.6	179.1	0	0	0	106.7	S777	I775-S777 WeakPolarHBondContact O-CB 3.45Å; I775-S777 PolarHBondContact O-N 2.8Å; I775-S777 PolarHBondContact O-OG 3.44Å
776	P	70.5	Confident	70.9	Confident	63 Å²	63	53.9 Å²	53.9	41%	0.409	32%	0.319	S	S	.	.			trans	-59.8	108.7	-179.9	-24	34.4	0	0	0	110.2	F760 S770 F774	F760-P776 HydrophobicContact CE1-CG 4.13Å; F760-P776 HydrophobicContact CE2-CG 4.24Å; F760-P776 HydrophobicContact CZ-CB 4.04Å; F760-P776 HydrophobicContact CZ-CG 3.51Å; S770-P776 WeakPolarHBondContact OG-CD 3.25Å; F774-P776 HydrophobicContact CD1-CG 3.96Å; F774-P776 HydrophobicContact CE1-CB 4.13Å; F774-P776 HydrophobicContact CE1-CG 3.85Å
777	S	61.7	Low	70.1	Confident	41 Å²	41	57.2 Å²	57.2	29%	0.287	33%	0.331	S	S	.	.			trans	-147.7	145.7	-168.7	48.9	0	0	0	0	110	I775 S779 T780	I775-S777 WeakPolarHBondContact O-CB 3.45Å; I775-S777 PolarHBondContact O-N 2.8Å; I775-S777 PolarHBondContact O-OG 3.44Å; S777-S779 PolarHBondContact O-N 2.87Å; S777-S779 PolarHBondContact OG-OG 3.41Å; S777-T780 PolarHBondContact O-N 3.43Å; S777-T780 PolarHBondContact O-OG1 3.33Å
778	A	50.3	Low	69.1	Low	22 Å²	22	58.5 Å²	58.5	18%	0.182	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-68.3	-5.1	-172	0	0	0	0	0	114.7	F789 P819 Q821	A778-F789 HydrophobicContact CB-CE1 4.23Å; A778-F789 HydrophobicContact CB-CE2 4.14Å; A778-F789 HydrophobicContact CB-CZ 3.57Å; A778-P819 HydrophobicContact CB-CG 3.62Å; A778-Q821 PolarHBondContact O-NE2 3.48Å
779	S	47.6	Very low	68.3	Low	35 Å²	35	58.8 Å²	58.8	25%	0.245	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-81.6	-10.3	178.5	45.8	0	0	0	0	113.9	S777 Q781 E851	S777-S779 PolarHBondContact O-N 2.87Å; S777-S779 PolarHBondContact OG-OG 3.41Å; S779-Q781 PolarHBondContact O-N 3.23Å; S779-E851 WeakPolarHBondContact CB-OE2 3.45Å
780	T	49.8	Very low	67.5	Low	52 Å²	52	61.5 Å²	61.5	32%	0.319	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-81.7	4.9	-177.8	61	0	0	0	0	114.6	F472 F774 S777	F472-T780 VanDerWaalsContact CZ-O 3.27Å; F472-T780 WeakPolarHBondContact CZ-O 3.35Å; F774-T780 HydrophobicContact CE2-CG2 3.99Å; F774-T780 HydrophobicContact CZ-CG2 4.2Å; S777-T780 PolarHBondContact O-N 3.43Å; S777-T780 PolarHBondContact O-OG1 3.33Å
781	Q	55.1	Low	67	Low	72 Å²	72	60.9 Å²	60.9	34%	0.336	34%	0.339	S	S	.	.	S	Bend	trans	-139.7	149.9	178	-68.9	-178.6	-10.7	0	0	110.5	S779 C783	S779-Q781 PolarHBondContact O-N 3.23Å; Q781-C783 VanDerWaalsContact C-N 3.34Å; Q781-C783 PolarHBondContact O-N 2.86Å
782	D	53.1	Low	66.6	Low	93 Å²	93	61.9 Å²	61.9	50%	0.497	35%	0.346	S	S	.	.			trans	-65.6	80.4	-177.5	-45.9	-76.4	0	0	0	112	R469	R469-D782 IonicContact CZ-OD2 3.29Å; R469-D782 IonicContact NH1-OD2 3.2Å; R469-D782 PolarHBondContact NH1-OD2 3.04Å; R469-D782 IonicContact NH2-OD2 3.37Å; R469-D782 PolarHBondContact NH2-OD2 2.86Å; R469-D782 VanDerWaalsContact NH2-OD2 3.14Å
783	C	60.5	Low	66.4	Low	19 Å²	19	55.5 Å²	55.5	13%	0.128	32%	0.32	C	S	.	.			trans	-100.9	99.1	-164.1	-138.7	0	0	0	0	113.6	Q781 T785 F789 C818	Q781-C783 VanDerWaalsContact C-N 3.34Å; Q781-C783 PolarHBondContact O-N 2.86Å; C783-T785 PolarHBondContact O-N 3.41Å; C783-F789 VanDerWaalsContact SG-CB 3.59Å; C783-F789 WeakPolarHBondContact SG-CD1 3.41Å; C783-F789 WeakPolarHBondContact SG-CG 3.39Å; C783-C818 VanDerWaalsContact C-SG 3.5Å; C783-C818 WeakPolarHBondContact CA-SG 3.44Å; C783-C818 HydrophobicContact CB-CB 3.88Å; C783-C818 WeakPolarHBondContact CB-SG 3.48Å; C783-C818 WeakPolarHBondContact SG-CA 3.25Å; C783-C818 WeakPolarHBondContact SG-CB 3.43Å; C783-C818 CovalentContact SG-SG 2.04Å; C783-C818 PolarHBondContact SG-SG 2.64Å
784	I	61.4	Low	66.4	Low	100 Å²	100	53.9 Å²	53.9	51%	0.513	31%	0.314	S	S	.	.			trans	-71.6	118.8	175.9	-62.2	178.1	0	0	0	109.9	G786 D787 C818 L853	I784-G786 PolarHBondContact O-N 2.86Å; I784-D787 WeakPolarHBondContact CB-OD2 3.39Å; I784-D787 PolarHBondContact O-N 3.15Å; I784-D787 VanDerWaalsContact O-N 3.15Å; I784-C818 VanDerWaalsContact O-CB 3.29Å; I784-C818 WeakPolarHBondContact O-CB 3.34Å; I784-C818 PolarHBondContact O-SG 3.48Å; I784-C818 VanDerWaalsContact O-SG 3.39Å; I784-L853 HydrophobicContact CB-CD2 4.39Å; I784-L853 HydrophobicContact CG2-CD2 3.78Å
785	T	54.3	Low	66.6	Low	50 Å²	50	53.8 Å²	53.8	31%	0.307	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	119.9	-177	-46.1	0	0	0	0	111.8	C783	C783-T785 PolarHBondContact O-N 3.41Å
786	G	58	Low	66.9	Low	60 Å²	60	49 Å²	49	62%	0.619	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	125.9	-39.8	-174.2	0	0	0	0	0	110.7	I784	I784-G786 PolarHBondContact O-N 2.86Å
787	D	64.6	Low	67.6	Low	96 Å²	96	49.7 Å²	49.7	51%	0.513	28%	0.284	S	S	.	.	S	Bend	trans	-74.5	170.5	175.9	-65.5	-35	0	0	0	112.1	I784 K817 C818	I784-D787 WeakPolarHBondContact CB-OD2 3.39Å; I784-D787 PolarHBondContact O-N 3.15Å; I784-D787 VanDerWaalsContact O-N 3.15Å; D787-K817 WeakPolarHBondContact O-CA 3.33Å; D787-C818 PolarHBondContact O-N 3.46Å
788	S	67.1	Low	68.7	Low	51 Å²	51	48.1 Å²	48.1	36%	0.357	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	124.8	173.2	64.8	0	0	0	0	111.3	Q815 Q816	S788-Q815 PolarHBondContact OG-NE2 3.17Å; S788-Q816 CarbonylContact C-O 3.56Å; S788-Q816 WeakPolarHBondContact CA-O 3.42Å
789	F	71.9	Confident	70.3	Confident	18 Å²	18	49.7 Å²	49.7	8%	0.079	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	161.7	170.6	76.5	-69.1	0	0	0	110.9	A778 C783 N791 Q815 Q816	A778-F789 HydrophobicContact CB-CE1 4.23Å; A778-F789 HydrophobicContact CB-CE2 4.14Å; A778-F789 HydrophobicContact CB-CZ 3.57Å; C783-F789 VanDerWaalsContact SG-CB 3.59Å; C783-F789 WeakPolarHBondContact SG-CD1 3.41Å; C783-F789 WeakPolarHBondContact SG-CG 3.39Å; F789-N791 HydrophobicContact CD2-CB 4.18Å; F789-N791 HydrophobicContact CE2-CB 3.49Å; F789-N791 VanDerWaalsContact CE2-CB 3.49Å; F789-N791 HydrophobicContact CZ-CB 3.83Å; F789-Q815 WeakPolarHBondContact O-CA 3.41Å; F789-Q816 HydrophobicContact CD1-CB 4.23Å; F789-Q816 VanDerWaalsContact CD1-O 3.23Å; F789-Q816 WeakPolarHBondContact CD1-O 3.34Å; F789-Q816 HydrophobicContact CE1-CB 3.65Å; F789-Q816 HydrophobicContact CZ-CB 4.07Å; F789-Q816 PolarHBondContact N-O 2.83Å; F789-Q816 PolarHBondContact O-N 2.83Å
790	F	74.9	Confident	71.9	Confident	115 Å²	115	50.2 Å²	50.2	50%	0.504	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	89.8	177.5	-76.2	-74	0	0	0	109.2	T792 P813 Q815	F790-T792 PolarHBondContact O-N 3.09Å; F790-P813 HydrophobicContact CB-CB 3.94Å; F790-P813 HydrophobicContact CB-CG 3.96Å; F790-P813 HydrophobicContact CD1-CG 4.13Å; F790-P813 HydrophobicContact CG-CG 4.33Å; F790-Q815 HydrophobicContact CD1-CB 4.26Å; F790-Q815 HydrophobicContact CE1-CB 3.99Å; F790-Q815 HydrophobicContact CE1-CG 4.37Å
791	N	77.6	Confident	73.6	Confident	32 Å²	32	48.1 Å²	48.1	17%	0.171	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	126.5	180	-166.9	-5.5	0	0	0	110.1	F789 P813 R814 Q816	F789-N791 HydrophobicContact CD2-CB 4.18Å; F789-N791 HydrophobicContact CE2-CB 3.49Å; F789-N791 VanDerWaalsContact CE2-CB 3.49Å; F789-N791 HydrophobicContact CZ-CB 3.83Å; N791-P813 CarbonylContact O-C 3.11Å; N791-R814 PolarHBondContact N-O 3.14Å; N791-R814 PolarHBondContact O-N 2.8Å; N791-Q816 HydrophobicContact CB-CB 4.44Å; N791-Q816 HydrophobicContact CB-CG 4.17Å; N791-Q816 PolarHBondContact ND2-NE2 2.86Å; N791-Q816 PolarHBondContact ND2-OE1 2.89Å
792	T	81.1	Confident	75	Confident	25 Å²	25	49 Å²	49	15%	0.153	28%	0.275	C	S	.	.			trans	-63.4	146.1	-176.1	-172.5	0	0	0	0	112.4	D757 F760 F790 G794	D757-T792 WeakPolarHBondContact CB-OG1 3.37Å; D757-T792 WeakPolarHBondContact OD2-CB 3.33Å; D757-T792 PolarHBondContact OD2-OG1 2.84Å; F760-T792 HydrophobicContact CE2-CG2 3.75Å; F760-T792 HydrophobicContact CZ-CG2 4.11Å; F790-T792 PolarHBondContact O-N 3.09Å; T792-G794 VanDerWaalsContact C-N 3.33Å; T792-G794 PolarHBondContact OG1-N 2.79Å
793	T	84.2	Confident	76.6	Confident	34 Å²	34	45 Å²	45	21%	0.209	25%	0.254	C	S	.	.			trans	-95.2	7	167.6	58.6	0	0	0	0	112.3	Y795 K810 R814	T793-Y795 WeakPolarHBondContact O-CD2 3.47Å; T793-K810 VanDerWaalsContact CB-O 3.28Å; T793-K810 WeakPolarHBondContact CB-O 3.45Å; T793-K810 PolarHBondContact OG1-O 3.13Å; T793-R814 HydrophobicContact CG2-CG 4Å
794	G	86.8	Confident	77.8	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	95.2	-0.3	-170.5	0	0	0	0	0	114.4	C756 D757 F760 C768 T792	C756-G794 WeakPolarHBondContact CA-O 3.37Å; D757-G794 PolarHBondContact N-O 3.29Å; F760-G794 VanDerWaalsContact CG-CA 3.47Å; F760-G794 VanDerWaalsContact CZ-CA 3.46Å; C768-G794 VanDerWaalsContact CB-O 3.23Å; C768-G794 WeakPolarHBondContact CB-O 3.44Å; T792-G794 VanDerWaalsContact C-N 3.33Å; T792-G794 PolarHBondContact OG1-N 2.79Å
795	Y	87.6	Confident	78.3	Confident	20 Å²	20	52.1 Å²	52.1	8%	0.078	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	142	-178	-55.9	-100.8	0	0	0	109.2	E755 C768 T793 Y811	E755-Y795 CarbonylContact O-C 3.58Å; E755-Y795 VanDerWaalsContact O-CA 3.3Å; E755-Y795 WeakPolarHBondContact O-CA 3.49Å; C768-Y795 HydrophobicContact CB-CD1 4.02Å; C768-Y795 HydrophobicContact CB-CD2 4.46Å; C768-Y795 HydrophobicContact CB-CE1 3.7Å; C768-Y795 HydrophobicContact CB-CE2 4.12Å; C768-Y795 HydrophobicContact CB-CG 4.4Å; C768-Y795 PolarHBondContact N-OH 3.33Å; C768-Y795 VanDerWaalsContact SG-CD1 3.57Å; C768-Y795 WeakPolarHBondContact SG-CE1 3.34Å; T793-Y795 WeakPolarHBondContact O-CD2 3.47Å; Y795-Y811 AromaticContact CD1-CD1 3.63Å; Y795-Y811 HydrophobicContact CD1-CD1 3.63Å; Y795-Y811 HydrophobicContact CD1-CE1 4.01Å; Y795-Y811 HydrophobicContact CD2-CD1 4.14Å; Y795-Y811 AromaticContact CE1-CD1 3.98Å; Y795-Y811 HydrophobicContact CE1-CD1 3.98Å; Y795-Y811 AromaticContact CE1-CE1 3.9Å; Y795-Y811 HydrophobicContact CE1-CE1 3.9Å; Y795-Y811 AromaticContact CG-CD1 3.71Å; Y795-Y811 HydrophobicContact CG-CD1 3.71Å; Y795-Y811 HydrophobicContact CG-CE1 4.45Å
796	R	86.3	Confident	78.6	Confident	31 Å²	31	50.7 Å²	50.7	12%	0.117	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	148.9	168.1	67.3	-175.5	-165.6	-152.9	-1.3	109.4	F472 T474 F754 E755 D757 A798	F472-R796 PolarHBondContact O-NH1 3.44Å; T474-R796 PolarHBondContact OG1-NH2 2.99Å; F754-R796 CarbonylContact C-O 3.24Å; F754-R796 VanDerWaalsContact CA-O 3.26Å; F754-R796 WeakPolarHBondContact CA-O 3.14Å; E755-R796 HydrophobicContact CG-CG 3.65Å; E755-R796 PolarHBondContact N-O 2.9Å; E755-R796 PolarHBondContact O-N 3.43Å; E755-R796 IonicContact OE1-CZ 2.82Å; E755-R796 IonicContact OE1-NE 3.72Å; E755-R796 PolarHBondContact OE1-NE 2.74Å; E755-R796 IonicContact OE1-NH2 2.64Å; E755-R796 PolarHBondContact OE1-NH2 2.94Å; D757-R796 HydrophobicContact CB-CB 4.38Å; D757-R796 HydrophobicContact CB-CG 4.45Å; D757-R796 WeakPolarHBondContact OD1-CD 3.07Å; D757-R796 IonicContact OD1-NH1 3.87Å; R796-A798 PolarHBondContact O-N 3.17Å
797	K	86	Confident	78.4	Confident	78 Å²	78	53.6 Å²	53.6	34%	0.339	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	133.7	173	-162.5	-166.8	-163.5	-170.8	0	107.6	F754 L799 N801 C803	F754-K797 HydrophobicContact CD1-CB 4.14Å; F754-K797 HydrophobicContact CE1-CB 4.06Å; F754-K797 HydrophobicContact CE1-CG 4.34Å; K797-L799 PolarHBondContact O-N 2.94Å; K797-N801 HydrophobicContact CD-CB 4.46Å; K797-N801 VanDerWaalsContact CE-O 3.26Å; K797-N801 WeakPolarHBondContact CE-O 3.32Å; K797-N801 WeakPolarHBondContact CE-OD1 3.4Å; K797-N801 HydrophobicContact CG-CB 4.36Å; K797-N801 PolarHBondContact NZ-O 2.71Å; K797-C803 WeakPolarHBondContact CE-SG 3.21Å; K797-C803 PolarHBondContact NZ-O 2.73Å
798	A	84.9	Confident	78.5	Confident	8 Å²	8	52.2 Å²	52.2	7%	0.066	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-57.7	135.7	172.8	0	0	0	0	0	109.3	M717 D753 R796 N801	M717-A798 HydrophobicContact CE-CB 4.17Å; D753-A798 PolarHBondContact O-N 2.88Å; R796-A798 PolarHBondContact O-N 3.17Å; A798-N801 HydrophobicContact CB-CB 4.26Å; A798-N801 WeakPolarHBondContact O-CB 3.47Å; A798-N801 PolarHBondContact O-N 2.66Å
799	L	82.8	Confident	78.5	Confident	54 Å²	54	56.4 Å²	56.4	28%	0.283	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	155.9	178.4	-72.1	165.8	0	0	0	110.1	Q447 M717 K797 N801	Q447-L799 HydrophobicContact CG-CB 3.95Å; Q447-L799 HydrophobicContact CG-CD1 3.53Å; Q447-L799 HydrophobicContact CG-CG 4.37Å; M717-L799 VanDerWaalsContact CE-O 3.23Å; M717-L799 WeakPolarHBondContact CE-O 3.34Å; K797-L799 PolarHBondContact O-N 2.94Å; L799-N801 PolarHBondContact O-N 3.34Å
800	S	81.9	Confident	78.6	Confident	46 Å²	46	59.9 Å²	59.9	32%	0.322	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	1	-164.2	-53.1	0	0	0	0	116.4	E445 N802	E445-S800 WeakPolarHBondContact CB-OG 3.34Å; E445-S800 VanDerWaalsContact CD-OG 3.23Å; E445-S800 VanDerWaalsContact OE2-CB 3.23Å; E445-S800 WeakPolarHBondContact OE2-CB 3.33Å; E445-S800 PolarHBondContact OE2-OG 2.98Å; S800-N802 PolarHBondContact O-N 2.75Å
801	N	85.1	Confident	78.8	Confident	8 Å²	8	55.1 Å²	55.1	4%	0.043	30%	0.299	C	S	.	.			trans	-77.4	121.7	177.4	-171.8	-56.5	0	0	0	111.4	M717 G718 D753 K797 A798 L799 C803	M717-N801 VanDerWaalsContact C-CG 3.45Å; M717-N801 VanDerWaalsContact C-ND2 3.26Å; M717-N801 WeakPolarHBondContact CA-ND2 3.31Å; M717-N801 HydrophobicContact CE-CB 4.34Å; M717-N801 WeakPolarHBondContact O-CA 3.44Å; G718-N801 WeakPolarHBondContact CA-OD1 3.45Å; G718-N801 PolarHBondContact N-ND2 2.68Å; D753-N801 WeakPolarHBondContact CB-ND2 3.45Å; D753-N801 PolarHBondContact OD1-ND2 2.71Å; D753-N801 PolarHBondContact OD1-OD1 3.45Å; K797-N801 HydrophobicContact CD-CB 4.46Å; K797-N801 VanDerWaalsContact CE-O 3.26Å; K797-N801 WeakPolarHBondContact CE-O 3.32Å; K797-N801 WeakPolarHBondContact CE-OD1 3.4Å; K797-N801 HydrophobicContact CG-CB 4.36Å; K797-N801 PolarHBondContact NZ-O 2.71Å; A798-N801 HydrophobicContact CB-CB 4.26Å; A798-N801 WeakPolarHBondContact O-CB 3.47Å; A798-N801 PolarHBondContact O-N 2.66Å; L799-N801 PolarHBondContact O-N 3.34Å; N801-C803 WeakPolarHBondContact OD1-CB 3.33Å; N801-C803 PolarHBondContact OD1-N 2.92Å; N801-C803 PolarHBondContact OD1-SG 2.83Å
802	N	85.8	Confident	78.8	Confident	91 Å²	91	55.8 Å²	55.8	49%	0.487	31%	0.306	S	S	.	.			trans	-105.5	24.1	-173.3	-73.5	-24.2	0	0	0	114	M717 M719 S746 S800	M717-N802 PolarHBondContact O-N 3.12Å; M719-N802 HydrophobicContact CG-CB 3.65Å; M719-N802 HydrophobicContact SD-CB 3.69Å; S746-N802 VanDerWaalsContact CB-O 3.27Å; S746-N802 WeakPolarHBondContact CB-O 3.09Å; S746-N802 PolarHBondContact OG-O 3.09Å; S800-N802 PolarHBondContact O-N 2.75Å
803	C	86.9	Confident	78.6	Confident	8 Å²	8	57.4 Å²	57.4	5%	0.054	32%	0.317	C	S	.	.			trans	-63.4	144.4	170.8	68.6	0	0	0	0	111.3	G718 C747 C749 K797 N801	G718-C803 WeakPolarHBondContact O-CA 3.3Å; G718-C803 PolarHBondContact O-N 3.48Å; C747-C803 WeakPolarHBondContact O-CA 3.31Å; C749-C803 WeakPolarHBondContact CA-SG 3.44Å; C749-C803 HydrophobicContact CB-CB 3.87Å; C749-C803 WeakPolarHBondContact CB-SG 3.45Å; C749-C803 WeakPolarHBondContact SG-CB 3.11Å; C749-C803 PolarHBondContact SG-O 2.66Å; C749-C803 CovalentContact SG-SG 2.03Å; C749-C803 PolarHBondContact SG-SG 3.21Å; K797-C803 WeakPolarHBondContact CE-SG 3.21Å; K797-C803 PolarHBondContact NZ-O 2.73Å; N801-C803 WeakPolarHBondContact OD1-CB 3.33Å; N801-C803 PolarHBondContact OD1-N 2.92Å; N801-C803 PolarHBondContact OD1-SG 2.83Å
804	T	85.3	Confident	78.4	Confident	73 Å²	73	62.9 Å²	62.9	45%	0.448	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-86.5	153	174.3	52.6	0	0	0	0	111.4	C747 C749 G806	C747-T804 PolarHBondContact O-N 2.84Å; C747-T804 PolarHBondContact O-OG1 3.15Å; C749-T804 PolarHBondContact N-O 2.88Å; C749-T804 PolarHBondContact SG-O 3Å; T804-G806 PolarHBondContact O-N 3.22Å
805	E	71.2	Confident	77.9	Confident	196 Å²	196	69.1 Å²	69.1	92%	0.916	36%	0.363	S	S	*	.			trans	-58.5	105.6	-169.6	-64.9	-166.5	150.4	0	0	113.5
806	G	61	Low	77.3	Confident	21 Å²	21	72.1 Å²	72.1	22%	0.216	38%	0.378	C	S	.	.			trans	-79	148.7	160.8	0	0	0	0	0	111	V748 T804 L808	V748-G806 VanDerWaalsContact CG1-CA 3.44Å; T804-G806 PolarHBondContact O-N 3.22Å; G806-L808 PolarHBondContact O-N 2.74Å
807	S	54.1	Low	76.6	Confident	120 Å²	120	78.8 Å²	78.8	84%	0.839	41%	0.408	S	S	*	.	S	Bend	trans	-71.7	65.4	179.3	173.7	0	0	0	0	112.7
808	L	65.9	Low	75.8	Confident	67 Å²	67	75.5 Å²	75.5	35%	0.351	40%	0.395	S	S	.	.			trans	-123	71.4	-173.4	-62.5	172.3	0	0	0	112.5	C749 G806 K810 Y811 S812	C749-L808 WeakPolarHBondContact O-CD1 3.38Å; G806-L808 PolarHBondContact O-N 2.74Å; L808-K810 PolarHBondContact O-N 3.27Å; L808-Y811 HydrophobicContact CB-CD2 3.72Å; L808-Y811 HydrophobicContact CB-CE2 4.05Å; L808-Y811 HydrophobicContact CD1-CD2 4.1Å; L808-Y811 HydrophobicContact CD1-CE2 3.96Å; L808-Y811 HydrophobicContact CD2-CE2 4.42Å; L808-Y811 HydrophobicContact CG-CD2 4.44Å; L808-Y811 HydrophobicContact CG-CE2 4.37Å; L808-Y811 PolarHBondContact O-N 3.17Å; L808-Y811 VanDerWaalsContact O-N 3.07Å; L808-S812 PolarHBondContact O-N 3.14Å
809	L	67.4	Low	75	Confident	140 Å²	140	77.8 Å²	77.8	73%	0.733	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	1.3	174.8	-66	168.9	0	0	0	115.6	S812	L809-S812 WeakPolarHBondContact CA-OG 3.39Å
810	K	75.1	Confident	74.2	Confident	91 Å²	91	77.8 Å²	77.8	40%	0.396	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-45	171	177.3	-177.8	161.8	-159	0	111.5	E751 T793 L808	E751-K810 IonicContact OE1-NZ 2.65Å; E751-K810 PolarHBondContact OE1-NZ 3.18Å; T793-K810 VanDerWaalsContact CB-O 3.28Å; T793-K810 WeakPolarHBondContact CB-O 3.45Å; T793-K810 PolarHBondContact OG1-O 3.13Å; L808-K810 PolarHBondContact O-N 3.27Å
811	Y	78.5	Confident	73.6	Confident	14 Å²	14	76.8 Å²	76.8	6%	0.055	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-19.1	-171.8	-42.3	-77.7	0	0	0	113.6	E751 F754 Y795 L808	E751-Y811 HydrophobicContact CG-CE1 3.98Å; E751-Y811 WeakPolarHBondContact CG-OH 3.06Å; E751-Y811 WeakPolarHBondContact OE1-CE1 3.27Å; E751-Y811 PolarHBondContact OE1-OH 2.99Å; E751-Y811 PolarHBondContact OE2-OH 3.12Å; F754-Y811 HydrophobicContact CB-CD1 4.44Å; F754-Y811 HydrophobicContact CD1-CG 4.41Å; F754-Y811 HydrophobicContact CD2-CD1 4.44Å; F754-Y811 HydrophobicContact CD2-CD2 4.09Å; F754-Y811 AromaticContact CD2-CG 3.86Å; F754-Y811 HydrophobicContact CD2-CG 3.86Å; F754-Y811 HydrophobicContact CE2-CD2 4.05Å; F754-Y811 HydrophobicContact CE2-CG 4.11Å; F754-Y811 HydrophobicContact CG-CD1 4.4Å; F754-Y811 HydrophobicContact CG-CG 4.04Å; F754-Y811 HydrophobicContact CZ-CG 4.5Å; Y795-Y811 AromaticContact CD1-CD1 3.63Å; Y795-Y811 HydrophobicContact CD1-CD1 3.63Å; Y795-Y811 HydrophobicContact CD1-CE1 4.01Å; Y795-Y811 HydrophobicContact CD2-CD1 4.14Å; Y795-Y811 AromaticContact CE1-CD1 3.98Å; Y795-Y811 HydrophobicContact CE1-CD1 3.98Å; Y795-Y811 AromaticContact CE1-CE1 3.9Å; Y795-Y811 HydrophobicContact CE1-CE1 3.9Å; Y795-Y811 AromaticContact CG-CD1 3.71Å; Y795-Y811 HydrophobicContact CG-CD1 3.71Å; Y795-Y811 HydrophobicContact CG-CE1 4.45Å; L808-Y811 HydrophobicContact CB-CD2 3.72Å; L808-Y811 HydrophobicContact CB-CE2 4.05Å; L808-Y811 HydrophobicContact CD1-CD2 4.1Å; L808-Y811 HydrophobicContact CD1-CE2 3.96Å; L808-Y811 HydrophobicContact CD2-CE2 4.42Å; L808-Y811 HydrophobicContact CG-CD2 4.44Å; L808-Y811 HydrophobicContact CG-CE2 4.37Å; L808-Y811 PolarHBondContact O-N 3.17Å; L808-Y811 VanDerWaalsContact O-N 3.07Å
812	S	76.3	Confident	73.1	Confident	47 Å²	47	77.9 Å²	77.9	33%	0.329	41%	0.413	S	S	.	.	S	Bend	trans	-64.7	126.8	170.6	59.9	0	0	0	0	110.2	L808 L809	L808-S812 PolarHBondContact O-N 3.14Å; L809-S812 WeakPolarHBondContact CA-OG 3.39Å
813	P	78.1	Confident	72.7	Confident	59 Å²	59	73.6 Å²	73.6	38%	0.383	39%	0.391	S	S	.	.			trans	-67.1	147.7	177.5	31.5	-36.9	0	0	0	110.2	F790 N791	F790-P813 HydrophobicContact CB-CB 3.94Å; F790-P813 HydrophobicContact CB-CG 3.96Å; F790-P813 HydrophobicContact CD1-CG 4.13Å; F790-P813 HydrophobicContact CG-CG 4.33Å; N791-P813 CarbonylContact O-C 3.11Å
814	R	79.4	Confident	72.2	Confident	148 Å²	148	80.3 Å²	80.3	56%	0.558	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	113.9	-169.4	-67.2	-179.8	178.4	178.9	0.6	110.2	N791 T793 Q816	N791-R814 PolarHBondContact N-O 3.14Å; N791-R814 PolarHBondContact O-N 2.8Å; T793-R814 HydrophobicContact CG2-CG 4Å; R814-Q816 PolarHBondContact O-N 3.17Å; R814-Q816 VanDerWaalsContact O-N 3.1Å
815	Q	77.2	Confident	71.6	Confident	132 Å²	132	78 Å²	78	62%	0.617	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.3	116.5	172.4	-168.1	-179	24.7	0	0	109.9	S788 F789 F790	S788-Q815 PolarHBondContact OG-NE2 3.17Å; F789-Q815 WeakPolarHBondContact O-CA 3.41Å; F790-Q815 HydrophobicContact CD1-CB 4.26Å; F790-Q815 HydrophobicContact CE1-CB 3.99Å; F790-Q815 HydrophobicContact CE1-CG 4.37Å
816	Q	74.3	Confident	72.1	Confident	82 Å²	82	69 Å²	69	38%	0.383	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	146.8	176.8	-70.9	-180	13	0	0	108.3	S788 F789 N791 R814	S788-Q816 CarbonylContact C-O 3.56Å; S788-Q816 WeakPolarHBondContact CA-O 3.42Å; F789-Q816 HydrophobicContact CD1-CB 4.23Å; F789-Q816 VanDerWaalsContact CD1-O 3.23Å; F789-Q816 WeakPolarHBondContact CD1-O 3.34Å; F789-Q816 HydrophobicContact CE1-CB 3.65Å; F789-Q816 HydrophobicContact CZ-CB 4.07Å; F789-Q816 PolarHBondContact N-O 2.83Å; F789-Q816 PolarHBondContact O-N 2.83Å; N791-Q816 HydrophobicContact CB-CB 4.44Å; N791-Q816 HydrophobicContact CB-CG 4.17Å; N791-Q816 PolarHBondContact ND2-NE2 2.86Å; N791-Q816 PolarHBondContact ND2-OE1 2.89Å; R814-Q816 PolarHBondContact O-N 3.17Å; R814-Q816 VanDerWaalsContact O-N 3.1Å
817	K	71.3	Confident	73.1	Confident	172 Å²	172	71 Å²	71	75%	0.748	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	136.6	171.3	-65.5	-164.5	174.4	-162.6	0	108.8	D787 P819	D787-K817 WeakPolarHBondContact O-CA 3.33Å; K817-P819 WeakPolarHBondContact O-CD 3.33Å; K817-P819 VanDerWaalsContact O-N 3.1Å
818	C	68.8	Low	74.5	Confident	9 Å²	9	65.8 Å²	65.8	6%	0.061	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-54.1	118.6	171	-74.2	0	0	0	0	108.5	C783 I784 D787	C783-C818 VanDerWaalsContact C-SG 3.5Å; C783-C818 WeakPolarHBondContact CA-SG 3.44Å; C783-C818 HydrophobicContact CB-CB 3.88Å; C783-C818 WeakPolarHBondContact CB-SG 3.48Å; C783-C818 WeakPolarHBondContact SG-CA 3.25Å; C783-C818 WeakPolarHBondContact SG-CB 3.43Å; C783-C818 CovalentContact SG-SG 2.04Å; C783-C818 PolarHBondContact SG-SG 2.64Å; I784-C818 VanDerWaalsContact O-CB 3.29Å; I784-C818 WeakPolarHBondContact O-CB 3.34Å; I784-C818 PolarHBondContact O-SG 3.48Å; I784-C818 VanDerWaalsContact O-SG 3.39Å; D787-C818 PolarHBondContact O-N 3.46Å
819	P	68.4	Low	75.2	Confident	56 Å²	56	66.1 Å²	66.1	36%	0.364	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-61.3	151.5	169.7	27.9	-32.8	0	0	0	108.2	A778 K817 Q821	A778-P819 HydrophobicContact CB-CG 3.62Å; K817-P819 WeakPolarHBondContact O-CD 3.33Å; K817-P819 VanDerWaalsContact O-N 3.1Å; P819-Q821 HydrophobicContact CG-CG 4.42Å; P819-Q821 PolarHBondContact O-N 3.04Å
820	S	67.1	Low	76	Confident	53 Å²	53	59.9 Å²	59.9	37%	0.371	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-63.1	131.7	161.5	40	0	0	0	0	108	L901	S820-L901 VanDerWaalsContact CB-CD1 3.49Å; S820-L901 WeakPolarHBondContact O-CD1 3.42Å
821	Q	68.3	Low	76	Confident	25 Å²	25	57.9 Å²	57.9	12%	0.117	29%	0.294	C	S	.	.			trans	-112	141	-178.9	-64.4	178.2	4.6	0	0	109.7	A778 P819 N899	A778-Q821 PolarHBondContact O-NE2 3.48Å; P819-Q821 HydrophobicContact CG-CG 4.42Å; P819-Q821 PolarHBondContact O-N 3.04Å; Q821-N899 PolarHBondContact O-ND2 3.19Å
822	A	74.1	Confident	75.7	Confident	31 Å²	31	62.5 Å²	62.5	26%	0.256	32%	0.316	S	S	.	.			trans	-69.2	147.4	164.6	0	0	0	0	0	108.6	L901	A822-L901 HydrophobicContact CB-CB 3.96Å
823	P	78.8	Confident	75.3	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.013	32%	0.323	C	S	.	.			trans	-62.7	141.5	179.1	28.1	-34.7	0	0	0	110.5	L849 E851 T857 A897 G902 D904	P823-L849 HydrophobicContact CB-CD1 3.88Å; P823-L849 HydrophobicContact CB-CD2 4.14Å; P823-E851 CarbonylContact C-O 3.58Å; P823-E851 VanDerWaalsContact CA-O 3.22Å; P823-E851 WeakPolarHBondContact CA-O 3.3Å; P823-T857 HydrophobicContact CB-CG2 3.97Å; P823-T857 HydrophobicContact CG-CG2 4.3Å; P823-A897 HydrophobicContact CB-CB 3.89Å; P823-A897 HydrophobicContact CG-CB 4.24Å; P823-A897 VanDerWaalsContact CG-O 3.31Å; P823-A897 WeakPolarHBondContact CG-O 3.4Å; P823-G902 WeakPolarHBondContact CD-O 3.34Å; P823-D904 WeakPolarHBondContact O-CB 3.22Å
824	R	75.9	Confident	75	Confident	148 Å²	148	61.3 Å²	61.3	56%	0.558	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.5	162.2	174.7	-64.8	-176.8	160.1	-176.7	-4.3	112.2	L826 L849 E850 E851 D904	R824-L826 VanDerWaalsContact C-N 3.3Å; R824-L849 WeakPolarHBondContact O-CD1 3.48Å; R824-E850 PolarHBondContact O-N 3.39Å; R824-E851 HydrophobicContact CB-CB 4.01Å; R824-E851 HydrophobicContact CB-CG 4.23Å; R824-E851 WeakPolarHBondContact CD-OE2 3.41Å; R824-E851 PolarHBondContact N-O 3.38Å; R824-E851 PolarHBondContact O-N 3.01Å; R824-D904 WeakPolarHBondContact CA-OD2 3.3Å
825	G	72.9	Confident	75	Confident	24 Å²	24	60.2 Å²	60.2	25%	0.247	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	66	37.5	179.5	0	0	0	0	0	111.3	Q827 E850 D904	G825-Q827 PolarHBondContact O-N 2.89Å; G825-E850 PolarHBondContact O-N 3.28Å; G825-D904 PolarHBondContact N-OD2 3Å
826	L	81.6	Confident	75.2	Confident	9 Å²	9	56.9 Å²	56.9	5%	0.047	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	118.1	175.4	-175.2	65.6	0	0	0	109.8	R824 V847 F848 L849 A895 A897 D904 V906	R824-L826 VanDerWaalsContact C-N 3.3Å; L826-V847 HydrophobicContact CD1-CG1 3.55Å; L826-F848 CarbonylContact C-O 3.55Å; L826-F848 WeakPolarHBondContact CA-O 3.27Å; L826-L849 HydrophobicContact CB-CD1 4.11Å; L826-L849 HydrophobicContact CD1-CB 4.42Å; L826-L849 HydrophobicContact CD1-CD1 4.1Å; L826-A895 HydrophobicContact CD2-CB 4.05Å; L826-A895 VanDerWaalsContact CD2-O 3.24Å; L826-A895 WeakPolarHBondContact CD2-O 3.49Å; L826-A895 HydrophobicContact CG-CB 4.43Å; L826-A897 HydrophobicContact CD1-CB 3.91Å; L826-A897 HydrophobicContact CD2-CB 3.8Å; L826-A897 HydrophobicContact CG-CB 4.37Å; L826-D904 HydrophobicContact CB-CB 4.04Å; L826-D904 WeakPolarHBondContact CB-OD2 3.41Å; L826-D904 PolarHBondContact N-OD2 2.86Å; L826-V906 HydrophobicContact CB-CG1 4.45Å; L826-V906 HydrophobicContact CD2-CG1 4.06Å; L826-V906 HydrophobicContact CG-CG1 3.83Å; L826-V906 VanDerWaalsContact O-CB 3.32Å; L826-V906 WeakPolarHBondContact O-CB 3.45Å
827	Q	81.9	Confident	75.6	Confident	61 Å²	61	53.5 Å²	53.5	29%	0.285	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	144.4	179.2	-55.3	-178.3	14.6	0	0	110.2	G825 F829 V847 F848	G825-Q827 PolarHBondContact O-N 2.89Å; Q827-F829 HydrophobicContact CB-CD2 4.44Å; Q827-F829 HydrophobicContact CB-CE2 3.61Å; Q827-F829 HydrophobicContact CB-CZ 3.99Å; Q827-V847 WeakPolarHBondContact O-CA 3.36Å; Q827-F848 HydrophobicContact CB-CB 4.44Å; Q827-F848 PolarHBondContact N-O 3.44Å; Q827-F848 PolarHBondContact O-N 2.93Å
828	L	83.7	Confident	76.2	Confident	11 Å²	11	48.2 Å²	48.2	6%	0.058	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	121	-176.4	171	64.7	0	0	0	109.2	F845 L846 V847 V893 A895 V906 L908	L828-F845 HydrophobicContact CD1-CB 4.13Å; L828-F845 HydrophobicContact CD1-CD1 4.15Å; L828-L846 WeakPolarHBondContact CA-O 3.21Å; L828-V847 HydrophobicContact CD1-CG2 4.02Å; L828-V893 HydrophobicContact CD2-CB 4.32Å; L828-V893 HydrophobicContact CD2-CG1 3.89Å; L828-A895 HydrophobicContact CB-CB 4.44Å; L828-A895 HydrophobicContact CD1-CB 4.46Å; L828-A895 HydrophobicContact CD2-CB 4.23Å; L828-V906 HydrophobicContact CB-CG1 3.53Å; L828-V906 HydrophobicContact CB-CG2 4.44Å; L828-V906 HydrophobicContact CD2-CG1 4.41Å; L828-L908 HydrophobicContact CD2-CB 3.7Å; L828-L908 HydrophobicContact CG-CB 4.11Å; L828-L908 HydrophobicContact CG-CD1 4.2Å
829	F	81.1	Confident	77	Confident	74 Å²	74	50.1 Å²	50.1	33%	0.325	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	163.1	-179.6	-55	-77.8	0	0	0	111.3	Q827 F845 L846 F848	Q827-F829 HydrophobicContact CB-CD2 4.44Å; Q827-F829 HydrophobicContact CB-CE2 3.61Å; Q827-F829 HydrophobicContact CB-CZ 3.99Å; F829-F845 CarbonylContact O-C 2.96Å; F829-F845 WeakPolarHBondContact O-CA 3.35Å; F829-L846 PolarHBondContact N-O 2.84Å; F829-L846 PolarHBondContact O-N 2.96Å; F829-F848 AromaticContact CD2-CD2 3.75Å; F829-F848 HydrophobicContact CD2-CD2 3.75Å; F829-F848 AromaticContact CD2-CE2 3.87Å; F829-F848 HydrophobicContact CD2-CE2 3.87Å; F829-F848 AromaticContact CE2-CD2 3.93Å; F829-F848 HydrophobicContact CE2-CD2 3.93Å; F829-F848 HydrophobicContact CE2-CE2 4.35Å
