A0A077Z834_TRITR Loading...

Transcription factor AP 2 alpha

AlphaFold DB , UniProt , Accession A0A077Z834, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,387 aa.

						>A0A077Z834_TRITR|A0A077Z834
MCCHYKKEVNIERTVAAQAVDPGASLTSELPLQALGLTNDSQLLVVRQLSSAASDIGRPSRQPFYRTPSVKMHQDLAALPIFINADRVSKMLRNFANEEMATYFLQSKFDAMTYQVDNGGHSDEVVALADAMASKLSSCVSAVGVIKKQILSIFQNSPYDMRAFKQYHECCTIDPQYLKHSPEHDALINGSMSCDVVPKGLSAFSFYPGQNLTNAFLLNAQNETSILKQFFISADGLRTEYPATRMDIRNYTNCELLSLKNRREVFASVAFDTAKQVVIVVQQGLGMSDKQLGVAKCVAKSLLNCLSEIDEVFVFAASDKLLMPANLYCANATTVASVEVKAKMEQFLDTLTTDSAFTNHTLALSTALDVLDNGRSLDRDAKPIVLYISRGLQFQLAENNVRLNDVVTANERSANPAEIVNLVIWDCCQPPTVSKPLAASAAELGRFSYEQLLGLKSSAKKSSSSSSSSSSSSSVFTANRIKVIVVNASDEECLSVKTLTQLFGMQRQKAAGKSPNTDVKIAAIDNPCTHRSSVLLASSLVQIGNNVVGLVGVEVDLAELVAPIMYYSDGGVTSYAFLLNEDGNVIVHPHYVTLPSVRLLDVPVAAVEKRFPILEWKHSLKTHNSGQVLQLRVPGETNRTDADVLYYWKRVQSTPYVIVVASREKLSVERANRPDFSGMITRNLAYHRLDLLLSKDFNLCFHGKMLASCDRVGLYLAPRCFQNPMKRFTASESKRTAQGFWAFVSDTTRLITNPGLKVNIRREIGALRKISTEWKRLATEGEFQSCVLRRYLATPSGVMLTFPAVLTHQQYDPVQRDWFQRAVQHPSKVVITGPNIDPSGFGHVVSLSHTIYEGKAAAMHHVNDLVVAVLAIDVPVTFLYKMLYKHVTICREQDINCFLFDDRGYIVAYDNMQLQGDVIKRPEGLHITHKEPLIASEILQKSDFVRKVVCMRFSDRTVQRMYVFNTSYEDVIRNNDGCLRYQIAVVRQTNVFLAVVNRSCHRQSAFCPCSVTDRRCLNCFRSEPTECECPCECPLLSSYCPRVDTKTVSSKQLPICNAASKEPLLAMPDMGFFESGTQQVRQCTEVTCSNYKSQISCLGIVGCEWCHVDVDRVTPLQDAYCASVLVCFSGVLGLSPYGSIDQGLPTSLYPSPYKCMVILDILNGKFASSTPVGPVAGGIMGVFVLLVAGVYWYRQQVNRIMESRCYRANDSSATRLNNELEEDFHFDDGSSNQPNVNGSVQNNGLLLASFERQNLIAMPRPRSRWRPGSRAESSDPGYSTMTANCDDSEPTTTVDAVSSNVSSAFKRSISSRPNGGTYTGQVNRIRSTNAGVNGPSDCDELLIGRNVCEETGKCPITDDRSATSLKDKPSAVSTEFVITAQVHAAAS
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.9	Very low	25.7	Very low	247 Å²	247	165.8 Å²	165.8	100%	1.217	83%	0.834	S	S	*	*				0	101.9	0	-83.9	-171.5	-89.1	0	0	108.9
2	C	22.7	Very low	25.9	Very low	129 Å²	129	166.4 Å²	166.4	87%	0.872	83%	0.832	S	S	*	*			trans	-86.7	120.1	175.2	-66.5	0	0	0	0	109.5
3	C	26.9	Very low	25.8	Very low	133 Å²	133	171.6 Å²	171.6	90%	0.899	84%	0.836	S	S	*	*			trans	-140.3	114.3	156.6	-86.2	0	0	0	0	109.2
4	H	23.8	Very low	25.9	Very low	169 Å²	169	169.4 Å²	169.4	78%	0.782	84%	0.837	S	S	*	*			trans	-55.5	135.1	170.3	-95.5	-89.9	0	0	0	112.2
5	Y	27	Very low	26	Very low	219 Å²	219	166.4 Å²	166.4	86%	0.859	83%	0.832	S	S	*	*			trans	-134.3	94.1	150.8	-108.5	-89.2	0	0	0	108.8
6	K	23.1	Very low	26.1	Very low	165 Å²	165	162.1 Å²	162.1	72%	0.717	83%	0.83	S	S	*	*			trans	-75.4	121.7	159	-95.2	-177	170.5	-172.4	0	107.1
7	K	26.3	Very low	26	Very low	185 Å²	185	157.9 Å²	157.9	80%	0.804	83%	0.826	S	S	*	*			trans	-137	97.2	156	-124.5	-178.7	-178.2	-177.8	0	107.5	V9	K7-V9 PolarHBondContact O-N 3.27Å
8	E	24.5	Very low	26	Very low	164 Å²	164	159.2 Å²	159.2	77%	0.766	83%	0.827	S	S	*	*			trans	-58.9	121.1	166.3	-73.9	163.6	169.9	0	0	108.2
9	V	25.6	Very low	26.1	Very low	115 Å²	115	156.2 Å²	156.2	70%	0.697	83%	0.828	S	S	*	*			trans	-117.9	97	163.9	-179.7	0	0	0	0	105.9	K7 I11	K7-V9 PolarHBondContact O-N 3.27Å; V9-I11 HydrophobicContact CG1-CD1 4.49Å; V9-I11 HydrophobicContact CG1-CG1 4.06Å; V9-I11 PolarHBondContact O-N 3.29Å
10	N	25.7	Very low	26.1	Very low	151 Å²	151	155.2 Å²	155.2	81%	0.807	83%	0.828	S	S	*	*			trans	-59.8	111	165.9	-85.4	-23.3	0	0	0	108.3
11	I	26.7	Very low	26.1	Very low	147 Å²	147	155.4 Å²	155.4	75%	0.754	83%	0.829	S	S	*	*			trans	-109	95.3	161.8	-59.1	-179.7	0	0	0	105.4	V9 R13	V9-I11 HydrophobicContact CG1-CD1 4.49Å; V9-I11 HydrophobicContact CG1-CG1 4.06Å; V9-I11 PolarHBondContact O-N 3.29Å; I11-R13 PolarHBondContact O-N 2.98Å
12	E	27.2	Very low	26.2	Very low	173 Å²	173	149.4 Å²	149.4	81%	0.808	81%	0.808	S	S	*	*			trans	-56.1	115.4	170.5	-73.3	178.1	150.7	0	0	109.1	T14	E12-T14 PolarHBondContact O-N 3.01Å
13	R	25.1	Very low	26.3	Very low	234 Å²	234	146.9 Å²	146.9	88%	0.883	81%	0.805	S	S	*	*			trans	-69	95.4	168.6	-78.8	178.8	171.4	176.7	-3.4	108.6	I11 V15	I11-R13 PolarHBondContact O-N 2.98Å; R13-V15 PolarHBondContact O-N 2.95Å; R13-V15 VanDerWaalsContact O-N 3.11Å
14	T	27.8	Very low	26.3	Very low	140 Å²	140	145.3 Å²	145.3	86%	0.859	80%	0.801	S	S	*	*			trans	-74.3	95.7	162.3	2.8	0	0	0	0	108	E12 A16	E12-T14 PolarHBondContact O-N 3.01Å; T14-A16 PolarHBondContact O-N 3.32Å; T14-A16 VanDerWaalsContact O-N 3.12Å
15	V	26.2	Very low	26.4	Very low	125 Å²	125	142.9 Å²	142.9	76%	0.758	80%	0.803	S	S	*	*			trans	-74.7	91.5	171.4	178.2	0	0	0	0	107.6	R13 A17	R13-V15 PolarHBondContact O-N 2.95Å; R13-V15 VanDerWaalsContact O-N 3.11Å; V15-A17 PolarHBondContact O-N 3.06Å
16	A	27.5	Very low	26.4	Very low	97 Å²	97	139.7 Å²	139.7	80%	0.802	80%	0.8	S	S	*	*			trans	-82.8	91.5	164.7	0	0	0	0	0	108.2	T14 Q18	T14-A16 PolarHBondContact O-N 3.32Å; T14-A16 VanDerWaalsContact O-N 3.12Å; A16-Q18 PolarHBondContact O-N 3.32Å
17	A	24.8	Very low	26.6	Very low	92 Å²	92	138.5 Å²	138.5	76%	0.76	81%	0.807	S	S	*	*			trans	-71.3	100.2	168.8	0	0	0	0	0	109.1	V15	V15-A17 PolarHBondContact O-N 3.06Å
18	Q	26.3	Very low	26.5	Very low	181 Å²	181	134.4 Å²	134.4	85%	0.846	80%	0.801	S	S	*	*			trans	-97	107	160.9	-99.2	178.7	-19.3	0	0	108.4	A16 V20	A16-Q18 PolarHBondContact O-N 3.32Å; Q18-V20 PolarHBondContact O-N 3.26Å
19	A	27.5	Very low	26.6	Very low	102 Å²	102	135.9 Å²	135.9	84%	0.843	81%	0.808	S	S	*	*			trans	-56.8	121.5	172.3	0	0	0	0	0	110	D21	A19-D21 PolarHBondContact O-N 2.98Å
20	V	26.1	Very low	26.5	Very low	135 Å²	135	138.1 Å²	138.1	82%	0.818	82%	0.816	S	S	*	*			trans	-87.3	103.9	171.2	175.9	0	0	0	0	106.8	Q18	Q18-V20 PolarHBondContact O-N 3.26Å
21	D	26.9	Very low	26.6	Very low	160 Å²	160	136 Å²	136	86%	0.856	81%	0.81	S	S	*	*			trans	-72.6	123.5	171.3	-116.6	-24.3	0	0	0	109.5	A19	A19-D21 PolarHBondContact O-N 2.98Å
22	P	32.6	Very low	26.4	Very low	121 Å²	121	137.4 Å²	137.4	79%	0.786	82%	0.818	S	S	*	*			trans	-94.3	102.8	-176.3	34	-27.5	0	0	0	110.1
23	G	25.4	Very low	26.3	Very low	77 Å²	77	137.6 Å²	137.6	79%	0.794	82%	0.819	S	S	*	*			trans	162.1	70.1	172.7	0	0	0	0	0	115.6
24	A	26.9	Very low	26.3	Very low	99 Å²	99	131.5 Å²	131.5	82%	0.818	82%	0.819	S	S	*	*			trans	-145.4	80.8	160	0	0	0	0	0	109.6	L26	A24-L26 PolarHBondContact O-N 2.96Å
25	S	25.7	Very low	26.2	Very low	118 Å²	118	132.7 Å²	132.7	83%	0.825	82%	0.819	S	S	*	*			trans	-70.2	103.6	158.7	52.8	0	0	0	0	108.4
26	L	26.7	Very low	26.1	Very low	152 Å²	152	130.1 Å²	130.1	80%	0.796	82%	0.818	S	S	*	*			trans	-142.7	100.9	163.6	-95.8	162.3	0	0	0	108.9	A24 S28	A24-L26 PolarHBondContact O-N 2.96Å; L26-S28 PolarHBondContact O-N 3.18Å
27	T	26.9	Very low	26	Very low	140 Å²	140	133.6 Å²	133.6	86%	0.859	82%	0.822	S	S	*	*			trans	-48.9	112.6	150.5	46.3	0	0	0	0	109.3
28	S	25.1	Very low	26.1	Very low	99 Å²	99	135.3 Å²	135.3	69%	0.692	82%	0.823	S	S	*	*			trans	-141.5	115.1	155.8	60.5	0	0	0	0	109.2	L26 L30	L26-S28 PolarHBondContact O-N 3.18Å; S28-L30 PolarHBondContact O-N 3.47Å
29	E	25.1	Very low	26.1	Very low	195 Å²	195	134.4 Å²	134.4	91%	0.911	82%	0.824	S	S	*	*			trans	-55.9	115.9	167.9	-63.3	179.7	148.7	0	0	108.3	P31	E29-P31 WeakPolarHBondContact O-CD 3.39Å
30	L	24.8	Very low	26.1	Very low	163 Å²	163	137.2 Å²	137.2	85%	0.853	83%	0.825	S	S	*	*			trans	-75.4	117.8	172.2	-102	140.7	0	0	0	108.3	S28	S28-L30 PolarHBondContact O-N 3.47Å
31	P	27.4	Very low	26.1	Very low	105 Å²	105	136.3 Å²	136.3	68%	0.682	83%	0.825	S	S	*	*			trans	-77.1	134.5	-176.6	30.2	-30.6	0	0	0	110.2	E29 Q33	E29-P31 WeakPolarHBondContact O-CD 3.39Å; P31-Q33 PolarHBondContact O-N 3.04Å
32	L	22.9	Very low	26.1	Very low	178 Å²	178	137.9 Å²	137.9	93%	0.932	83%	0.827	S	S	*	*			trans	-56.5	106.4	163.5	-82.1	102.8	0	0	0	109.4
33	Q	24.9	Very low	25.8	Very low	177 Å²	177	139.8 Å²	139.8	83%	0.827	83%	0.83	S	S	*	*			trans	-122.1	119.6	156.5	-90.7	-174.1	-17.3	0	0	109.7	P31 L35	P31-Q33 PolarHBondContact O-N 3.04Å; Q33-L35 PolarHBondContact O-N 3.11Å
34	A	24.9	Very low	25.7	Very low	106 Å²	106	144 Å²	144	88%	0.876	83%	0.833	S	S	*	*			trans	-57.8	114.5	179.4	0	0	0	0	0	111.2	G36	A34-G36 PolarHBondContact O-N 3.08Å
35	L	24.8	Very low	25.6	Very low	165 Å²	165	145 Å²	145	86%	0.864	83%	0.829	S	S	*	*			trans	-86	100.7	161.2	-85.1	157.9	0	0	0	107.6	Q33 L37	Q33-L35 PolarHBondContact O-N 3.11Å; L35-L37 PolarHBondContact O-N 2.8Å
36	G	24	Very low	25.6	Very low	71 Å²	71	145.4 Å²	145.4	73%	0.732	83%	0.826	S	S	*	*			trans	-60.5	111.2	166.2	0	0	0	0	0	109.6	A34 T38	A34-G36 PolarHBondContact O-N 3.08Å; G36-T38 PolarHBondContact O-N 3.32Å
37	L	26.7	Very low	25.5	Very low	169 Å²	169	149.2 Å²	149.2	89%	0.885	83%	0.83	S	S	*	*			trans	-81.4	105.9	167	-78.4	161	0	0	0	107.7	L35 N39	L35-L37 PolarHBondContact O-N 2.8Å; L37-N39 PolarHBondContact O-N 3.05Å
38	T	27.6	Very low	25.4	Very low	129 Å²	129	151.4 Å²	151.4	79%	0.791	83%	0.83	S	S	*	*			trans	-60.3	124.8	170	44.4	0	0	0	0	110.1	G36 D40	G36-T38 PolarHBondContact O-N 3.32Å; T38-D40 PolarHBondContact O-N 2.8Å
39	N	25.6	Very low	25.4	Very low	161 Å²	161	155.3 Å²	155.3	86%	0.861	84%	0.842	S	S	*	*			trans	-52.2	112.1	166.5	-79.6	-28.8	0	0	0	110.6	L37	L37-N39 PolarHBondContact O-N 3.05Å
40	D	26.3	Very low	25.2	Very low	162 Å²	162	150.6 Å²	150.6	87%	0.866	83%	0.831	S	S	*	*			trans	-160.2	83.8	155.8	-93.9	-28.5	0	0	0	108.9	T38	T38-D40 PolarHBondContact O-N 2.8Å
41	S	27.7	Very low	25.2	Very low	116 Å²	116	148.5 Å²	148.5	81%	0.811	83%	0.83	S	S	*	*			trans	-136	107.5	162.8	56.3	0	0	0	0	108.8	L43	S41-L43 PolarHBondContact O-N 3.39Å
42	Q	26.7	Very low	25.2	Very low	192 Å²	192	147.7 Å²	147.7	90%	0.897	83%	0.832	S	S	*	*			trans	-53.2	123	-172.4	-64.6	173.1	-16.2	0	0	112	L44	Q42-L44 PolarHBondContact O-N 3.4Å
43	L	25.1	Very low	25.2	Very low	162 Å²	162	144 Å²	144	85%	0.848	83%	0.827	S	S	*	*			trans	-62.3	110	167.8	-94.2	125.8	0	0	0	109.8	S41 V45	S41-L43 PolarHBondContact O-N 3.39Å; L43-V45 VanDerWaalsContact C-N 3.32Å; L43-V45 PolarHBondContact O-N 2.85Å
44	L	23.5	Very low	25.5	Very low	164 Å²	164	141.3 Å²	141.3	86%	0.859	83%	0.828	S	S	*	*			trans	-65.7	91.6	160.9	-101.2	146.6	0	0	0	108.6	Q42 V46	Q42-L44 PolarHBondContact O-N 3.4Å; L44-V46 PolarHBondContact O-N 2.83Å
45	V	25	Very low	25.5	Very low	121 Å²	121	143.9 Å²	143.9	73%	0.733	83%	0.827	S	S	*	*			trans	-69.6	96.1	171.5	177.8	0	0	0	0	108.5	L43 R47	L43-V45 VanDerWaalsContact C-N 3.32Å; L43-V45 PolarHBondContact O-N 2.85Å; V45-R47 PolarHBondContact O-N 3.25Å
46	V	26.1	Very low	25.8	Very low	127 Å²	127	144.3 Å²	144.3	77%	0.77	83%	0.828	S	S	*	*			trans	-70.4	108.3	167.3	178.6	0	0	0	0	107.7	L44 Q48	L44-V46 PolarHBondContact O-N 2.83Å; V46-Q48 PolarHBondContact O-N 2.93Å
47	R	24.2	Very low	25.9	Very low	232 Å²	232	144.1 Å²	144.1	88%	0.875	83%	0.827	S	S	*	*			trans	-47	116.8	178	-84.9	175.1	165.1	160.7	-4.8	111.8	V45 L49	V45-R47 PolarHBondContact O-N 3.25Å; R47-L49 PolarHBondContact O-N 2.77Å
48	Q	24	Very low	26	Very low	186 Å²	186	148 Å²	148	87%	0.869	83%	0.829	S	S	*	*			trans	-67.8	120	162.3	-78.8	-179.5	-35.8	0	0	109.7	V46 S50	V46-Q48 PolarHBondContact O-N 2.93Å; Q48-S50 PolarHBondContact O-N 3.47Å
49	L	25.1	Very low	26.4	Very low	181 Å²	181	147 Å²	147	95%	0.948	83%	0.825	S	S	*	*			trans	-75.2	106.6	163.6	-85.8	154.3	0	0	0	108.4	R47	R47-L49 PolarHBondContact O-N 2.77Å
50	S	22.6	Very low	26.3	Very low	96 Å²	96	144.5 Å²	144.5	67%	0.671	82%	0.821	S	S	*	*			trans	-97.4	145.2	174.8	54.5	0	0	0	0	111.8	Q48	Q48-S50 PolarHBondContact O-N 3.47Å
51	S	23.5	Very low	26.4	Very low	119 Å²	119	148.2 Å²	148.2	83%	0.832	82%	0.822	S	S	*	*			trans	73.7	143.3	158.9	79.1	0	0	0	0	116.2
52	A	27.1	Very low	26.3	Very low	87 Å²	87	152.1 Å²	152.1	72%	0.719	83%	0.828	S	S	*	*			cis	-156.7	131.4	15.5	0	0	0	0	0	107.3
53	A	24.4	Very low	26.4	Very low	100 Å²	100	148.7 Å²	148.7	83%	0.826	82%	0.822	S	S	*	*				49.7	106.9	100.2	0	0	0	0	0	115.7
54	S	30.6	Very low	26.6	Very low	122 Å²	122	150.6 Å²	150.6	85%	0.853	82%	0.824	S	S	*	*			trans	-146.1	109.5	146.9	57.1	0	0	0	0	110.7
55	D	24.9	Very low	26.7	Very low	159 Å²	159	154.4 Å²	154.4	85%	0.85	83%	0.829	S	S	*	*			trans	-65	133.6	171.3	-78.3	-52.3	0	0	0	112.1
56	I	31.8	Very low	26.9	Very low	174 Å²	174	159.8 Å²	159.8	89%	0.892	84%	0.836	S	S	*	*			trans	-139.5	106.1	145.8	-59.7	-177	0	0	0	108.4
57	G	25.6	Very low	27	Very low	68 Å²	68	159.9 Å²	159.9	70%	0.701	84%	0.837	S	S	*	*			trans	-79.9	153.8	176.7	0	0	0	0	0	114.1
58	R	29.1	Very low	27.2	Very low	249 Å²	249	154.3 Å²	154.3	94%	0.94	83%	0.83	S	S	*	*			trans	-152.8	149.1	150.6	-107.9	-177.8	-178.7	-178.9	0.9	110.4
59	P	35	Very low	27.6	Very low	109 Å²	109	150.2 Å²	150.2	71%	0.708	82%	0.823	S	S	*	*			trans	-106.5	165.2	-145.2	39.1	-34.4	0	0	0	116
60	S	24.4	Very low	27.9	Very low	109 Å²	109	147.6 Å²	147.6	76%	0.762	81%	0.814	S	S	*	*			trans	71.4	104.2	148.6	70.9	0	0	0	0	119.3
61	R	28.8	Very low	28.3	Very low	240 Å²	240	151.5 Å²	151.5	91%	0.906	82%	0.819	S	S	*	*			trans	-155.5	107.9	131.8	-106.6	176.6	-175.5	-171.8	1.4	108	P63	R61-P63 WeakPolarHBondContact O-CD 3.17Å
62	Q	24.6	Very low	28.7	Very low	197 Å²	197	153 Å²	153	92%	0.921	81%	0.814	S	S	*	*			trans	-57.4	118.6	174.3	-71.9	172.3	-29	0	0	110.2
63	P	28.5	Very low	29.2	Very low	120 Å²	120	156.9 Å²	156.9	78%	0.779	82%	0.817	S	S	*	*			trans	-100.8	126	166.6	13.9	7.6	0	0	0	109.3	R61	R61-P63 WeakPolarHBondContact O-CD 3.17Å
64	F	28.9	Very low	30.1	Very low	203 Å²	203	156.9 Å²	156.9	89%	0.89	80%	0.8	S	S	*	*			trans	-29.2	129.7	172.4	-89.2	-106.5	0	0	0	115.3	R66	F64-R66 PolarHBondContact O-N 2.69Å
65	Y	27	Very low	31.2	Very low	243 Å²	243	155.9 Å²	155.9	95%	0.953	79%	0.785	S	S	*	*			trans	-45.8	103.1	167.9	-76.4	-92.9	0	0	0	111.7
66	R	28.1	Very low	32.7	Very low	235 Å²	235	148.6 Å²	148.6	89%	0.887	75%	0.746	S	S	*	*			trans	-104.1	113.4	153.9	-121.2	-178.3	-165.7	-177.1	4.1	106.5	F64	F64-R66 PolarHBondContact O-N 2.69Å
67	T	29.1	Very low	33.8	Very low	129 Å²	129	143 Å²	143	79%	0.791	73%	0.726	S	S	*	*			trans	-42.9	130.6	171.9	40.1	0	0	0	0	110.5	S69	T67-S69 PolarHBondContact O-N 2.95Å; T67-S69 VanDerWaalsContact O-N 3.14Å
68	P	28.8	Very low	35.2	Very low	114 Å²	114	143.8 Å²	143.8	74%	0.74	73%	0.726	S	S	*	*			trans	-67	117.4	-170.7	26.8	-31.7	0	0	0	109.1	V70	P68-V70 PolarHBondContact O-N 3.4Å
69	S	31	Very low	36.8	Very low	101 Å²	101	132.7 Å²	132.7	71%	0.706	69%	0.685	S	S	*	*			trans	-59.2	105.4	163.5	53.7	0	0	0	0	106.9	T67 K71	T67-S69 PolarHBondContact O-N 2.95Å; T67-S69 VanDerWaalsContact O-N 3.14Å; S69-K71 VanDerWaalsContact C-N 3.28Å; S69-K71 PolarHBondContact O-N 3.15Å
70	V	32.1	Very low	38.8	Very low	126 Å²	126	130.6 Å²	130.6	76%	0.764	67%	0.672	S	S	*	*			trans	-58.3	98	168.9	178.1	0	0	0	0	106.1	P68 M72	P68-V70 PolarHBondContact O-N 3.4Å; V70-M72 PolarHBondContact O-N 3.4Å
71	K	32.1	Very low	41.8	Very low	177 Å²	177	125.4 Å²	125.4	77%	0.77	64%	0.635	S	S	*	*			trans	-68.6	83.4	165	-79.2	-173.2	176	-175.4	0	105.7	S69 H73	S69-K71 VanDerWaalsContact C-N 3.28Å; S69-K71 PolarHBondContact O-N 3.15Å; K71-H73 VanDerWaalsContact C-N 3.28Å; K71-H73 PolarHBondContact O-N 3.33Å
72	M	31.7	Very low	44.5	Very low	151 Å²	151	118.1 Å²	118.1	74%	0.744	61%	0.61	S	S	*	*			trans	-61.1	100.8	162.9	-128.6	177.6	169.8	0	0	104.9	V70 Q74	V70-M72 PolarHBondContact O-N 3.4Å; M72-Q74 PolarHBondContact O-N 3.08Å
73	H	36.2	Very low	47.5	Very low	169 Å²	169	112.9 Å²	112.9	78%	0.782	59%	0.588	S	S	*	*			trans	-61	93.1	161	-78.7	-27	0	0	0	105.6	K71 D75	K71-H73 VanDerWaalsContact C-N 3.28Å; K71-H73 PolarHBondContact O-N 3.33Å; H73-D75 VanDerWaalsContact C-N 3.32Å; H73-D75 PolarHBondContact O-N 3.16Å
74	Q	44.4	Very low	50.5	Low	100 Å²	100	107.7 Å²	107.7	47%	0.467	55%	0.554	S	S	.	*			trans	-68.6	99.1	171.6	-76.6	-175	4	0	0	106.4	M72 L76 E892	M72-Q74 PolarHBondContact O-N 3.08Å; Q74-L76 PolarHBondContact O-N 3.31Å; Q74-E892 PolarHBondContact OE1-OE1 3.41Å
75	D	53.7	Low	53.5	Low	100 Å²	100	98.2 Å²	98.2	54%	0.535	51%	0.512	S	S	.	.			trans	-55.8	122.4	162.3	-89.2	-33.3	0	0	0	107.5	H73 A77 A78	H73-D75 VanDerWaalsContact C-N 3.32Å; H73-D75 PolarHBondContact O-N 3.16Å; D75-A77 HydrophobicContact CB-CB 4.33Å; D75-A77 PolarHBondContact O-N 3.33Å; D75-A78 WeakPolarHBondContact O-CB 3.35Å; D75-A78 PolarHBondContact O-N 2.92Å
76	L	55.3	Low	56.5	Low	6 Å²	6	89.6 Å²	89.6	3%	0.031	48%	0.483	C	S	.	.	G	3₁₀ helix	trans	-51.3	-29.2	174.2	-141.4	79.2	0	0	0	110.5	Q74 A78 L79 I889 R980 Q982 N997	Q74-L76 PolarHBondContact O-N 3.31Å; L76-A78 PolarHBondContact O-N 3.06Å; L76-L79 WeakPolarHBondContact O-CB 3.34Å; L76-L79 PolarHBondContact O-N 3.09Å; L76-I889 HydrophobicContact CD1-CD1 4.16Å; L76-R980 HydrophobicContact CD2-CB 4.02Å; L76-Q982 HydrophobicContact CD2-CG 3.93Å; L76-Q982 HydrophobicContact CG-CG 4.4Å; L76-Q982 PolarHBondContact O-NE2 2.98Å; L76-N997 HydrophobicContact CD1-CB 4.11Å
77	A	55.1	Low	59.6	Low	57 Å²	57	84.3 Å²	84.3	47%	0.471	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-55.5	-30.7	174.6	0	0	0	0	0	114.2	D75 L79	D75-A77 HydrophobicContact CB-CB 4.33Å; D75-A77 PolarHBondContact O-N 3.33Å; A77-L79 VanDerWaalsContact C-N 3.28Å; A77-L79 PolarHBondContact O-N 3.43Å
78	A	55.8	Low	62.7	Low	84 Å²	84	78.1 Å²	78.1	69%	0.694	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-83	-2.8	177.2	0	0	0	0	0	113.3	D75 L76 P80	D75-A78 WeakPolarHBondContact O-CB 3.35Å; D75-A78 PolarHBondContact O-N 2.92Å; L76-A78 PolarHBondContact O-N 3.06Å; A78-P80 WeakPolarHBondContact O-CD 3.48Å
79	L	63.4	Low	65.8	Low	17 Å²	17	72.9 Å²	72.9	9%	0.089	39%	0.391	C	S	.	.			trans	-76.9	123.3	-174	-139.2	86.3	0	0	0	112.1	L76 A77 I81 I889	L76-L79 WeakPolarHBondContact O-CB 3.34Å; L76-L79 PolarHBondContact O-N 3.09Å; A77-L79 VanDerWaalsContact C-N 3.28Å; A77-L79 PolarHBondContact O-N 3.43Å; L79-I81 PolarHBondContact O-N 2.88Å; L79-I889 HydrophobicContact CD1-CD1 3.42Å; L79-I889 VanDerWaalsContact CD1-CD1 3.42Å; L79-I889 HydrophobicContact CD2-CB 4.43Å; L79-I889 HydrophobicContact CD2-CD1 3.41Å; L79-I889 VanDerWaalsContact CD2-CD1 3.41Å; L79-I889 HydrophobicContact CD2-CG1 4.49Å; L79-I889 HydrophobicContact CD2-CG2 3.99Å; L79-I889 HydrophobicContact CG-CD1 4Å
80	P	76.8	Confident	68.8	Low	65 Å²	65	73.1 Å²	73.1	42%	0.422	38%	0.379	S	S	.	.			trans	-80.9	69	175.2	34.3	-35.3	0	0	0	110	A78 F82 I83 N84	A78-P80 WeakPolarHBondContact O-CD 3.48Å; P80-F82 PolarHBondContact O-N 3.07Å; P80-F82 VanDerWaalsContact O-N 3.14Å; P80-I83 HydrophobicContact CB-CB 4.09Å; P80-I83 HydrophobicContact CB-CD1 3.57Å; P80-I83 HydrophobicContact CB-CG1 3.81Å; P80-I83 HydrophobicContact CG-CB 4.39Å; P80-I83 HydrophobicContact CG-CD1 4.02Å; P80-I83 HydrophobicContact CG-CG1 4.48Å; P80-I83 WeakPolarHBondContact O-CB 3.26Å; P80-I83 PolarHBondContact O-N 3.38Å; P80-N84 PolarHBondContact O-N 3.42Å
81	I	86.2	Confident	71.7	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-54.5	-33.6	-179.5	-172.3	169.2	0	0	0	112.5	L79 I83 N84 A85 V971 Q982 A984 L993 V995	L79-I81 PolarHBondContact O-N 2.88Å; I81-I83 VanDerWaalsContact C-N 3.31Å; I81-I83 PolarHBondContact O-N 3.24Å; I81-N84 CarbonylContact O-C 3.51Å; I81-N84 PolarHBondContact O-N 3.09Å; I81-N84 VanDerWaalsContact O-N 3.14Å; I81-A85 WeakPolarHBondContact O-CB 3.27Å; I81-A85 PolarHBondContact O-N 2.7Å; I81-V971 HydrophobicContact CG2-CB 4.32Å; I81-V971 HydrophobicContact CG2-CG1 3.6Å; I81-V971 HydrophobicContact CG2-CG2 3.67Å; I81-Q982 HydrophobicContact CD1-CB 3.49Å; I81-Q982 VanDerWaalsContact CD1-CB 3.49Å; I81-Q982 WeakPolarHBondContact CD1-O 3.27Å; I81-A984 HydrophobicContact CD1-CB 3.9Å; I81-A984 HydrophobicContact CG1-CB 3.82Å; I81-A984 HydrophobicContact CG2-CB 4.17Å; I81-L993 HydrophobicContact CG1-CD2 4.41Å; I81-V995 HydrophobicContact CD1-CG2 4.32Å
82	F	86	Confident	74.7	Confident	86 Å²	86	59.8 Å²	59.8	38%	0.377	31%	0.312	S	S	.	.	H	α-helix	trans	-59.1	-39.4	173.4	-74.2	-60.1	0	0	0	113.1	P80 N84 A85 D86 E969 V971	P80-F82 PolarHBondContact O-N 3.07Å; P80-F82 VanDerWaalsContact O-N 3.14Å; F82-N84 VanDerWaalsContact C-N 3.33Å; F82-A85 PolarHBondContact O-N 3.27Å; F82-D86 WeakPolarHBondContact O-CB 3.17Å; F82-D86 PolarHBondContact O-N 3.36Å; F82-E969 WeakPolarHBondContact CE1-O 3.34Å; F82-E969 VanDerWaalsContact CZ-O 3.25Å; F82-E969 WeakPolarHBondContact CZ-O 3.37Å; F82-V971 HydrophobicContact CD1-CG2 4.4Å; F82-V971 HydrophobicContact CD2-CG2 3.82Å; F82-V971 HydrophobicContact CE1-CG2 3.84Å; F82-V971 HydrophobicContact CE2-CG2 3.19Å; F82-V971 HydrophobicContact CG-CG2 4.39Å; F82-V971 HydrophobicContact CZ-CB 4.47Å; F82-V971 HydrophobicContact CZ-CG2 3.2Å
83	I	88.1	Confident	77.7	Confident	88 Å²	88	56.6 Å²	56.6	45%	0.451	29%	0.291	S	S	.	.	H	α-helix	trans	-66.6	-40.5	177.2	-61.3	-179.6	0	0	0	109.7	P80 I81 D86 R87	P80-I83 HydrophobicContact CB-CB 4.09Å; P80-I83 HydrophobicContact CB-CD1 3.57Å; P80-I83 HydrophobicContact CB-CG1 3.81Å; P80-I83 HydrophobicContact CG-CB 4.39Å; P80-I83 HydrophobicContact CG-CD1 4.02Å; P80-I83 HydrophobicContact CG-CG1 4.48Å; P80-I83 WeakPolarHBondContact O-CB 3.26Å; P80-I83 PolarHBondContact O-N 3.38Å; I81-I83 VanDerWaalsContact C-N 3.31Å; I81-I83 PolarHBondContact O-N 3.24Å; I83-D86 PolarHBondContact O-N 3.17Å; I83-R87 WeakPolarHBondContact O-CG 3.23Å; I83-R87 PolarHBondContact O-N 3.02Å
84	N	90.4	Very high	80.5	Confident	11 Å²	11	53.5 Å²	53.5	6%	0.059	28%	0.28	C	S	.	.	H	α-helix	trans	-67.3	-42	176.2	-69.6	-35.1	0	0	0	111.8	P80 I81 F82 D86 R87 V88 V887 L993	P80-N84 PolarHBondContact O-N 3.42Å; I81-N84 CarbonylContact O-C 3.51Å; I81-N84 PolarHBondContact O-N 3.09Å; I81-N84 VanDerWaalsContact O-N 3.14Å; F82-N84 VanDerWaalsContact C-N 3.33Å; N84-D86 PolarHBondContact O-N 2.77Å; N84-R87 WeakPolarHBondContact O-CB 3.38Å; N84-R87 PolarHBondContact O-N 2.89Å; N84-V88 WeakPolarHBondContact O-CG2 3.38Å; N84-V88 PolarHBondContact O-N 2.9Å; N84-V887 HydrophobicContact CB-CG1 4.09Å; N84-V887 HydrophobicContact CB-CG2 4.34Å; N84-L993 HydrophobicContact CB-CD2 4.13Å
85	A	91.4	Very high	82.9	Confident	3 Å²	3	49.2 Å²	49.2	3%	0.025	26%	0.26	C	S	.	.	H	α-helix	trans	-63.4	-39.3	175.7	0	0	0	0	0	112	I81 F82 V88 S89 A984 L993	I81-A85 WeakPolarHBondContact O-CB 3.27Å; I81-A85 PolarHBondContact O-N 2.7Å; F82-A85 PolarHBondContact O-N 3.27Å; A85-V88 PolarHBondContact O-N 3.33Å; A85-S89 WeakPolarHBondContact O-CB 3.42Å; A85-S89 PolarHBondContact O-N 3.45Å; A85-A984 HydrophobicContact CB-CB 4.25Å; A85-L993 HydrophobicContact CB-CD2 4.33Å
86	D	91.6	Very high	84.8	Confident	62 Å²	62	44.4 Å²	44.4	33%	0.332	24%	0.235	S	C	.	.	H	α-helix	trans	-66.5	-39.5	173.9	-178	64.7	0	0	0	112.2	F82 I83 N84 S89 K90	F82-D86 WeakPolarHBondContact O-CB 3.17Å; F82-D86 PolarHBondContact O-N 3.36Å; I83-D86 PolarHBondContact O-N 3.17Å; N84-D86 PolarHBondContact O-N 2.77Å; D86-S89 WeakPolarHBondContact O-CB 3.43Å; D86-S89 PolarHBondContact O-N 3.41Å; D86-K90 WeakPolarHBondContact O-CG 3.29Å; D86-K90 PolarHBondContact O-N 3.38Å; D86-K90 WeakPolarHBondContact OD2-CE 3.44Å; D86-K90 IonicContact OD2-NZ 3.76Å; D86-K90 PolarHBondContact OD2-NZ 3.07Å
87	R	92.1	Very high	86.6	Confident	124 Å²	124	44.5 Å²	44.5	47%	0.468	24%	0.235	S	C	.	.	H	α-helix	trans	-60.7	-44.8	172.1	-75.4	175.2	-176.3	177.7	2.4	111.6	I83 N84 K90 M91	I83-R87 WeakPolarHBondContact O-CG 3.23Å; I83-R87 PolarHBondContact O-N 3.02Å; N84-R87 WeakPolarHBondContact O-CB 3.38Å; N84-R87 PolarHBondContact O-N 2.89Å; R87-K90 PolarHBondContact O-N 2.81Å; R87-M91 WeakPolarHBondContact O-CB 3.47Å; R87-M91 PolarHBondContact O-N 3.1Å
88	V	94.2	Very high	88.5	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.6	-43.6	175.9	173.3	0	0	0	0	110.6	N84 A85 M91 L92 L883 V887 L899 V986 L993	N84-V88 WeakPolarHBondContact O-CG2 3.38Å; N84-V88 PolarHBondContact O-N 2.9Å; A85-V88 PolarHBondContact O-N 3.33Å; V88-M91 HydrophobicContact CG1-CE 4.43Å; V88-M91 HydrophobicContact CG2-CE 4.43Å; V88-M91 PolarHBondContact O-N 3.25Å; V88-L92 HydrophobicContact CG1-CD1 3.69Å; V88-L92 HydrophobicContact CG1-CG 4.13Å; V88-L92 WeakPolarHBondContact O-CB 3.25Å; V88-L92 VanDerWaalsContact O-CG 3.32Å; V88-L92 WeakPolarHBondContact O-CG 3.4Å; V88-L92 PolarHBondContact O-N 2.92Å; V88-L883 HydrophobicContact CG2-CD1 3.75Å; V88-V887 HydrophobicContact CG2-CG2 3.53Å; V88-L899 HydrophobicContact CG1-CD1 4.32Å; V88-L899 HydrophobicContact CG1-CD2 4.38Å; V88-V986 HydrophobicContact CG1-CG1 4.15Å; V88-V986 HydrophobicContact CG1-CG2 4.29Å; V88-L993 HydrophobicContact CG2-CD2 4.46Å
89	S	94.4	Very high	90.3	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-57.2	-51.8	176	174.2	0	0	0	0	112.2	A85 D86 M91 L92 R93 R987	A85-S89 WeakPolarHBondContact O-CB 3.42Å; A85-S89 PolarHBondContact O-N 3.45Å; D86-S89 WeakPolarHBondContact O-CB 3.43Å; D86-S89 PolarHBondContact O-N 3.41Å; S89-M91 VanDerWaalsContact C-N 3.32Å; S89-M91 PolarHBondContact O-N 3.4Å; S89-L92 PolarHBondContact O-N 2.9Å; S89-R93 WeakPolarHBondContact O-CB 3.45Å; S89-R93 VanDerWaalsContact O-CG 3.26Å; S89-R93 WeakPolarHBondContact O-CG 3.28Å; S89-R93 PolarHBondContact O-N 3.46Å; S89-R987 WeakPolarHBondContact CB-O 3.49Å; S89-R987 PolarHBondContact OG-O 3.19Å
90	K	94.7	Very high	91.8	Very high	107 Å²	107	42.9 Å²	42.9	47%	0.465	20%	0.203	S	C	.	.	H	α-helix	trans	-58.8	-44.6	178.2	-74.7	168.5	176.8	160.9	0	111.6	D86 R87 R93 N94	D86-K90 WeakPolarHBondContact O-CG 3.29Å; D86-K90 PolarHBondContact O-N 3.38Å; D86-K90 WeakPolarHBondContact OD2-CE 3.44Å; D86-K90 IonicContact OD2-NZ 3.76Å; D86-K90 PolarHBondContact OD2-NZ 3.07Å; R87-K90 PolarHBondContact O-N 2.81Å; K90-R93 PolarHBondContact O-N 3.22Å; K90-N94 WeakPolarHBondContact O-CB 3.5Å; K90-N94 PolarHBondContact O-N 3.49Å; K90-N94 PolarHBondContact O-OD1 3.01Å
91	M	92.9	Very high	92.7	Very high	20 Å²	20	40 Å²	40	10%	0.099	19%	0.185	C	C	.	.	H	α-helix	trans	-62.7	-50.4	178.5	169.3	-100.7	-76.3	0	0	112	R87 V88 S89 R93 N94 F95 M882 H886	R87-M91 WeakPolarHBondContact O-CB 3.47Å; R87-M91 PolarHBondContact O-N 3.1Å; V88-M91 HydrophobicContact CG1-CE 4.43Å; V88-M91 HydrophobicContact CG2-CE 4.43Å; V88-M91 PolarHBondContact O-N 3.25Å; S89-M91 VanDerWaalsContact C-N 3.32Å; S89-M91 PolarHBondContact O-N 3.4Å; M91-R93 VanDerWaalsContact C-N 3.33Å; M91-R93 PolarHBondContact O-N 3.5Å; M91-N94 PolarHBondContact O-N 2.91Å; M91-F95 VanDerWaalsContact O-CB 3.32Å; M91-F95 WeakPolarHBondContact O-CB 3.39Å; M91-F95 PolarHBondContact O-N 3.41Å; M91-M882 HydrophobicContact CE-CB 3.65Å; M91-M882 WeakPolarHBondContact CE-O 3.24Å; M91-M882 HydrophobicContact CG-CE 3.4Å; M91-M882 HydrophobicContact SD-CB 3.64Å; M91-M882 HydrophobicContact SD-CE 3.64Å; M91-M882 HydrophobicContact SD-CG 4.28Å; M91-H886 HydrophobicContact CE-CB 4.15Å