830	T	83.1	Confident	77.6	Confident	9 Å²	9	49.8 Å²	49.8	6%	0.055	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	149.7	163.4	59.1	0	0	0	0	109.8	E832 G833 T834 V843 T844 F845 L908 L910	T830-E832 PolarHBondContact O-N 2.99Å; T830-E832 VanDerWaalsContact O-N 3.07Å; T830-G833 PolarHBondContact O-N 2.84Å; T830-G833 PolarHBondContact OG1-N 2.76Å; T830-T834 WeakPolarHBondContact CG2-O 3.24Å; T830-T834 PolarHBondContact OG1-N 2.94Å; T830-T834 PolarHBondContact OG1-O 2.9Å; T830-V843 HydrophobicContact CG2-CG1 4.09Å; T830-T844 CarbonylContact C-O 3.41Å; T830-T844 WeakPolarHBondContact CA-O 3.37Å; T830-F845 HydrophobicContact CG2-CD1 4.14Å; T830-F845 HydrophobicContact CG2-CE1 4.01Å; T830-L908 HydrophobicContact CG2-CD1 4.36Å; T830-L910 HydrophobicContact CG2-CD1 4.18Å
831	S	75.3	Confident	78.3	Confident	50 Å²	50	55.3 Å²	55.3	35%	0.35	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-6.6	176.6	66.1	0	0	0	0	114.7	T844	S831-T844 PolarHBondContact N-O 2.86Å; S831-T844 WeakPolarHBondContact OG-CB 3.38Å
832	E	71.4	Confident	79.2	Confident	111 Å²	111	58.9 Å²	58.9	52%	0.519	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-2.7	174	-66	-174.8	-175.8	0	0	112	F390 T830 T834	F390-E832 VanDerWaalsContact CE2-O 3.27Å; F390-E832 WeakPolarHBondContact CE2-O 3.4Å; T830-E832 PolarHBondContact O-N 2.99Å; T830-E832 VanDerWaalsContact O-N 3.07Å; E832-T834 WeakPolarHBondContact CB-OG1 3.49Å; E832-T834 PolarHBondContact O-N 3.34Å
833	G	67.8	Low	79.8	Confident	45 Å²	45	58.2 Å²	58.2	46%	0.464	31%	0.312	S	S	.	.	S	Bend	trans	62.2	20.2	-176	0	0	0	0	0	114	T830	T830-G833 PolarHBondContact O-N 2.84Å; T830-G833 PolarHBondContact OG1-N 2.76Å
834	T	72.1	Confident	80.2	Confident	36 Å²	36	59 Å²	59	22%	0.221	32%	0.318	C	S	.	.			trans	-119.6	144.9	-174.4	50.9	0	0	0	0	111.5	T830 E832 V836	T830-T834 WeakPolarHBondContact CG2-O 3.24Å; T830-T834 PolarHBondContact OG1-N 2.94Å; T830-T834 PolarHBondContact OG1-O 2.9Å; E832-T834 WeakPolarHBondContact CB-OG1 3.49Å; E832-T834 PolarHBondContact O-N 3.34Å; T834-V836 VanDerWaalsContact C-N 3.28Å
835	F	80	Confident	80.7	Confident	124 Å²	124	52 Å²	52	54%	0.544	29%	0.291	S	S	.	.	S	Bend	trans	-91.7	17.6	172.7	-57.2	-64.5	0	0	0	112.9	L908 H911	F835-L908 HydrophobicContact CD1-CD1 4.03Å; F835-L908 HydrophobicContact CD1-CD2 4.15Å; F835-L908 HydrophobicContact CD1-CG 3.82Å; F835-L908 HydrophobicContact CE1-CD1 3.8Å; F835-L908 HydrophobicContact CE1-CG 3.86Å; F835-H911 PolarHBondContact O-N 3.03Å
836	V	80.9	Confident	81.1	Confident	62 Å²	62	51.8 Å²	51.8	38%	0.376	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	131.6	-176.4	-177.2	0	0	0	0	109	T834 H911 N913	T834-V836 VanDerWaalsContact C-N 3.28Å; V836-H911 WeakPolarHBondContact CA-O 3.32Å; V836-H911 HydrophobicContact CG2-CB 4.41Å; V836-N913 WeakPolarHBondContact CG1-ND2 3.23Å
837	A	83.8	Confident	81.1	Confident	12 Å²	12	51.9 Å²	51.9	10%	0.099	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	149.5	177.9	0	0	0	0	0	111.4	V843 L910 H911 V912 N913	A837-V843 HydrophobicContact CB-CG2 3.55Å; A837-L910 HydrophobicContact CB-CD1 4.18Å; A837-L910 HydrophobicContact CB-CD2 3.93Å; A837-L910 HydrophobicContact CB-CG 4.21Å; A837-H911 PolarHBondContact N-O 2.95Å; A837-V912 HydrophobicContact CB-CG2 4.38Å; A837-V912 WeakPolarHBondContact O-CA 3.36Å; A837-N913 PolarHBondContact O-N 2.89Å; A837-N913 PolarHBondContact O-OD1 3.07Å
838	T	82.7	Confident	80.8	Confident	61 Å²	61	53.5 Å²	53.5	37%	0.374	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	137.5	175.1	46	0	0	0	0	111.1	G840 R841	T838-G840 PolarHBondContact O-N 3.23Å; T838-R841 PolarHBondContact O-N 2.82Å; T838-R841 WeakPolarHBondContact OG1-CD 3.38Å; T838-R841 WeakPolarHBondContact OG1-CG 3.48Å; T838-R841 PolarHBondContact OG1-NE 3.26Å
839	L	85.5	Confident	80.4	Confident	49 Å²	49	54.5 Å²	54.5	26%	0.257	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	132.5	-179.2	-168.7	74.5	0	0	0	112.2	C41 R841 Y885 K887 V888 V912 N913	C41-L839 HydrophobicContact CB-CD2 4.39Å; C41-L839 VanDerWaalsContact SG-CD2 3.54Å; L839-R841 VanDerWaalsContact C-N 3.3Å; L839-R841 PolarHBondContact O-N 3.17Å; L839-Y885 WeakPolarHBondContact CD1-O 3.42Å; L839-K887 VanDerWaalsContact CD1-O 3.31Å; L839-K887 WeakPolarHBondContact CD1-O 3.45Å; L839-V888 HydrophobicContact CD1-CG1 4.22Å; L839-V888 HydrophobicContact CD2-CG1 4.39Å; L839-V912 HydrophobicContact CD1-CG1 4.01Å; L839-N913 PolarHBondContact N-O 3.09Å
840	G	81.1	Confident	79.7	Confident	48 Å²	48	55.2 Å²	55.2	50%	0.495	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	6	174.9	0	0	0	0	0	116.4	T838 Y885	T838-G840 PolarHBondContact O-N 3.23Å; G840-Y885 PolarHBondContact N-O 3.03Å; G840-Y885 VanDerWaalsContact N-O 3.14Å
841	R	82.9	Confident	78.7	Confident	169 Å²	169	56.7 Å²	56.7	64%	0.638	31%	0.307	S	S	*	.	S	Bend	trans	-90.8	158.9	165.8	-64.3	-161.3	-172.7	175.4	1.5	111.7	T838 L839 V843	T838-R841 PolarHBondContact O-N 2.82Å; T838-R841 WeakPolarHBondContact OG1-CD 3.38Å; T838-R841 WeakPolarHBondContact OG1-CG 3.48Å; T838-R841 PolarHBondContact OG1-NE 3.26Å; L839-R841 VanDerWaalsContact C-N 3.3Å; L839-R841 PolarHBondContact O-N 3.17Å; R841-V843 PolarHBondContact O-N 2.89Å
842	N	87.3	Confident	77.9	Confident	101 Å²	101	55.6 Å²	55.6	54%	0.54	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	119.6	169.7	-67.1	-0.1	0	0	0	109.4	H883 I884	N842-H883 WeakPolarHBondContact CA-O 3.18Å; N842-I884 VanDerWaalsContact OD1-CD1 3.23Å; N842-I884 WeakPolarHBondContact OD1-CD1 3.24Å; N842-I884 VanDerWaalsContact OD1-CG1 3.26Å; N842-I884 WeakPolarHBondContact OD1-CG1 3.36Å
843	V	86.5	Confident	77.4	Confident	16 Å²	16	51.4 Å²	51.4	10%	0.097	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	128.7	164.4	-175	0	0	0	0	107.3	T830 A837 R841 F845 K882 H883 Y885 L910	T830-V843 HydrophobicContact CG2-CG1 4.09Å; A837-V843 HydrophobicContact CB-CG2 3.55Å; R841-V843 PolarHBondContact O-N 2.89Å; V843-F845 HydrophobicContact CB-CE2 3.97Å; V843-F845 HydrophobicContact CB-CZ 4.28Å; V843-F845 HydrophobicContact CG1-CD2 4.2Å; V843-F845 HydrophobicContact CG1-CE1 4.1Å; V843-F845 HydrophobicContact CG1-CE2 3.66Å; V843-F845 HydrophobicContact CG1-CZ 3.63Å; V843-K882 WeakPolarHBondContact O-CA 3.29Å; V843-H883 PolarHBondContact N-O 2.86Å; V843-H883 PolarHBondContact O-N 3.38Å; V843-Y885 HydrophobicContact CG2-CD2 4.24Å; V843-Y885 HydrophobicContact CG2-CE2 4.4Å; V843-L910 HydrophobicContact CG1-CD2 4.35Å; V843-L910 HydrophobicContact CG2-CD2 4.31Å
844	T	86.6	Confident	76.9	Confident	20 Å²	20	52.2 Å²	52.2	12%	0.123	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	126.3	173.8	-48.2	0	0	0	0	109.2	T830 S831 V881 K882	T830-T844 CarbonylContact C-O 3.41Å; T830-T844 WeakPolarHBondContact CA-O 3.37Å; S831-T844 PolarHBondContact N-O 2.86Å; S831-T844 WeakPolarHBondContact OG-CB 3.38Å; T844-V881 CarbonylContact C-O 3.58Å; T844-V881 WeakPolarHBondContact CA-O 3.25Å; T844-K882 HydrophobicContact CG2-CD 4.47Å; T844-K882 HydrophobicContact CG2-CG 3.86Å; T844-K882 WeakPolarHBondContact OG1-CG 3.26Å
845	F	86.1	Confident	76.4	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.6	178.3	-64.2	-86.5	0	0	0	110.4	L828 F829 T830 V843 F863 G880 V881 H883 Y885 V893 L908 L910	L828-F845 HydrophobicContact CD1-CB 4.13Å; L828-F845 HydrophobicContact CD1-CD1 4.15Å; F829-F845 CarbonylContact O-C 2.96Å; F829-F845 WeakPolarHBondContact O-CA 3.35Å; T830-F845 HydrophobicContact CG2-CD1 4.14Å; T830-F845 HydrophobicContact CG2-CE1 4.01Å; V843-F845 HydrophobicContact CB-CE2 3.97Å; V843-F845 HydrophobicContact CB-CZ 4.28Å; V843-F845 HydrophobicContact CG1-CD2 4.2Å; V843-F845 HydrophobicContact CG1-CE1 4.1Å; V843-F845 HydrophobicContact CG1-CE2 3.66Å; V843-F845 HydrophobicContact CG1-CZ 3.63Å; F845-F863 AromaticContact CD2-CD1 4Å; F845-F863 HydrophobicContact CD2-CD1 4Å; F845-F863 AromaticContact CD2-CE1 3.53Å; F845-F863 HydrophobicContact CD2-CE1 3.53Å; F845-F863 AromaticContact CE2-CD1 3.64Å; F845-F863 HydrophobicContact CE2-CD1 3.64Å; F845-F863 AromaticContact CE2-CE1 3.66Å; F845-F863 HydrophobicContact CE2-CE1 3.66Å; F845-F863 HydrophobicContact CG-CE1 4.32Å; F845-F863 HydrophobicContact CZ-CD1 4.22Å; F845-G880 CarbonylContact O-C 3.56Å; F845-G880 VanDerWaalsContact O-CA 3.23Å; F845-G880 WeakPolarHBondContact O-CA 3.4Å; F845-V881 PolarHBondContact N-O 2.83Å; F845-V881 PolarHBondContact O-N 2.04Å; F845-H883 HydrophobicContact CE2-CB 4.23Å; F845-Y885 HydrophobicContact CE2-CE2 4.31Å; F845-Y885 HydrophobicContact CZ-CE2 4.08Å; F845-V893 HydrophobicContact CD1-CG1 4.23Å; F845-V893 HydrophobicContact CE1-CB 4.34Å; F845-V893 HydrophobicContact CE1-CG1 3.94Å; F845-V893 HydrophobicContact CE1-CG2 3.86Å; F845-V893 HydrophobicContact CZ-CG1 4.29Å; F845-V893 HydrophobicContact CZ-CG2 3.9Å; F845-L908 HydrophobicContact CE1-CD2 4.37Å; F845-L910 HydrophobicContact CZ-CD2 4.07Å
846	L	82.4	Confident	75.9	Confident	19 Å²	19	53.7 Å²	53.7	10%	0.099	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.7	177.2	-59.6	171	0	0	0	108.1	P388 L828 F829 F848	P388-L846 HydrophobicContact CB-CD1 3.69Å; P388-L846 HydrophobicContact CG-CD1 3.9Å; L828-L846 WeakPolarHBondContact CA-O 3.21Å; F829-L846 PolarHBondContact N-O 2.84Å; F829-L846 PolarHBondContact O-N 2.96Å; L846-F848 HydrophobicContact CB-CE2 3.71Å; L846-F848 HydrophobicContact CB-CZ 4.14Å
847	V	81.6	Confident	75.7	Confident	11 Å²	11	50.8 Å²	50.8	7%	0.067	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	119.4	-178.8	-174.7	0	0	0	0	108.2	L826 Q827 L828 I859 V861 I877 A895	L826-V847 HydrophobicContact CD1-CG1 3.55Å; Q827-V847 WeakPolarHBondContact O-CA 3.36Å; L828-V847 HydrophobicContact CD1-CG2 4.02Å; V847-I859 HydrophobicContact CG1-CG2 4.07Å; V847-V861 HydrophobicContact CG2-CG2 3.87Å; V847-I877 HydrophobicContact CB-CG2 4.44Å; V847-I877 HydrophobicContact CG2-CG2 4.5Å; V847-A895 HydrophobicContact CG1-CB 4.2Å; V847-A895 HydrophobicContact CG2-CB 4.37Å
848	F	74.6	Confident	75.8	Confident	95 Å²	95	52.4 Å²	52.4	42%	0.417	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	144.5	175.9	-57.7	-83.8	0	0	0	109.1	P388 L826 Q827 F829 L846	P388-F848 HydrophobicContact CG-CZ 4.36Å; L826-F848 CarbonylContact C-O 3.55Å; L826-F848 WeakPolarHBondContact CA-O 3.27Å; Q827-F848 HydrophobicContact CB-CB 4.44Å; Q827-F848 PolarHBondContact N-O 3.44Å; Q827-F848 PolarHBondContact O-N 2.93Å; F829-F848 AromaticContact CD2-CD2 3.75Å; F829-F848 HydrophobicContact CD2-CD2 3.75Å; F829-F848 AromaticContact CD2-CE2 3.87Å; F829-F848 HydrophobicContact CD2-CE2 3.87Å; F829-F848 AromaticContact CE2-CD2 3.93Å; F829-F848 HydrophobicContact CE2-CD2 3.93Å; F829-F848 HydrophobicContact CE2-CE2 4.35Å; L846-F848 HydrophobicContact CB-CE2 3.71Å; L846-F848 HydrophobicContact CB-CZ 4.14Å
849	L	74.9	Confident	76	Confident	33 Å²	33	49.5 Å²	49.5	17%	0.173	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	123.4	177.2	-179.8	69.3	0	0	0	107.8	P823 R824 L826 E851 T857 I874 A897	P823-L849 HydrophobicContact CB-CD1 3.88Å; P823-L849 HydrophobicContact CB-CD2 4.14Å; R824-L849 WeakPolarHBondContact O-CD1 3.48Å; L826-L849 HydrophobicContact CB-CD1 4.11Å; L826-L849 HydrophobicContact CD1-CB 4.42Å; L826-L849 HydrophobicContact CD1-CD1 4.1Å; L849-E851 WeakPolarHBondContact CD1-O 3.49Å; L849-E851 VanDerWaalsContact CG-O 3.3Å; L849-E851 WeakPolarHBondContact CG-O 3.49Å; L849-T857 HydrophobicContact CD2-CG2 3.94Å; L849-I874 HydrophobicContact CB-CD1 3.87Å; L849-A897 HydrophobicContact CD1-CB 4.1Å
850	E	66.1	Low	76.2	Confident	89 Å²	89	49.3 Å²	49.3	42%	0.416	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-46.7	-177.3	-169.4	168.8	-164.8	0	0	111.9	K428 R824 G825	K428-E850 IonicContact NZ-OE1 2.84Å; K428-E850 PolarHBondContact NZ-OE1 3.38Å; R824-E850 PolarHBondContact O-N 3.39Å; G825-E850 PolarHBondContact O-N 3.28Å
851	E	62.9	Low	76.7	Confident	39 Å²	39	47 Å²	47	18%	0.182	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126	175.5	-57.4	173.9	-152.6	0	0	109.7	S779 P823 R824 L849	S779-E851 WeakPolarHBondContact CB-OE2 3.45Å; P823-E851 CarbonylContact C-O 3.58Å; P823-E851 VanDerWaalsContact CA-O 3.22Å; P823-E851 WeakPolarHBondContact CA-O 3.3Å; R824-E851 HydrophobicContact CB-CB 4.01Å; R824-E851 HydrophobicContact CB-CG 4.23Å; R824-E851 WeakPolarHBondContact CD-OE2 3.41Å; R824-E851 PolarHBondContact N-O 3.38Å; R824-E851 PolarHBondContact O-N 3.01Å; L849-E851 WeakPolarHBondContact CD1-O 3.49Å; L849-E851 VanDerWaalsContact CG-O 3.3Å; L849-E851 WeakPolarHBondContact CG-O 3.49Å
852	G	58.8	Low	77.2	Confident	27 Å²	27	41.8 Å²	41.8	28%	0.278	24%	0.237	S	C	.	.	S	Bend	trans	141.3	145.4	166.5	0	0	0	0	0	115.6	S854	G852-S854 PolarHBondContact O-N 2.79Å
853	L	59.9	Low	77.5	Confident	23 Å²	23	37 Å²	37	12%	0.12	21%	0.211	C	C	.	.			trans	-62.9	121.9	-178.1	-96.4	-175.9	0	0	0	112.9	I784 S855 M856 T857	I784-L853 HydrophobicContact CB-CD2 4.39Å; I784-L853 HydrophobicContact CG2-CD2 3.78Å; L853-S855 PolarHBondContact O-N 3.45Å; L853-M856 HydrophobicContact CB-CB 4.07Å; L853-M856 HydrophobicContact CD1-CB 4.06Å; L853-M856 HydrophobicContact CD1-CG 3.98Å; L853-M856 HydrophobicContact CD1-SD 3.97Å; L853-M856 PolarHBondContact O-N 3.39Å; L853-T857 WeakPolarHBondContact O-CB 3.5Å; L853-T857 PolarHBondContact O-N 2.87Å; L853-T857 PolarHBondContact O-OG1 2.95Å
854	S	59.2	Low	77.6	Confident	63 Å²	63	38 Å²	38	44%	0.441	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48	-42	170.6	-52.2	0	0	0	0	113.6	G852 N873 I874	G852-S854 PolarHBondContact O-N 2.79Å; S854-N873 VanDerWaalsContact O-CA 3.25Å; S854-N873 WeakPolarHBondContact O-CA 3.32Å; S854-N873 PolarHBondContact O-OD1 2.85Å; S854-I874 PolarHBondContact O-N 3.32Å
855	S	60.2	Low	77.8	Confident	79 Å²	79	39.7 Å²	39.7	55%	0.552	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-6.9	-171	55.8	0	0	0	0	115.5	L853	L853-S855 PolarHBondContact O-N 3.45Å
856	M	69.2	Low	77.8	Confident	112 Å²	112	43.3 Å²	43.3	55%	0.552	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.9	-4.1	179.3	-72.8	-164.3	172.2	0	0	113.9	L853 N899	L853-M856 HydrophobicContact CB-CB 4.07Å; L853-M856 HydrophobicContact CD1-CB 4.06Å; L853-M856 HydrophobicContact CD1-CG 3.98Å; L853-M856 HydrophobicContact CD1-SD 3.97Å; L853-M856 PolarHBondContact O-N 3.39Å; M856-N899 VanDerWaalsContact O-CB 3.3Å; M856-N899 WeakPolarHBondContact O-CB 3.46Å
857	T	77.2	Confident	78.1	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.006	28%	0.283	C	S	.	.			trans	-100.5	109.6	177.8	-55.6	0	0	0	0	109.7	P823 L849 L853 I859 A897	P823-T857 HydrophobicContact CB-CG2 3.97Å; P823-T857 HydrophobicContact CG-CG2 4.3Å; L849-T857 HydrophobicContact CD2-CG2 3.94Å; L853-T857 WeakPolarHBondContact O-CB 3.5Å; L853-T857 PolarHBondContact O-N 2.87Å; L853-T857 PolarHBondContact O-OG1 2.95Å; T857-I859 HydrophobicContact CG2-CG1 4.44Å; T857-A897 HydrophobicContact CG2-CB 3.75Å
858	S	85.9	Confident	78.5	Confident	45 Å²	45	47.5 Å²	47.5	32%	0.315	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	129	171.8	64.4	0	0	0	0	110.1	Y871 A897 S898	S858-Y871 CarbonylContact C-O 3.51Å; S858-Y871 VanDerWaalsContact CA-O 3.28Å; S858-Y871 WeakPolarHBondContact CA-O 3.35Å; S858-A897 CarbonylContact O-C 3.39Å; S858-A897 WeakPolarHBondContact O-CA 3.48Å; S858-S898 PolarHBondContact N-O 3.46Å; S858-S898 PolarHBondContact O-N 3.28Å; S858-S898 PolarHBondContact OG-O 2.7Å; S858-S898 VanDerWaalsContact OG-O 3.13Å; S858-S898 PolarHBondContact OG-OG 3.18Å; S858-S898 VanDerWaalsContact OG-OG 3.05Å
859	I	87.9	Confident	79.2	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	120	-178.7	-65.5	173.2	0	0	0	108.2	V847 T857 V861 S870 Y871 I874 I877 T896 A897	V847-I859 HydrophobicContact CG1-CG2 4.07Å; T857-I859 HydrophobicContact CG2-CG1 4.44Å; I859-V861 HydrophobicContact CG2-CG2 4.35Å; I859-S870 CarbonylContact O-C 3.59Å; I859-S870 WeakPolarHBondContact O-CA 3.06Å; I859-Y871 PolarHBondContact N-O 2.74Å; I859-Y871 PolarHBondContact O-N 2.81Å; I859-I874 HydrophobicContact CD1-CB 3.78Å; I859-I874 HydrophobicContact CD1-CD1 3.76Å; I859-I874 HydrophobicContact CD1-CG1 3.57Å; I859-I877 HydrophobicContact CB-CD1 3.94Å; I859-I877 HydrophobicContact CD1-CD1 4.16Å; I859-I877 HydrophobicContact CG2-CD1 3.78Å; I859-T896 WeakPolarHBondContact CA-O 3.31Å; I859-A897 HydrophobicContact CG1-CB 4.21Å
860	T	89.8	Confident	79.8	Confident	44 Å²	44	48.8 Å²	48.8	27%	0.27	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	121.4	174.9	-54.8	0	0	0	0	109.5	A868 I869 S870 A895 T896	T860-A868 HydrophobicContact CG2-CB 4.33Å; T860-I869 WeakPolarHBondContact CA-O 3.47Å; T860-S870 WeakPolarHBondContact OG1-CB 3.25Å; T860-A895 CarbonylContact O-C 3.5Å; T860-A895 WeakPolarHBondContact O-CA 3.29Å; T860-T896 PolarHBondContact N-O 2.78Å; T860-T896 PolarHBondContact O-N 2.92Å
861	V	91.6	Very high	80.7	Confident	0 Å²	0	47 Å²	47	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	114.8	172.3	-174.1	0	0	0	0	108.1	V847 I859 F863 A868 I869 V881 V893 S894 A895	V847-V861 HydrophobicContact CG2-CG2 3.87Å; I859-V861 HydrophobicContact CG2-CG2 4.35Å; V861-F863 HydrophobicContact CB-CE1 4.49Å; V861-F863 HydrophobicContact CB-CZ 4.36Å; V861-F863 HydrophobicContact CG1-CD1 4.13Å; V861-F863 HydrophobicContact CG1-CE1 3.56Å; V861-F863 HydrophobicContact CG1-CZ 3.9Å; V861-A868 CarbonylContact O-C 3.59Å; V861-A868 WeakPolarHBondContact O-CA 3.39Å; V861-I869 PolarHBondContact N-O 3.39Å; V861-I869 PolarHBondContact O-N 2.87Å; V861-V881 HydrophobicContact CG2-CG2 4.31Å; V861-V893 HydrophobicContact CG1-CG1 4.23Å; V861-S894 WeakPolarHBondContact CA-O 3.12Å; V861-A895 HydrophobicContact CG2-CB 4.45Å
862	D	93.6	Very high	81.2	Confident	60 Å²	60	50.8 Å²	50.8	32%	0.321	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.9	170.5	-173	-29.3	0	0	0	108.4	G864 A868 V893 S894	D862-G864 VanDerWaalsContact C-N 3.3Å; D862-G864 PolarHBondContact O-N 2.81Å; D862-G864 PolarHBondContact OD1-N 3.3Å; D862-A868 HydrophobicContact CB-CB 3.94Å; D862-V893 CarbonylContact O-C 3.58Å; D862-V893 VanDerWaalsContact O-CA 3.3Å; D862-V893 WeakPolarHBondContact O-CA 3.22Å; D862-V893 WeakPolarHBondContact O-CG1 3.27Å; D862-S894 PolarHBondContact N-O 2.91Å; D862-S894 PolarHBondContact O-N 3.32Å
863	F	92.3	Very high	81.7	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	34%	0.336	C	S	.	.			trans	-84.8	-1.4	-176.5	-62.4	-63.7	0	0	0	114.1	F845 V861 D865 T867 I869 V881 H883 Y885 V893	F845-F863 AromaticContact CD2-CD1 4Å; F845-F863 HydrophobicContact CD2-CD1 4Å; F845-F863 AromaticContact CD2-CE1 3.53Å; F845-F863 HydrophobicContact CD2-CE1 3.53Å; F845-F863 AromaticContact CE2-CD1 3.64Å; F845-F863 HydrophobicContact CE2-CD1 3.64Å; F845-F863 AromaticContact CE2-CE1 3.66Å; F845-F863 HydrophobicContact CE2-CE1 3.66Å; F845-F863 HydrophobicContact CG-CE1 4.32Å; F845-F863 HydrophobicContact CZ-CD1 4.22Å; V861-F863 HydrophobicContact CB-CE1 4.49Å; V861-F863 HydrophobicContact CB-CZ 4.36Å; V861-F863 HydrophobicContact CG1-CD1 4.13Å; V861-F863 HydrophobicContact CG1-CE1 3.56Å; V861-F863 HydrophobicContact CG1-CZ 3.9Å; F863-D865 PolarHBondContact O-N 3.39Å; F863-T867 WeakPolarHBondContact CD2-O 3.02Å; F863-T867 PolarHBondContact N-O 2.74Å; F863-I869 HydrophobicContact CE2-CD1 3.88Å; F863-I869 HydrophobicContact CE2-CG1 4.05Å; F863-I869 HydrophobicContact CZ-CD1 4.39Å; F863-V881 HydrophobicContact CZ-CB 4.42Å; F863-V881 HydrophobicContact CZ-CG1 3.69Å; F863-H883 VanDerWaalsContact CB-CD2 3.46Å; F863-H883 WeakPolarHBondContact CB-CD2 3.43Å; F863-H883 HydrophobicContact CD1-CB 3.93Å; F863-H883 AromaticContact CD1-CD2 3.84Å; F863-H883 HydrophobicContact CD2-CB 4.24Å; F863-H883 AromaticContact CD2-CD2 3.75Å; F863-H883 AromaticContact CD2-CG 3.76Å; F863-H883 HydrophobicContact CE1-CB 3.86Å; F863-H883 HydrophobicContact CE2-CB 4.16Å; F863-H883 HydrophobicContact CG-CB 4.14Å; F863-H883 AromaticContact CG-CD2 3.37Å; F863-H883 WeakPolarHBondContact CG-CD2 3.47Å; F863-H883 AromaticContact CG-CG 3.74Å; F863-H883 AromaticContact CG-NE2 3.9Å; F863-H883 HydrophobicContact CZ-CB 3.99Å; F863-Y885 HydrophobicContact CB-CE1 4.33Å; F863-Y885 WeakPolarHBondContact O-CE1 3.47Å; F863-Y885 PolarHBondContact O-OH 2.77Å; F863-V893 HydrophobicContact CD1-CG1 4.32Å
864	G	89.6	Confident	82.1	Confident	36 Å²	36	52.4 Å²	52.4	37%	0.371	34%	0.337	S	S	.	.	S	Bend	trans	76.2	1.7	-179.3	0	0	0	0	0	114.2	D862 Q892	D862-G864 VanDerWaalsContact C-N 3.3Å; D862-G864 PolarHBondContact O-N 2.81Å; D862-G864 PolarHBondContact OD1-N 3.3Å; G864-Q892 WeakPolarHBondContact CA-O 3.47Å
865	D	89.4	Confident	82.2	Confident	57 Å²	57	52.7 Å²	52.7	31%	0.305	34%	0.339	S	S	.	.	S	Bend	trans	-103.6	1.7	177.9	75.7	-9.2	0	0	0	113.8	F863 T867 H883 Y885 Y891	F863-D865 PolarHBondContact O-N 3.39Å; D865-T867 WeakPolarHBondContact OD1-CB 3.35Å; D865-T867 PolarHBondContact OD1-N 2.91Å; D865-T867 PolarHBondContact OD1-OG1 3.01Å; D865-H883 IonicContact OD1-NE2 3.51Å; D865-H883 IonicContact OD2-CE1 2.79Å; D865-H883 PolarHBondContact OD2-CE1 3.35Å; D865-H883 IonicContact OD2-NE2 2.68Å; D865-H883 PolarHBondContact OD2-NE2 3.26Å; D865-Y885 HydrophobicContact CB-CD1 4.47Å; D865-Y885 HydrophobicContact CB-CE1 4.35Å; D865-Y891 HydrophobicContact CB-CD1 3.91Å; D865-Y891 HydrophobicContact CB-CE1 3.45Å; D865-Y891 VanDerWaalsContact CB-CE1 3.45Å
866	G	86.9	Confident	82.3	Confident	75 Å²	75	52.3 Å²	52.3	77%	0.773	34%	0.336	S	S	*	.	S	Bend	trans	96.4	-1.7	-173.8	0	0	0	0	0	114.2
867	T	89.6	Confident	82.2	Confident	62 Å²	62	47.3 Å²	47.3	38%	0.38	31%	0.312	S	S	.	.			trans	-98.4	131.3	166.4	62	0	0	0	0	111.1	F863 D865 H883	F863-T867 WeakPolarHBondContact CD2-O 3.02Å; F863-T867 PolarHBondContact N-O 2.74Å; D865-T867 WeakPolarHBondContact OD1-CB 3.35Å; D865-T867 PolarHBondContact OD1-N 2.91Å; D865-T867 PolarHBondContact OD1-OG1 3.01Å; T867-H883 PolarHBondContact OG1-CE1 3.12Å; T867-H883 PolarHBondContact OG1-NE2 3.26Å
868	A	89.8	Confident	81.6	Confident	56 Å²	56	53 Å²	53	46%	0.463	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	140.5	173.2	0	0	0	0	0	109.5	T860 V861 D862	T860-A868 HydrophobicContact CG2-CB 4.33Å; V861-A868 CarbonylContact O-C 3.59Å; V861-A868 WeakPolarHBondContact O-CA 3.39Å; D862-A868 HydrophobicContact CB-CB 3.94Å
869	I	88.9	Confident	80.7	Confident	67 Å²	67	57.6 Å²	57.6	34%	0.344	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.2	179.4	-55.1	174.7	0	0	0	108.2	T860 V861 F863 Y871 V881	T860-I869 WeakPolarHBondContact CA-O 3.47Å; V861-I869 PolarHBondContact N-O 3.39Å; V861-I869 PolarHBondContact O-N 2.87Å; F863-I869 HydrophobicContact CE2-CD1 3.88Å; F863-I869 HydrophobicContact CE2-CG1 4.05Å; F863-I869 HydrophobicContact CZ-CD1 4.39Å; I869-Y871 HydrophobicContact CB-CE2 4.05Å; I869-Y871 HydrophobicContact CG2-CD2 4.12Å; I869-Y871 HydrophobicContact CG2-CE1 4.43Å; I869-Y871 HydrophobicContact CG2-CE2 3.43Å; I869-Y871 VanDerWaalsContact CG2-CE2 3.43Å; I869-V881 HydrophobicContact CD1-CG1 4.15Å
870	S	87.9	Confident	80.3	Confident	88 Å²	88	58 Å²	58	62%	0.615	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.7	137.1	176.3	55.3	0	0	0	0	111.8	I859 T860	I859-S870 CarbonylContact O-C 3.59Å; I859-S870 WeakPolarHBondContact O-CA 3.06Å; T860-S870 WeakPolarHBondContact OG1-CB 3.25Å
871	Y	84.1	Confident	80.1	Confident	52 Å²	52	56.1 Å²	56.1	20%	0.204	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	142.7	-178.3	-65.5	-89.6	0	0	0	109.4	S858 I859 I869 S876 I877 V881	S858-Y871 CarbonylContact C-O 3.51Å; S858-Y871 VanDerWaalsContact CA-O 3.28Å; S858-Y871 WeakPolarHBondContact CA-O 3.35Å; I859-Y871 PolarHBondContact N-O 2.74Å; I859-Y871 PolarHBondContact O-N 2.81Å; I869-Y871 HydrophobicContact CB-CE2 4.05Å; I869-Y871 HydrophobicContact CG2-CD2 4.12Å; I869-Y871 HydrophobicContact CG2-CE1 4.43Å; I869-Y871 HydrophobicContact CG2-CE2 3.43Å; I869-Y871 VanDerWaalsContact CG2-CE2 3.43Å; Y871-S876 VanDerWaalsContact CD1-OG 3.3Å; Y871-S876 WeakPolarHBondContact CD1-OG 3.25Å; Y871-I877 HydrophobicContact CD1-CG1 3.98Å; Y871-I877 HydrophobicContact CD2-CD1 3.72Å; Y871-I877 HydrophobicContact CD2-CG1 3.89Å; Y871-I877 HydrophobicContact CE1-CG1 4.33Å; Y871-I877 HydrophobicContact CE2-CD1 4.4Å; Y871-I877 HydrophobicContact CE2-CG1 4.25Å; Y871-I877 HydrophobicContact CG-CD1 3.78Å; Y871-I877 HydrophobicContact CG-CG1 3.74Å; Y871-V881 HydrophobicContact CE2-CG1 4.19Å; Y871-V881 HydrophobicContact CE2-CG2 3.74Å; Y871-V881 WeakPolarHBondContact OH-CG1 3.29Å
872	V	73.5	Confident	80	Confident	118 Å²	118	61.5 Å²	61.5	72%	0.715	38%	0.38	S	S	*	.	S	Bend	trans	-91.8	-16.9	-176.4	-172	0	0	0	0	112.3
873	N	70.2	Confident	79.8	Confident	55 Å²	55	59.9 Å²	59.9	29%	0.294	37%	0.37	S	S	.	.	S	Bend	trans	-144.4	134.4	178.7	177	-0.3	0	0	0	110.3	S854 S875 S876	S854-N873 VanDerWaalsContact O-CA 3.25Å; S854-N873 WeakPolarHBondContact O-CA 3.32Å; S854-N873 PolarHBondContact O-OD1 2.85Å; N873-S875 PolarHBondContact ND2-OG 2.75Å; N873-S875 VanDerWaalsContact ND2-OG 3.1Å; N873-S875 PolarHBondContact O-N 2.68Å; N873-S875 PolarHBondContact OD1-N 2.79Å; N873-S875 VanDerWaalsContact OD1-N 3.11Å; N873-S875 PolarHBondContact OD1-OG 3.48Å; N873-S876 PolarHBondContact O-N 3.02Å; N873-S876 VanDerWaalsContact O-N 3.17Å; N873-S876 PolarHBondContact O-OG 3.42Å
874	I	67.1	Low	79.8	Confident	29 Å²	29	63 Å²	63	15%	0.149	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-58.6	-33.3	-179.3	-163.5	167.5	0	0	0	113	L849 S854 I859 S876 I877	L849-I874 HydrophobicContact CB-CD1 3.87Å; S854-I874 PolarHBondContact O-N 3.32Å; I859-I874 HydrophobicContact CD1-CB 3.78Å; I859-I874 HydrophobicContact CD1-CD1 3.76Å; I859-I874 HydrophobicContact CD1-CG1 3.57Å; I874-S876 PolarHBondContact O-N 3.48Å; I874-I877 WeakPolarHBondContact O-CB 3.44Å; I874-I877 PolarHBondContact O-N 3.36Å
875	S	62.5	Low	79.8	Confident	70 Å²	70	61.5 Å²	61.5	49%	0.49	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-69.5	5.1	179.6	78.7	0	0	0	0	114.5	N873	N873-S875 PolarHBondContact ND2-OG 2.75Å; N873-S875 VanDerWaalsContact ND2-OG 3.1Å; N873-S875 PolarHBondContact O-N 2.68Å; N873-S875 PolarHBondContact OD1-N 2.79Å; N873-S875 VanDerWaalsContact OD1-N 3.11Å; N873-S875 PolarHBondContact OD1-OG 3.48Å
876	S	60.3	Low	79.7	Confident	70 Å²	70	64 Å²	64	49%	0.49	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-96.4	4.2	166.9	62.8	0	0	0	0	113.1	Y871 N873 I874	Y871-S876 VanDerWaalsContact CD1-OG 3.3Å; Y871-S876 WeakPolarHBondContact CD1-OG 3.25Å; N873-S876 PolarHBondContact O-N 3.02Å; N873-S876 VanDerWaalsContact O-N 3.17Å; N873-S876 PolarHBondContact O-OG 3.42Å; I874-S876 PolarHBondContact O-N 3.48Å
877	I	68.8	Low	79.6	Confident	8 Å²	8	67.8 Å²	67.8	4%	0.041	38%	0.378	C	S	.	.	S	Bend	trans	-121.2	-2	-176.3	-49.8	170.8	0	0	0	112.1	V847 I859 Y871 I874 D879 G880 V881	V847-I877 HydrophobicContact CB-CG2 4.44Å; V847-I877 HydrophobicContact CG2-CG2 4.5Å; I859-I877 HydrophobicContact CB-CD1 3.94Å; I859-I877 HydrophobicContact CD1-CD1 4.16Å; I859-I877 HydrophobicContact CG2-CD1 3.78Å; Y871-I877 HydrophobicContact CD1-CG1 3.98Å; Y871-I877 HydrophobicContact CD2-CD1 3.72Å; Y871-I877 HydrophobicContact CD2-CG1 3.89Å; Y871-I877 HydrophobicContact CE1-CG1 4.33Å; Y871-I877 HydrophobicContact CE2-CD1 4.4Å; Y871-I877 HydrophobicContact CE2-CG1 4.25Å; Y871-I877 HydrophobicContact CG-CD1 3.78Å; Y871-I877 HydrophobicContact CG-CG1 3.74Å; I874-I877 WeakPolarHBondContact O-CB 3.44Å; I874-I877 PolarHBondContact O-N 3.36Å; I877-D879 PolarHBondContact O-N 3.15Å; I877-D879 VanDerWaalsContact O-N 3.1Å; I877-G880 VanDerWaalsContact O-CA 3.31Å; I877-G880 WeakPolarHBondContact O-CA 3.22Å; I877-G880 PolarHBondContact O-N 3.39Å; I877-V881 HydrophobicContact CG2-CG2 3.58Å
878	D	64.3	Low	79.4	Confident	121 Å²	121	66.5 Å²	66.5	65%	0.647	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-33.5	-175.5	-62.6	-12.8	0	0	0	113.7	G880	D878-G880 VanDerWaalsContact C-N 3.27Å; D878-G880 PolarHBondContact O-N 3.18Å
879	D	67.1	Low	79.2	Confident	141 Å²	141	65.1 Å²	65.1	75%	0.754	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	0.1	174.4	-86.7	-24.4	0	0	0	114.9	I877 K882	I877-D879 PolarHBondContact O-N 3.15Å; I877-D879 VanDerWaalsContact O-N 3.1Å; D879-K882 WeakPolarHBondContact O-CE 3.48Å; D879-K882 PolarHBondContact O-NZ 2.82Å
880	G	79.4	Confident	79.1	Confident	10 Å²	10	66.1 Å²	66.1	10%	0.103	37%	0.366	C	S	.	.			trans	75.5	145.7	-176.6	0	0	0	0	0	115.6	F845 I877 D878	F845-G880 CarbonylContact O-C 3.56Å; F845-G880 VanDerWaalsContact O-CA 3.23Å; F845-G880 WeakPolarHBondContact O-CA 3.4Å; I877-G880 VanDerWaalsContact O-CA 3.31Å; I877-G880 WeakPolarHBondContact O-CA 3.22Å; I877-G880 PolarHBondContact O-N 3.39Å; D878-G880 VanDerWaalsContact C-N 3.27Å; D878-G880 PolarHBondContact O-N 3.18Å
881	V	85.8	Confident	79.2	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.024	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	126.4	177.3	-164.8	0	0	0	0	110.2	T844 F845 V861 F863 I869 Y871 I877	T844-V881 CarbonylContact C-O 3.58Å; T844-V881 WeakPolarHBondContact CA-O 3.25Å; F845-V881 PolarHBondContact N-O 2.83Å; F845-V881 PolarHBondContact O-N 2.04Å; V861-V881 HydrophobicContact CG2-CG2 4.31Å; F863-V881 HydrophobicContact CZ-CB 4.42Å; F863-V881 HydrophobicContact CZ-CG1 3.69Å; I869-V881 HydrophobicContact CD1-CG1 4.15Å; Y871-V881 HydrophobicContact CE2-CG1 4.19Å; Y871-V881 HydrophobicContact CE2-CG2 3.74Å; Y871-V881 WeakPolarHBondContact OH-CG1 3.29Å; I877-V881 HydrophobicContact CG2-CG2 3.58Å
882	K	87.9	Confident	79.6	Confident	113 Å²	113	64.7 Å²	64.7	49%	0.491	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	125.4	-174	-72.3	156	-168.1	152.1	0	110.9	V843 T844 D879	V843-K882 WeakPolarHBondContact O-CA 3.29Å; T844-K882 HydrophobicContact CG2-CD 4.47Å; T844-K882 HydrophobicContact CG2-CG 3.86Å; T844-K882 WeakPolarHBondContact OG1-CG 3.26Å; D879-K882 WeakPolarHBondContact O-CE 3.48Å; D879-K882 PolarHBondContact O-NZ 2.82Å
883	H	90.8	Very high	80.5	Confident	26 Å²	26	59.1 Å²	59.1	12%	0.12	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	159.4	179.3	-169.5	40.8	0	0	0	112.6	N842 V843 F845 F863 D865 T867 Y885	N842-H883 WeakPolarHBondContact CA-O 3.18Å; V843-H883 PolarHBondContact N-O 2.86Å; V843-H883 PolarHBondContact O-N 3.38Å; F845-H883 HydrophobicContact CE2-CB 4.23Å; F863-H883 VanDerWaalsContact CB-CD2 3.46Å; F863-H883 WeakPolarHBondContact CB-CD2 3.43Å; F863-H883 HydrophobicContact CD1-CB 3.93Å; F863-H883 AromaticContact CD1-CD2 3.84Å; F863-H883 HydrophobicContact CD2-CB 4.24Å; F863-H883 AromaticContact CD2-CD2 3.75Å; F863-H883 AromaticContact CD2-CG 3.76Å; F863-H883 HydrophobicContact CE1-CB 3.86Å; F863-H883 HydrophobicContact CE2-CB 4.16Å; F863-H883 HydrophobicContact CG-CB 4.14Å; F863-H883 AromaticContact CG-CD2 3.37Å; F863-H883 WeakPolarHBondContact CG-CD2 3.47Å; F863-H883 AromaticContact CG-CG 3.74Å; F863-H883 AromaticContact CG-NE2 3.9Å; F863-H883 HydrophobicContact CZ-CB 3.99Å; D865-H883 IonicContact OD1-NE2 3.51Å; D865-H883 IonicContact OD2-CE1 2.79Å; D865-H883 PolarHBondContact OD2-CE1 3.35Å; D865-H883 IonicContact OD2-NE2 2.68Å; D865-H883 PolarHBondContact OD2-NE2 3.26Å; T867-H883 PolarHBondContact OG1-CE1 3.12Å; T867-H883 PolarHBondContact OG1-NE2 3.26Å; H883-Y885 AromaticContact CD2-CE1 3.93Å; H883-Y885 AromaticContact CD2-CE2 3.79Å; H883-Y885 AromaticContact CD2-CZ 3.7Å
884	I	91.3	Very high	81.6	Confident	66 Å²	66	57 Å²	57	34%	0.338	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	112.8	178.1	-54.2	175.6	0	0	0	109.9	N842 N886	N842-I884 VanDerWaalsContact OD1-CD1 3.23Å; N842-I884 WeakPolarHBondContact OD1-CD1 3.24Å; N842-I884 VanDerWaalsContact OD1-CG1 3.26Å; N842-I884 WeakPolarHBondContact OD1-CG1 3.36Å; I884-N886 PolarHBondContact O-ND2 2.89Å
885	Y	89.9	Confident	82.7	Confident	3 Å²	3	55.7 Å²	55.7	1%	0.012	30%	0.3	C	S	.	.			trans	-77.2	129.4	175.8	-69.2	-84.8	0	0	0	111.9	L839 G840 V843 F845 F863 D865 H883 Y891 V893 L910 V912	L839-Y885 WeakPolarHBondContact CD1-O 3.42Å; G840-Y885 PolarHBondContact N-O 3.03Å; G840-Y885 VanDerWaalsContact N-O 3.14Å; V843-Y885 HydrophobicContact CG2-CD2 4.24Å; V843-Y885 HydrophobicContact CG2-CE2 4.4Å; F845-Y885 HydrophobicContact CE2-CE2 4.31Å; F845-Y885 HydrophobicContact CZ-CE2 4.08Å; F863-Y885 HydrophobicContact CB-CE1 4.33Å; F863-Y885 WeakPolarHBondContact O-CE1 3.47Å; F863-Y885 PolarHBondContact O-OH 2.77Å; D865-Y885 HydrophobicContact CB-CD1 4.47Å; D865-Y885 HydrophobicContact CB-CE1 4.35Å; H883-Y885 AromaticContact CD2-CE1 3.93Å; H883-Y885 AromaticContact CD2-CE2 3.79Å; H883-Y885 AromaticContact CD2-CZ 3.7Å; Y885-Y891 AromaticContact CD1-CD1 3.98Å; Y885-Y891 HydrophobicContact CD1-CD1 3.98Å; Y885-Y891 AromaticContact CD1-CD2 3.65Å; Y885-Y891 HydrophobicContact CD1-CD2 3.65Å; Y885-Y891 AromaticContact CD1-CE1 3.94Å; Y885-Y891 HydrophobicContact CD1-CE1 3.94Å; Y885-Y891 AromaticContact CD1-CE2 3.58Å; Y885-Y891 HydrophobicContact CD1-CE2 3.58Å; Y885-Y891 AromaticContact CD1-CG 3.83Å; Y885-Y891 HydrophobicContact CD1-CG 3.83Å; Y885-Y891 AromaticContact CD1-CZ 3.7Å; Y885-Y891 AromaticContact CE1-CD1 3.64Å; Y885-Y891 HydrophobicContact CE1-CD1 3.64Å; Y885-Y891 AromaticContact CE1-CD2 3.74Å; Y885-Y891 HydrophobicContact CE1-CD2 3.74Å; Y885-Y891 HydrophobicContact CE1-CE1 4.05Å; Y885-Y891 HydrophobicContact CE1-CE2 4.12Å; Y885-Y891 AromaticContact CE1-CG 3.45Å; Y885-Y891 HydrophobicContact CE1-CG 3.45Å; Y885-Y891 VanDerWaalsContact CE1-CG 3.45Å; Y885-Y891 HydrophobicContact CG-CD2 4.42Å; Y885-Y891 HydrophobicContact CG-CE2 4.3Å; Y885-V893 VanDerWaalsContact OH-CG2 3.28Å; Y885-V893 WeakPolarHBondContact OH-CG2 3.46Å; Y885-L910 HydrophobicContact CD2-CD2 3.93Å; Y885-L910 HydrophobicContact CE2-CD2 3.34Å; Y885-V912 HydrophobicContact CD1-CG2 4.09Å; Y885-V912 HydrophobicContact CD2-CG2 3.77Å; Y885-V912 HydrophobicContact CE2-CG2 4.36Å; Y885-V912 HydrophobicContact CG-CG2 3.61Å
886	N	86.6	Confident	84.1	Confident	109 Å²	109	53.1 Å²	53.1	58%	0.583	28%	0.281	S	S	*	.			trans	-105.9	0.6	-174.7	-72.4	-82.8	0	0	0	114.1	I884	I884-N886 PolarHBondContact O-ND2 2.89Å
887	K	85	Confident	85.4	Confident	156 Å²	156	49.8 Å²	49.8	68%	0.678	26%	0.258	S	S	*	.	S	Bend	trans	-137.4	156.6	170.4	-59	171.7	-175.6	167.7	0	109.1	L839 Y891 V912	L839-K887 VanDerWaalsContact CD1-O 3.31Å; L839-K887 WeakPolarHBondContact CD1-O 3.45Å; K887-Y891 PolarHBondContact O-OH 2.93Å; K887-V912 WeakPolarHBondContact O-CG1 3.29Å
888	V	85.4	Confident	86.3	Confident	34 Å²	34	51.1 Å²	51.1	21%	0.206	27%	0.268	C	S	.	.			trans	-79.5	148.5	168.9	-64.1	0	0	0	0	110.2	L839 V912 C914 S943	L839-V888 HydrophobicContact CD1-CG1 4.22Å; L839-V888 HydrophobicContact CD2-CG1 4.39Å; V888-V912 WeakPolarHBondContact CA-O 3.07Å; V888-V912 WeakPolarHBondContact CB-O 3.45Å; V888-C914 HydrophobicContact CG1-CB 3.7Å; V888-S943 WeakPolarHBondContact CG2-O 3.5Å
889	G	85.5	Confident	87.3	Confident	27 Å²	27	46.6 Å²	46.6	28%	0.278	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	159.4	176.8	-178.5	0	0	0	0	0	113	V912	G889-V912 PolarHBondContact N-O 2.87Å; G889-V912 PolarHBondContact O-N 2.77Å
890	I	87.5	Confident	88	Confident	88 Å²	88	45.9 Å²	45.9	45%	0.451	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122	168.5	-57.4	173.2	0	0	0	107	Y909 L910 H911	I890-Y909 HydrophobicContact CG2-CD1 4.44Å; I890-L910 WeakPolarHBondContact CA-O 3.42Å; I890-H911 VanDerWaalsContact CD1-CE1 3.49Å; I890-H911 WeakPolarHBondContact CD1-CE1 3.4Å
891	Y	90.2	Very high	88.1	Confident	26 Å²	26	49.5 Å²	49.5	10%	0.102	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.5	-176.7	-72.1	-82.1	0	0	0	110.3	D865 Y885 K887 V893 Y909 L910 V912	D865-Y891 HydrophobicContact CB-CD1 3.91Å; D865-Y891 HydrophobicContact CB-CE1 3.45Å; D865-Y891 VanDerWaalsContact CB-CE1 3.45Å; Y885-Y891 AromaticContact CD1-CD1 3.98Å; Y885-Y891 HydrophobicContact CD1-CD1 3.98Å; Y885-Y891 AromaticContact CD1-CD2 3.65Å; Y885-Y891 HydrophobicContact CD1-CD2 3.65Å; Y885-Y891 AromaticContact CD1-CE1 3.94Å; Y885-Y891 HydrophobicContact CD1-CE1 3.94Å; Y885-Y891 AromaticContact CD1-CE2 3.58Å; Y885-Y891 HydrophobicContact CD1-CE2 3.58Å; Y885-Y891 AromaticContact CD1-CG 3.83Å; Y885-Y891 HydrophobicContact CD1-CG 3.83Å; Y885-Y891 AromaticContact CD1-CZ 3.7Å; Y885-Y891 AromaticContact CE1-CD1 3.64Å; Y885-Y891 HydrophobicContact CE1-CD1 3.64Å; Y885-Y891 AromaticContact CE1-CD2 3.74Å; Y885-Y891 HydrophobicContact CE1-CD2 3.74Å; Y885-Y891 HydrophobicContact CE1-CE1 4.05Å; Y885-Y891 HydrophobicContact CE1-CE2 4.12Å; Y885-Y891 AromaticContact CE1-CG 3.45Å; Y885-Y891 HydrophobicContact CE1-CG 3.45Å; Y885-Y891 VanDerWaalsContact CE1-CG 3.45Å; Y885-Y891 HydrophobicContact CG-CD2 4.42Å; Y885-Y891 HydrophobicContact CG-CE2 4.3Å; K887-Y891 PolarHBondContact O-OH 2.93Å; Y891-V893 PolarHBondContact O-N 2.71Å; Y891-Y909 CarbonylContact O-C 3.51Å; Y891-Y909 WeakPolarHBondContact O-CA 3.41Å; Y891-L910 PolarHBondContact N-O 3.47Å; Y891-L910 PolarHBondContact O-N 3.34Å; Y891-V912 HydrophobicContact CD2-CB 3.99Å; Y891-V912 HydrophobicContact CD2-CG2 3.53Å; Y891-V912 HydrophobicContact CE2-CB 3.89Å; Y891-V912 HydrophobicContact CE2-CG2 3.79Å
892	Q	92.9	Very high	88.1	Confident	85 Å²	85	50.5 Å²	50.5	40%	0.397	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	91.6	170.5	-173.7	178.9	26.9	0	0	108.6	G864 F907 Y909	G864-Q892 WeakPolarHBondContact CA-O 3.47Å; Q892-F907 HydrophobicContact CG-CD1 3.87Å; Q892-F907 VanDerWaalsContact NE2-CD1 3.25Å; Q892-Y909 HydrophobicContact CB-CD1 4.11Å; Q892-Y909 HydrophobicContact CB-CE1 3.89Å; Q892-Y909 HydrophobicContact CG-CD1 4.24Å; Q892-Y909 HydrophobicContact CG-CE1 3.72Å; Q892-Y909 PolarHBondContact NE2-OH 3.21Å
893	V	93	Very high	88.2	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	136.7	170.1	-170.4	0	0	0	0	107.7	L828 F845 V861 D862 F863 Y885 Y891 F907 L908 L910	L828-V893 HydrophobicContact CD2-CB 4.32Å; L828-V893 HydrophobicContact CD2-CG1 3.89Å; F845-V893 HydrophobicContact CD1-CG1 4.23Å; F845-V893 HydrophobicContact CE1-CB 4.34Å; F845-V893 HydrophobicContact CE1-CG1 3.94Å; F845-V893 HydrophobicContact CE1-CG2 3.86Å; F845-V893 HydrophobicContact CZ-CG1 4.29Å; F845-V893 HydrophobicContact CZ-CG2 3.9Å; V861-V893 HydrophobicContact CG1-CG1 4.23Å; D862-V893 CarbonylContact O-C 3.58Å; D862-V893 VanDerWaalsContact O-CA 3.3Å; D862-V893 WeakPolarHBondContact O-CA 3.22Å; D862-V893 WeakPolarHBondContact O-CG1 3.27Å; F863-V893 HydrophobicContact CD1-CG1 4.32Å; Y885-V893 VanDerWaalsContact OH-CG2 3.28Å; Y885-V893 WeakPolarHBondContact OH-CG2 3.46Å; Y891-V893 PolarHBondContact O-N 2.71Å; V893-F907 CarbonylContact O-C 3.54Å; V893-F907 WeakPolarHBondContact O-CA 3.38Å; V893-L908 HydrophobicContact CB-CB 4.39Å; V893-L908 HydrophobicContact CB-CD2 4.46Å; V893-L908 HydrophobicContact CG2-CD2 4.31Å; V893-L908 PolarHBondContact N-O 3.16Å; V893-L908 PolarHBondContact O-N 3.36Å; V893-L910 HydrophobicContact CG2-CB 4.23Å
894	S	92.3	Very high	88.1	Confident	12 Å²	12	52.8 Å²	52.8	8%	0.084	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	133.1	171.7	77.1	0	0	0	0	111.4	V861 D862 V906	V861-S894 WeakPolarHBondContact CA-O 3.12Å; D862-S894 PolarHBondContact N-O 2.91Å; D862-S894 PolarHBondContact O-N 3.32Å; S894-V906 VanDerWaalsContact CA-O 3.28Å; S894-V906 WeakPolarHBondContact CA-O 3.28Å
895	A	91.3	Very high	88	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	132.2	164.7	0	0	0	0	0	107.7	L826 L828 V847 T860 V861 R905 V906	L826-A895 HydrophobicContact CD2-CB 4.05Å; L826-A895 VanDerWaalsContact CD2-O 3.24Å; L826-A895 WeakPolarHBondContact CD2-O 3.49Å; L826-A895 HydrophobicContact CG-CB 4.43Å; L828-A895 HydrophobicContact CB-CB 4.44Å; L828-A895 HydrophobicContact CD1-CB 4.46Å; L828-A895 HydrophobicContact CD2-CB 4.23Å; V847-A895 HydrophobicContact CG1-CB 4.2Å; V847-A895 HydrophobicContact CG2-CB 4.37Å; T860-A895 CarbonylContact O-C 3.5Å; T860-A895 WeakPolarHBondContact O-CA 3.29Å; V861-A895 HydrophobicContact CG2-CB 4.45Å; A895-R905 WeakPolarHBondContact O-CA 3.24Å; A895-V906 HydrophobicContact CB-CG1 3.9Å; A895-V906 PolarHBondContact N-O 2.89Å; A895-V906 VanDerWaalsContact N-O 3.09Å; A895-V906 PolarHBondContact O-N 3.06Å
896	T	90.4	Very high	88	Confident	16 Å²	16	57.1 Å²	57.1	10%	0.098	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	117	172.5	-50.1	0	0	0	0	108.6	I859 T860 F903 D904 R905	I859-T896 WeakPolarHBondContact CA-O 3.31Å; T860-T896 PolarHBondContact N-O 2.78Å; T860-T896 PolarHBondContact O-N 2.92Å; T896-F903 HydrophobicContact CG2-CB 4.41Å; T896-F903 HydrophobicContact CG2-CD2 4.4Å; T896-D904 CarbonylContact C-O 3.54Å; T896-D904 WeakPolarHBondContact CA-O 3.27Å; T896-R905 PolarHBondContact OG1-NE 3.32Å; T896-R905 PolarHBondContact OG1-NH2 3.32Å
897	A	88.6	Confident	88.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	130.4	170.6	0	0	0	0	0	108.1	P823 L826 L849 T857 S858 I859 F903 D904	P823-A897 HydrophobicContact CB-CB 3.89Å; P823-A897 HydrophobicContact CG-CB 4.24Å; P823-A897 VanDerWaalsContact CG-O 3.31Å; P823-A897 WeakPolarHBondContact CG-O 3.4Å; L826-A897 HydrophobicContact CD1-CB 3.91Å; L826-A897 HydrophobicContact CD2-CB 3.8Å; L826-A897 HydrophobicContact CG-CB 4.37Å; L849-A897 HydrophobicContact CD1-CB 4.1Å; T857-A897 HydrophobicContact CG2-CB 3.75Å; S858-A897 CarbonylContact O-C 3.39Å; S858-A897 WeakPolarHBondContact O-CA 3.48Å; I859-A897 HydrophobicContact CG1-CB 4.21Å; A897-F903 CarbonylContact O-C 3.56Å; A897-F903 WeakPolarHBondContact O-CA 3.49Å; A897-F903 VanDerWaalsContact O-CB 3.32Å; A897-F903 WeakPolarHBondContact O-CB 3.33Å; A897-D904 PolarHBondContact N-O 2.79Å; A897-D904 PolarHBondContact O-N 3.44Å
898	S	87.9	Confident	88.3	Confident	36 Å²	36	49.6 Å²	49.6	25%	0.252	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	138.8	-177	65.5	0	0	0	0	113.3	S858	S858-S898 PolarHBondContact N-O 3.46Å; S858-S898 PolarHBondContact O-N 3.28Å; S858-S898 PolarHBondContact OG-O 2.7Å; S858-S898 VanDerWaalsContact OG-O 3.13Å; S858-S898 PolarHBondContact OG-OG 3.18Å; S858-S898 VanDerWaalsContact OG-OG 3.05Å
899	N	85.4	Confident	88.5	Confident	27 Å²	27	54.1 Å²	54.1	14%	0.144	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	-170.7	175	76.5	16.3	0	0	0	110.9	Q821 M856 L901 G902	Q821-N899 PolarHBondContact O-ND2 3.19Å; M856-N899 VanDerWaalsContact O-CB 3.3Å; M856-N899 WeakPolarHBondContact O-CB 3.46Å; N899-L901 PolarHBondContact O-N 2.95Å; N899-L901 VanDerWaalsContact O-N 3.12Å; N899-L901 PolarHBondContact OD1-N 3.47Å; N899-G902 PolarHBondContact N-O 2.85Å; N899-G902 PolarHBondContact O-N 3.35Å; N899-G902 PolarHBondContact OD1-N 3.39Å
900	H	81.9	Confident	88.6	Confident	126 Å²	126	52.9 Å²	52.9	58%	0.583	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-1.4	-175.2	63.5	-97	0	0	0	115.4
901	L	81.3	Confident	88.5	Confident	85 Å²	85	52.5 Å²	52.5	45%	0.445	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-20.6	178.8	-62.5	178	0	0	0	114.2	S820 A822 N899	S820-L901 VanDerWaalsContact CB-CD1 3.49Å; S820-L901 WeakPolarHBondContact O-CD1 3.42Å; A822-L901 HydrophobicContact CB-CB 3.96Å; N899-L901 PolarHBondContact O-N 2.95Å; N899-L901 VanDerWaalsContact O-N 3.12Å; N899-L901 PolarHBondContact OD1-N 3.47Å
902	G	85.4	Confident	88.3	Confident	26 Å²	26	51.4 Å²	51.4	27%	0.268	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	168.8	-169.7	-176.5	0	0	0	0	0	113.1	P823 N899	P823-G902 WeakPolarHBondContact CD-O 3.34Å; N899-G902 PolarHBondContact N-O 2.85Å; N899-G902 PolarHBondContact O-N 3.35Å; N899-G902 PolarHBondContact OD1-N 3.39Å
903	F	88.7	Confident	88	Confident	144 Å²	144	48.7 Å²	48.7	63%	0.632	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-142.8	153.4	176.7	67.7	-87.5	0	0	0	110.8	T896 A897	T896-F903 HydrophobicContact CG2-CB 4.41Å; T896-F903 HydrophobicContact CG2-CD2 4.4Å; A897-F903 CarbonylContact O-C 3.56Å; A897-F903 WeakPolarHBondContact O-CA 3.49Å; A897-F903 VanDerWaalsContact O-CB 3.32Å; A897-F903 WeakPolarHBondContact O-CB 3.33Å
904	D	88.6	Confident	87.5	Confident	43 Å²	43	49.3 Å²	49.3	23%	0.23	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	151.8	165.5	-164.8	4.2	0	0	0	108.9	P823 R824 G825 L826 T896 A897	P823-D904 WeakPolarHBondContact O-CB 3.22Å; R824-D904 WeakPolarHBondContact CA-OD2 3.3Å; G825-D904 PolarHBondContact N-OD2 3Å; L826-D904 HydrophobicContact CB-CB 4.04Å; L826-D904 WeakPolarHBondContact CB-OD2 3.41Å; L826-D904 PolarHBondContact N-OD2 2.86Å; T896-D904 CarbonylContact C-O 3.54Å; T896-D904 WeakPolarHBondContact CA-O 3.27Å; A897-D904 PolarHBondContact N-O 2.79Å; A897-D904 PolarHBondContact O-N 3.44Å
905	R	90.4	Very high	87	Confident	124 Å²	124	54.7 Å²	54.7	47%	0.468	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	122.2	-179	178	174.1	-72	-178.6	-8.8	111.7	A895 T896 F907	A895-R905 WeakPolarHBondContact O-CA 3.24Å; T896-R905 PolarHBondContact OG1-NE 3.32Å; T896-R905 PolarHBondContact OG1-NH2 3.32Å; R905-F907 HydrophobicContact CG-CE1 4.23Å; R905-F907 HydrophobicContact CG-CE2 4Å; R905-F907 HydrophobicContact CG-CZ 3.83Å
906	V	90.1	Very high	86.6	Confident	36 Å²	36	54.7 Å²	54.7	22%	0.218	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	151.1	173.8	65.5	0	0	0	0	110.5	L826 L828 S894 A895	L826-V906 HydrophobicContact CB-CG1 4.45Å; L826-V906 HydrophobicContact CD2-CG1 4.06Å; L826-V906 HydrophobicContact CG-CG1 3.83Å; L826-V906 VanDerWaalsContact O-CB 3.32Å; L826-V906 WeakPolarHBondContact O-CB 3.45Å; L828-V906 HydrophobicContact CB-CG1 3.53Å; L828-V906 HydrophobicContact CB-CG2 4.44Å; L828-V906 HydrophobicContact CD2-CG1 4.41Å; S894-V906 VanDerWaalsContact CA-O 3.28Å; S894-V906 WeakPolarHBondContact CA-O 3.28Å; A895-V906 HydrophobicContact CB-CG1 3.9Å; A895-V906 PolarHBondContact N-O 2.89Å; A895-V906 VanDerWaalsContact N-O 3.09Å; A895-V906 PolarHBondContact O-N 3.06Å
907	F	89.2	Confident	86.3	Confident	101 Å²	101	59.8 Å²	59.8	44%	0.443	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	141.1	179.8	-60	-83.3	0	0	0	110.9	Q892 V893 R905	Q892-F907 HydrophobicContact CG-CD1 3.87Å; Q892-F907 VanDerWaalsContact NE2-CD1 3.25Å; V893-F907 CarbonylContact O-C 3.54Å; V893-F907 WeakPolarHBondContact O-CA 3.38Å; R905-F907 HydrophobicContact CG-CE1 4.23Å; R905-F907 HydrophobicContact CG-CE2 4Å; R905-F907 HydrophobicContact CG-CZ 3.83Å
908	L	88.2	Confident	86.1	Confident	6 Å²	6	64 Å²	64	3%	0.031	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	126.9	173.6	179.2	155	0	0	0	108.5	L828 T830 F835 F845 V893 L910	L828-L908 HydrophobicContact CD2-CB 3.7Å; L828-L908 HydrophobicContact CG-CB 4.11Å; L828-L908 HydrophobicContact CG-CD1 4.2Å; T830-L908 HydrophobicContact CG2-CD1 4.36Å; F835-L908 HydrophobicContact CD1-CD1 4.03Å; F835-L908 HydrophobicContact CD1-CD2 4.15Å; F835-L908 HydrophobicContact CD1-CG 3.82Å; F835-L908 HydrophobicContact CE1-CD1 3.8Å; F835-L908 HydrophobicContact CE1-CG 3.86Å; F845-L908 HydrophobicContact CE1-CD2 4.37Å; V893-L908 HydrophobicContact CB-CB 4.39Å; V893-L908 HydrophobicContact CB-CD2 4.46Å; V893-L908 HydrophobicContact CG2-CD2 4.31Å; V893-L908 PolarHBondContact N-O 3.16Å; V893-L908 PolarHBondContact O-N 3.36Å; L908-L910 HydrophobicContact CD2-CB 3.92Å; L908-L910 HydrophobicContact CD2-CD1 4.35Å
909	Y	88.7	Confident	86.1	Confident	128 Å²	128	62.4 Å²	62.4	50%	0.502	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	108	176.7	-65.7	-79.6	0	0	0	109.9	I890 Y891 Q892	I890-Y909 HydrophobicContact CG2-CD1 4.44Å; Y891-Y909 CarbonylContact O-C 3.51Å; Y891-Y909 WeakPolarHBondContact O-CA 3.41Å; Q892-Y909 HydrophobicContact CB-CD1 4.11Å; Q892-Y909 HydrophobicContact CB-CE1 3.89Å; Q892-Y909 HydrophobicContact CG-CD1 4.24Å; Q892-Y909 HydrophobicContact CG-CE1 3.72Å; Q892-Y909 PolarHBondContact NE2-OH 3.21Å
910	L	87.7	Confident	86.2	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	122.9	-179.7	-170.9	77.2	0	0	0	110.8	T830 A837 V843 F845 Y885 I890 Y891 V893 L908 V912	T830-L910 HydrophobicContact CG2-CD1 4.18Å; A837-L910 HydrophobicContact CB-CD1 4.18Å; A837-L910 HydrophobicContact CB-CD2 3.93Å; A837-L910 HydrophobicContact CB-CG 4.21Å; V843-L910 HydrophobicContact CG1-CD2 4.35Å; V843-L910 HydrophobicContact CG2-CD2 4.31Å; F845-L910 HydrophobicContact CZ-CD2 4.07Å; Y885-L910 HydrophobicContact CD2-CD2 3.93Å; Y885-L910 HydrophobicContact CE2-CD2 3.34Å; I890-L910 WeakPolarHBondContact CA-O 3.42Å; Y891-L910 PolarHBondContact N-O 3.47Å; Y891-L910 PolarHBondContact O-N 3.34Å; V893-L910 HydrophobicContact CG2-CB 4.23Å; L908-L910 HydrophobicContact CD2-CB 3.92Å; L908-L910 HydrophobicContact CD2-CD1 4.35Å; L910-V912 HydrophobicContact CD2-CG2 3.88Å; L910-V912 HydrophobicContact CG-CG2 4.27Å; L910-V912 PolarHBondContact O-N 3.07Å
911	H	85.7	Confident	86.5	Confident	81 Å²	81	58.8 Å²	58.8	38%	0.375	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	102.4	175.6	-73.1	-129.9	0	0	0	109.8	F835 V836 A837 I890	F835-H911 PolarHBondContact O-N 3.03Å; V836-H911 WeakPolarHBondContact CA-O 3.32Å; V836-H911 HydrophobicContact CG2-CB 4.41Å; A837-H911 PolarHBondContact N-O 2.95Å; I890-H911 VanDerWaalsContact CD1-CE1 3.49Å; I890-H911 WeakPolarHBondContact CD1-CE1 3.4Å
912	V	87.3	Confident	86.7	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.018	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	113.1	176.5	179.7	0	0	0	0	109.5	A837 L839 Y885 K887 V888 G889 Y891 L910	A837-V912 HydrophobicContact CB-CG2 4.38Å; A837-V912 WeakPolarHBondContact O-CA 3.36Å; L839-V912 HydrophobicContact CD1-CG1 4.01Å; Y885-V912 HydrophobicContact CD1-CG2 4.09Å; Y885-V912 HydrophobicContact CD2-CG2 3.77Å; Y885-V912 HydrophobicContact CE2-CG2 4.36Å; Y885-V912 HydrophobicContact CG-CG2 3.61Å; K887-V912 WeakPolarHBondContact O-CG1 3.29Å; V888-V912 WeakPolarHBondContact CA-O 3.07Å; V888-V912 WeakPolarHBondContact CB-O 3.45Å; G889-V912 PolarHBondContact N-O 2.87Å; G889-V912 PolarHBondContact O-N 2.77Å; Y891-V912 HydrophobicContact CD2-CB 3.99Å; Y891-V912 HydrophobicContact CD2-CG2 3.53Å; Y891-V912 HydrophobicContact CE2-CB 3.89Å; Y891-V912 HydrophobicContact CE2-CG2 3.79Å; L910-V912 HydrophobicContact CD2-CG2 3.88Å; L910-V912 HydrophobicContact CG-CG2 4.27Å; L910-V912 PolarHBondContact O-N 3.07Å
913	N	84.8	Confident	86.6	Confident	27 Å²	27	56.8 Å²	56.8	14%	0.144	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	161.6	-179	62.6	27.2	0	0	0	112.9	V836 A837 L839 V944	V836-N913 WeakPolarHBondContact CG1-ND2 3.23Å; A837-N913 PolarHBondContact O-N 2.89Å; A837-N913 PolarHBondContact O-OD1 3.07Å; L839-N913 PolarHBondContact N-O 3.09Å; N913-V944 WeakPolarHBondContact CA-O 3.45Å; N913-V944 WeakPolarHBondContact CB-O 3.41Å
914	C	83.9	Confident	86.3	Confident	14 Å²	14	52.7 Å²	52.7	10%	0.095	26%	0.255	C	S	.	.			trans	-112.5	145.4	164.7	176.7	0	0	0	0	108	C41 V888 L916 V944	C41-C914 HydrophobicContact CB-CB 4.14Å; C41-C914 WeakPolarHBondContact CB-SG 3.29Å; C41-C914 WeakPolarHBondContact SG-CB 3.38Å; C41-C914 CovalentContact SG-SG 2.05Å; C41-C914 PolarHBondContact SG-SG 3.03Å; V888-C914 HydrophobicContact CG1-CB 3.7Å; C914-L916 PolarHBondContact O-N 3.37Å; C914-V944 PolarHBondContact N-O 2.81Å; C914-V944 WeakPolarHBondContact O-CG1 3.36Å
915	H	81.1	Confident	85.8	Confident	125 Å²	125	52.9 Å²	52.9	58%	0.579	26%	0.256	S	S	*	.			trans	-61.8	128.7	-179.7	-164.5	-69.1	0	0	0	109.9	P941	H915-P941 WeakPolarHBondContact O-CD 3.38Å
916	L	84.3	Confident	85.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.235	C	C	.	.			trans	-74.4	136.9	172.5	-176.5	61.8	0	0	0	109	C914 L939 V944 A983 A985 H990	C914-L916 PolarHBondContact O-N 3.37Å; L916-L939 HydrophobicContact CD1-CB 4.11Å; L916-L939 HydrophobicContact CD1-CD2 3.9Å; L916-L939 HydrophobicContact CD1-CG 4.47Å; L916-L939 HydrophobicContact CD2-CD2 4.38Å; L916-V944 HydrophobicContact CB-CG1 4.16Å; L916-V944 HydrophobicContact CD1-CG1 3.98Å; L916-V944 HydrophobicContact CD1-CG2 4.47Å; L916-A983 HydrophobicContact CD2-CB 4.1Å; L916-A985 HydrophobicContact CB-CB 4.03Å; L916-A985 HydrophobicContact CD2-CB 4.11Å; L916-H990 HydrophobicContact CD2-CB 3.97Å; L916-H990 HydrophobicContact CG-CB 4.43Å; L916-H990 PolarHBondContact O-NE2 2.98Å; L916-H990 VanDerWaalsContact O-NE2 3.12Å
917	E	84	Confident	85.2	Confident	122 Å²	122	45.9 Å²	45.9	57%	0.57	23%	0.226	S	C	*	.			trans	-106.4	-39	178.1	-61.8	175.9	165.7	0	0	110.8	R940 H990	E917-R940 WeakPolarHBondContact CA-O 3.27Å; E917-R940 WeakPolarHBondContact CB-O 3.32Å; E917-R940 PolarHBondContact N-O 3.29Å; E917-H990 PolarHBondContact O-CE1 2.89Å; E917-H990 PolarHBondContact O-ND1 2.87Å; E917-H990 VanDerWaalsContact O-ND1 3.08Å
918	Q	83.5	Confident	84.9	Confident	88 Å²	88	44.2 Å²	44.2	41%	0.411	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	141.3	-178.1	-177	174.6	42.3	0	0	111.6	R940	Q918-R940 HydrophobicContact CB-CB 4.24Å; Q918-R940 PolarHBondContact N-O 3Å; Q918-R940 PolarHBondContact O-N 2.85Å
919	V	88.1	Confident	84.7	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.024	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	145.8	158.3	63	0	0	0	0	108.7	T937 L939 V981 A983 H990 D992	V919-T937 HydrophobicContact CG2-CG2 4.08Å; V919-L939 HydrophobicContact CB-CD2 4.04Å; V919-L939 HydrophobicContact CG2-CD2 3.89Å; V919-V981 HydrophobicContact CG2-CG1 4.41Å; V919-A983 HydrophobicContact CB-CB 4.05Å; V919-A983 HydrophobicContact CG1-CB 4.35Å; V919-A983 HydrophobicContact CG2-CB 4.04Å; V919-H990 HydrophobicContact CG1-CB 3.96Å; V919-D992 HydrophobicContact CG1-CB 4.22Å
920	Q	87.1	Confident	84.6	Confident	65 Å²	65	45.7 Å²	45.7	30%	0.304	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	126.7	174.3	177.6	167.7	29.5	0	0	110.6	T937 T938 D992	Q920-T937 CarbonylContact O-C 3.6Å; Q920-T937 WeakPolarHBondContact O-CA 3.41Å; Q920-T938 PolarHBondContact N-O 2.94Å; Q920-T938 PolarHBondContact O-N 2.89Å; Q920-T938 PolarHBondContact O-OG1 2.83Å; Q920-D992 WeakPolarHBondContact CA-OD2 3.28Å
921	L	88	Confident	84.5	Confident	11 Å²	11	50.5 Å²	50.5	6%	0.058	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	131.5	-177.7	178	53.9	0	0	0	111.4	F935 T937 W951 V979 V981 D992 I994	L921-F935 HydrophobicContact CD1-CD1 4.44Å; L921-T937 HydrophobicContact CD1-CG2 4.43Å; L921-W951 HydrophobicContact CD1-CH2 4.17Å; L921-W951 HydrophobicContact CD1-CZ3 3.64Å; L921-V979 HydrophobicContact CD2-CG1 4.43Å; L921-V979 WeakPolarHBondContact CD2-O 3.21Å; L921-V981 HydrophobicContact CB-CG1 3.91Å; L921-V981 HydrophobicContact CD1-CG1 4.14Å; L921-V981 HydrophobicContact CD2-CB 4.39Å; L921-V981 HydrophobicContact CD2-CG1 3.99Å; L921-V981 HydrophobicContact CG-CG1 4.23Å; L921-D992 HydrophobicContact CB-CB 4.16Å; L921-D992 PolarHBondContact N-OD2 2.93Å; L921-I994 HydrophobicContact CD2-CB 4.1Å; L921-I994 HydrophobicContact CD2-CG2 3.61Å; L921-I994 HydrophobicContact CG-CB 4.34Å; L921-I994 HydrophobicContact CG-CG2 3.95Å
922	S	85.1	Confident	84.6	Confident	62 Å²	62	49.5 Å²	49.5	43%	0.434	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	123	178.8	-178.5	0	0	0	0	110.9	T936	S922-T936 PolarHBondContact N-O 2.75Å; S922-T936 PolarHBondContact O-N 3.03Å; S922-T936 PolarHBondContact O-OG1 2.93Å
923	A	84	Confident	84.7	Confident	7 Å²	7	50 Å²	50	6%	0.058	27%	0.265	C	S	.	.			trans	-150	161.7	177.3	0	0	0	0	0	112.2	F935 I994 K1049	A923-F935 HydrophobicContact CB-CD1 3.48Å; A923-F935 VanDerWaalsContact CB-CD1 3.48Å; A923-F935 HydrophobicContact CB-CE1 3.53Å; A923-F935 HydrophobicContact CB-CG 4.4Å; A923-F935 HydrophobicContact CB-CZ 4.48Å; A923-I994 HydrophobicContact CB-CD1 4.28Å; A923-I994 HydrophobicContact CB-CG2 4.15Å; A923-K1049 PolarHBondContact O-NZ 3.41Å
924	P	82.3	Confident	85	Confident	59 Å²	59	52.6 Å²	52.6	38%	0.383	28%	0.279	S	S	.	.			trans	-57.8	146.1	164.4	-23.3	35.9	0	0	0	111.8	V927 V933	P924-V927 HydrophobicContact CB-CG2 4.32Å; P924-V933 HydrophobicContact CG-CG1 3.95Å
925	L	78.1	Confident	85.3	Confident	47 Å²	47	52 Å²	52	25%	0.246	27%	0.274	C	S	.	.	S	Bend	trans	-80.2	-37.5	177.1	-179	65.6	0	0	0	112	A997 K1049	L925-A997 PolarHBondContact O-N 3.28Å; L925-K1049 HydrophobicContact CB-CD 3.73Å; L925-K1049 HydrophobicContact CD2-CB 4Å; L925-K1049 HydrophobicContact CD2-CD 4.32Å
926	V	82.1	Confident	85.7	Confident	7 Å²	7	48.7 Å²	48.7	4%	0.042	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	136.4	-178.2	-167.2	0	0	0	0	108.8	A997 Y999 F1002 L1047 F1061 V1063	V926-A997 CarbonylContact C-O 3.48Å; V926-A997 WeakPolarHBondContact CA-O 3.41Å; V926-Y999 HydrophobicContact CG1-CD2 3.95Å; V926-Y999 HydrophobicContact CG1-CE2 4.34Å; V926-F1002 HydrophobicContact CB-CE1 4.3Å; V926-F1002 HydrophobicContact CB-CZ 4.47Å; V926-F1002 HydrophobicContact CG1-CD1 3.56Å; V926-F1002 HydrophobicContact CG1-CE1 3.74Å; V926-F1002 HydrophobicContact CG1-CG 3.97Å; V926-F1002 HydrophobicContact CG1-CZ 4.31Å; V926-L1047 HydrophobicContact CG2-CB 4.48Å; V926-L1047 HydrophobicContact CG2-CD1 3.65Å; V926-F1061 HydrophobicContact CB-CD1 3.89Å; V926-F1061 HydrophobicContact CB-CE1 4.19Å; V926-F1061 HydrophobicContact CB-CG 4.23Å; V926-F1061 HydrophobicContact CG2-CB 4.02Å; V926-F1061 HydrophobicContact CG2-CD1 3.82Å; V926-F1061 HydrophobicContact CG2-CD2 3.9Å; V926-F1061 HydrophobicContact CG2-CE1 4.27Å; V926-F1061 HydrophobicContact CG2-CE2 4.34Å; V926-F1061 HydrophobicContact CG2-CG 3.64Å; V926-V1063 HydrophobicContact CG1-CG1 4.32Å