92	L	95.1	Very high	93	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.016	19%	0.187	C	C	.	.	H	α-helix	trans	-61	-42.9	178.5	-71.6	173.2	0	0	0	111.4	V88 S89 A96 I831 L879 L899 V986 T989 V991	V88-L92 HydrophobicContact CG1-CD1 3.69Å; V88-L92 HydrophobicContact CG1-CG 4.13Å; V88-L92 WeakPolarHBondContact O-CB 3.25Å; V88-L92 VanDerWaalsContact O-CG 3.32Å; V88-L92 WeakPolarHBondContact O-CG 3.4Å; V88-L92 PolarHBondContact O-N 2.92Å; S89-L92 PolarHBondContact O-N 2.9Å; L92-A96 WeakPolarHBondContact O-CB 3.2Å; L92-A96 PolarHBondContact O-N 2.75Å; L92-I831 HydrophobicContact CD1-CD1 3.98Å; L92-I831 HydrophobicContact CD2-CD1 4.09Å; L92-L879 HydrophobicContact CD2-CD2 3.95Å; L92-L899 HydrophobicContact CD1-CD1 4.48Å; L92-V986 HydrophobicContact CD1-CG1 4.34Å; L92-T989 HydrophobicContact CD1-CG2 4.36Å; L92-V991 HydrophobicContact CD1-CG2 4.2Å
93	R	94.7	Very high	93.4	Very high	84 Å²	84	43.3 Å²	43.3	32%	0.317	20%	0.197	S	C	.	.	H	α-helix	trans	-66	-45.3	179.3	-73.1	174	64	-130.8	-5.1	113.2	S89 K90 M91 N97 V829	S89-R93 WeakPolarHBondContact O-CB 3.45Å; S89-R93 VanDerWaalsContact O-CG 3.26Å; S89-R93 WeakPolarHBondContact O-CG 3.28Å; S89-R93 PolarHBondContact O-N 3.46Å; K90-R93 PolarHBondContact O-N 3.22Å; M91-R93 VanDerWaalsContact C-N 3.33Å; M91-R93 PolarHBondContact O-N 3.5Å; R93-N97 VanDerWaalsContact O-CB 3.24Å; R93-N97 WeakPolarHBondContact O-CB 3.2Å; R93-N97 PolarHBondContact O-N 2.83Å; R93-N97 PolarHBondContact O-ND2 3.11Å; R93-V829 HydrophobicContact CG-CG2 3.98Å
94	N	93.8	Very high	93.6	Very high	103 Å²	103	41.8 Å²	41.8	55%	0.551	19%	0.187	S	C	*	.	H	α-helix	trans	-62.9	-51.3	178.8	-70.4	-1.5	0	0	0	110	K90 M91 A96 E98	K90-N94 WeakPolarHBondContact O-CB 3.5Å; K90-N94 PolarHBondContact O-N 3.49Å; K90-N94 PolarHBondContact O-OD1 3.01Å; M91-N94 PolarHBondContact O-N 2.91Å; N94-A96 PolarHBondContact O-N 3.05Å; N94-E98 WeakPolarHBondContact O-CB 3.06Å; N94-E98 PolarHBondContact O-N 2.93Å
95	F	94.3	Very high	93.7	Very high	10 Å²	10	41.2 Å²	41.2	4%	0.044	18%	0.184	C	C	.	.	H	α-helix	trans	-56.2	-53.2	176.9	172.7	-104.1	0	0	0	111.8	M91 E99 F783 V787 L847 I872 V874 F878	M91-F95 VanDerWaalsContact O-CB 3.32Å; M91-F95 WeakPolarHBondContact O-CB 3.39Å; M91-F95 PolarHBondContact O-N 3.41Å; F95-E99 HydrophobicContact CD2-CG 3.85Å; F95-E99 HydrophobicContact CE2-CG 3.61Å; F95-E99 HydrophobicContact CZ-CG 4.17Å; F95-E99 VanDerWaalsContact O-CB 3.27Å; F95-E99 WeakPolarHBondContact O-CB 3.46Å; F95-E99 WeakPolarHBondContact O-CG 3.42Å; F95-E99 PolarHBondContact O-N 2.79Å; F95-F783 AromaticContact CD2-CD2 3.76Å; F95-F783 HydrophobicContact CD2-CD2 3.76Å; F95-F783 AromaticContact CD2-CE2 3.9Å; F95-F783 HydrophobicContact CD2-CE2 3.9Å; F95-F783 HydrophobicContact CD2-CG 4.2Å; F95-F783 HydrophobicContact CD2-CZ 4.43Å; F95-F783 HydrophobicContact CE2-CB 4.05Å; F95-F783 HydrophobicContact CE2-CD1 4.36Å; F95-F783 AromaticContact CE2-CD2 3.77Å; F95-F783 HydrophobicContact CE2-CD2 3.77Å; F95-F783 HydrophobicContact CE2-CE2 4.33Å; F95-F783 AromaticContact CE2-CG 3.79Å; F95-F783 HydrophobicContact CE2-CG 3.79Å; F95-V787 HydrophobicContact CE2-CG2 4.34Å; F95-V787 HydrophobicContact CZ-CG2 4.05Å; F95-L847 HydrophobicContact CD1-CD2 4.06Å; F95-L847 HydrophobicContact CE1-CD2 4.18Å; F95-I872 HydrophobicContact CD1-CD1 4.29Å; F95-I872 HydrophobicContact CE1-CD1 3.55Å; F95-I872 HydrophobicContact CZ-CD1 3.92Å; F95-V874 HydrophobicContact CE1-CG1 4.14Å; F95-V874 HydrophobicContact CZ-CG1 3.92Å; F95-F878 HydrophobicContact CD1-CE1 4.21Å; F95-F878 HydrophobicContact CD2-CE1 4.28Å; F95-F878 HydrophobicContact CD2-CZ 4.14Å; F95-F878 HydrophobicContact CE1-CD1 4.48Å; F95-F878 AromaticContact CE1-CE1 3.62Å; F95-F878 HydrophobicContact CE1-CE1 3.62Å; F95-F878 HydrophobicContact CE1-CZ 4.34Å; F95-F878 AromaticContact CE2-CE1 3.69Å; F95-F878 HydrophobicContact CE2-CE1 3.69Å; F95-F878 AromaticContact CE2-CZ 3.55Å; F95-F878 HydrophobicContact CE2-CZ 3.55Å; F95-F878 HydrophobicContact CZ-CD1 4.31Å; F95-F878 AromaticContact CZ-CE1 3.33Å; F95-F878 HydrophobicContact CZ-CE1 3.33Å; F95-F878 AromaticContact CZ-CZ 3.68Å; F95-F878 HydrophobicContact CZ-CZ 3.68Å
96	A	94.6	Very high	93.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.8	-50.6	-176.9	0	0	0	0	0	112	L92 N94 M100 V829 L847	L92-A96 WeakPolarHBondContact O-CB 3.2Å; L92-A96 PolarHBondContact O-N 2.75Å; N94-A96 PolarHBondContact O-N 3.05Å; A96-M100 HydrophobicContact CB-CE 3.44Å; A96-M100 VanDerWaalsContact CB-CE 3.44Å; A96-M100 WeakPolarHBondContact O-CB 3.32Å; A96-M100 VanDerWaalsContact O-CE 3.26Å; A96-M100 WeakPolarHBondContact O-CE 3.02Å; A96-M100 VanDerWaalsContact O-CG 3.31Å; A96-M100 WeakPolarHBondContact O-CG 3.4Å; A96-M100 PolarHBondContact O-N 3.35Å; A96-V829 HydrophobicContact CB-CB 4.45Å; A96-V829 HydrophobicContact CB-CG1 3.68Å; A96-V829 HydrophobicContact CB-CG2 3.83Å; A96-L847 HydrophobicContact CB-CD2 4.12Å
97	N	93.7	Very high	93.5	Very high	7 Å²	7	41.6 Å²	41.6	4%	0.037	19%	0.189	C	C	.	.	H	α-helix	trans	-71.5	-32.4	-175	-71.3	-19.7	0	0	0	113.3	R93 A101 T102 Y103 H849	R93-N97 VanDerWaalsContact O-CB 3.24Å; R93-N97 WeakPolarHBondContact O-CB 3.2Å; R93-N97 PolarHBondContact O-N 2.83Å; R93-N97 PolarHBondContact O-ND2 3.11Å; N97-A101 PolarHBondContact O-N 3.15Å; N97-T102 PolarHBondContact O-N 2.8Å; N97-T102 PolarHBondContact OD1-OG1 3.05Å; N97-Y103 HydrophobicContact CB-CD2 4.17Å; N97-Y103 HydrophobicContact CB-CE2 3.66Å; N97-Y103 PolarHBondContact ND2-OH 3.4Å; N97-H849 PolarHBondContact OD1-CD2 2.91Å
98	E	93.7	Very high	93.3	Very high	121 Å²	121	39 Å²	39	57%	0.565	18%	0.181	S	C	*	.	H	α-helix	trans	-71.6	-52.9	175.4	-173.2	170.9	-175.3	0	0	110.8	N94 M100 A101 L777	N94-E98 WeakPolarHBondContact O-CB 3.06Å; N94-E98 PolarHBondContact O-N 2.93Å; E98-M100 PolarHBondContact O-N 2.89Å; E98-A101 PolarHBondContact O-N 2.78Å; E98-L777 WeakPolarHBondContact O-CD1 3.46Å
99	E	94.6	Very high	92.8	Very high	3 Å²	3	39.2 Å²	39.2	1%	0.014	18%	0.182	C	C	.	.	H	α-helix	trans	-70.5	-28.4	-176.4	-69.5	-61.2	150.2	0	0	113.7	F95 F783 V787 R790 I872	F95-E99 HydrophobicContact CD2-CG 3.85Å; F95-E99 HydrophobicContact CE2-CG 3.61Å; F95-E99 HydrophobicContact CZ-CG 4.17Å; F95-E99 VanDerWaalsContact O-CB 3.27Å; F95-E99 WeakPolarHBondContact O-CB 3.46Å; F95-E99 WeakPolarHBondContact O-CG 3.42Å; F95-E99 PolarHBondContact O-N 2.79Å; E99-F783 HydrophobicContact CG-CD2 4.35Å; E99-F783 WeakPolarHBondContact OE1-CD2 3.38Å; E99-V787 HydrophobicContact CB-CG2 4.45Å; E99-V787 HydrophobicContact CG-CG2 4.21Å; E99-R790 WeakPolarHBondContact O-CD 3.46Å; E99-R790 PolarHBondContact O-NE 2.03Å; E99-R790 VanDerWaalsContact O-NE 3.1Å; E99-R790 IonicContact OE2-CZ 3.78Å; E99-R790 IonicContact OE2-NE 3.47Å; E99-R790 IonicContact OE2-NH2 3.62Å; E99-R790 PolarHBondContact OE2-NH2 2.04Å; E99-I872 HydrophobicContact CB-CD1 3.89Å
100	M	95	Very high	92.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-78.5	-18.4	171	-76.5	-174.5	-96.5	0	0	113.4	A96 E98 W774 L847 H849 L870 I872	A96-M100 HydrophobicContact CB-CE 3.44Å; A96-M100 VanDerWaalsContact CB-CE 3.44Å; A96-M100 WeakPolarHBondContact O-CB 3.32Å; A96-M100 VanDerWaalsContact O-CE 3.26Å; A96-M100 WeakPolarHBondContact O-CE 3.02Å; A96-M100 VanDerWaalsContact O-CG 3.31Å; A96-M100 WeakPolarHBondContact O-CG 3.4Å; A96-M100 PolarHBondContact O-N 3.35Å; E98-M100 PolarHBondContact O-N 2.89Å; M100-W774 PolarHBondContact O-NE1 3.3Å; M100-L847 HydrophobicContact CE-CB 4.35Å; M100-H849 HydrophobicContact CE-CB 4.12Å; M100-H849 HydrophobicContact SD-CB 4.17Å; M100-L870 HydrophobicContact CB-CB 4.13Å; M100-L870 HydrophobicContact CB-CD1 4.39Å; M100-L870 HydrophobicContact CG-CB 4.26Å; M100-L870 VanDerWaalsContact SD-C 3.58Å; M100-L870 HydrophobicContact SD-CB 3.82Å; M100-I872 HydrophobicContact CG-CB 4.47Å; M100-I872 HydrophobicContact CG-CG1 4.27Å; M100-I872 HydrophobicContact CG-CG2 3.69Å
101	A	95.1	Very high	91.7	Very high	6 Å²	6	39.5 Å²	39.5	5%	0.05	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	39.7	-167.7	0	0	0	0	0	113.8	N97 E98 F104 L105 E773 L777	N97-A101 PolarHBondContact O-N 3.15Å; E98-A101 PolarHBondContact O-N 2.78Å; A101-F104 HydrophobicContact CB-CB 4.19Å; A101-F104 WeakPolarHBondContact O-CB 3.45Å; A101-F104 PolarHBondContact O-N 3.35Å; A101-L105 PolarHBondContact O-N 3.1Å; A101-E773 HydrophobicContact CB-CB 4.49Å; A101-E773 HydrophobicContact CB-CG 3.69Å; A101-L777 HydrophobicContact CB-CD1 4.1Å
102	T	93.9	Very high	90.9	Very high	6 Å²	6	39.5 Å²	39.5	4%	0.037	20%	0.2	C	C	.	.	H	α-helix	trans	-59.1	-51.8	-175	-54.3	0	0	0	0	112.3	N97 F104 L105 Q106 H849 I851 L870	N97-T102 PolarHBondContact O-N 2.8Å; N97-T102 PolarHBondContact OD1-OG1 3.05Å; T102-F104 VanDerWaalsContact C-N 3.3Å; T102-F104 PolarHBondContact O-N 2.93Å; T102-L105 PolarHBondContact O-N 2.93Å; T102-Q106 WeakPolarHBondContact O-CB 3.46Å; T102-Q106 PolarHBondContact O-N 3.44Å; T102-H849 HydrophobicContact CG2-CB 4.46Å; T102-I851 HydrophobicContact CG2-CD1 3.89Å; T102-L870 HydrophobicContact CG2-CD1 4.4Å
103	Y	92.4	Very high	89.4	Confident	149 Å²	149	43.8 Å²	43.8	58%	0.584	23%	0.227	S	C	*	.	H	α-helix	trans	-63.3	-37.6	-179.7	-62.8	-60.7	0	0	0	112.3	N97 S107	N97-Y103 HydrophobicContact CB-CD2 4.17Å; N97-Y103 HydrophobicContact CB-CE2 3.66Å; N97-Y103 PolarHBondContact ND2-OH 3.4Å; Y103-S107 WeakPolarHBondContact O-CB 3.34Å; Y103-S107 PolarHBondContact O-N 2.04Å
104	F	93.4	Very high	87.9	Confident	55 Å²	55	42.2 Å²	42.2	24%	0.241	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-51.1	176.2	172.4	-92.7	0	0	0	110.5	A101 T102 S107 K108 K769 E773	A101-F104 HydrophobicContact CB-CB 4.19Å; A101-F104 WeakPolarHBondContact O-CB 3.45Å; A101-F104 PolarHBondContact O-N 3.35Å; T102-F104 VanDerWaalsContact C-N 3.3Å; T102-F104 PolarHBondContact O-N 2.93Å; F104-S107 PolarHBondContact O-N 3.45Å; F104-S107 PolarHBondContact O-OG 3.04Å; F104-K108 HydrophobicContact CE1-CG 4.34Å; F104-K108 HydrophobicContact CZ-CG 4.45Å; F104-K108 WeakPolarHBondContact O-CG 3.04Å; F104-K108 PolarHBondContact O-N 2.63Å; F104-K769 HydrophobicContact CE1-CB 4.26Å; F104-K769 HydrophobicContact CZ-CB 4.23Å; F104-E773 HydrophobicContact CB-CG 4.44Å; F104-E773 HydrophobicContact CD1-CB 4.12Å; F104-E773 HydrophobicContact CD1-CG 4.21Å; F104-E773 HydrophobicContact CD2-CG 4.41Å; F104-E773 HydrophobicContact CE1-CB 4.07Å; F104-E773 HydrophobicContact CG-CB 4.44Å; F104-E773 HydrophobicContact CG-CG 4.1Å; F104-E773 HydrophobicContact CZ-CB 4.33Å
105	L	91.5	Very high	86	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-66.7	-45.1	-177.9	-171.6	60.4	0	0	0	111.5	A101 T102 S107 K108 F109 L767 I770 I851 L870	A101-L105 PolarHBondContact O-N 3.1Å; T102-L105 PolarHBondContact O-N 2.93Å; L105-S107 VanDerWaalsContact C-N 3.28Å; L105-S107 PolarHBondContact O-N 2.04Å; L105-K108 WeakPolarHBondContact O-CA 3.49Å; L105-K108 WeakPolarHBondContact O-CB 3.38Å; L105-K108 PolarHBondContact O-N 3.07Å; L105-F109 HydrophobicContact CD1-CD2 4.12Å; L105-F109 HydrophobicContact CD1-CE2 3.79Å; L105-F109 HydrophobicContact CD2-CE2 4.26Å; L105-F109 HydrophobicContact CG-CD2 4.02Å; L105-F109 HydrophobicContact CG-CE2 3.85Å; L105-F109 WeakPolarHBondContact O-CD2 3.45Å; L105-F109 PolarHBondContact O-N 3.04Å; L105-F109 VanDerWaalsContact O-N 3.14Å; L105-L767 HydrophobicContact CD2-CD2 4.33Å; L105-I770 HydrophobicContact CB-CD1 4.34Å; L105-I770 HydrophobicContact CD2-CD1 3.99Å; L105-I851 HydrophobicContact CB-CD1 4.33Å; L105-I851 HydrophobicContact CD2-CG1 4.06Å; L105-L870 HydrophobicContact CB-CD1 4.36Å; L105-L870 HydrophobicContact CD2-CD1 4.13Å; L105-L870 HydrophobicContact CD2-CD2 3.92Å; L105-L870 HydrophobicContact CD2-CG 4.17Å
106	Q	91	Very high	84	Confident	21 Å²	21	45.7 Å²	45.7	10%	0.098	24%	0.239	C	C	.	.	H	α-helix	trans	-56.4	-43.7	177.2	-170.5	62.2	61.2	0	0	111.3	T102 K108 F109 D110 I851 Y852 H860	T102-Q106 WeakPolarHBondContact O-CB 3.46Å; T102-Q106 PolarHBondContact O-N 3.44Å; Q106-K108 PolarHBondContact O-N 3.26Å; Q106-K108 VanDerWaalsContact O-N 3.16Å; Q106-F109 WeakPolarHBondContact O-CA 3.45Å; Q106-F109 PolarHBondContact O-N 3.02Å; Q106-D110 PolarHBondContact NE2-OD1 3.48Å; Q106-D110 VanDerWaalsContact O-CG 3.27Å; Q106-D110 PolarHBondContact O-N 3.23Å; Q106-I851 HydrophobicContact CB-CD1 4.19Å; Q106-Y852 PolarHBondContact NE2-O 3.25Å; Q106-H860 PolarHBondContact NE2-NE2 3.39Å; Q106-H860 VanDerWaalsContact NE2-NE2 3.15Å
107	S	89.1	Confident	81.9	Confident	52 Å²	52	49.1 Å²	49.1	36%	0.364	26%	0.257	S	S	.	.	H	α-helix	trans	-60.3	-28.3	176.3	79.1	0	0	0	0	113.6	Y103 F104 L105 A111	Y103-S107 WeakPolarHBondContact O-CB 3.34Å; Y103-S107 PolarHBondContact O-N 2.04Å; F104-S107 PolarHBondContact O-N 3.45Å; F104-S107 PolarHBondContact O-OG 3.04Å; L105-S107 VanDerWaalsContact C-N 3.28Å; L105-S107 PolarHBondContact O-N 2.04Å; S107-A111 WeakPolarHBondContact O-CB 3.04Å; S107-A111 PolarHBondContact O-N 3.02Å
108	K	86.5	Confident	79.7	Confident	68 Å²	68	55.7 Å²	55.7	30%	0.296	29%	0.292	S	S	.	.	H	α-helix	trans	-76.8	-32.6	175.4	-60.1	-43	176.4	-155.9	0	111.8	F104 L105 Q106 M112 K769	F104-K108 HydrophobicContact CE1-CG 4.34Å; F104-K108 HydrophobicContact CZ-CG 4.45Å; F104-K108 WeakPolarHBondContact O-CG 3.04Å; F104-K108 PolarHBondContact O-N 2.63Å; L105-K108 WeakPolarHBondContact O-CA 3.49Å; L105-K108 WeakPolarHBondContact O-CB 3.38Å; L105-K108 PolarHBondContact O-N 3.07Å; Q106-K108 PolarHBondContact O-N 3.26Å; Q106-K108 VanDerWaalsContact O-N 3.16Å; K108-M112 WeakPolarHBondContact O-CG 3.46Å; K108-K769 HydrophobicContact CD-CD 4.2Å; K108-K769 HydrophobicContact CG-CD 4.29Å
109	F	84.6	Confident	77.8	Confident	6 Å²	6	52.1 Å²	52.1	3%	0.026	29%	0.288	C	S	.	.	H	α-helix	trans	-70.8	-45.1	173	-82.6	-93.1	0	0	0	111.8	L105 Q106 A111 M112 Y114 L767 I851 G854 V867	L105-F109 HydrophobicContact CD1-CD2 4.12Å; L105-F109 HydrophobicContact CD1-CE2 3.79Å; L105-F109 HydrophobicContact CD2-CE2 4.26Å; L105-F109 HydrophobicContact CG-CD2 4.02Å; L105-F109 HydrophobicContact CG-CE2 3.85Å; L105-F109 WeakPolarHBondContact O-CD2 3.45Å; L105-F109 PolarHBondContact O-N 3.04Å; L105-F109 VanDerWaalsContact O-N 3.14Å; Q106-F109 WeakPolarHBondContact O-CA 3.45Å; Q106-F109 PolarHBondContact O-N 3.02Å; F109-A111 PolarHBondContact O-N 3.32Å; F109-A111 VanDerWaalsContact O-N 3.17Å; F109-M112 HydrophobicContact CB-CE 4.05Å; F109-M112 HydrophobicContact CD1-CE 3.18Å; F109-M112 HydrophobicContact CD2-CE 4.15Å; F109-M112 HydrophobicContact CE1-CE 3.54Å; F109-M112 HydrophobicContact CE2-CE 4.44Å; F109-M112 HydrophobicContact CG-CE 3.53Å; F109-M112 HydrophobicContact CZ-CE 4.16Å; F109-M112 WeakPolarHBondContact O-CB 3.46Å; F109-M112 PolarHBondContact O-N 2.82Å; F109-Y114 PolarHBondContact O-OH 3.39Å; F109-L767 HydrophobicContact CE2-CD2 4.02Å; F109-L767 HydrophobicContact CZ-CD2 3.92Å; F109-I851 HydrophobicContact CD2-CG2 3.79Å; F109-I851 HydrophobicContact CE2-CG2 4.11Å; F109-I851 HydrophobicContact CG-CG2 4.18Å; F109-G854 WeakPolarHBondContact O-CA 3.07Å; F109-V867 HydrophobicContact CD1-CB 4.49Å; F109-V867 HydrophobicContact CD1-CG2 3.61Å; F109-V867 HydrophobicContact CE1-CB 4.07Å; F109-V867 HydrophobicContact CE1-CG2 3.46Å; F109-V867 VanDerWaalsContact CE1-CG2 3.46Å; F109-V867 HydrophobicContact CG-CG2 4.24Å; F109-V867 HydrophobicContact CZ-CG2 3.98Å
110	D	84.6	Confident	76.7	Confident	33 Å²	33	53.1 Å²	53.1	18%	0.176	30%	0.299	C	S	.	.	H	α-helix	trans	-61.1	-27.1	178.1	-62	-14.8	0	0	0	113.1	Q106 M112 G854 A858 H860	Q106-D110 PolarHBondContact NE2-OD1 3.48Å; Q106-D110 VanDerWaalsContact O-CG 3.27Å; Q106-D110 PolarHBondContact O-N 3.23Å; D110-M112 VanDerWaalsContact C-N 3.34Å; D110-G854 WeakPolarHBondContact OD1-CA 3.45Å; D110-A858 HydrophobicContact CB-CB 4.35Å; D110-A858 WeakPolarHBondContact OD2-CB 3.35Å; D110-H860 IonicContact OD1-CE1 2.67Å; D110-H860 PolarHBondContact OD1-CE1 3.14Å; D110-H860 IonicContact OD1-NE2 3.89Å; D110-H860 PolarHBondContact OD1-NE2 3.23Å; D110-H860 IonicContact OD2-NE2 3.98Å; D110-H860 PolarHBondContact OD2-NE2 3.46Å
111	A	81.7	Confident	75.9	Confident	83 Å²	83	54.9 Å²	54.9	69%	0.686	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-3.5	175.9	0	0	0	0	0	114.4	S107 F109	S107-A111 WeakPolarHBondContact O-CB 3.04Å; S107-A111 PolarHBondContact O-N 3.02Å; F109-A111 PolarHBondContact O-N 3.32Å; F109-A111 VanDerWaalsContact O-N 3.17Å
112	M	75.5	Confident	75.3	Confident	19 Å²	19	57.1 Å²	57.1	9%	0.094	32%	0.323	C	S	.	.	S	Bend	trans	-84.7	144.5	176.3	-70.2	-168.6	-85.8	0	0	111.1	K108 F109 D110 Y114 A671 R673 A766	K108-M112 WeakPolarHBondContact O-CG 3.46Å; F109-M112 HydrophobicContact CB-CE 4.05Å; F109-M112 HydrophobicContact CD1-CE 3.18Å; F109-M112 HydrophobicContact CD2-CE 4.15Å; F109-M112 HydrophobicContact CE1-CE 3.54Å; F109-M112 HydrophobicContact CE2-CE 4.44Å; F109-M112 HydrophobicContact CG-CE 3.53Å; F109-M112 HydrophobicContact CZ-CE 4.16Å; F109-M112 WeakPolarHBondContact O-CB 3.46Å; F109-M112 PolarHBondContact O-N 2.82Å; D110-M112 VanDerWaalsContact C-N 3.34Å; M112-Y114 HydrophobicContact CB-CE2 3.96Å; M112-Y114 VanDerWaalsContact O-CD2 3.22Å; M112-Y114 WeakPolarHBondContact O-CD2 3.06Å; M112-Y114 WeakPolarHBondContact O-CE2 3.48Å; M112-A671 HydrophobicContact CB-CB 4.11Å; M112-A671 HydrophobicContact SD-CB 4.37Å; M112-R673 HydrophobicContact SD-CG 4.31Å; M112-A766 HydrophobicContact CE-CB 4.08Å; M112-A766 HydrophobicContact SD-CB 4.14Å
113	T	64.1	Low	74.9	Confident	94 Å²	94	62.2 Å²	62.2	58%	0.577	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	135.6	173.7	44.6	0	0	0	0	110.3	A671 N672	T113-A671 CarbonylContact O-C 3.54Å; T113-A671 VanDerWaalsContact O-C 3.27Å; T113-A671 WeakPolarHBondContact O-CA 3.28Å; T113-A671 WeakPolarHBondContact O-CB 3.38Å; T113-N672 WeakPolarHBondContact O-CA 3.29Å; T113-N672 PolarHBondContact O-N 2.86Å; T113-N672 PolarHBondContact OG1-O 3.38Å
114	Y	62.3	Low	74.7	Confident	50 Å²	50	58.1 Å²	58.1	20%	0.196	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	141.5	-177.9	-61.9	-100	0	0	0	114.2	F109 M112 E669 A671 E853 G854	F109-Y114 PolarHBondContact O-OH 3.39Å; M112-Y114 HydrophobicContact CB-CE2 3.96Å; M112-Y114 VanDerWaalsContact O-CD2 3.22Å; M112-Y114 WeakPolarHBondContact O-CD2 3.06Å; M112-Y114 WeakPolarHBondContact O-CE2 3.48Å; Y114-E669 HydrophobicContact CD1-CB 4.16Å; Y114-E669 WeakPolarHBondContact CD1-O 3.2Å; Y114-E669 HydrophobicContact CG-CB 4.31Å; Y114-A671 HydrophobicContact CD1-CB 3.73Å; Y114-A671 HydrophobicContact CE1-CB 3.7Å; Y114-A671 HydrophobicContact CG-CB 4.23Å; Y114-E853 HydrophobicContact CE1-CB 4.41Å; Y114-G854 WeakPolarHBondContact CD2-O 3.48Å; Y114-G854 WeakPolarHBondContact CE2-O 3.48Å; Y114-G854 WeakPolarHBondContact OH-CA 3.46Å; Y114-G854 PolarHBondContact OH-N 3.09Å
115	Q	55.1	Low	74.5	Confident	112 Å²	112	55.7 Å²	55.7	52%	0.523	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133.2	171	-74	-165.1	-23.7	0	0	109.1	D117 E669 R670 N672	Q115-D117 PolarHBondContact O-N 2.82Å; Q115-E669 CarbonylContact O-C 3.45Å; Q115-R670 PolarHBondContact N-O 3.02Å; Q115-R670 PolarHBondContact O-N 3.21Å; Q115-N672 VanDerWaalsContact CD-CG 3.46Å; Q115-N672 VanDerWaalsContact CD-ND2 3.29Å; Q115-N672 VanDerWaalsContact CD-OD1 3.27Å; Q115-N672 HydrophobicContact CG-CB 4.32Å; Q115-N672 PolarHBondContact NE2-ND2 2.74Å; Q115-N672 PolarHBondContact OE1-OD1 3.24Å
116	V	52.5	Low	74.6	Confident	74 Å²	74	57.8 Å²	57.8	45%	0.448	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	117.5	173.3	178.6	0	0	0	0	108.7	E669	V116-E669 HydrophobicContact CG2-CG 3.93Å
117	D	50.8	Low	74.6	Confident	73 Å²	73	59.6 Å²	59.6	39%	0.39	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	119.2	169.1	-159.9	-9.3	0	0	0	108.9	Q115 G119 V668 R670	Q115-D117 PolarHBondContact O-N 2.82Å; D117-G119 PolarHBondContact O-N 3.4Å; D117-G119 PolarHBondContact OD1-N 3.43Å; D117-V668 PolarHBondContact N-O 3.1Å; D117-V668 VanDerWaalsContact N-O 3.15Å; D117-R670 HydrophobicContact CB-CG 4.31Å; D117-R670 IonicContact OD2-CZ 3.63Å; D117-R670 IonicContact OD2-NE 3.7Å; D117-R670 IonicContact OD2-NH1 3.07Å; D117-R670 PolarHBondContact OD2-NH1 3.12Å
118	N	47.1	Very low	74.7	Confident	144 Å²	144	58.3 Å²	58.3	77%	0.77	35%	0.346	S	S	*	.			trans	-85.9	16.7	-179.3	-80.1	-9.6	0	0	0	112.8	G120	N118-G120 PolarHBondContact O-N 3.5Å
119	G	53.9	Low	75.1	Confident	46 Å²	46	55.1 Å²	55.1	47%	0.474	33%	0.332	S	S	.	.			trans	-52.1	107.8	174.5	0	0	0	0	0	110.7	D117	D117-G119 PolarHBondContact O-N 3.4Å; D117-G119 PolarHBondContact OD1-N 3.43Å
120	G	70.7	Confident	75.5	Confident	25 Å²	25	58 Å²	58	26%	0.258	35%	0.347	S	S	.	.			trans	-76.9	131.6	-176.4	0	0	0	0	0	110.6	N118 S122 D123 E124	N118-G120 PolarHBondContact O-N 3.5Å; G120-S122 PolarHBondContact O-N 3.33Å; G120-D123 PolarHBondContact O-N 2.77Å; G120-E124 PolarHBondContact O-N 3.14Å
121	H	78.7	Confident	75.7	Confident	37 Å²	37	58.9 Å²	58.9	17%	0.171	36%	0.36	C	S	.	.	H	α-helix	trans	-55.7	-21	172.1	-63.9	-51.9	0	0	0	113	E124 V125 Y567 Y647 V660 S662	H121-E124 IonicContact ND1-OE2 3.85Å; H121-E124 PolarHBondContact ND1-OE2 3.48Å; H121-E124 VanDerWaalsContact ND1-OE2 3.11Å; H121-V125 PolarHBondContact O-N 2.83Å; H121-Y567 PolarHBondContact ND1-OH 3.49Å; H121-Y567 VanDerWaalsContact ND1-OH 3.15Å; H121-Y647 HydrophobicContact CB-CD2 3.6Å; H121-Y647 HydrophobicContact CB-CE2 3.61Å; H121-Y647 HydrophobicContact CB-CG 4.13Å; H121-V660 HydrophobicContact CB-CG1 4.25Å; H121-S662 VanDerWaalsContact CD2-CB 3.47Å; H121-S662 WeakPolarHBondContact CD2-CB 3.47Å; H121-S662 PolarHBondContact CD2-OG 3.32Å; H121-S662 PolarHBondContact NE2-OG 2.95Å
122	S	82.5	Confident	76.1	Confident	52 Å²	52	55.3 Å²	55.3	36%	0.364	33%	0.329	S	S	.	.	H	α-helix	trans	-59.7	-42.4	169.8	57.4	0	0	0	0	113.1	G120 V125 V126	G120-S122 PolarHBondContact O-N 3.33Å; S122-V125 WeakPolarHBondContact O-CG1 3.48Å; S122-V126 VanDerWaalsContact O-CG2 3.27Å; S122-V126 WeakPolarHBondContact O-CG2 3.49Å; S122-V126 PolarHBondContact O-N 3.43Å
123	D	85.2	Confident	76.9	Confident	113 Å²	113	55 Å²	55	60%	0.604	33%	0.33	S	S	*	.	H	α-helix	trans	-78.2	-34.6	-176.8	-60.6	-14	0	0	0	109.9	G120 V126 A127	G120-D123 PolarHBondContact O-N 2.77Å; D123-V126 PolarHBondContact O-N 3.42Å; D123-A127 WeakPolarHBondContact O-CB 3.3Å; D123-A127 PolarHBondContact O-N 3.42Å
124	E	87	Confident	78	Confident	63 Å²	63	54 Å²	54	29%	0.294	33%	0.327	S	S	.	.	H	α-helix	trans	-65.4	-42.6	176.3	-62.7	-178.5	154.1	0	0	112.2	G120 H121 V126 A127 L128 Y567	G120-E124 PolarHBondContact O-N 3.14Å; H121-E124 IonicContact ND1-OE2 3.85Å; H121-E124 PolarHBondContact ND1-OE2 3.48Å; H121-E124 VanDerWaalsContact ND1-OE2 3.11Å; E124-V126 VanDerWaalsContact C-N 3.31Å; E124-V126 PolarHBondContact O-N 3.08Å; E124-A127 PolarHBondContact O-N 2.66Å; E124-L128 WeakPolarHBondContact O-CG 3.47Å; E124-L128 PolarHBondContact O-N 3.24Å; E124-Y567 HydrophobicContact CB-CE2 4.05Å; E124-Y567 WeakPolarHBondContact OE2-CE2 3.21Å; E124-Y567 PolarHBondContact OE2-OH 3.36Å
125	V	91.1	Very high	79.1	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.024	33%	0.329	C	S	.	.	H	α-helix	trans	-67.6	-33.6	177.1	78.9	0	0	0	0	111.7	H121 S122 A129 K649 I658 V660	H121-V125 PolarHBondContact O-N 2.83Å; S122-V125 WeakPolarHBondContact O-CG1 3.48Å; V125-A129 WeakPolarHBondContact O-CB 3.07Å; V125-A129 PolarHBondContact O-N 3.35Å; V125-A129 VanDerWaalsContact O-N 3.07Å; V125-K649 HydrophobicContact CG1-CB 4.23Å; V125-K649 HydrophobicContact CG2-CB 4.24Å; V125-I658 HydrophobicContact CG2-CB 4.3Å; V125-I658 HydrophobicContact CG2-CG2 3.94Å; V125-V660 HydrophobicContact CB-CB 4.4Å; V125-V660 HydrophobicContact CB-CG2 3.84Å; V125-V660 HydrophobicContact CG2-CB 4.39Å; V125-V660 HydrophobicContact CG2-CG2 3.81Å
126	V	92.8	Very high	80.7	Confident	45 Å²	45	49.2 Å²	49.2	27%	0.273	31%	0.305	S	S	.	.	H	α-helix	trans	-65.5	-47.5	173.1	172.2	0	0	0	0	110.5	S122 D123 E124 L128 A129 D130 K649	S122-V126 VanDerWaalsContact O-CG2 3.27Å; S122-V126 WeakPolarHBondContact O-CG2 3.49Å; S122-V126 PolarHBondContact O-N 3.43Å; D123-V126 PolarHBondContact O-N 3.42Å; E124-V126 VanDerWaalsContact C-N 3.31Å; E124-V126 PolarHBondContact O-N 3.08Å; V126-L128 VanDerWaalsContact C-N 3.33Å; V126-L128 PolarHBondContact O-N 2.82Å; V126-A129 PolarHBondContact O-N 3.47Å; V126-A129 VanDerWaalsContact O-N 3.15Å; V126-D130 WeakPolarHBondContact CG1-OD2 3.32Å; V126-D130 WeakPolarHBondContact O-CB 3.44Å; V126-D130 PolarHBondContact O-N 3.35Å; V126-K649 HydrophobicContact CG2-CD 4.2Å; V126-K649 HydrophobicContact CG2-CG 4.47Å
127	A	90.6	Very high	82.3	Confident	59 Å²	59	49 Å²	49	49%	0.488	31%	0.307	S	S	.	.	H	α-helix	trans	-60.4	-40.6	178.1	0	0	0	0	0	112.6	D123 E124 A131	D123-A127 WeakPolarHBondContact O-CB 3.3Å; D123-A127 PolarHBondContact O-N 3.42Å; E124-A127 PolarHBondContact O-N 2.66Å; A127-A131 VanDerWaalsContact O-CB 3.27Å; A127-A131 WeakPolarHBondContact O-CB 3.35Å; A127-A131 PolarHBondContact O-N 2.82Å
128	L	91.6	Very high	84	Confident	25 Å²	25	47 Å²	47	13%	0.131	30%	0.299	C	S	.	.	H	α-helix	trans	-62.2	-44.8	174.3	-76.5	172.7	0	0	0	111.8	E124 V126 M132 P563 Y567 A576 I658 V660	E124-L128 WeakPolarHBondContact O-CG 3.47Å; E124-L128 PolarHBondContact O-N 3.24Å; V126-L128 VanDerWaalsContact C-N 3.33Å; V126-L128 PolarHBondContact O-N 2.82Å; L128-M132 PolarHBondContact O-N 3.37Å; L128-M132 VanDerWaalsContact O-N 3.07Å; L128-P563 HydrophobicContact CD2-CB 3.94Å; L128-Y567 HydrophobicContact CD1-CD2 3.75Å; L128-Y567 HydrophobicContact CD1-CE2 4.32Å; L128-Y567 HydrophobicContact CD1-CG 4.13Å; L128-A576 HydrophobicContact CD1-CB 4.21Å; L128-I658 HydrophobicContact CB-CD1 3.99Å; L128-I658 HydrophobicContact CB-CG2 4.35Å; L128-I658 HydrophobicContact CD1-CG2 4.37Å; L128-V660 HydrophobicContact CD1-CG2 4.34Å
129	A	94	Very high	86	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68.1	-41.2	-178.8	0	0	0	0	0	112.3	V125 V126 M132 A133 K649 V651 I658	V125-A129 WeakPolarHBondContact O-CB 3.07Å; V125-A129 PolarHBondContact O-N 3.35Å; V125-A129 VanDerWaalsContact O-N 3.07Å; V126-A129 PolarHBondContact O-N 3.47Å; V126-A129 VanDerWaalsContact O-N 3.15Å; A129-M132 PolarHBondContact O-N 3.48Å; A129-A133 VanDerWaalsContact O-CB 3.29Å; A129-A133 WeakPolarHBondContact O-CB 3.44Å; A129-A133 PolarHBondContact O-N 3.46Å; A129-K649 HydrophobicContact CB-CB 3.91Å; A129-K649 HydrophobicContact CB-CG 3.33Å; A129-V651 HydrophobicContact CB-CG2 4.19Å; A129-I658 HydrophobicContact CB-CD1 4.18Å