927	V	85.1	Confident	86	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.03	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	138.4	-170.9	163.6	0	0	0	0	110	P924 V933 F971 V996 A997 V998 Y999	P924-V927 HydrophobicContact CB-CG2 4.32Å; V927-V933 HydrophobicContact CB-CG2 4.19Å; V927-V933 HydrophobicContact CG1-CG2 3.48Å; V927-V933 VanDerWaalsContact CG1-CG2 3.48Å; V927-V933 HydrophobicContact CG2-CG1 4.19Å; V927-V933 HydrophobicContact CG2-CG2 3.63Å; V927-F971 HydrophobicContact CG1-CD2 4.04Å; V927-V996 HydrophobicContact CB-CG1 3.99Å; V927-V996 HydrophobicContact CG2-CG1 3.46Å; V927-V996 VanDerWaalsContact CG2-CG1 3.46Å; V927-A997 PolarHBondContact N-O 2.89Å; V927-V998 HydrophobicContact CB-CG2 4.22Å; V927-V998 HydrophobicContact CG1-CG1 4.45Å; V927-V998 HydrophobicContact CG1-CG2 4.23Å; V927-V998 WeakPolarHBondContact O-CA 3.44Å; V927-Y999 PolarHBondContact O-N 3.35Å
928	I	83.6	Confident	86.2	Confident	67 Å²	67	47.3 Å²	47.3	34%	0.344	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	125.7	168.6	-51.2	178.7	0	0	0	107.4	K931 Y999 F1002	I928-K931 HydrophobicContact CB-CB 4.22Å; I928-K931 HydrophobicContact CD1-CD 4.44Å; I928-K931 WeakPolarHBondContact O-CB 3.43Å; I928-K931 PolarHBondContact O-N 2.77Å; I928-Y999 WeakPolarHBondContact CA-O 3.2Å; I928-F1002 HydrophobicContact CD1-CE1 4.43Å; I928-F1002 HydrophobicContact CG1-CD1 4.15Å; I928-F1002 HydrophobicContact CG1-CE1 3.54Å; I928-F1002 HydrophobicContact CG1-CZ 4.24Å
929	K	85	Confident	86.4	Confident	61 Å²	61	44.2 Å²	44.2	27%	0.265	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	148.5	173.8	179.8	-156.7	168.6	-163.7	0	111.7	K931 F971 E974 V998 Y999 D1000	K929-K931 PolarHBondContact O-N 2.81Å; K929-F971 WeakPolarHBondContact CA-O 3.11Å; K929-F971 VanDerWaalsContact CG-O 3.24Å; K929-F971 WeakPolarHBondContact CG-O 3.45Å; K929-E974 HydrophobicContact CD-CG 4.44Å; K929-V998 HydrophobicContact CB-CG1 3.84Å; K929-V998 HydrophobicContact CG-CG1 4.49Å; K929-Y999 PolarHBondContact N-O 2.9Å; K929-D1000 WeakPolarHBondContact CD-OD1 3.31Å; K929-D1000 IonicContact NZ-OD1 3.84Å; K929-D1000 PolarHBondContact NZ-OD1 3.39Å; K929-D1000 IonicContact NZ-OD2 3.21Å
930	D	85.2	Confident	86.1	Confident	104 Å²	104	50.1 Å²	50.1	56%	0.556	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	1.8	-178.6	-56.7	-47.4	0	0	0	115.3	F971 S972	D930-F971 PolarHBondContact N-O 2.86Å; D930-S972 WeakPolarHBondContact OD1-CA 3.34Å
931	K	86.7	Confident	85.7	Confident	102 Å²	102	48.2 Å²	48.2	44%	0.443	27%	0.265	S	S	.	.	S	Bend	trans	-92.5	142.3	169.8	-168	176.2	178.9	-178.5	0	110.7	I928 K929	I928-K931 HydrophobicContact CB-CB 4.22Å; I928-K931 HydrophobicContact CD1-CD 4.44Å; I928-K931 WeakPolarHBondContact O-CB 3.43Å; I928-K931 PolarHBondContact O-N 2.77Å; K929-K931 PolarHBondContact O-N 2.81Å
932	A	87.3	Confident	85.2	Confident	60 Å²	60	52.8 Å²	52.8	50%	0.496	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	139.4	175.9	0	0	0	0	0	111.7	T970	A932-T970 HydrophobicContact CB-CG2 4.08Å
933	V	89	Confident	84.8	Confident	13 Å²	13	52.4 Å²	52.4	8%	0.079	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	129.9	-179.2	178	0	0	0	0	109.8	P924 V927 F935 T968 F969	P924-V933 HydrophobicContact CG-CG1 3.95Å; V927-V933 HydrophobicContact CB-CG2 4.19Å; V927-V933 HydrophobicContact CG1-CG2 3.48Å; V927-V933 VanDerWaalsContact CG1-CG2 3.48Å; V927-V933 HydrophobicContact CG2-CG1 4.19Å; V927-V933 HydrophobicContact CG2-CG2 3.63Å; V933-F935 HydrophobicContact CB-CE2 3.92Å; V933-F935 HydrophobicContact CG1-CD2 4.17Å; V933-F935 HydrophobicContact CG1-CE2 3.65Å; V933-F935 HydrophobicContact CG1-CZ 4Å; V933-T968 WeakPolarHBondContact O-CA 3.25Å; V933-F969 PolarHBondContact N-O 2.9Å; V933-F969 PolarHBondContact O-N 3.14Å
934	N	90.8	Very high	84.5	Confident	82 Å²	82	52.2 Å²	52.2	44%	0.439	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	118.4	176.5	-59.6	14	0	0	0	109.1	T968	N934-T968 WeakPolarHBondContact OD1-CG2 3.44Å
935	F	90.3	Very high	84.3	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	140.8	167.9	-67.1	-97.3	0	0	0	108.6	L921 A923 V933 W951 F953 A966 I967 F969 F971 V979 V996	L921-F935 HydrophobicContact CD1-CD1 4.44Å; A923-F935 HydrophobicContact CB-CD1 3.48Å; A923-F935 VanDerWaalsContact CB-CD1 3.48Å; A923-F935 HydrophobicContact CB-CE1 3.53Å; A923-F935 HydrophobicContact CB-CG 4.4Å; A923-F935 HydrophobicContact CB-CZ 4.48Å; V933-F935 HydrophobicContact CB-CE2 3.92Å; V933-F935 HydrophobicContact CG1-CD2 4.17Å; V933-F935 HydrophobicContact CG1-CE2 3.65Å; V933-F935 HydrophobicContact CG1-CZ 4Å; F935-W951 HydrophobicContact CB-CE3 4.42Å; F935-W951 HydrophobicContact CB-CH2 3.97Å; F935-W951 HydrophobicContact CB-CZ3 3.61Å; F935-W951 HydrophobicContact CG-CZ3 4.49Å; F935-F953 HydrophobicContact CD2-CE1 4.22Å; F935-F953 HydrophobicContact CE2-CE1 4.12Å; F935-A966 VanDerWaalsContact O-CA 3.24Å; F935-A966 WeakPolarHBondContact O-CA 3.26Å; F935-I967 HydrophobicContact CB-CG2 3.87Å; F935-I967 PolarHBondContact N-O 2.62Å; F935-I967 PolarHBondContact O-N 2.87Å; F935-F969 HydrophobicContact CD2-CB 4.37Å; F935-F969 HydrophobicContact CE2-CB 4.13Å; F935-F971 AromaticContact CE2-CE2 3.96Å; F935-F971 HydrophobicContact CE2-CE2 3.96Å; F935-F971 HydrophobicContact CE2-CZ 4.26Å; F935-F971 AromaticContact CZ-CE2 3.72Å; F935-F971 HydrophobicContact CZ-CE2 3.72Å; F935-F971 AromaticContact CZ-CZ 3.78Å; F935-F971 HydrophobicContact CZ-CZ 3.78Å; F935-V979 HydrophobicContact CD1-CB 4.37Å; F935-V979 HydrophobicContact CD1-CG1 3.93Å; F935-V979 HydrophobicContact CD1-CG2 4.49Å; F935-V979 HydrophobicContact CE1-CB 3.91Å; F935-V979 HydrophobicContact CE1-CG1 3.91Å; F935-V979 HydrophobicContact CE1-CG2 3.65Å; F935-V979 HydrophobicContact CZ-CG2 3.84Å; F935-V996 HydrophobicContact CE1-CG2 3.98Å; F935-V996 HydrophobicContact CZ-CG2 4.21Å
936	T	90.6	Very high	84.4	Confident	57 Å²	57	53 Å²	53	35%	0.35	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	143.5	-177.3	51.7	0	0	0	0	110.8	S922 G965 A966	S922-T936 PolarHBondContact N-O 2.75Å; S922-T936 PolarHBondContact O-N 3.03Å; S922-T936 PolarHBondContact O-OG1 2.93Å; T936-G965 CarbonylContact C-O 3.59Å; T936-G965 WeakPolarHBondContact CA-O 3.31Å; T936-A966 HydrophobicContact CG2-CB 4.05Å
937	T	90.3	Very high	84.6	Confident	18 Å²	18	53.1 Å²	53.1	11%	0.11	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	152.6	175.5	52.5	0	0	0	0	111.4	V919 Q920 L921 Y949 W951 G965 V981	V919-T937 HydrophobicContact CG2-CG2 4.08Å; Q920-T937 CarbonylContact O-C 3.6Å; Q920-T937 WeakPolarHBondContact O-CA 3.41Å; L921-T937 HydrophobicContact CD1-CG2 4.43Å; T937-Y949 HydrophobicContact CG2-CD1 4.15Å; T937-Y949 HydrophobicContact CG2-CE1 4.18Å; T937-Y949 WeakPolarHBondContact OG1-CE1 3.19Å; T937-W951 HydrophobicContact CG2-CH2 3.71Å; T937-W951 HydrophobicContact CG2-CZ2 4.11Å; T937-W951 HydrophobicContact CG2-CZ3 4.41Å; T937-G965 PolarHBondContact N-O 2.9Å; T937-G965 WeakPolarHBondContact OG1-CA 3.37Å; T937-G965 PolarHBondContact OG1-O 2.93Å; T937-V981 HydrophobicContact CG2-CB 4.27Å; T937-V981 HydrophobicContact CG2-CG1 3.71Å; T937-V981 HydrophobicContact CG2-CG2 3.8Å
938	T	88.4	Confident	84.8	Confident	74 Å²	74	54.7 Å²	54.7	45%	0.454	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	139.7	167.5	53.6	0	0	0	0	109	Q920	Q920-T938 PolarHBondContact N-O 2.94Å; Q920-T938 PolarHBondContact O-N 2.89Å; Q920-T938 PolarHBondContact O-OG1 2.83Å
939	L	86.7	Confident	85.2	Confident	24 Å²	24	52.4 Å²	52.4	13%	0.126	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	147.4	-177.3	-60.7	176.6	0	0	0	110.9	L916 V919 P941 S942 V944 V947 Y949 A983	L916-L939 HydrophobicContact CD1-CB 4.11Å; L916-L939 HydrophobicContact CD1-CD2 3.9Å; L916-L939 HydrophobicContact CD1-CG 4.47Å; L916-L939 HydrophobicContact CD2-CD2 4.38Å; V919-L939 HydrophobicContact CB-CD2 4.04Å; V919-L939 HydrophobicContact CG2-CD2 3.89Å; L939-P941 CarbonylContact C-O 3.57Å; L939-P941 CarbonylContact O-C 3.58Å; L939-S942 WeakPolarHBondContact O-CA 3.5Å; L939-S942 PolarHBondContact O-N 2.95Å; L939-V944 HydrophobicContact CD1-CG2 3.77Å; L939-V947 HydrophobicContact CD1-CB 4.4Å; L939-V947 HydrophobicContact CD1-CG1 4.4Å; L939-V947 HydrophobicContact CD1-CG2 3.79Å; L939-Y949 WeakPolarHBondContact CD1-OH 3.42Å; L939-Y949 HydrophobicContact CD2-CE1 4.24Å; L939-A983 HydrophobicContact CD2-CB 4.09Å
940	R	81.8	Confident	85.6	Confident	128 Å²	128	52.2 Å²	52.2	48%	0.483	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	119.5	171.3	-65.4	177.8	177.7	174.3	-4.2	109.1	E917 Q918	E917-R940 WeakPolarHBondContact CA-O 3.27Å; E917-R940 WeakPolarHBondContact CB-O 3.32Å; E917-R940 PolarHBondContact N-O 3.29Å; Q918-R940 HydrophobicContact CB-CB 4.24Å; Q918-R940 PolarHBondContact N-O 3Å; Q918-R940 PolarHBondContact O-N 2.85Å
941	P	79.6	Confident	85.9	Confident	25 Å²	25	47.3 Å²	47.3	16%	0.162	28%	0.276	C	S	.	.	S	Bend	cis	-60.8	160	-13.7	26.6	-32	0	0	0	112	C41 H915 L939 S943 V944	C41-P941 HydrophobicContact CB-CB 4.16Å; C41-P941 HydrophobicContact CB-CG 4.15Å; H915-P941 WeakPolarHBondContact O-CD 3.38Å; L939-P941 CarbonylContact C-O 3.57Å; L939-P941 CarbonylContact O-C 3.58Å; P941-S943 VanDerWaalsContact C-N 3.33Å; P941-S943 PolarHBondContact O-N 2.82Å; P941-V944 HydrophobicContact CG-CG1 3.84Å
942	S	77.7	Confident	86.1	Confident	107 Å²	107	45.7 Å²	45.7	75%	0.748	27%	0.267	S	S	*	.	S	Bend	trans	-75	-21.6	-177.6	52.8	0	0	0	0	113.8	L939	L939-S942 WeakPolarHBondContact O-CA 3.5Å; L939-S942 PolarHBondContact O-N 2.95Å
943	S	76.9	Confident	86.3	Confident	53 Å²	53	43 Å²	43	37%	0.371	24%	0.244	S	C	.	.			trans	-110.8	77.9	178.4	62.4	0	0	0	0	111.1	V888 P941	V888-S943 WeakPolarHBondContact CG2-O 3.5Å; P941-S943 VanDerWaalsContact C-N 3.33Å; P941-S943 PolarHBondContact O-N 2.82Å
944	V	77.6	Confident	86	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.018	26%	0.256	C	S	.	.			trans	-95.3	-22.8	176	-72.8	0	0	0	0	114.1	N913 C914 L916 L939 P941 V947 A985	N913-V944 WeakPolarHBondContact CA-O 3.45Å; N913-V944 WeakPolarHBondContact CB-O 3.41Å; C914-V944 PolarHBondContact N-O 2.81Å; C914-V944 WeakPolarHBondContact O-CG1 3.36Å; L916-V944 HydrophobicContact CB-CG1 4.16Å; L916-V944 HydrophobicContact CD1-CG1 3.98Å; L916-V944 HydrophobicContact CD1-CG2 4.47Å; L939-V944 HydrophobicContact CD1-CG2 3.77Å; P941-V944 HydrophobicContact CG-CG1 3.84Å; V944-V947 HydrophobicContact CG2-CG2 3.45Å; V944-V947 VanDerWaalsContact CG2-CG2 3.45Å; V944-A985 HydrophobicContact CB-CB 4.49Å; V944-A985 HydrophobicContact CG2-CB 4.31Å
945	G	77.9	Confident	85.4	Confident	35 Å²	35	49.5 Å²	49.5	36%	0.361	28%	0.279	S	S	.	.	S	Bend	trans	120.7	-152.2	-174.4	0	0	0	0	0	111.1
946	T	80.6	Confident	84.9	Confident	88 Å²	88	54.9 Å²	54.9	54%	0.54	30%	0.302	S	S	.	.	S	Bend	trans	-68.7	134.6	170.9	-49.1	0	0	0	0	110.3
947	V	85.8	Confident	84.3	Confident	10 Å²	10	58.2 Å²	58.2	6%	0.061	32%	0.323	C	S	.	.			trans	-131.2	137.4	-179.5	-179.6	0	0	0	0	109.5	L939 V944 Y949 A983 L984 A985	L939-V947 HydrophobicContact CD1-CB 4.4Å; L939-V947 HydrophobicContact CD1-CG1 4.4Å; L939-V947 HydrophobicContact CD1-CG2 3.79Å; V944-V947 HydrophobicContact CG2-CG2 3.45Å; V944-V947 VanDerWaalsContact CG2-CG2 3.45Å; V947-Y949 HydrophobicContact CB-CE2 4.03Å; V947-Y949 HydrophobicContact CG1-CD1 4.4Å; V947-Y949 HydrophobicContact CG1-CD2 4.3Å; V947-Y949 HydrophobicContact CG1-CE1 3.98Å; V947-Y949 HydrophobicContact CG1-CE2 3.86Å; V947-A983 HydrophobicContact CG1-CB 3.9Å; V947-L984 WeakPolarHBondContact CA-O 3.33Å; V947-A985 HydrophobicContact CG2-CB 4.03Å
948	T	89.8	Confident	84	Confident	37 Å²	37	64.7 Å²	64.7	23%	0.227	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.5	172.9	-55.5	0	0	0	0	109	F950 V961 L984	T948-F950 HydrophobicContact CG2-CD2 4.39Å; T948-F950 HydrophobicContact CG2-CE1 4.43Å; T948-F950 HydrophobicContact CG2-CE2 3.7Å; T948-F950 HydrophobicContact CG2-CZ 3.72Å; T948-V961 HydrophobicContact CG2-CG1 3.5Å; T948-V961 VanDerWaalsContact CG2-CG1 3.5Å; T948-L984 PolarHBondContact N-O 2.89Å; T948-L984 PolarHBondContact O-N 3.33Å
949	Y	91.8	Very high	84.2	Confident	20 Å²	20	63.2 Å²	63.2	8%	0.078	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	126.5	-179.1	-58.2	-93.1	0	0	0	110.5	T937 L939 V947 V961 T962 L963 V981 Q982 A983	T937-Y949 HydrophobicContact CG2-CD1 4.15Å; T937-Y949 HydrophobicContact CG2-CE1 4.18Å; T937-Y949 WeakPolarHBondContact OG1-CE1 3.19Å; L939-Y949 WeakPolarHBondContact CD1-OH 3.42Å; L939-Y949 HydrophobicContact CD2-CE1 4.24Å; V947-Y949 HydrophobicContact CB-CE2 4.03Å; V947-Y949 HydrophobicContact CG1-CD1 4.4Å; V947-Y949 HydrophobicContact CG1-CD2 4.3Å; V947-Y949 HydrophobicContact CG1-CE1 3.98Å; V947-Y949 HydrophobicContact CG1-CE2 3.86Å; Y949-V961 WeakPolarHBondContact O-CA 3.23Å; Y949-T962 PolarHBondContact N-O 2.91Å; Y949-T962 PolarHBondContact O-N 2.85Å; Y949-L963 WeakPolarHBondContact CE2-O 3.46Å; Y949-V981 HydrophobicContact CD1-CG2 4.26Å; Y949-Q982 CarbonylContact C-O 3.55Å; Y949-Q982 WeakPolarHBondContact CA-O 3.31Å; Y949-A983 HydrophobicContact CD1-CB 4.12Å; Y949-A983 HydrophobicContact CE1-CB 4.15Å
950	F	92.7	Very high	84.4	Confident	57 Å²	57	65.3 Å²	65.3	25%	0.25	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	114.3	176.1	-58.5	-95.8	0	0	0	109	T948 P959 V961 V981 Q982 L984	T948-F950 HydrophobicContact CG2-CD2 4.39Å; T948-F950 HydrophobicContact CG2-CE1 4.43Å; T948-F950 HydrophobicContact CG2-CE2 3.7Å; T948-F950 HydrophobicContact CG2-CZ 3.72Å; F950-P959 HydrophobicContact CB-CB 4.03Å; F950-P959 HydrophobicContact CB-CG 4.35Å; F950-P959 HydrophobicContact CD1-CB 4.47Å; F950-P959 HydrophobicContact CD1-CG 3.96Å; F950-V961 HydrophobicContact CD1-CG2 3.73Å; F950-V961 HydrophobicContact CE1-CG1 4.39Å; F950-V961 HydrophobicContact CE1-CG2 3.88Å; F950-V981 WeakPolarHBondContact O-CA 3.05Å; F950-Q982 HydrophobicContact CB-CB 4.29Å; F950-Q982 PolarHBondContact N-O 2.77Å; F950-Q982 PolarHBondContact O-N 3.22Å; F950-L984 HydrophobicContact CE2-CB 3.89Å; F950-L984 HydrophobicContact CE2-CD2 4.13Å; F950-L984 HydrophobicContact CZ-CD2 4.41Å
951	W	92.1	Very high	84.8	Confident	1 Å²	1	63.1 Å²	63.1	0%	0.004	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	114.9	-174.6	-60	90.5	0	0	0	111.2	L921 F935 T937 F953 P959 V960 T962 I967 V981	L921-W951 HydrophobicContact CD1-CH2 4.17Å; L921-W951 HydrophobicContact CD1-CZ3 3.64Å; F935-W951 HydrophobicContact CB-CE3 4.42Å; F935-W951 HydrophobicContact CB-CH2 3.97Å; F935-W951 HydrophobicContact CB-CZ3 3.61Å; F935-W951 HydrophobicContact CG-CZ3 4.49Å; T937-W951 HydrophobicContact CG2-CH2 3.71Å; T937-W951 HydrophobicContact CG2-CZ2 4.11Å; T937-W951 HydrophobicContact CG2-CZ3 4.41Å; W951-F953 HydrophobicContact CB-CD2 4.45Å; W951-F953 HydrophobicContact CB-CE2 3.69Å; W951-F953 HydrophobicContact CB-CZ 4.11Å; W951-P959 WeakPolarHBondContact O-CA 3.37Å; W951-V960 HydrophobicContact CB-CB 4.38Å; W951-V960 WeakPolarHBondContact CB-O 3.21Å; W951-V960 PolarHBondContact N-O 2.96Å; W951-V960 PolarHBondContact O-N 3.03Å; W951-T962 PolarHBondContact NE1-OG1 2.84Å; W951-I967 HydrophobicContact CB-CD1 4.34Å; W951-I967 HydrophobicContact CD2-CB 4.32Å; W951-I967 HydrophobicContact CD2-CG2 3.47Å; W951-I967 VanDerWaalsContact CD2-CG2 3.47Å; W951-I967 HydrophobicContact CE3-CG2 3.61Å; W951-I967 HydrophobicContact CG-CD1 4.11Å; W951-I967 HydrophobicContact CG-CG2 4.01Å; W951-I967 HydrophobicContact CH2-CG2 3.87Å; W951-I967 HydrophobicContact CZ2-CB 4.29Å; W951-I967 HydrophobicContact CZ2-CG2 3.76Å; W951-I967 HydrophobicContact CZ3-CG2 3.81Å; W951-V981 HydrophobicContact CD2-CB 4.33Å; W951-V981 HydrophobicContact CD2-CG2 3.73Å; W951-V981 HydrophobicContact CE3-CB 3.84Å; W951-V981 HydrophobicContact CE3-CG2 3.71Å; W951-V981 HydrophobicContact CG-CG2 4.42Å; W951-V981 HydrophobicContact CH2-CG2 4.06Å; W951-V981 HydrophobicContact CZ2-CG2 4.04Å; W951-V981 HydrophobicContact CZ3-CB 3.96Å; W951-V981 HydrophobicContact CZ3-CG2 3.87Å
952	W	91.5	Very high	85.4	Confident	68 Å²	68	63.2 Å²	63.2	26%	0.258	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	117.4	178.4	-58.6	88.3	0	0	0	109.5	K956 P959 V979 T980	W952-K956 WeakPolarHBondContact CZ3-O 3.37Å; W952-P959 HydrophobicContact CD2-CB 3.88Å; W952-P959 HydrophobicContact CE3-CB 4.26Å; W952-P959 HydrophobicContact CG-CB 4.33Å; W952-P959 HydrophobicContact CH2-CB 4.34Å; W952-P959 HydrophobicContact CH2-CG 4.05Å; W952-P959 HydrophobicContact CZ2-CB 3.94Å; W952-P959 HydrophobicContact CZ2-CG 3.79Å; W952-P959 HydrophobicContact CZ3-CB 4.48Å; W952-V979 WeakPolarHBondContact O-CA 3.48Å; W952-T980 PolarHBondContact N-O 2.88Å; W952-T980 PolarHBondContact O-N 2.83Å
953	F	89.9	Confident	85.9	Confident	3 Å²	3	64.2 Å²	64.2	1%	0.013	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	104.5	176.6	-61.1	-84.5	0	0	0	109.2	F935 W951 K956 V960 I967 F969 F971 V979	F935-F953 HydrophobicContact CD2-CE1 4.22Å; F935-F953 HydrophobicContact CE2-CE1 4.12Å; W951-F953 HydrophobicContact CB-CD2 4.45Å; W951-F953 HydrophobicContact CB-CE2 3.69Å; W951-F953 HydrophobicContact CB-CZ 4.11Å; F953-K956 WeakPolarHBondContact O-CD 3.23Å; F953-K956 WeakPolarHBondContact O-CG 3.44Å; F953-V960 HydrophobicContact CD2-CG2 4.37Å; F953-V960 HydrophobicContact CE2-CG2 4.23Å; F953-I967 HydrophobicContact CE2-CD1 4.13Å; F953-I967 HydrophobicContact CZ-CD1 4.22Å; F953-I967 HydrophobicContact CZ-CG2 4.03Å; F953-F969 HydrophobicContact CB-CE1 4.03Å; F953-F969 HydrophobicContact CB-CE2 4.19Å; F953-F969 HydrophobicContact CB-CZ 3.8Å; F953-F969 HydrophobicContact CD1-CB 4.21Å; F953-F969 AromaticContact CD1-CD1 3.49Å; F953-F969 HydrophobicContact CD1-CD1 3.49Å; F953-F969 VanDerWaalsContact CD1-CD1 3.49Å; F953-F969 AromaticContact CD1-CD2 3.98Å; F953-F969 HydrophobicContact CD1-CD2 3.98Å; F953-F969 AromaticContact CD1-CE1 3.77Å; F953-F969 HydrophobicContact CD1-CE1 3.77Å; F953-F969 HydrophobicContact CD1-CE2 4.23Å; F953-F969 AromaticContact CD1-CG 3.61Å; F953-F969 HydrophobicContact CD1-CG 3.61Å; F953-F969 HydrophobicContact CD1-CZ 4.13Å; F953-F969 AromaticContact CD2-CD2 3.88Å; F953-F969 HydrophobicContact CD2-CD2 3.88Å; F953-F969 AromaticContact CD2-CE2 3.89Å; F953-F969 HydrophobicContact CD2-CE2 3.89Å; F953-F969 HydrophobicContact CD2-CG 4.35Å; F953-F969 HydrophobicContact CD2-CZ 4.35Å; F953-F969 HydrophobicContact CE1-CB 3.55Å; F953-F969 AromaticContact CE1-CD1 3.75Å; F953-F969 HydrophobicContact CE1-CD1 3.75Å; F953-F969 AromaticContact CE1-CD2 3.96Å; F953-F969 HydrophobicContact CE1-CD2 3.96Å; F953-F969 HydrophobicContact CE1-CE1 4.45Å; F953-F969 AromaticContact CE1-CG 3.46Å; F953-F969 HydrophobicContact CE1-CG 3.46Å; F953-F969 VanDerWaalsContact CE1-CG 3.46Å; F953-F969 AromaticContact CE2-CD2 3.84Å; F953-F969 HydrophobicContact CE2-CD2 3.84Å; F953-F969 HydrophobicContact CE2-CE2 4.31Å; F953-F969 HydrophobicContact CE2-CG 4.21Å; F953-F969 HydrophobicContact CG-CD1 4.06Å; F953-F969 AromaticContact CG-CD2 3.95Å; F953-F969 HydrophobicContact CG-CD2 3.95Å; F953-F969 AromaticContact CG-CE1 3.95Å; F953-F969 HydrophobicContact CG-CE1 3.95Å; F953-F969 AromaticContact CG-CE2 3.84Å; F953-F969 HydrophobicContact CG-CE2 3.84Å; F953-F969 HydrophobicContact CG-CG 4.06Å; F953-F969 AromaticContact CG-CZ 3.84Å; F953-F969 HydrophobicContact CG-CZ 3.84Å; F953-F969 HydrophobicContact CZ-CB 3.73Å; F953-F969 HydrophobicContact CZ-CD1 4.49Å; F953-F969 AromaticContact CZ-CD2 3.88Å; F953-F969 HydrophobicContact CZ-CD2 3.88Å; F953-F969 AromaticContact CZ-CG 3.78Å; F953-F969 HydrophobicContact CZ-CG 3.78Å; F953-F971 HydrophobicContact CD1-CZ 4.37Å; F953-V979 HydrophobicContact CD1-CB 4.49Å; F953-V979 HydrophobicContact CD1-CG1 3.93Å; F953-V979 HydrophobicContact CD1-CG2 3.8Å; F953-V979 HydrophobicContact CE1-CG1 3.75Å; F953-V979 HydrophobicContact CE1-CG2 4.17Å; F953-V979 HydrophobicContact CZ-CG1 4.49Å
954	D	83.9	Confident	86.3	Confident	60 Å²	60	67.7 Å²	67.7	32%	0.321	37%	0.368	S	S	.	.	S	Bend	trans	55.4	-167.6	-165.3	-54.2	-47.2	0	0	0	113.6	K956 H977 I978	D954-K956 PolarHBondContact O-N 2.91Å; D954-H977 VanDerWaalsContact CG-ND1 3.29Å; D954-H977 VanDerWaalsContact OD1-CA 3.27Å; D954-H977 WeakPolarHBondContact OD1-CA 3.04Å; D954-H977 WeakPolarHBondContact OD1-CB 3.48Å; D954-H977 IonicContact OD1-CG 3.47Å; D954-H977 IonicContact OD1-ND1 2.84Å; D954-H977 PolarHBondContact OD1-ND1 2.81Å; D954-H977 VanDerWaalsContact OD1-ND1 3.13Å; D954-H977 IonicContact OD2-CE1 2.69Å; D954-H977 PolarHBondContact OD2-CE1 2.66Å; D954-H977 IonicContact OD2-CG 2.72Å; D954-H977 IonicContact OD2-ND1 3.83Å; D954-H977 PolarHBondContact OD2-ND1 3.2Å; D954-I978 PolarHBondContact N-O 2.86Å; D954-I978 PolarHBondContact OD1-N 3Å; D954-I978 VanDerWaalsContact OD1-N 3.13Å
955	N	78	Confident	86.7	Confident	171 Å²	171	68.5 Å²	68.5	91%	0.914	38%	0.377	S	S	*	.	S	Bend	trans	-76.7	52.9	-178.8	-164.9	59	0	0	0	112.7
956	K	79.4	Confident	87.2	Confident	114 Å²	114	69.3 Å²	69.3	50%	0.496	38%	0.38	S	S	.	.			trans	-80.6	152.8	168	-71.7	-179	179.7	-178	0	110.3	W952 F953 D954	W952-K956 WeakPolarHBondContact CZ3-O 3.37Å; F953-K956 WeakPolarHBondContact O-CD 3.23Å; F953-K956 WeakPolarHBondContact O-CG 3.44Å; D954-K956 PolarHBondContact O-N 2.91Å
957	T	78.9	Confident	87.8	Confident	127 Å²	127	66.2 Å²	66.2	78%	0.779	36%	0.36	S	S	*	.	S	Bend	trans	-83.4	-13.1	178.1	46.2	0	0	0	0	114.1
958	E	83.8	Confident	88.1	Confident	154 Å²	154	70.3 Å²	70.3	72%	0.72	39%	0.385	S	S	*	.	S	Bend	trans	-126.3	127.9	-175.7	-68.8	169.3	-167.2	0	0	110.1
959	P	91.4	Very high	88.1	Confident	42 Å²	42	70.7 Å²	70.7	27%	0.273	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-83.8	153.6	173.7	32.7	-31.2	0	0	0	111.5	F950 W951 W952	F950-P959 HydrophobicContact CB-CB 4.03Å; F950-P959 HydrophobicContact CB-CG 4.35Å; F950-P959 HydrophobicContact CD1-CB 4.47Å; F950-P959 HydrophobicContact CD1-CG 3.96Å; W951-P959 WeakPolarHBondContact O-CA 3.37Å; W952-P959 HydrophobicContact CD2-CB 3.88Å; W952-P959 HydrophobicContact CE3-CB 4.26Å; W952-P959 HydrophobicContact CG-CB 4.33Å; W952-P959 HydrophobicContact CH2-CB 4.34Å; W952-P959 HydrophobicContact CH2-CG 4.05Å; W952-P959 HydrophobicContact CZ2-CB 3.94Å; W952-P959 HydrophobicContact CZ2-CG 3.79Å; W952-P959 HydrophobicContact CZ3-CB 4.48Å
960	V	90.8	Very high	88	Confident	69 Å²	69	73.2 Å²	73.2	42%	0.418	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	130.4	163.2	-172.1	0	0	0	0	108.4	W951 F953 I967	W951-V960 HydrophobicContact CB-CB 4.38Å; W951-V960 WeakPolarHBondContact CB-O 3.21Å; W951-V960 PolarHBondContact N-O 2.96Å; W951-V960 PolarHBondContact O-N 3.03Å; F953-V960 HydrophobicContact CD2-CG2 4.37Å; F953-V960 HydrophobicContact CE2-CG2 4.23Å; V960-I967 HydrophobicContact CB-CD1 4.02Å; V960-I967 HydrophobicContact CG1-CD1 3.7Å
961	V	91.4	Very high	87.9	Confident	82 Å²	82	70.7 Å²	70.7	50%	0.497	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	130.5	-177.1	-174.4	0	0	0	0	110.4	T948 Y949 F950	T948-V961 HydrophobicContact CG2-CG1 3.5Å; T948-V961 VanDerWaalsContact CG2-CG1 3.5Å; Y949-V961 WeakPolarHBondContact O-CA 3.23Å; F950-V961 HydrophobicContact CD1-CG2 3.73Å; F950-V961 HydrophobicContact CE1-CG1 4.39Å; F950-V961 HydrophobicContact CE1-CG2 3.88Å
962	T	91.6	Very high	87.6	Confident	27 Å²	27	74.8 Å²	74.8	17%	0.166	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	154.5	173.2	68	0	0	0	0	111.8	Y949 W951 D964 I967	Y949-T962 PolarHBondContact N-O 2.91Å; Y949-T962 PolarHBondContact O-N 2.85Å; W951-T962 PolarHBondContact NE1-OG1 2.84Å; T962-D964 WeakPolarHBondContact CB-O 3.4Å; T962-D964 PolarHBondContact OG1-O 3.48Å; T962-I967 HydrophobicContact CG2-CB 4.47Å; T962-I967 HydrophobicContact CG2-CD1 4.02Å; T962-I967 HydrophobicContact CG2-CG1 4.39Å
963	L	87.6	Confident	87.3	Confident	127 Å²	127	80.2 Å²	80.2	67%	0.665	44%	0.44	S	S	*	.	S	Bend	trans	-93	-32.3	168.6	-62.8	176.6	0	0	0	111.4	Y949	Y949-L963 WeakPolarHBondContact CE2-O 3.46Å
964	D	85.9	Confident	87	Confident	127 Å²	127	84.8 Å²	84.8	68%	0.679	46%	0.461	S	S	*	.	S	Bend	trans	-75.4	139.2	169.6	-68.2	-59.2	0	0	0	110.7	T962 A966	T962-D964 WeakPolarHBondContact CB-O 3.4Å; T962-D964 PolarHBondContact OG1-O 3.48Å; D964-A966 PolarHBondContact O-N 2.88Å
965	G	85.6	Confident	87.1	Confident	20 Å²	20	83.4 Å²	83.4	21%	0.206	46%	0.461	C	S	.	.	S	Bend	trans	-72.7	22.3	176.2	0	0	0	0	0	114.5	T936 T937	T936-G965 CarbonylContact C-O 3.59Å; T936-G965 WeakPolarHBondContact CA-O 3.31Å; T937-G965 PolarHBondContact N-O 2.9Å; T937-G965 WeakPolarHBondContact OG1-CA 3.37Å; T937-G965 PolarHBondContact OG1-O 2.93Å
966	A	90	Very high	87.4	Confident	51 Å²	51	78 Å²	78	42%	0.421	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	143	-179.9	0	0	0	0	0	111.2	F935 T936 D964	F935-A966 VanDerWaalsContact O-CA 3.24Å; F935-A966 WeakPolarHBondContact O-CA 3.26Å; T936-A966 HydrophobicContact CG2-CB 4.05Å; D964-A966 PolarHBondContact O-N 2.88Å
967	I	92.4	Very high	87.9	Confident	24 Å²	24	73.2 Å²	73.2	12%	0.123	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	150.2	178.6	-169.8	168.7	0	0	0	110.4	F935 W951 F953 V960 T962	F935-I967 HydrophobicContact CB-CG2 3.87Å; F935-I967 PolarHBondContact N-O 2.62Å; F935-I967 PolarHBondContact O-N 2.87Å; W951-I967 HydrophobicContact CB-CD1 4.34Å; W951-I967 HydrophobicContact CD2-CB 4.32Å; W951-I967 HydrophobicContact CD2-CG2 3.47Å; W951-I967 VanDerWaalsContact CD2-CG2 3.47Å; W951-I967 HydrophobicContact CE3-CG2 3.61Å; W951-I967 HydrophobicContact CG-CD1 4.11Å; W951-I967 HydrophobicContact CG-CG2 4.01Å; W951-I967 HydrophobicContact CH2-CG2 3.87Å; W951-I967 HydrophobicContact CZ2-CB 4.29Å; W951-I967 HydrophobicContact CZ2-CG2 3.76Å; W951-I967 HydrophobicContact CZ3-CG2 3.81Å; F953-I967 HydrophobicContact CE2-CD1 4.13Å; F953-I967 HydrophobicContact CZ-CD1 4.22Å; F953-I967 HydrophobicContact CZ-CG2 4.03Å; V960-I967 HydrophobicContact CB-CD1 4.02Å; V960-I967 HydrophobicContact CG1-CD1 3.7Å; T962-I967 HydrophobicContact CG2-CB 4.47Å; T962-I967 HydrophobicContact CG2-CD1 4.02Å; T962-I967 HydrophobicContact CG2-CG1 4.39Å
968	T	91.3	Very high	88.4	Confident	95 Å²	95	69.9 Å²	69.9	58%	0.583	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.6	171.8	60.5	0	0	0	0	110.4	V933 N934	V933-T968 WeakPolarHBondContact O-CA 3.25Å; N934-T968 WeakPolarHBondContact OD1-CG2 3.44Å
969	F	89.8	Confident	88.7	Confident	46 Å²	46	62.5 Å²	62.5	20%	0.202	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	152.2	-178.6	-169.9	-100.1	0	0	0	112	V933 F935 F953 F971	V933-F969 PolarHBondContact N-O 2.9Å; V933-F969 PolarHBondContact O-N 3.14Å; F935-F969 HydrophobicContact CD2-CB 4.37Å; F935-F969 HydrophobicContact CE2-CB 4.13Å; F953-F969 HydrophobicContact CB-CE1 4.03Å; F953-F969 HydrophobicContact CB-CE2 4.19Å; F953-F969 HydrophobicContact CB-CZ 3.8Å; F953-F969 HydrophobicContact CD1-CB 4.21Å; F953-F969 AromaticContact CD1-CD1 3.49Å; F953-F969 HydrophobicContact CD1-CD1 3.49Å; F953-F969 VanDerWaalsContact CD1-CD1 3.49Å; F953-F969 AromaticContact CD1-CD2 3.98Å; F953-F969 HydrophobicContact CD1-CD2 3.98Å; F953-F969 AromaticContact CD1-CE1 3.77Å; F953-F969 HydrophobicContact CD1-CE1 3.77Å; F953-F969 HydrophobicContact CD1-CE2 4.23Å; F953-F969 AromaticContact CD1-CG 3.61Å; F953-F969 HydrophobicContact CD1-CG 3.61Å; F953-F969 HydrophobicContact CD1-CZ 4.13Å; F953-F969 AromaticContact CD2-CD2 3.88Å; F953-F969 HydrophobicContact CD2-CD2 3.88Å; F953-F969 AromaticContact CD2-CE2 3.89Å; F953-F969 HydrophobicContact CD2-CE2 3.89Å; F953-F969 HydrophobicContact CD2-CG 4.35Å; F953-F969 HydrophobicContact CD2-CZ 4.35Å; F953-F969 HydrophobicContact CE1-CB 3.55Å; F953-F969 AromaticContact CE1-CD1 3.75Å; F953-F969 HydrophobicContact CE1-CD1 3.75Å; F953-F969 AromaticContact CE1-CD2 3.96Å; F953-F969 HydrophobicContact CE1-CD2 3.96Å; F953-F969 HydrophobicContact CE1-CE1 4.45Å; F953-F969 AromaticContact CE1-CG 3.46Å; F953-F969 HydrophobicContact CE1-CG 3.46Å; F953-F969 VanDerWaalsContact CE1-CG 3.46Å; F953-F969 AromaticContact CE2-CD2 3.84Å; F953-F969 HydrophobicContact CE2-CD2 3.84Å; F953-F969 HydrophobicContact CE2-CE2 4.31Å; F953-F969 HydrophobicContact CE2-CG 4.21Å; F953-F969 HydrophobicContact CG-CD1 4.06Å; F953-F969 AromaticContact CG-CD2 3.95Å; F953-F969 HydrophobicContact CG-CD2 3.95Å; F953-F969 AromaticContact CG-CE1 3.95Å; F953-F969 HydrophobicContact CG-CE1 3.95Å; F953-F969 AromaticContact CG-CE2 3.84Å; F953-F969 HydrophobicContact CG-CE2 3.84Å; F953-F969 HydrophobicContact CG-CG 4.06Å; F953-F969 AromaticContact CG-CZ 3.84Å; F953-F969 HydrophobicContact CG-CZ 3.84Å; F953-F969 HydrophobicContact CZ-CB 3.73Å; F953-F969 HydrophobicContact CZ-CD1 4.49Å; F953-F969 AromaticContact CZ-CD2 3.88Å; F953-F969 HydrophobicContact CZ-CD2 3.88Å; F953-F969 AromaticContact CZ-CG 3.78Å; F953-F969 HydrophobicContact CZ-CG 3.78Å; F969-F971 HydrophobicContact CD1-CD1 4.22Å; F969-F971 HydrophobicContact CD1-CD2 4.07Å; F969-F971 AromaticContact CD1-CE1 3.94Å; F969-F971 HydrophobicContact CD1-CE1 3.94Å; F969-F971 AromaticContact CD1-CE2 3.8Å; F969-F971 HydrophobicContact CD1-CE2 3.8Å; F969-F971 HydrophobicContact CD1-CG 4.27Å; F969-F971 AromaticContact CD1-CZ 3.73Å; F969-F971 HydrophobicContact CD1-CZ 3.73Å; F969-F971 AromaticContact CE1-CD1 3.87Å; F969-F971 HydrophobicContact CE1-CD1 3.87Å; F969-F971 HydrophobicContact CE1-CD2 4.46Å; F969-F971 AromaticContact CE1-CE1 3.78Å; F969-F971 HydrophobicContact CE1-CE1 3.78Å; F969-F971 HydrophobicContact CE1-CE2 4.41Å; F969-F971 HydrophobicContact CE1-CG 4.21Å; F969-F971 HydrophobicContact CE1-CZ 4.07Å
970	T	91.1	Very high	88.7	Confident	73 Å²	73	61.8 Å²	61.8	45%	0.448	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	130.3	-179.8	45.2	0	0	0	0	110.7	A932	A932-T970 HydrophobicContact CB-CG2 4.08Å
971	F	89.3	Confident	88.8	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.018	33%	0.333	C	S	.	.			trans	-101.2	118.5	177.5	-63.6	-91.5	0	0	0	110.5	V927 K929 D930 F935 F953 F969 H977 V979 V998	V927-F971 HydrophobicContact CG1-CD2 4.04Å; K929-F971 WeakPolarHBondContact CA-O 3.11Å; K929-F971 VanDerWaalsContact CG-O 3.24Å; K929-F971 WeakPolarHBondContact CG-O 3.45Å; D930-F971 PolarHBondContact N-O 2.86Å; F935-F971 AromaticContact CE2-CE2 3.96Å; F935-F971 HydrophobicContact CE2-CE2 3.96Å; F935-F971 HydrophobicContact CE2-CZ 4.26Å; F935-F971 AromaticContact CZ-CE2 3.72Å; F935-F971 HydrophobicContact CZ-CE2 3.72Å; F935-F971 AromaticContact CZ-CZ 3.78Å; F935-F971 HydrophobicContact CZ-CZ 3.78Å; F953-F971 HydrophobicContact CD1-CZ 4.37Å; F969-F971 HydrophobicContact CD1-CD1 4.22Å; F969-F971 HydrophobicContact CD1-CD2 4.07Å; F969-F971 AromaticContact CD1-CE1 3.94Å; F969-F971 HydrophobicContact CD1-CE1 3.94Å; F969-F971 AromaticContact CD1-CE2 3.8Å; F969-F971 HydrophobicContact CD1-CE2 3.8Å; F969-F971 HydrophobicContact CD1-CG 4.27Å; F969-F971 AromaticContact CD1-CZ 3.73Å; F969-F971 HydrophobicContact CD1-CZ 3.73Å; F969-F971 AromaticContact CE1-CD1 3.87Å; F969-F971 HydrophobicContact CE1-CD1 3.87Å; F969-F971 HydrophobicContact CE1-CD2 4.46Å; F969-F971 AromaticContact CE1-CE1 3.78Å; F969-F971 HydrophobicContact CE1-CE1 3.78Å; F969-F971 HydrophobicContact CE1-CE2 4.41Å; F969-F971 HydrophobicContact CE1-CG 4.21Å; F969-F971 HydrophobicContact CE1-CZ 4.07Å; F971-H977 HydrophobicContact CD1-CB 3.96Å; F971-H977 AromaticContact CD1-CG 3.62Å; F971-H977 AromaticContact CD1-ND1 3.8Å; F971-H977 HydrophobicContact CE1-CB 3.62Å; F971-H977 AromaticContact CE1-CG 3.81Å; F971-H977 HydrophobicContact CZ-CB 4.49Å; F971-V979 HydrophobicContact CE1-CG2 4.37Å; F971-V979 HydrophobicContact CZ-CG2 3.85Å; F971-V998 HydrophobicContact CB-CB 4.34Å; F971-V998 HydrophobicContact CB-CG1 3.79Å; F971-V998 HydrophobicContact CB-CG2 3.69Å; F971-V998 HydrophobicContact CD1-CG2 4.04Å; F971-V998 HydrophobicContact CD2-CG2 4.04Å; F971-V998 HydrophobicContact CG-CG2 3.66Å
972	S	86	Confident	88.8	Confident	87 Å²	87	56.8 Å²	56.8	61%	0.608	32%	0.32	S	S	*	.			trans	-94.4	2.6	-178.6	57.1	0	0	0	0	114.6	D930	D930-S972 WeakPolarHBondContact OD1-CA 3.34Å
973	R	85.8	Confident	88.8	Confident	181 Å²	181	55.5 Å²	55.5	68%	0.683	31%	0.312	S	S	*	.	S	Bend	trans	-125.8	142.1	179.3	-65.7	178.9	63.5	-175.5	-1.6	109.5	H977 V998	R973-H977 PolarHBondContact O-NE2 3.48Å; R973-V998 WeakPolarHBondContact O-CG1 3.33Å
974	E	84.3	Confident	88.8	Confident	100 Å²	100	52.1 Å²	52.1	47%	0.467	29%	0.294	S	S	.	.			trans	-77.1	146.3	165.7	-62.6	-168.6	110.8	0	0	110.6	K929 V998 Y999 D1000	K929-E974 HydrophobicContact CD-CG 4.44Å; E974-V998 WeakPolarHBondContact CA-O 3.47Å; E974-Y999 WeakPolarHBondContact OE1-CA 3.16Å; E974-D1000 PolarHBondContact OE1-N 3.37Å
975	G	84.1	Confident	88.7	Confident	31 Å²	31	46.3 Å²	46.3	32%	0.32	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	147.8	-164.8	177.2	0	0	0	0	0	114	V998	G975-V998 PolarHBondContact N-O 3.45Å; G975-V998 PolarHBondContact O-N 2.62Å
976	S	85.8	Confident	88.1	Confident	57 Å²	57	47.1 Å²	47.1	40%	0.399	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	114.8	168.7	-179.2	0	0	0	0	108.9	R995 V996	S976-R995 VanDerWaalsContact OG-CD 3.24Å; S976-R995 WeakPolarHBondContact OG-CD 3.35Å; S976-R995 WeakPolarHBondContact OG-CG 3.42Å; S976-R995 PolarHBondContact OG-NH1 2.76Å; S976-V996 WeakPolarHBondContact CA-O 3.23Å
977	H	88.3	Confident	87.1	Confident	13 Å²	13	52.2 Å²	52.2	6%	0.06	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	153.1	178.5	-68.2	-89.3	0	0	0	109.9	D954 F971 R973 R995 V996	D954-H977 VanDerWaalsContact CG-ND1 3.29Å; D954-H977 VanDerWaalsContact OD1-CA 3.27Å; D954-H977 WeakPolarHBondContact OD1-CA 3.04Å; D954-H977 WeakPolarHBondContact OD1-CB 3.48Å; D954-H977 IonicContact OD1-CG 3.47Å; D954-H977 IonicContact OD1-ND1 2.84Å; D954-H977 PolarHBondContact OD1-ND1 2.81Å; D954-H977 VanDerWaalsContact OD1-ND1 3.13Å; D954-H977 IonicContact OD2-CE1 2.69Å; D954-H977 PolarHBondContact OD2-CE1 2.66Å; D954-H977 IonicContact OD2-CG 2.72Å; D954-H977 IonicContact OD2-ND1 3.83Å; D954-H977 PolarHBondContact OD2-ND1 3.2Å; F971-H977 HydrophobicContact CD1-CB 3.96Å; F971-H977 AromaticContact CD1-CG 3.62Å; F971-H977 AromaticContact CD1-ND1 3.8Å; F971-H977 HydrophobicContact CE1-CB 3.62Å; F971-H977 AromaticContact CE1-CG 3.81Å; F971-H977 HydrophobicContact CZ-CB 4.49Å; R973-H977 PolarHBondContact O-NE2 3.48Å; H977-R995 WeakPolarHBondContact O-CA 3.5Å; H977-V996 PolarHBondContact N-O 2.79Å; H977-V996 PolarHBondContact O-N 2.74Å
978	I	89.9	Confident	86.4	Confident	57 Å²	57	52.3 Å²	52.3	29%	0.292	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	128	174.2	-57.4	177.9	0	0	0	107.7	D954	D954-I978 PolarHBondContact N-O 2.86Å; D954-I978 PolarHBondContact OD1-N 3Å; D954-I978 VanDerWaalsContact OD1-N 3.13Å
979	V	91.1	Very high	86.2	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	118	172.6	-175	0	0	0	0	108	L921 F935 W952 F953 F971 Q993 I994 V996	L921-V979 HydrophobicContact CD2-CG1 4.43Å; L921-V979 WeakPolarHBondContact CD2-O 3.21Å; F935-V979 HydrophobicContact CD1-CB 4.37Å; F935-V979 HydrophobicContact CD1-CG1 3.93Å; F935-V979 HydrophobicContact CD1-CG2 4.49Å; F935-V979 HydrophobicContact CE1-CB 3.91Å; F935-V979 HydrophobicContact CE1-CG1 3.91Å; F935-V979 HydrophobicContact CE1-CG2 3.65Å; F935-V979 HydrophobicContact CZ-CG2 3.84Å; W952-V979 WeakPolarHBondContact O-CA 3.48Å; F953-V979 HydrophobicContact CD1-CB 4.49Å; F953-V979 HydrophobicContact CD1-CG1 3.93Å; F953-V979 HydrophobicContact CD1-CG2 3.8Å; F953-V979 HydrophobicContact CE1-CG1 3.75Å; F953-V979 HydrophobicContact CE1-CG2 4.17Å; F953-V979 HydrophobicContact CZ-CG1 4.49Å; F971-V979 HydrophobicContact CE1-CG2 4.37Å; F971-V979 HydrophobicContact CZ-CG2 3.85Å; V979-Q993 WeakPolarHBondContact O-CA 3.48Å; V979-I994 HydrophobicContact CB-CG2 4.29Å; V979-I994 PolarHBondContact N-O 3.36Å; V979-I994 PolarHBondContact O-N 3.35Å; V979-V996 HydrophobicContact CG2-CG2 4.33Å
980	T	91	Very high	86.1	Confident	27 Å²	27	52.3 Å²	52.3	17%	0.166	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	135.4	176.5	-56.1	0	0	0	0	108.7	W952 Q982 D992 Q993	W952-T980 PolarHBondContact N-O 2.88Å; W952-T980 PolarHBondContact O-N 2.83Å; T980-Q982 HydrophobicContact CG2-CG 4.48Å; T980-D992 WeakPolarHBondContact CA-O 3.48Å; T980-Q993 HydrophobicContact CG2-CB 4.22Å; T980-Q993 WeakPolarHBondContact OG1-CB 3.25Å
981	V	92.2	Very high	86.2	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	135.1	172.2	70.3	0	0	0	0	109.5	V919 L921 T937 Y949 F950 W951 Q991 D992	V919-V981 HydrophobicContact CG2-CG1 4.41Å; L921-V981 HydrophobicContact CB-CG1 3.91Å; L921-V981 HydrophobicContact CD1-CG1 4.14Å; L921-V981 HydrophobicContact CD2-CB 4.39Å; L921-V981 HydrophobicContact CD2-CG1 3.99Å; L921-V981 HydrophobicContact CG-CG1 4.23Å; T937-V981 HydrophobicContact CG2-CB 4.27Å; T937-V981 HydrophobicContact CG2-CG1 3.71Å; T937-V981 HydrophobicContact CG2-CG2 3.8Å; Y949-V981 HydrophobicContact CD1-CG2 4.26Å; F950-V981 WeakPolarHBondContact O-CA 3.05Å; W951-V981 HydrophobicContact CD2-CB 4.33Å; W951-V981 HydrophobicContact CD2-CG2 3.73Å; W951-V981 HydrophobicContact CE3-CB 3.84Å; W951-V981 HydrophobicContact CE3-CG2 3.71Å; W951-V981 HydrophobicContact CG-CG2 4.42Å; W951-V981 HydrophobicContact CH2-CG2 4.06Å; W951-V981 HydrophobicContact CZ2-CG2 4.04Å; W951-V981 HydrophobicContact CZ3-CB 3.96Å; W951-V981 HydrophobicContact CZ3-CG2 3.87Å; V981-Q991 VanDerWaalsContact O-CA 3.27Å; V981-Q991 WeakPolarHBondContact O-CA 3.44Å; V981-D992 PolarHBondContact N-O 2.8Å; V981-D992 PolarHBondContact O-N 3.03Å
982	Q	92	Very high	86.2	Confident	46 Å²	46	57.1 Å²	57.1	22%	0.215	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124.8	173.5	-49.7	-179.7	-57.2	0	0	108.1	Y949 F950 T980 V989 H990 Q991	Y949-Q982 CarbonylContact C-O 3.55Å; Y949-Q982 WeakPolarHBondContact CA-O 3.31Å; F950-Q982 HydrophobicContact CB-CB 4.29Å; F950-Q982 PolarHBondContact N-O 2.77Å; F950-Q982 PolarHBondContact O-N 3.22Å; T980-Q982 HydrophobicContact CG2-CG 4.48Å; Q982-V989 HydrophobicContact CB-CG1 4.44Å; Q982-H990 CarbonylContact C-O 3.55Å; Q982-H990 WeakPolarHBondContact CA-O 3.46Å; Q982-Q991 HydrophobicContact CB-CB 4.32Å; Q982-Q991 HydrophobicContact CG-CB 3.82Å
983	A	91.3	Very high	86.4	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	117	177.6	0	0	0	0	0	109.3	L916 V919 L939 V947 Y949 V989 H990	L916-A983 HydrophobicContact CD2-CB 4.1Å; V919-A983 HydrophobicContact CB-CB 4.05Å; V919-A983 HydrophobicContact CG1-CB 4.35Å; V919-A983 HydrophobicContact CG2-CB 4.04Å; L939-A983 HydrophobicContact CD2-CB 4.09Å; V947-A983 HydrophobicContact CG1-CB 3.9Å; Y949-A983 HydrophobicContact CD1-CB 4.12Å; Y949-A983 HydrophobicContact CE1-CB 4.15Å; A983-V989 WeakPolarHBondContact O-CA 3.41Å; A983-H990 PolarHBondContact N-O 2.89Å; A983-H990 PolarHBondContact O-N 3.32Å
984	L	87.5	Confident	86.5	Confident	56 Å²	56	52.3 Å²	52.3	29%	0.293	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	116.9	173.8	174.5	69.1	0	0	0	109.2	V947 T948 F950 G986 T988 V989	V947-L984 WeakPolarHBondContact CA-O 3.33Å; T948-L984 PolarHBondContact N-O 2.89Å; T948-L984 PolarHBondContact O-N 3.33Å; F950-L984 HydrophobicContact CE2-CB 3.89Å; F950-L984 HydrophobicContact CE2-CD2 4.13Å; F950-L984 HydrophobicContact CZ-CD2 4.41Å; L984-G986 VanDerWaalsContact CD1-O 3.31Å; L984-G986 WeakPolarHBondContact CD1-O 3.25Å; L984-T988 WeakPolarHBondContact CA-O 3.4Å; L984-V989 HydrophobicContact CB-CG2 4.48Å; L984-V989 HydrophobicContact CD1-CG2 3.51Å
985	A	83.2	Confident	86.6	Confident	5 Å²	5	54.4 Å²	54.4	4%	0.041	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	105.9	176.1	0	0	0	0	0	109.3	L916 V944 V947 N987 T988	L916-A985 HydrophobicContact CB-CB 4.03Å; L916-A985 HydrophobicContact CD2-CB 4.11Å; V944-A985 HydrophobicContact CB-CB 4.49Å; V944-A985 HydrophobicContact CG2-CB 4.31Å; V947-A985 HydrophobicContact CG2-CB 4.03Å; A985-N987 PolarHBondContact O-N 2.88Å; A985-T988 PolarHBondContact N-O 3.44Å; A985-T988 PolarHBondContact O-N 3.29Å; A985-T988 PolarHBondContact O-OG1 3.13Å
986	G	73.4	Confident	86.8	Confident	36 Å²	36	53 Å²	53	37%	0.371	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	-121.5	-168.9	0	0	0	0	0	110.7	L984	L984-G986 VanDerWaalsContact CD1-O 3.31Å; L984-G986 WeakPolarHBondContact CD1-O 3.25Å
987	N	69.1	Low	86.8	Confident	158 Å²	158	50.9 Å²	50.9	85%	0.845	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	5.5	178.6	-60.4	21	0	0	0	113	A985	A985-N987 PolarHBondContact O-N 2.88Å
988	T	77.9	Confident	86.7	Confident	26 Å²	26	50.3 Å²	50.3	16%	0.16	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	130.6	-177.7	61.7	0	0	0	0	111.5	L984 A985	L984-T988 WeakPolarHBondContact CA-O 3.4Å; A985-T988 PolarHBondContact N-O 3.44Å; A985-T988 PolarHBondContact O-N 3.29Å; A985-T988 PolarHBondContact O-OG1 3.13Å
989	V	86.6	Confident	86.5	Confident	89 Å²	89	49.2 Å²	49.2	54%	0.539	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	118.9	174.9	178.2	0	0	0	0	108.8	Q982 A983 L984	Q982-V989 HydrophobicContact CB-CG1 4.44Å; A983-V989 WeakPolarHBondContact O-CA 3.41Å; L984-V989 HydrophobicContact CB-CG2 4.48Å; L984-V989 HydrophobicContact CD1-CG2 3.51Å
990	H	89.1	Confident	85.9	Confident	52 Å²	52	53.5 Å²	53.5	24%	0.241	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	148	171.4	-69	-106.2	0	0	0	109.4	L916 E917 V919 Q982 A983	L916-H990 HydrophobicContact CD2-CB 3.97Å; L916-H990 HydrophobicContact CG-CB 4.43Å; L916-H990 PolarHBondContact O-NE2 2.98Å; L916-H990 VanDerWaalsContact O-NE2 3.12Å; E917-H990 PolarHBondContact O-CE1 2.89Å; E917-H990 PolarHBondContact O-ND1 2.87Å; E917-H990 VanDerWaalsContact O-ND1 3.08Å; V919-H990 HydrophobicContact CG1-CB 3.96Å; Q982-H990 CarbonylContact C-O 3.55Å; Q982-H990 WeakPolarHBondContact CA-O 3.46Å; A983-H990 PolarHBondContact N-O 2.89Å; A983-H990 PolarHBondContact O-N 3.32Å
991	Q	91.9	Very high	85.2	Confident	128 Å²	128	57.9 Å²	57.9	60%	0.598	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136	148.3	-177.4	66.6	-177.3	-2.6	0	0	112.3	V981 Q982	V981-Q991 VanDerWaalsContact O-CA 3.27Å; V981-Q991 WeakPolarHBondContact O-CA 3.44Å; Q982-Q991 HydrophobicContact CB-CB 4.32Å; Q982-Q991 HydrophobicContact CG-CB 3.82Å
992	D	89.8	Confident	84.8	Confident	51 Å²	51	59.7 Å²	59.7	27%	0.273	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	153.3	172.3	-169	17.4	0	0	0	110	V919 Q920 L921 T980 V981	V919-D992 HydrophobicContact CG1-CB 4.22Å; Q920-D992 WeakPolarHBondContact CA-OD2 3.28Å; L921-D992 HydrophobicContact CB-CB 4.16Å; L921-D992 PolarHBondContact N-OD2 2.93Å; T980-D992 WeakPolarHBondContact CA-O 3.48Å; V981-D992 PolarHBondContact N-O 2.8Å; V981-D992 PolarHBondContact O-N 3.03Å
993	Q	90	Very high	84.2	Confident	131 Å²	131	60.1 Å²	60.1	61%	0.612	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138	137.7	-174.9	59.4	175.1	-15.2	0	0	111.8	V979 T980	V979-Q993 WeakPolarHBondContact O-CA 3.48Å; T980-Q993 HydrophobicContact CG2-CB 4.22Å; T980-Q993 WeakPolarHBondContact OG1-CB 3.25Å
994	I	87.6	Confident	83.9	Confident	36 Å²	36	61.9 Å²	61.9	19%	0.185	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142.8	176.2	-159	165.4	0	0	0	111.2	L921 A923 V979 V996	L921-I994 HydrophobicContact CD2-CB 4.1Å; L921-I994 HydrophobicContact CD2-CG2 3.61Å; L921-I994 HydrophobicContact CG-CB 4.34Å; L921-I994 HydrophobicContact CG-CG2 3.95Å; A923-I994 HydrophobicContact CB-CD1 4.28Å; A923-I994 HydrophobicContact CB-CG2 4.15Å; V979-I994 HydrophobicContact CB-CG2 4.29Å; V979-I994 PolarHBondContact N-O 3.36Å; V979-I994 PolarHBondContact O-N 3.35Å; I994-V996 HydrophobicContact CG2-CG2 4.19Å
995	R	86.6	Confident	83.8	Confident	144 Å²	144	61.3 Å²	61.3	54%	0.543	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	121	175.2	-176.4	175.3	-67.6	-73.8	-3.1	109.4	S976 H977	S976-R995 VanDerWaalsContact OG-CD 3.24Å; S976-R995 WeakPolarHBondContact OG-CD 3.35Å; S976-R995 WeakPolarHBondContact OG-CG 3.42Å; S976-R995 PolarHBondContact OG-NH1 2.76Å; H977-R995 WeakPolarHBondContact O-CA 3.5Å
996	V	88.1	Confident	83.9	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	138.6	179.5	-177.2	0	0	0	0	109.1	V927 F935 S976 H977 V979 I994 V998	V927-V996 HydrophobicContact CB-CG1 3.99Å; V927-V996 HydrophobicContact CG2-CG1 3.46Å; V927-V996 VanDerWaalsContact CG2-CG1 3.46Å; F935-V996 HydrophobicContact CE1-CG2 3.98Å; F935-V996 HydrophobicContact CZ-CG2 4.21Å; S976-V996 WeakPolarHBondContact CA-O 3.23Å; H977-V996 PolarHBondContact N-O 2.79Å; H977-V996 PolarHBondContact O-N 2.74Å; V979-V996 HydrophobicContact CG2-CG2 4.33Å; I994-V996 HydrophobicContact CG2-CG2 4.19Å; V996-V998 HydrophobicContact CG1-CG2 4.31Å
997	A	86.2	Confident	84.6	Confident	14 Å²	14	62.6 Å²	62.6	12%	0.116	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122.6	174.3	0	0	0	0	0	110.4	L925 V926 V927 Y999 L1047	L925-A997 PolarHBondContact O-N 3.28Å; V926-A997 CarbonylContact C-O 3.48Å; V926-A997 WeakPolarHBondContact CA-O 3.41Å; V927-A997 PolarHBondContact N-O 2.89Å; A997-Y999 HydrophobicContact CB-CD2 4.45Å; A997-Y999 HydrophobicContact CB-CE2 3.77Å; A997-L1047 HydrophobicContact CB-CD1 4.29Å
998	V	87.3	Confident	85.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.2	-175.5	-176.3	0	0	0	0	109.8	V927 K929 F971 R973 E974 G975 V996	V927-V998 HydrophobicContact CB-CG2 4.22Å; V927-V998 HydrophobicContact CG1-CG1 4.45Å; V927-V998 HydrophobicContact CG1-CG2 4.23Å; V927-V998 WeakPolarHBondContact O-CA 3.44Å; K929-V998 HydrophobicContact CB-CG1 3.84Å; K929-V998 HydrophobicContact CG-CG1 4.49Å; F971-V998 HydrophobicContact CB-CB 4.34Å; F971-V998 HydrophobicContact CB-CG1 3.79Å; F971-V998 HydrophobicContact CB-CG2 3.69Å; F971-V998 HydrophobicContact CD1-CG2 4.04Å; F971-V998 HydrophobicContact CD2-CG2 4.04Å; F971-V998 HydrophobicContact CG-CG2 3.66Å; R973-V998 WeakPolarHBondContact O-CG1 3.33Å; E974-V998 WeakPolarHBondContact CA-O 3.47Å; G975-V998 PolarHBondContact N-O 3.45Å; G975-V998 PolarHBondContact O-N 2.62Å; V996-V998 HydrophobicContact CG1-CG2 4.31Å
999	Y	84.6	Confident	85.9	Confident	34 Å²	34	56.6 Å²	56.6	13%	0.133	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	155.5	-179.7	-63	-85.5	0	0	0	111.2	V926 V927 I928 K929 E974 A997 Y1001 V1063 P1064	V926-Y999 HydrophobicContact CG1-CD2 3.95Å; V926-Y999 HydrophobicContact CG1-CE2 4.34Å; V927-Y999 PolarHBondContact O-N 3.35Å; I928-Y999 WeakPolarHBondContact CA-O 3.2Å; K929-Y999 PolarHBondContact N-O 2.9Å; E974-Y999 WeakPolarHBondContact OE1-CA 3.16Å; A997-Y999 HydrophobicContact CB-CD2 4.45Å; A997-Y999 HydrophobicContact CB-CE2 3.77Å; Y999-Y1001 VanDerWaalsContact C-N 3.31Å; Y999-Y1001 PolarHBondContact O-N 3.39Å; Y999-V1063 HydrophobicContact CD2-CB 4.34Å; Y999-V1063 HydrophobicContact CD2-CG1 4.01Å; Y999-V1063 HydrophobicContact CE1-CB 4.16Å; Y999-V1063 HydrophobicContact CE2-CB 3.92Å; Y999-V1063 HydrophobicContact CE2-CG1 3.69Å; Y999-V1063 HydrophobicContact CE2-CG2 4.38Å; Y999-P1064 HydrophobicContact CD1-CG 4.28Å
1000	D	77.8	Confident	85.8	Confident	91 Å²	91	53.2 Å²	53.2	49%	0.487	25%	0.251	S	S	.	.	S	Bend	trans	-63.2	-34.8	172	-84.7	2.8	0	0	0	111.9	K929 E974	K929-D1000 WeakPolarHBondContact CD-OD1 3.31Å; K929-D1000 IonicContact NZ-OD1 3.84Å; K929-D1000 PolarHBondContact NZ-OD1 3.39Å; K929-D1000 IonicContact NZ-OD2 3.21Å; E974-D1000 PolarHBondContact OE1-N 3.37Å
1001	Y	77.1	Confident	85.5	Confident	119 Å²	119	54.5 Å²	54.5	47%	0.467	27%	0.266	S	S	.	.			trans	-156.9	147.7	178.3	-179.8	-100.6	0	0	0	112.4	Y999 R1003 P1064	Y999-Y1001 VanDerWaalsContact C-N 3.31Å; Y999-Y1001 PolarHBondContact O-N 3.39Å; Y1001-R1003 HydrophobicContact CE1-CG 3.94Å; Y1001-R1003 WeakPolarHBondContact OH-CG 3.49Å; Y1001-R1003 PolarHBondContact OH-NE 3.33Å; Y1001-P1064 WeakPolarHBondContact O-CD 3.34Å; Y1001-P1064 WeakPolarHBondContact O-CG 3.38Å
1002	F	83.2	Confident	85	Confident	37 Å²	37	51.3 Å²	51.3	16%	0.162	25%	0.253	C	S	.	.			trans	-146.2	163.8	169.1	64.9	-97	0	0	0	110.6	V926 I928 F1061 I1062 V1063	V926-F1002 HydrophobicContact CB-CE1 4.3Å; V926-F1002 HydrophobicContact CB-CZ 4.47Å; V926-F1002 HydrophobicContact CG1-CD1 3.56Å; V926-F1002 HydrophobicContact CG1-CE1 3.74Å; V926-F1002 HydrophobicContact CG1-CG 3.97Å; V926-F1002 HydrophobicContact CG1-CZ 4.31Å; I928-F1002 HydrophobicContact CD1-CE1 4.43Å; I928-F1002 HydrophobicContact CG1-CD1 4.15Å; I928-F1002 HydrophobicContact CG1-CE1 3.54Å; I928-F1002 HydrophobicContact CG1-CZ 4.24Å; F1002-F1061 AromaticContact CD2-CD1 3.86Å; F1002-F1061 HydrophobicContact CD2-CD1 3.86Å; F1002-F1061 AromaticContact CE2-CD1 3.68Å; F1002-F1061 HydrophobicContact CE2-CD1 3.68Å; F1002-F1061 HydrophobicContact CE2-CE1 4.05Å; F1002-F1061 HydrophobicContact CZ-CD1 4.42Å; F1002-I1062 WeakPolarHBondContact CA-O 3.41Å; F1002-I1062 WeakPolarHBondContact CB-O 3.48Å; F1002-V1063 HydrophobicContact CB-CG1 4.19Å
1003	R	80.3	Confident	84.8	Confident	56 Å²	56	48.9 Å²	48.9	21%	0.211	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	146.5	162.7	-68.6	-167.4	-177.7	178.9	7	109.6	Y1001 F1061 I1062 D1081	Y1001-R1003 HydrophobicContact CE1-CG 3.94Å; Y1001-R1003 WeakPolarHBondContact OH-CG 3.49Å; Y1001-R1003 PolarHBondContact OH-NE 3.33Å; R1003-F1061 CarbonylContact O-C 3.59Å; R1003-F1061 WeakPolarHBondContact O-CA 3.43Å; R1003-I1062 PolarHBondContact N-O 2.83Å; R1003-I1062 VanDerWaalsContact N-O 3.16Å; R1003-I1062 PolarHBondContact O-N 2.75Å; R1003-D1081 WeakPolarHBondContact CD-OD2 3.49Å; R1003-D1081 IonicContact CZ-OD2 2.68Å; R1003-D1081 IonicContact NE-OD2 3.74Å; R1003-D1081 IonicContact NH1-OD2 3.33Å; R1003-D1081 PolarHBondContact NH1-OD2 3.45Å
1004	S	85.1	Confident	84.6	Confident	37 Å²	37	44.5 Å²	44.5	26%	0.259	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	149	174.4	68.4	0	0	0	0	112.4	E1059 V1060	S1004-E1059 WeakPolarHBondContact CB-OE1 3.04Å; S1004-E1059 PolarHBondContact OG-OE1 2.82Å; S1004-V1060 CarbonylContact C-O 3.44Å; S1004-V1060 WeakPolarHBondContact CA-O 3.44Å
1005	H	84.6	Confident	84.2	Confident	43 Å²	43	51 Å²	51	20%	0.199	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	129.5	178.4	-55.1	-88.6	0	0	0	109.5	E1059 V1060 D1081	H1005-E1059 WeakPolarHBondContact O-CA 3.1Å; H1005-V1060 HydrophobicContact CB-CG1 4.02Å; H1005-V1060 PolarHBondContact N-O 2.84Å; H1005-V1060 PolarHBondContact O-N 3.29Å; H1005-D1081 IonicContact NE2-OD1 2.71Å; H1005-D1081 PolarHBondContact NE2-OD1 2.81Å; H1005-D1081 IonicContact NE2-OD2 3.65Å; H1005-D1081 PolarHBondContact NE2-OD2 3.38Å
1006	H	85.6	Confident	84	Confident	69 Å²	69	46.6 Å²	46.6	32%	0.319	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	131.1	174.9	-175.4	-89.5	0	0	0	110.3	T1057 T1108	H1006-T1057 WeakPolarHBondContact NE2-CB 3.47Å; H1006-T1057 PolarHBondContact NE2-OG1 3.05Å; H1006-T1108 PolarHBondContact O-N 2.82Å; H1006-T1108 PolarHBondContact O-OG1 3.01Å
1007	L	87.8	Confident	83.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.5	-176.3	-57.4	-179.8	0	0	0	109.6	V1031 I1035 T1057 A1058 V1060 L1088 V1105 Y1106	L1007-V1031 HydrophobicContact CD1-CG1 4.24Å; L1007-I1035 HydrophobicContact CD1-CD1 4.46Å; L1007-T1057 WeakPolarHBondContact O-CA 3.42Å; L1007-T1057 WeakPolarHBondContact O-CB 3.09Å; L1007-A1058 HydrophobicContact CB-CB 4.19Å; L1007-A1058 HydrophobicContact CD1-CB 4.42Å; L1007-A1058 PolarHBondContact N-O 2.86Å; L1007-A1058 PolarHBondContact O-N 3.43Å; L1007-V1060 HydrophobicContact CD1-CB 3.96Å; L1007-V1060 HydrophobicContact CD1-CG1 3.85Å; L1007-V1060 HydrophobicContact CD2-CG1 3.96Å; L1007-V1060 HydrophobicContact CG-CB 4.49Å; L1007-V1060 HydrophobicContact CG-CG1 3.96Å; L1007-L1088 HydrophobicContact CD2-CD1 3.58Å; L1007-L1088 HydrophobicContact CD2-CD2 3.93Å; L1007-L1088 HydrophobicContact CD2-CG 4.43Å; L1007-V1105 HydrophobicContact CB-CG1 4.07Å; L1007-V1105 HydrophobicContact CD1-CG1 4.05Å; L1007-V1105 HydrophobicContact CD2-CG1 4.37Å; L1007-V1105 HydrophobicContact CG-CG1 4.4Å; L1007-Y1106 WeakPolarHBondContact CA-O 3.47Å
1008	V	86.2	Confident	83.6	Confident	46 Å²	46	50.9 Å²	50.9	28%	0.279	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	139.6	173.9	175.3	0	0	0	0	108.5	T1057 Y1106 T1108	V1008-T1057 HydrophobicContact CG2-CG2 4.21Å; V1008-Y1106 PolarHBondContact N-O 3.14Å; V1008-Y1106 PolarHBondContact O-N 3.34Å; V1008-T1108 HydrophobicContact CB-CG2 4.43Å; V1008-T1108 HydrophobicContact CG2-CG2 3.5Å; V1008-T1108 VanDerWaalsContact CG2-CG2 3.5Å
1009	F	87.8	Confident	83.1	Confident	11 Å²	11	53.2 Å²	53.2	5%	0.048	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	155.8	179.3	-60.6	-84.8	0	0	0	111	L1013 V1031 L1050 T1056 A1058 F1095 V1103 N1104 V1105	F1009-L1013 HydrophobicContact CB-CB 4.06Å; F1009-L1013 HydrophobicContact CB-CD2 3.55Å; F1009-L1013 HydrophobicContact CB-CG 4.45Å; F1009-L1013 HydrophobicContact CD1-CD2 3.65Å; F1009-L1013 HydrophobicContact CD2-CD2 3.5Å; F1009-L1013 VanDerWaalsContact CD2-CD2 3.5Å; F1009-L1013 HydrophobicContact CE1-CD2 4.2Å; F1009-L1013 HydrophobicContact CE2-CD2 4.07Å; F1009-L1013 HydrophobicContact CG-CD2 3.26Å; F1009-L1013 HydrophobicContact CZ-CD2 4.4Å; F1009-V1031 HydrophobicContact CE1-CG2 3.61Å; F1009-V1031 HydrophobicContact CZ-CG2 3.95Å; F1009-L1050 HydrophobicContact CE2-CD2 4.49Å; F1009-L1050 HydrophobicContact CE2-CG 4.21Å; F1009-L1050 HydrophobicContact CZ-CD1 4.22Å; F1009-L1050 HydrophobicContact CZ-CG 4.37Å; F1009-T1056 HydrophobicContact CD2-CG2 4.12Å; F1009-T1056 WeakPolarHBondContact CD2-O 3.23Å; F1009-T1056 HydrophobicContact CE2-CG2 4.38Å; F1009-A1058 HydrophobicContact CE2-CB 3.74Å; F1009-A1058 HydrophobicContact CZ-CB 3.91Å; F1009-F1095 HydrophobicContact CD1-CE1 4.3Å; F1009-F1095 HydrophobicContact CE1-CE1 4.18Å; F1009-F1095 HydrophobicContact CE1-CZ 4.45Å; F1009-V1103 HydrophobicContact CB-CG1 4.27Å; F1009-V1103 HydrophobicContact CD1-CG1 4.01Å; F1009-N1104 WeakPolarHBondContact CA-O 3.07Å; F1009-V1105 HydrophobicContact CD1-CB 4.42Å; F1009-V1105 HydrophobicContact CD1-CG1 4.23Å; F1009-V1105 HydrophobicContact CD1-CG2 3.78Å; F1009-V1105 HydrophobicContact CE1-CB 4.37Å; F1009-V1105 HydrophobicContact CE1-CG1 3.9Å; F1009-V1105 HydrophobicContact CE1-CG2 3.65Å; F1009-V1105 HydrophobicContact CZ-CG1 4.48Å
1010	S	85.6	Confident	82.8	Confident	19 Å²	19	54.6 Å²	54.6	13%	0.133	30%	0.297	C	S	.	.			trans	-58.3	143.3	163.4	58.4	0	0	0	0	111.1	N1012 L1013 V1103 N1104	S1010-N1012 PolarHBondContact O-N 3.39Å; S1010-L1013 PolarHBondContact O-N 2.63Å; S1010-V1103 WeakPolarHBondContact OG-CA 3.34Å; S1010-N1104 PolarHBondContact N-O 3.21Å; S1010-N1104 PolarHBondContact OG-N 3.31Å
1011	S	81.8	Confident	82.6	Confident	79 Å²	79	52.7 Å²	52.7	55%	0.552	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-52.7	-21.2	-179	52.7	0	0	0	0	115.2	L1013 D1014	S1011-L1013 PolarHBondContact O-N 3.07Å; S1011-D1014 WeakPolarHBondContact O-CB 3.43Å; S1011-D1014 PolarHBondContact O-N 2.78Å
1012	N	82.1	Confident	82.8	Confident	61 Å²	61	53.8 Å²	53.8	33%	0.326	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-52.8	-22.7	170.8	-61.5	-3.5	0	0	0	113.9	S1010 L1101 Q1102 V1103	S1010-N1012 PolarHBondContact O-N 3.39Å; N1012-L1101 HydrophobicContact CB-CD1 3.93Å; N1012-L1101 HydrophobicContact CB-CG 4.36Å; N1012-Q1102 PolarHBondContact ND2-O 2.72Å; N1012-V1103 HydrophobicContact CB-CG2 4.03Å
1013	L	85.8	Confident	83	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-80.7	-32	174.1	-174.7	64.6	0	0	0	112.8	F1009 S1010 S1011 M1016 N1017 W1023 T1056 I1097 V1103	F1009-L1013 HydrophobicContact CB-CB 4.06Å; F1009-L1013 HydrophobicContact CB-CD2 3.55Å; F1009-L1013 HydrophobicContact CB-CG 4.45Å; F1009-L1013 HydrophobicContact CD1-CD2 3.65Å; F1009-L1013 HydrophobicContact CD2-CD2 3.5Å; F1009-L1013 VanDerWaalsContact CD2-CD2 3.5Å; F1009-L1013 HydrophobicContact CE1-CD2 4.2Å; F1009-L1013 HydrophobicContact CE2-CD2 4.07Å; F1009-L1013 HydrophobicContact CG-CD2 3.26Å; F1009-L1013 HydrophobicContact CZ-CD2 4.4Å; S1010-L1013 PolarHBondContact O-N 2.63Å; S1011-L1013 PolarHBondContact O-N 3.07Å; L1013-M1016 CarbonylContact O-C 3.52Å; L1013-M1016 WeakPolarHBondContact O-CA 3.44Å; L1013-M1016 PolarHBondContact O-N 2.97Å; L1013-M1016 VanDerWaalsContact O-N 3.09Å; L1013-N1017 PolarHBondContact O-N 3.01Å; L1013-N1017 VanDerWaalsContact O-N 3.12Å; L1013-W1023 HydrophobicContact CD1-CH2 3.59Å; L1013-W1023 HydrophobicContact CD1-CZ2 3.7Å; L1013-W1023 HydrophobicContact CG-CH2 3.99Å; L1013-T1056 HydrophobicContact CD2-CG2 3.6Å; L1013-T1056 HydrophobicContact CG-CG2 4.24Å; L1013-I1097 HydrophobicContact CD1-CD1 3.4Å; L1013-I1097 VanDerWaalsContact CD1-CD1 3.4Å; L1013-V1103 HydrophobicContact CB-CG1 4.04Å; L1013-V1103 HydrophobicContact CB-CG2 4.23Å