130	D	92.9	Very high	87.7	Confident	66 Å²	66	40.2 Å²	40.2	35%	0.353	25%	0.253	S	S	.	.	H	α-helix	trans	-68.6	-37.7	178.3	-69.6	-20.5	0	0	0	111.3	V126 A133 S134	V126-D130 WeakPolarHBondContact CG1-OD2 3.32Å; V126-D130 WeakPolarHBondContact O-CB 3.44Å; V126-D130 PolarHBondContact O-N 3.35Å; D130-A133 PolarHBondContact O-N 2.65Å; D130-S134 WeakPolarHBondContact O-CB 2.9Å; D130-S134 PolarHBondContact O-N 2.78Å
131	A	89.3	Confident	88.5	Confident	53 Å²	53	42.4 Å²	42.4	44%	0.438	27%	0.265	S	S	.	.	H	α-helix	trans	-63.1	-42.4	173.8	0	0	0	0	0	112.2	A127 K135	A127-A131 VanDerWaalsContact O-CB 3.27Å; A127-A131 WeakPolarHBondContact O-CB 3.35Å; A127-A131 PolarHBondContact O-N 2.82Å; A131-K135 PolarHBondContact O-N 2.89Å
132	M	90.9	Very high	89.1	Confident	8 Å²	8	40.8 Å²	40.8	4%	0.039	26%	0.258	C	S	.	.	H	α-helix	trans	-66.3	-45.5	175.2	-171	176.9	178.9	0	0	111.2	L128 A129 S134 K135 L136 L560 I564 L578 V651 Y656 I658	L128-M132 PolarHBondContact O-N 3.37Å; L128-M132 VanDerWaalsContact O-N 3.07Å; A129-M132 PolarHBondContact O-N 3.48Å; M132-S134 VanDerWaalsContact C-N 3.31Å; M132-S134 PolarHBondContact O-N 3.44Å; M132-K135 PolarHBondContact O-N 3.23Å; M132-L136 HydrophobicContact CE-CD1 4.19Å; M132-L136 HydrophobicContact CG-CD1 4.04Å; M132-L136 WeakPolarHBondContact O-CG 3.21Å; M132-L136 PolarHBondContact O-N 2.78Å; M132-L136 VanDerWaalsContact O-N 3.09Å; M132-L560 HydrophobicContact CE-CD2 3.61Å; M132-L560 HydrophobicContact CE-CG 3.92Å; M132-L560 HydrophobicContact CG-CD1 3.79Å; M132-L560 HydrophobicContact CG-CD2 4.49Å; M132-L560 HydrophobicContact CG-CG 4.08Å; M132-I564 HydrophobicContact SD-CD1 4.22Å; M132-L578 HydrophobicContact CE-CD1 4.16Å; M132-L578 HydrophobicContact CE-CD2 3.95Å; M132-L578 HydrophobicContact SD-CD1 4.07Å; M132-V651 HydrophobicContact CB-CG1 4.24Å; M132-V651 HydrophobicContact CG-CG1 4.12Å; M132-V651 HydrophobicContact SD-CG1 4.32Å; M132-V651 HydrophobicContact SD-CG2 3.91Å; M132-Y656 HydrophobicContact CE-CD2 4.13Å; M132-I658 HydrophobicContact CB-CD1 4.38Å; M132-I658 HydrophobicContact SD-CD1 4.07Å; M132-I658 HydrophobicContact SD-CG1 4.43Å
133	A	91.1	Very high	89.6	Confident	13 Å²	13	38.3 Å²	38.3	11%	0.107	24%	0.24	C	C	.	.	H	α-helix	trans	-60.4	-40.2	177.9	0	0	0	0	0	111.9	A129 D130 L136 S137 V651 Q652	A129-A133 VanDerWaalsContact O-CB 3.29Å; A129-A133 WeakPolarHBondContact O-CB 3.44Å; A129-A133 PolarHBondContact O-N 3.46Å; D130-A133 PolarHBondContact O-N 2.65Å; A133-L136 PolarHBondContact O-N 2.81Å; A133-S137 WeakPolarHBondContact O-CB 3Å; A133-S137 PolarHBondContact O-N 2.77Å; A133-V651 HydrophobicContact CB-CG1 4Å; A133-Q652 HydrophobicContact CB-CB 4.22Å
134	S	88.1	Confident	89.8	Confident	73 Å²	73	34.6 Å²	34.6	51%	0.51	23%	0.228	S	C	.	.	H	α-helix	trans	-59.3	-49.5	176.6	-173.2	0	0	0	0	111.7	D130 M132 L136 S137 S138	D130-S134 WeakPolarHBondContact O-CB 2.9Å; D130-S134 PolarHBondContact O-N 2.78Å; M132-S134 VanDerWaalsContact C-N 3.31Å; M132-S134 PolarHBondContact O-N 3.44Å; S134-L136 VanDerWaalsContact C-N 3.31Å; S134-L136 PolarHBondContact O-N 3.24Å; S134-S137 PolarHBondContact O-N 2.82Å; S134-S137 PolarHBondContact O-OG 2.89Å; S134-S138 PolarHBondContact O-N 2.81Å
135	K	85.9	Confident	90	Very high	56 Å²	56	34.7 Å²	34.7	24%	0.243	23%	0.233	C	C	.	.	H	α-helix	trans	-61.4	-39.6	177.8	-70.3	-172.7	177.3	-165.1	0	112.2	A131 M132 S138 C139 E559 L560	A131-K135 PolarHBondContact O-N 2.89Å; M132-K135 PolarHBondContact O-N 3.23Å; K135-S138 WeakPolarHBondContact O-CB 3.46Å; K135-S138 PolarHBondContact O-N 3.32Å; K135-C139 PolarHBondContact O-SG 3.5Å; K135-C139 VanDerWaalsContact O-SG 3.34Å; K135-E559 PolarHBondContact NZ-O 3.36Å; K135-E559 IonicContact NZ-OE1 2.77Å; K135-L560 HydrophobicContact CB-CD1 4.1Å; K135-L560 HydrophobicContact CD-CD1 4.13Å
136	L	87.8	Confident	90.1	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-71.6	-32.4	179.4	-66.3	176.3	0	0	0	112.7	M132 A133 S134 S138 C139 V140 L535 L560 V651 T654	M132-L136 HydrophobicContact CE-CD1 4.19Å; M132-L136 HydrophobicContact CG-CD1 4.04Å; M132-L136 WeakPolarHBondContact O-CG 3.21Å; M132-L136 PolarHBondContact O-N 2.78Å; M132-L136 VanDerWaalsContact O-N 3.09Å; A133-L136 PolarHBondContact O-N 2.81Å; S134-L136 VanDerWaalsContact C-N 3.31Å; S134-L136 PolarHBondContact O-N 3.24Å; L136-S138 VanDerWaalsContact C-N 3.29Å; L136-S138 PolarHBondContact O-N 3.27Å; L136-C139 WeakPolarHBondContact O-CB 3.24Å; L136-C139 PolarHBondContact O-N 2.84Å; L136-C139 VanDerWaalsContact O-N 3.09Å; L136-V140 WeakPolarHBondContact O-CG2 3.29Å; L136-V140 PolarHBondContact O-N 2.91Å; L136-L535 HydrophobicContact CD2-CD2 3.16Å; L136-L535 HydrophobicContact CG-CD2 4.47Å; L136-L560 HydrophobicContact CD1-CD2 4.43Å; L136-L560 HydrophobicContact CD2-CD1 4.26Å; L136-L560 HydrophobicContact CD2-CD2 3.89Å; L136-L560 HydrophobicContact CG-CD1 4.25Å; L136-L560 HydrophobicContact CG-CD2 4.42Å; L136-V651 HydrophobicContact CD1-CG1 4.31Å; L136-T654 HydrophobicContact CD1-CG2 3.46Å; L136-T654 VanDerWaalsContact CD1-CG2 3.46Å
137	S	87.1	Confident	90	Very high	70 Å²	70	34.6 Å²	34.6	49%	0.49	23%	0.229	S	C	.	.	H	α-helix	trans	-61.5	-37.5	176	78.1	0	0	0	0	112.3	A133 S134 C139 V140 S141	A133-S137 WeakPolarHBondContact O-CB 3Å; A133-S137 PolarHBondContact O-N 2.77Å; S134-S137 PolarHBondContact O-N 2.82Å; S134-S137 PolarHBondContact O-OG 2.89Å; S137-C139 VanDerWaalsContact C-N 3.31Å; S137-C139 PolarHBondContact O-N 2.85Å; S137-V140 PolarHBondContact O-N 3.41Å; S137-S141 WeakPolarHBondContact O-CB 3.44Å; S137-S141 PolarHBondContact O-N 2.88Å
138	S	86.3	Confident	90	Very high	32 Å²	32	39.6 Å²	39.6	22%	0.224	24%	0.239	C	C	.	.	H	α-helix	trans	-59.7	-42.2	172.7	-57.2	0	0	0	0	111.7	S134 K135 L136 S141 A142 E223	S134-S138 PolarHBondContact O-N 2.81Å; K135-S138 WeakPolarHBondContact O-CB 3.46Å; K135-S138 PolarHBondContact O-N 3.32Å; L136-S138 VanDerWaalsContact C-N 3.29Å; L136-S138 PolarHBondContact O-N 3.27Å; S138-S141 WeakPolarHBondContact O-CB 3.34Å; S138-S141 PolarHBondContact O-N 2.86Å; S138-A142 WeakPolarHBondContact O-CB 3.17Å; S138-A142 PolarHBondContact O-N 3.48Å; S138-E223 WeakPolarHBondContact CB-OE2 3.38Å; S138-E223 PolarHBondContact OG-OE2 3.47Å
139	C	88.6	Confident	89.9	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.007	25%	0.251	C	S	.	.	H	α-helix	trans	-68.6	-41.9	-179.8	-57.7	0	0	0	0	111.7	K135 L136 S137 S141 A142 V143 A537 V555	K135-C139 PolarHBondContact O-SG 3.5Å; K135-C139 VanDerWaalsContact O-SG 3.34Å; L136-C139 WeakPolarHBondContact O-CB 3.24Å; L136-C139 PolarHBondContact O-N 2.84Å; L136-C139 VanDerWaalsContact O-N 3.09Å; S137-C139 VanDerWaalsContact C-N 3.31Å; S137-C139 PolarHBondContact O-N 2.85Å; C139-S141 VanDerWaalsContact C-N 3.32Å; C139-S141 PolarHBondContact O-N 2.82Å; C139-A142 PolarHBondContact O-N 3.28Å; C139-V143 WeakPolarHBondContact O-CG2 3.27Å; C139-V143 PolarHBondContact O-N 3.38Å; C139-A537 HydrophobicContact CB-CB 4.14Å; C139-V555 HydrophobicContact CB-CG2 4.43Å; C139-V555 WeakPolarHBondContact SG-CG2 3.28Å
140	V	89	Confident	89.7	Confident	45 Å²	45	42.2 Å²	42.2	27%	0.273	25%	0.251	S	S	.	.	H	α-helix	trans	-60.9	-43.2	173.6	172.2	0	0	0	0	110.7	L136 S137 V143 G144 V519 I521	L136-V140 WeakPolarHBondContact O-CG2 3.29Å; L136-V140 PolarHBondContact O-N 2.91Å; S137-V140 PolarHBondContact O-N 3.41Å; V140-V143 PolarHBondContact O-N 3.5Å; V140-G144 PolarHBondContact O-N 3.42Å; V140-V519 HydrophobicContact CG1-CB 4.12Å; V140-V519 HydrophobicContact CG1-CG2 3.95Å; V140-V519 HydrophobicContact CG2-CB 4.3Å; V140-V519 HydrophobicContact CG2-CG1 4.02Å; V140-I521 HydrophobicContact CG2-CD1 3.96Å
141	S	89.2	Confident	89.5	Confident	72 Å²	72	41.2 Å²	41.2	50%	0.503	25%	0.245	S	C	.	.	H	α-helix	trans	-61.5	-45.2	175.3	-176.3	0	0	0	0	111.9	S137 S138 C139 V143 G144 V145	S137-S141 WeakPolarHBondContact O-CB 3.44Å; S137-S141 PolarHBondContact O-N 2.88Å; S138-S141 WeakPolarHBondContact O-CB 3.34Å; S138-S141 PolarHBondContact O-N 2.86Å; C139-S141 VanDerWaalsContact C-N 3.32Å; C139-S141 PolarHBondContact O-N 2.82Å; S141-V143 PolarHBondContact O-N 3.3Å; S141-G144 WeakPolarHBondContact O-CA 3.43Å; S141-G144 PolarHBondContact O-N 2.83Å; S141-V145 WeakPolarHBondContact O-CG2 3.4Å; S141-V145 PolarHBondContact O-N 3.48Å
142	A	90.6	Very high	89.3	Confident	3 Å²	3	41 Å²	41	3%	0.025	24%	0.241	C	C	.	.	H	α-helix	trans	-58.3	-45.7	177.7	0	0	0	0	0	112.2	S138 C139 G144 V145 I146 N219 I226 V553	S138-A142 WeakPolarHBondContact O-CB 3.17Å; S138-A142 PolarHBondContact O-N 3.48Å; C139-A142 PolarHBondContact O-N 3.28Å; A142-G144 VanDerWaalsContact C-N 3.31Å; A142-G144 PolarHBondContact O-N 2.79Å; A142-V145 PolarHBondContact O-N 2.81Å; A142-I146 WeakPolarHBondContact O-CD1 3.3Å; A142-I146 WeakPolarHBondContact O-CG1 3.25Å; A142-I146 PolarHBondContact O-N 3.45Å; A142-I146 VanDerWaalsContact O-N 3.11Å; A142-N219 HydrophobicContact CB-CB 4.12Å; A142-N219 PolarHBondContact O-ND2 3.49Å; A142-I226 HydrophobicContact CB-CD1 3.87Å; A142-V553 HydrophobicContact CB-CG2 4.16Å
143	V	92	Very high	89.1	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-58.6	-43.4	173.3	173.5	0	0	0	0	111	C139 V140 S141 I146 K147 V519 A537 V551 V553	C139-V143 WeakPolarHBondContact O-CG2 3.27Å; C139-V143 PolarHBondContact O-N 3.38Å; V140-V143 PolarHBondContact O-N 3.5Å; S141-V143 PolarHBondContact O-N 3.3Å; V143-I146 PolarHBondContact O-N 3.24Å; V143-K147 VanDerWaalsContact O-CB 3.25Å; V143-K147 WeakPolarHBondContact O-CB 3.29Å; V143-K147 PolarHBondContact O-N 3.49Å; V143-V519 HydrophobicContact CB-CG1 4.41Å; V143-V519 HydrophobicContact CB-CG2 4.23Å; V143-V519 HydrophobicContact CG1-CG1 4.34Å; V143-V519 HydrophobicContact CG1-CG2 3.87Å; V143-V519 HydrophobicContact CG2-CG1 4.35Å; V143-A537 HydrophobicContact CG2-CB 4.21Å; V143-A537 WeakPolarHBondContact CG2-O 3.5Å; V143-V551 HydrophobicContact CG1-CB 4.46Å; V143-V551 HydrophobicContact CG1-CG1 4.09Å; V143-V553 HydrophobicContact CG2-CB 4.16Å; V143-V553 HydrophobicContact CG2-CG2 3.64Å
144	G	91	Very high	88.7	Confident	34 Å²	34	43.3 Å²	43.3	35%	0.351	25%	0.249	S	C	.	.	H	α-helix	trans	-61.1	-43.8	177.9	0	0	0	0	0	113.4	V140 S141 A142 K147 K148	V140-G144 PolarHBondContact O-N 3.42Å; S141-G144 WeakPolarHBondContact O-CA 3.43Å; S141-G144 PolarHBondContact O-N 2.83Å; A142-G144 VanDerWaalsContact C-N 3.31Å; A142-G144 PolarHBondContact O-N 2.79Å; G144-K147 PolarHBondContact O-N 3.34Å; G144-K148 WeakPolarHBondContact O-CB 3.28Å; G144-K148 PolarHBondContact O-N 2.84Å
145	V	90.9	Very high	88.4	Confident	66 Å²	66	46.7 Å²	46.7	40%	0.4	26%	0.257	S	S	.	.	H	α-helix	trans	-61.8	-49.4	177.3	171.7	0	0	0	0	110.8	S141 A142 K147 K148 Q149	S141-V145 WeakPolarHBondContact O-CG2 3.4Å; S141-V145 PolarHBondContact O-N 3.48Å; A142-V145 PolarHBondContact O-N 2.81Å; V145-K147 PolarHBondContact O-N 2.81Å; V145-K148 PolarHBondContact O-N 2.92Å; V145-Q149 PolarHBondContact O-N 3.41Å
146	I	92.1	Very high	88	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63	-44.4	179.4	-61.4	156.7	0	0	0	110.3	A142 V143 K148 Q149 I150 F216 V551 V553	A142-I146 WeakPolarHBondContact O-CD1 3.3Å; A142-I146 WeakPolarHBondContact O-CG1 3.25Å; A142-I146 PolarHBondContact O-N 3.45Å; A142-I146 VanDerWaalsContact O-N 3.11Å; V143-I146 PolarHBondContact O-N 3.24Å; I146-K148 VanDerWaalsContact C-N 3.34Å; I146-K148 PolarHBondContact O-N 3.46Å; I146-Q149 PolarHBondContact O-N 2.79Å; I146-I150 HydrophobicContact CG2-CD1 3.7Å; I146-I150 HydrophobicContact CG2-CG1 4.36Å; I146-I150 WeakPolarHBondContact O-CG1 3.31Å; I146-I150 PolarHBondContact O-N 3.48Å; I146-F216 HydrophobicContact CD1-CD1 3.84Å; I146-F216 HydrophobicContact CD1-CE1 3.68Å; I146-F216 HydrophobicContact CG1-CD1 4.03Å; I146-F216 HydrophobicContact CG1-CE1 3.89Å; I146-F216 HydrophobicContact CG2-CE1 3.99Å; I146-V551 HydrophobicContact CB-CG1 3.73Å; I146-V551 HydrophobicContact CB-CG2 4.49Å; I146-V551 HydrophobicContact CD1-CG1 3.95Å; I146-V551 HydrophobicContact CG1-CG1 4.49Å; I146-V551 HydrophobicContact CG2-CB 4.34Å; I146-V551 HydrophobicContact CG2-CG1 3.58Å; I146-V551 HydrophobicContact CG2-CG2 3.74Å; I146-V553 HydrophobicContact CD1-CG2 4.29Å
147	K	91.3	Very high	87.1	Confident	46 Å²	46	52.8 Å²	52.8	20%	0.2	30%	0.297	C	S	.	.	H	α-helix	trans	-57.3	-46	177	-179.2	174.5	-174.5	177.2	0	111.5	V143 G144 V145 Q149 I150 L151 S539 L540 V541	V143-K147 VanDerWaalsContact O-CB 3.25Å; V143-K147 WeakPolarHBondContact O-CB 3.29Å; V143-K147 PolarHBondContact O-N 3.49Å; G144-K147 PolarHBondContact O-N 3.34Å; V145-K147 PolarHBondContact O-N 2.81Å; K147-Q149 VanDerWaalsContact C-N 3.34Å; K147-Q149 PolarHBondContact O-N 2.79Å; K147-I150 PolarHBondContact O-N 3.27Å; K147-L151 HydrophobicContact CG-CD1 4.3Å; K147-L151 WeakPolarHBondContact O-CG 3.24Å; K147-L151 PolarHBondContact O-N 2.8Å; K147-S539 PolarHBondContact NZ-OG 3.12Å; K147-L540 WeakPolarHBondContact CE-O 3.33Å; K147-L540 PolarHBondContact NZ-O 2.8Å; K147-V541 HydrophobicContact CG-CG2 4.24Å
148	K	89.9	Confident	85.9	Confident	164 Å²	164	51.3 Å²	51.3	71%	0.713	29%	0.285	S	S	*	.	H	α-helix	trans	-61.8	-42.5	177.1	-173.5	179.7	179	-177.2	0	111.7	G144 V145 I146 L151 S152	G144-K148 WeakPolarHBondContact O-CB 3.28Å; G144-K148 PolarHBondContact O-N 2.84Å; V145-K148 PolarHBondContact O-N 2.92Å; I146-K148 VanDerWaalsContact C-N 3.34Å; I146-K148 PolarHBondContact O-N 3.46Å; K148-L151 PolarHBondContact O-N 3.27Å; K148-S152 PolarHBondContact O-N 2.75Å
149	Q	89.7	Confident	85	Confident	80 Å²	80	56.4 Å²	56.4	37%	0.374	30%	0.3	S	S	.	.	H	α-helix	trans	-63.7	-44.2	178.3	-170.1	65	6.6	0	0	111.7	V145 I146 K147 L151 S152 I153 L212	V145-Q149 PolarHBondContact O-N 3.41Å; I146-Q149 PolarHBondContact O-N 2.79Å; K147-Q149 VanDerWaalsContact C-N 3.34Å; K147-Q149 PolarHBondContact O-N 2.79Å; Q149-L151 PolarHBondContact O-N 3.47Å; Q149-S152 PolarHBondContact O-N 3.18Å; Q149-I153 HydrophobicContact CG-CD1 3.97Å; Q149-I153 VanDerWaalsContact O-CG1 3.28Å; Q149-I153 WeakPolarHBondContact O-CG1 3.48Å; Q149-I153 PolarHBondContact O-N 2.87Å; Q149-L212 HydrophobicContact CB-CD2 4.29Å; Q149-L212 HydrophobicContact CG-CD2 3.94Å
150	I	89.5	Confident	83.9	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.5	-45.5	177.2	-69.9	163.1	0	0	0	111.3	I146 K147 S152 I153 F154 F206 L212 F231 V541 V548 V551	I146-I150 HydrophobicContact CG2-CD1 3.7Å; I146-I150 HydrophobicContact CG2-CG1 4.36Å; I146-I150 WeakPolarHBondContact O-CG1 3.31Å; I146-I150 PolarHBondContact O-N 3.48Å; K147-I150 PolarHBondContact O-N 3.27Å; I150-S152 VanDerWaalsContact C-N 3.29Å; I150-S152 PolarHBondContact O-N 3.5Å; I150-I153 PolarHBondContact O-N 2.69Å; I150-F154 WeakPolarHBondContact O-CB 3.5Å; I150-F154 PolarHBondContact O-N 3.31Å; I150-F206 HydrophobicContact CG2-CE1 3.8Å; I150-F206 HydrophobicContact CG2-CZ 4.02Å; I150-L212 HydrophobicContact CD1-CD1 4.25Å; I150-L212 HydrophobicContact CG1-CD1 4.07Å; I150-L212 HydrophobicContact CG1-CD2 3.76Å; I150-F231 HydrophobicContact CD1-CB 4.27Å; I150-F231 HydrophobicContact CD1-CD2 3.37Å; I150-F231 HydrophobicContact CD1-CE2 3.86Å; I150-F231 HydrophobicContact CD1-CG 3.92Å; I150-F231 HydrophobicContact CG1-CD2 4.38Å; I150-F231 HydrophobicContact CG2-CE2 4.21Å; I150-V541 HydrophobicContact CD1-CG2 4.41Å; I150-V541 HydrophobicContact CG2-CG1 3.9Å; I150-V548 HydrophobicContact CG2-CG1 4.41Å; I150-V551 HydrophobicContact CD1-CG2 3.21Å
151	L	88.4	Confident	82.5	Confident	45 Å²	45	63.4 Å²	63.4	24%	0.236	33%	0.334	C	S	.	.	H	α-helix	trans	-61	-40.4	177.9	-71.1	172	0	0	0	111.4	K147 K148 Q149 Q155 V541 I543	K147-L151 HydrophobicContact CG-CD1 4.3Å; K147-L151 WeakPolarHBondContact O-CG 3.24Å; K147-L151 PolarHBondContact O-N 2.8Å; K148-L151 PolarHBondContact O-N 3.27Å; Q149-L151 PolarHBondContact O-N 3.47Å; L151-Q155 WeakPolarHBondContact O-CB 3.35Å; L151-Q155 VanDerWaalsContact O-CG 3.28Å; L151-Q155 WeakPolarHBondContact O-CG 3.36Å; L151-Q155 PolarHBondContact O-N 3.27Å; L151-Q155 VanDerWaalsContact O-N 3.07Å; L151-V541 HydrophobicContact CD2-CG1 3.74Å; L151-V541 HydrophobicContact CG-CG1 4.05Å; L151-I543 HydrophobicContact CD2-CD1 4.01Å; L151-I543 HydrophobicContact CD2-CG1 3.66Å
152	S	86.9	Confident	81.3	Confident	49 Å²	49	69.8 Å²	69.8	34%	0.343	35%	0.347	S	S	.	.	H	α-helix	trans	-64.8	-43.2	175.3	-174.4	0	0	0	0	112.6	K148 Q149 I150 N156	K148-S152 PolarHBondContact O-N 2.75Å; Q149-S152 PolarHBondContact O-N 3.18Å; I150-S152 VanDerWaalsContact C-N 3.29Å; I150-S152 PolarHBondContact O-N 3.5Å; S152-N156 WeakPolarHBondContact O-CB 3.42Å; S152-N156 VanDerWaalsContact O-CG 3.31Å; S152-N156 PolarHBondContact O-N 3.35Å; S152-N156 PolarHBondContact O-ND2 3.06Å
153	I	85.3	Confident	79.9	Confident	19 Å²	19	70.5 Å²	70.5	10%	0.097	35%	0.353	C	S	.	.	H	α-helix	trans	-64.5	-45.6	178.4	-66.4	162.2	0	0	0	110	Q149 I150 Q155 N156 S157 F206 P208 N211 L212	Q149-I153 HydrophobicContact CG-CD1 3.97Å; Q149-I153 VanDerWaalsContact O-CG1 3.28Å; Q149-I153 WeakPolarHBondContact O-CG1 3.48Å; Q149-I153 PolarHBondContact O-N 2.87Å; I150-I153 PolarHBondContact O-N 2.69Å; I153-Q155 VanDerWaalsContact C-N 3.33Å; I153-Q155 PolarHBondContact O-N 3.43Å; I153-N156 PolarHBondContact O-N 3.01Å; I153-S157 CarbonylContact O-C 3.57Å; I153-S157 PolarHBondContact O-N 3.29Å; I153-F206 HydrophobicContact CG2-CE2 4.02Å; I153-F206 HydrophobicContact CG2-CZ 4.23Å; I153-P208 HydrophobicContact CD1-CB 4.02Å; I153-P208 HydrophobicContact CG2-CB 4.28Å; I153-N211 HydrophobicContact CD1-CB 3.58Å; I153-N211 HydrophobicContact CG1-CB 4.35Å; I153-L212 HydrophobicContact CD1-CD2 3.96Å
154	F	83.4	Confident	78.7	Confident	51 Å²	51	72.6 Å²	72.6	22%	0.224	36%	0.362	C	S	.	.	H	α-helix	trans	-62.2	-39.3	-179	-168.5	-82.3	0	0	0	112.4	I150 P158 F206 I543 V548	I150-F154 WeakPolarHBondContact O-CB 3.5Å; I150-F154 PolarHBondContact O-N 3.31Å; F154-P158 HydrophobicContact CE2-CB 4.42Å; F154-P158 HydrophobicContact CZ-CB 4.49Å; F154-P158 WeakPolarHBondContact O-CD 3.25Å; F154-F206 HydrophobicContact CB-CE2 3.87Å; F154-F206 HydrophobicContact CB-CZ 3.9Å; F154-F206 HydrophobicContact CD2-CD1 4.05Å; F154-F206 AromaticContact CD2-CD2 3.54Å; F154-F206 HydrophobicContact CD2-CD2 3.54Å; F154-F206 HydrophobicContact CD2-CE1 4.11Å; F154-F206 AromaticContact CD2-CE2 3.62Å; F154-F206 HydrophobicContact CD2-CE2 3.62Å; F154-F206 AromaticContact CD2-CG 3.77Å; F154-F206 HydrophobicContact CD2-CG 3.77Å; F154-F206 AromaticContact CD2-CZ 3.9Å; F154-F206 HydrophobicContact CD2-CZ 3.9Å; F154-F206 HydrophobicContact CE2-CB 4.38Å; F154-F206 HydrophobicContact CE2-CD2 4.15Å; F154-F206 HydrophobicContact CE2-CG 4.12Å; F154-F206 HydrophobicContact CG-CD2 4.47Å; F154-F206 HydrophobicContact CG-CE2 4.19Å; F154-F206 HydrophobicContact CG-CZ 4.42Å; F154-I543 HydrophobicContact CB-CD1 4.22Å; F154-I543 HydrophobicContact CD1-CD1 3.12Å; F154-I543 HydrophobicContact CE1-CD1 3.53Å; F154-I543 HydrophobicContact CG-CD1 3.75Å; F154-I543 HydrophobicContact CZ-CD1 4.44Å; F154-V548 HydrophobicContact CD2-CB 4.47Å; F154-V548 HydrophobicContact CD2-CG1 3.5Å; F154-V548 HydrophobicContact CD2-CG2 4.1Å; F154-V548 HydrophobicContact CE1-CG2 4.48Å; F154-V548 HydrophobicContact CE2-CB 4.48Å; F154-V548 HydrophobicContact CE2-CG1 3.79Å; F154-V548 HydrophobicContact CE2-CG2 3.97Å; F154-V548 HydrophobicContact CG-CG1 4.29Å; F154-V548 HydrophobicContact CG-CG2 4.42Å; F154-V548 HydrophobicContact CZ-CG2 4.16Å
155	Q	80.6	Confident	77.6	Confident	144 Å²	144	79.9 Å²	79.9	67%	0.673	38%	0.384	S	S	*	.	H	α-helix	trans	-68.9	-36.6	177.3	-74.6	175	-5.2	0	0	112.9	L151 I153	L151-Q155 WeakPolarHBondContact O-CB 3.35Å; L151-Q155 VanDerWaalsContact O-CG 3.28Å; L151-Q155 WeakPolarHBondContact O-CG 3.36Å; L151-Q155 PolarHBondContact O-N 3.27Å; L151-Q155 VanDerWaalsContact O-N 3.07Å; I153-Q155 VanDerWaalsContact C-N 3.33Å; I153-Q155 PolarHBondContact O-N 3.43Å
156	N	78.3	Confident	76.6	Confident	132 Å²	132	82.3 Å²	82.3	71%	0.706	39%	0.391	S	S	*	.	H	α-helix	trans	-85.9	-37.2	-174.2	-70.1	-20.4	0	0	0	113.5	S152 I153	S152-N156 WeakPolarHBondContact O-CB 3.42Å; S152-N156 VanDerWaalsContact O-CG 3.31Å; S152-N156 PolarHBondContact O-N 3.35Å; S152-N156 PolarHBondContact O-ND2 3.06Å; I153-N156 PolarHBondContact O-N 3.01Å
157	S	68.2	Low	76	Confident	56 Å²	56	86.2 Å²	86.2	39%	0.392	41%	0.406	S	S	.	.			trans	-158.8	82.9	-178	-178.1	0	0	0	0	111.3	I153 Y159	I153-S157 CarbonylContact O-C 3.57Å; I153-S157 PolarHBondContact O-N 3.29Å; S157-Y159 VanDerWaalsContact C-N 3.25Å; S157-Y159 PolarHBondContact O-N 2.88Å
158	P	61.9	Low	75.7	Confident	39 Å²	39	89 Å²	89	25%	0.253	42%	0.42	S	S	.	.	S	Bend	trans	-67.9	-23.2	-176.8	24.1	-31	0	0	0	113.6	F154 F206	F154-P158 HydrophobicContact CE2-CB 4.42Å; F154-P158 HydrophobicContact CZ-CB 4.49Å; F154-P158 WeakPolarHBondContact O-CD 3.25Å; P158-F206 WeakPolarHBondContact O-CD2 3.36Å
159	Y	67.9	Low	75.6	Confident	138 Å²	138	83 Å²	83	54%	0.541	39%	0.394	S	S	.	.			trans	-136.7	76.1	-172.4	-50.2	-63.8	0	0	0	111.6	S157 F204	S157-Y159 VanDerWaalsContact C-N 3.25Å; S157-Y159 PolarHBondContact O-N 2.88Å; Y159-F204 HydrophobicContact CD1-CB 4.36Å; Y159-F204 WeakPolarHBondContact CD1-O 3.17Å; Y159-F204 WeakPolarHBondContact CE1-O 3.26Å
160	D	65.5	Low	75.6	Confident	79 Å²	79	79.2 Å²	79.2	42%	0.422	38%	0.377	S	S	.	.			trans	-95.1	101.3	171	-172.4	-3.4	0	0	0	111	R162 A163 F164	D160-R162 PolarHBondContact O-N 3.14Å; D160-R162 WeakPolarHBondContact OD1-CB 3.39Å; D160-R162 PolarHBondContact OD1-N 3.29Å; D160-A163 HydrophobicContact CB-CB 4.13Å; D160-A163 PolarHBondContact O-N 2.84Å; D160-F164 PolarHBondContact O-N 2.61Å
161	M	60.4	Low	75.6	Confident	115 Å²	115	79.5 Å²	79.5	57%	0.567	38%	0.379	S	S	*	.	H	α-helix	trans	-65	-22	176.4	-76.1	-150.4	-67.5	0	0	113.6	F164 K165 A203	M161-F164 PolarHBondContact O-N 2.85Å; M161-K165 PolarHBondContact O-N 3.49Å; M161-A203 HydrophobicContact SD-CB 4.22Å
162	R	63.7	Low	75.6	Confident	206 Å²	206	81.2 Å²	81.2	78%	0.777	39%	0.391	S	S	*	.	H	α-helix	trans	-70.9	-41.9	177.5	-65.3	-178.7	177.8	177.5	0.1	110.5	D160 F164 K165	D160-R162 PolarHBondContact O-N 3.14Å; D160-R162 WeakPolarHBondContact OD1-CB 3.39Å; D160-R162 PolarHBondContact OD1-N 3.29Å; R162-F164 PolarHBondContact O-N 3.27Å; R162-K165 PolarHBondContact O-N 3.29Å; R162-K165 VanDerWaalsContact O-N 3.09Å
163	A	61.5	Low	75.7	Confident	17 Å²	17	79.8 Å²	79.8	14%	0.14	38%	0.379	C	S	.	.	H	α-helix	trans	-58.3	-39.9	174.9	0	0	0	0	0	111.1	D160 K165 Q166 Y207	D160-A163 HydrophobicContact CB-CB 4.13Å; D160-A163 PolarHBondContact O-N 2.84Å; A163-K165 VanDerWaalsContact C-N 3.27Å; A163-K165 PolarHBondContact O-N 3.24Å; A163-Q166 PolarHBondContact O-N 3.44Å; A163-Y207 HydrophobicContact CB-CD1 3.92Å; A163-Y207 HydrophobicContact CB-CE1 4.32Å; A163-Y207 WeakPolarHBondContact O-CE1 3.29Å
164	F	66.6	Low	75.7	Confident	44 Å²	44	82.3 Å²	82.3	19%	0.193	39%	0.393	C	S	.	.	H	α-helix	trans	-67.2	-20.1	177.9	-160	-93.9	0	0	0	114.2	D160 M161 R162 Q166 Y167 V197 L201 Y207	D160-F164 PolarHBondContact O-N 2.61Å; M161-F164 PolarHBondContact O-N 2.85Å; R162-F164 PolarHBondContact O-N 3.27Å; F164-Q166 VanDerWaalsContact C-N 3.3Å; F164-Q166 PolarHBondContact O-N 3.47Å; F164-Y167 VanDerWaalsContact O-CD1 3.27Å; F164-Y167 WeakPolarHBondContact O-CD1 3.5Å; F164-V197 HydrophobicContact CZ-CG1 4.4Å; F164-L201 HydrophobicContact CE2-CD2 3.66Å; F164-L201 HydrophobicContact CZ-CD2 3.87Å; F164-L201 HydrophobicContact CZ-CG 4.49Å; F164-Y207 HydrophobicContact CD2-CD2 4.41Å; F164-Y207 HydrophobicContact CD2-CG 4.24Å
165	K	67.4	Low	75.7	Confident	188 Å²	188	82.2 Å²	82.2	82%	0.817	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-9.1	177.3	-76.7	-171.6	175.7	-174	0	114.1	M161 R162 A163	M161-K165 PolarHBondContact O-N 3.49Å; R162-K165 PolarHBondContact O-N 3.29Å; R162-K165 VanDerWaalsContact O-N 3.09Å; A163-K165 VanDerWaalsContact C-N 3.27Å; A163-K165 PolarHBondContact O-N 3.24Å
166	Q	70.2	Confident	75.9	Confident	116 Å²	116	81.7 Å²	81.7	54%	0.542	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	20.4	-172.7	-60.2	-176.5	-8.7	0	0	113	A163 F164 Q210	A163-Q166 PolarHBondContact O-N 3.44Å; F164-Q166 VanDerWaalsContact C-N 3.3Å; F164-Q166 PolarHBondContact O-N 3.47Å; Q166-Q210 PolarHBondContact O-NE2 3.23Å
167	Y	79	Confident	76.4	Confident	83 Å²	83	82.5 Å²	82.5	33%	0.325	39%	0.39	S	S	.	.			trans	-69.2	152.5	176.7	79	-88	0	0	0	111.3	F164 E169 D195 V197	F164-Y167 VanDerWaalsContact O-CD1 3.27Å; F164-Y167 WeakPolarHBondContact O-CD1 3.5Å; Y167-E169 HydrophobicContact CD2-CB 4.38Å; Y167-E169 HydrophobicContact CE2-CB 3.93Å; Y167-D195 HydrophobicContact CD2-CB 4.33Å; Y167-V197 HydrophobicContact CD2-CG2 3.65Å; Y167-V197 HydrophobicContact CE2-CB 4.44Å; Y167-V197 HydrophobicContact CE2-CG2 3.52Å; Y167-V197 HydrophobicContact CG-CG2 4.38Å
168	H	84.5	Confident	77.3	Confident	104 Å²	104	80.4 Å²	80.4	48%	0.481	37%	0.374	S	S	.	.			trans	-114	108.8	176.5	-69.1	-63.2	0	0	0	109.4	C194 D195	H168-C194 CarbonylContact O-C 3.55Å; H168-C194 WeakPolarHBondContact O-CA 3.32Å; H168-C194 WeakPolarHBondContact O-CB 3.49Å; H168-D195 PolarHBondContact O-N 3.23Å
169	E	88.4	Confident	78.5	Confident	37 Å²	37	86.6 Å²	86.6	17%	0.173	40%	0.397	C	S	.	.	B	Isolated β-bridge	trans	-73.3	129.3	-177.7	-169.8	175.9	-179	0	0	112	Y167 C171 T172 I173 D195 Y251	Y167-E169 HydrophobicContact CD2-CB 4.38Å; Y167-E169 HydrophobicContact CE2-CB 3.93Å; E169-C171 PolarHBondContact O-N 2.6Å; E169-C171 VanDerWaalsContact O-N 3.16Å; E169-T172 HydrophobicContact CB-CG2 4.08Å; E169-T172 WeakPolarHBondContact CB-OG1 3.29Å; E169-T172 HydrophobicContact CG-CG2 4.32Å; E169-T172 PolarHBondContact O-N 2.76Å; E169-T172 VanDerWaalsContact O-N 3.12Å; E169-T172 PolarHBondContact O-OG1 2.87Å; E169-T172 VanDerWaalsContact O-OG1 3.08Å; E169-T172 WeakPolarHBondContact OE2-CG2 3.46Å; E169-I173 WeakPolarHBondContact O-CG1 3.44Å; E169-I173 PolarHBondContact O-N 3.32Å; E169-D195 WeakPolarHBondContact CA-O 3.12Å; E169-Y251 PolarHBondContact OE1-OH 2.98Å; E169-Y251 VanDerWaalsContact OE1-OH 3.08Å
170	C	90	Very high	79	Confident	2 Å²	2	85.6 Å²	85.6	1%	0.014	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-36.2	-175.9	-62.9	0	0	0	0	113.6	C194 D195 V196 T244	C170-C194 VanDerWaalsContact CA-SG 3.56Å; C170-C194 HydrophobicContact CB-CB 3.92Å; C170-C194 WeakPolarHBondContact CB-SG 3.4Å; C170-C194 WeakPolarHBondContact SG-CB 3.17Å; C170-C194 CovalentContact SG-SG 2.04Å; C170-C194 PolarHBondContact SG-SG 3.41Å; C170-D195 PolarHBondContact N-O 3.08Å; C170-D195 PolarHBondContact SG-N 3.49Å; C170-D195 VanDerWaalsContact SG-N 3.44Å; C170-V196 HydrophobicContact CB-CG2 4.36Å; C170-T244 WeakPolarHBondContact CB-O 3.34Å