1014	D	85.3	Confident	83.3	Confident	39 Å²	39	53.2 Å²	53.2	21%	0.209	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-71.1	-40.6	-171.5	-71	-15.5	0	0	0	112.1	S1011 M1016 N1017 L1054 P1055 T1056	S1011-D1014 WeakPolarHBondContact O-CB 3.43Å; S1011-D1014 PolarHBondContact O-N 2.78Å; D1014-M1016 PolarHBondContact O-N 2.92Å; D1014-M1016 VanDerWaalsContact O-N 3.12Å; D1014-N1017 PolarHBondContact O-N 3.36Å; D1014-L1054 HydrophobicContact CB-CD2 3.9Å; D1014-P1055 WeakPolarHBondContact OD2-CA 3.37Å; D1014-P1055 WeakPolarHBondContact OD2-CB 3.26Å; D1014-T1056 WeakPolarHBondContact OD1-CA 3.3Å; D1014-T1056 WeakPolarHBondContact OD1-CB 3.48Å; D1014-T1056 PolarHBondContact OD1-N 3.27Å; D1014-T1056 PolarHBondContact OD1-OG1 2.74Å
1015	E	80.7	Confident	83.2	Confident	172 Å²	172	57.8 Å²	57.8	80%	0.804	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-62.1	-16.3	171.9	-60.8	-174.4	175.9	0	0	113
1016	M	80.8	Confident	83.3	Confident	51 Å²	51	59.6 Å²	59.6	25%	0.251	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-111.6	1.3	-174.4	-73.8	-62.5	-40.5	0	0	113.6	L1013 D1014 P1018 W1023 I1097 K1098 L1101	L1013-M1016 CarbonylContact O-C 3.52Å; L1013-M1016 WeakPolarHBondContact O-CA 3.44Å; L1013-M1016 PolarHBondContact O-N 2.97Å; L1013-M1016 VanDerWaalsContact O-N 3.09Å; D1014-M1016 PolarHBondContact O-N 2.92Å; D1014-M1016 VanDerWaalsContact O-N 3.12Å; M1016-P1018 WeakPolarHBondContact O-CD 3.26Å; M1016-W1023 WeakPolarHBondContact O-CZ2 3.06Å; M1016-I1097 HydrophobicContact CE-CG2 4.47Å; M1016-K1098 HydrophobicContact CE-CD 4.42Å; M1016-K1098 HydrophobicContact SD-CD 4.45Å; M1016-L1101 HydrophobicContact CG-CD2 3.76Å; M1016-L1101 HydrophobicContact SD-CD2 4.45Å
1017	N	84.9	Confident	83.5	Confident	27 Å²	27	57 Å²	57	14%	0.144	31%	0.314	C	S	.	.			trans	-87.7	110.8	-177	-178.4	-14.1	0	0	0	111.4	L1013 D1014 G1019 W1023 L1054 T1056	L1013-N1017 PolarHBondContact O-N 3.01Å; L1013-N1017 VanDerWaalsContact O-N 3.12Å; D1014-N1017 PolarHBondContact O-N 3.36Å; N1017-G1019 VanDerWaalsContact C-N 3.3Å; N1017-G1019 PolarHBondContact O-N 2.96Å; N1017-G1019 PolarHBondContact OD1-N 3.23Å; N1017-W1023 HydrophobicContact CB-CH2 3.6Å; N1017-W1023 HydrophobicContact CB-CZ2 4.28Å; N1017-W1023 HydrophobicContact CB-CZ3 3.91Å; N1017-W1023 VanDerWaalsContact CG-CZ3 3.49Å; N1017-W1023 WeakPolarHBondContact OD1-CZ3 3.13Å; N1017-L1054 HydrophobicContact CB-CD2 4.2Å; N1017-T1056 PolarHBondContact ND2-OG1 3.37Å
1018	P	81.2	Confident	83.5	Confident	78 Å²	78	57.3 Å²	57.3	51%	0.506	32%	0.317	S	S	.	.			trans	-85.3	3	-176.5	37.2	-36.5	0	0	0	113.5	M1016 V1020 W1023	M1016-P1018 WeakPolarHBondContact O-CD 3.26Å; P1018-V1020 HydrophobicContact CB-CG2 4.2Å; P1018-V1020 HydrophobicContact CG-CB 4.3Å; P1018-V1020 HydrophobicContact CG-CG2 4.2Å; P1018-V1020 PolarHBondContact O-N 3.15Å; P1018-V1020 VanDerWaalsContact O-N 3.16Å; P1018-W1023 HydrophobicContact CG-CB 3.88Å; P1018-W1023 HydrophobicContact CG-CD2 3.97Å; P1018-W1023 HydrophobicContact CG-CG 3.64Å
1019	G	76.3	Confident	83.5	Confident	49 Å²	49	61.5 Å²	61.5	51%	0.505	33%	0.328	S	S	.	.			trans	73.5	-3.6	-176.7	0	0	0	0	0	115.8	N1017 R1024	N1017-G1019 VanDerWaalsContact C-N 3.3Å; N1017-G1019 PolarHBondContact O-N 2.96Å; N1017-G1019 PolarHBondContact OD1-N 3.23Å; G1019-R1024 PolarHBondContact O-NH1 3.45Å
1020	V	78.7	Confident	83.6	Confident	62 Å²	62	63.8 Å²	63.8	38%	0.376	34%	0.342	S	S	.	.			trans	-75	145.9	-179.7	-174.7	0	0	0	0	111.9	P1018 E1022 W1023 R1024	P1018-V1020 HydrophobicContact CB-CG2 4.2Å; P1018-V1020 HydrophobicContact CG-CB 4.3Å; P1018-V1020 HydrophobicContact CG-CG2 4.2Å; P1018-V1020 PolarHBondContact O-N 3.15Å; P1018-V1020 VanDerWaalsContact O-N 3.16Å; V1020-E1022 HydrophobicContact CG1-CB 4.17Å; V1020-E1022 HydrophobicContact CG1-CG 4.43Å; V1020-W1023 HydrophobicContact CB-CB 4.36Å; V1020-R1024 PolarHBondContact O-N 2.74Å; V1020-R1024 PolarHBondContact O-NH1 3.07Å
1021	S	75.1	Confident	83.7	Confident	52 Å²	52	62.9 Å²	62.9	36%	0.364	34%	0.336	S	S	.	.	H	α-helix	trans	-67.4	-48.6	177.1	36.9	0	0	0	0	113	W1023 R1024 E1025	S1021-W1023 VanDerWaalsContact C-N 3.29Å; S1021-W1023 PolarHBondContact O-N 3.04Å; S1021-R1024 WeakPolarHBondContact O-CA 3.34Å; S1021-R1024 WeakPolarHBondContact O-CB 3.37Å; S1021-R1024 PolarHBondContact O-N 3Å; S1021-E1025 PolarHBondContact O-N 2.72Å
1022	E	80.7	Confident	84	Confident	141 Å²	141	60.9 Å²	60.9	66%	0.659	32%	0.317	S	S	*	.	H	α-helix	trans	-54.9	-44.6	-179.4	-60.2	159.8	160.9	0	0	111.4	V1020 R1024 E1025 D1026	V1020-E1022 HydrophobicContact CG1-CB 4.17Å; V1020-E1022 HydrophobicContact CG1-CG 4.43Å; E1022-R1024 PolarHBondContact O-N 2.93Å; E1022-E1025 PolarHBondContact O-N 3.41Å; E1022-D1026 PolarHBondContact O-N 2.93Å
1023	W	86.6	Confident	84.3	Confident	46 Å²	46	60.5 Å²	60.5	17%	0.174	32%	0.317	C	S	.	.	H	α-helix	trans	-61.1	-40.3	174.2	-179.9	93.6	0	0	0	112.7	L1013 M1016 N1017 P1018 V1020 S1021 E1025 D1026 I1027 L1050	L1013-W1023 HydrophobicContact CD1-CH2 3.59Å; L1013-W1023 HydrophobicContact CD1-CZ2 3.7Å; L1013-W1023 HydrophobicContact CG-CH2 3.99Å; M1016-W1023 WeakPolarHBondContact O-CZ2 3.06Å; N1017-W1023 HydrophobicContact CB-CH2 3.6Å; N1017-W1023 HydrophobicContact CB-CZ2 4.28Å; N1017-W1023 HydrophobicContact CB-CZ3 3.91Å; N1017-W1023 VanDerWaalsContact CG-CZ3 3.49Å; N1017-W1023 WeakPolarHBondContact OD1-CZ3 3.13Å; P1018-W1023 HydrophobicContact CG-CB 3.88Å; P1018-W1023 HydrophobicContact CG-CD2 3.97Å; P1018-W1023 HydrophobicContact CG-CG 3.64Å; V1020-W1023 HydrophobicContact CB-CB 4.36Å; S1021-W1023 VanDerWaalsContact C-N 3.29Å; S1021-W1023 PolarHBondContact O-N 3.04Å; W1023-E1025 VanDerWaalsContact C-N 3.31Å; W1023-E1025 PolarHBondContact O-N 3.06Å; W1023-D1026 PolarHBondContact O-N 2.92Å; W1023-I1027 HydrophobicContact CD2-CG1 3.91Å; W1023-I1027 HydrophobicContact CE3-CG1 4.25Å; W1023-I1027 HydrophobicContact CG-CG1 4.49Å; W1023-I1027 HydrophobicContact CH2-CG1 4.18Å; W1023-I1027 HydrophobicContact CZ2-CD1 4.3Å; W1023-I1027 HydrophobicContact CZ2-CG1 3.83Å; W1023-I1027 HydrophobicContact CZ3-CG1 4.37Å; W1023-I1027 WeakPolarHBondContact O-CB 3.33Å; W1023-I1027 VanDerWaalsContact O-CG1 3.31Å; W1023-I1027 WeakPolarHBondContact O-CG1 3.37Å; W1023-I1027 PolarHBondContact O-N 2.82Å; W1023-L1050 HydrophobicContact CZ3-CD2 4.24Å
1024	R	86.6	Confident	84.3	Confident	36 Å²	36	61.5 Å²	61.5	14%	0.136	32%	0.324	C	S	.	.	H	α-helix	trans	-65.9	-33.3	175.7	-78.5	-168.9	-62.6	-81.1	-0.5	112.3	G1019 V1020 S1021 E1022 G1028 L1050 F1051	G1019-R1024 PolarHBondContact O-NH1 3.45Å; V1020-R1024 PolarHBondContact O-N 2.74Å; V1020-R1024 PolarHBondContact O-NH1 3.07Å; S1021-R1024 WeakPolarHBondContact O-CA 3.34Å; S1021-R1024 WeakPolarHBondContact O-CB 3.37Å; S1021-R1024 PolarHBondContact O-N 3Å; E1022-R1024 PolarHBondContact O-N 2.93Å; R1024-G1028 PolarHBondContact O-N 3.07Å; R1024-L1050 HydrophobicContact CB-CB 3.89Å; R1024-L1050 HydrophobicContact CG-CB 3.9Å; R1024-L1050 HydrophobicContact CG-CD2 4.31Å; R1024-F1051 WeakPolarHBondContact CD-O 3.4Å
1025	E	83.7	Confident	84.4	Confident	132 Å²	132	59.6 Å²	59.6	62%	0.617	31%	0.314	S	S	*	.	H	α-helix	trans	-72.6	-41.7	175.5	-69.4	-177.7	-160.5	0	0	112.1	S1021 E1022 W1023 G1028 R1029	S1021-E1025 PolarHBondContact O-N 2.72Å; E1022-E1025 PolarHBondContact O-N 3.41Å; W1023-E1025 VanDerWaalsContact C-N 3.31Å; W1023-E1025 PolarHBondContact O-N 3.06Å; E1025-G1028 PolarHBondContact O-N 2.86Å; E1025-R1029 WeakPolarHBondContact O-CB 3.28Å; E1025-R1029 PolarHBondContact O-N 3.35Å
1026	D	87	Confident	84.7	Confident	82 Å²	82	53 Å²	53	44%	0.439	29%	0.285	S	S	.	.	H	α-helix	trans	-65.9	-45.3	176	-83.6	-6.1	0	0	0	112.2	E1022 W1023 G1028 R1029 V1030	E1022-D1026 PolarHBondContact O-N 2.93Å; W1023-D1026 PolarHBondContact O-N 2.92Å; D1026-G1028 VanDerWaalsContact C-N 3.32Å; D1026-G1028 PolarHBondContact O-N 2.96Å; D1026-R1029 WeakPolarHBondContact O-CB 3.25Å; D1026-R1029 PolarHBondContact O-N 3.12Å; D1026-R1029 IonicContact OD1-CZ 2.66Å; D1026-R1029 IonicContact OD1-NH1 2.67Å; D1026-R1029 PolarHBondContact OD1-NH1 3.03Å; D1026-R1029 IonicContact OD1-NH2 2.52Å; D1026-R1029 PolarHBondContact OD1-NH2 2.86Å; D1026-V1030 WeakPolarHBondContact O-CG2 3.36Å; D1026-V1030 PolarHBondContact O-N 2.92Å
1027	I	88.8	Confident	84.9	Confident	15 Å²	15	57.6 Å²	57.6	8%	0.077	31%	0.306	C	S	.	.	H	α-helix	trans	-64.1	-38.9	172.8	-61.8	-64.5	0	0	0	110.6	W1023 R1029 V1030 V1031 L1050 F1095 I1097	W1023-I1027 HydrophobicContact CD2-CG1 3.91Å; W1023-I1027 HydrophobicContact CE3-CG1 4.25Å; W1023-I1027 HydrophobicContact CG-CG1 4.49Å; W1023-I1027 HydrophobicContact CH2-CG1 4.18Å; W1023-I1027 HydrophobicContact CZ2-CD1 4.3Å; W1023-I1027 HydrophobicContact CZ2-CG1 3.83Å; W1023-I1027 HydrophobicContact CZ3-CG1 4.37Å; W1023-I1027 WeakPolarHBondContact O-CB 3.33Å; W1023-I1027 VanDerWaalsContact O-CG1 3.31Å; W1023-I1027 WeakPolarHBondContact O-CG1 3.37Å; W1023-I1027 PolarHBondContact O-N 2.82Å; I1027-R1029 VanDerWaalsContact C-N 3.29Å; I1027-R1029 PolarHBondContact O-N 2.99Å; I1027-V1030 PolarHBondContact O-N 3.42Å; I1027-V1031 HydrophobicContact CG2-CG2 4.27Å; I1027-V1031 VanDerWaalsContact O-CG2 3.29Å; I1027-V1031 WeakPolarHBondContact O-CG2 3.43Å; I1027-V1031 PolarHBondContact O-N 2.7Å; I1027-L1050 HydrophobicContact CB-CD2 3.91Å; I1027-L1050 HydrophobicContact CG2-CD1 4.36Å; I1027-L1050 HydrophobicContact CG2-CD2 3.63Å; I1027-F1095 HydrophobicContact CD1-CE2 4.12Å; I1027-F1095 HydrophobicContact CG2-CE2 4.34Å; I1027-F1095 HydrophobicContact CG2-CZ 3.97Å; I1027-I1097 HydrophobicContact CD1-CD1 4.41Å
1028	G	87.1	Confident	84.9	Confident	5 Å²	5	59.3 Å²	59.3	5%	0.052	32%	0.317	C	S	.	.	H	α-helix	trans	-59.3	-38.3	173.2	0	0	0	0	0	112.9	R1024 E1025 D1026 K1032	R1024-G1028 PolarHBondContact O-N 3.07Å; E1025-G1028 PolarHBondContact O-N 2.86Å; D1026-G1028 VanDerWaalsContact C-N 3.32Å; D1026-G1028 PolarHBondContact O-N 2.96Å; G1028-K1032 VanDerWaalsContact O-CB 3.31Å; G1028-K1032 WeakPolarHBondContact O-CB 3.5Å; G1028-K1032 PolarHBondContact O-N 2.88Å
1029	R	86.9	Confident	84.9	Confident	135 Å²	135	56.6 Å²	56.6	51%	0.509	30%	0.299	S	S	.	.	H	α-helix	trans	-66.2	-46.7	173.7	-160.9	-174.6	-51.3	113.4	14.6	111.5	E1025 D1026 I1027 V1031 K1032 T1033	E1025-R1029 WeakPolarHBondContact O-CB 3.28Å; E1025-R1029 PolarHBondContact O-N 3.35Å; D1026-R1029 WeakPolarHBondContact O-CB 3.25Å; D1026-R1029 PolarHBondContact O-N 3.12Å; D1026-R1029 IonicContact OD1-CZ 2.66Å; D1026-R1029 IonicContact OD1-NH1 2.67Å; D1026-R1029 PolarHBondContact OD1-NH1 3.03Å; D1026-R1029 IonicContact OD1-NH2 2.52Å; D1026-R1029 PolarHBondContact OD1-NH2 2.86Å; I1027-R1029 VanDerWaalsContact C-N 3.29Å; I1027-R1029 PolarHBondContact O-N 2.99Å; R1029-V1031 PolarHBondContact O-N 2.85Å; R1029-K1032 PolarHBondContact O-N 2.89Å; R1029-T1033 PolarHBondContact O-N 3.42Å; R1029-T1033 PolarHBondContact O-OG1 3.01Å; R1029-T1033 VanDerWaalsContact O-OG1 3.09Å
1030	V	89.3	Confident	85.1	Confident	59 Å²	59	57.5 Å²	57.5	36%	0.358	31%	0.309	S	S	.	.	H	α-helix	trans	-57.3	-50.4	175.9	171.8	0	0	0	0	110.9	D1026 I1027 K1032 T1033 C1034 F1095	D1026-V1030 WeakPolarHBondContact O-CG2 3.36Å; D1026-V1030 PolarHBondContact O-N 2.92Å; I1027-V1030 PolarHBondContact O-N 3.42Å; V1030-K1032 VanDerWaalsContact C-N 3.34Å; V1030-K1032 PolarHBondContact O-N 3.26Å; V1030-T1033 PolarHBondContact O-N 3.14Å; V1030-T1033 VanDerWaalsContact O-N 3.16Å; V1030-C1034 PolarHBondContact O-N 3.48Å; V1030-C1034 PolarHBondContact O-SG 2.92Å; V1030-C1034 VanDerWaalsContact O-SG 3.32Å; V1030-F1095 HydrophobicContact CG1-CB 3.9Å; V1030-F1095 HydrophobicContact CG1-CD1 4.42Å; V1030-F1095 HydrophobicContact CG1-CD2 3.71Å; V1030-F1095 HydrophobicContact CG1-CE2 4.3Å; V1030-F1095 HydrophobicContact CG1-CG 3.77Å
1031	V	88.8	Confident	85.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.5	-43.8	178.3	172.5	0	0	0	0	111.4	L1007 F1009 I1027 R1029 C1034 I1035 V1048 F1095 V1105	L1007-V1031 HydrophobicContact CD1-CG1 4.24Å; F1009-V1031 HydrophobicContact CE1-CG2 3.61Å; F1009-V1031 HydrophobicContact CZ-CG2 3.95Å; I1027-V1031 HydrophobicContact CG2-CG2 4.27Å; I1027-V1031 VanDerWaalsContact O-CG2 3.29Å; I1027-V1031 WeakPolarHBondContact O-CG2 3.43Å; I1027-V1031 PolarHBondContact O-N 2.7Å; R1029-V1031 PolarHBondContact O-N 2.85Å; V1031-C1034 PolarHBondContact O-N 2.92Å; V1031-I1035 HydrophobicContact CG1-CD1 3.85Å; V1031-I1035 VanDerWaalsContact O-CG1 3.26Å; V1031-I1035 WeakPolarHBondContact O-CG1 2.94Å; V1031-I1035 PolarHBondContact O-N 2.93Å; V1031-V1048 HydrophobicContact CB-CG1 4.42Å; V1031-V1048 HydrophobicContact CG1-CG1 4.14Å; V1031-F1095 HydrophobicContact CG2-CE1 3.83Å; V1031-F1095 HydrophobicContact CG2-CZ 4.21Å; V1031-V1105 HydrophobicContact CG2-CG2 4.47Å
1032	K	88.6	Confident	85.6	Confident	37 Å²	37	55.8 Å²	55.8	16%	0.161	29%	0.293	C	S	.	.	H	α-helix	trans	-59.2	-47.2	174.1	174.1	171.3	166	161	0	111.9	G1028 R1029 V1030 I1035 V1036 E1043 L1046 V1048	G1028-K1032 VanDerWaalsContact O-CB 3.31Å; G1028-K1032 WeakPolarHBondContact O-CB 3.5Å; G1028-K1032 PolarHBondContact O-N 2.88Å; R1029-K1032 PolarHBondContact O-N 2.89Å; V1030-K1032 VanDerWaalsContact C-N 3.34Å; V1030-K1032 PolarHBondContact O-N 3.26Å; K1032-I1035 PolarHBondContact O-N 2.84Å; K1032-V1036 WeakPolarHBondContact O-CG2 3.45Å; K1032-V1036 PolarHBondContact O-N 3.1Å; K1032-E1043 HydrophobicContact CD-CG 4.49Å; K1032-E1043 WeakPolarHBondContact CE-O 3.42Å; K1032-E1043 PolarHBondContact NZ-O 2.87Å; K1032-L1046 WeakPolarHBondContact CD-O 3.43Å; K1032-L1046 VanDerWaalsContact CE-O 3.29Å; K1032-L1046 WeakPolarHBondContact CE-O 3.41Å; K1032-L1046 PolarHBondContact NZ-O 3.23Å; K1032-V1048 HydrophobicContact CB-CB 4.43Å; K1032-V1048 HydrophobicContact CB-CG2 3.87Å
1033	T	87.2	Confident	85.6	Confident	53 Å²	53	53.6 Å²	53.6	33%	0.325	28%	0.283	S	S	.	.	H	α-helix	trans	-63	-43	178.3	-58.2	0	0	0	0	111.9	R1029 V1030 V1036 Q1037	R1029-T1033 PolarHBondContact O-N 3.42Å; R1029-T1033 PolarHBondContact O-OG1 3.01Å; R1029-T1033 VanDerWaalsContact O-OG1 3.09Å; V1030-T1033 PolarHBondContact O-N 3.14Å; V1030-T1033 VanDerWaalsContact O-N 3.16Å; T1033-V1036 PolarHBondContact O-N 3.3Å; T1033-Q1037 HydrophobicContact CG2-CG 4.44Å; T1033-Q1037 WeakPolarHBondContact O-CB 3.49Å; T1033-Q1037 VanDerWaalsContact O-CG 3.32Å; T1033-Q1037 WeakPolarHBondContact O-CG 3.26Å; T1033-Q1037 PolarHBondContact O-N 2.04Å
1034	C	87	Confident	85.2	Confident	20 Å²	20	57.4 Å²	57.4	14%	0.135	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-45	175	-68	0	0	0	0	111.8	V1030 V1031 V1036 Q1037 V1038 I1093	V1030-C1034 PolarHBondContact O-N 3.48Å; V1030-C1034 PolarHBondContact O-SG 2.92Å; V1030-C1034 VanDerWaalsContact O-SG 3.32Å; V1031-C1034 PolarHBondContact O-N 2.92Å; C1034-V1036 PolarHBondContact O-N 3.13Å; C1034-Q1037 PolarHBondContact O-N 2.94Å; C1034-V1038 WeakPolarHBondContact O-CB 3.11Å; C1034-V1038 VanDerWaalsContact O-CG2 3.29Å; C1034-V1038 WeakPolarHBondContact O-CG2 3.47Å; C1034-V1038 PolarHBondContact O-N 2.74Å; C1034-I1093 HydrophobicContact CB-CG2 4.14Å
1035	I	86.4	Confident	84.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.2	-48.2	175.7	-69.1	165.1	0	0	0	110.7	L1007 V1031 K1032 Q1037 V1038 T1039 L1046 V1048 V1060 L1084 I1093	L1007-I1035 HydrophobicContact CD1-CD1 4.46Å; V1031-I1035 HydrophobicContact CG1-CD1 3.85Å; V1031-I1035 VanDerWaalsContact O-CG1 3.26Å; V1031-I1035 WeakPolarHBondContact O-CG1 2.94Å; V1031-I1035 PolarHBondContact O-N 2.93Å; K1032-I1035 PolarHBondContact O-N 2.84Å; I1035-Q1037 PolarHBondContact O-N 3.09Å; I1035-V1038 PolarHBondContact O-N 3.11Å; I1035-T1039 HydrophobicContact CG2-CG2 4.25Å; I1035-T1039 WeakPolarHBondContact O-CB 3.05Å; I1035-T1039 WeakPolarHBondContact O-CG2 3.46Å; I1035-T1039 PolarHBondContact O-N 2.98Å; I1035-T1039 PolarHBondContact O-OG1 2.83Å; I1035-L1046 HydrophobicContact CG2-CD1 3.63Å; I1035-V1048 HydrophobicContact CD1-CG2 4.44Å; I1035-V1060 HydrophobicContact CD1-CG2 4.28Å; I1035-L1084 HydrophobicContact CG1-CD1 4.42Å; I1035-L1084 HydrophobicContact CG2-CD1 3.49Å; I1035-L1084 VanDerWaalsContact CG2-CD1 3.49Å; I1035-I1093 HydrophobicContact CG1-CD1 3.96Å; I1035-I1093 HydrophobicContact CG1-CG1 4.47Å; I1035-I1093 HydrophobicContact CG1-CG2 4.12Å
1036	V	87	Confident	84.9	Confident	32 Å²	32	50.6 Å²	50.6	19%	0.194	28%	0.276	C	S	.	.	H	α-helix	trans	-59.2	-45.5	178.6	168.2	0	0	0	0	111.4	K1032 T1033 C1034 V1038 G1040 E1043 L1046	K1032-V1036 WeakPolarHBondContact O-CG2 3.45Å; K1032-V1036 PolarHBondContact O-N 3.1Å; T1033-V1036 PolarHBondContact O-N 3.3Å; C1034-V1036 PolarHBondContact O-N 3.13Å; V1036-V1038 PolarHBondContact O-N 3.04Å; V1036-G1040 WeakPolarHBondContact O-CA 3.42Å; V1036-G1040 PolarHBondContact O-N 3.1Å; V1036-E1043 HydrophobicContact CG2-CB 4.13Å; V1036-E1043 HydrophobicContact CG2-CG 4.25Å; V1036-L1046 HydrophobicContact CG2-CD1 3.83Å
1037	Q	84.6	Confident	84.8	Confident	149 Å²	149	48.8 Å²	48.8	70%	0.696	27%	0.267	S	S	*	.	H	α-helix	trans	-64	-38.1	179.8	-74.3	176.5	0.1	0	0	113.3	T1033 C1034 I1035	T1033-Q1037 HydrophobicContact CG2-CG 4.44Å; T1033-Q1037 WeakPolarHBondContact O-CB 3.49Å; T1033-Q1037 VanDerWaalsContact O-CG 3.32Å; T1033-Q1037 WeakPolarHBondContact O-CG 3.26Å; T1033-Q1037 PolarHBondContact O-N 2.04Å; C1034-Q1037 PolarHBondContact O-N 2.94Å; I1035-Q1037 PolarHBondContact O-N 3.09Å
1038	V	84.6	Confident	84.8	Confident	62 Å²	62	49.1 Å²	49.1	38%	0.376	27%	0.269	S	S	.	.	H	α-helix	trans	-82.5	-35.9	-177.3	174.2	0	0	0	0	112.4	C1034 I1035 V1036 A1087 L1092 I1093	C1034-V1038 WeakPolarHBondContact O-CB 3.11Å; C1034-V1038 VanDerWaalsContact O-CG2 3.29Å; C1034-V1038 WeakPolarHBondContact O-CG2 3.47Å; C1034-V1038 PolarHBondContact O-N 2.74Å; I1035-V1038 PolarHBondContact O-N 3.11Å; V1036-V1038 PolarHBondContact O-N 3.04Å; V1038-A1087 HydrophobicContact CG1-CB 3.82Å; V1038-L1092 HydrophobicContact CG1-CB 3.75Å; V1038-L1092 HydrophobicContact CG1-CD1 4.3Å; V1038-L1092 WeakPolarHBondContact CG2-O 3.18Å; V1038-I1093 HydrophobicContact CB-CG1 4.26Å; V1038-I1093 HydrophobicContact CG1-CG1 4.24Å; V1038-I1093 HydrophobicContact CG2-CG1 4.28Å
1039	T	82.4	Confident	84.7	Confident	21 Å²	21	51.6 Å²	51.6	13%	0.129	28%	0.279	C	S	.	.	H	α-helix	trans	-100.7	-19.9	-171.8	63.7	0	0	0	0	114.6	I1035 I1041 V1083 L1084 A1087	I1035-T1039 HydrophobicContact CG2-CG2 4.25Å; I1035-T1039 WeakPolarHBondContact O-CB 3.05Å; I1035-T1039 WeakPolarHBondContact O-CG2 3.46Å; I1035-T1039 PolarHBondContact O-N 2.98Å; I1035-T1039 PolarHBondContact O-OG1 2.83Å; T1039-I1041 HydrophobicContact CG2-CD1 4.44Å; T1039-I1041 PolarHBondContact O-N 3.5Å; T1039-I1041 WeakPolarHBondContact OG1-CD1 3.46Å; T1039-I1041 WeakPolarHBondContact OG1-CG1 3.46Å; T1039-I1041 PolarHBondContact OG1-N 3.17Å; T1039-V1083 HydrophobicContact CG2-CG1 4.32Å; T1039-L1084 HydrophobicContact CG2-CD1 4.21Å; T1039-A1087 HydrophobicContact CG2-CB 3.97Å
1040	G	79.1	Confident	84.6	Confident	69 Å²	69	45.6 Å²	45.6	71%	0.711	26%	0.257	S	S	*	.			trans	69.8	9.5	-174	0	0	0	0	0	114.9	V1036	V1036-G1040 WeakPolarHBondContact O-CA 3.42Å; V1036-G1040 PolarHBondContact O-N 3.1Å
1041	I	83.6	Confident	84.3	Confident	6 Å²	6	45.8 Å²	45.8	3%	0.031	25%	0.253	C	S	.	.			trans	-67.5	140.6	174.7	-60.3	172.9	0	0	0	109.1	T1039 E1043 Q1045 L1046 L1080 L1084	T1039-I1041 HydrophobicContact CG2-CD1 4.44Å; T1039-I1041 PolarHBondContact O-N 3.5Å; T1039-I1041 WeakPolarHBondContact OG1-CD1 3.46Å; T1039-I1041 WeakPolarHBondContact OG1-CG1 3.46Å; T1039-I1041 PolarHBondContact OG1-N 3.17Å; I1041-E1043 PolarHBondContact O-N 2.76Å; I1041-Q1045 HydrophobicContact CG2-CB 4.21Å; I1041-L1046 HydrophobicContact CB-CD1 3.91Å; I1041-L1046 HydrophobicContact CG2-CD1 3.75Å; I1041-L1046 HydrophobicContact CG2-CD2 4.34Å; I1041-L1046 HydrophobicContact CG2-CG 3.81Å; I1041-L1080 HydrophobicContact CD1-CD2 4.5Å; I1041-L1080 HydrophobicContact CG1-CD2 3.94Å; I1041-L1084 HydrophobicContact CD1-CB 4.25Å
1042	N	81.9	Confident	83.6	Confident	72 Å²	72	50.6 Å²	50.6	39%	0.385	28%	0.284	S	S	.	.			trans	-61.9	134.8	179.9	-176	-2.7	0	0	0	110.7	D1044 Q1045	N1042-D1044 PolarHBondContact O-N 3.06Å; N1042-D1044 PolarHBondContact OD1-N 3.25Å; N1042-Q1045 HydrophobicContact CB-CG 4.11Å; N1042-Q1045 WeakPolarHBondContact O-CB 3.39Å; N1042-Q1045 PolarHBondContact O-N 2.87Å
1043	E	80.4	Confident	82.9	Confident	95 Å²	95	50.8 Å²	50.8	44%	0.444	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-59.9	-31.2	-178.3	-168.6	173.3	-178.1	0	0	112.7	K1032 V1036 I1041 Q1045 L1046	K1032-E1043 HydrophobicContact CD-CG 4.49Å; K1032-E1043 WeakPolarHBondContact CE-O 3.42Å; K1032-E1043 PolarHBondContact NZ-O 2.87Å; V1036-E1043 HydrophobicContact CG2-CB 4.13Å; V1036-E1043 HydrophobicContact CG2-CG 4.25Å; I1041-E1043 PolarHBondContact O-N 2.76Å; E1043-Q1045 PolarHBondContact O-N 2.9Å; E1043-L1046 PolarHBondContact O-N 2.83Å
1044	D	77.5	Confident	82.4	Confident	125 Å²	125	54 Å²	54	67%	0.668	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-68.4	-16.9	174.6	-84.5	-20.1	0	0	0	113.9	N1042	N1042-D1044 PolarHBondContact O-N 3.06Å; N1042-D1044 PolarHBondContact OD1-N 3.25Å
1045	Q	80.3	Confident	82.2	Confident	25 Å²	25	57.1 Å²	57.1	12%	0.117	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-94.2	-2.9	-178.5	-66.2	178.5	-50.9	0	0	113.6	I1041 N1042 E1043 I1062 V1063	I1041-Q1045 HydrophobicContact CG2-CB 4.21Å; N1042-Q1045 HydrophobicContact CB-CG 4.11Å; N1042-Q1045 WeakPolarHBondContact O-CB 3.39Å; N1042-Q1045 PolarHBondContact O-N 2.87Å; E1043-Q1045 PolarHBondContact O-N 2.9Å; Q1045-I1062 WeakPolarHBondContact O-CA 3.43Å; Q1045-V1063 PolarHBondContact O-N 2.8Å
1046	L	85	Confident	82.2	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	128.5	-176.5	-71.7	168.9	0	0	0	112	K1032 I1035 V1036 I1041 E1043 V1060 F1061 I1062	K1032-L1046 WeakPolarHBondContact CD-O 3.43Å; K1032-L1046 VanDerWaalsContact CE-O 3.29Å; K1032-L1046 WeakPolarHBondContact CE-O 3.41Å; K1032-L1046 PolarHBondContact NZ-O 3.23Å; I1035-L1046 HydrophobicContact CG2-CD1 3.63Å; V1036-L1046 HydrophobicContact CG2-CD1 3.83Å; I1041-L1046 HydrophobicContact CB-CD1 3.91Å; I1041-L1046 HydrophobicContact CG2-CD1 3.75Å; I1041-L1046 HydrophobicContact CG2-CD2 4.34Å; I1041-L1046 HydrophobicContact CG2-CG 3.81Å; E1043-L1046 PolarHBondContact O-N 2.83Å; L1046-V1060 HydrophobicContact CD2-CG2 3.84Å; L1046-F1061 WeakPolarHBondContact CA-O 3.26Å; L1046-I1062 HydrophobicContact CD2-CG1 4.17Å
1047	L	85.3	Confident	82.3	Confident	44 Å²	44	56.8 Å²	56.8	23%	0.23	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	141.4	167.6	-58.5	172.1	0	0	0	108.6	V926 A997 V1060 F1061 V1063	V926-L1047 HydrophobicContact CG2-CB 4.48Å; V926-L1047 HydrophobicContact CG2-CD1 3.65Å; A997-L1047 HydrophobicContact CB-CD1 4.29Å; L1047-V1060 CarbonylContact O-C 3.56Å; L1047-V1060 WeakPolarHBondContact O-CA 3.11Å; L1047-F1061 HydrophobicContact CB-CB 4.29Å; L1047-F1061 HydrophobicContact CB-CD2 4.34Å; L1047-F1061 PolarHBondContact N-O 3.37Å; L1047-F1061 PolarHBondContact O-N 2.91Å; L1047-V1063 HydrophobicContact CD1-CG1 4.16Å
1048	V	87.1	Confident	82.4	Confident	22 Å²	22	49.7 Å²	49.7	13%	0.133	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	132.3	179.1	178.7	0	0	0	0	108.5	V1031 K1032 I1035 L1050 A1058 E1059 V1060	V1031-V1048 HydrophobicContact CB-CG1 4.42Å; V1031-V1048 HydrophobicContact CG1-CG1 4.14Å; K1032-V1048 HydrophobicContact CB-CB 4.43Å; K1032-V1048 HydrophobicContact CB-CG2 3.87Å; I1035-V1048 HydrophobicContact CD1-CG2 4.44Å; V1048-L1050 HydrophobicContact CG1-CD1 4.33Å; V1048-A1058 HydrophobicContact CG1-CB 4.41Å; V1048-E1059 WeakPolarHBondContact CA-O 3.22Å; V1048-V1060 HydrophobicContact CG2-CB 4.17Å; V1048-V1060 HydrophobicContact CG2-CG2 3.96Å
1049	K	84.8	Confident	82.6	Confident	58 Å²	58	48.6 Å²	48.6	25%	0.252	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	121.6	174	177.1	158	172.9	169.8	0	110	A923 L925 A1058 E1059 F1061	A923-K1049 PolarHBondContact O-NZ 3.41Å; L925-K1049 HydrophobicContact CB-CD 3.73Å; L925-K1049 HydrophobicContact CD2-CB 4Å; L925-K1049 HydrophobicContact CD2-CD 4.32Å; K1049-A1058 CarbonylContact O-C 3.49Å; K1049-A1058 WeakPolarHBondContact O-CA 3.09Å; K1049-A1058 WeakPolarHBondContact O-CB 3.44Å; K1049-E1059 PolarHBondContact N-O 3.45Å; K1049-E1059 PolarHBondContact O-N 2.89Å; K1049-F1061 HydrophobicContact CB-CE2 4.27Å
1050	L	86.4	Confident	82.9	Confident	8 Å²	8	47.6 Å²	47.6	4%	0.042	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	139.7	166.2	-88.3	70.1	0	0	0	109.9	F1009 W1023 R1024 I1027 V1048 T1056 T1057 A1058	F1009-L1050 HydrophobicContact CE2-CD2 4.49Å; F1009-L1050 HydrophobicContact CE2-CG 4.21Å; F1009-L1050 HydrophobicContact CZ-CD1 4.22Å; F1009-L1050 HydrophobicContact CZ-CG 4.37Å; W1023-L1050 HydrophobicContact CZ3-CD2 4.24Å; R1024-L1050 HydrophobicContact CB-CB 3.89Å; R1024-L1050 HydrophobicContact CG-CB 3.9Å; R1024-L1050 HydrophobicContact CG-CD2 4.31Å; I1027-L1050 HydrophobicContact CB-CD2 3.91Å; I1027-L1050 HydrophobicContact CG2-CD1 4.36Å; I1027-L1050 HydrophobicContact CG2-CD2 3.63Å; V1048-L1050 HydrophobicContact CG1-CD1 4.33Å; L1050-T1056 HydrophobicContact CD2-CG2 4.06Å; L1050-T1057 WeakPolarHBondContact CA-O 3.01Å; L1050-A1058 HydrophobicContact CD1-CB 3.82Å; L1050-A1058 HydrophobicContact CG-CB 4Å
1051	F	82.4	Confident	83.2	Confident	63 Å²	63	44.9 Å²	44.9	28%	0.276	25%	0.249	S	C	.	.			trans	-86.9	151.6	176.5	-65.4	-72.9	0	0	0	111.8	R1024 G1053 T1057 E1059	R1024-F1051 WeakPolarHBondContact CD-O 3.4Å; F1051-G1053 PolarHBondContact O-N 3.27Å; F1051-T1057 WeakPolarHBondContact CD2-OG1 3.35Å; F1051-T1057 PolarHBondContact N-O 3.26Å; F1051-E1059 HydrophobicContact CE2-CB 3.73Å; F1051-E1059 HydrophobicContact CZ-CB 3.78Å
1052	P	74.2	Confident	83.2	Confident	101 Å²	101	44.8 Å²	44.8	66%	0.656	25%	0.249	S	C	*	.	S	Bend	trans	-79.2	110.9	170.4	31.5	-31.3	0	0	0	110.2
1053	G	73.8	Confident	83.1	Confident	41 Å²	41	41.4 Å²	41.4	42%	0.423	23%	0.231	S	C	.	.	S	Bend	trans	167.1	176.5	176.9	0	0	0	0	0	112.9	F1051	F1051-G1053 PolarHBondContact O-N 3.27Å
1054	L	76.1	Confident	82.7	Confident	122 Å²	122	38.1 Å²	38.1	64%	0.639	22%	0.217	S	C	*	.	S	Bend	trans	-129.6	133.9	165.8	-68.4	178.3	0	0	0	108.1	D1014 N1017	D1014-L1054 HydrophobicContact CB-CD2 3.9Å; N1017-L1054 HydrophobicContact CB-CD2 4.2Å
1055	P	83.7	Confident	82.2	Confident	85 Å²	85	37.1 Å²	37.1	55%	0.552	21%	0.209	S	C	*	.	S	Bend	cis	-62.8	152.7	-3.2	30	-36.9	0	0	0	112.1	D1014 T1057	D1014-P1055 WeakPolarHBondContact OD2-CA 3.37Å; D1014-P1055 WeakPolarHBondContact OD2-CB 3.26Å; P1055-T1057 PolarHBondContact O-N 2.91Å
1056	T	87	Confident	81.2	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.24	C	C	.	.			trans	-69.8	130	179.9	-49.8	0	0	0	0	108.9	F1009 L1013 D1014 N1017 L1050	F1009-T1056 HydrophobicContact CD2-CG2 4.12Å; F1009-T1056 WeakPolarHBondContact CD2-O 3.23Å; F1009-T1056 HydrophobicContact CE2-CG2 4.38Å; L1013-T1056 HydrophobicContact CD2-CG2 3.6Å; L1013-T1056 HydrophobicContact CG-CG2 4.24Å; D1014-T1056 WeakPolarHBondContact OD1-CA 3.3Å; D1014-T1056 WeakPolarHBondContact OD1-CB 3.48Å; D1014-T1056 PolarHBondContact OD1-N 3.27Å; D1014-T1056 PolarHBondContact OD1-OG1 2.74Å; N1017-T1056 PolarHBondContact ND2-OG1 3.37Å; L1050-T1056 HydrophobicContact CD2-CG2 4.06Å
1057	T	88	Confident	79.7	Confident	25 Å²	25	57.1 Å²	57.1	15%	0.153	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	162.8	177.1	66.3	0	0	0	0	110.8	H1006 L1007 V1008 L1050 F1051 P1055	H1006-T1057 WeakPolarHBondContact NE2-CB 3.47Å; H1006-T1057 PolarHBondContact NE2-OG1 3.05Å; L1007-T1057 WeakPolarHBondContact O-CA 3.42Å; L1007-T1057 WeakPolarHBondContact O-CB 3.09Å; V1008-T1057 HydrophobicContact CG2-CG2 4.21Å; L1050-T1057 WeakPolarHBondContact CA-O 3.01Å; F1051-T1057 WeakPolarHBondContact CD2-OG1 3.35Å; F1051-T1057 PolarHBondContact N-O 3.26Å; P1055-T1057 PolarHBondContact O-N 2.91Å
1058	A	87.8	Confident	77.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	167.4	174.2	0	0	0	0	0	111.4	L1007 F1009 V1048 K1049 L1050	L1007-A1058 HydrophobicContact CB-CB 4.19Å; L1007-A1058 HydrophobicContact CD1-CB 4.42Å; L1007-A1058 PolarHBondContact N-O 2.86Å; L1007-A1058 PolarHBondContact O-N 3.43Å; F1009-A1058 HydrophobicContact CE2-CB 3.74Å; F1009-A1058 HydrophobicContact CZ-CB 3.91Å; V1048-A1058 HydrophobicContact CG1-CB 4.41Å; K1049-A1058 CarbonylContact O-C 3.49Å; K1049-A1058 WeakPolarHBondContact O-CA 3.09Å; K1049-A1058 WeakPolarHBondContact O-CB 3.44Å; L1050-A1058 HydrophobicContact CD1-CB 3.82Å; L1050-A1058 HydrophobicContact CG-CB 4Å
1059	E	88.4	Confident	76.1	Confident	39 Å²	39	68.9 Å²	68.9	18%	0.182	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	131	165.8	-171	169.2	-157.2	0	0	108.7	S1004 H1005 V1048 K1049 F1051 F1061	S1004-E1059 WeakPolarHBondContact CB-OE1 3.04Å; S1004-E1059 PolarHBondContact OG-OE1 2.82Å; H1005-E1059 WeakPolarHBondContact O-CA 3.1Å; V1048-E1059 WeakPolarHBondContact CA-O 3.22Å; K1049-E1059 PolarHBondContact N-O 3.45Å; K1049-E1059 PolarHBondContact O-N 2.89Å; F1051-E1059 HydrophobicContact CE2-CB 3.73Å; F1051-E1059 HydrophobicContact CZ-CB 3.78Å; E1059-F1061 HydrophobicContact CB-CE2 3.91Å; E1059-F1061 HydrophobicContact CB-CZ 3.84Å; E1059-F1061 VanDerWaalsContact CD-CZ 3.43Å; E1059-F1061 HydrophobicContact CG-CD1 4.46Å; E1059-F1061 HydrophobicContact CG-CD2 4.49Å; E1059-F1061 HydrophobicContact CG-CE1 3.85Å; E1059-F1061 HydrophobicContact CG-CE2 3.89Å; E1059-F1061 HydrophobicContact CG-CZ 3.53Å; E1059-F1061 WeakPolarHBondContact OE2-CZ 3.24Å
1060	V	87.8	Confident	74.1	Confident	0 Å²	0	73 Å²	73	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	131.3	170.3	57.9	0	0	0	0	109.2	S1004 H1005 L1007 I1035 L1046 L1047 V1048 L1084	S1004-V1060 CarbonylContact C-O 3.44Å; S1004-V1060 WeakPolarHBondContact CA-O 3.44Å; H1005-V1060 HydrophobicContact CB-CG1 4.02Å; H1005-V1060 PolarHBondContact N-O 2.84Å; H1005-V1060 PolarHBondContact O-N 3.29Å; L1007-V1060 HydrophobicContact CD1-CB 3.96Å; L1007-V1060 HydrophobicContact CD1-CG1 3.85Å; L1007-V1060 HydrophobicContact CD2-CG1 3.96Å; L1007-V1060 HydrophobicContact CG-CB 4.49Å; L1007-V1060 HydrophobicContact CG-CG1 3.96Å; I1035-V1060 HydrophobicContact CD1-CG2 4.28Å; L1046-V1060 HydrophobicContact CD2-CG2 3.84Å; L1047-V1060 CarbonylContact O-C 3.56Å; L1047-V1060 WeakPolarHBondContact O-CA 3.11Å; V1048-V1060 HydrophobicContact CG2-CB 4.17Å; V1048-V1060 HydrophobicContact CG2-CG2 3.96Å; V1060-L1084 HydrophobicContact CG1-CD2 4.05Å; V1060-L1084 HydrophobicContact CG2-CD2 4.44Å
1061	F	85.6	Confident	72.3	Confident	12 Å²	12	76.1 Å²	76.1	5%	0.053	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	126.6	-179.7	-51.1	-97.6	0	0	0	109.1	V926 F1002 R1003 L1046 L1047 K1049 E1059 V1063	V926-F1061 HydrophobicContact CB-CD1 3.89Å; V926-F1061 HydrophobicContact CB-CE1 4.19Å; V926-F1061 HydrophobicContact CB-CG 4.23Å; V926-F1061 HydrophobicContact CG2-CB 4.02Å; V926-F1061 HydrophobicContact CG2-CD1 3.82Å; V926-F1061 HydrophobicContact CG2-CD2 3.9Å; V926-F1061 HydrophobicContact CG2-CE1 4.27Å; V926-F1061 HydrophobicContact CG2-CE2 4.34Å; V926-F1061 HydrophobicContact CG2-CG 3.64Å; F1002-F1061 AromaticContact CD2-CD1 3.86Å; F1002-F1061 HydrophobicContact CD2-CD1 3.86Å; F1002-F1061 AromaticContact CE2-CD1 3.68Å; F1002-F1061 HydrophobicContact CE2-CD1 3.68Å; F1002-F1061 HydrophobicContact CE2-CE1 4.05Å; F1002-F1061 HydrophobicContact CZ-CD1 4.42Å; R1003-F1061 CarbonylContact O-C 3.59Å; R1003-F1061 WeakPolarHBondContact O-CA 3.43Å; L1046-F1061 WeakPolarHBondContact CA-O 3.26Å; L1047-F1061 HydrophobicContact CB-CB 4.29Å; L1047-F1061 HydrophobicContact CB-CD2 4.34Å; L1047-F1061 PolarHBondContact N-O 3.37Å; L1047-F1061 PolarHBondContact O-N 2.91Å; K1049-F1061 HydrophobicContact CB-CE2 4.27Å; E1059-F1061 HydrophobicContact CB-CE2 3.91Å; E1059-F1061 HydrophobicContact CB-CZ 3.84Å; E1059-F1061 VanDerWaalsContact CD-CZ 3.43Å; E1059-F1061 HydrophobicContact CG-CD1 4.46Å; E1059-F1061 HydrophobicContact CG-CD2 4.49Å; E1059-F1061 HydrophobicContact CG-CE1 3.85Å; E1059-F1061 HydrophobicContact CG-CE2 3.89Å; E1059-F1061 HydrophobicContact CG-CZ 3.53Å; E1059-F1061 WeakPolarHBondContact OE2-CZ 3.24Å; F1061-V1063 HydrophobicContact CB-CG1 4.41Å
1062	I	84.1	Confident	71	Confident	3 Å²	3	76 Å²	76	2%	0.015	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	118.8	170.5	-49.1	177.6	0	0	0	107.4	F1002 R1003 Q1045 L1046 W1077 D1081 L1084	F1002-I1062 WeakPolarHBondContact CA-O 3.41Å; F1002-I1062 WeakPolarHBondContact CB-O 3.48Å; R1003-I1062 PolarHBondContact N-O 2.83Å; R1003-I1062 VanDerWaalsContact N-O 3.16Å; R1003-I1062 PolarHBondContact O-N 2.75Å; Q1045-I1062 WeakPolarHBondContact O-CA 3.43Å; L1046-I1062 HydrophobicContact CD2-CG1 4.17Å; I1062-W1077 HydrophobicContact CB-CZ3 4.42Å; I1062-W1077 HydrophobicContact CG2-CE3 4.2Å; I1062-W1077 HydrophobicContact CG2-CZ3 3.93Å; I1062-D1081 HydrophobicContact CD1-CB 4.5Å; I1062-L1084 HydrophobicContact CD1-CD2 3.85Å; I1062-L1084 HydrophobicContact CG1-CD2 4.15Å
1063	V	79	Confident	70	Confident	1 Å²	1	74.8 Å²	74.8	1%	0.006	39%	0.393	C	S	.	.			trans	-118.6	156.2	-173	-62.7	0	0	0	0	112.9	V926 Y999 F1002 Q1045 L1047 F1061	V926-V1063 HydrophobicContact CG1-CG1 4.32Å; Y999-V1063 HydrophobicContact CD2-CB 4.34Å; Y999-V1063 HydrophobicContact CD2-CG1 4.01Å; Y999-V1063 HydrophobicContact CE1-CB 4.16Å; Y999-V1063 HydrophobicContact CE2-CB 3.92Å; Y999-V1063 HydrophobicContact CE2-CG1 3.69Å; Y999-V1063 HydrophobicContact CE2-CG2 4.38Å; F1002-V1063 HydrophobicContact CB-CG1 4.19Å; Q1045-V1063 PolarHBondContact O-N 2.8Å; L1047-V1063 HydrophobicContact CD1-CG1 4.16Å; F1061-V1063 HydrophobicContact CB-CG1 4.41Å
1064	P	72.1	Confident	69.1	Low	26 Å²	26	78.7 Å²	78.7	17%	0.169	40%	0.404	C	S	.	.			trans	-66.6	147.9	-170.9	-21.5	32.7	0	0	0	115.2	Y999 Y1001 R1066 W1077	Y999-P1064 HydrophobicContact CD1-CG 4.28Å; Y1001-P1064 WeakPolarHBondContact O-CD 3.34Å; Y1001-P1064 WeakPolarHBondContact O-CG 3.38Å; P1064-R1066 PolarHBondContact O-N 2.79Å; P1064-W1077 HydrophobicContact CB-CH2 4.09Å; P1064-W1077 HydrophobicContact CB-CZ2 3.9Å; P1064-W1077 HydrophobicContact CG-CH2 3.78Å; P1064-W1077 HydrophobicContact CG-CZ2 4Å
1065	E	67.8	Low	68.2	Low	104 Å²	104	81.1 Å²	81.1	49%	0.486	41%	0.412	S	S	.	.			trans	-69.9	124.4	169.6	-152.6	174.6	-174.7	0	0	110	R1067 S1068	E1065-R1067 PolarHBondContact O-N 3.13Å; E1065-S1068 PolarHBondContact O-N 2.95Å
1066	R	58	Low	67.3	Low	205 Å²	205	84.5 Å²	84.5	77%	0.774	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	7.2	-169.2	-83.7	179.5	165.5	164.8	-3.3	117.4	P1064	P1064-R1066 PolarHBondContact O-N 2.79Å
1067	R	54.4	Low	66.3	Low	240 Å²	240	85.6 Å²	85.6	91%	0.906	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.4	1.8	-171.3	-69.2	-170.3	174.6	175.3	-0.3	116.8	E1065 R1069	E1065-R1067 PolarHBondContact O-N 3.13Å; R1067-R1069 PolarHBondContact O-N 3.42Å
1068	S	47.3	Very low	65.1	Low	58 Å²	58	86.6 Å²	86.6	41%	0.406	43%	0.433	S	S	.	.			trans	-89.8	85.2	-176.9	60.8	0	0	0	0	114.1	E1065 D1070	E1065-S1068 PolarHBondContact O-N 2.95Å; S1068-D1070 VanDerWaalsContact C-N 3.35Å; S1068-D1070 PolarHBondContact O-N 3.39Å
1069	R	48.9	Very low	64.4	Low	255 Å²	255	92.3 Å²	92.3	96%	0.962	46%	0.46	S	S	*	.			trans	-84.7	72.5	161.1	-85.4	-173.2	168.4	-174.7	-3.1	110.7	R1067	R1067-R1069 PolarHBondContact O-N 3.42Å
1070	D	43.5	Very low	63.7	Low	144 Å²	144	92.5 Å²	92.5	77%	0.77	46%	0.461	S	S	*	.	S	Bend	trans	-155.1	155.4	167.3	-149.2	-16.7	0	0	0	112.5	S1068 G1072	S1068-D1070 VanDerWaalsContact C-N 3.35Å; S1068-D1070 PolarHBondContact O-N 3.39Å; D1070-G1072 VanDerWaalsContact C-N 3.29Å; D1070-G1072 PolarHBondContact O-N 2.68Å
1071	G	49.4	Very low	63.1	Low	74 Å²	74	93.2 Å²	93.2	76%	0.763	47%	0.465	S	S	*	.	S	Bend	trans	-74.6	-2.5	-166.7	0	0	0	0	0	116.7	M1073	G1071-M1073 PolarHBondContact O-N 2.66Å
1072	G	53.9	Low	62.7	Low	60 Å²	60	99.2 Å²	99.2	62%	0.619	49%	0.494	S	S	*	.			trans	-75.4	28.3	-176.8	0	0	0	0	0	115.7	D1070	D1070-G1072 VanDerWaalsContact C-N 3.29Å; D1070-G1072 PolarHBondContact O-N 2.68Å
1073	M	52.8	Low	62.6	Low	76 Å²	76	101 Å²	101	37%	0.374	51%	0.505	S	S	.	.	H	α-helix	trans	-79.1	-20.6	-160	-158.4	72	105.2	0	0	115.2	G1071 W1077	G1071-M1073 PolarHBondContact O-N 2.66Å; M1073-W1077 HydrophobicContact SD-CZ2 4.41Å; M1073-W1077 PolarHBondContact SD-NE1 3.24Å
1074	N	55.2	Low	62.8	Low	123 Å²	123	101 Å²	101	66%	0.658	51%	0.505	S	S	*	.	H	α-helix	trans	-84.8	-38.5	-173.3	-97.5	-26.5	0	0	0	115.1	W1077 A1078	N1074-W1077 PolarHBondContact O-N 2.87Å; N1074-A1078 PolarHBondContact O-N 2.89Å; N1074-A1078 VanDerWaalsContact O-N 3.08Å
1075	E	57.8	Low	63.2	Low	173 Å²	173	102 Å²	102	81%	0.808	51%	0.508	S	S	*	.	H	α-helix	trans	-75.1	-45.4	-170	-63.6	-173.6	148.5	0	0	113	W1077 A1078 H1079	E1075-W1077 PolarHBondContact O-N 3.48Å; E1075-A1078 PolarHBondContact O-N 2.73Å; E1075-H1079 PolarHBondContact O-N 3.43Å; E1075-H1079 VanDerWaalsContact O-N 3.1Å
1076	K	63.6	Low	63.8	Low	157 Å²	157	99.5 Å²	99.5	68%	0.683	50%	0.502	S	S	*	.	H	α-helix	trans	-56.6	-36	173.9	-92.7	-172.4	170.2	-172.9	0	112.4	H1079 L1080	K1076-H1079 WeakPolarHBondContact O-CB 3.44Å; K1076-H1079 PolarHBondContact O-N 2.92Å; K1076-L1080 WeakPolarHBondContact O-CG 3.36Å; K1076-L1080 PolarHBondContact O-N 3.39Å
1077	W	66.3	Low	64.9	Low	23 Å²	23	90 Å²	90	9%	0.087	47%	0.467	C	S	.	.	H	α-helix	trans	-78.7	-39	-176.7	-77	72.4	0	0	0	112.9	I1062 P1064 M1073 N1074 E1075 H1079 L1080 D1081	I1062-W1077 HydrophobicContact CB-CZ3 4.42Å; I1062-W1077 HydrophobicContact CG2-CE3 4.2Å; I1062-W1077 HydrophobicContact CG2-CZ3 3.93Å; P1064-W1077 HydrophobicContact CB-CH2 4.09Å; P1064-W1077 HydrophobicContact CB-CZ2 3.9Å; P1064-W1077 HydrophobicContact CG-CH2 3.78Å; P1064-W1077 HydrophobicContact CG-CZ2 4Å; M1073-W1077 HydrophobicContact SD-CZ2 4.41Å; M1073-W1077 PolarHBondContact SD-NE1 3.24Å; N1074-W1077 PolarHBondContact O-N 2.87Å; E1075-W1077 PolarHBondContact O-N 3.48Å; W1077-H1079 PolarHBondContact O-N 3.21Å; W1077-L1080 PolarHBondContact O-N 3.29Å; W1077-D1081 WeakPolarHBondContact O-CB 3.29Å; W1077-D1081 PolarHBondContact O-N 2.78Å
1078	A	64	Low	66.2	Low	45 Å²	45	78.7 Å²	78.7	37%	0.372	43%	0.425	S	S	.	.	H	α-helix	trans	-57.7	-36.8	168.3	0	0	0	0	0	111.3	N1074 E1075 Q1082	N1074-A1078 PolarHBondContact O-N 2.89Å; N1074-A1078 VanDerWaalsContact O-N 3.08Å; E1075-A1078 PolarHBondContact O-N 2.73Å; A1078-Q1082 WeakPolarHBondContact O-CB 3.03Å; A1078-Q1082 PolarHBondContact O-N 2.88Å
1079	H	71.9	Confident	67.7	Low	121 Å²	121	78.9 Å²	78.9	56%	0.56	42%	0.421	S	S	*	.	H	α-helix	trans	-67.6	-48.3	175.3	-172.1	56.7	0	0	0	113.2	E1075 K1076 W1077 D1081 Q1082 V1083	E1075-H1079 PolarHBondContact O-N 3.43Å; E1075-H1079 VanDerWaalsContact O-N 3.1Å; K1076-H1079 WeakPolarHBondContact O-CB 3.44Å; K1076-H1079 PolarHBondContact O-N 2.92Å; W1077-H1079 PolarHBondContact O-N 3.21Å; H1079-D1081 PolarHBondContact O-N 3.25Å; H1079-Q1082 PolarHBondContact O-N 2.9Å; H1079-V1083 WeakPolarHBondContact O-CG2 3.05Å; H1079-V1083 PolarHBondContact O-N 3.35Å
1080	L	74.8	Confident	69.2	Low	42 Å²	42	72.8 Å²	72.8	22%	0.22	40%	0.404	C	S	.	.	H	α-helix	trans	-60.9	-44.1	178	-70.5	164.8	0	0	0	112.5	I1041 K1076 W1077 V1083 L1084	I1041-L1080 HydrophobicContact CD1-CD2 4.5Å; I1041-L1080 HydrophobicContact CG1-CD2 3.94Å; K1076-L1080 WeakPolarHBondContact O-CG 3.36Å; K1076-L1080 PolarHBondContact O-N 3.39Å; W1077-L1080 PolarHBondContact O-N 3.29Å; L1080-V1083 PolarHBondContact O-N 2.95Å; L1080-L1084 PolarHBondContact O-N 2.88Å
1081	D	74.6	Confident	70.7	Confident	16 Å²	16	69.3 Å²	69.3	9%	0.086	39%	0.385	C	S	.	.	H	α-helix	trans	-60.2	-48.7	174.4	-178	-18.1	0	0	0	110.8	R1003 H1005 I1062 W1077 H1079 V1083 L1084 L1085	R1003-D1081 WeakPolarHBondContact CD-OD2 3.49Å; R1003-D1081 IonicContact CZ-OD2 2.68Å; R1003-D1081 IonicContact NE-OD2 3.74Å; R1003-D1081 IonicContact NH1-OD2 3.33Å; R1003-D1081 PolarHBondContact NH1-OD2 3.45Å; H1005-D1081 IonicContact NE2-OD1 2.71Å; H1005-D1081 PolarHBondContact NE2-OD1 2.81Å; H1005-D1081 IonicContact NE2-OD2 3.65Å; H1005-D1081 PolarHBondContact NE2-OD2 3.38Å; I1062-D1081 HydrophobicContact CD1-CB 4.5Å; W1077-D1081 WeakPolarHBondContact O-CB 3.29Å; W1077-D1081 PolarHBondContact O-N 2.78Å; H1079-D1081 PolarHBondContact O-N 3.25Å; D1081-V1083 VanDerWaalsContact C-N 3.31Å; D1081-V1083 PolarHBondContact O-N 3.36Å; D1081-L1084 PolarHBondContact O-N 2.84Å; D1081-L1085 WeakPolarHBondContact O-CB 3.46Å; D1081-L1085 WeakPolarHBondContact O-CG 3.43Å; D1081-L1085 PolarHBondContact O-N 2.04Å; D1081-L1085 WeakPolarHBondContact OD1-CD1 3.4Å
1082	Q	78	Confident	72	Confident	138 Å²	138	70 Å²	70	65%	0.645	37%	0.371	S	S	*	.	H	α-helix	trans	-65.1	-30.2	177.7	-170	172.1	9.3	0	0	113.4	A1078 H1079 S1086	A1078-Q1082 WeakPolarHBondContact O-CB 3.03Å; A1078-Q1082 PolarHBondContact O-N 2.88Å; H1079-Q1082 PolarHBondContact O-N 2.9Å; Q1082-S1086 VanDerWaalsContact O-CB 3.26Å; Q1082-S1086 WeakPolarHBondContact O-CB 3.13Å; Q1082-S1086 PolarHBondContact O-N 2.8Å; Q1082-S1086 PolarHBondContact O-OG 2.96Å
1083	V	82.3	Confident	73.5	Confident	41 Å²	41	67.1 Å²	67.1	25%	0.248	34%	0.342	C	S	.	.	H	α-helix	trans	-71	-46	172	167.5	0	0	0	0	111.2	T1039 H1079 L1080 D1081 S1086 A1087	T1039-V1083 HydrophobicContact CG2-CG1 4.32Å; H1079-V1083 WeakPolarHBondContact O-CG2 3.05Å; H1079-V1083 PolarHBondContact O-N 3.35Å; L1080-V1083 PolarHBondContact O-N 2.95Å; D1081-V1083 VanDerWaalsContact C-N 3.31Å; D1081-V1083 PolarHBondContact O-N 3.36Å; V1083-S1086 PolarHBondContact O-N 3.35Å; V1083-S1086 PolarHBondContact O-OG 2.86Å; V1083-A1087 PolarHBondContact O-N 2.96Å; V1083-A1087 VanDerWaalsContact O-N 3.07Å
1084	L	82.8	Confident	75.1	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-61.1	-47	176.5	178.9	62.2	0	0	0	111.3	I1035 T1039 I1041 V1060 I1062 L1080 D1081 S1086 A1087 L1088	I1035-L1084 HydrophobicContact CG1-CD1 4.42Å; I1035-L1084 HydrophobicContact CG2-CD1 3.49Å; I1035-L1084 VanDerWaalsContact CG2-CD1 3.49Å; T1039-L1084 HydrophobicContact CG2-CD1 4.21Å; I1041-L1084 HydrophobicContact CD1-CB 4.25Å; V1060-L1084 HydrophobicContact CG1-CD2 4.05Å; V1060-L1084 HydrophobicContact CG2-CD2 4.44Å; I1062-L1084 HydrophobicContact CD1-CD2 3.85Å; I1062-L1084 HydrophobicContact CG1-CD2 4.15Å; L1080-L1084 PolarHBondContact O-N 2.88Å; D1081-L1084 PolarHBondContact O-N 2.84Å; L1084-S1086 VanDerWaalsContact C-N 3.34Å; L1084-S1086 PolarHBondContact O-N 2.73Å; L1084-A1087 PolarHBondContact O-N 2.72Å; L1084-L1088 HydrophobicContact CD1-CD1 3.91Å; L1084-L1088 HydrophobicContact CD1-CG 4.4Å; L1084-L1088 HydrophobicContact CG-CD1 3.86Å; L1084-L1088 WeakPolarHBondContact O-CB 3.47Å; L1084-L1088 WeakPolarHBondContact O-CG 3.38Å; L1084-L1088 PolarHBondContact O-N 2.97Å
1085	L	80.1	Confident	76.7	Confident	48 Å²	48	62.9 Å²	62.9	25%	0.251	32%	0.316	S	S	.	.	H	α-helix	trans	-65.1	-35.1	176.3	-72.6	178	0	0	0	112.2	D1081 L1088 N1089 A1107	D1081-L1085 WeakPolarHBondContact O-CB 3.46Å; D1081-L1085 WeakPolarHBondContact O-CG 3.43Å; D1081-L1085 PolarHBondContact O-N 2.04Å; D1081-L1085 WeakPolarHBondContact OD1-CD1 3.4Å; L1085-L1088 PolarHBondContact O-N 2.88Å; L1085-N1089 VanDerWaalsContact O-CB 3.3Å; L1085-N1089 WeakPolarHBondContact O-CB 3.36Å; L1085-N1089 PolarHBondContact O-N 3.2Å; L1085-N1089 PolarHBondContact O-ND2 3.07Å; L1085-A1107 HydrophobicContact CD2-CB 3.93Å
1086	S	80.4	Confident	78	Confident	51 Å²	51	59.4 Å²	59.4	36%	0.357	31%	0.307	S	S	.	.	H	α-helix	trans	-67	-41.1	177	73.9	0	0	0	0	111.8	Q1082 V1083 L1084 N1089 Q1090	Q1082-S1086 VanDerWaalsContact O-CB 3.26Å; Q1082-S1086 WeakPolarHBondContact O-CB 3.13Å; Q1082-S1086 PolarHBondContact O-N 2.8Å; Q1082-S1086 PolarHBondContact O-OG 2.96Å; V1083-S1086 PolarHBondContact O-N 3.35Å; V1083-S1086 PolarHBondContact O-OG 2.86Å; L1084-S1086 VanDerWaalsContact C-N 3.34Å; L1084-S1086 PolarHBondContact O-N 2.73Å; S1086-N1089 PolarHBondContact O-N 3.47Å; S1086-Q1090 WeakPolarHBondContact O-CB 3.45Å; S1086-Q1090 VanDerWaalsContact O-CG 3.24Å; S1086-Q1090 WeakPolarHBondContact O-CG 3.27Å; S1086-Q1090 PolarHBondContact O-N 3.36Å; S1086-Q1090 VanDerWaalsContact O-N 3.16Å
1087	A	80.8	Confident	79	Confident	5 Å²	5	54.1 Å²	54.1	4%	0.041	29%	0.286	C	S	.	.	H	α-helix	trans	-62.6	-45.5	174.1	0	0	0	0	0	112.5	V1038 T1039 V1083 L1084 N1089 Q1090 D1091 L1092 I1093	V1038-A1087 HydrophobicContact CG1-CB 3.82Å; T1039-A1087 HydrophobicContact CG2-CB 3.97Å; V1083-A1087 PolarHBondContact O-N 2.96Å; V1083-A1087 VanDerWaalsContact O-N 3.07Å; L1084-A1087 PolarHBondContact O-N 2.72Å; A1087-N1089 VanDerWaalsContact C-N 3.27Å; A1087-N1089 PolarHBondContact O-N 3.08Å; A1087-Q1090 PolarHBondContact O-N 3.03Å; A1087-D1091 PolarHBondContact O-N 2.86Å; A1087-L1092 PolarHBondContact O-N 2.86Å; A1087-I1093 HydrophobicContact CB-CD1 3.84Å; A1087-I1093 HydrophobicContact CB-CG1 4.47Å
1088	L	82.4	Confident	79.6	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-72.1	-12.3	178.1	-71.1	167.3	0	0	0	114.7	L1007 L1084 L1085 I1093 V1105 A1107	L1007-L1088 HydrophobicContact CD2-CD1 3.58Å; L1007-L1088 HydrophobicContact CD2-CD2 3.93Å; L1007-L1088 HydrophobicContact CD2-CG 4.43Å; L1084-L1088 HydrophobicContact CD1-CD1 3.91Å; L1084-L1088 HydrophobicContact CD1-CG 4.4Å; L1084-L1088 HydrophobicContact CG-CD1 3.86Å; L1084-L1088 WeakPolarHBondContact O-CB 3.47Å; L1084-L1088 WeakPolarHBondContact O-CG 3.38Å; L1084-L1088 PolarHBondContact O-N 2.97Å; L1085-L1088 PolarHBondContact O-N 2.88Å; L1088-I1093 HydrophobicContact CD2-CB 4.36Å; L1088-I1093 HydrophobicContact CD2-CD1 3.5Å; L1088-I1093 HydrophobicContact CG-CD1 3.66Å; L1088-V1105 HydrophobicContact CD2-CB 4.39Å; L1088-V1105 HydrophobicContact CD2-CG1 4.17Å; L1088-V1105 WeakPolarHBondContact CD2-O 3.46Å; L1088-A1107 HydrophobicContact CB-CB 3.75Å; L1088-A1107 HydrophobicContact CD1-CB 4.02Å; L1088-A1107 HydrophobicContact CG-CB 4.46Å
1089	N	79.1	Confident	80.2	Confident	62 Å²	62	62.9 Å²	62.9	33%	0.332	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	1.4	173.2	-78.2	-107.3	0	0	0	112.5	L1085 S1086 A1087 R1109	L1085-N1089 VanDerWaalsContact O-CB 3.3Å; L1085-N1089 WeakPolarHBondContact O-CB 3.36Å; L1085-N1089 PolarHBondContact O-N 3.2Å; L1085-N1089 PolarHBondContact O-ND2 3.07Å; S1086-N1089 PolarHBondContact O-N 3.47Å; A1087-N1089 VanDerWaalsContact C-N 3.27Å; A1087-N1089 PolarHBondContact O-N 3.08Å; N1089-R1109 VanDerWaalsContact OD1-CZ 3.26Å; N1089-R1109 PolarHBondContact OD1-NE 3.09Å; N1089-R1109 PolarHBondContact OD1-NH2 3.37Å
1090	Q	78.7	Confident	80.4	Confident	127 Å²	127	61.2 Å²	61.2	59%	0.593	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117	13.2	176	-70.6	176.9	17.5	0	0	111.6	S1086 A1087 L1092	S1086-Q1090 WeakPolarHBondContact O-CB 3.45Å; S1086-Q1090 VanDerWaalsContact O-CG 3.24Å; S1086-Q1090 WeakPolarHBondContact O-CG 3.27Å; S1086-Q1090 PolarHBondContact O-N 3.36Å; S1086-Q1090 VanDerWaalsContact O-N 3.16Å; A1087-Q1090 PolarHBondContact O-N 3.03Å; Q1090-L1092 HydrophobicContact CB-CD1 4.12Å; Q1090-L1092 HydrophobicContact CB-CG 3.84Å; Q1090-L1092 PolarHBondContact O-N 3.09Å
1091	D	75.6	Confident	80.7	Confident	72 Å²	72	61.3 Å²	61.3	39%	0.385	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	21.4	179.5	-57.3	-3.5	0	0	0	114.6	A1087 I1093 Y1106	A1087-D1091 PolarHBondContact O-N 2.86Å; D1091-I1093 PolarHBondContact O-N 3.46Å; D1091-Y1106 WeakPolarHBondContact OD1-CD1 3.48Å; D1091-Y1106 WeakPolarHBondContact OD1-CE1 3.01Å
1092	L	77.8	Confident	81.2	Confident	87 Å²	87	64.6 Å²	64.6	46%	0.455	36%	0.361	S	S	.	.			trans	-74.1	-8.3	-174.4	-61.1	179.9	0	0	0	114.1	V1038 A1087 Q1090	V1038-L1092 HydrophobicContact CG1-CB 3.75Å; V1038-L1092 HydrophobicContact CG1-CD1 4.3Å; V1038-L1092 WeakPolarHBondContact CG2-O 3.18Å; A1087-L1092 PolarHBondContact O-N 2.86Å; Q1090-L1092 HydrophobicContact CB-CD1 4.12Å; Q1090-L1092 HydrophobicContact CB-CG 3.84Å; Q1090-L1092 PolarHBondContact O-N 3.09Å
1093	I	84.1	Confident	81.6	Confident	1 Å²	1	58 Å²	58	1%	0.005	33%	0.33	C	S	.	.			trans	-107.8	93.3	-177.6	-64.4	155.2	0	0	0	107.8	C1034 I1035 V1038 A1087 L1088 D1091 V1105	C1034-I1093 HydrophobicContact CB-CG2 4.14Å; I1035-I1093 HydrophobicContact CG1-CD1 3.96Å; I1035-I1093 HydrophobicContact CG1-CG1 4.47Å; I1035-I1093 HydrophobicContact CG1-CG2 4.12Å; V1038-I1093 HydrophobicContact CB-CG1 4.26Å; V1038-I1093 HydrophobicContact CG1-CG1 4.24Å; V1038-I1093 HydrophobicContact CG2-CG1 4.28Å; A1087-I1093 HydrophobicContact CB-CD1 3.84Å; A1087-I1093 HydrophobicContact CB-CG1 4.47Å; L1088-I1093 HydrophobicContact CD2-CB 4.36Å; L1088-I1093 HydrophobicContact CD2-CD1 3.5Å; L1088-I1093 HydrophobicContact CG-CD1 3.66Å; D1091-I1093 PolarHBondContact O-N 3.46Å; I1093-V1105 HydrophobicContact CB-CB 4.4Å; I1093-V1105 HydrophobicContact CG2-CB 3.88Å; I1093-V1105 HydrophobicContact CG2-CG2 3.9Å; I1093-V1105 PolarHBondContact O-N 3.37Å
1094	E	86.9	Confident	81.8	Confident	91 Å²	91	57.4 Å²	57.4	43%	0.425	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	152.1	-178	49.8	163.3	-116.3	0	0	111	Q1102 V1103	E1094-Q1102 HydrophobicContact CB-CG 4.49Å; E1094-Q1102 PolarHBondContact OE1-NE2 3.45Å; E1094-Q1102 PolarHBondContact OE2-NE2 2.03Å; E1094-V1103 CarbonylContact C-O 3.57Å; E1094-V1103 VanDerWaalsContact CA-O 3.28Å; E1094-V1103 WeakPolarHBondContact CA-O 3.48Å
1095	F	88.2	Confident	82	Confident	18 Å²	18	57.4 Å²	57.4	8%	0.079	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	151.3	175.4	64.1	-80.4	0	0	0	112	F1009 I1027 V1030 V1031 I1097 V1103 V1105	F1009-F1095 HydrophobicContact CD1-CE1 4.3Å; F1009-F1095 HydrophobicContact CE1-CE1 4.18Å; F1009-F1095 HydrophobicContact CE1-CZ 4.45Å; I1027-F1095 HydrophobicContact CD1-CE2 4.12Å; I1027-F1095 HydrophobicContact CG2-CE2 4.34Å; I1027-F1095 HydrophobicContact CG2-CZ 3.97Å; V1030-F1095 HydrophobicContact CG1-CB 3.9Å; V1030-F1095 HydrophobicContact CG1-CD1 4.42Å; V1030-F1095 HydrophobicContact CG1-CD2 3.71Å; V1030-F1095 HydrophobicContact CG1-CE2 4.3Å; V1030-F1095 HydrophobicContact CG1-CG 3.77Å; V1031-F1095 HydrophobicContact CG2-CE1 3.83Å; V1031-F1095 HydrophobicContact CG2-CZ 4.21Å; F1095-I1097 HydrophobicContact CD2-CG1 3.89Å; F1095-I1097 HydrophobicContact CE2-CD1 3.78Å; F1095-I1097 HydrophobicContact CE2-CG1 3.57Å; F1095-I1097 HydrophobicContact CZ-CD1 4.46Å; F1095-V1103 HydrophobicContact CD1-CB 4.38Å; F1095-V1103 HydrophobicContact CD1-CG1 4.42Å; F1095-V1103 HydrophobicContact CE1-CB 4.03Å; F1095-V1103 HydrophobicContact CE1-CG1 3.66Å; F1095-V1103 HydrophobicContact CE2-CB 4.26Å; F1095-V1103 HydrophobicContact CE2-CG1 4.41Å; F1095-V1103 HydrophobicContact CZ-CB 3.97Å; F1095-V1103 HydrophobicContact CZ-CG1 3.66Å; F1095-V1103 PolarHBondContact N-O 2.84Å; F1095-V1103 PolarHBondContact O-N 3.26Å; F1095-V1105 HydrophobicContact CD1-CG2 4.27Å; F1095-V1105 HydrophobicContact CE1-CG2 3.91Å
1096	T	86.4	Confident	82.1	Confident	100 Å²	100	59.2 Å²	59.2	61%	0.613	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101	121.9	176.7	25.6	0	0	0	0	111.5	L1101 Q1102	T1096-L1101 WeakPolarHBondContact CA-O 3.42Å; T1096-Q1102 HydrophobicContact CG2-CB 4.31Å
1097	I	82.7	Confident	82.1	Confident	47 Å²	47	57.5 Å²	57.5	24%	0.241	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-35.2	177.4	-60.8	179.8	0	0	0	111.2	L1013 M1016 I1027 F1095 L1101 V1103	L1013-I1097 HydrophobicContact CD1-CD1 3.4Å; L1013-I1097 VanDerWaalsContact CD1-CD1 3.4Å; M1016-I1097 HydrophobicContact CE-CG2 4.47Å; I1027-I1097 HydrophobicContact CD1-CD1 4.41Å; F1095-I1097 HydrophobicContact CD2-CG1 3.89Å; F1095-I1097 HydrophobicContact CE2-CD1 3.78Å; F1095-I1097 HydrophobicContact CE2-CG1 3.57Å; F1095-I1097 HydrophobicContact CZ-CD1 4.46Å; I1097-L1101 PolarHBondContact N-O 3.02Å; I1097-V1103 HydrophobicContact CD1-CG2 3.66Å; I1097-V1103 HydrophobicContact CG1-CG2 4.15Å
1098	K	80.4	Confident	81.7	Confident	113 Å²	113	60.5 Å²	60.5	49%	0.491	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	156.8	173.9	-72.2	177.9	179	169	0	108.7	M1016 G1100 L1101	M1016-K1098 HydrophobicContact CE-CD 4.42Å; M1016-K1098 HydrophobicContact SD-CD 4.45Å; K1098-G1100 PolarHBondContact O-N 2.91Å; K1098-G1100 VanDerWaalsContact O-N 3.14Å; K1098-L1101 HydrophobicContact CB-CB 4.31Å; K1098-L1101 PolarHBondContact O-N 2.97Å
1099	P	76.4	Confident	80.2	Confident	138 Å²	138	69.9 Å²	69.9	90%	0.896	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	121.4	172.7	-25.6	35.1	0	0	0	111
1100	G	75.5	Confident	78.2	Confident	86 Å²	86	75 Å²	75	89%	0.887	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	-2.3	-177	0	0	0	0	0	116.3	K1098	K1098-G1100 PolarHBondContact O-N 2.91Å; K1098-G1100 VanDerWaalsContact O-N 3.14Å
1101	L	81.7	Confident	75.7	Confident	44 Å²	44	74.7 Å²	74.7	23%	0.23	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	96.5	175.5	-168.5	73.5	0	0	0	111	N1012 M1016 T1096 I1097 K1098	N1012-L1101 HydrophobicContact CB-CD1 3.93Å; N1012-L1101 HydrophobicContact CB-CG 4.36Å; M1016-L1101 HydrophobicContact CG-CD2 3.76Å; M1016-L1101 HydrophobicContact SD-CD2 4.45Å; T1096-L1101 WeakPolarHBondContact CA-O 3.42Å; I1097-L1101 PolarHBondContact N-O 3.02Å; K1098-L1101 HydrophobicContact CB-CB 4.31Å; K1098-L1101 PolarHBondContact O-N 2.97Å
1102	Q	84.1	Confident	73.8	Confident	85 Å²	85	77 Å²	77	40%	0.397	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	140.7	178.3	-163	171.2	22.4	0	0	110	N1012 E1094 T1096	N1012-Q1102 PolarHBondContact ND2-O 2.72Å; E1094-Q1102 HydrophobicContact CB-CG 4.49Å; E1094-Q1102 PolarHBondContact OE1-NE2 3.45Å; E1094-Q1102 PolarHBondContact OE2-NE2 2.03Å; T1096-Q1102 HydrophobicContact CG2-CB 4.31Å
1103	V	87.2	Confident	71.4	Confident	0 Å²	0	77 Å²	77	0%	0	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	126.6	177	173.1	0	0	0	0	108.9	F1009 S1010 N1012 L1013 E1094 F1095 I1097	F1009-V1103 HydrophobicContact CB-CG1 4.27Å; F1009-V1103 HydrophobicContact CD1-CG1 4.01Å; S1010-V1103 WeakPolarHBondContact OG-CA 3.34Å; N1012-V1103 HydrophobicContact CB-CG2 4.03Å; L1013-V1103 HydrophobicContact CB-CG1 4.04Å; L1013-V1103 HydrophobicContact CB-CG2 4.23Å; E1094-V1103 CarbonylContact C-O 3.57Å; E1094-V1103 VanDerWaalsContact CA-O 3.28Å; E1094-V1103 WeakPolarHBondContact CA-O 3.48Å; F1095-V1103 HydrophobicContact CD1-CB 4.38Å; F1095-V1103 HydrophobicContact CD1-CG1 4.42Å; F1095-V1103 HydrophobicContact CE1-CB 4.03Å; F1095-V1103 HydrophobicContact CE1-CG1 3.66Å; F1095-V1103 HydrophobicContact CE2-CB 4.26Å; F1095-V1103 HydrophobicContact CE2-CG1 4.41Å; F1095-V1103 HydrophobicContact CZ-CB 3.97Å; F1095-V1103 HydrophobicContact CZ-CG1 3.66Å; F1095-V1103 PolarHBondContact N-O 2.84Å; F1095-V1103 PolarHBondContact O-N 3.26Å; I1097-V1103 HydrophobicContact CD1-CG2 3.66Å; I1097-V1103 HydrophobicContact CG1-CG2 4.15Å
1104	N	85.9	Confident	69.1	Low	29 Å²	29	81.6 Å²	81.6	16%	0.155	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	146.9	-179.3	-66.3	41.5	0	0	0	109.8	F1009 S1010 Y1106	F1009-N1104 WeakPolarHBondContact CA-O 3.07Å; S1010-N1104 PolarHBondContact N-O 3.21Å; S1010-N1104 PolarHBondContact OG-N 3.31Å; N1104-Y1106 HydrophobicContact CB-CE1 4.23Å; N1104-Y1106 HydrophobicContact CB-CE2 3.89Å; N1104-Y1106 WeakPolarHBondContact CB-OH 3.15Å
1105	V	86.8	Confident	66.4	Low	0 Å²	0	84.4 Å²	84.4	0%	0	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.1	-175.5	-166	0	0	0	0	110.4	L1007 F1009 V1031 L1088 I1093 F1095	L1007-V1105 HydrophobicContact CB-CG1 4.07Å; L1007-V1105 HydrophobicContact CD1-CG1 4.05Å; L1007-V1105 HydrophobicContact CD2-CG1 4.37Å; L1007-V1105 HydrophobicContact CG-CG1 4.4Å; F1009-V1105 HydrophobicContact CD1-CB 4.42Å; F1009-V1105 HydrophobicContact CD1-CG1 4.23Å; F1009-V1105 HydrophobicContact CD1-CG2 3.78Å; F1009-V1105 HydrophobicContact CE1-CB 4.37Å; F1009-V1105 HydrophobicContact CE1-CG1 3.9Å; F1009-V1105 HydrophobicContact CE1-CG2 3.65Å; F1009-V1105 HydrophobicContact CZ-CG1 4.48Å; V1031-V1105 HydrophobicContact CG2-CG2 4.47Å; L1088-V1105 HydrophobicContact CD2-CB 4.39Å; L1088-V1105 HydrophobicContact CD2-CG1 4.17Å; L1088-V1105 WeakPolarHBondContact CD2-O 3.46Å; I1093-V1105 HydrophobicContact CB-CB 4.4Å; I1093-V1105 HydrophobicContact CG2-CB 3.88Å; I1093-V1105 HydrophobicContact CG2-CG2 3.9Å; I1093-V1105 PolarHBondContact O-N 3.37Å; F1095-V1105 HydrophobicContact CD1-CG2 4.27Å; F1095-V1105 HydrophobicContact CE1-CG2 3.91Å
1106	Y	83.4	Confident	64	Low	85 Å²	85	88.5 Å²	88.5	33%	0.333	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	145.5	-173.1	-48.6	-83.8	0	0	0	111.7	L1007 V1008 D1091 N1104	L1007-Y1106 WeakPolarHBondContact CA-O 3.47Å; V1008-Y1106 PolarHBondContact N-O 3.14Å; V1008-Y1106 PolarHBondContact O-N 3.34Å; D1091-Y1106 WeakPolarHBondContact OD1-CD1 3.48Å; D1091-Y1106 WeakPolarHBondContact OD1-CE1 3.01Å; N1104-Y1106 HydrophobicContact CB-CE1 4.23Å; N1104-Y1106 HydrophobicContact CB-CE2 3.89Å; N1104-Y1106 WeakPolarHBondContact CB-OH 3.15Å