171	C	89	Confident	79.6	Confident	5 Å²	5	82.6 Å²	82.6	3%	0.034	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-11.9	-177.1	-64.2	0	0	0	0	114.3	E169 R245 Y251 C254 E255	E169-C171 PolarHBondContact O-N 2.6Å; E169-C171 VanDerWaalsContact O-N 3.16Å; C171-R245 VanDerWaalsContact O-CZ 3.23Å; C171-R245 PolarHBondContact O-NH1 2.99Å; C171-Y251 HydrophobicContact CB-CD2 3.87Å; C171-Y251 HydrophobicContact CB-CE2 3.71Å; C171-Y251 WeakPolarHBondContact O-CD2 3.4Å; C171-C254 VanDerWaalsContact CA-SG 3.51Å; C171-C254 HydrophobicContact CB-CB 3.87Å; C171-C254 WeakPolarHBondContact CB-SG 3.36Å; C171-C254 WeakPolarHBondContact SG-CB 3.31Å; C171-C254 CovalentContact SG-SG 2.06Å; C171-C254 PolarHBondContact SG-SG 2.97Å; C171-E255 PolarHBondContact SG-N 2.87Å
172	T	89.1	Confident	80	Confident	81 Å²	81	80.6 Å²	80.6	50%	0.497	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-8.1	176.6	64.3	0	0	0	0	113.2	E169 D174 Y251	E169-T172 HydrophobicContact CB-CG2 4.08Å; E169-T172 WeakPolarHBondContact CB-OG1 3.29Å; E169-T172 HydrophobicContact CG-CG2 4.32Å; E169-T172 PolarHBondContact O-N 2.76Å; E169-T172 VanDerWaalsContact O-N 3.12Å; E169-T172 PolarHBondContact O-OG1 2.87Å; E169-T172 VanDerWaalsContact O-OG1 3.08Å; E169-T172 WeakPolarHBondContact OE2-CG2 3.46Å; T172-D174 PolarHBondContact O-N 2.63Å; T172-Y251 HydrophobicContact CG2-CE2 3.81Å
173	I	88	Confident	80.4	Confident	19 Å²	19	76.4 Å²	76.4	10%	0.097	37%	0.367	C	S	.	.	S	Bend	trans	-56.8	125.2	175.9	-54.9	176.3	0	0	0	108.9	E169 L178 C194 A243 R245	E169-I173 WeakPolarHBondContact O-CG1 3.44Å; E169-I173 PolarHBondContact O-N 3.32Å; I173-L178 HydrophobicContact CG2-CD1 4.46Å; I173-L178 HydrophobicContact CG2-CD2 3.85Å; I173-L178 HydrophobicContact CG2-CG 4.03Å; I173-C194 HydrophobicContact CD1-CB 3.76Å; I173-A243 HydrophobicContact CD1-CB 3.86Å; I173-R245 PolarHBondContact O-NH1 3.28Å
174	D	85.5	Confident	81	Confident	72 Å²	72	77.2 Å²	77.2	39%	0.385	37%	0.368	S	S	.	.			trans	-64.5	125.5	174.7	-172.7	-34.3	0	0	0	109.1	T172 Q176 Y177	T172-D174 PolarHBondContact O-N 2.63Å; D174-Q176 HydrophobicContact CB-CG 4.17Å; D174-Q176 VanDerWaalsContact CG-NE2 3.32Å; D174-Q176 PolarHBondContact O-N 3.2Å; D174-Q176 VanDerWaalsContact OD1-CG 3.28Å; D174-Q176 WeakPolarHBondContact OD1-CG 3.39Å; D174-Q176 PolarHBondContact OD1-N 3.07Å; D174-Q176 PolarHBondContact OD2-NE2 3.2Å; D174-Y177 HydrophobicContact CB-CD2 3.79Å; D174-Y177 HydrophobicContact CB-CE2 3.98Å; D174-Y177 PolarHBondContact O-N 3.12Å
175	P	83	Confident	81.2	Confident	49 Å²	49	80 Å²	80	32%	0.318	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-51.4	-25.6	179.9	-27.8	35.9	0	0	0	114.6	Y177 L178 I248	P175-Y177 PolarHBondContact O-N 2.95Å; P175-L178 PolarHBondContact O-N 2.66Å; P175-L178 VanDerWaalsContact O-N 3.09Å; P175-I248 HydrophobicContact CB-CG2 3.95Å; P175-I248 HydrophobicContact CG-CG2 3.75Å
176	Q	86	Confident	81.5	Confident	134 Å²	134	71.8 Å²	71.8	63%	0.626	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-63.5	-24.6	178.1	74.8	-174.3	-38.2	0	0	114.2	D174 L178	D174-Q176 HydrophobicContact CB-CG 4.17Å; D174-Q176 VanDerWaalsContact CG-NE2 3.32Å; D174-Q176 PolarHBondContact O-N 3.2Å; D174-Q176 VanDerWaalsContact OD1-CG 3.28Å; D174-Q176 WeakPolarHBondContact OD1-CG 3.39Å; D174-Q176 PolarHBondContact OD1-N 3.07Å; D174-Q176 PolarHBondContact OD2-NE2 3.2Å; Q176-L178 VanDerWaalsContact C-N 3.35Å
177	Y	88.2	Confident	82.1	Confident	149 Å²	149	68.3 Å²	68.3	58%	0.584	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-88.7	-4.3	177.1	-61.8	-66.6	0	0	0	113.3	D174 P175 N189	D174-Y177 HydrophobicContact CB-CD2 3.79Å; D174-Y177 HydrophobicContact CB-CE2 3.98Å; D174-Y177 PolarHBondContact O-N 3.12Å; P175-Y177 PolarHBondContact O-N 2.95Å; Y177-N189 PolarHBondContact O-ND2 3.14Å
178	L	87.9	Confident	82.6	Confident	12 Å²	12	65.2 Å²	65.2	6%	0.063	33%	0.325	C	S	.	.			trans	-98.8	134.5	178.1	-54.5	172.6	0	0	0	109.6	I173 P175 Q176 L187 N189 R245	I173-L178 HydrophobicContact CG2-CD1 4.46Å; I173-L178 HydrophobicContact CG2-CD2 3.85Å; I173-L178 HydrophobicContact CG2-CG 4.03Å; P175-L178 PolarHBondContact O-N 2.66Å; P175-L178 VanDerWaalsContact O-N 3.09Å; Q176-L178 VanDerWaalsContact C-N 3.35Å; L178-L187 HydrophobicContact CB-CB 3.7Å; L178-L187 HydrophobicContact CB-CD1 4.47Å; L178-L187 HydrophobicContact CD1-CB 4.2Å; L178-N189 HydrophobicContact CD2-CB 4.09Å; L178-R245 HydrophobicContact CD1-CB 3.75Å
179	K	85.9	Confident	82.8	Confident	168 Å²	168	61.2 Å²	61.2	73%	0.73	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	139.7	175.5	-67.1	-176.2	-179.7	-179.6	0	109.6	S181 L187 I188	K179-S181 PolarHBondContact O-N 3.41Å; K179-L187 WeakPolarHBondContact O-CA 3.41Å; K179-I188 PolarHBondContact N-O 3.32Å; K179-I188 PolarHBondContact O-N 2.92Å
180	H	79.3	Confident	82.7	Confident	117 Å²	117	61.4 Å²	61.4	54%	0.542	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	123.3	175.4	-175.2	-90.4	0	0	0	110.4	L187	H180-L187 HydrophobicContact CB-CD2 3.63Å
181	S	78.3	Confident	82.5	Confident	17 Å²	17	65 Å²	65	12%	0.119	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	113	173	173.2	0	0	0	0	109.6	K179 E183 H184 D185 A186 I188	K179-S181 PolarHBondContact O-N 3.41Å; S181-E183 PolarHBondContact O-N 2.84Å; S181-H184 PolarHBondContact O-N 3.1Å; S181-H184 VanDerWaalsContact O-N 3.12Å; S181-H184 PolarHBondContact OG-ND1 3.06Å; S181-D185 PolarHBondContact O-N 2.95Å; S181-A186 PolarHBondContact N-O 2.68Å; S181-I188 VanDerWaalsContact CB-CD1 3.47Å
182	P	68.2	Low	82.4	Confident	72 Å²	72	67.7 Å²	67.7	47%	0.468	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-34.9	176	-24	33.3	0	0	0	113.5	H184 D185 T729	P182-H184 VanDerWaalsContact C-N 3.31Å; P182-H184 PolarHBondContact O-N 3.4Å; P182-D185 PolarHBondContact O-N 2.75Å; P182-T729 WeakPolarHBondContact CB-O 3.15Å
183	E	72.3	Confident	82.5	Confident	118 Å²	118	64.3 Å²	64.3	55%	0.551	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-30.9	179.6	-64.2	174.8	174.6	0	0	113.2	S181 L227	S181-E183 PolarHBondContact O-N 2.84Å; E183-L227 WeakPolarHBondContact O-CD2 3.23Å
184	H	73.2	Confident	82.6	Confident	35 Å²	35	63.4 Å²	63.4	16%	0.162	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-6.8	-178.1	-63.2	75.8	0	0	0	112	S181 P182 A186 I188 L227	S181-H184 PolarHBondContact O-N 3.1Å; S181-H184 VanDerWaalsContact O-N 3.12Å; S181-H184 PolarHBondContact OG-ND1 3.06Å; P182-H184 VanDerWaalsContact C-N 3.31Å; P182-H184 PolarHBondContact O-N 3.4Å; H184-A186 HydrophobicContact CB-CB 4.38Å; H184-A186 WeakPolarHBondContact O-CB 3.29Å; H184-A186 PolarHBondContact O-N 2.75Å; H184-I188 HydrophobicContact CB-CG2 3.99Å; H184-L227 PolarHBondContact CD2-O 3.03Å; H184-L227 PolarHBondContact NE2-O 2.75Å
185	D	71	Confident	82.8	Confident	103 Å²	103	60 Å²	60	55%	0.551	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.6	45.6	-169.5	-164.3	33.2	0	0	0	112.2	S181 P182	S181-D185 PolarHBondContact O-N 2.95Å; P182-D185 PolarHBondContact O-N 2.75Å
186	A	75.1	Confident	83	Confident	14 Å²	14	58.2 Å²	58.2	12%	0.116	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	158.4	-172.1	0	0	0	0	0	112.9	S181 H184 I188 R531	S181-A186 PolarHBondContact N-O 2.68Å; H184-A186 HydrophobicContact CB-CB 4.38Å; H184-A186 WeakPolarHBondContact O-CB 3.29Å; H184-A186 PolarHBondContact O-N 2.75Å; A186-I188 HydrophobicContact CB-CG2 4.05Å; A186-R531 VanDerWaalsContact CB-NH2 3.34Å
187	L	82.7	Confident	82.8	Confident	44 Å²	44	53.1 Å²	53.1	23%	0.23	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	119.6	163.9	-64.4	-169.9	0	0	0	109.4	L178 K179 H180 I248	L178-L187 HydrophobicContact CB-CB 3.7Å; L178-L187 HydrophobicContact CB-CD1 4.47Å; L178-L187 HydrophobicContact CD1-CB 4.2Å; K179-L187 WeakPolarHBondContact O-CA 3.41Å; H180-L187 HydrophobicContact CB-CD2 3.63Å; L187-I248 HydrophobicContact CB-CD1 4.39Å; L187-I248 HydrophobicContact CD1-CD1 3.33Å; L187-I248 HydrophobicContact CD1-CG1 4.05Å; L187-I248 HydrophobicContact CG-CD1 3.83Å
188	I	88.2	Confident	82.3	Confident	17 Å²	17	46.4 Å²	46.4	9%	0.087	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	158.7	-175.5	72.4	168.7	0	0	0	111.6	K179 S181 H184 A186 P242 A243 T244	K179-I188 PolarHBondContact N-O 3.32Å; K179-I188 PolarHBondContact O-N 2.92Å; S181-I188 VanDerWaalsContact CB-CD1 3.47Å; H184-I188 HydrophobicContact CB-CG2 3.99Å; A186-I188 HydrophobicContact CB-CG2 4.05Å; I188-P242 HydrophobicContact CB-CB 4.28Å; I188-P242 HydrophobicContact CB-CG 4.15Å; I188-P242 HydrophobicContact CD1-CB 4.17Å; I188-P242 HydrophobicContact CD1-CG 3.8Å; I188-P242 HydrophobicContact CG2-CG 4.33Å; I188-A243 CarbonylContact C-O 3.56Å; I188-A243 WeakPolarHBondContact CA-O 3.49Å; I188-T244 HydrophobicContact CB-CG2 4.13Å; I188-T244 HydrophobicContact CG2-CG2 3.52Å
189	N	89.5	Confident	81.6	Confident	21 Å²	21	50.4 Å²	50.4	11%	0.112	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	104.8	161.8	-172.3	-20.9	0	0	0	109.7	Y177 L178 S191 M192 P242 A243	Y177-N189 PolarHBondContact O-ND2 3.14Å; L178-N189 HydrophobicContact CD2-CB 4.09Å; N189-S191 PolarHBondContact O-N 3.27Å; N189-S191 WeakPolarHBondContact OD1-CB 3.47Å; N189-S191 PolarHBondContact OD1-N 2.92Å; N189-S191 PolarHBondContact OD1-OG 3.14Å; N189-M192 HydrophobicContact CB-CG 4.14Å; N189-M192 WeakPolarHBondContact ND2-CE 3.48Å; N189-M192 VanDerWaalsContact O-O 3.14Å; N189-P242 WeakPolarHBondContact O-CB 3.43Å; N189-A243 HydrophobicContact CB-CB 4.3Å; N189-A243 PolarHBondContact N-O 3.05Å; N189-A243 PolarHBondContact O-N 3.05Å
190	G	86.3	Confident	80.7	Confident	40 Å²	40	46.4 Å²	46.4	41%	0.412	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	6.3	179.4	0	0	0	0	0	115.2	Y241	G190-Y241 PolarHBondContact O-OH 3.31Å
191	S	86.2	Confident	80.5	Confident	78 Å²	78	42.3 Å²	42.3	55%	0.545	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-9.2	178.3	67.7	0	0	0	0	114	N189	N189-S191 PolarHBondContact O-N 3.27Å; N189-S191 WeakPolarHBondContact OD1-CB 3.47Å; N189-S191 PolarHBondContact OD1-N 2.92Å; N189-S191 PolarHBondContact OD1-OG 3.14Å
192	M	87.5	Confident	80.2	Confident	62 Å²	62	44.2 Å²	44.2	31%	0.305	27%	0.274	S	S	.	.			trans	-147.4	160	-175.8	64.7	179.4	62.5	0	0	112.1	N189 Y241 A243	N189-M192 HydrophobicContact CB-CG 4.14Å; N189-M192 WeakPolarHBondContact ND2-CE 3.48Å; N189-M192 VanDerWaalsContact O-O 3.14Å; M192-Y241 WeakPolarHBondContact O-CD2 3.48Å; M192-A243 HydrophobicContact CG-CB 3.93Å; M192-A243 WeakPolarHBondContact O-CB 3.45Å; M192-A243 PolarHBondContact O-N 3.19Å
193	S	90.3	Very high	80.3	Confident	9 Å²	9	43.2 Å²	43.2	6%	0.063	27%	0.271	C	S	.	.			trans	-95	159.6	166	49.3	0	0	0	0	110.8	T213 E240	S193-T213 PolarHBondContact OG-OG1 3.46Å; S193-E240 CarbonylContact C-O 3.53Å; S193-E240 WeakPolarHBondContact CA-O 3.45Å; S193-E240 WeakPolarHBondContact CB-O 3.43Å
194	C	90.8	Very high	80.3	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	164.3	171.2	71.1	0	0	0	0	111.2	H168 C170 I173 T239 E240 A243	H168-C194 CarbonylContact O-C 3.55Å; H168-C194 WeakPolarHBondContact O-CA 3.32Å; H168-C194 WeakPolarHBondContact O-CB 3.49Å; C170-C194 VanDerWaalsContact CA-SG 3.56Å; C170-C194 HydrophobicContact CB-CB 3.92Å; C170-C194 WeakPolarHBondContact CB-SG 3.4Å; C170-C194 WeakPolarHBondContact SG-CB 3.17Å; C170-C194 CovalentContact SG-SG 2.04Å; C170-C194 PolarHBondContact SG-SG 3.41Å; I173-C194 HydrophobicContact CD1-CB 3.76Å; C194-T239 WeakPolarHBondContact O-CA 3.29Å; C194-E240 PolarHBondContact N-O 3.39Å; C194-E240 PolarHBondContact O-N 3.14Å; C194-A243 HydrophobicContact CB-CB 3.71Å
195	D	89.9	Confident	80.5	Confident	2 Å²	2	43 Å²	43	1%	0.011	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	137.4	-174.8	-62.5	-66.1	0	0	0	111.6	Y167 H168 E169 C170 V197 Y207 R238 T239	Y167-D195 HydrophobicContact CD2-CB 4.33Å; H168-D195 PolarHBondContact O-N 3.23Å; E169-D195 WeakPolarHBondContact CA-O 3.12Å; C170-D195 PolarHBondContact N-O 3.08Å; C170-D195 PolarHBondContact SG-N 3.49Å; C170-D195 VanDerWaalsContact SG-N 3.44Å; D195-V197 HydrophobicContact CB-CG2 4.1Å; D195-Y207 WeakPolarHBondContact OD2-CE2 3.37Å; D195-Y207 PolarHBondContact OD2-OH 3.35Å; D195-R238 CarbonylContact C-O 3.6Å; D195-R238 WeakPolarHBondContact CA-O 3.44Å; D195-T239 WeakPolarHBondContact OD1-CA 3.29Å; D195-T239 VanDerWaalsContact OD1-CB 3.25Å; D195-T239 WeakPolarHBondContact OD1-CB 2.93Å; D195-T239 WeakPolarHBondContact OD1-CG2 3.31Å; D195-T239 PolarHBondContact OD1-OG1 2.84Å
196	V	86.4	Confident	81.1	Confident	11 Å²	11	38.6 Å²	38.6	7%	0.067	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	106.8	165.7	-177.8	0	0	0	0	106.7	C170 R238 L259	C170-V196 HydrophobicContact CB-CG2 4.36Å; V196-R238 HydrophobicContact CB-CB 4.25Å; V196-R238 PolarHBondContact N-O 3Å; V196-R238 PolarHBondContact O-N 3.32Å; V196-R238 VanDerWaalsContact O-N 3.08Å; V196-L259 HydrophobicContact CG1-CD2 4.5Å
197	V	82.2	Confident	81.4	Confident	27 Å²	27	38.9 Å²	38.9	16%	0.164	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-100.7	120.5	-172.7	-172	0	0	0	0	109.6	F164 Y167 D195 L201 L237	F164-V197 HydrophobicContact CZ-CG1 4.4Å; Y167-V197 HydrophobicContact CD2-CG2 3.65Å; Y167-V197 HydrophobicContact CE2-CB 4.44Å; Y167-V197 HydrophobicContact CE2-CG2 3.52Å; Y167-V197 HydrophobicContact CG-CG2 4.38Å; D195-V197 HydrophobicContact CB-CG2 4.1Å; V197-L201 HydrophobicContact CG1-CB 4.27Å; V197-L201 HydrophobicContact CG1-CD2 3.86Å; V197-L237 HydrophobicContact CB-CD1 4.47Å; V197-L237 HydrophobicContact CG1-CD1 4.38Å; V197-L237 HydrophobicContact CG2-CD1 3.88Å
198	P	77.1	Confident	81.3	Confident	7 Å²	7	36.9 Å²	36.9	5%	0.045	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-65.5	142.5	174	27.4	-34	0	0	0	110.9	G200 L201 E492	P198-G200 PolarHBondContact O-N 2.95Å; P198-L201 HydrophobicContact CG-CB 4.12Å; P198-L201 HydrophobicContact CG-CD1 3.87Å; P198-L201 HydrophobicContact CG-CD2 4.35Å; P198-L201 HydrophobicContact CG-CG 4.34Å; P198-L201 WeakPolarHBondContact O-CB 3.35Å; P198-L201 PolarHBondContact O-N 3.34Å; P198-E492 VanDerWaalsContact CA-OE1 3.23Å; P198-E492 WeakPolarHBondContact CA-OE1 3.39Å; P198-E492 VanDerWaalsContact CB-CD 3.48Å; P198-E492 WeakPolarHBondContact CB-OE1 3.41Å
199	K	72.8	Confident	80.6	Confident	96 Å²	96	36 Å²	36	42%	0.417	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	135.6	175.6	-73.6	177.8	172.8	155.1	0	110.3	E255 E491	K199-E255 WeakPolarHBondContact CE-OE1 3.38Å; K199-E255 IonicContact NZ-OE1 2.67Å; K199-E255 PolarHBondContact NZ-OE1 2.85Å; K199-E255 IonicContact NZ-OE2 2.81Å; K199-E491 HydrophobicContact CD-CB 3.93Å; K199-E491 HydrophobicContact CD-CG 4.37Å; K199-E491 WeakPolarHBondContact CD-OE2 3.3Å; K199-E491 WeakPolarHBondContact CE-OE2 3.41Å; K199-E491 IonicContact NZ-OE2 3.3Å; K199-E491 PolarHBondContact NZ-OE2 3.36Å
200	G	68.5	Low	79.7	Confident	85 Å²	85	38.3 Å²	38.3	88%	0.876	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.5	13.6	-177.5	0	0	0	0	0	115.1	P198 S202	P198-G200 PolarHBondContact O-N 2.95Å; G200-S202 PolarHBondContact O-N 3.46Å
201	L	74.9	Confident	79.4	Confident	31 Å²	31	40.8 Å²	40.8	16%	0.162	24%	0.242	C	C	.	.			trans	-54.5	133.6	173.5	-168.9	63.2	0	0	0	110.9	F164 V197 P198 S205 D235 L237	F164-L201 HydrophobicContact CE2-CD2 3.66Å; F164-L201 HydrophobicContact CZ-CD2 3.87Å; F164-L201 HydrophobicContact CZ-CG 4.49Å; V197-L201 HydrophobicContact CG1-CB 4.27Å; V197-L201 HydrophobicContact CG1-CD2 3.86Å; P198-L201 HydrophobicContact CG-CB 4.12Å; P198-L201 HydrophobicContact CG-CD1 3.87Å; P198-L201 HydrophobicContact CG-CD2 4.35Å; P198-L201 HydrophobicContact CG-CG 4.34Å; P198-L201 WeakPolarHBondContact O-CB 3.35Å; P198-L201 PolarHBondContact O-N 3.34Å; L201-S205 WeakPolarHBondContact CD1-OG 3.36Å; L201-D235 HydrophobicContact CD1-CB 3.6Å; L201-L237 HydrophobicContact CD2-CB 4.04Å; L201-L237 HydrophobicContact CD2-CD1 3.91Å
202	S	71.1	Confident	79.5	Confident	57 Å²	57	37 Å²	37	40%	0.399	22%	0.216	S	C	.	.			trans	-66.5	141.6	179.2	178.4	0	0	0	0	110.7	G200 F204 S205	G200-S202 PolarHBondContact O-N 3.46Å; S202-F204 PolarHBondContact O-N 2.77Å; S202-F204 VanDerWaalsContact O-N 3.08Å; S202-F204 PolarHBondContact OG-N 3.3Å; S202-F204 VanDerWaalsContact OG-N 3.12Å; S202-S205 VanDerWaalsContact O-CB 3.26Å; S202-S205 WeakPolarHBondContact O-CB 3.28Å; S202-S205 PolarHBondContact O-N 3.44Å; S202-S205 PolarHBondContact O-OG 3.02Å
203	A	69.8	Low	79.3	Confident	51 Å²	51	35.1 Å²	35.1	42%	0.421	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.4	169.5	0	0	0	0	0	112.9	M161	M161-A203 HydrophobicContact SD-CB 4.22Å
204	F	72.6	Confident	79.1	Confident	140 Å²	140	40.1 Å²	40.1	61%	0.614	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.7	18.5	173.5	-54.7	-76.3	0	0	0	112.7	Y159 S202	Y159-F204 HydrophobicContact CD1-CB 4.36Å; Y159-F204 WeakPolarHBondContact CD1-O 3.17Å; Y159-F204 WeakPolarHBondContact CE1-O 3.26Å; S202-F204 PolarHBondContact O-N 2.77Å; S202-F204 VanDerWaalsContact O-N 3.08Å; S202-F204 PolarHBondContact OG-N 3.3Å; S202-F204 VanDerWaalsContact OG-N 3.12Å
205	S	78	Confident	79	Confident	8 Å²	8	40.6 Å²	40.6	6%	0.056	24%	0.238	C	C	.	.	S	Bend	trans	-79.4	144.9	173	-74.5	0	0	0	0	111.1	L201 S202 Y207 D235	L201-S205 WeakPolarHBondContact CD1-OG 3.36Å; S202-S205 VanDerWaalsContact O-CB 3.26Å; S202-S205 WeakPolarHBondContact O-CB 3.28Å; S202-S205 PolarHBondContact O-N 3.44Å; S202-S205 PolarHBondContact O-OG 3.02Å; S205-Y207 PolarHBondContact O-N 2.82Å; S205-D235 VanDerWaalsContact CB-OD2 3.26Å; S205-D235 WeakPolarHBondContact CB-OD2 3.43Å; S205-D235 PolarHBondContact OG-OD2 3.16Å
206	F	82.5	Confident	79.1	Confident	11 Å²	11	40.5 Å²	40.5	5%	0.048	24%	0.237	C	C	.	.			trans	-70.1	120.6	-179.4	174.8	-114	0	0	0	111.2	I150 I153 F154 P158 P208 F231 V548	I150-F206 HydrophobicContact CG2-CE1 3.8Å; I150-F206 HydrophobicContact CG2-CZ 4.02Å; I153-F206 HydrophobicContact CG2-CE2 4.02Å; I153-F206 HydrophobicContact CG2-CZ 4.23Å; F154-F206 HydrophobicContact CB-CE2 3.87Å; F154-F206 HydrophobicContact CB-CZ 3.9Å; F154-F206 HydrophobicContact CD2-CD1 4.05Å; F154-F206 AromaticContact CD2-CD2 3.54Å; F154-F206 HydrophobicContact CD2-CD2 3.54Å; F154-F206 HydrophobicContact CD2-CE1 4.11Å; F154-F206 AromaticContact CD2-CE2 3.62Å; F154-F206 HydrophobicContact CD2-CE2 3.62Å; F154-F206 AromaticContact CD2-CG 3.77Å; F154-F206 HydrophobicContact CD2-CG 3.77Å; F154-F206 AromaticContact CD2-CZ 3.9Å; F154-F206 HydrophobicContact CD2-CZ 3.9Å; F154-F206 HydrophobicContact CE2-CB 4.38Å; F154-F206 HydrophobicContact CE2-CD2 4.15Å; F154-F206 HydrophobicContact CE2-CG 4.12Å; F154-F206 HydrophobicContact CG-CD2 4.47Å; F154-F206 HydrophobicContact CG-CE2 4.19Å; F154-F206 HydrophobicContact CG-CZ 4.42Å; P158-F206 WeakPolarHBondContact O-CD2 3.36Å; F206-P208 HydrophobicContact CD1-CG 4.41Å; F206-P208 HydrophobicContact CE1-CB 4.11Å; F206-P208 HydrophobicContact CE1-CG 3.73Å; F206-P208 HydrophobicContact CZ-CB 3.84Å; F206-P208 HydrophobicContact CZ-CG 4Å; F206-F231 HydrophobicContact CD1-CE1 4.05Å; F206-F231 AromaticContact CD1-CZ 3.82Å; F206-F231 HydrophobicContact CD1-CZ 3.82Å; F206-F231 HydrophobicContact CE1-CE1 4Å; F206-F231 AromaticContact CE1-CZ 3.72Å; F206-F231 HydrophobicContact CE1-CZ 3.72Å; F206-V548 HydrophobicContact CD1-CG1 3.68Å; F206-V548 HydrophobicContact CE1-CG1 3.72Å; F206-V548 HydrophobicContact CG-CG1 4.47Å
207	Y	82.7	Confident	79.2	Confident	20 Å²	20	41.9 Å²	41.9	8%	0.078	24%	0.244	C	C	.	.			trans	-126.9	100.1	-178.5	178.7	-99.3	0	0	0	111.2	A163 F164 D195 S205 Q210 L237	A163-Y207 HydrophobicContact CB-CD1 3.92Å; A163-Y207 HydrophobicContact CB-CE1 4.32Å; A163-Y207 WeakPolarHBondContact O-CE1 3.29Å; F164-Y207 HydrophobicContact CD2-CD2 4.41Å; F164-Y207 HydrophobicContact CD2-CG 4.24Å; D195-Y207 WeakPolarHBondContact OD2-CE2 3.37Å; D195-Y207 PolarHBondContact OD2-OH 3.35Å; S205-Y207 PolarHBondContact O-N 2.82Å; Y207-Q210 HydrophobicContact CE1-CG 4.49Å; Y207-L237 HydrophobicContact CD2-CD1 3.99Å; Y207-L237 HydrophobicContact CD2-CD2 3.35Å; Y207-L237 HydrophobicContact CD2-CG 4.25Å; Y207-L237 HydrophobicContact CE2-CD1 4.31Å; Y207-L237 HydrophobicContact CE2-CD2 4.04Å; Y207-L237 HydrophobicContact CG-CD2 4.26Å
208	P	80.2	Confident	79.6	Confident	1 Å²	1	46 Å²	46	1%	0.006	27%	0.265	C	S	.	.			trans	-93	-4.4	174.9	35.6	-34.8	0	0	0	113.8	I153 F206 Q210 N211 L212 F231	I153-P208 HydrophobicContact CD1-CB 4.02Å; I153-P208 HydrophobicContact CG2-CB 4.28Å; F206-P208 HydrophobicContact CD1-CG 4.41Å; F206-P208 HydrophobicContact CE1-CB 4.11Å; F206-P208 HydrophobicContact CE1-CG 3.73Å; F206-P208 HydrophobicContact CZ-CB 3.84Å; F206-P208 HydrophobicContact CZ-CG 4Å; P208-Q210 PolarHBondContact O-N 3.16Å; P208-N211 WeakPolarHBondContact O-CA 3.32Å; P208-N211 WeakPolarHBondContact O-CB 3.3Å; P208-N211 PolarHBondContact O-N 3.34Å; P208-L212 HydrophobicContact CB-CD1 4.03Å; P208-L212 HydrophobicContact CB-CD2 4.39Å; P208-L212 HydrophobicContact CB-CG 4.02Å; P208-L212 HydrophobicContact CG-CD1 3.77Å; P208-L212 HydrophobicContact CG-CG 4.32Å; P208-L212 PolarHBondContact O-N 3.38Å; P208-F231 HydrophobicContact CG-CD1 3.45Å; P208-F231 VanDerWaalsContact CG-CD1 3.45Å; P208-F231 HydrophobicContact CG-CE1 3.43Å; P208-F231 VanDerWaalsContact CG-CE1 3.43Å; P208-F231 HydrophobicContact CG-CG 4.29Å; P208-F231 HydrophobicContact CG-CZ 4.27Å
209	G	72.6	Confident	80.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-45.4	-60.4	-156.8	0	0	0	0	0	116	N211 L212	G209-N211 PolarHBondContact O-N 3.22Å; G209-L212 PolarHBondContact O-N 2.97Å
210	Q	71.9	Confident	80.9	Confident	69 Å²	69	43 Å²	43	32%	0.322	26%	0.256	S	S	.	.	H	α-helix	trans	-59.6	-30.6	-179.8	-71.7	-168.4	-10.1	0	0	114.1	Q166 Y207 P208 L212 T213	Q166-Q210 PolarHBondContact O-NE2 3.23Å; Y207-Q210 HydrophobicContact CE1-CG 4.49Å; P208-Q210 PolarHBondContact O-N 3.16Å; Q210-L212 VanDerWaalsContact C-N 3.27Å; Q210-L212 PolarHBondContact O-N 3.49Å; Q210-T213 PolarHBondContact O-OG1 3.2Å
211	N	80.2	Confident	81.7	Confident	91 Å²	91	45.9 Å²	45.9	49%	0.487	25%	0.247	S	C	.	.	H	α-helix	trans	-79.2	-12.5	179.5	-69.1	-21.4	0	0	0	112.7	I153 P208 G209	I153-N211 HydrophobicContact CD1-CB 3.58Å; I153-N211 HydrophobicContact CG1-CB 4.35Å; P208-N211 WeakPolarHBondContact O-CA 3.32Å; P208-N211 WeakPolarHBondContact O-CB 3.3Å; P208-N211 PolarHBondContact O-N 3.34Å; G209-N211 PolarHBondContact O-N 3.22Å
212	L	86.9	Confident	82.2	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-90	-20.6	177.1	-60.1	-177.4	0	0	0	112.9	Q149 I150 I153 P208 G209 Q210 N214 A215 F216 F231	Q149-L212 HydrophobicContact CB-CD2 4.29Å; Q149-L212 HydrophobicContact CG-CD2 3.94Å; I150-L212 HydrophobicContact CD1-CD1 4.25Å; I150-L212 HydrophobicContact CG1-CD1 4.07Å; I150-L212 HydrophobicContact CG1-CD2 3.76Å; I153-L212 HydrophobicContact CD1-CD2 3.96Å; P208-L212 HydrophobicContact CB-CD1 4.03Å; P208-L212 HydrophobicContact CB-CD2 4.39Å; P208-L212 HydrophobicContact CB-CG 4.02Å; P208-L212 HydrophobicContact CG-CD1 3.77Å; P208-L212 HydrophobicContact CG-CG 4.32Å; P208-L212 PolarHBondContact O-N 3.38Å; G209-L212 PolarHBondContact O-N 2.97Å; Q210-L212 VanDerWaalsContact C-N 3.27Å; Q210-L212 PolarHBondContact O-N 3.49Å; L212-N214 VanDerWaalsContact C-N 3.27Å; L212-N214 PolarHBondContact O-N 2.95Å; L212-A215 WeakPolarHBondContact O-CA 3.47Å; L212-A215 WeakPolarHBondContact O-CB 3.5Å; L212-A215 PolarHBondContact O-N 3.19Å; L212-F216 HydrophobicContact CB-CD2 4.08Å; L212-F216 HydrophobicContact CB-CE1 4.35Å; L212-F216 HydrophobicContact CB-CE2 3.54Å; L212-F216 HydrophobicContact CB-CZ 3.7Å; L212-F216 HydrophobicContact CD1-CE2 4.38Å; L212-F216 HydrophobicContact CD1-CZ 3.91Å; L212-F216 HydrophobicContact CG-CZ 4.44Å; L212-F216 WeakPolarHBondContact O-CD2 3.41Å; L212-F216 WeakPolarHBondContact O-CG 3.49Å; L212-F216 PolarHBondContact O-N 3.25Å; L212-F231 HydrophobicContact CD1-CB 3.83Å; L212-F231 HydrophobicContact CD1-CD1 4.48Å; L212-F231 HydrophobicContact CD1-CG 4.26Å
213	T	84.1	Confident	82.7	Confident	21 Å²	21	49.7 Å²	49.7	13%	0.129	26%	0.262	C	S	.	.	H	α-helix	trans	-54.9	-41.5	-175.4	-46.4	0	0	0	0	112.4	S193 Q210 A215 F216 L217	S193-T213 PolarHBondContact OG-OG1 3.46Å; Q210-T213 PolarHBondContact O-OG1 3.2Å; T213-A215 PolarHBondContact O-N 2.78Å; T213-F216 PolarHBondContact O-N 3.25Å; T213-L217 HydrophobicContact CG2-CD1 4.1Å; T213-L217 WeakPolarHBondContact O-CB 3.3Å; T213-L217 WeakPolarHBondContact O-CG 3.05Å; T213-L217 PolarHBondContact O-N 2.94Å
214	N	86	Confident	83	Confident	114 Å²	114	52.4 Å²	52.4	61%	0.61	27%	0.273	S	S	*	.	H	α-helix	trans	-64.6	-39.6	176.7	-71	-21.3	0	0	0	112.7	L212 L217 L218	L212-N214 VanDerWaalsContact C-N 3.27Å; L212-N214 PolarHBondContact O-N 2.95Å; N214-L217 PolarHBondContact O-N 3.49Å; N214-L218 VanDerWaalsContact O-CG 3.28Å; N214-L218 WeakPolarHBondContact O-CG 3.23Å; N214-L218 PolarHBondContact O-N 3.03Å
215	A	89.1	Confident	83.2	Confident	10 Å²	10	45.8 Å²	45.8	8%	0.083	25%	0.245	C	C	.	.	H	α-helix	trans	-66.8	-41.5	176.5	0	0	0	0	0	110.9	L212 T213 L218 N219	L212-A215 WeakPolarHBondContact O-CA 3.47Å; L212-A215 WeakPolarHBondContact O-CB 3.5Å; L212-A215 PolarHBondContact O-N 3.19Å; T213-A215 PolarHBondContact O-N 2.78Å; A215-L218 PolarHBondContact O-N 2.92Å; A215-N219 WeakPolarHBondContact O-CB 3.36Å; A215-N219 VanDerWaalsContact O-CG 3.23Å; A215-N219 PolarHBondContact O-N 3.4Å; A215-N219 PolarHBondContact O-ND2 2.83Å
216	F	91.9	Very high	83.6	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.4	-45.2	175.8	-61.6	-35.3	0	0	0	112.2	I146 L212 T213 N219 A220 Q229 T239 Y241	I146-F216 HydrophobicContact CD1-CD1 3.84Å; I146-F216 HydrophobicContact CD1-CE1 3.68Å; I146-F216 HydrophobicContact CG1-CD1 4.03Å; I146-F216 HydrophobicContact CG1-CE1 3.89Å; I146-F216 HydrophobicContact CG2-CE1 3.99Å; L212-F216 HydrophobicContact CB-CD2 4.08Å; L212-F216 HydrophobicContact CB-CE1 4.35Å; L212-F216 HydrophobicContact CB-CE2 3.54Å; L212-F216 HydrophobicContact CB-CZ 3.7Å; L212-F216 HydrophobicContact CD1-CE2 4.38Å; L212-F216 HydrophobicContact CD1-CZ 3.91Å; L212-F216 HydrophobicContact CG-CZ 4.44Å; L212-F216 WeakPolarHBondContact O-CD2 3.41Å; L212-F216 WeakPolarHBondContact O-CG 3.49Å; L212-F216 PolarHBondContact O-N 3.25Å; T213-F216 PolarHBondContact O-N 3.25Å; F216-N219 PolarHBondContact O-N 3.13Å; F216-A220 WeakPolarHBondContact O-CB 3.41Å; F216-A220 PolarHBondContact O-N 2.99Å; F216-Q229 HydrophobicContact CD1-CB 3.61Å; F216-Q229 HydrophobicContact CD1-CG 4.43Å; F216-Q229 HydrophobicContact CE1-CB 3.91Å; F216-Q229 HydrophobicContact CG-CB 4.22Å; F216-Q229 PolarHBondContact O-NE2 3.3Å; F216-T239 HydrophobicContact CE2-CG2 4.15Å; F216-Y241 HydrophobicContact CB-CD1 3.72Å; F216-Y241 HydrophobicContact CB-CD2 4.24Å; F216-Y241 HydrophobicContact CB-CE1 4.44Å; F216-Y241 HydrophobicContact CB-CG 3.62Å; F216-Y241 HydrophobicContact CD2-CG 4.27Å; F216-Y241 HydrophobicContact CG-CG 4.26Å
217	L	88.9	Confident	83.7	Confident	40 Å²	40	46.8 Å²	46.8	21%	0.209	25%	0.25	C	C	.	.	H	α-helix	trans	-59.1	-48.1	176.6	-79.5	163.8	0	0	0	111.9	T213 N214 N219 A220 Q221 Y241	T213-L217 HydrophobicContact CG2-CD1 4.1Å; T213-L217 WeakPolarHBondContact O-CB 3.3Å; T213-L217 WeakPolarHBondContact O-CG 3.05Å; T213-L217 PolarHBondContact O-N 2.94Å; N214-L217 PolarHBondContact O-N 3.49Å; L217-N219 VanDerWaalsContact C-N 3.35Å; L217-N219 PolarHBondContact O-N 2.89Å; L217-A220 PolarHBondContact O-N 3.11Å; L217-Q221 WeakPolarHBondContact O-CB 3.41Å; L217-Q221 VanDerWaalsContact O-CG 3.31Å; L217-Q221 WeakPolarHBondContact O-CG 2.98Å; L217-Q221 PolarHBondContact O-N 2.84Å; L217-Y241 HydrophobicContact CD2-CE2 3.86Å; L217-Y241 VanDerWaalsContact CD2-OH 3.25Å; L217-Y241 WeakPolarHBondContact CD2-OH 3.34Å; L217-Y241 HydrophobicContact CG-CE2 4.08Å
218	L	89.5	Confident	84	Confident	113 Å²	113	46.2 Å²	46.2	59%	0.592	25%	0.248	S	C	*	.	H	α-helix	trans	-61.8	-42.6	178.9	-72.7	170.4	0	0	0	112.1	N214 A215 Q221 N222	N214-L218 VanDerWaalsContact O-CG 3.28Å; N214-L218 WeakPolarHBondContact O-CG 3.23Å; N214-L218 PolarHBondContact O-N 3.03Å; A215-L218 PolarHBondContact O-N 2.92Å; L218-Q221 PolarHBondContact O-N 2.94Å; L218-N222 WeakPolarHBondContact O-CB 3.42Å; L218-N222 PolarHBondContact O-N 3.19Å
219	N	91.5	Very high	84.6	Confident	15 Å²	15	46.2 Å²	46.2	8%	0.08	25%	0.247	C	C	.	.	H	α-helix	trans	-62.3	-45.2	176.5	-73.6	-16.6	0	0	0	111.8	A142 A215 F216 L217 Q221 N222 E223 I226 Q229	A142-N219 HydrophobicContact CB-CB 4.12Å; A142-N219 PolarHBondContact O-ND2 3.49Å; A215-N219 WeakPolarHBondContact O-CB 3.36Å; A215-N219 VanDerWaalsContact O-CG 3.23Å; A215-N219 PolarHBondContact O-N 3.4Å; A215-N219 PolarHBondContact O-ND2 2.83Å; F216-N219 PolarHBondContact O-N 3.13Å; L217-N219 VanDerWaalsContact C-N 3.35Å; L217-N219 PolarHBondContact O-N 2.89Å; N219-Q221 VanDerWaalsContact C-N 3.32Å; N219-Q221 PolarHBondContact O-N 2.87Å; N219-N222 PolarHBondContact O-N 2.94Å; N219-E223 PolarHBondContact O-N 3.25Å; N219-I226 HydrophobicContact CB-CD1 4.36Å; N219-Q229 PolarHBondContact ND2-OE1 2.01Å
220	A	86.5	Confident	85.5	Confident	25 Å²	25	46.2 Å²	46.2	21%	0.207	25%	0.247	C	C	.	.	H	α-helix	trans	-68.7	-29.9	-179.9	0	0	0	0	0	113	F216 L217 Y241	F216-A220 WeakPolarHBondContact O-CB 3.41Å; F216-A220 PolarHBondContact O-N 2.99Å; L217-A220 PolarHBondContact O-N 3.11Å; A220-Y241 HydrophobicContact CB-CE1 3.81Å
221	Q	85.8	Confident	86.5	Confident	146 Å²	146	42.9 Å²	42.9	68%	0.682	23%	0.232	S	C	*	.	H	α-helix	trans	-72.7	-34.5	173	-74.3	175.1	-1.3	0	0	112.4	L217 L218 N219	L217-Q221 WeakPolarHBondContact O-CB 3.41Å; L217-Q221 VanDerWaalsContact O-CG 3.31Å; L217-Q221 WeakPolarHBondContact O-CG 2.98Å; L217-Q221 PolarHBondContact O-N 2.84Å; L218-Q221 PolarHBondContact O-N 2.94Å; N219-Q221 VanDerWaalsContact C-N 3.32Å; N219-Q221 PolarHBondContact O-N 2.87Å
222	N	84.1	Confident	86.9	Confident	137 Å²	137	38.6 Å²	38.6	73%	0.733	21%	0.209	S	C	*	.	H	α-helix	trans	-80	-34.7	-178.1	-167.2	47.3	0	0	0	112.7	L218 N219	L218-N222 WeakPolarHBondContact O-CB 3.42Å; L218-N222 PolarHBondContact O-N 3.19Å; N219-N222 PolarHBondContact O-N 2.94Å
223	E	81.4	Confident	86.9	Confident	32 Å²	32	38.6 Å²	38.6	15%	0.15	21%	0.209	C	C	.	.			trans	-131.2	106.5	179	-177.8	58.8	-98.8	0	0	110.5	S138 N219 S225 I226	S138-E223 WeakPolarHBondContact CB-OE2 3.38Å; S138-E223 PolarHBondContact OG-OE2 3.47Å; N219-E223 PolarHBondContact O-N 3.25Å; E223-S225 VanDerWaalsContact CG-OG 3.31Å; E223-S225 WeakPolarHBondContact CG-OG 3.14Å; E223-S225 PolarHBondContact O-N 3.45Å; E223-S225 PolarHBondContact OE1-N 2.65Å; E223-S225 PolarHBondContact OE1-OG 2.76Å; E223-I226 HydrophobicContact CB-CD1 3.94Å; E223-I226 HydrophobicContact CB-CG1 4.15Å; E223-I226 HydrophobicContact CG-CD1 4.25Å; E223-I226 HydrophobicContact CG-CG1 3.98Å; E223-I226 PolarHBondContact O-N 3.5Å
224	T	75.9	Confident	86.7	Confident	107 Å²	107	38.8 Å²	38.8	66%	0.656	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-15.7	-176.8	56.2	0	0	0	0	113.1	I226	T224-I226 PolarHBondContact O-N 3.33Å
225	S	77.1	Confident	86.4	Confident	2 Å²	2	36 Å²	36	1%	0.014	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-10.5	177.9	70.7	0	0	0	0	113.6	E223 L227 V555	E223-S225 VanDerWaalsContact CG-OG 3.31Å; E223-S225 WeakPolarHBondContact CG-OG 3.14Å; E223-S225 PolarHBondContact O-N 3.45Å; E223-S225 PolarHBondContact OE1-N 2.65Å; E223-S225 PolarHBondContact OE1-OG 2.76Å; S225-L227 PolarHBondContact O-N 3.33Å; S225-V555 WeakPolarHBondContact O-CG1 3.24Å
226	I	85.9	Confident	86	Confident	11 Å²	11	35.6 Å²	35.6	6%	0.056	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	110.4	177.9	-64.9	176.5	0	0	0	109.2	A142 N219 E223 T224 Q229 V553	A142-I226 HydrophobicContact CB-CD1 3.87Å; N219-I226 HydrophobicContact CB-CD1 4.36Å; E223-I226 HydrophobicContact CB-CD1 3.94Å; E223-I226 HydrophobicContact CB-CG1 4.15Å; E223-I226 HydrophobicContact CG-CD1 4.25Å; E223-I226 HydrophobicContact CG-CG1 3.98Å; E223-I226 PolarHBondContact O-N 3.5Å; T224-I226 PolarHBondContact O-N 3.33Å; I226-Q229 HydrophobicContact CG2-CG 3.44Å; I226-Q229 VanDerWaalsContact CG2-CG 3.44Å; I226-V553 HydrophobicContact CB-CG1 4.18Å; I226-V553 HydrophobicContact CD1-CG1 3.9Å; I226-V553 HydrophobicContact CG1-CG1 3.69Å; I226-V553 HydrophobicContact CG2-CG1 3.59Å
227	L	85.3	Confident	85.7	Confident	29 Å²	29	35.6 Å²	35.6	15%	0.152	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-40.9	176.2	-68.2	-177.3	0	0	0	112.2	E183 H184 S225 P242 V534 E554 D556	E183-L227 WeakPolarHBondContact O-CD2 3.23Å; H184-L227 PolarHBondContact CD2-O 3.03Å; H184-L227 PolarHBondContact NE2-O 2.75Å; S225-L227 PolarHBondContact O-N 3.33Å; L227-P242 WeakPolarHBondContact O-CD 3.48Å; L227-V534 HydrophobicContact CD1-CG1 4.47Å; L227-E554 PolarHBondContact N-O 2.81Å; L227-D556 HydrophobicContact CD1-CB 3.73Å; L227-D556 HydrophobicContact CG-CB 4.2Å
228	K	89	Confident	85.7	Confident	7 Å²	7	33.8 Å²	33.8	3%	0.03	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	145.7	-174.8	-151.8	171.6	-169.8	176.7	0	111.2	E240 Y241 V553 E554	K228-E240 VanDerWaalsContact CE-OE1 3.32Å; K228-E240 WeakPolarHBondContact CE-OE1 3.47Å; K228-E240 WeakPolarHBondContact CE-OE2 3.37Å; K228-E240 IonicContact NZ-OE1 2.97Å; K228-E240 PolarHBondContact NZ-OE1 3.31Å; K228-E240 IonicContact NZ-OE2 3.05Å; K228-E240 PolarHBondContact NZ-OE2 3.41Å; K228-Y241 CarbonylContact C-O 3.55Å; K228-Y241 WeakPolarHBondContact CA-O 3.14Å; K228-Y241 WeakPolarHBondContact CG-O 3.36Å; K228-V553 CarbonylContact O-C 3.54Å; K228-V553 WeakPolarHBondContact O-CA 3.39Å; K228-E554 HydrophobicContact CB-CB 3.96Å; K228-E554 HydrophobicContact CB-CG 4.31Å; K228-E554 PolarHBondContact N-O 2.84Å; K228-E554 PolarHBondContact O-N 3.13Å
229	Q	92.8	Very high	85.8	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	141.8	174.6	-58.4	177.1	68.1	0	0	108.3	F216 N219 I226 E240 Y241 G552 V553	F216-Q229 HydrophobicContact CD1-CB 3.61Å; F216-Q229 HydrophobicContact CD1-CG 4.43Å; F216-Q229 HydrophobicContact CE1-CB 3.91Å; F216-Q229 HydrophobicContact CG-CB 4.22Å; F216-Q229 PolarHBondContact O-NE2 3.3Å; N219-Q229 PolarHBondContact ND2-OE1 2.01Å; I226-Q229 HydrophobicContact CG2-CG 3.44Å; I226-Q229 VanDerWaalsContact CG2-CG 3.44Å; Q229-E240 CarbonylContact O-C 3.52Å; Q229-E240 WeakPolarHBondContact O-CA 3.41Å; Q229-Y241 PolarHBondContact N-O 3.14Å; Q229-Y241 PolarHBondContact O-N 3.39Å; Q229-G552 WeakPolarHBondContact CA-O 3.47Å; Q229-V553 HydrophobicContact CG-CG1 4.37Å; Q229-V553 HydrophobicContact CG-CG2 4.19Å
230	F	92.1	Very high	85.8	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	158.4	-178.9	60.3	-94.5	0	0	0	113.6	I232 T239 E240 V265 L536 L550 V551 G552 E554	F230-I232 HydrophobicContact CD2-CD1 4.2Å; F230-I232 HydrophobicContact CD2-CG1 3.92Å; F230-I232 HydrophobicContact CE2-CD1 4.18Å; F230-I232 HydrophobicContact CE2-CG1 4.32Å; F230-T239 CarbonylContact C-O 3.5Å; F230-T239 WeakPolarHBondContact CA-O 3.13Å; F230-T239 VanDerWaalsContact CB-O 3.24Å; F230-T239 WeakPolarHBondContact CB-O 3.27Å; F230-E240 HydrophobicContact CB-CB 4.18Å; F230-V265 HydrophobicContact CD2-CG1 4.42Å; F230-V265 HydrophobicContact CE1-CG1 4.11Å; F230-V265 HydrophobicContact CE2-CG1 3.39Å; F230-V265 HydrophobicContact CZ-CG1 3.19Å; F230-L536 HydrophobicContact CE1-CD1 3.75Å; F230-L536 HydrophobicContact CZ-CD1 3.53Å; F230-L536 HydrophobicContact CZ-CD2 4.39Å; F230-L550 HydrophobicContact CD2-CD1 4.21Å; F230-L550 HydrophobicContact CE2-CD1 3.58Å; F230-V551 WeakPolarHBondContact O-CA 3.29Å; F230-G552 PolarHBondContact N-O 3.49Å; F230-G552 PolarHBondContact O-N 3.31Å; F230-E554 HydrophobicContact CE1-CG 3.99Å; F230-E554 WeakPolarHBondContact CE1-OE1 3.36Å
231	F	92.5	Very high	86	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134	166.9	168.8	-109.8	0	0	0	108.8	I150 F206 P208 L212 R238 T239 L550 V551	I150-F231 HydrophobicContact CD1-CB 4.27Å; I150-F231 HydrophobicContact CD1-CD2 3.37Å; I150-F231 HydrophobicContact CD1-CE2 3.86Å; I150-F231 HydrophobicContact CD1-CG 3.92Å; I150-F231 HydrophobicContact CG1-CD2 4.38Å; I150-F231 HydrophobicContact CG2-CE2 4.21Å; F206-F231 HydrophobicContact CD1-CE1 4.05Å; F206-F231 AromaticContact CD1-CZ 3.82Å; F206-F231 HydrophobicContact CD1-CZ 3.82Å; F206-F231 HydrophobicContact CE1-CE1 4Å; F206-F231 AromaticContact CE1-CZ 3.72Å; F206-F231 HydrophobicContact CE1-CZ 3.72Å; P208-F231 HydrophobicContact CG-CD1 3.45Å; P208-F231 VanDerWaalsContact CG-CD1 3.45Å; P208-F231 HydrophobicContact CG-CE1 3.43Å; P208-F231 VanDerWaalsContact CG-CE1 3.43Å; P208-F231 HydrophobicContact CG-CG 4.29Å; P208-F231 HydrophobicContact CG-CZ 4.27Å; L212-F231 HydrophobicContact CD1-CB 3.83Å; L212-F231 HydrophobicContact CD1-CD1 4.48Å; L212-F231 HydrophobicContact CD1-CG 4.26Å; F231-R238 CarbonylContact O-C 3.6Å; F231-R238 VanDerWaalsContact O-CA 3.28Å; F231-R238 WeakPolarHBondContact O-CA 3.3Å; F231-T239 PolarHBondContact N-O 2.9Å; F231-T239 PolarHBondContact O-N 2.94Å; F231-L550 CarbonylContact C-O 3.52Å; F231-L550 WeakPolarHBondContact CA-O 3.37Å; F231-L550 WeakPolarHBondContact CD2-O 3Å; F231-V551 HydrophobicContact CD2-CG2 4.14Å
232	I	89.5	Confident	86.3	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	118.9	170.6	-45.9	178.4	0	0	0	108.5	F230 L237 R238 R262 V265 F266 G549 L550	F230-I232 HydrophobicContact CD2-CD1 4.2Å; F230-I232 HydrophobicContact CD2-CG1 3.92Å; F230-I232 HydrophobicContact CE2-CD1 4.18Å; F230-I232 HydrophobicContact CE2-CG1 4.32Å; I232-L237 CarbonylContact C-O 3.53Å; I232-L237 VanDerWaalsContact CA-O 3.28Å; I232-L237 WeakPolarHBondContact CA-O 3.34Å; I232-R238 HydrophobicContact CG1-CB 4.07Å; I232-R238 HydrophobicContact CG1-CG 3.99Å; I232-R238 HydrophobicContact CG2-CB 4.46Å; I232-R262 HydrophobicContact CD1-CG 4.24Å; I232-R262 HydrophobicContact CG2-CG 4.3Å; I232-V265 HydrophobicContact CD1-CB 4.5Å; I232-V265 HydrophobicContact CD1-CG1 4.08Å; I232-F266 HydrophobicContact CB-CD2 4.07Å; I232-F266 HydrophobicContact CD1-CB 4.1Å; I232-F266 HydrophobicContact CD1-CD2 4.47Å; I232-F266 HydrophobicContact CG2-CD2 3.71Å; I232-F266 HydrophobicContact CG2-CE2 4.38Å; I232-G549 CarbonylContact O-C 3.6Å; I232-G549 WeakPolarHBondContact O-CA 3.34Å; I232-L550 HydrophobicContact CB-CD1 4.25Å; I232-L550 HydrophobicContact CB-CD2 4.4Å; I232-L550 HydrophobicContact CB-CG 4.01Å; I232-L550 HydrophobicContact CD1-CD1 4.07Å; I232-L550 HydrophobicContact CD1-CD2 4.48Å; I232-L550 HydrophobicContact CG1-CD1 4.05Å; I232-L550 HydrophobicContact CG1-CG 4.36Å; I232-L550 PolarHBondContact N-O 3.23Å; I232-L550 PolarHBondContact O-N 2.93Å
233	S	86.6	Confident	86.5	Confident	1 Å²	1	14.1 Å²	14.1	1%	0.007	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	160.5	176.8	83.1	0	0	0	0	111.5	D235 G236 L237	S233-D235 PolarHBondContact O-N 3.07Å; S233-D235 PolarHBondContact OG-N 3.14Å; S233-G236 WeakPolarHBondContact O-CA 3.47Å; S233-G236 PolarHBondContact O-N 3.39Å; S233-G236 PolarHBondContact OG-N 2.94Å; S233-L237 PolarHBondContact N-O 2.68Å; S233-L237 WeakPolarHBondContact OG-CB 2.73Å; S233-L237 PolarHBondContact OG-N 3.32Å; S233-L237 VanDerWaalsContact OG-N 3.1Å
234	A	80.1	Confident	86.8	Confident	25 Å²	25	12.9 Å²	12.9	21%	0.207	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.5	174.7	0	0	0	0	0	113.6	G236 V547 V548	A234-G236 VanDerWaalsContact C-N 3.28Å; A234-V547 VanDerWaalsContact CB-O 3.27Å; A234-V547 WeakPolarHBondContact CB-O 3.48Å; A234-V548 PolarHBondContact N-O 3.17Å
235	D	79	Confident	87.3	Confident	56 Å²	56	9.5 Å²	9.5	30%	0.299	5%	0.05	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-5.7	172.5	-63.4	-37.9	0	0	0	112.4	L201 S205 S233	L201-D235 HydrophobicContact CD1-CB 3.6Å; S205-D235 VanDerWaalsContact CB-OD2 3.26Å; S205-D235 WeakPolarHBondContact CB-OD2 3.43Å; S205-D235 PolarHBondContact OG-OD2 3.16Å; S233-D235 PolarHBondContact O-N 3.07Å; S233-D235 PolarHBondContact OG-N 3.14Å
236	G	79.9	Confident	87.3	Confident	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.056	C	C	.	.			trans	95.5	6.4	173.7	0	0	0	0	0	115.5	S233 A234 R238 R262	S233-G236 WeakPolarHBondContact O-CA 3.47Å; S233-G236 PolarHBondContact O-N 3.39Å; S233-G236 PolarHBondContact OG-N 2.94Å; A234-G236 VanDerWaalsContact C-N 3.28Å; G236-R238 PolarHBondContact O-N 3.4Å; G236-R262 WeakPolarHBondContact O-CD 3.5Å; G236-R262 PolarHBondContact O-NH1 2.87Å
237	L	86.4	Confident	86.8	Confident	1 Å²	1	11.7 Å²	11.7	1%	0.005	6%	0.061	C	C	.	.			trans	-64.1	126.1	169.4	173.7	94.6	0	0	0	109.4	V197 L201 Y207 I232 S233	V197-L237 HydrophobicContact CB-CD1 4.47Å; V197-L237 HydrophobicContact CG1-CD1 4.38Å; V197-L237 HydrophobicContact CG2-CD1 3.88Å; L201-L237 HydrophobicContact CD2-CB 4.04Å; L201-L237 HydrophobicContact CD2-CD1 3.91Å; Y207-L237 HydrophobicContact CD2-CD1 3.99Å; Y207-L237 HydrophobicContact CD2-CD2 3.35Å; Y207-L237 HydrophobicContact CD2-CG 4.25Å; Y207-L237 HydrophobicContact CE2-CD1 4.31Å; Y207-L237 HydrophobicContact CE2-CD2 4.04Å; Y207-L237 HydrophobicContact CG-CD2 4.26Å; I232-L237 CarbonylContact C-O 3.53Å; I232-L237 VanDerWaalsContact CA-O 3.28Å; I232-L237 WeakPolarHBondContact CA-O 3.34Å; S233-L237 PolarHBondContact N-O 2.68Å; S233-L237 WeakPolarHBondContact OG-CB 2.73Å; S233-L237 PolarHBondContact OG-N 3.32Å; S233-L237 VanDerWaalsContact OG-N 3.1Å
238	R	89.1	Confident	86.4	Confident	1 Å²	1	13.8 Å²	13.8	0%	0.004	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	118.3	173.3	173.5	177.3	-175.9	167.3	9.7	110.5	D195 V196 F231 I232 G236 E240 N261 R262 E554	D195-R238 CarbonylContact C-O 3.6Å; D195-R238 WeakPolarHBondContact CA-O 3.44Å; V196-R238 HydrophobicContact CB-CB 4.25Å; V196-R238 PolarHBondContact N-O 3Å; V196-R238 PolarHBondContact O-N 3.32Å; V196-R238 VanDerWaalsContact O-N 3.08Å; F231-R238 CarbonylContact O-C 3.6Å; F231-R238 VanDerWaalsContact O-CA 3.28Å; F231-R238 WeakPolarHBondContact O-CA 3.3Å; I232-R238 HydrophobicContact CG1-CB 4.07Å; I232-R238 HydrophobicContact CG1-CG 3.99Å; I232-R238 HydrophobicContact CG2-CB 4.46Å; G236-R238 PolarHBondContact O-N 3.4Å; R238-E240 IonicContact CZ-OE2 3.72Å; R238-E240 IonicContact NE-OE2 3.67Å; R238-E240 PolarHBondContact NE-OE2 3.08Å; R238-E240 IonicContact NH2-OE2 3.76Å; R238-N261 PolarHBondContact NH1-OD1 3Å; R238-R262 HydrophobicContact CB-CG 4.08Å; R238-E554 IonicContact NH2-OE1 3.85Å
239	T	91.5	Very high	85.9	Confident	0 Å²	0	25 Å²	25	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	131.5	166.7	-55.2	0	0	0	0	108.8	C194 D195 F216 F230 F231	C194-T239 WeakPolarHBondContact O-CA 3.29Å; D195-T239 WeakPolarHBondContact OD1-CA 3.29Å; D195-T239 VanDerWaalsContact OD1-CB 3.25Å; D195-T239 WeakPolarHBondContact OD1-CB 2.93Å; D195-T239 WeakPolarHBondContact OD1-CG2 3.31Å; D195-T239 PolarHBondContact OD1-OG1 2.84Å; F216-T239 HydrophobicContact CE2-CG2 4.15Å; F230-T239 CarbonylContact C-O 3.5Å; F230-T239 WeakPolarHBondContact CA-O 3.13Å; F230-T239 VanDerWaalsContact CB-O 3.24Å; F230-T239 WeakPolarHBondContact CB-O 3.27Å; F231-T239 PolarHBondContact N-O 2.9Å; F231-T239 PolarHBondContact O-N 2.94Å
240	E	90.9	Very high	85.4	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	147.8	179.9	61.2	175.5	-128.4	0	0	114.1	S193 C194 K228 Q229 F230 R238 T244	S193-E240 CarbonylContact C-O 3.53Å; S193-E240 WeakPolarHBondContact CA-O 3.45Å; S193-E240 WeakPolarHBondContact CB-O 3.43Å; C194-E240 PolarHBondContact N-O 3.39Å; C194-E240 PolarHBondContact O-N 3.14Å; K228-E240 VanDerWaalsContact CE-OE1 3.32Å; K228-E240 WeakPolarHBondContact CE-OE1 3.47Å; K228-E240 WeakPolarHBondContact CE-OE2 3.37Å; K228-E240 IonicContact NZ-OE1 2.97Å; K228-E240 PolarHBondContact NZ-OE1 3.31Å; K228-E240 IonicContact NZ-OE2 3.05Å; K228-E240 PolarHBondContact NZ-OE2 3.41Å; Q229-E240 CarbonylContact O-C 3.52Å; Q229-E240 WeakPolarHBondContact O-CA 3.41Å; F230-E240 HydrophobicContact CB-CB 4.18Å; R238-E240 IonicContact CZ-OE2 3.72Å; R238-E240 IonicContact NE-OE2 3.67Å; R238-E240 PolarHBondContact NE-OE2 3.08Å; R238-E240 IonicContact NH2-OE2 3.76Å; E240-T244 PolarHBondContact OE1-OG1 3.06Å
241	Y	91.2	Very high	85	Confident	19 Å²	19	32.5 Å²	32.5	8%	0.075	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	140.8	176.4	173.6	-86.3	0	0	0	110.5	G190 M192 F216 L217 A220 K228 Q229	G190-Y241 PolarHBondContact O-OH 3.31Å; M192-Y241 WeakPolarHBondContact O-CD2 3.48Å; F216-Y241 HydrophobicContact CB-CD1 3.72Å; F216-Y241 HydrophobicContact CB-CD2 4.24Å; F216-Y241 HydrophobicContact CB-CE1 4.44Å; F216-Y241 HydrophobicContact CB-CG 3.62Å; F216-Y241 HydrophobicContact CD2-CG 4.27Å; F216-Y241 HydrophobicContact CG-CG 4.26Å; L217-Y241 HydrophobicContact CD2-CE2 3.86Å; L217-Y241 VanDerWaalsContact CD2-OH 3.25Å; L217-Y241 WeakPolarHBondContact CD2-OH 3.34Å; L217-Y241 HydrophobicContact CG-CE2 4.08Å; A220-Y241 HydrophobicContact CB-CE1 3.81Å; K228-Y241 CarbonylContact C-O 3.55Å; K228-Y241 WeakPolarHBondContact CA-O 3.14Å; K228-Y241 WeakPolarHBondContact CG-O 3.36Å; Q229-Y241 PolarHBondContact N-O 3.14Å; Q229-Y241 PolarHBondContact O-N 3.39Å
242	P	91.4	Very high	84.5	Confident	4 Å²	4	36.5 Å²	36.5	3%	0.026	17%	0.173	C	C	.	.	S	Bend	cis	-65.4	159.9	-8.4	29.8	-35.1	0	0	0	111.2	I188 N189 L227 T244	I188-P242 HydrophobicContact CB-CB 4.28Å; I188-P242 HydrophobicContact CB-CG 4.15Å; I188-P242 HydrophobicContact CD1-CB 4.17Å; I188-P242 HydrophobicContact CD1-CG 3.8Å; I188-P242 HydrophobicContact CG2-CG 4.33Å; N189-P242 WeakPolarHBondContact O-CB 3.43Å; L227-P242 WeakPolarHBondContact O-CD 3.48Å; P242-T244 HydrophobicContact CG-CG2 4.47Å; P242-T244 WeakPolarHBondContact O-CG2 3.31Å; P242-T244 PolarHBondContact O-N 3.27Å
243	A	90	Very high	84	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	127.3	177.2	0	0	0	0	0	110.2	I173 I188 N189 M192 C194	I173-A243 HydrophobicContact CD1-CB 3.86Å; I188-A243 CarbonylContact C-O 3.56Å; I188-A243 WeakPolarHBondContact CA-O 3.49Å; N189-A243 HydrophobicContact CB-CB 4.3Å; N189-A243 PolarHBondContact N-O 3.05Å; N189-A243 PolarHBondContact O-N 3.05Å; M192-A243 HydrophobicContact CG-CB 3.93Å; M192-A243 WeakPolarHBondContact O-CB 3.45Å; M192-A243 PolarHBondContact O-N 3.19Å; C194-A243 HydrophobicContact CB-CB 3.71Å
244	T	87.7	Confident	83.9	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.031	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	148.8	-178.1	71.1	0	0	0	0	111.6	C170 I188 E240 P242	C170-T244 WeakPolarHBondContact CB-O 3.34Å; I188-T244 HydrophobicContact CB-CG2 4.13Å; I188-T244 HydrophobicContact CG2-CG2 3.52Å; E240-T244 PolarHBondContact OE1-OG1 3.06Å; P242-T244 HydrophobicContact CG-CG2 4.47Å; P242-T244 WeakPolarHBondContact O-CG2 3.31Å; P242-T244 PolarHBondContact O-N 3.27Å
245	R	85.3	Confident	84	Confident	36 Å²	36	40 Å²	40	14%	0.136	19%	0.187	C	C	.	.			trans	-114.2	112.7	173.3	-177.1	172	171.1	163.8	-0.4	109.3	C171 I173 L178 D247 I248	C171-R245 VanDerWaalsContact O-CZ 3.23Å; C171-R245 PolarHBondContact O-NH1 2.99Å; I173-R245 PolarHBondContact O-NH1 3.28Å; L178-R245 HydrophobicContact CD1-CB 3.75Å; R245-D247 WeakPolarHBondContact CG-O 3.18Å; R245-D247 PolarHBondContact NE-O 3.28Å; R245-D247 PolarHBondContact O-N 3.03Å; R245-I248 PolarHBondContact NH2-O 3.35Å
246	M	76.4	Confident	83.9	Confident	30 Å²	30	43 Å²	43	15%	0.148	20%	0.202	C	C	.	.	S	Bend	trans	-66.6	-34.8	-172.8	-62.4	-165.7	-162.9	0	0	113.3	L257 N261	M246-L257 HydrophobicContact CB-CB 4.28Å; M246-L257 HydrophobicContact CB-CD1 4.49Å; M246-L257 HydrophobicContact SD-CB 4Å; M246-N261 HydrophobicContact CE-CB 4.03Å; M246-N261 WeakPolarHBondContact CE-ND2 3.14Å; M246-N261 HydrophobicContact SD-CB 4.4Å
247	D	76.9	Confident	83.9	Confident	29 Å²	29	44.9 Å²	44.9	16%	0.155	21%	0.212	C	C	.	.			trans	-129.7	115.5	170.8	-170.7	-21.3	0	0	0	110.4	R245 R249 N250 N253 C254	R245-D247 WeakPolarHBondContact CG-O 3.18Å; R245-D247 PolarHBondContact NE-O 3.28Å; R245-D247 PolarHBondContact O-N 3.03Å; D247-R249 WeakPolarHBondContact OD1-CA 3.24Å; D247-R249 PolarHBondContact OD1-N 3.01Å; D247-N250 PolarHBondContact OD1-N 3.24Å; D247-N253 HydrophobicContact CB-CB 4.38Å; D247-N253 WeakPolarHBondContact OD2-CB 3.36Å; D247-N253 PolarHBondContact OD2-ND2 3.42Å; D247-C254 HydrophobicContact CB-CB 3.97Å
248	I	76.1	Confident	83.7	Confident	73 Å²	73	44.9 Å²	44.9	37%	0.374	21%	0.212	S	C	.	.	S	Bend	trans	-77.3	-29.4	-178.4	-58.3	152.1	0	0	0	110.9	P175 L187 R245	P175-I248 HydrophobicContact CB-CG2 3.95Å; P175-I248 HydrophobicContact CG-CG2 3.75Å; L187-I248 HydrophobicContact CB-CD1 4.39Å; L187-I248 HydrophobicContact CD1-CD1 3.33Å; L187-I248 HydrophobicContact CD1-CG1 4.05Å; L187-I248 HydrophobicContact CG-CD1 3.83Å; R245-I248 PolarHBondContact NH2-O 3.35Å
249	R	79	Confident	83.1	Confident	242 Å²	242	46.2 Å²	46.2	91%	0.913	22%	0.219	S	C	*	.	S	Bend	trans	-88.9	-36.8	-172.7	-54	-174.7	-149.8	-169.8	5.8	112	D247	D247-R249 WeakPolarHBondContact OD1-CA 3.24Å; D247-R249 PolarHBondContact OD1-N 3.01Å
250	N	81.3	Confident	82.4	Confident	73 Å²	73	48.7 Å²	48.7	39%	0.39	23%	0.23	S	C	.	.			trans	-127.7	116.1	-174.1	-170.7	-3.9	0	0	0	112.4	D247 T252 N253 C254	D247-N250 PolarHBondContact OD1-N 3.24Å; N250-T252 PolarHBondContact ND2-OG1 3.48Å; N250-T252 PolarHBondContact OD1-N 2.79Å; N250-T252 VanDerWaalsContact OD1-N 3.09Å; N250-T252 PolarHBondContact OD1-OG1 3.49Å; N250-N253 HydrophobicContact CB-CB 3.94Å; N250-N253 PolarHBondContact O-N 3.37Å; N250-C254 WeakPolarHBondContact O-CB 3.15Å; N250-C254 PolarHBondContact O-N 2.93Å
251	Y	84.2	Confident	81.9	Confident	87 Å²	87	49 Å²	49	34%	0.341	23%	0.232	S	C	.	.	H	α-helix	trans	-60.2	-46.6	176.9	178.1	-89.2	0	0	0	112.6	E169 C171 T172 N253 C254 E255	E169-Y251 PolarHBondContact OE1-OH 2.98Å; E169-Y251 VanDerWaalsContact OE1-OH 3.08Å; C171-Y251 HydrophobicContact CB-CD2 3.87Å; C171-Y251 HydrophobicContact CB-CE2 3.71Å; C171-Y251 WeakPolarHBondContact O-CD2 3.4Å; T172-Y251 HydrophobicContact CG2-CE2 3.81Å; Y251-N253 VanDerWaalsContact C-N 3.31Å; Y251-N253 PolarHBondContact O-N 3.01Å; Y251-C254 WeakPolarHBondContact O-CB 3.26Å; Y251-C254 PolarHBondContact O-N 3.03Å; Y251-C254 VanDerWaalsContact O-N 3.17Å; Y251-E255 PolarHBondContact O-N 3.03Å
252	T	81.5	Confident	81.5	Confident	84 Å²	84	48.1 Å²	48.1	52%	0.515	23%	0.228	S	C	.	.	H	α-helix	trans	-66.8	-35.8	-176.2	51.8	0	0	0	0	111.7	N250 E255 L256	N250-T252 PolarHBondContact ND2-OG1 3.48Å; N250-T252 PolarHBondContact OD1-N 2.79Å; N250-T252 VanDerWaalsContact OD1-N 3.09Å; N250-T252 PolarHBondContact OD1-OG1 3.49Å; T252-E255 PolarHBondContact O-N 2.92Å; T252-L256 WeakPolarHBondContact O-CB 3.27Å; T252-L256 PolarHBondContact O-N 2.99Å
253	N	80.1	Confident	80.9	Confident	64 Å²	64	48.9 Å²	48.9	34%	0.342	23%	0.231	S	C	.	.	H	α-helix	trans	-70.1	-38.7	174.5	-165.3	35.7	0	0	0	111.7	D247 N250 Y251 E255 L256 L257	D247-N253 HydrophobicContact CB-CB 4.38Å; D247-N253 WeakPolarHBondContact OD2-CB 3.36Å; D247-N253 PolarHBondContact OD2-ND2 3.42Å; N250-N253 HydrophobicContact CB-CB 3.94Å; N250-N253 PolarHBondContact O-N 3.37Å; Y251-N253 VanDerWaalsContact C-N 3.31Å; Y251-N253 PolarHBondContact O-N 3.01Å; N253-E255 VanDerWaalsContact C-N 3.34Å; N253-E255 PolarHBondContact O-N 3.47Å; N253-L256 PolarHBondContact O-N 3.43Å; N253-L257 WeakPolarHBondContact O-CB 2.97Å; N253-L257 VanDerWaalsContact O-CG 3.29Å; N253-L257 WeakPolarHBondContact O-CG 3.33Å; N253-L257 PolarHBondContact O-N 2.94Å
254	C	83.4	Confident	80.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-57.8	-46.3	172.6	178.8	0	0	0	0	111.6	C171 D247 N250 Y251 S258	C171-C254 VanDerWaalsContact CA-SG 3.51Å; C171-C254 HydrophobicContact CB-CB 3.87Å; C171-C254 WeakPolarHBondContact CB-SG 3.36Å; C171-C254 WeakPolarHBondContact SG-CB 3.31Å; C171-C254 CovalentContact SG-SG 2.06Å; C171-C254 PolarHBondContact SG-SG 2.97Å; D247-C254 HydrophobicContact CB-CB 3.97Å; N250-C254 WeakPolarHBondContact O-CB 3.15Å; N250-C254 PolarHBondContact O-N 2.93Å; Y251-C254 WeakPolarHBondContact O-CB 3.26Å; Y251-C254 PolarHBondContact O-N 3.03Å; Y251-C254 VanDerWaalsContact O-N 3.17Å; C254-S258 VanDerWaalsContact O-CB 3.22Å; C254-S258 WeakPolarHBondContact O-CB 3.32Å; C254-S258 PolarHBondContact O-N 3.01Å; C254-S258 PolarHBondContact O-OG 2.92Å
255	E	82.5	Confident	79.8	Confident	36 Å²	36	50.6 Å²	50.6	17%	0.168	24%	0.239	C	C	.	.	H	α-helix	trans	-60.1	-49.9	178.1	-168	-174.9	162	0	0	110.4	C171 K199 Y251 T252 N253 L257 S258 L259	C171-E255 PolarHBondContact SG-N 2.87Å; K199-E255 WeakPolarHBondContact CE-OE1 3.38Å; K199-E255 IonicContact NZ-OE1 2.67Å; K199-E255 PolarHBondContact NZ-OE1 2.85Å; K199-E255 IonicContact NZ-OE2 2.81Å; Y251-E255 PolarHBondContact O-N 3.03Å; T252-E255 PolarHBondContact O-N 2.92Å; N253-E255 VanDerWaalsContact C-N 3.34Å; N253-E255 PolarHBondContact O-N 3.47Å; E255-L257 PolarHBondContact O-N 3.43Å; E255-S258 PolarHBondContact O-N 3.41Å; E255-L259 HydrophobicContact CG-CD1 4.01Å; E255-L259 WeakPolarHBondContact O-CB 3.32Å; E255-L259 WeakPolarHBondContact O-CG 3.32Å; E255-L259 PolarHBondContact O-N 3.45Å