1107	A	79.7	Confident	61.2	Low	16 Å²	16	89.6 Å²	89.6	13%	0.132	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	128.2	172	0	0	0	0	0	112	L1085 L1088 R1109	L1085-A1107 HydrophobicContact CD2-CB 3.93Å; L1088-A1107 HydrophobicContact CB-CB 3.75Å; L1088-A1107 HydrophobicContact CD1-CB 4.02Å; L1088-A1107 HydrophobicContact CG-CB 4.46Å; A1107-R1109 PolarHBondContact O-N 3.34Å
1108	T	73	Confident	59.2	Low	68 Å²	68	91.6 Å²	91.6	42%	0.417	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-74.2	117.7	171.4	48.4	0	0	0	0	110.8	H1006 V1008	H1006-T1108 PolarHBondContact O-N 2.82Å; H1006-T1108 PolarHBondContact O-OG1 3.01Å; V1008-T1108 HydrophobicContact CB-CG2 4.43Å; V1008-T1108 HydrophobicContact CG2-CG2 3.5Å; V1008-T1108 VanDerWaalsContact CG2-CG2 3.5Å
1109	R	50.6	Low	57.2	Low	198 Å²	198	90.7 Å²	90.7	75%	0.747	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-73.2	129.3	175.4	-69.9	-171.2	177.7	-155.3	1.3	111.2	N1089 A1107	N1089-R1109 VanDerWaalsContact OD1-CZ 3.26Å; N1089-R1109 PolarHBondContact OD1-NE 3.09Å; N1089-R1109 PolarHBondContact OD1-NH2 3.37Å; A1107-R1109 PolarHBondContact O-N 3.34Å
1110	L	37.7	Very low	55.4	Low	171 Å²	171	91.8 Å²	91.8	90%	0.895	56%	0.556	S	S	*	*			trans	67.6	101.6	173.5	-66.3	164.2	0	0	0	117
1111	S	26.7	Very low	53.6	Low	119 Å²	119	93 Å²	93	83%	0.832	55%	0.551	S	S	*	*				-158.6	146.6	116.6	-132.9	0	0	0	0	111.3
1112	P	34.6	Very low	51.4	Low	120 Å²	120	94.8 Å²	94.8	78%	0.779	58%	0.58	S	S	*	*			trans	-90.6	119	-179.5	33.3	-31.2	0	0	0	113
1113	A	28	Very low	49.1	Very low	88 Å²	88	99 Å²	99	73%	0.727	60%	0.599	S	S	*	*			trans	60.7	139.1	165.9	0	0	0	0	0	118.8	L1115	A1113-L1115 PolarHBondContact O-N 3.1Å
1114	P	34.2	Very low	46.9	Very low	98 Å²	98	101.9 Å²	101.9	64%	0.636	62%	0.62	S	S	*	*			trans	-76.7	110.3	166.9	30.6	-31.8	0	0	0	110.6	V1116	P1114-V1116 PolarHBondContact O-N 3.03Å
1115	L	30.5	Very low	45.2	Very low	149 Å²	149	102.9 Å²	102.9	78%	0.78	64%	0.636	S	S	*	*			trans	-74.6	118.3	160.3	-85.4	168	0	0	0	109.1	A1113 D1117	A1113-L1115 PolarHBondContact O-N 3.1Å; L1115-D1117 PolarHBondContact O-N 2.67Å
1116	V	39.2	Very low	43.6	Very low	104 Å²	104	107.5 Å²	107.5	63%	0.63	67%	0.665	S	S	*	*			trans	-87.5	90.2	153	177.1	0	0	0	0	105.5	P1114	P1114-V1116 PolarHBondContact O-N 3.03Å
1117	D	27.6	Very low	42	Very low	124 Å²	124	105.9 Å²	105.9	66%	0.663	67%	0.669	S	S	*	*			trans	-138.4	117.8	163.9	-98.7	-46.3	0	0	0	108	L1115 S1119	L1115-D1117 PolarHBondContact O-N 2.67Å; D1117-S1119 PolarHBondContact O-N 3.44Å
1118	G	39.8	Very low	40.5	Very low	88 Å²	88	109 Å²	109	91%	0.907	69%	0.686	S	S	*	*			trans	-96.1	61	-173.8	0	0	0	0	0	112.7
1119	S	38.2	Very low	39.7	Very low	95 Å²	95	111.6 Å²	111.6	66%	0.664	70%	0.696	S	S	*	*			trans	-148.6	144.1	174.3	52.6	0	0	0	0	113.6	D1117	D1117-S1119 PolarHBondContact O-N 3.44Å
1120	D	38.4	Very low	39.9	Very low	161 Å²	161	108.1 Å²	108.1	86%	0.861	69%	0.69	S	S	*	*	S	Bend	trans	41.9	87.2	163.4	-64.5	-10.9	0	0	0	120.2
1121	S	38.7	Very low	40.6	Very low	111 Å²	111	105.5 Å²	105.5	78%	0.776	68%	0.676	S	S	*	*			trans	-162.4	24.4	136.3	41.8	0	0	0	0	115.2	H1123	S1121-H1123 PolarHBondContact O-N 3.01Å
1122	G	35.1	Very low	42.3	Very low	82 Å²	82	103.7 Å²	103.7	85%	0.845	66%	0.66	S	S	*	*			trans	-71.8	55.1	179.4	0	0	0	0	0	115.8	S1124	G1122-S1124 VanDerWaalsContact C-N 3.27Å; G1122-S1124 PolarHBondContact O-N 2.78Å
1123	H	36.6	Very low	43.6	Very low	173 Å²	173	100.6 Å²	100.6	80%	0.801	64%	0.641	S	S	*	*			trans	-72.6	76.9	177.1	-89.1	86.8	0	0	0	112	S1121 G1125	S1121-H1123 PolarHBondContact O-N 3.01Å; H1123-G1125 PolarHBondContact O-N 3.24Å
1124	S	39.6	Very low	45.5	Very low	61 Å²	61	100.8 Å²	100.8	43%	0.427	63%	0.633	S	S	.	*			trans	-59.7	123.1	172.4	179.7	0	0	0	0	111.1	G1122 T1126 A1127	G1122-S1124 VanDerWaalsContact C-N 3.27Å; G1122-S1124 PolarHBondContact O-N 2.78Å; S1124-T1126 PolarHBondContact O-N 2.85Å; S1124-T1126 VanDerWaalsContact O-N 3.07Å; S1124-T1126 PolarHBondContact OG-N 3.01Å; S1124-T1126 PolarHBondContact OG-OG1 3.4Å; S1124-A1127 WeakPolarHBondContact O-CB 3.43Å; S1124-A1127 PolarHBondContact O-N 3.08Å
1125	G	50.1	Low	47.2	Very low	49 Å²	49	100.3 Å²	100.3	51%	0.505	63%	0.628	S	S	.	*	H	α-helix	trans	-58.4	-21.7	177.2	0	0	0	0	0	114	H1123 I1129	H1123-G1125 PolarHBondContact O-N 3.24Å; G1125-I1129 WeakPolarHBondContact O-CD1 3.48Å; G1125-I1129 WeakPolarHBondContact O-CG1 3.37Å; G1125-I1129 PolarHBondContact O-N 3.07Å
1126	T	54.1	Low	48.8	Very low	97 Å²	97	98.3 Å²	98.3	60%	0.595	62%	0.618	S	S	*	*	H	α-helix	trans	-74.2	-29	176	60	0	0	0	0	113.1	S1124 I1129 M1130	S1124-T1126 PolarHBondContact O-N 2.85Å; S1124-T1126 VanDerWaalsContact O-N 3.07Å; S1124-T1126 PolarHBondContact OG-N 3.01Å; S1124-T1126 PolarHBondContact OG-OG1 3.4Å; T1126-I1129 PolarHBondContact O-N 2.72Å; T1126-M1130 WeakPolarHBondContact O-CB 3.36Å; T1126-M1130 WeakPolarHBondContact O-CG 3.46Å; T1126-M1130 PolarHBondContact O-N 2.87Å
1127	A	49.8	Very low	50.1	Low	52 Å²	52	98.9 Å²	98.9	43%	0.43	62%	0.615	S	S	.	*	H	α-helix	trans	-70.2	-39.3	178.7	0	0	0	0	0	111.8	S1124 M1130 L1131	S1124-A1127 WeakPolarHBondContact O-CB 3.43Å; S1124-A1127 PolarHBondContact O-N 3.08Å; A1127-M1130 PolarHBondContact O-N 3.45Å; A1127-L1131 WeakPolarHBondContact O-CB 3.5Å; A1127-L1131 PolarHBondContact O-N 3.16Å
1128	V	49	Very low	51.9	Low	81 Å²	81	94.8 Å²	94.8	49%	0.491	60%	0.602	S	S	.	*	H	α-helix	trans	-66.8	-41.3	175	-177.6	0	0	0	0	110.8	L1131 V1132	V1128-L1131 PolarHBondContact O-N 3.46Å; V1128-V1132 HydrophobicContact CG1-CG2 4.44Å; V1128-V1132 WeakPolarHBondContact O-CB 3.45Å; V1128-V1132 VanDerWaalsContact O-CG2 3.3Å; V1128-V1132 WeakPolarHBondContact O-CG2 3.46Å; V1128-V1132 PolarHBondContact O-N 3.13Å
1129	I	55.6	Low	53.1	Low	122 Å²	122	95.2 Å²	95.2	63%	0.626	58%	0.583	S	S	*	*	H	α-helix	trans	-64.6	-41.5	175.5	-66.8	168.3	0	0	0	111	G1125 T1126 V1132 S1133	G1125-I1129 WeakPolarHBondContact O-CD1 3.48Å; G1125-I1129 WeakPolarHBondContact O-CG1 3.37Å; G1125-I1129 PolarHBondContact O-N 3.07Å; T1126-I1129 PolarHBondContact O-N 2.72Å; I1129-V1132 PolarHBondContact O-N 3.3Å; I1129-S1133 WeakPolarHBondContact O-CB 3.27Å; I1129-S1133 PolarHBondContact O-N 2.79Å; I1129-S1133 PolarHBondContact O-OG 3.49Å
1130	M	54.3	Low	54	Low	125 Å²	125	92.7 Å²	92.7	62%	0.616	57%	0.568	S	S	*	*	H	α-helix	trans	-59.5	-50.9	172.8	-79.5	-76.1	-78.9	0	0	111.5	T1126 A1127 V1132 S1133 V1134	T1126-M1130 WeakPolarHBondContact O-CB 3.36Å; T1126-M1130 WeakPolarHBondContact O-CG 3.46Å; T1126-M1130 PolarHBondContact O-N 2.87Å; A1127-M1130 PolarHBondContact O-N 3.45Å; M1130-V1132 PolarHBondContact O-N 2.03Å; M1130-S1133 PolarHBondContact O-N 2.89Å; M1130-S1133 VanDerWaalsContact O-N 3.13Å; M1130-S1133 PolarHBondContact O-OG 3.13Å; M1130-V1134 WeakPolarHBondContact O-CG2 3.16Å; M1130-V1134 PolarHBondContact O-N 3.46Å
1131	L	53.4	Low	55.3	Low	117 Å²	117	89.7 Å²	89.7	61%	0.613	55%	0.551	S	S	*	*	H	α-helix	trans	-57.8	-45.5	176.4	-89.2	161.7	0	0	0	112.5	A1127 V1128 S1133 V1134 V1135	A1127-L1131 WeakPolarHBondContact O-CB 3.5Å; A1127-L1131 PolarHBondContact O-N 3.16Å; V1128-L1131 PolarHBondContact O-N 3.46Å; L1131-S1133 VanDerWaalsContact C-N 3.33Å; L1131-S1133 PolarHBondContact O-N 2.86Å; L1131-V1134 PolarHBondContact O-N 2.02Å; L1131-V1135 WeakPolarHBondContact O-CB 3.26Å; L1131-V1135 WeakPolarHBondContact O-CG2 3.45Å; L1131-V1135 PolarHBondContact O-N 2.7Å
1132	V	61.2	Low	56.2	Low	80 Å²	80	90.1 Å²	90.1	49%	0.485	54%	0.539	S	S	.	.	H	α-helix	trans	-62.8	-39.6	175.9	169.4	0	0	0	0	111.1	V1128 I1129 M1130 V1135 L1136	V1128-V1132 HydrophobicContact CG1-CG2 4.44Å; V1128-V1132 WeakPolarHBondContact O-CB 3.45Å; V1128-V1132 VanDerWaalsContact O-CG2 3.3Å; V1128-V1132 WeakPolarHBondContact O-CG2 3.46Å; V1128-V1132 PolarHBondContact O-N 3.13Å; I1129-V1132 PolarHBondContact O-N 3.3Å; M1130-V1132 PolarHBondContact O-N 2.03Å; V1132-V1135 PolarHBondContact O-N 2.93Å; V1132-L1136 HydrophobicContact CG1-CD1 3.9Å; V1132-L1136 HydrophobicContact CG1-CG 4.48Å; V1132-L1136 WeakPolarHBondContact O-CB 3.28Å; V1132-L1136 VanDerWaalsContact O-CG 3.28Å; V1132-L1136 WeakPolarHBondContact O-CG 3.41Å; V1132-L1136 PolarHBondContact O-N 2.82Å
1133	S	63	Low	57.3	Low	55 Å²	55	90.3 Å²	90.3	39%	0.385	52%	0.523	S	S	.	.	H	α-helix	trans	-67.2	-36.9	175.8	78.9	0	0	0	0	113.1	I1129 M1130 L1131 L1136 M1137	I1129-S1133 WeakPolarHBondContact O-CB 3.27Å; I1129-S1133 PolarHBondContact O-N 2.79Å; I1129-S1133 PolarHBondContact O-OG 3.49Å; M1130-S1133 PolarHBondContact O-N 2.89Å; M1130-S1133 VanDerWaalsContact O-N 3.13Å; M1130-S1133 PolarHBondContact O-OG 3.13Å; L1131-S1133 VanDerWaalsContact C-N 3.33Å; L1131-S1133 PolarHBondContact O-N 2.86Å; S1133-L1136 PolarHBondContact O-N 3.02Å; S1133-M1137 WeakPolarHBondContact O-CB 3.48Å; S1133-M1137 PolarHBondContact O-N 2.96Å
1134	V	67.4	Low	58.2	Low	92 Å²	92	87.4 Å²	87.4	56%	0.558	51%	0.513	S	S	*	.	H	α-helix	trans	-71.7	-37	176.5	169.9	0	0	0	0	110.9	M1130 L1131 G1138	M1130-V1134 WeakPolarHBondContact O-CG2 3.16Å; M1130-V1134 PolarHBondContact O-N 3.46Å; L1131-V1134 PolarHBondContact O-N 2.02Å; V1134-G1138 PolarHBondContact O-N 2.75Å
1135	V	69.3	Low	58.8	Low	88 Å²	88	92.4 Å²	92.4	53%	0.533	52%	0.523	S	S	.	.	H	α-helix	trans	-67.4	-40.7	171.8	169.7	0	0	0	0	111.3	L1131 V1132 G1138 L1139	L1131-V1135 WeakPolarHBondContact O-CB 3.26Å; L1131-V1135 WeakPolarHBondContact O-CG2 3.45Å; L1131-V1135 PolarHBondContact O-N 2.7Å; V1132-V1135 PolarHBondContact O-N 2.93Å; V1135-G1138 PolarHBondContact O-N 3.39Å; V1135-L1139 HydrophobicContact CG1-CD1 4.12Å; V1135-L1139 WeakPolarHBondContact O-CB 3.44Å; V1135-L1139 WeakPolarHBondContact O-CG 3.44Å; V1135-L1139 PolarHBondContact O-N 3.07Å
1136	L	63.8	Low	58.5	Low	107 Å²	107	97.9 Å²	97.9	56%	0.56	53%	0.533	S	S	*	.	H	α-helix	trans	-65.5	-41.3	174.3	-76.4	167.1	0	0	0	112.2	V1132 S1133 L1139 A1140	V1132-L1136 HydrophobicContact CG1-CD1 3.9Å; V1132-L1136 HydrophobicContact CG1-CG 4.48Å; V1132-L1136 WeakPolarHBondContact O-CB 3.28Å; V1132-L1136 VanDerWaalsContact O-CG 3.28Å; V1132-L1136 WeakPolarHBondContact O-CG 3.41Å; V1132-L1136 PolarHBondContact O-N 2.82Å; S1133-L1136 PolarHBondContact O-N 3.02Å; L1136-L1139 PolarHBondContact O-N 2.93Å; L1136-A1140 WeakPolarHBondContact O-CB 3.39Å; L1136-A1140 PolarHBondContact O-N 3.36Å
1137	M	66.6	Low	58.1	Low	116 Å²	116	102.1 Å²	102.1	57%	0.571	54%	0.544	S	S	*	.	H	α-helix	trans	-66.7	-38.7	172	-93.3	-67.2	-74.9	0	0	112.2	S1133 A1140 I1141	S1133-M1137 WeakPolarHBondContact O-CB 3.48Å; S1133-M1137 PolarHBondContact O-N 2.96Å; M1137-A1140 PolarHBondContact O-N 3.35Å; M1137-I1141 HydrophobicContact CE-CD1 3.96Å; M1137-I1141 HydrophobicContact CE-CG1 4.38Å; M1137-I1141 WeakPolarHBondContact O-CB 3.23Å; M1137-I1141 VanDerWaalsContact O-CG1 3.25Å; M1137-I1141 WeakPolarHBondContact O-CG1 3.15Å; M1137-I1141 PolarHBondContact O-N 3.11Å
1138	G	65.4	Low	57.6	Low	38 Å²	38	108.1 Å²	108.1	39%	0.392	56%	0.56	S	S	.	*	H	α-helix	trans	-60.5	-43.6	173.2	0	0	0	0	0	112	V1134 V1135 F1142	V1134-G1138 PolarHBondContact O-N 2.75Å; V1135-G1138 PolarHBondContact O-N 3.39Å; G1138-F1142 VanDerWaalsContact O-CB 3.22Å; G1138-F1142 WeakPolarHBondContact O-CB 3.45Å; G1138-F1142 PolarHBondContact O-N 3.49Å
1139	L	64.7	Low	57.3	Low	98 Å²	98	114.7 Å²	114.7	51%	0.513	58%	0.576	S	S	.	*	H	α-helix	trans	-65.8	-42.2	173.6	-75.1	166.3	0	0	0	112.2	V1135 L1136 F1142 V1143	V1135-L1139 HydrophobicContact CG1-CD1 4.12Å; V1135-L1139 WeakPolarHBondContact O-CB 3.44Å; V1135-L1139 WeakPolarHBondContact O-CG 3.44Å; V1135-L1139 PolarHBondContact O-N 3.07Å; L1136-L1139 PolarHBondContact O-N 2.93Å; L1139-F1142 PolarHBondContact O-N 2.85Å; L1139-V1143 WeakPolarHBondContact O-CG2 3.4Å; L1139-V1143 PolarHBondContact O-N 3Å
1140	A	58.3	Low	56.1	Low	41 Å²	41	118 Å²	118	34%	0.339	59%	0.586	S	S	.	*	H	α-helix	trans	-62.6	-46.7	176	0	0	0	0	0	111.8	L1136 M1137 F1142 V1143 I1144	L1136-A1140 WeakPolarHBondContact O-CB 3.39Å; L1136-A1140 PolarHBondContact O-N 3.36Å; M1137-A1140 PolarHBondContact O-N 3.35Å; A1140-F1142 VanDerWaalsContact C-N 3.34Å; A1140-F1142 PolarHBondContact O-N 2.84Å; A1140-V1143 PolarHBondContact O-N 3.46Å; A1140-I1144 WeakPolarHBondContact O-CB 3.26Å; A1140-I1144 WeakPolarHBondContact O-CD1 3.02Å; A1140-I1144 VanDerWaalsContact O-CG1 3.26Å; A1140-I1144 WeakPolarHBondContact O-CG1 2.91Å; A1140-I1144 PolarHBondContact O-N 2.99Å
1141	I	64.4	Low	55.2	Low	99 Å²	99	119.3 Å²	119.3	51%	0.508	59%	0.594	S	S	.	*	H	α-helix	trans	-61.4	-42.4	174.5	-70.2	166.9	0	0	0	110.4	M1137 V1143 I1144 Y1145	M1137-I1141 HydrophobicContact CE-CD1 3.96Å; M1137-I1141 HydrophobicContact CE-CG1 4.38Å; M1137-I1141 WeakPolarHBondContact O-CB 3.23Å; M1137-I1141 VanDerWaalsContact O-CG1 3.25Å; M1137-I1141 WeakPolarHBondContact O-CG1 3.15Å; M1137-I1141 PolarHBondContact O-N 3.11Å; I1141-V1143 PolarHBondContact O-N 3.34Å; I1141-I1144 PolarHBondContact O-N 2.82Å; I1141-Y1145 WeakPolarHBondContact O-CB 3.48Å; I1141-Y1145 PolarHBondContact O-N 2.9Å
1142	F	57.7	Low	54.7	Low	119 Å²	119	120 Å²	120	52%	0.522	61%	0.605	S	S	.	*	H	α-helix	trans	-64	-39.7	177.8	-173	-102	0	0	0	112.6	G1138 L1139 A1140 Y1145 K1146	G1138-F1142 VanDerWaalsContact O-CB 3.22Å; G1138-F1142 WeakPolarHBondContact O-CB 3.45Å; G1138-F1142 PolarHBondContact O-N 3.49Å; L1139-F1142 PolarHBondContact O-N 2.85Å; A1140-F1142 VanDerWaalsContact C-N 3.34Å; A1140-F1142 PolarHBondContact O-N 2.84Å; F1142-Y1145 PolarHBondContact O-N 3.49Å; F1142-K1146 HydrophobicContact CE1-CD 4.49Å; F1142-K1146 WeakPolarHBondContact O-CB 3.49Å; F1142-K1146 PolarHBondContact O-N 2.65Å
1143	V	58.3	Low	53.1	Low	86 Å²	86	119.7 Å²	119.7	52%	0.521	62%	0.619	S	S	.	*	H	α-helix	trans	-66	-44.9	174.4	168.8	0	0	0	0	111.3	L1139 A1140 I1141 Y1145 K1146 F1147	L1139-V1143 WeakPolarHBondContact O-CG2 3.4Å; L1139-V1143 PolarHBondContact O-N 3Å; A1140-V1143 PolarHBondContact O-N 3.46Å; I1141-V1143 PolarHBondContact O-N 3.34Å; V1143-Y1145 VanDerWaalsContact C-N 3.35Å; V1143-Y1145 PolarHBondContact O-N 3.29Å; V1143-K1146 PolarHBondContact O-N 2.61Å; V1143-F1147 PolarHBondContact O-N 3.15Å
1144	I	57	Low	51.5	Low	113 Å²	113	125.3 Å²	125.3	58%	0.579	64%	0.641	S	S	*	*	H	α-helix	trans	-62.4	-42.7	175.7	-69	164.9	0	0	0	110.8	A1140 I1141 F1147 K1148	A1140-I1144 WeakPolarHBondContact O-CB 3.26Å; A1140-I1144 WeakPolarHBondContact O-CD1 3.02Å; A1140-I1144 VanDerWaalsContact O-CG1 3.26Å; A1140-I1144 WeakPolarHBondContact O-CG1 2.91Å; A1140-I1144 PolarHBondContact O-N 2.99Å; I1141-I1144 PolarHBondContact O-N 2.82Å; I1144-F1147 PolarHBondContact O-N 2.94Å; I1144-K1148 PolarHBondContact O-N 2.63Å
1145	Y	52.2	Low	49.5	Very low	165 Å²	165	127.5 Å²	127.5	65%	0.647	65%	0.649	S	S	*	*	H	α-helix	trans	-64.4	-43.2	178.3	-172.9	-107.1	0	0	0	111.8	I1141 F1142 V1143 F1147 K1148	I1141-Y1145 WeakPolarHBondContact O-CB 3.48Å; I1141-Y1145 PolarHBondContact O-N 2.9Å; F1142-Y1145 PolarHBondContact O-N 3.49Å; V1143-Y1145 VanDerWaalsContact C-N 3.35Å; V1143-Y1145 PolarHBondContact O-N 3.29Å; Y1145-F1147 VanDerWaalsContact C-N 3.3Å; Y1145-F1147 PolarHBondContact O-N 3.37Å; Y1145-K1148 PolarHBondContact O-N 3.2Å
1146	K	44.1	Very low	47.6	Very low	165 Å²	165	130 Å²	130	72%	0.717	67%	0.665	S	S	*	*	H	α-helix	trans	-66.3	-27.3	177.4	-111.1	-160.5	175.4	-171.3	0	114.1	F1142 V1143	F1142-K1146 HydrophobicContact CE1-CD 4.49Å; F1142-K1146 WeakPolarHBondContact O-CB 3.49Å; F1142-K1146 PolarHBondContact O-N 2.65Å; V1143-K1146 PolarHBondContact O-N 2.61Å
1147	F	45.1	Very low	46	Very low	186 Å²	186	135.5 Å²	135.5	82%	0.816	68%	0.68	S	S	*	*	H	α-helix	trans	-85.8	-15.3	179.5	-102.9	-84.5	0	0	0	114.7	V1143 I1144 Y1145	V1143-F1147 PolarHBondContact O-N 3.15Å; I1144-F1147 PolarHBondContact O-N 2.94Å; Y1145-F1147 VanDerWaalsContact C-N 3.3Å; Y1145-F1147 PolarHBondContact O-N 3.37Å
1148	K	38.8	Very low	44.3	Very low	178 Å²	178	133.7 Å²	133.7	77%	0.774	68%	0.683	S	S	*	*	S	Bend	trans	-107.5	36.9	-167	-145.4	177.8	-175.7	-178.5	0	116	I1144 Y1145	I1144-K1148 PolarHBondContact O-N 2.63Å; Y1145-K1148 PolarHBondContact O-N 3.2Å
1149	R	41.9	Very low	42.6	Very low	218 Å²	218	138 Å²	138	82%	0.823	70%	0.702	S	S	*	*			trans	-133.9	99.4	164	-83.5	-166.5	171.5	-169.8	-1.3	113.7
1150	K	30.4	Very low	40.9	Very low	191 Å²	191	140.1 Å²	140.1	83%	0.83	71%	0.71	S	S	*	*			trans	-140.9	99.8	153.6	-91.6	-171	171.7	-178.5	0	110.1
1151	I	35.5	Very low	39.5	Very low	154 Å²	154	146 Å²	146	79%	0.79	73%	0.728	S	S	*	*			trans	52.9	134.1	132	-56.1	156.1	0	0	0	118.3
1152	P	42.7	Very low	38.7	Very low	131 Å²	131	146.3 Å²	146.3	85%	0.851	74%	0.736	S	S	*	*			cis	-117.2	-158.9	-8.9	34.6	-13.7	0	0	0	111.3
1153	G	28.6	Very low	37.5	Very low	74 Å²	74	146.5 Å²	146.5	76%	0.763	74%	0.742	S	S	*	*			cis	152.1	-179.4	-16.2	0	0	0	0	0	114.5
1154	M	28.7	Very low	36.1	Very low	173 Å²	173	148.9 Å²	148.9	85%	0.852	75%	0.746	S	S	*	*			trans	81.9	81.1	166.7	-152.3	164.9	79.9	0	0	122.1
1155	N	26.5	Very low	34.8	Very low	137 Å²	137	150.2 Å²	150.2	73%	0.733	75%	0.749	S	S	*	*				45.4	125.7	122.7	-49.7	-1.2	0	0	0	123.3
1156	T	29.4	Very low	33.6	Very low	142 Å²	142	148.6 Å²	148.6	87%	0.871	75%	0.748	S	S	*	*				-156.3	146.2	112.6	17.7	0	0	0	0	114.2
1157	Y	29.8	Very low	32.7	Very low	221 Å²	221	148.3 Å²	148.3	87%	0.867	75%	0.749	S	S	*	*			trans	-50.4	167.8	161.6	-67	-105.6	0	0	0	113.4
1158	A	29.9	Very low	31.9	Very low	78 Å²	78	145.7 Å²	145.7	65%	0.645	75%	0.748	S	S	*	*			cis	-172.3	-171.9	-19.3	0	0	0	0	0	106.6
1159	T	29.7	Very low	31.7	Very low	128 Å²	128	144.4 Å²	144.4	79%	0.785	75%	0.748	S	S	*	*			cis	-158	-169.7	12.6	-27.1	0	0	0	0	110.9
1160	E	29.4	Very low	31.2	Very low	143 Å²	143	140 Å²	140	67%	0.668	75%	0.747	S	S	*	*			trans	-48.9	167.2	167.9	-67	-179.6	111.3	0	0	117.7
1161	K	29.8	Very low	31	Very low	166 Å²	166	135 Å²	135	72%	0.722	74%	0.742	S	S	*	*			cis	-173.8	177	-5.5	-112.4	175.6	-179.9	154.8	0	108.7
1162	P	47.4	Very low	30.6	Very low	105 Å²	105	133.5 Å²	133.5	68%	0.682	74%	0.74	S	S	*	*			cis	-117.9	-120.2	-19.3	23.6	2	0	0	0	108.5
1163	D	31.9	Very low	29.8	Very low	122 Å²	122	133.4 Å²	133.4	65%	0.652	74%	0.737	S	S	*	*			cis	-168.6	166.5	-19.2	-126.8	8.9	0	0	0	105.9
1164	K	28.5	Very low	29.7	Very low	136 Å²	136	134 Å²	134	59%	0.591	73%	0.73	S	S	*	*			cis	-160	140.2	-7.7	-144.4	172.7	-152.6	-63.3	0	111.3
1165	E	29.8	Very low	29.6	Very low	141 Å²	141	133.5 Å²	133.5	66%	0.659	73%	0.728	S	S	*	*			trans	34.8	153.7	140.6	-63.8	164.5	-164.1	0	0	125.3
1166	Q	27.1	Very low	29.5	Very low	131 Å²	131	130.9 Å²	130.9	61%	0.612	73%	0.726	S	S	*	*			cis	-174.1	145.2	-23.8	-172.7	153.8	-2.8	0	0	111.7
1167	E	26	Very low	29.4	Very low	159 Å²	159	130.7 Å²	130.7	74%	0.743	72%	0.724	S	S	*	*			trans	52.8	168.5	154.2	-76.3	163.3	-160.3	0	0	121.9
1168	V	27.6	Very low	29.7	Very low	131 Å²	131	126 Å²	126	79%	0.794	72%	0.721	S	S	*	*			cis	174.3	149.8	-42.5	142	0	0	0	0	106.6
1169	I	34.8	Very low	29.6	Very low	151 Å²	151	129.3 Å²	129.3	77%	0.774	73%	0.728	S	S	*	*			trans	-81.7	154.8	-178.1	-19.6	177	0	0	0	111.8
1170	P	32	Very low	30.5	Very low	125 Å²	125	127.8 Å²	127.8	81%	0.812	72%	0.72	S	S	*	*				-147.4	-170.3	106.4	39.4	-23.2	0	0	0	114.2
1171	A	26.7	Very low	30.4	Very low	86 Å²	86	129.1 Å²	129.1	71%	0.711	73%	0.726	S	S	*	*			trans	-147.8	178.3	-174.9	0	0	0	0	0	113.7
1172	V	26.3	Very low	30.4	Very low	124 Å²	124	124 Å²	124	75%	0.752	72%	0.721	S	S	*	*			trans	91.3	138.5	160.6	-177.3	0	0	0	0	119.2
1173	T	25.4	Very low	29.5	Very low	128 Å²	128	126.3 Å²	126.3	79%	0.785	73%	0.727	S	S	*	*			trans	66.4	153.6	165.2	44.1	0	0	0	0	120.8
1174	S	26.6	Very low	29.4	Very low	88 Å²	88	128.5 Å²	128.5	62%	0.615	73%	0.734	S	S	*	*			cis	179.3	156.6	-33.1	56.2	0	0	0	0	112.7
1175	I	26.4	Very low	29.5	Very low	161 Å²	161	128.3 Å²	128.3	83%	0.826	74%	0.739	S	S	*	*			trans	86.2	138.3	156.1	-65.5	158	0	0	0	121
1176	A	25	Very low	29.4	Very low	82 Å²	82	127.4 Å²	127.4	68%	0.678	74%	0.743	S	S	*	*			trans	67.6	111.8	161.3	0	0	0	0	0	120.8
1177	V	28.2	Very low	29.5	Very low	138 Å²	138	125.6 Å²	125.6	84%	0.836	75%	0.745	S	S	*	*				60	116.3	67	-178.9	0	0	0	0	112.1
1178	P	34.7	Very low	29.6	Very low	123 Å²	123	125.7 Å²	125.7	80%	0.799	75%	0.749	S	S	*	*				-144.8	167.2	70.1	40.9	-23.1	0	0	0	119.5
1179	N	28	Very low	29.6	Very low	148 Å²	148	125.9 Å²	125.9	79%	0.791	75%	0.746	S	S	*	*			trans	-80.2	-176.4	166.7	-123.1	24.4	0	0	0	110.8
1180	P	48	Very low	29.3	Very low	95 Å²	95	127.6 Å²	127.6	62%	0.617	75%	0.75	S	S	*	*			cis	-118.8	-168.6	23	44.1	-29.4	0	0	0	112.9
1181	E	29	Very low	29.1	Very low	171 Å²	171	127.3 Å²	127.3	80%	0.799	75%	0.746	S	S	*	*			cis	-160.2	161.8	13.8	-135.8	140.8	-101.7	0	0	105.5
1182	G	29	Very low	29.2	Very low	59 Å²	59	130.5 Å²	130.5	61%	0.608	75%	0.751	S	S	*	*			cis	149.5	148.7	5.2	0	0	0	0	0	107.3
1183	D	29	Very low	29.3	Very low	153 Å²	153	132.1 Å²	132.1	82%	0.818	75%	0.754	S	S	*	*			cis	-160.3	-176.3	-6.3	-75	-56.6	0	0	0	106.8
1184	E	30.4	Very low	29.3	Very low	169 Å²	169	134 Å²	134	79%	0.79	75%	0.754	S	S	*	*			cis	-154.3	-161.1	14.6	-146.9	-155.7	120.8	0	0	112.4
1185	L	30.3	Very low	29.3	Very low	132 Å²	132	138.1 Å²	138.1	69%	0.691	77%	0.768	S	S	*	*			trans	-64.4	175.9	-178.7	-94.5	50.9	0	0	0	118.5
1186	T	27.7	Very low	29.2	Very low	122 Å²	122	136.1 Å²	136.1	75%	0.748	76%	0.759	S	S	*	*			cis	-139.5	150.8	12	35.8	0	0	0	0	108.9
1187	S	27.8	Very low	29.3	Very low	93 Å²	93	137.9 Å²	137.9	65%	0.65	77%	0.766	S	S	*	*			cis	94.7	108.8	22.1	80.1	0	0	0	0	116.6
1188	L	28.9	Very low	29.3	Very low	160 Å²	160	139.5 Å²	139.5	84%	0.838	76%	0.762	S	S	*	*			trans	-159.4	114.3	154.5	-129.5	146.3	0	0	0	113.5
1189	D	27.9	Very low	28.7	Very low	136 Å²	136	139.5 Å²	139.5	73%	0.727	77%	0.765	S	S	*	*			trans	32.4	127.8	156.1	-50.8	-17.6	0	0	0	124
1190	H	28.1	Very low	28.6	Very low	186 Å²	186	142.5 Å²	142.5	86%	0.861	77%	0.765	S	S	*	*			trans	-75.2	148.9	145.9	-104.9	10.7	0	0	0	110.3
1191	V	28.2	Very low	27.4	Very low	120 Å²	120	141.5 Å²	141.5	73%	0.727	77%	0.772	S	S	*	*			trans	-128	114.9	164.7	178	0	0	0	0	108.7	I1193	V1191-I1193 HydrophobicContact CG1-CG1 4.35Å; V1191-I1193 PolarHBondContact O-N 3.46Å
1192	D	28.5	Very low	27	Very low	153 Å²	153	142.3 Å²	142.3	82%	0.818	77%	0.769	S	S	*	*			trans	-67.5	116.2	170.7	-69.6	-61.1	0	0	0	110.1	Q1194	D1192-Q1194 PolarHBondContact O-N 3.08Å
1193	I	27.5	Very low	26.7	Very low	157 Å²	157	147 Å²	147	81%	0.805	78%	0.78	S	S	*	*			trans	-98	87.2	169.4	-58.6	-174.5	0	0	0	109.6	V1191 L1195	V1191-I1193 HydrophobicContact CG1-CG1 4.35Å; V1191-I1193 PolarHBondContact O-N 3.46Å; I1193-L1195 PolarHBondContact O-N 2.94Å
1194	Q	25.3	Very low	26.4	Very low	169 Å²	169	145.4 Å²	145.4	79%	0.79	78%	0.777	S	S	*	*			trans	-22	113.6	154.5	-174.4	172.1	13.4	0	0	114.4	D1192 D1196	D1192-Q1194 PolarHBondContact O-N 3.08Å; Q1194-D1196 PolarHBondContact O-N 3.39Å; Q1194-D1196 VanDerWaalsContact O-N 3.16Å
1195	L	26.7	Very low	26	Very low	174 Å²	174	141.7 Å²	141.7	91%	0.911	77%	0.77	S	S	*	*			trans	-65.6	107	167.9	-98.3	141.1	0	0	0	109.8	I1193 S1197	I1193-L1195 PolarHBondContact O-N 2.94Å; L1195-S1197 PolarHBondContact O-N 3.05Å
1196	D	25	Very low	25.8	Very low	119 Å²	119	145 Å²	145	64%	0.636	78%	0.782	S	S	*	*			trans	-77.3	101.6	-177.8	-167.6	11.3	0	0	0	111.3	Q1194 K1198	Q1194-D1196 PolarHBondContact O-N 3.39Å; Q1194-D1196 VanDerWaalsContact O-N 3.16Å; D1196-K1198 PolarHBondContact O-N 2.8Å
1197	S	28.1	Very low	25.8	Very low	119 Å²	119	143.8 Å²	143.8	83%	0.832	77%	0.774	S	S	*	*			trans	-77.1	61.2	-177	46.2	0	0	0	0	112.9	L1195	L1195-S1197 PolarHBondContact O-N 3.05Å
1198	K	26.6	Very low	25.7	Very low	172 Å²	172	146.4 Å²	146.4	75%	0.748	78%	0.781	S	S	*	*			trans	-134.6	41.4	-177.2	-79.8	-177.9	-176	155.2	0	115.6	D1196	D1196-K1198 PolarHBondContact O-N 2.8Å
1199	S	23.5	Very low	25.4	Very low	122 Å²	122	145.7 Å²	145.7	85%	0.853	78%	0.776	S	S	*	*			trans	-77.4	120.8	150.3	55	0	0	0	0	109	G1201	S1199-G1201 PolarHBondContact O-N 3.48Å
1200	R	24.4	Very low	25.2	Very low	211 Å²	211	146 Å²	146	80%	0.796	77%	0.771	S	S	*	*			trans	-80.3	111.5	179.2	-152.8	177.7	-172	169.3	-2.4	107.6	Y1202	R1200-Y1202 PolarHBondContact O-N 2.96Å
1201	G	22.6	Very low	25	Very low	74 Å²	74	141 Å²	141	76%	0.763	75%	0.751	S	S	*	*			trans	-62.6	93.6	174.9	0	0	0	0	0	111.3	S1199	S1199-G1201 PolarHBondContact O-N 3.48Å
1202	Y	21.4	Very low	24.8	Very low	189 Å²	189	139.1 Å²	139.1	74%	0.741	74%	0.743	S	S	*	*			trans	-78.7	112.9	161.6	-86.5	-83.7	0	0	0	107.5	R1200 P1204	R1200-Y1202 PolarHBondContact O-N 2.96Å; Y1202-P1204 WeakPolarHBondContact O-CD 3.34Å
1203	L	22.3	Very low	24.9	Very low	158 Å²	158	135.5 Å²	135.5	83%	0.827	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-68.3	126.8	158.2	-73	85.6	0	0	0	107.3
1204	P	22.9	Very low	24.9	Very low	119 Å²	119	134 Å²	134	77%	0.773	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-62	133.5	156.5	-14.8	30.4	0	0	0	108.2	Y1202	Y1202-P1204 WeakPolarHBondContact O-CD 3.34Å
1205	S	21.9	Very low	24.7	Very low	91 Å²	91	128.4 Å²	128.4	64%	0.636	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-69	145.5	166.1	45	0	0	0	0	109.7	T1207	S1205-T1207 PolarHBondContact O-N 2.92Å
1206	H	27.2	Very low	24.4	Very low	202 Å²	202	125.4 Å²	125.4	94%	0.935	69%	0.686	S	S	*	*	S	Bend	trans	-69.8	75.2	172	-81.1	-82	0	0	0	111.7
1207	T	26.4	Very low	24.3	Very low	95 Å²	95	128.9 Å²	128.9	58%	0.583	69%	0.69	S	S	*	*			trans	-151.7	155.8	166.4	46.2	0	0	0	0	108.3	S1205	S1205-T1207 PolarHBondContact O-N 2.92Å
1208	D	25.7	Very low	23.9	Very low	148 Å²	148	129 Å²	129	79%	0.791	69%	0.686	S	S	*	*			trans	69.4	47.9	171.9	-48.5	-30.8	0	0	0	116.9
1209	I	23.1	Very low	23.7	Very low	146 Å²	146	132.5 Å²	132.5	75%	0.749	70%	0.702	S	S	*	*			trans	-83	108.1	148.4	-52.3	175.6	0	0	0	106.9	L1211	I1209-L1211 HydrophobicContact CG2-CD1 3.66Å; I1209-L1211 HydrophobicContact CG2-CG 4.21Å
1210	K	23.4	Very low	23.7	Very low	143 Å²	143	133 Å²	133	62%	0.622	69%	0.694	S	S	*	*			trans	-95.6	98.7	164.4	-78.4	-170.7	171.2	-173.9	0	108.1	F222	F222-K1210 PolarHBondContact O-NZ 3.04Å
1211	L	25	Very low	23.6	Very low	81 Å²	81	128.9 Å²	128.9	42%	0.424	69%	0.689	S	S	.	*			trans	-68.3	154.9	167.5	-72.2	95.8	0	0	0	110.2	E487 I1209	E487-L1211 WeakPolarHBondContact OE1-CA 3.45Å; I1209-L1211 HydrophobicContact CG2-CD1 3.66Å; I1209-L1211 HydrophobicContact CG2-CG 4.21Å
1212	S	23.3	Very low	23.7	Very low	80 Å²	80	131.9 Å²	131.9	56%	0.559	68%	0.684	S	S	*	*			trans	-89	121.9	165.1	-163.3	0	0	0	0	110.1	E487 E1214	E487-S1212 PolarHBondContact OE1-N 2.77Å; S1212-E1214 PolarHBondContact O-N 3.49Å
1213	D	30.4	Very low	23.8	Very low	76 Å²	76	128.6 Å²	128.6	41%	0.406	68%	0.681	S	S	.	*			trans	-77.1	61	-177.2	-75.3	-46	0	0	0	112.9	Y257	Y257-D1213 HydrophobicContact CE1-CB 3.84Å; Y257-D1213 HydrophobicContact CE2-CB 4.29Å; Y257-D1213 VanDerWaalsContact CZ-OD2 3.26Å; Y257-D1213 VanDerWaalsContact OH-CB 3.23Å; Y257-D1213 WeakPolarHBondContact OH-CB 3.15Å; Y257-D1213 PolarHBondContact OH-OD2 3.27Å
1214	E	27.2	Very low	23.9	Very low	126 Å²	126	126.8 Å²	126.8	59%	0.589	67%	0.672	S	S	*	*			trans	-137.9	115.5	173.2	-117.7	154.9	-149.8	0	0	111.7	S1212	S1212-E1214 PolarHBondContact O-N 3.49Å
1215	A	21.7	Very low	24	Very low	51 Å²	51	127.3 Å²	127.3	42%	0.421	67%	0.665	S	S	.	*			trans	-80	137	-177.9	0	0	0	0	0	110.8	R1217	A1215-R1217 PolarHBondContact O-N 2.82Å; A1215-R1217 VanDerWaalsContact O-N 3.07Å
1216	P	20.8	Very low	24.1	Very low	112 Å²	112	129.9 Å²	129.9	73%	0.727	67%	0.667	S	S	*	*			trans	-63.2	114.1	-174.3	24.8	-34.3	0	0	0	111.1	V1218	P1216-V1218 PolarHBondContact O-N 3.35Å
1217	R	22.3	Very low	23.9	Very low	191 Å²	191	124.3 Å²	124.3	72%	0.721	65%	0.647	S	S	*	*			trans	-83.1	96.6	168	-70.8	-173.7	179	177.8	3.4	108.4	A1215 F1219	A1215-R1217 PolarHBondContact O-N 2.82Å; A1215-R1217 VanDerWaalsContact O-N 3.07Å; R1217-F1219 PolarHBondContact O-N 3.3Å
1218	V	20.4	Very low	23.7	Very low	122 Å²	122	126.8 Å²	126.8	74%	0.739	65%	0.652	S	S	*	*			trans	-51.4	125	165.7	-177.9	0	0	0	0	108.5	P1216	P1216-V1218 PolarHBondContact O-N 3.35Å
1219	F	20.9	Very low	23.5	Very low	245 Å²	245	124.8 Å²	124.8	100%	1.075	64%	0.639	S	S	*	*			trans	-84.8	0	162.9	-90.5	-78.6	0	0	0	109.5	R1217	R1217-F1219 PolarHBondContact O-N 3.3Å

Retrieved 1,219 of 1,219 residues in 1732 ms (Link to these results)

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