256	L	78	Confident	79.4	Confident	119 Å²	119	49.1 Å²	49.1	62%	0.623	23%	0.233	S	C	*	.	H	α-helix	trans	-58.3	-48.9	178.3	-109	155.5	0	0	0	113.2	T252 N253 L259 K260	T252-L256 WeakPolarHBondContact O-CB 3.27Å; T252-L256 PolarHBondContact O-N 2.99Å; N253-L256 PolarHBondContact O-N 3.43Å; L256-L259 PolarHBondContact O-N 3.41Å; L256-K260 WeakPolarHBondContact O-CB 3.21Å; L256-K260 PolarHBondContact O-N 3Å
257	L	78.7	Confident	79.3	Confident	38 Å²	38	47.8 Å²	47.8	20%	0.199	23%	0.228	C	C	.	.	H	α-helix	trans	-64.5	-41.5	178.9	-71.1	169.7	0	0	0	111.5	M246 N253 E255 K260 N261 C528	M246-L257 HydrophobicContact CB-CB 4.28Å; M246-L257 HydrophobicContact CB-CD1 4.49Å; M246-L257 HydrophobicContact SD-CB 4Å; N253-L257 WeakPolarHBondContact O-CB 2.97Å; N253-L257 VanDerWaalsContact O-CG 3.29Å; N253-L257 WeakPolarHBondContact O-CG 3.33Å; N253-L257 PolarHBondContact O-N 2.94Å; E255-L257 PolarHBondContact O-N 3.43Å; L257-K260 PolarHBondContact O-N 3.49Å; L257-N261 VanDerWaalsContact O-CB 3.28Å; L257-N261 WeakPolarHBondContact O-CB 3.36Å; L257-N261 PolarHBondContact O-N 3.31Å; L257-C528 HydrophobicContact CD2-CB 4.18Å
258	S	82	Confident	79	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.014	23%	0.233	C	C	.	.	H	α-helix	trans	-65.3	-41.6	178.6	-59.2	0	0	0	0	111.7	C254 E255 R262	C254-S258 VanDerWaalsContact O-CB 3.22Å; C254-S258 WeakPolarHBondContact O-CB 3.32Å; C254-S258 PolarHBondContact O-N 3.01Å; C254-S258 PolarHBondContact O-OG 2.92Å; E255-S258 PolarHBondContact O-N 3.41Å; S258-R262 VanDerWaalsContact O-CB 3.23Å; S258-R262 WeakPolarHBondContact O-CB 3.25Å; S258-R262 PolarHBondContact O-N 2.93Å
259	L	77.5	Confident	78.9	Confident	29 Å²	29	45 Å²	45	15%	0.152	22%	0.216	C	C	.	.	H	α-helix	trans	-65.3	-43.8	175.2	-71.1	170.2	0	0	0	112	V196 E255 L256 R263 E492	V196-L259 HydrophobicContact CG1-CD2 4.5Å; E255-L259 HydrophobicContact CG-CD1 4.01Å; E255-L259 WeakPolarHBondContact O-CB 3.32Å; E255-L259 WeakPolarHBondContact O-CG 3.32Å; E255-L259 PolarHBondContact O-N 3.45Å; L256-L259 PolarHBondContact O-N 3.41Å; L259-R263 WeakPolarHBondContact O-CG 3.29Å; L259-R263 PolarHBondContact O-N 3.49Å; L259-R263 VanDerWaalsContact O-N 3.13Å; L259-E492 WeakPolarHBondContact CD2-OE1 3.04Å
260	K	77.1	Confident	78.6	Confident	51 Å²	51	34 Å²	34	22%	0.222	18%	0.177	C	C	.	.	H	α-helix	trans	-61.9	-53.1	177.2	-179.3	166.1	177.5	159.6	0	111.2	L256 L257 R262 R263 E264 N304 E345	L256-K260 WeakPolarHBondContact O-CB 3.21Å; L256-K260 PolarHBondContact O-N 3Å; L257-K260 PolarHBondContact O-N 3.49Å; K260-R262 VanDerWaalsContact C-N 3.34Å; K260-R262 PolarHBondContact O-N 2.95Å; K260-R263 PolarHBondContact O-N 3.32Å; K260-R263 VanDerWaalsContact O-N 3.11Å; K260-E264 WeakPolarHBondContact CE-OE1 3.39Å; K260-E264 PolarHBondContact O-N 3.38Å; K260-N304 WeakPolarHBondContact CE-OD1 3.46Å; K260-N304 PolarHBondContact NZ-OD1 3.49Å; K260-E345 IonicContact NZ-OE1 2.68Å; K260-E345 PolarHBondContact NZ-OE1 3.15Å; K260-E345 IonicContact NZ-OE2 2.6Å; K260-E345 PolarHBondContact NZ-OE2 2.86Å
261	N	79.4	Confident	78.2	Confident	8 Å²	8	31 Å²	31	4%	0.043	16%	0.161	C	C	.	.	H	α-helix	trans	-58	-45.1	177.9	-179	-18.4	0	0	0	111.4	R238 M246 L257 R263 E264 V265	R238-N261 PolarHBondContact NH1-OD1 3Å; M246-N261 HydrophobicContact CE-CB 4.03Å; M246-N261 WeakPolarHBondContact CE-ND2 3.14Å; M246-N261 HydrophobicContact SD-CB 4.4Å; L257-N261 VanDerWaalsContact O-CB 3.28Å; L257-N261 WeakPolarHBondContact O-CB 3.36Å; L257-N261 PolarHBondContact O-N 3.31Å; N261-R263 VanDerWaalsContact C-N 3.31Å; N261-R263 PolarHBondContact O-N 3.44Å; N261-E264 PolarHBondContact O-N 2.91Å; N261-V265 WeakPolarHBondContact O-CB 3.48Å; N261-V265 VanDerWaalsContact O-CG2 3.31Å; N261-V265 WeakPolarHBondContact O-CG2 3.28Å; N261-V265 PolarHBondContact O-N 2.91Å; N261-V265 VanDerWaalsContact OD1-CG2 3.29Å; N261-V265 WeakPolarHBondContact OD1-CG2 3.39Å
262	R	83.7	Confident	77.3	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-54.5	-45.4	175.3	176.2	-173	62.1	133.2	-2	112.3	I232 G236 R238 S258 K260 F266 E492	I232-R262 HydrophobicContact CD1-CG 4.24Å; I232-R262 HydrophobicContact CG2-CG 4.3Å; G236-R262 WeakPolarHBondContact O-CD 3.5Å; G236-R262 PolarHBondContact O-NH1 2.87Å; R238-R262 HydrophobicContact CB-CG 4.08Å; S258-R262 VanDerWaalsContact O-CB 3.23Å; S258-R262 WeakPolarHBondContact O-CB 3.25Å; S258-R262 PolarHBondContact O-N 2.93Å; K260-R262 VanDerWaalsContact C-N 3.34Å; K260-R262 PolarHBondContact O-N 2.95Å; R262-F266 VanDerWaalsContact O-CB 3.26Å; R262-F266 WeakPolarHBondContact O-CB 3.47Å; R262-F266 PolarHBondContact O-N 3.29Å; R262-E492 IonicContact CZ-OE1 3.65Å; R262-E492 IonicContact NH1-OE1 3.62Å; R262-E492 IonicContact NH2-OE1 3.11Å; R262-E492 PolarHBondContact NH2-OE1 2.85Å; R262-E492 IonicContact NH2-OE2 3.66Å; R262-E492 PolarHBondContact NH2-OE2 2.86Å
263	R	78.7	Confident	76.8	Confident	21 Å²	21	30.8 Å²	30.8	8%	0.079	17%	0.165	C	C	.	.	H	α-helix	trans	-68.8	-45.5	-178.7	-74.4	178	178.8	165.6	3.4	112	L259 K260 N261 F266 A267 S301 E492 L494	L259-R263 WeakPolarHBondContact O-CG 3.29Å; L259-R263 PolarHBondContact O-N 3.49Å; L259-R263 VanDerWaalsContact O-N 3.13Å; K260-R263 PolarHBondContact O-N 3.32Å; K260-R263 VanDerWaalsContact O-N 3.11Å; N261-R263 VanDerWaalsContact C-N 3.31Å; N261-R263 PolarHBondContact O-N 3.44Å; R263-F266 PolarHBondContact O-N 3.3Å; R263-A267 WeakPolarHBondContact O-CB 3.33Å; R263-A267 PolarHBondContact O-N 3.02Å; R263-S301 PolarHBondContact NH1-OG 2.86Å; R263-E492 PolarHBondContact NH2-O 3Å; R263-E492 IonicContact NH2-OE2 2.79Å; R263-L494 PolarHBondContact NH2-O 3.16Å
264	E	75.8	Confident	76.6	Confident	30 Å²	30	29.3 Å²	29.3	14%	0.14	16%	0.162	C	C	.	.	H	α-helix	trans	-57.9	-49.7	177.5	-76.2	173.3	-178.7	0	0	111.1	K260 N261 A267 S268 N304 P527	K260-E264 WeakPolarHBondContact CE-OE1 3.39Å; K260-E264 PolarHBondContact O-N 3.38Å; N261-E264 PolarHBondContact O-N 2.91Å; E264-A267 PolarHBondContact O-N 2.95Å; E264-S268 WeakPolarHBondContact O-CB 3.42Å; E264-S268 PolarHBondContact O-N 3.33Å; E264-S268 PolarHBondContact O-OG 3Å; E264-N304 HydrophobicContact CG-CB 4.31Å; E264-N304 WeakPolarHBondContact CG-O 3.46Å; E264-P527 WeakPolarHBondContact OE2-CG 3.43Å
265	V	77.2	Confident	76.5	Confident	10 Å²	10	29.7 Å²	29.7	6%	0.061	16%	0.163	C	C	.	.	H	α-helix	trans	-61.4	-48.7	177.2	171.2	0	0	0	0	111	F230 I232 N261 A267 S268 V269 L536	F230-V265 HydrophobicContact CD2-CG1 4.42Å; F230-V265 HydrophobicContact CE1-CG1 4.11Å; F230-V265 HydrophobicContact CE2-CG1 3.39Å; F230-V265 HydrophobicContact CZ-CG1 3.19Å; I232-V265 HydrophobicContact CD1-CB 4.5Å; I232-V265 HydrophobicContact CD1-CG1 4.08Å; N261-V265 WeakPolarHBondContact O-CB 3.48Å; N261-V265 VanDerWaalsContact O-CG2 3.31Å; N261-V265 WeakPolarHBondContact O-CG2 3.28Å; N261-V265 PolarHBondContact O-N 2.91Å; N261-V265 VanDerWaalsContact OD1-CG2 3.29Å; N261-V265 WeakPolarHBondContact OD1-CG2 3.39Å; V265-A267 PolarHBondContact O-N 3.48Å; V265-S268 PolarHBondContact O-N 3.14Å; V265-S268 PolarHBondContact O-OG 3.27Å; V265-V269 WeakPolarHBondContact O-CG2 3.42Å; V265-V269 PolarHBondContact O-N 3.34Å; V265-L536 HydrophobicContact CG1-CD2 4.3Å
266	F	77.6	Confident	76.8	Confident	5 Å²	5	28.7 Å²	28.7	2%	0.022	16%	0.159	C	C	.	.	H	α-helix	trans	-60.6	-45.9	-179.9	-174.9	-77.3	0	0	0	112.1	I232 R262 R263 V269 A270 F271 V496 T500 L550	I232-F266 HydrophobicContact CB-CD2 4.07Å; I232-F266 HydrophobicContact CD1-CB 4.1Å; I232-F266 HydrophobicContact CD1-CD2 4.47Å; I232-F266 HydrophobicContact CG2-CD2 3.71Å; I232-F266 HydrophobicContact CG2-CE2 4.38Å; R262-F266 VanDerWaalsContact O-CB 3.26Å; R262-F266 WeakPolarHBondContact O-CB 3.47Å; R262-F266 PolarHBondContact O-N 3.29Å; R263-F266 PolarHBondContact O-N 3.3Å; F266-V269 PolarHBondContact O-N 2.96Å; F266-A270 HydrophobicContact CD1-CB 4.08Å; F266-A270 HydrophobicContact CE1-CB 3.73Å; F266-A270 HydrophobicContact CZ-CB 4.37Å; F266-A270 VanDerWaalsContact O-CB 3.24Å; F266-A270 WeakPolarHBondContact O-CB 3.35Å; F266-A270 PolarHBondContact O-N 3Å; F266-F271 HydrophobicContact CE1-CZ 4.41Å; F266-V496 HydrophobicContact CD1-CG1 3.73Å; F266-V496 HydrophobicContact CD2-CG1 3.7Å; F266-V496 HydrophobicContact CE1-CG1 3.61Å; F266-V496 HydrophobicContact CE2-CG1 3.57Å; F266-V496 HydrophobicContact CG-CG1 3.81Å; F266-V496 HydrophobicContact CZ-CG1 3.53Å; F266-T500 HydrophobicContact CE1-CG2 3.31Å; F266-T500 HydrophobicContact CZ-CG2 3.38Å; F266-L550 HydrophobicContact CB-CD2 4.08Å; F266-L550 HydrophobicContact CD2-CD2 3.18Å; F266-L550 HydrophobicContact CD2-CG 4.19Å; F266-L550 HydrophobicContact CE2-CD2 3.59Å; F266-L550 HydrophobicContact CE2-CG 4.47Å; F266-L550 HydrophobicContact CG-CD2 3.7Å; F266-L550 HydrophobicContact CZ-CD2 4.39Å
267	A	74.4	Confident	77.4	Confident	3 Å²	3	23 Å²	23	3%	0.025	13%	0.129	C	C	.	.	H	α-helix	trans	-65.9	-43.4	-177.8	0	0	0	0	0	112.3	R263 E264 V265 V269 A270 F271 C305	R263-A267 WeakPolarHBondContact O-CB 3.33Å; R263-A267 PolarHBondContact O-N 3.02Å; E264-A267 PolarHBondContact O-N 2.95Å; V265-A267 PolarHBondContact O-N 3.48Å; A267-V269 PolarHBondContact O-N 3.18Å; A267-A270 PolarHBondContact O-N 3.37Å; A267-F271 VanDerWaalsContact CA-CD2 3.5Å; A267-F271 HydrophobicContact CB-CD2 3.62Å; A267-F271 HydrophobicContact CB-CE2 3.77Å; A267-F271 WeakPolarHBondContact O-CB 3.36Å; A267-F271 WeakPolarHBondContact O-CD2 3.42Å; A267-F271 PolarHBondContact O-N 3.1Å; A267-C305 HydrophobicContact CB-CB 3.71Å; A267-C305 WeakPolarHBondContact CB-O 3.05Å
268	S	70.7	Confident	78	Confident	37 Å²	37	21.2 Å²	21.2	26%	0.259	12%	0.12	S	C	.	.	H	α-helix	trans	-59.5	-31.2	178	68	0	0	0	0	113.2	E264 V265	E264-S268 WeakPolarHBondContact O-CB 3.42Å; E264-S268 PolarHBondContact O-N 3.33Å; E264-S268 PolarHBondContact O-OG 3Å; V265-S268 PolarHBondContact O-N 3.14Å; V265-S268 PolarHBondContact O-OG 3.27Å
269	V	73.7	Confident	78.6	Confident	6 Å²	6	21.1 Å²	21.1	4%	0.036	12%	0.119	C	C	.	.	H	α-helix	trans	-87.1	-43.1	179.1	177.9	0	0	0	0	111.9	V265 F266 A267 L536 S538 L550	V265-V269 WeakPolarHBondContact O-CG2 3.42Å; V265-V269 PolarHBondContact O-N 3.34Å; F266-V269 PolarHBondContact O-N 2.96Å; A267-V269 PolarHBondContact O-N 3.18Å; V269-L536 HydrophobicContact CG2-CD2 3.55Å; V269-S538 WeakPolarHBondContact CG1-OG 3.31Å; V269-S538 VanDerWaalsContact CG2-OG 3.25Å; V269-S538 WeakPolarHBondContact CG2-OG 3.47Å; V269-L550 HydrophobicContact CB-CD2 4.32Å; V269-L550 HydrophobicContact CG1-CB 4.44Å; V269-L550 HydrophobicContact CG1-CD2 4.43Å
270	A	72.4	Confident	79.4	Confident	11 Å²	11	19.7 Å²	19.7	9%	0.091	11%	0.112	C	C	.	.	H	α-helix	trans	-78.9	-28.6	-173.7	0	0	0	0	0	113.5	F266 A267	F266-A270 HydrophobicContact CD1-CB 4.08Å; F266-A270 HydrophobicContact CE1-CB 3.73Å; F266-A270 HydrophobicContact CZ-CB 4.37Å; F266-A270 VanDerWaalsContact O-CB 3.24Å; F266-A270 WeakPolarHBondContact O-CB 3.35Å; F266-A270 PolarHBondContact O-N 3Å; A267-A270 PolarHBondContact O-N 3.37Å
271	F	73.8	Confident	80.2	Confident	10 Å²	10	17.3 Å²	17.3	4%	0.044	10%	0.101	C	C	.	.			trans	-116.8	60.9	-169.4	-48	-42	0	0	0	113	F266 A267 T273 K275 L499 F503	F266-F271 HydrophobicContact CE1-CZ 4.41Å; A267-F271 VanDerWaalsContact CA-CD2 3.5Å; A267-F271 HydrophobicContact CB-CD2 3.62Å; A267-F271 HydrophobicContact CB-CE2 3.77Å; A267-F271 WeakPolarHBondContact O-CB 3.36Å; A267-F271 WeakPolarHBondContact O-CD2 3.42Å; A267-F271 PolarHBondContact O-N 3.1Å; F271-T273 PolarHBondContact O-N 3.28Å; F271-T273 VanDerWaalsContact O-N 3.13Å; F271-K275 PolarHBondContact O-NZ 3.03Å; F271-K275 VanDerWaalsContact O-NZ 3.12Å; F271-L499 HydrophobicContact CZ-CB 4.31Å; F271-L499 WeakPolarHBondContact CZ-O 3.3Å; F271-F503 HydrophobicContact CD1-CB 3.48Å; F271-F503 VanDerWaalsContact CD1-CB 3.48Å; F271-F503 HydrophobicContact CD1-CG 4.42Å; F271-F503 HydrophobicContact CD2-CB 4.12Å; F271-F503 AromaticContact CD2-CD2 3.78Å; F271-F503 HydrophobicContact CD2-CD2 3.78Å; F271-F503 HydrophobicContact CD2-CG 4.21Å; F271-F503 HydrophobicContact CE1-CB 3.6Å; F271-F503 HydrophobicContact CE1-CD2 4.42Å; F271-F503 HydrophobicContact CE1-CG 4.5Å; F271-F503 HydrophobicContact CE2-CB 4.22Å; F271-F503 AromaticContact CE2-CD2 3.57Å; F271-F503 HydrophobicContact CE2-CD2 3.57Å; F271-F503 HydrophobicContact CE2-CE2 4.39Å; F271-F503 HydrophobicContact CE2-CG 4.3Å; F271-F503 HydrophobicContact CG-CB 3.79Å; F271-F503 HydrophobicContact CG-CD2 4.32Å; F271-F503 HydrophobicContact CG-CG 4.3Å; F271-F503 HydrophobicContact CZ-CB 3.98Å; F271-F503 AromaticContact CZ-CD2 3.92Å; F271-F503 HydrophobicContact CZ-CD2 3.92Å; F271-F503 HydrophobicContact CZ-CG 4.45Å
272	D	65	Low	80.7	Confident	95 Å²	95	17.5 Å²	17.5	51%	0.508	10%	0.102	S	C	.	.			trans	-77.1	11.5	-171.4	-167.2	39.2	0	0	0	116.1	K520	D272-K520 WeakPolarHBondContact OD2-CE 3.29Å; D272-K520 IonicContact OD2-NZ 3.44Å; D272-K520 PolarHBondContact OD2-NZ 3.19Å
273	T	71	Confident	81	Confident	72 Å²	72	18.1 Å²	18.1	44%	0.442	11%	0.105	S	C	.	.	S	Bend	trans	-108.9	135.6	175.6	56.3	0	0	0	0	109.2	F271 K275	F271-T273 PolarHBondContact O-N 3.28Å; F271-T273 VanDerWaalsContact O-N 3.13Å; T273-K275 WeakPolarHBondContact O-CG 3.48Å; T273-K275 PolarHBondContact O-N 2.87Å; T273-K275 PolarHBondContact O-NZ 3.32Å
274	A	75.7	Confident	81.1	Confident	33 Å²	33	17.1 Å²	17.1	27%	0.273	10%	0.101	S	C	.	.			trans	-58.7	130.6	173.4	0	0	0	0	0	110.7	I309	A274-I309 WeakPolarHBondContact CB-O 3.47Å
275	K	82.3	Confident	81.1	Confident	7 Å²	7	18.9 Å²	18.9	3%	0.03	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	143.8	-178.5	-65.2	163.5	-62.3	-59.6	0	108.9	F271 T273 V277 D310 E311 I384 F503	F271-K275 PolarHBondContact O-NZ 3.03Å; F271-K275 VanDerWaalsContact O-NZ 3.12Å; T273-K275 WeakPolarHBondContact O-CG 3.48Å; T273-K275 PolarHBondContact O-N 2.87Å; T273-K275 PolarHBondContact O-NZ 3.32Å; K275-V277 HydrophobicContact CB-CG2 3.8Å; K275-D310 WeakPolarHBondContact CB-OD1 3.4Å; K275-D310 WeakPolarHBondContact CE-OD1 3.43Å; K275-D310 WeakPolarHBondContact CE-OD2 3.44Å; K275-D310 PolarHBondContact N-OD1 2.87Å; K275-D310 VanDerWaalsContact NZ-CG 3.28Å; K275-D310 IonicContact NZ-OD1 3.78Å; K275-D310 PolarHBondContact NZ-OD1 3.32Å; K275-D310 IonicContact NZ-OD2 2.84Å; K275-D310 PolarHBondContact NZ-OD2 3Å; K275-D310 CarbonylContact O-C 3.52Å; K275-D310 WeakPolarHBondContact O-CA 3.22Å; K275-E311 PolarHBondContact O-N 3.06Å; K275-I384 HydrophobicContact CB-CD1 4.49Å; K275-I384 HydrophobicContact CD-CD1 4.43Å; K275-I384 HydrophobicContact CG-CD1 4.3Å; K275-F503 HydrophobicContact CD-CD1 3.56Å; K275-F503 HydrophobicContact CD-CE1 3.94Å; K275-F503 HydrophobicContact CD-CG 4.31Å
276	Q	87.3	Confident	80.8	Confident	15 Å²	15	19.7 Å²	19.7	7%	0.07	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	108.4	170.8	-166.4	-167.3	20.4	0	0	107.8	E311 T333 L371 L377 K382 P383 I384	Q276-E311 HydrophobicContact CG-CB 4.17Å; Q276-T333 HydrophobicContact CG-CG2 3.98Å; Q276-T333 PolarHBondContact NE2-OG1 2.75Å; Q276-L371 HydrophobicContact CB-CD2 4.2Å; Q276-L371 HydrophobicContact CG-CD2 3.63Å; Q276-L371 PolarHBondContact NE2-O 2.83Å; Q276-L377 HydrophobicContact CB-CD1 4.48Å; Q276-K382 PolarHBondContact N-O 2.92Å; Q276-P383 CarbonylContact O-C 3.55Å; Q276-P383 WeakPolarHBondContact O-CA 2.95Å; Q276-I384 PolarHBondContact O-N 3.17Å
277	V	90.8	Very high	80.9	Confident	0 Å²	0	20 Å²	20	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.7	-165.3	-176.3	0	0	0	0	111.2	K275 I279 L306 E311 V312 F313 I384 L386	K275-V277 HydrophobicContact CB-CG2 3.8Å; V277-I279 HydrophobicContact CG1-CG1 4.06Å; V277-L306 HydrophobicContact CB-CD1 4.16Å; V277-L306 HydrophobicContact CB-CD2 4.37Å; V277-L306 HydrophobicContact CG1-CD1 4.41Å; V277-L306 HydrophobicContact CG2-CD1 4.46Å; V277-L306 HydrophobicContact CG2-CD2 3.8Å; V277-E311 PolarHBondContact N-O 2.87Å; V277-V312 CarbonylContact O-C 3.5Å; V277-V312 VanDerWaalsContact O-CA 3.22Å; V277-V312 WeakPolarHBondContact O-CA 3.43Å; V277-F313 PolarHBondContact O-N 2.94Å; V277-I384 WeakPolarHBondContact CA-O 3.4Å; V277-I384 HydrophobicContact CG2-CB 4.45Å; V277-L386 HydrophobicContact CG1-CD1 3.51Å; V277-L386 HydrophobicContact CG1-CG 3.89Å
278	V	92.8	Very high	81.3	Confident	0 Å²	0	22 Å²	22	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	120	168.7	176.5	0	0	0	0	109.1	V280 F313 F315 T333 A367 V370 L371 I384 L386	V278-V280 HydrophobicContact CG1-CG2 4.16Å; V278-F313 CarbonylContact C-O 3.52Å; V278-F313 WeakPolarHBondContact CA-O 3.48Å; V278-F313 HydrophobicContact CG2-CB 4.32Å; V278-F315 HydrophobicContact CG1-CD1 4.15Å; V278-F315 HydrophobicContact CG1-CE1 3.54Å; V278-T333 HydrophobicContact CG2-CG2 3.94Å; V278-A367 HydrophobicContact CB-CB 4.49Å; V278-A367 HydrophobicContact CG1-CB 3.8Å; V278-V370 HydrophobicContact CG2-CB 4.44Å; V278-V370 HydrophobicContact CG2-CG1 3.93Å; V278-L371 HydrophobicContact CG2-CD1 4.45Å; V278-L371 HydrophobicContact CG2-CD2 3.67Å; V278-L371 HydrophobicContact CG2-CG 3.69Å; V278-I384 PolarHBondContact N-O 2.83Å; V278-L386 PolarHBondContact O-N 3.31Å
279	I	94.8	Very high	82	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	119.2	177.6	-51.6	179.5	0	0	0	108.8	V277 V281 A299 L302 L303 V312 F313 V314 F315 L386 I388	V277-I279 HydrophobicContact CG1-CG1 4.06Å; I279-V281 HydrophobicContact CG2-CG2 4.35Å; I279-A299 HydrophobicContact CG2-CB 4.14Å; I279-L302 HydrophobicContact CD1-CB 3.98Å; I279-L303 HydrophobicContact CD1-CB 4.44Å; I279-V312 HydrophobicContact CD1-CG2 4.49Å; I279-F313 PolarHBondContact N-O 3.37Å; I279-V314 HydrophobicContact CB-CG1 4.34Å; I279-V314 HydrophobicContact CB-CG2 4.1Å; I279-V314 HydrophobicContact CD1-CG2 4.17Å; I279-V314 HydrophobicContact CG1-CG2 4.36Å; I279-V314 WeakPolarHBondContact O-CA 3.49Å; I279-F315 PolarHBondContact O-N 3.27Å; I279-F315 VanDerWaalsContact O-N 3.12Å; I279-L386 WeakPolarHBondContact CA-O 3.36Å; I279-L386 HydrophobicContact CG1-CB 4.38Å; I279-L386 HydrophobicContact CG1-CD1 4.32Å; I279-I388 HydrophobicContact CG2-CD1 4Å
280	V	93.5	Very high	82.4	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	120	177.6	-172.6	0	0	0	0	108.9	V278 F315 A317 A363 A367 V385 L386 Y387 I388	V278-V280 HydrophobicContact CG1-CG2 4.16Å; V280-F315 WeakPolarHBondContact CA-O 3.34Å; V280-F315 HydrophobicContact CB-CE2 4.48Å; V280-F315 HydrophobicContact CB-CZ 4.35Å; V280-F315 HydrophobicContact CG1-CD2 4.41Å; V280-F315 HydrophobicContact CG1-CE2 3.79Å; V280-F315 HydrophobicContact CG1-CZ 4.08Å; V280-F315 HydrophobicContact CG2-CE1 3.78Å; V280-F315 HydrophobicContact CG2-CE2 4.09Å; V280-F315 HydrophobicContact CG2-CZ 3.5Å; V280-F315 VanDerWaalsContact CG2-CZ 3.5Å; V280-A317 HydrophobicContact CG1-CB 4.14Å; V280-A363 HydrophobicContact CG1-CB 4.25Å; V280-A367 HydrophobicContact CG2-CB 4Å; V280-V385 HydrophobicContact CG2-CG1 4.26Å; V280-L386 PolarHBondContact N-O 2.92Å; V280-Y387 HydrophobicContact CB-CD2 3.9Å; V280-Y387 HydrophobicContact CB-CE2 4.18Å; V280-Y387 HydrophobicContact CB-CG 4.18Å; V280-Y387 HydrophobicContact CG1-CD2 3.94Å; V280-Y387 HydrophobicContact CG1-CE1 4.44Å; V280-Y387 HydrophobicContact CG1-CE2 3.68Å; V280-Y387 HydrophobicContact CG1-CG 4.44Å; V280-Y387 HydrophobicContact CG2-CD2 4.27Å; V280-I388 PolarHBondContact O-N 2.89Å
281	V	93.4	Very high	83	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	114.9	177.7	-174.7	0	0	0	0	109.8	I279 Q283 L292 A295 A299 F315 A316 A317 L348 L351 I388	I279-V281 HydrophobicContact CG2-CG2 4.35Å; V281-Q283 PolarHBondContact O-N 2.91Å; V281-L292 HydrophobicContact CG1-CD1 4.28Å; V281-A295 HydrophobicContact CG1-CB 4.06Å; V281-A299 HydrophobicContact CG2-CB 3.98Å; V281-F315 PolarHBondContact N-O 3.17Å; V281-A316 HydrophobicContact CB-CB 4.38Å; V281-A316 CarbonylContact O-C 3.55Å; V281-A316 WeakPolarHBondContact O-CA 3.09Å; V281-A317 PolarHBondContact O-N 2.92Å; V281-L348 HydrophobicContact CG2-CD2 3.82Å; V281-L351 HydrophobicContact CB-CD1 4.19Å; V281-L351 HydrophobicContact CG1-CD1 4.07Å; V281-I388 HydrophobicContact CG2-CD1 4.36Å
282	Q	89.5	Confident	83.8	Confident	12 Å²	12	30.4 Å²	30.4	6%	0.056	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	129.4	170.9	-177.8	174.6	-3.2	0	0	110.2	M287 T358 Y387 I388 S389	Q282-M287 HydrophobicContact CB-CG 4.48Å; Q282-M287 HydrophobicContact CG-CG 4.03Å; Q282-T358 HydrophobicContact CG-CG2 4.17Å; Q282-T358 PolarHBondContact NE2-OG1 3.28Å; Q282-Y387 HydrophobicContact CB-CE1 4.39Å; Q282-I388 VanDerWaalsContact CB-O 3.29Å; Q282-I388 WeakPolarHBondContact CB-O 3.2Å; Q282-I388 PolarHBondContact N-O 3.17Å; Q282-S389 VanDerWaalsContact OE1-CB 3.25Å
283	Q	89.9	Confident	84.9	Confident	13 Å²	13	27.7 Å²	27.7	6%	0.061	17%	0.167	C	C	.	.			trans	-124.7	-8.1	173.1	72	-179.2	9.1	0	0	113.4	V281 L292 A316 A317 T352 D354	V281-Q283 PolarHBondContact O-N 2.91Å; Q283-L292 HydrophobicContact CB-CD1 4.41Å; Q283-A316 HydrophobicContact CG-CB 4.46Å; Q283-A317 PolarHBondContact N-O 2.91Å; Q283-T352 PolarHBondContact OE1-O 2.94Å; Q283-D354 HydrophobicContact CG-CB 4.23Å; Q283-D354 PolarHBondContact O-N 2.71Å
284	G	82.5	Confident	85.7	Confident	0 Å²	0	25 Å²	25	0%	0	15%	0.15	C	C	.	.	S	Bend	trans	-69.8	-175.1	-176.2	0	0	0	0	0	115.4	G286 M287 A317 D354 A356 T358	G284-G286 PolarHBondContact O-N 2.93Å; G284-M287 PolarHBondContact O-N 2.9Å; G284-M287 VanDerWaalsContact O-N 3.09Å; G284-A317 PolarHBondContact N-O 2.77Å; G284-D354 CarbonylContact C-O 3.53Å; G284-A356 CarbonylContact C-O 3.56Å; G284-A356 WeakPolarHBondContact CA-O 3.41Å; G284-T358 WeakPolarHBondContact CA-OG1 3.41Å
285	L	75.6	Confident	86.4	Confident	67 Å²	67	23.4 Å²	23.4	35%	0.351	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	123.2	-172.2	-174.1	69.8	0	0	0	111.4	D354 S355 A356 F357 Q395	L285-D354 PolarHBondContact N-O 3.19Å; L285-D354 VanDerWaalsContact N-O 3.11Å; L285-S355 WeakPolarHBondContact CB-O 3.16Å; L285-S355 WeakPolarHBondContact CD1-O 3.37Å; L285-A356 PolarHBondContact N-O 2.98Å; L285-F357 HydrophobicContact CD2-CD1 4.27Å; L285-F357 HydrophobicContact CD2-CD2 3.76Å; L285-F357 HydrophobicContact CD2-CE1 3.86Å; L285-F357 HydrophobicContact CD2-CE2 3.35Å; L285-F357 HydrophobicContact CD2-CG 4.19Å; L285-F357 HydrophobicContact CD2-CZ 3.37Å; L285-Q395 PolarHBondContact O-NE2 2.79Å
286	G	69.7	Low	86.9	Confident	27 Å²	27	25 Å²	25	28%	0.278	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	109.4	-17.7	-177.3	0	0	0	0	0	113.3	G284 S288 Q291 R390	G284-G286 PolarHBondContact O-N 2.93Å; G286-S288 PolarHBondContact O-N 3.31Å; G286-Q291 PolarHBondContact O-OE1 3.04Å; G286-R390 WeakPolarHBondContact O-CD 3.25Å; G286-R390 PolarHBondContact O-NH1 3.46Å
287	M	81.3	Confident	86.9	Confident	12 Å²	12	26.3 Å²	26.3	6%	0.059	15%	0.154	C	C	.	.			trans	-76.1	120.4	168.2	-78.1	-69.6	-78.9	0	0	110.1	Q282 G284 Q291 L292 A295 T353 R390 I424	Q282-M287 HydrophobicContact CB-CG 4.48Å; Q282-M287 HydrophobicContact CG-CG 4.03Å; G284-M287 PolarHBondContact O-N 2.9Å; G284-M287 VanDerWaalsContact O-N 3.09Å; M287-Q291 HydrophobicContact CE-CB 4.03Å; M287-Q291 HydrophobicContact SD-CB 4.01Å; M287-L292 HydrophobicContact CE-CB 4.29Å; M287-L292 HydrophobicContact CE-CD1 4.4Å; M287-A295 HydrophobicContact CE-CB 3.79Å; M287-T353 WeakPolarHBondContact O-CG2 3.35Å; M287-R390 HydrophobicContact SD-CB 3.86Å; M287-I424 HydrophobicContact CE-CD1 4.25Å
288	S	82.1	Confident	86.9	Confident	46 Å²	46	26.3 Å²	26.3	32%	0.322	15%	0.154	S	C	.	.			trans	-77.7	160.4	169.5	74.5	0	0	0	0	111.2	G286 K290 Q291 L292	G286-S288 PolarHBondContact O-N 3.31Å; S288-K290 PolarHBondContact O-N 3.13Å; S288-Q291 CarbonylContact O-C 3.55Å; S288-Q291 PolarHBondContact O-N 3.37Å; S288-Q291 VanDerWaalsContact OG-CG 3.3Å; S288-Q291 WeakPolarHBondContact OG-CG 3.01Å; S288-Q291 PolarHBondContact OG-N 2.83Å; S288-Q291 VanDerWaalsContact OG-N 3.15Å; S288-Q291 PolarHBondContact OG-OE1 2.93Å; S288-L292 PolarHBondContact O-N 3.22Å
289	D	84.3	Confident	86.9	Confident	122 Å²	122	26.3 Å²	26.3	65%	0.652	15%	0.154	S	C	*	.	H	α-helix	trans	-57.3	-38.7	176.1	-68.6	-45.1	0	0	0	112.4	L292 G293 T353	D289-L292 PolarHBondContact O-N 3.31Å; D289-G293 PolarHBondContact O-N 2.85Å; D289-T353 WeakPolarHBondContact OD1-CG2 3.44Å
290	K	83.5	Confident	86.7	Confident	105 Å²	105	28.6 Å²	28.6	46%	0.457	16%	0.164	S	C	.	.	H	α-helix	trans	-62.3	-46.1	174.4	-173.5	-174.2	175	-164.1	0	111.1	S288 G293 V294 D426	S288-K290 PolarHBondContact O-N 3.13Å; K290-G293 PolarHBondContact O-N 3.05Å; K290-V294 WeakPolarHBondContact O-CG2 3.39Å; K290-V294 PolarHBondContact O-N 2.85Å; K290-D426 IonicContact NZ-OD1 4Å; K290-D426 PolarHBondContact NZ-OD1 2.96Å; K290-D426 IonicContact NZ-OD2 3.18Å; K290-D426 PolarHBondContact NZ-OD2 3.48Å
291	Q	84.7	Confident	86.4	Confident	8 Å²	8	28.8 Å²	28.8	4%	0.037	17%	0.165	C	C	.	.	H	α-helix	trans	-66.5	-39.8	178.3	-71.6	173	-44.7	0	0	112.1	G286 M287 S288 G293 V294 A295 R390 I424	G286-Q291 PolarHBondContact O-OE1 3.04Å; M287-Q291 HydrophobicContact CE-CB 4.03Å; M287-Q291 HydrophobicContact SD-CB 4.01Å; S288-Q291 CarbonylContact O-C 3.55Å; S288-Q291 PolarHBondContact O-N 3.37Å; S288-Q291 VanDerWaalsContact OG-CG 3.3Å; S288-Q291 WeakPolarHBondContact OG-CG 3.01Å; S288-Q291 PolarHBondContact OG-N 2.83Å; S288-Q291 VanDerWaalsContact OG-N 3.15Å; S288-Q291 PolarHBondContact OG-OE1 2.93Å; Q291-G293 VanDerWaalsContact C-N 3.33Å; Q291-V294 PolarHBondContact O-N 2.93Å; Q291-A295 WeakPolarHBondContact O-CB 3.48Å; Q291-A295 PolarHBondContact O-N 2.96Å; Q291-R390 VanDerWaalsContact OE1-CD 3.32Å; Q291-I424 HydrophobicContact CB-CG2 4.15Å; Q291-I424 HydrophobicContact CG-CG2 4.07Å; Q291-I424 WeakPolarHBondContact O-CD1 3.4Å
292	L	89.8	Confident	86.2	Confident	5 Å²	5	28.8 Å²	28.8	3%	0.026	17%	0.165	C	C	.	.	H	α-helix	trans	-65.5	-38.4	174.6	-177	63.6	0	0	0	111.1	V281 Q283 M287 S288 D289 V294 A295 K296 T353	V281-L292 HydrophobicContact CG1-CD1 4.28Å; Q283-L292 HydrophobicContact CB-CD1 4.41Å; M287-L292 HydrophobicContact CE-CB 4.29Å; M287-L292 HydrophobicContact CE-CD1 4.4Å; S288-L292 PolarHBondContact O-N 3.22Å; D289-L292 PolarHBondContact O-N 3.31Å; L292-V294 PolarHBondContact O-N 2.82Å; L292-A295 HydrophobicContact CD1-CB 4.46Å; L292-A295 WeakPolarHBondContact O-CB 3.4Å; L292-A295 PolarHBondContact O-N 3.33Å; L292-A295 VanDerWaalsContact O-N 3.15Å; L292-K296 WeakPolarHBondContact O-CG 3.42Å; L292-K296 PolarHBondContact O-N 3.23Å; L292-T353 HydrophobicContact CB-CG2 4.06Å; L292-T353 HydrophobicContact CD2-CG2 3.69Å; L292-T353 VanDerWaalsContact CD2-N 3.29Å
293	G	88.7	Confident	86.1	Confident	38 Å²	38	28.2 Å²	28.2	39%	0.392	16%	0.163	S	C	.	.	H	α-helix	trans	-56.9	-47.3	172.1	0	0	0	0	0	112.2	D289 K290 Q291 K296 C297	D289-G293 PolarHBondContact O-N 2.85Å; K290-G293 PolarHBondContact O-N 3.05Å; Q291-G293 VanDerWaalsContact C-N 3.33Å; G293-K296 PolarHBondContact O-N 3.2Å; G293-C297 WeakPolarHBondContact O-CB 2.99Å; G293-C297 PolarHBondContact O-N 2.92Å
294	V	87.9	Confident	85.8	Confident	14 Å²	14	28.2 Å²	28.2	9%	0.085	16%	0.163	C	C	.	.	H	α-helix	trans	-64.1	-40.4	173.8	176.8	0	0	0	0	111	K290 Q291 L292 K296 C297 V298 I424 V486 A488	K290-V294 WeakPolarHBondContact O-CG2 3.39Å; K290-V294 PolarHBondContact O-N 2.85Å; Q291-V294 PolarHBondContact O-N 2.93Å; L292-V294 PolarHBondContact O-N 2.82Å; V294-K296 PolarHBondContact O-N 2.72Å; V294-C297 WeakPolarHBondContact O-CB 3.3Å; V294-C297 PolarHBondContact O-N 3.09Å; V294-C297 VanDerWaalsContact O-N 3.17Å; V294-V298 HydrophobicContact CG1-CG2 4.19Å; V294-V298 VanDerWaalsContact O-CG2 3.31Å; V294-V298 WeakPolarHBondContact O-CG2 3.47Å; V294-V298 PolarHBondContact O-N 2.86Å; V294-I424 HydrophobicContact CB-CG2 4.19Å; V294-I424 HydrophobicContact CG1-CD1 4.36Å; V294-I424 HydrophobicContact CG1-CG2 4.04Å; V294-V486 HydrophobicContact CG1-CG1 4.34Å; V294-A488 HydrophobicContact CG2-CB 4.07Å
295	A	90.2	Very high	85.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61	-46.4	178.1	0	0	0	0	0	112.4	V281 M287 Q291 L292 C297 V298 A299 I388 I424	V281-A295 HydrophobicContact CG1-CB 4.06Å; M287-A295 HydrophobicContact CE-CB 3.79Å; Q291-A295 WeakPolarHBondContact O-CB 3.48Å; Q291-A295 PolarHBondContact O-N 2.96Å; L292-A295 HydrophobicContact CD1-CB 4.46Å; L292-A295 WeakPolarHBondContact O-CB 3.4Å; L292-A295 PolarHBondContact O-N 3.33Å; L292-A295 VanDerWaalsContact O-N 3.15Å; A295-C297 VanDerWaalsContact C-N 3.3Å; A295-C297 PolarHBondContact O-N 3Å; A295-V298 PolarHBondContact O-N 3.39Å; A295-A299 WeakPolarHBondContact O-CB 3.43Å; A295-A299 PolarHBondContact O-N 3.24Å; A295-I388 HydrophobicContact CB-CG2 3.77Å; A295-I424 VanDerWaalsContact CA-CD1 3.42Å; A295-I424 HydrophobicContact CB-CD1 3.36Å
296	K	92.4	Very high	86.2	Confident	42 Å²	42	25.4 Å²	25.4	18%	0.183	15%	0.149	C	C	.	.	H	α-helix	trans	-57	-47.4	173.1	-71.1	177.8	178.3	-168	0	110.3	L292 G293 V294 V298 A299 K300 L348 D349 L351	L292-K296 WeakPolarHBondContact O-CG 3.42Å; L292-K296 PolarHBondContact O-N 3.23Å; G293-K296 PolarHBondContact O-N 3.2Å; V294-K296 PolarHBondContact O-N 2.72Å; K296-V298 PolarHBondContact O-N 3.41Å; K296-A299 PolarHBondContact O-N 3.12Å; K296-K300 WeakPolarHBondContact O-CB 3.18Å; K296-K300 VanDerWaalsContact O-CG 3.28Å; K296-K300 WeakPolarHBondContact O-CG 3.4Å; K296-K300 PolarHBondContact O-N 3.03Å; K296-L348 VanDerWaalsContact CD-O 3.32Å; K296-L348 WeakPolarHBondContact CD-O 3.38Å; K296-L348 WeakPolarHBondContact CE-O 3.15Å; K296-L348 WeakPolarHBondContact CG-O 3.33Å; K296-D349 PolarHBondContact NZ-O 3.27Å; K296-L351 WeakPolarHBondContact CE-O 3.26Å; K296-L351 PolarHBondContact NZ-O 3.46Å
297	C	88.7	Confident	86.4	Confident	41 Å²	41	25.4 Å²	25.4	28%	0.277	15%	0.145	S	C	.	.	H	α-helix	trans	-62.3	-43.2	179.7	-173.4	0	0	0	0	112.7	G293 V294 A295 K300 S301 C493	G293-C297 WeakPolarHBondContact O-CB 2.99Å; G293-C297 PolarHBondContact O-N 2.92Å; V294-C297 WeakPolarHBondContact O-CB 3.3Å; V294-C297 PolarHBondContact O-N 3.09Å; V294-C297 VanDerWaalsContact O-N 3.17Å; A295-C297 VanDerWaalsContact C-N 3.3Å; A295-C297 PolarHBondContact O-N 3Å; C297-K300 PolarHBondContact O-N 3.47Å; C297-S301 WeakPolarHBondContact O-CB 3.28Å; C297-S301 PolarHBondContact O-N 3.21Å; C297-S301 PolarHBondContact O-OG 2.91Å; C297-C493 HydrophobicContact CB-CB 3.66Å; C297-C493 WeakPolarHBondContact CB-SG 3.35Å; C297-C493 WeakPolarHBondContact SG-CB 3.38Å; C297-C493 CovalentContact SG-SG 2.01Å; C297-C493 PolarHBondContact SG-SG 3.07Å
298	V	90.5	Very high	85.9	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.5	-46.9	174.1	172.3	0	0	0	0	110.8	V294 A295 K296 K300 S301 L302 I388 L422 V486 C493	V294-V298 HydrophobicContact CG1-CG2 4.19Å; V294-V298 VanDerWaalsContact O-CG2 3.31Å; V294-V298 WeakPolarHBondContact O-CG2 3.47Å; V294-V298 PolarHBondContact O-N 2.86Å; A295-V298 PolarHBondContact O-N 3.39Å; K296-V298 PolarHBondContact O-N 3.41Å; V298-K300 PolarHBondContact O-N 3.21Å; V298-S301 WeakPolarHBondContact O-CB 3.13Å; V298-S301 PolarHBondContact O-N 3.1Å; V298-S301 VanDerWaalsContact O-N 3.12Å; V298-L302 HydrophobicContact CG1-CD1 3.9Å; V298-L302 HydrophobicContact CG1-CG 4.38Å; V298-L302 WeakPolarHBondContact O-CG 3.49Å; V298-L302 PolarHBondContact O-N 2.9Å; V298-I388 HydrophobicContact CB-CD1 4.23Å; V298-I388 HydrophobicContact CG1-CD1 3.83Å; V298-I388 HydrophobicContact CG1-CG1 4.32Å; V298-L422 HydrophobicContact CG1-CD2 3.84Å; V298-V486 HydrophobicContact CG2-CG1 3.99Å; V298-C493 HydrophobicContact CG2-CB 4.06Å
299	A	93	Very high	85.4	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.2	-46	178.6	0	0	0	0	0	111.9	I279 V281 A295 K296 S301 L302 L303 L348 I388	I279-A299 HydrophobicContact CG2-CB 4.14Å; V281-A299 HydrophobicContact CG2-CB 3.98Å; A295-A299 WeakPolarHBondContact O-CB 3.43Å; A295-A299 PolarHBondContact O-N 3.24Å; K296-A299 PolarHBondContact O-N 3.12Å; A299-S301 VanDerWaalsContact C-N 3.33Å; A299-S301 PolarHBondContact O-N 3.31Å; A299-L302 PolarHBondContact O-N 3.16Å; A299-L303 VanDerWaalsContact O-CB 3.3Å; A299-L303 WeakPolarHBondContact O-CB 3.43Å; A299-L303 PolarHBondContact O-N 2.97Å; A299-L348 HydrophobicContact CB-CD1 3.69Å; A299-L348 HydrophobicContact CB-CD2 3.69Å; A299-L348 HydrophobicContact CB-CG 4.36Å; A299-I388 HydrophobicContact CB-CD1 3.73Å
300	K	90.5	Very high	85.3	Confident	48 Å²	48	23.5 Å²	23.5	21%	0.209	13%	0.128	C	C	.	.	H	α-helix	trans	-61.5	-41.2	173.9	-69.6	-177.1	176.8	-164.7	0	111.9	K296 C297 V298 L302 L303 N304 E345 L348 D349	K296-K300 WeakPolarHBondContact O-CB 3.18Å; K296-K300 VanDerWaalsContact O-CG 3.28Å; K296-K300 WeakPolarHBondContact O-CG 3.4Å; K296-K300 PolarHBondContact O-N 3.03Å; C297-K300 PolarHBondContact O-N 3.47Å; V298-K300 PolarHBondContact O-N 3.21Å; K300-L302 PolarHBondContact O-N 3.5Å; K300-L303 PolarHBondContact O-N 3.04Å; K300-N304 WeakPolarHBondContact O-CB 3.14Å; K300-N304 VanDerWaalsContact O-CG 3.23Å; K300-N304 PolarHBondContact O-N 2.99Å; K300-N304 PolarHBondContact O-ND2 2.89Å; K300-N304 VanDerWaalsContact O-ND2 3.12Å; K300-E345 HydrophobicContact CG-CG 4.19Å; K300-L348 HydrophobicContact CG-CD1 3.81Å; K300-D349 WeakPolarHBondContact CE-OD1 3.19Å; K300-D349 IonicContact NZ-OD1 3.45Å; K300-D349 PolarHBondContact NZ-OD1 3.45Å; K300-D349 IonicContact NZ-OD2 3.02Å; K300-D349 PolarHBondContact NZ-OD2 2.78Å
301	S	86.2	Confident	85.3	Confident	4 Å²	4	18.7 Å²	18.7	3%	0.028	11%	0.107	C	C	.	.	H	α-helix	trans	-62.3	-42.9	178.2	-58.3	0	0	0	0	112	R263 C297 V298 A299 C305	R263-S301 PolarHBondContact NH1-OG 2.86Å; C297-S301 WeakPolarHBondContact O-CB 3.28Å; C297-S301 PolarHBondContact O-N 3.21Å; C297-S301 PolarHBondContact O-OG 2.91Å; V298-S301 WeakPolarHBondContact O-CB 3.13Å; V298-S301 PolarHBondContact O-N 3.1Å; V298-S301 VanDerWaalsContact O-N 3.12Å; A299-S301 VanDerWaalsContact C-N 3.33Å; A299-S301 PolarHBondContact O-N 3.31Å; S301-C305 PolarHBondContact O-N 3.21Å; S301-C305 PolarHBondContact O-SG 3.19Å
302	L	89.3	Confident	85.5	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.9	-45.4	175.9	-68.9	167.8	0	0	0	111.5	I279 V298 A299 K300 N304 C305 L386 I388 L422 L494 L499 L502 F503	I279-L302 HydrophobicContact CD1-CB 3.98Å; V298-L302 HydrophobicContact CG1-CD1 3.9Å; V298-L302 HydrophobicContact CG1-CG 4.38Å; V298-L302 WeakPolarHBondContact O-CG 3.49Å; V298-L302 PolarHBondContact O-N 2.9Å; A299-L302 PolarHBondContact O-N 3.16Å; K300-L302 PolarHBondContact O-N 3.5Å; L302-N304 VanDerWaalsContact C-N 3.3Å; L302-N304 PolarHBondContact O-N 3.2Å; L302-C305 WeakPolarHBondContact O-CB 3.49Å; L302-C305 PolarHBondContact O-N 3.03Å; L302-L386 HydrophobicContact CB-CD1 4.29Å; L302-L386 HydrophobicContact CD1-CB 4.37Å; L302-L386 HydrophobicContact CD1-CD1 3.85Å; L302-L386 HydrophobicContact CD2-CD1 4Å; L302-L386 HydrophobicContact CG-CD1 4.26Å; L302-I388 HydrophobicContact CD1-CD1 4.25Å; L302-L422 HydrophobicContact CD1-CD1 4.46Å; L302-L422 HydrophobicContact CD1-CD2 4.31Å; L302-L494 HydrophobicContact CD2-CD2 3.64Å; L302-L494 HydrophobicContact CG-CD2 4.09Å; L302-L499 HydrophobicContact CD2-CD2 4.02Å; L302-L502 HydrophobicContact CD2-CD2 3.3Å; L302-F503 HydrophobicContact CD2-CE2 4.48Å; L302-F503 HydrophobicContact CD2-CZ 4.46Å
303	L	88.1	Confident	85.6	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-58.9	-40.5	177.6	-177.9	63.8	0	0	0	112.2	I279 A299 K300 C305 L306 V312 K341 M344 E345 L348	I279-L303 HydrophobicContact CD1-CB 4.44Å; A299-L303 VanDerWaalsContact O-CB 3.3Å; A299-L303 WeakPolarHBondContact O-CB 3.43Å; A299-L303 PolarHBondContact O-N 2.97Å; K300-L303 PolarHBondContact O-N 3.04Å; L303-C305 PolarHBondContact O-N 3.27Å; L303-L306 PolarHBondContact O-N 3.22Å; L303-V312 HydrophobicContact CD1-CG1 4.16Å; L303-V312 HydrophobicContact CD1-CG2 3.9Å; L303-K341 HydrophobicContact CD1-CB 4.42Å; L303-K341 HydrophobicContact CD1-CG 3.9Å; L303-K341 HydrophobicContact CD2-CB 4.33Å; L303-K341 HydrophobicContact CG-CB 4.15Å; L303-K341 HydrophobicContact CG-CG 3.96Å; L303-K341 WeakPolarHBondContact O-CE 3.45Å; L303-M344 HydrophobicContact CD1-CB 4.4Å; L303-M344 HydrophobicContact CD1-SD 3.89Å; L303-M344 HydrophobicContact CD2-CB 3.61Å; L303-E345 HydrophobicContact CD2-CG 3.77Å; L303-L348 HydrophobicContact CD2-CD1 4.49Å
304	N	83.6	Confident	85.8	Confident	13 Å²	13	16.3 Å²	16.3	7%	0.07	9%	0.086	C	C	.	.	H	α-helix	trans	-70.1	-15.8	176.3	-69.5	-28.9	0	0	0	113.3	K260 E264 K300 L302 E345	K260-N304 WeakPolarHBondContact CE-OD1 3.46Å; K260-N304 PolarHBondContact NZ-OD1 3.49Å; E264-N304 HydrophobicContact CG-CB 4.31Å; E264-N304 WeakPolarHBondContact CG-O 3.46Å; K300-N304 WeakPolarHBondContact O-CB 3.14Å; K300-N304 VanDerWaalsContact O-CG 3.23Å; K300-N304 PolarHBondContact O-N 2.99Å; K300-N304 PolarHBondContact O-ND2 2.89Å; K300-N304 VanDerWaalsContact O-ND2 3.12Å; L302-N304 VanDerWaalsContact C-N 3.3Å; L302-N304 PolarHBondContact O-N 3.2Å; N304-E345 PolarHBondContact ND2-OE1 2.94Å; N304-E345 PolarHBondContact OD1-OE1 2.79Å; N304-E345 VanDerWaalsContact OD1-OE1 3.05Å
305	C	83.5	Confident	86	Confident	3 Å²	3	15.6 Å²	15.6	2%	0.02	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-6.4	175.5	-64	0	0	0	0	113.8	A267 S301 L302 L303 L499 F503	A267-C305 HydrophobicContact CB-CB 3.71Å; A267-C305 WeakPolarHBondContact CB-O 3.05Å; S301-C305 PolarHBondContact O-N 3.21Å; S301-C305 PolarHBondContact O-SG 3.19Å; L302-C305 WeakPolarHBondContact O-CB 3.49Å; L302-C305 PolarHBondContact O-N 3.03Å; L303-C305 PolarHBondContact O-N 3.27Å; C305-L499 HydrophobicContact CB-CD2 4.28Å; C305-L499 WeakPolarHBondContact SG-CD1 3.4Å; C305-L499 VanDerWaalsContact SG-CD2 3.56Å; C305-F503 HydrophobicContact CB-CE2 4.08Å
306	L	82.7	Confident	86.1	Confident	5 Å²	5	15.6 Å²	15.6	3%	0.026	8%	0.082	C	C	.	.			trans	-82.5	149.4	175.9	-56.3	-179.8	0	0	0	109.5	V277 L303 D310 V312 A336 K341 F503	V277-L306 HydrophobicContact CB-CD1 4.16Å; V277-L306 HydrophobicContact CB-CD2 4.37Å; V277-L306 HydrophobicContact CG1-CD1 4.41Å; V277-L306 HydrophobicContact CG2-CD1 4.46Å; V277-L306 HydrophobicContact CG2-CD2 3.8Å; L303-L306 PolarHBondContact O-N 3.22Å; L306-D310 HydrophobicContact CB-CB 4.13Å; L306-D310 HydrophobicContact CD2-CB 4.4Å; L306-V312 HydrophobicContact CD1-CB 3.54Å; L306-V312 HydrophobicContact CD1-CG1 4.39Å; L306-V312 HydrophobicContact CD1-CG2 3.44Å; L306-V312 VanDerWaalsContact CD1-CG2 3.44Å; L306-A336 HydrophobicContact CB-CB 3.89Å; L306-K341 WeakPolarHBondContact O-CE 3.45Å; L306-K341 PolarHBondContact O-NZ 3.39Å; L306-F503 HydrophobicContact CD2-CE1 4.49Å; L306-F503 HydrophobicContact CD2-CZ 4.19Å
307	S	74.1	Confident	86	Confident	28 Å²	28	13.6 Å²	13.6	20%	0.196	7%	0.073	C	C	.	.			trans	-111.7	173.2	179	61.2	0	0	0	0	110.6	I309 D310	S307-I309 PolarHBondContact O-N 3.41Å; S307-I309 WeakPolarHBondContact OG-CG1 3.2Å; S307-D310 PolarHBondContact N-OD2 3.17Å; S307-D310 WeakPolarHBondContact O-CB 3.5Å; S307-D310 PolarHBondContact O-N 2.54Å; S307-D310 PolarHBondContact OG-OD2 2.68Å
308	E	69.7	Low	86	Confident	59 Å²	59	11.8 Å²	11.8	28%	0.276	6%	0.061	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-12.3	-180	-59.7	-160.8	146	0	0	113.8	D310 V335	E308-D310 VanDerWaalsContact C-N 3.29Å; E308-V335 WeakPolarHBondContact O-CG1 3.28Å
309	I	72.2	Confident	85.7	Confident	80 Å²	80	15 Å²	15	41%	0.41	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-10.2	168.7	61.1	163.7	0	0	0	112.6	A274 S307	A274-I309 WeakPolarHBondContact CB-O 3.47Å; S307-I309 PolarHBondContact O-N 3.41Å; S307-I309 WeakPolarHBondContact OG-CG1 3.2Å
310	D	81.3	Confident	85.4	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.005	11%	0.107	C	C	.	.	S	Bend	trans	-93.7	149.4	179	-59.4	-48.5	0	0	0	110.9	K275 L306 S307 E308 A336	K275-D310 WeakPolarHBondContact CB-OD1 3.4Å; K275-D310 WeakPolarHBondContact CE-OD1 3.43Å; K275-D310 WeakPolarHBondContact CE-OD2 3.44Å; K275-D310 PolarHBondContact N-OD1 2.87Å; K275-D310 VanDerWaalsContact NZ-CG 3.28Å; K275-D310 IonicContact NZ-OD1 3.78Å; K275-D310 PolarHBondContact NZ-OD1 3.32Å; K275-D310 IonicContact NZ-OD2 2.84Å; K275-D310 PolarHBondContact NZ-OD2 3Å; K275-D310 CarbonylContact O-C 3.52Å; K275-D310 WeakPolarHBondContact O-CA 3.22Å; L306-D310 HydrophobicContact CB-CB 4.13Å; L306-D310 HydrophobicContact CD2-CB 4.4Å; S307-D310 PolarHBondContact N-OD2 3.17Å; S307-D310 WeakPolarHBondContact O-CB 3.5Å; S307-D310 PolarHBondContact O-N 2.54Å; S307-D310 PolarHBondContact OG-OD2 2.68Å; E308-D310 VanDerWaalsContact C-N 3.29Å; D310-A336 PolarHBondContact O-N 3.39Å
311	E	84.7	Confident	85.3	Confident	3 Å²	3	21.7 Å²	21.7	1%	0.014	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	141.7	170.1	-76.4	-172.5	177.9	0	0	110.5	K275 Q276 V277 T333 T334 R375 L377	K275-E311 PolarHBondContact O-N 3.06Å; Q276-E311 HydrophobicContact CG-CB 4.17Å; V277-E311 PolarHBondContact N-O 2.87Å; E311-T333 PolarHBondContact OE2-OG1 2.99Å; E311-T334 CarbonylContact C-O 3.56Å; E311-T334 VanDerWaalsContact CA-O 3.32Å; E311-T334 WeakPolarHBondContact CA-O 3.4Å; E311-R375 WeakPolarHBondContact OE1-CB 3.2Å; E311-R375 WeakPolarHBondContact OE1-CD 3.16Å; E311-R375 WeakPolarHBondContact OE1-CG 3.42Å; E311-L377 HydrophobicContact CB-CD1 4.22Å; E311-L377 VanDerWaalsContact CD-CD1 3.41Å; E311-L377 HydrophobicContact CG-CD1 3.74Å
312	V	89	Confident	85.4	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	146.3	-177.2	66.4	0	0	0	0	112.3	V277 I279 L303 L306 V314 T334 A336 V340 M344	V277-V312 CarbonylContact O-C 3.5Å; V277-V312 VanDerWaalsContact O-CA 3.22Å; V277-V312 WeakPolarHBondContact O-CA 3.43Å; I279-V312 HydrophobicContact CD1-CG2 4.49Å; L303-V312 HydrophobicContact CD1-CG1 4.16Å; L303-V312 HydrophobicContact CD1-CG2 3.9Å; L306-V312 HydrophobicContact CD1-CB 3.54Å; L306-V312 HydrophobicContact CD1-CG1 4.39Å; L306-V312 HydrophobicContact CD1-CG2 3.44Å; L306-V312 VanDerWaalsContact CD1-CG2 3.44Å; V312-V314 HydrophobicContact CG2-CG2 4.08Å; V312-T334 PolarHBondContact N-O 2.71Å; V312-T334 PolarHBondContact O-N 3.1Å; V312-T334 VanDerWaalsContact O-N 3.12Å; V312-A336 HydrophobicContact CB-CB 4.21Å; V312-A336 HydrophobicContact CG1-CB 3.58Å; V312-V340 HydrophobicContact CG1-CG1 4.11Å; V312-M344 HydrophobicContact CG1-CE 3.93Å; V312-M344 HydrophobicContact CG1-SD 3.71Å; V312-M344 HydrophobicContact CG2-SD 4.16Å
313	F	91	Very high	85.2	Confident	1 Å²	1	27.8 Å²	27.8	0%	0.004	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	144.9	161.4	-167.8	-102.8	0	0	0	110	V277 V278 I279 F315 M323 L327 A330 A332 T333 V370	V277-F313 PolarHBondContact O-N 2.94Å; V278-F313 CarbonylContact C-O 3.52Å; V278-F313 WeakPolarHBondContact CA-O 3.48Å; V278-F313 HydrophobicContact CG2-CB 4.32Å; I279-F313 PolarHBondContact N-O 3.37Å; F313-F315 AromaticContact CD1-CD1 3.76Å; F313-F315 HydrophobicContact CD1-CD1 3.76Å; F313-F315 HydrophobicContact CD1-CE1 4.46Å; F313-F315 HydrophobicContact CE1-CB 4.12Å; F313-F315 AromaticContact CE1-CD1 3.75Å; F313-F315 HydrophobicContact CE1-CD1 3.75Å; F313-F315 HydrophobicContact CE1-CG 4.33Å; F313-M323 HydrophobicContact CE1-CE 3.83Å; F313-M323 HydrophobicContact CE1-SD 4.22Å; F313-M323 HydrophobicContact CZ-CE 4.15Å; F313-M323 HydrophobicContact CZ-SD 3.94Å; F313-L327 HydrophobicContact CD2-CD2 4.32Å; F313-L327 HydrophobicContact CE2-CD2 4.06Å; F313-A330 WeakPolarHBondContact CZ-O 3.22Å; F313-A332 WeakPolarHBondContact CD2-O 3.48Å; F313-T333 HydrophobicContact CB-CG2 4.13Å; F313-V370 HydrophobicContact CB-CG1 3.79Å; F313-V370 HydrophobicContact CD1-CG1 3.76Å; F313-V370 HydrophobicContact CD1-CG2 4.26Å; F313-V370 HydrophobicContact CE1-CG1 4.48Å; F313-V370 HydrophobicContact CE1-CG2 4.26Å; F313-V370 HydrophobicContact CG-CG1 3.79Å
314	V	92.2	Very high	84.6	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	128.6	-177	-175.2	0	0	0	0	109.2	I279 V312 P324 M344 F347 L348	I279-V314 HydrophobicContact CB-CG1 4.34Å; I279-V314 HydrophobicContact CB-CG2 4.1Å; I279-V314 HydrophobicContact CD1-CG2 4.17Å; I279-V314 HydrophobicContact CG1-CG2 4.36Å; I279-V314 WeakPolarHBondContact O-CA 3.49Å; V312-V314 HydrophobicContact CG2-CG2 4.08Å; V314-P324 WeakPolarHBondContact O-CD 3.2Å; V314-M344 HydrophobicContact CB-CG 4.31Å; V314-M344 HydrophobicContact CB-SD 4.26Å; V314-M344 HydrophobicContact CG2-CB 4.2Å; V314-M344 HydrophobicContact CG2-CE 4.43Å; V314-M344 HydrophobicContact CG2-CG 4.1Å; V314-M344 HydrophobicContact CG2-SD 3.55Å; V314-M344 VanDerWaalsContact CG2-SD 3.55Å; V314-F347 HydrophobicContact CG1-CD1 4.25Å; V314-F347 HydrophobicContact CG1-CE1 4.19Å; V314-L348 HydrophobicContact CG1-CD1 4.48Å; V314-L348 HydrophobicContact CG1-CD2 3.81Å; V314-L348 HydrophobicContact CG1-CG 4.17Å
315	F	93.1	Very high	83.6	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	161.7	172	68.1	-88.7	0	0	0	111.3	V278 I279 V280 V281 F313 L321 L322 M323 A363 A367	V278-F315 HydrophobicContact CG1-CD1 4.15Å; V278-F315 HydrophobicContact CG1-CE1 3.54Å; I279-F315 PolarHBondContact O-N 3.27Å; I279-F315 VanDerWaalsContact O-N 3.12Å; V280-F315 WeakPolarHBondContact CA-O 3.34Å; V280-F315 HydrophobicContact CB-CE2 4.48Å; V280-F315 HydrophobicContact CB-CZ 4.35Å; V280-F315 HydrophobicContact CG1-CD2 4.41Å; V280-F315 HydrophobicContact CG1-CE2 3.79Å; V280-F315 HydrophobicContact CG1-CZ 4.08Å; V280-F315 HydrophobicContact CG2-CE1 3.78Å; V280-F315 HydrophobicContact CG2-CE2 4.09Å; V280-F315 HydrophobicContact CG2-CZ 3.5Å; V280-F315 VanDerWaalsContact CG2-CZ 3.5Å; V281-F315 PolarHBondContact N-O 3.17Å; F313-F315 AromaticContact CD1-CD1 3.76Å; F313-F315 HydrophobicContact CD1-CD1 3.76Å; F313-F315 HydrophobicContact CD1-CE1 4.46Å; F313-F315 HydrophobicContact CE1-CB 4.12Å; F313-F315 AromaticContact CE1-CD1 3.75Å; F313-F315 HydrophobicContact CE1-CD1 3.75Å; F313-F315 HydrophobicContact CE1-CG 4.33Å; F315-L321 HydrophobicContact CD2-CD2 4.17Å; F315-L321 HydrophobicContact CE2-CD2 3.9Å; F315-L322 WeakPolarHBondContact CB-O 3.46Å; F315-M323 HydrophobicContact CB-CE 4.43Å; F315-M323 HydrophobicContact CB-CG 4.16Å; F315-M323 HydrophobicContact CG-CE 4.37Å; F315-A363 HydrophobicContact CE2-CB 4.5Å; F315-A363 WeakPolarHBondContact CZ-O 3.4Å; F315-A367 HydrophobicContact CE1-CB 4.17Å; F315-A367 HydrophobicContact CZ-CB 4.02Å
316	A	92.7	Very high	82.3	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	150	176.3	0	0	0	0	0	111.4	V281 Q283 L322 F347 L351	V281-A316 HydrophobicContact CB-CB 4.38Å; V281-A316 CarbonylContact O-C 3.55Å; V281-A316 WeakPolarHBondContact O-CA 3.09Å; Q283-A316 HydrophobicContact CG-CB 4.46Å; A316-L322 HydrophobicContact CB-CB 4.29Å; A316-L322 PolarHBondContact N-O 3.26Å; A316-L322 PolarHBondContact O-N 2.94Å; A316-F347 HydrophobicContact CB-CZ 4.35Å; A316-L351 HydrophobicContact CB-CD1 3.84Å; A316-L351 HydrophobicContact CB-CD2 3.55Å; A316-L351 HydrophobicContact CB-CG 4.33Å
317	A	89.6	Confident	80.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	128.8	-174.7	0	0	0	0	0	112.6	V280 V281 Q283 G284 L321 T358 A363	V280-A317 HydrophobicContact CG1-CB 4.14Å; V281-A317 PolarHBondContact O-N 2.92Å; Q283-A317 PolarHBondContact N-O 2.91Å; G284-A317 PolarHBondContact N-O 2.77Å; A317-L321 HydrophobicContact CB-CD2 4.11Å; A317-T358 HydrophobicContact CB-CG2 4.2Å; A317-A363 HydrophobicContact CB-CB 3.63Å
318	S	88	Confident	80.1	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.021	23%	0.225	C	C	.	.	S	Bend	trans	-129.5	-133.3	164.8	59.5	0	0	0	0	108.8	K320 D354 F357 T358 N359	S318-K320 PolarHBondContact N-O 3.4Å; S318-K320 PolarHBondContact O-N 3.09Å; S318-K320 PolarHBondContact OG-O 3.08Å; S318-D354 WeakPolarHBondContact CB-OD2 3.26Å; S318-D354 PolarHBondContact OG-OD2 3.09Å; S318-F357 CarbonylContact C-O 3.48Å; S318-T358 CarbonylContact O-C 3.17Å; S318-T358 WeakPolarHBondContact O-CA 3.42Å; S318-N359 PolarHBondContact O-N 2.88Å
319	D	84.4	Confident	79.7	Confident	67 Å²	67	40.3 Å²	40.3	36%	0.358	22%	0.215	S	C	.	.	S	Bend	trans	-67.4	-21.6	166	68.8	-40.4	0	0	0	111.6	A356 F357	D319-A356 HydrophobicContact CB-CB 3.75Å; D319-A356 WeakPolarHBondContact OD1-CB 3.49Å; D319-F357 WeakPolarHBondContact CA-O 3.38Å; D319-F357 PolarHBondContact N-O 3.37Å
320	K	87.7	Confident	79.3	Confident	140 Å²	140	39.7 Å²	39.7	61%	0.609	22%	0.221	S	C	*	.	S	Bend	trans	-122.8	168.3	177.2	-65.9	167.7	-168.5	165.8	0	110.4	S318	S318-K320 PolarHBondContact N-O 3.4Å; S318-K320 PolarHBondContact O-N 3.09Å; S318-K320 PolarHBondContact OG-O 3.08Å
321	L	88.3	Confident	78.9	Confident	48 Å²	48	44.3 Å²	44.3	25%	0.251	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	127.1	173.5	-55.2	179.5	0	0	0	108.9	F315 A317 L362 A363 T366	F315-L321 HydrophobicContact CD2-CD2 4.17Å; F315-L321 HydrophobicContact CE2-CD2 3.9Å; A317-L321 HydrophobicContact CB-CD2 4.11Å; L321-L362 HydrophobicContact CD1-CD1 4.33Å; L321-L362 HydrophobicContact CD1-CD2 4.47Å; L321-L362 HydrophobicContact CD1-CG 4.06Å; L321-L362 HydrophobicContact CD2-CD2 4.45Å; L321-L362 HydrophobicContact CD2-CG 4.25Å; L321-L362 HydrophobicContact CG-CD2 4.1Å; L321-L362 HydrophobicContact CG-CG 4.1Å; L321-A363 HydrophobicContact CD2-CB 4.33Å; L321-T366 HydrophobicContact CD1-CG2 3.66Å; L321-T366 VanDerWaalsContact CD1-OG1 3.23Å; L321-T366 WeakPolarHBondContact CD1-OG1 3.37Å
322	L	88.3	Confident	78.7	Confident	76 Å²	76	44.6 Å²	44.6	40%	0.398	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	117.9	170	-162.6	84.7	0	0	0	107.8	F315 A316 F347 L351	F315-L322 WeakPolarHBondContact CB-O 3.46Å; A316-L322 HydrophobicContact CB-CB 4.29Å; A316-L322 PolarHBondContact N-O 3.26Å; A316-L322 PolarHBondContact O-N 2.94Å; L322-F347 HydrophobicContact CD2-CE2 3.85Å; L322-F347 HydrophobicContact CD2-CZ 4.29Å; L322-F347 HydrophobicContact CG-CE2 4.16Å; L322-F347 WeakPolarHBondContact O-CZ 3.43Å; L322-L351 HydrophobicContact CD2-CD2 3.52Å
323	M	84.7	Confident	78.4	Confident	57 Å²	57	44.6 Å²	44.6	28%	0.281	25%	0.249	S	C	.	.			trans	-111	153	177.3	-63.9	-162	159.5	0	0	110.3	F313 F315 A325 T366	F313-M323 HydrophobicContact CE1-CE 3.83Å; F313-M323 HydrophobicContact CE1-SD 4.22Å; F313-M323 HydrophobicContact CZ-CE 4.15Å; F313-M323 HydrophobicContact CZ-SD 3.94Å; F315-M323 HydrophobicContact CB-CE 4.43Å; F315-M323 HydrophobicContact CB-CG 4.16Å; F315-M323 HydrophobicContact CG-CE 4.37Å; M323-A325 PolarHBondContact O-N 2.98Å; M323-T366 HydrophobicContact CE-CG2 3.86Å
324	P	75	Confident	77.7	Confident	15 Å²	15	44.8 Å²	44.8	10%	0.097	25%	0.25	C	S	.	.			trans	-63.5	123.5	179.3	-15.3	27.9	0	0	0	110.8	V314 L327 F347	V314-P324 WeakPolarHBondContact O-CD 3.2Å; P324-L327 HydrophobicContact CB-CB 4.1Å; P324-L327 HydrophobicContact CB-CD1 3.79Å; P324-L327 HydrophobicContact CB-CD2 4.35Å; P324-L327 HydrophobicContact CB-CG 4.28Å; P324-L327 HydrophobicContact CG-CD1 4.26Å; P324-L327 HydrophobicContact CG-CD2 4.07Å; P324-L327 PolarHBondContact O-N 3.02Å; P324-F347 HydrophobicContact CB-CB 3.97Å; P324-F347 HydrophobicContact CB-CD1 4.47Å; P324-F347 HydrophobicContact CB-CD2 3.81Å; P324-F347 HydrophobicContact CB-CE2 4.41Å; P324-F347 HydrophobicContact CB-CG 3.82Å; P324-F347 HydrophobicContact CG-CB 4.13Å; P324-F347 HydrophobicContact CG-CD1 3.78Å; P324-F347 HydrophobicContact CG-CD2 3.86Å; P324-F347 HydrophobicContact CG-CE1 4.11Å; P324-F347 HydrophobicContact CG-CE2 4.17Å; P324-F347 HydrophobicContact CG-CG 3.63Å; P324-F347 HydrophobicContact CG-CZ 4.29Å
325	A	63.1	Low	77	Confident	90 Å²	90	46 Å²	46	74%	0.744	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	139.3	174.5	0	0	0	0	0	110.2	M323 L327	M323-A325 PolarHBondContact O-N 2.98Å; A325-L327 VanDerWaalsContact C-N 3.27Å; A325-L327 PolarHBondContact O-N 2.86Å
326	N	56.3	Low	76.3	Confident	154 Å²	154	46 Å²	46	82%	0.824	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	21.7	-179.4	-52.5	-29.6	0	0	0	115.5
327	L	53.4	Low	75.3	Confident	23 Å²	23	46.8 Å²	46.8	12%	0.12	26%	0.263	C	S	.	.			trans	-74.6	137.5	171.9	-138.7	78.1	0	0	0	111.1	F313 P324 A325 C329 K343 M344	F313-L327 HydrophobicContact CD2-CD2 4.32Å; F313-L327 HydrophobicContact CE2-CD2 4.06Å; P324-L327 HydrophobicContact CB-CB 4.1Å; P324-L327 HydrophobicContact CB-CD1 3.79Å; P324-L327 HydrophobicContact CB-CD2 4.35Å; P324-L327 HydrophobicContact CB-CG 4.28Å; P324-L327 HydrophobicContact CG-CD1 4.26Å; P324-L327 HydrophobicContact CG-CD2 4.07Å; P324-L327 PolarHBondContact O-N 3.02Å; A325-L327 VanDerWaalsContact C-N 3.27Å; A325-L327 PolarHBondContact O-N 2.86Å; L327-C329 VanDerWaalsContact C-N 3.26Å; L327-C329 PolarHBondContact O-N 3.07Å; L327-C329 VanDerWaalsContact O-N 3.17Å; L327-K343 HydrophobicContact CD1-CB 4.22Å; L327-M344 HydrophobicContact CD2-CE 3.84Å
328	Y	58	Low	74.3	Confident	80 Å²	80	49.1 Å²	49.1	31%	0.314	28%	0.277	S	S	.	.	S	Bend	trans	-58.3	-31.1	-168.3	-62	-76.3	0	0	0	114.5	K343 L1036 C1040	Y328-K343 HydrophobicContact CE2-CD 3.95Å; Y328-K343 PolarHBondContact OH-NZ 3.23Å; Y328-L1036 HydrophobicContact CD1-CD2 3.79Å; Y328-L1036 HydrophobicContact CE1-CD2 3.92Å; Y328-C1040 PolarHBondContact O-SG 3.12Å
329	C	60.3	Low	73.3	Confident	9 Å²	9	52.6 Å²	52.6	6%	0.061	29%	0.293	C	S	.	.	S	Bend	trans	-128.1	96.3	178.2	-41.2	0	0	0	0	109.1	L327 N331 A332 C1040	L327-C329 VanDerWaalsContact C-N 3.26Å; L327-C329 PolarHBondContact O-N 3.07Å; L327-C329 VanDerWaalsContact O-N 3.17Å; C329-N331 VanDerWaalsContact C-N 3.27Å; C329-N331 PolarHBondContact O-N 3.12Å; C329-A332 HydrophobicContact CB-CB 4.34Å; C329-C1040 VanDerWaalsContact CA-SG 3.56Å; C329-C1040 HydrophobicContact CB-CB 4.04Å; C329-C1040 WeakPolarHBondContact CB-SG 3.34Å; C329-C1040 WeakPolarHBondContact SG-CA 3.38Å; C329-C1040 WeakPolarHBondContact SG-CB 3.36Å; C329-C1040 CovalentContact SG-SG 2.04Å; C329-C1040 PolarHBondContact SG-SG 2.93Å
330	A	63.1	Low	73	Confident	66 Å²	66	49.7 Å²	49.7	55%	0.545	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-32.8	-170	0	0	0	0	0	114.1	F313	F313-A330 WeakPolarHBondContact CZ-O 3.22Å
331	N	73.5	Confident	72.8	Confident	99 Å²	99	44.1 Å²	44.1	53%	0.529	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.6	25.8	-171.7	-65.3	-4.2	0	0	0	113.5	C329 N373	C329-N331 VanDerWaalsContact C-N 3.27Å; C329-N331 PolarHBondContact O-N 3.12Å; N331-N373 WeakPolarHBondContact O-CB 3.23Å; N331-N373 PolarHBondContact O-ND2 2.78Å
332	A	80	Confident	72.4	Confident	9 Å²	9	44.3 Å²	44.3	7%	0.074	26%	0.262	C	S	.	.	S	Bend	trans	-143	150.6	-179.7	0	0	0	0	0	110.5	F313 C329 N373 P1041	F313-A332 WeakPolarHBondContact CD2-O 3.48Å; C329-A332 HydrophobicContact CB-CB 4.34Å; A332-N373 HydrophobicContact CB-CB 4.1Å; A332-N373 WeakPolarHBondContact CB-O 3.27Å; A332-P1041 HydrophobicContact CB-CG 4.08Å
333	T	83	Confident	72	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.257	C	S	.	.			trans	-61	147.9	169.1	55.2	0	0	0	0	110.8	Q276 V278 E311 F313 V370 L371 G374	Q276-T333 HydrophobicContact CG-CG2 3.98Å; Q276-T333 PolarHBondContact NE2-OG1 2.75Å; V278-T333 HydrophobicContact CG2-CG2 3.94Å; E311-T333 PolarHBondContact OE2-OG1 2.99Å; F313-T333 HydrophobicContact CB-CG2 4.13Å; T333-V370 HydrophobicContact CG2-CG1 3.91Å; T333-L371 HydrophobicContact CG2-CD2 4.29Å; T333-G374 VanDerWaalsContact OG1-CA 3.31Å; T333-G374 WeakPolarHBondContact OG1-CA 3.34Å
334	T	76.3	Confident	72.1	Confident	4 Å²	4	41 Å²	41	3%	0.025	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	155	179.8	-175.9	0	0	0	0	109.4	E311 V312 A336 V340 M344	E311-T334 CarbonylContact C-O 3.56Å; E311-T334 VanDerWaalsContact CA-O 3.32Å; E311-T334 WeakPolarHBondContact CA-O 3.4Å; V312-T334 PolarHBondContact N-O 2.71Å; V312-T334 PolarHBondContact O-N 3.1Å; V312-T334 VanDerWaalsContact O-N 3.12Å; T334-A336 PolarHBondContact O-N 3.47Å; T334-V340 HydrophobicContact CG2-CG1 3.71Å; T334-V340 HydrophobicContact CG2-CG2 4.23Å; T334-M344 HydrophobicContact CG2-CE 4.19Å
335	V	77.3	Confident	72.8	Confident	25 Å²	25	42 Å²	42	15%	0.152	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54	133.7	177.3	173.9	0	0	0	0	110.7	E308 S337 V340 Y1039	E308-V335 WeakPolarHBondContact O-CG1 3.28Å; V335-S337 PolarHBondContact O-N 3.47Å; V335-V340 WeakPolarHBondContact O-CG2 3.16Å; V335-Y1039 HydrophobicContact CB-CG 4.46Å; V335-Y1039 HydrophobicContact CG2-CD1 3.79Å; V335-Y1039 HydrophobicContact CG2-CE1 4.49Å; V335-Y1039 HydrophobicContact CG2-CG 4Å
336	A	79.7	Confident	73.9	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.24	C	C	.	.			trans	-77.7	55.3	-178.7	0	0	0	0	0	112.9	L306 D310 V312 T334 K341	L306-A336 HydrophobicContact CB-CB 3.89Å; D310-A336 PolarHBondContact O-N 3.39Å; V312-A336 HydrophobicContact CB-CB 4.21Å; V312-A336 HydrophobicContact CG1-CB 3.58Å; T334-A336 PolarHBondContact O-N 3.47Å; A336-K341 VanDerWaalsContact O-CE 3.23Å; A336-K341 WeakPolarHBondContact O-CE 3.45Å
337	S	70.4	Confident	75.5	Confident	18 Å²	18	37.3 Å²	37.3	13%	0.126	20%	0.204	C	C	.	.			trans	-66.6	162.4	175.6	86.4	0	0	0	0	112.1	V335 E339 V340 K341	V335-S337 PolarHBondContact O-N 3.47Å; S337-E339 WeakPolarHBondContact CB-OE2 3.21Å; S337-E339 PolarHBondContact O-N 2.95Å; S337-E339 PolarHBondContact OG-N 2.91Å; S337-E339 PolarHBondContact OG-OE2 2.96Å; S337-V340 PolarHBondContact O-N 2.68Å; S337-V340 VanDerWaalsContact O-N 3.14Å; S337-V340 PolarHBondContact OG-N 2.88Å; S337-K341 WeakPolarHBondContact O-CG 3.35Å; S337-K341 PolarHBondContact O-N 2.99Å
338	V	69.9	Low	77.4	Confident	49 Å²	49	36.2 Å²	36.2	30%	0.297	20%	0.198	S	C	.	.	H	α-helix	trans	-52.3	-41.9	177.3	178.4	0	0	0	0	112.2	A342 P527	V338-A342 WeakPolarHBondContact O-CB 3.19Å; V338-A342 PolarHBondContact O-N 3.45Å; V338-P527 HydrophobicContact CG1-CB 3.8Å; V338-P527 HydrophobicContact CG2-CB 4.31Å
339	E	67.4	Low	79	Confident	75 Å²	75	36.6 Å²	36.6	35%	0.35	21%	0.206	S	C	.	.	H	α-helix	trans	-72.8	-37.8	-179.8	-54.1	84.8	168.2	0	0	112.8	S337 K341 A342 K343 R956	S337-E339 WeakPolarHBondContact CB-OE2 3.21Å; S337-E339 PolarHBondContact O-N 2.95Å; S337-E339 PolarHBondContact OG-N 2.91Å; S337-E339 PolarHBondContact OG-OE2 2.96Å; E339-K341 VanDerWaalsContact C-N 3.35Å; E339-A342 PolarHBondContact O-N 2.94Å; E339-K343 WeakPolarHBondContact O-CG 3.39Å; E339-K343 PolarHBondContact O-N 2.95Å; E339-R956 IonicContact OE1-CZ 3.52Å; E339-R956 IonicContact OE1-NE 2.72Å; E339-R956 IonicContact OE1-NH1 3.88Å; E339-R956 PolarHBondContact OE1-NH1 2.94Å; E339-R956 IonicContact OE2-CZ 2.84Å; E339-R956 IonicContact OE2-NH1 2.65Å; E339-R956 PolarHBondContact OE2-NH1 3.39Å
340	V	77.5	Confident	80.4	Confident	7 Å²	7	40.4 Å²	40.4	4%	0.042	23%	0.229	C	C	.	.	H	α-helix	trans	-62.8	-46.5	175.4	170.2	0	0	0	0	109.5	V312 T334 V335 S337 K343 M344	V312-V340 HydrophobicContact CG1-CG1 4.11Å; T334-V340 HydrophobicContact CG2-CG1 3.71Å; T334-V340 HydrophobicContact CG2-CG2 4.23Å; V335-V340 WeakPolarHBondContact O-CG2 3.16Å; S337-V340 PolarHBondContact O-N 2.68Å; S337-V340 VanDerWaalsContact O-N 3.14Å; S337-V340 PolarHBondContact OG-N 2.88Å; V340-K343 PolarHBondContact O-N 3.3Å; V340-M344 HydrophobicContact CG1-CE 3.56Å; V340-M344 HydrophobicContact CG1-CG 4.42Å; V340-M344 HydrophobicContact CG1-SD 3.75Å; V340-M344 WeakPolarHBondContact O-CB 3.39Å; V340-M344 VanDerWaalsContact O-CG 3.3Å; V340-M344 WeakPolarHBondContact O-CG 3.46Å; V340-M344 PolarHBondContact O-N 2.98Å
341	K	83.1	Confident	81.8	Confident	23 Å²	23	37.3 Å²	37.3	10%	0.1	20%	0.203	C	C	.	.	H	α-helix	trans	-59.1	-49.4	175.3	-68.3	176	178.5	170.3	0	111.3	L303 L306 A336 S337 E339 K343 M344 E345	L303-K341 HydrophobicContact CD1-CB 4.42Å; L303-K341 HydrophobicContact CD1-CG 3.9Å; L303-K341 HydrophobicContact CD2-CB 4.33Å; L303-K341 HydrophobicContact CG-CB 4.15Å; L303-K341 HydrophobicContact CG-CG 3.96Å; L303-K341 WeakPolarHBondContact O-CE 3.45Å; L306-K341 WeakPolarHBondContact O-CE 3.45Å; L306-K341 PolarHBondContact O-NZ 3.39Å; A336-K341 VanDerWaalsContact O-CE 3.23Å; A336-K341 WeakPolarHBondContact O-CE 3.45Å; S337-K341 WeakPolarHBondContact O-CG 3.35Å; S337-K341 PolarHBondContact O-N 2.99Å; E339-K341 VanDerWaalsContact C-N 3.35Å; K341-K343 VanDerWaalsContact C-N 3.31Å; K341-K343 PolarHBondContact O-N 2.86Å; K341-M344 CarbonylContact O-C 3.55Å; K341-M344 PolarHBondContact O-N 3.43Å; K341-M344 VanDerWaalsContact O-N 3.12Å; K341-E345 WeakPolarHBondContact O-CG 3.26Å; K341-E345 PolarHBondContact O-N 2.92Å
342	A	79.9	Confident	82.6	Confident	52 Å²	52	37.4 Å²	37.4	43%	0.43	21%	0.208	S	C	.	.	H	α-helix	trans	-58.4	-41.7	179.4	0	0	0	0	0	112.6	V338 E339 E345 Q346	V338-A342 WeakPolarHBondContact O-CB 3.19Å; V338-A342 PolarHBondContact O-N 3.45Å; E339-A342 PolarHBondContact O-N 2.94Å; A342-E345 PolarHBondContact O-N 3.48Å; A342-Q346 WeakPolarHBondContact O-CB 3.33Å; A342-Q346 PolarHBondContact O-N 2.6Å
343	K	79.3	Confident	83	Confident	64 Å²	64	39.5 Å²	39.5	28%	0.278	22%	0.219	S	C	.	.	H	α-helix	trans	-67.5	-38.9	175.3	-74.6	-174.6	179.8	-162.6	0	113	L327 Y328 E339 V340 K341 Q346 F347	L327-K343 HydrophobicContact CD1-CB 4.22Å; Y328-K343 HydrophobicContact CE2-CD 3.95Å; Y328-K343 PolarHBondContact OH-NZ 3.23Å; E339-K343 WeakPolarHBondContact O-CG 3.39Å; E339-K343 PolarHBondContact O-N 2.95Å; V340-K343 PolarHBondContact O-N 3.3Å; K341-K343 VanDerWaalsContact C-N 3.31Å; K341-K343 PolarHBondContact O-N 2.86Å; K343-Q346 PolarHBondContact O-N 2.78Å; K343-F347 PolarHBondContact O-N 2.85Å
344	M	88.1	Confident	83.1	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-69.2	-37.8	176	-73.2	175.9	175.2	0	0	111.5	L303 V312 V314 L327 T334 V340 K341 F347 L348	L303-M344 HydrophobicContact CD1-CB 4.4Å; L303-M344 HydrophobicContact CD1-SD 3.89Å; L303-M344 HydrophobicContact CD2-CB 3.61Å; V312-M344 HydrophobicContact CG1-CE 3.93Å; V312-M344 HydrophobicContact CG1-SD 3.71Å; V312-M344 HydrophobicContact CG2-SD 4.16Å; V314-M344 HydrophobicContact CB-CG 4.31Å; V314-M344 HydrophobicContact CB-SD 4.26Å; V314-M344 HydrophobicContact CG2-CB 4.2Å; V314-M344 HydrophobicContact CG2-CE 4.43Å; V314-M344 HydrophobicContact CG2-CG 4.1Å; V314-M344 HydrophobicContact CG2-SD 3.55Å; V314-M344 VanDerWaalsContact CG2-SD 3.55Å; L327-M344 HydrophobicContact CD2-CE 3.84Å; T334-M344 HydrophobicContact CG2-CE 4.19Å; V340-M344 HydrophobicContact CG1-CE 3.56Å; V340-M344 HydrophobicContact CG1-CG 4.42Å; V340-M344 HydrophobicContact CG1-SD 3.75Å; V340-M344 WeakPolarHBondContact O-CB 3.39Å; V340-M344 VanDerWaalsContact O-CG 3.3Å; V340-M344 WeakPolarHBondContact O-CG 3.46Å; V340-M344 PolarHBondContact O-N 2.98Å; K341-M344 CarbonylContact O-C 3.55Å; K341-M344 PolarHBondContact O-N 3.43Å; K341-M344 VanDerWaalsContact O-N 3.12Å; M344-F347 WeakPolarHBondContact O-CB 3.31Å; M344-F347 PolarHBondContact O-N 3.26Å; M344-L348 WeakPolarHBondContact O-CB 3.05Å; M344-L348 VanDerWaalsContact O-CG 3.25Å; M344-L348 WeakPolarHBondContact O-CG 3.41Å; M344-L348 PolarHBondContact O-N 3.48Å
345	E	89	Confident	83.4	Confident	35 Å²	35	46.3 Å²	46.3	16%	0.164	26%	0.263	C	S	.	.	H	α-helix	trans	-60.7	-45.4	170.8	-71.3	-172.8	146.9	0	0	110.6	K260 K300 L303 N304 K341 A342 F347 L348 D349	K260-E345 IonicContact NZ-OE1 2.68Å; K260-E345 PolarHBondContact NZ-OE1 3.15Å; K260-E345 IonicContact NZ-OE2 2.6Å; K260-E345 PolarHBondContact NZ-OE2 2.86Å; K300-E345 HydrophobicContact CG-CG 4.19Å; L303-E345 HydrophobicContact CD2-CG 3.77Å; N304-E345 PolarHBondContact ND2-OE1 2.94Å; N304-E345 PolarHBondContact OD1-OE1 2.79Å; N304-E345 VanDerWaalsContact OD1-OE1 3.05Å; K341-E345 WeakPolarHBondContact O-CG 3.26Å; K341-E345 PolarHBondContact O-N 2.92Å; A342-E345 PolarHBondContact O-N 3.48Å; E345-F347 VanDerWaalsContact C-N 3.34Å; E345-F347 PolarHBondContact O-N 2.89Å; E345-L348 WeakPolarHBondContact O-CB 3.32Å; E345-L348 PolarHBondContact O-N 3.48Å; E345-D349 PolarHBondContact O-N 3.28Å
346	Q	86.2	Confident	83.6	Confident	132 Å²	132	46.1 Å²	46.1	62%	0.617	26%	0.264	S	S	*	.	H	α-helix	trans	-59.8	-43.3	174.9	-173.5	-176.9	13.5	0	0	111.7	A342 K343 D349 T350	A342-Q346 WeakPolarHBondContact O-CB 3.33Å; A342-Q346 PolarHBondContact O-N 2.6Å; K343-Q346 PolarHBondContact O-N 2.78Å; Q346-D349 WeakPolarHBondContact O-CB 3.18Å; Q346-D349 PolarHBondContact O-N 2.79Å; Q346-T350 WeakPolarHBondContact O-CG2 3.43Å; Q346-T350 PolarHBondContact O-N 2.77Å
347	F	91	Very high	83.6	Confident	14 Å²	14	51.8 Å²	51.8	6%	0.061	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-47	174	165.1	-104.6	0	0	0	111.9	V314 A316 L322 P324 K343 M344 E345 D349 T350 L351	V314-F347 HydrophobicContact CG1-CD1 4.25Å; V314-F347 HydrophobicContact CG1-CE1 4.19Å; A316-F347 HydrophobicContact CB-CZ 4.35Å; L322-F347 HydrophobicContact CD2-CE2 3.85Å; L322-F347 HydrophobicContact CD2-CZ 4.29Å; L322-F347 HydrophobicContact CG-CE2 4.16Å; L322-F347 WeakPolarHBondContact O-CZ 3.43Å; P324-F347 HydrophobicContact CB-CB 3.97Å; P324-F347 HydrophobicContact CB-CD1 4.47Å; P324-F347 HydrophobicContact CB-CD2 3.81Å; P324-F347 HydrophobicContact CB-CE2 4.41Å; P324-F347 HydrophobicContact CB-CG 3.82Å; P324-F347 HydrophobicContact CG-CB 4.13Å; P324-F347 HydrophobicContact CG-CD1 3.78Å; P324-F347 HydrophobicContact CG-CD2 3.86Å; P324-F347 HydrophobicContact CG-CE1 4.11Å; P324-F347 HydrophobicContact CG-CE2 4.17Å; P324-F347 HydrophobicContact CG-CG 3.63Å; P324-F347 HydrophobicContact CG-CZ 4.29Å; K343-F347 PolarHBondContact O-N 2.85Å; M344-F347 WeakPolarHBondContact O-CB 3.31Å; M344-F347 PolarHBondContact O-N 3.26Å; E345-F347 VanDerWaalsContact C-N 3.34Å; E345-F347 PolarHBondContact O-N 2.89Å; F347-D349 PolarHBondContact O-N 3.14Å; F347-T350 PolarHBondContact O-N 3.19Å; F347-T350 PolarHBondContact O-OG1 3.1Å; F347-L351 HydrophobicContact CE1-CD2 4.15Å; F347-L351 HydrophobicContact CE2-CD2 3.97Å; F347-L351 HydrophobicContact CZ-CD2 3.71Å
348	L	92.2	Very high	84.1	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-58	-36.3	177.1	-72.5	168.6	0	0	0	111.7	V281 K296 A299 K300 L303 V314 M344 E345 T350 L351	V281-L348 HydrophobicContact CG2-CD2 3.82Å; K296-L348 VanDerWaalsContact CD-O 3.32Å; K296-L348 WeakPolarHBondContact CD-O 3.38Å; K296-L348 WeakPolarHBondContact CE-O 3.15Å; K296-L348 WeakPolarHBondContact CG-O 3.33Å; A299-L348 HydrophobicContact CB-CD1 3.69Å; A299-L348 HydrophobicContact CB-CD2 3.69Å; A299-L348 HydrophobicContact CB-CG 4.36Å; K300-L348 HydrophobicContact CG-CD1 3.81Å; L303-L348 HydrophobicContact CD2-CD1 4.49Å; V314-L348 HydrophobicContact CG1-CD1 4.48Å; V314-L348 HydrophobicContact CG1-CD2 3.81Å; V314-L348 HydrophobicContact CG1-CG 4.17Å; M344-L348 WeakPolarHBondContact O-CB 3.05Å; M344-L348 VanDerWaalsContact O-CG 3.25Å; M344-L348 WeakPolarHBondContact O-CG 3.41Å; M344-L348 PolarHBondContact O-N 3.48Å; E345-L348 WeakPolarHBondContact O-CB 3.32Å; E345-L348 PolarHBondContact O-N 3.48Å; L348-T350 VanDerWaalsContact C-N 3.3Å; L348-T350 PolarHBondContact O-N 3.36Å; L348-L351 HydrophobicContact CD2-CD1 3.9Å; L348-L351 PolarHBondContact O-N 2.91Å
349	D	91.2	Very high	84.7	Confident	87 Å²	87	51.4 Å²	51.4	47%	0.465	28%	0.284	S	S	.	.	H	α-helix	trans	-64.4	-34.1	176.2	-76	-36.1	0	0	0	113.1	K296 K300 E345 Q346 F347 L351	K296-D349 PolarHBondContact NZ-O 3.27Å; K300-D349 WeakPolarHBondContact CE-OD1 3.19Å; K300-D349 IonicContact NZ-OD1 3.45Å; K300-D349 PolarHBondContact NZ-OD1 3.45Å; K300-D349 IonicContact NZ-OD2 3.02Å; K300-D349 PolarHBondContact NZ-OD2 2.78Å; E345-D349 PolarHBondContact O-N 3.28Å; Q346-D349 WeakPolarHBondContact O-CB 3.18Å; Q346-D349 PolarHBondContact O-N 2.79Å; F347-D349 PolarHBondContact O-N 3.14Å; D349-L351 VanDerWaalsContact C-N 3.29Å; D349-L351 PolarHBondContact O-N 3.23Å
350	T	91.2	Very high	85.5	Confident	90 Å²	90	48.9 Å²	48.9	55%	0.552	27%	0.273	S	S	*	.	H	α-helix	trans	-73.1	-12.8	178.5	65.8	0	0	0	0	114.9	Q346 F347 L348	Q346-T350 WeakPolarHBondContact O-CG2 3.43Å; Q346-T350 PolarHBondContact O-N 2.77Å; F347-T350 PolarHBondContact O-N 3.19Å; F347-T350 PolarHBondContact O-OG1 3.1Å; L348-T350 VanDerWaalsContact C-N 3.3Å; L348-T350 PolarHBondContact O-N 3.36Å
351	L	91.9	Very high	85.7	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	28%	0.276	C	S	.	.			trans	-66.9	142.2	-175.7	-57.2	178.8	0	0	0	112.2	V281 K296 A316 L322 F347 L348 D349	V281-L351 HydrophobicContact CB-CD1 4.19Å; V281-L351 HydrophobicContact CG1-CD1 4.07Å; K296-L351 WeakPolarHBondContact CE-O 3.26Å; K296-L351 PolarHBondContact NZ-O 3.46Å; A316-L351 HydrophobicContact CB-CD1 3.84Å; A316-L351 HydrophobicContact CB-CD2 3.55Å; A316-L351 HydrophobicContact CB-CG 4.33Å; L322-L351 HydrophobicContact CD2-CD2 3.52Å; F347-L351 HydrophobicContact CE1-CD2 4.15Å; F347-L351 HydrophobicContact CE2-CD2 3.97Å; F347-L351 HydrophobicContact CZ-CD2 3.71Å; L348-L351 HydrophobicContact CD2-CD1 3.9Å; L348-L351 PolarHBondContact O-N 2.91Å; D349-L351 VanDerWaalsContact C-N 3.29Å; D349-L351 PolarHBondContact O-N 3.23Å
352	T	90.8	Very high	85.9	Confident	101 Å²	101	51.3 Å²	51.3	62%	0.62	29%	0.287	S	S	*	.			trans	-134.8	156.4	175.7	55.6	0	0	0	0	109.4	Q283	Q283-T352 PolarHBondContact OE1-O 2.94Å
353	T	88.4	Confident	86.2	Confident	52 Å²	52	48.9 Å²	48.9	32%	0.319	27%	0.266	S	S	.	.			trans	-63.5	140.4	177.2	56.9	0	0	0	0	110.5	M287 D289 L292	M287-T353 WeakPolarHBondContact O-CG2 3.35Å; D289-T353 WeakPolarHBondContact OD1-CG2 3.44Å; L292-T353 HydrophobicContact CB-CG2 4.06Å; L292-T353 HydrophobicContact CD2-CG2 3.69Å; L292-T353 VanDerWaalsContact CD2-N 3.29Å
354	D	85.3	Confident	86.6	Confident	47 Å²	47	46.3 Å²	46.3	25%	0.251	26%	0.256	S	S	.	.			trans	-110.4	142.1	176.8	-167.5	-13.4	0	0	0	109.8	Q283 G284 L285 S318 A356	Q283-D354 HydrophobicContact CG-CB 4.23Å; Q283-D354 PolarHBondContact O-N 2.71Å; G284-D354 CarbonylContact C-O 3.53Å; L285-D354 PolarHBondContact N-O 3.19Å; L285-D354 VanDerWaalsContact N-O 3.11Å; S318-D354 WeakPolarHBondContact CB-OD2 3.26Å; S318-D354 PolarHBondContact OG-OD2 3.09Å; D354-A356 VanDerWaalsContact C-N 3.27Å; D354-A356 PolarHBondContact O-N 3Å; D354-A356 PolarHBondContact OD1-N 2.63Å; D354-A356 VanDerWaalsContact OD1-N 3.13Å
355	S	81.7	Confident	86.6	Confident	100 Å²	100	47.9 Å²	47.9	70%	0.699	27%	0.266	S	S	*	.	S	Bend	trans	-78.5	-9.3	178.5	63.4	0	0	0	0	113.6	L285	L285-S355 WeakPolarHBondContact CB-O 3.16Å; L285-S355 WeakPolarHBondContact CD1-O 3.37Å
356	A	81.6	Confident	86.6	Confident	21 Å²	21	47.3 Å²	47.3	17%	0.174	27%	0.265	C	S	.	.	S	Bend	trans	-87.1	143.7	-178.1	0	0	0	0	0	113.2	G284 L285 D319 D354	G284-A356 CarbonylContact C-O 3.56Å; G284-A356 WeakPolarHBondContact CA-O 3.41Å; L285-A356 PolarHBondContact N-O 2.98Å; D319-A356 HydrophobicContact CB-CB 3.75Å; D319-A356 WeakPolarHBondContact OD1-CB 3.49Å; D354-A356 VanDerWaalsContact C-N 3.27Å; D354-A356 PolarHBondContact O-N 3Å; D354-A356 PolarHBondContact OD1-N 2.63Å; D354-A356 VanDerWaalsContact OD1-N 3.13Å
357	F	79.1	Confident	86.8	Confident	120 Å²	120	41 Å²	41	53%	0.526	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-58.1	139.6	174.6	-72.9	-102.5	0	0	0	111.1	L285 S318 D319 N359 Q395	L285-F357 HydrophobicContact CD2-CD1 4.27Å; L285-F357 HydrophobicContact CD2-CD2 3.76Å; L285-F357 HydrophobicContact CD2-CE1 3.86Å; L285-F357 HydrophobicContact CD2-CE2 3.35Å; L285-F357 HydrophobicContact CD2-CG 4.19Å; L285-F357 HydrophobicContact CD2-CZ 3.37Å; S318-F357 CarbonylContact C-O 3.48Å; D319-F357 WeakPolarHBondContact CA-O 3.38Å; D319-F357 PolarHBondContact N-O 3.37Å; F357-N359 PolarHBondContact O-N 2.86Å; F357-Q395 HydrophobicContact CD1-CB 4.07Å; F357-Q395 HydrophobicContact CD1-CG 3.42Å; F357-Q395 VanDerWaalsContact CD1-CG 3.42Å; F357-Q395 HydrophobicContact CE1-CG 3.8Å
358	T	81.3	Confident	86.7	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.018	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-78.3	125.2	-176.5	-53.7	0	0	0	0	110.9	Q282 G284 A317 S318 H360 Q395	Q282-T358 HydrophobicContact CG-CG2 4.17Å; Q282-T358 PolarHBondContact NE2-OG1 3.28Å; G284-T358 WeakPolarHBondContact CA-OG1 3.41Å; A317-T358 HydrophobicContact CB-CG2 4.2Å; S318-T358 CarbonylContact O-C 3.17Å; S318-T358 WeakPolarHBondContact O-CA 3.42Å; T358-H360 PolarHBondContact O-CD2 2.86Å; T358-H360 PolarHBondContact O-N 2.88Å; T358-H360 VanDerWaalsContact O-N 3.08Å; T358-Q395 VanDerWaalsContact N-OE1 3.13Å
359	N	83.7	Confident	86.5	Confident	56 Å²	56	45.4 Å²	45.4	30%	0.299	26%	0.26	S	S	.	.			trans	-82.2	83.4	172.1	-170.5	-16.7	0	0	0	110.1	S318 F357 T361 L362 A363	S318-N359 PolarHBondContact O-N 2.88Å; F357-N359 PolarHBondContact O-N 2.86Å; N359-T361 VanDerWaalsContact C-N 3.29Å; N359-T361 PolarHBondContact O-N 2.82Å; N359-T361 PolarHBondContact OD1-N 3.01Å; N359-L362 HydrophobicContact CB-CB 4.01Å; N359-L362 VanDerWaalsContact CG-CB 3.42Å; N359-L362 PolarHBondContact O-N 3.26Å; N359-L362 PolarHBondContact OD1-N 2.03Å; N359-L362 VanDerWaalsContact OD1-N 3.09Å; N359-A363 PolarHBondContact O-N 2.98Å
360	H	82.7	Confident	86.3	Confident	22 Å²	22	41.4 Å²	41.4	10%	0.102	24%	0.239	C	C	.	.	H	α-helix	trans	-60.9	-34.7	-178.5	-65.6	-67.8	0	0	0	113.4	T358 A363 L364 Y387 L396 L403	T358-H360 PolarHBondContact O-CD2 2.86Å; T358-H360 PolarHBondContact O-N 2.88Å; T358-H360 VanDerWaalsContact O-N 3.08Å; H360-A363 PolarHBondContact O-N 3.33Å; H360-L364 WeakPolarHBondContact O-CB 3.43Å; H360-L364 PolarHBondContact O-N 2.93Å; H360-Y387 AromaticContact ND1-CZ 3.64Å; H360-Y387 PolarHBondContact ND1-OH 2.88Å; H360-L396 HydrophobicContact CB-CD2 4.49Å; H360-L403 HydrophobicContact CB-CD1 4.42Å
361	T	82.1	Confident	86	Confident	19 Å²	19	37.5 Å²	37.5	12%	0.117	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-48	176.9	-51.4	0	0	0	0	110.6	N359 L364 S365 R402 V406	N359-T361 VanDerWaalsContact C-N 3.29Å; N359-T361 PolarHBondContact O-N 2.82Å; N359-T361 PolarHBondContact OD1-N 3.01Å; T361-L364 PolarHBondContact O-N 2.56Å; T361-S365 WeakPolarHBondContact O-CB 3.28Å; T361-S365 PolarHBondContact O-N 3.41Å; T361-S365 PolarHBondContact O-OG 2.79Å; T361-R402 HydrophobicContact CG2-CB 3.87Å; T361-V406 HydrophobicContact CG2-CG2 3.96Å
362	L	86.6	Confident	85.5	Confident	62 Å²	62	42.8 Å²	42.8	33%	0.325	24%	0.243	S	C	.	.	H	α-helix	trans	-63.1	-41.5	177.4	176.7	63.7	0	0	0	112	L321 N359 S365 T366	L321-L362 HydrophobicContact CD1-CD1 4.33Å; L321-L362 HydrophobicContact CD1-CD2 4.47Å; L321-L362 HydrophobicContact CD1-CG 4.06Å; L321-L362 HydrophobicContact CD2-CD2 4.45Å; L321-L362 HydrophobicContact CD2-CG 4.25Å; L321-L362 HydrophobicContact CG-CD2 4.1Å; L321-L362 HydrophobicContact CG-CG 4.1Å; N359-L362 HydrophobicContact CB-CB 4.01Å; N359-L362 VanDerWaalsContact CG-CB 3.42Å; N359-L362 PolarHBondContact O-N 3.26Å; N359-L362 PolarHBondContact OD1-N 2.03Å; N359-L362 VanDerWaalsContact OD1-N 3.09Å; L362-S365 PolarHBondContact O-OG 3.17Å; L362-T366 VanDerWaalsContact O-CB 3.3Å; L362-T366 WeakPolarHBondContact O-CB 3.13Å; L362-T366 PolarHBondContact O-N 3.06Å; L362-T366 PolarHBondContact O-OG1 3.19Å
363	A	87.2	Confident	84.8	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-47.8	178.9	0	0	0	0	0	111.7	V280 F315 A317 L321 N359 H360 A367 Y387	V280-A363 HydrophobicContact CG1-CB 4.25Å; F315-A363 HydrophobicContact CE2-CB 4.5Å; F315-A363 WeakPolarHBondContact CZ-O 3.4Å; A317-A363 HydrophobicContact CB-CB 3.63Å; L321-A363 HydrophobicContact CD2-CB 4.33Å; N359-A363 PolarHBondContact O-N 2.98Å; H360-A363 PolarHBondContact O-N 3.33Å; A363-A367 WeakPolarHBondContact O-CB 3.37Å; A363-A367 PolarHBondContact O-N 3.29Å; A363-Y387 HydrophobicContact CB-CE2 3.96Å
364	L	87	Confident	83.8	Confident	11 Å²	11	37.7 Å²	37.7	6%	0.058	21%	0.212	C	C	.	.	H	α-helix	trans	-70.6	-42.2	-179	-173.2	63.4	0	0	0	112.1	H360 T361 T366 A367 L368 V385 L403 V406 V407 I419	H360-L364 WeakPolarHBondContact O-CB 3.43Å; H360-L364 PolarHBondContact O-N 2.93Å; T361-L364 PolarHBondContact O-N 2.56Å; L364-T366 VanDerWaalsContact C-N 3.31Å; L364-T366 PolarHBondContact O-N 2.85Å; L364-A367 PolarHBondContact O-N 3.06Å; L364-L368 HydrophobicContact CG-CD1 4.47Å; L364-L368 WeakPolarHBondContact O-CG 2.89Å; L364-L368 PolarHBondContact O-N 3.33Å; L364-L368 VanDerWaalsContact O-N 3.1Å; L364-V385 HydrophobicContact CD1-CG1 4.21Å; L364-L403 HydrophobicContact CB-CD1 4.24Å; L364-L403 HydrophobicContact CD2-CD1 3.79Å; L364-V406 HydrophobicContact CB-CG1 4.3Å; L364-V406 HydrophobicContact CD2-CB 4.49Å; L364-V406 HydrophobicContact CD2-CG1 3.88Å; L364-V406 HydrophobicContact CG-CG1 3.86Å; L364-V407 HydrophobicContact CD2-CG2 3.87Å; L364-I419 HydrophobicContact CD1-CD1 4.1Å; L364-I419 HydrophobicContact CD1-CG1 4.5Å; L364-I419 HydrophobicContact CD2-CD1 4.31Å
365	S	88	Confident	82.6	Confident	32 Å²	32	40 Å²	40	22%	0.224	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-43.8	176.9	69.1	0	0	0	0	110.9	T361 L362 A367 L368 D369	T361-S365 WeakPolarHBondContact O-CB 3.28Å; T361-S365 PolarHBondContact O-N 3.41Å; T361-S365 PolarHBondContact O-OG 2.79Å; L362-S365 PolarHBondContact O-OG 3.17Å; S365-A367 VanDerWaalsContact C-N 3.34Å; S365-A367 PolarHBondContact O-N 3.17Å; S365-L368 PolarHBondContact O-N 2.87Å; S365-D369 PolarHBondContact O-N 2.66Å
366	T	89.4	Confident	81.2	Confident	23 Å²	23	41.3 Å²	41.3	14%	0.141	23%	0.227	C	C	.	.	H	α-helix	trans	-67.5	-35.1	178.8	-52.3	0	0	0	0	112.1	L321 M323 L362 L364 L368 D369 V370	L321-T366 HydrophobicContact CD1-CG2 3.66Å; L321-T366 VanDerWaalsContact CD1-OG1 3.23Å; L321-T366 WeakPolarHBondContact CD1-OG1 3.37Å; M323-T366 HydrophobicContact CE-CG2 3.86Å; L362-T366 VanDerWaalsContact O-CB 3.3Å; L362-T366 WeakPolarHBondContact O-CB 3.13Å; L362-T366 PolarHBondContact O-N 3.06Å; L362-T366 PolarHBondContact O-OG1 3.19Å; L364-T366 VanDerWaalsContact C-N 3.31Å; L364-T366 PolarHBondContact O-N 2.85Å; T366-L368 VanDerWaalsContact C-N 3.32Å; T366-L368 PolarHBondContact O-N 3.03Å; T366-D369 PolarHBondContact O-N 3.32Å; T366-V370 HydrophobicContact CG2-CG2 4.31Å; T366-V370 WeakPolarHBondContact O-CB 3.34Å; T366-V370 VanDerWaalsContact O-CG2 3.22Å; T366-V370 WeakPolarHBondContact O-CG2 3.19Å; T366-V370 PolarHBondContact O-N 2.91Å
367	A	90.1	Very high	79.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.8	-42	174.7	0	0	0	0	0	111.9	V278 V280 F315 A363 L364 S365 L371 V385	V278-A367 HydrophobicContact CB-CB 4.49Å; V278-A367 HydrophobicContact CG1-CB 3.8Å; V280-A367 HydrophobicContact CG2-CB 4Å; F315-A367 HydrophobicContact CE1-CB 4.17Å; F315-A367 HydrophobicContact CZ-CB 4.02Å; A363-A367 WeakPolarHBondContact O-CB 3.37Å; A363-A367 PolarHBondContact O-N 3.29Å; L364-A367 PolarHBondContact O-N 3.06Å; S365-A367 VanDerWaalsContact C-N 3.34Å; S365-A367 PolarHBondContact O-N 3.17Å; A367-L371 WeakPolarHBondContact O-CG 3.48Å; A367-L371 PolarHBondContact O-N 2.76Å; A367-V385 HydrophobicContact CB-CG1 3.95Å; A367-V385 HydrophobicContact CB-CG2 4.21Å
368	L	89.2	Confident	78.5	Confident	19 Å²	19	43 Å²	43	10%	0.099	24%	0.238	C	C	.	.	H	α-helix	trans	-68.6	-42.9	176.2	-63.9	171.2	0	0	0	111.5	L364 S365 T366 V370 L371 D372 V385 V406 N410 A417	L364-L368 HydrophobicContact CG-CD1 4.47Å; L364-L368 WeakPolarHBondContact O-CG 2.89Å; L364-L368 PolarHBondContact O-N 3.33Å; L364-L368 VanDerWaalsContact O-N 3.1Å; S365-L368 PolarHBondContact O-N 2.87Å; T366-L368 VanDerWaalsContact C-N 3.32Å; T366-L368 PolarHBondContact O-N 3.03Å; L368-V370 VanDerWaalsContact C-N 3.29Å; L368-V370 PolarHBondContact O-N 2.96Å; L368-L371 HydrophobicContact CD2-CD1 4.42Å; L368-L371 WeakPolarHBondContact O-CB 3.3Å; L368-L371 PolarHBondContact O-N 3.17Å; L368-L371 VanDerWaalsContact O-N 3.13Å; L368-D372 PolarHBondContact O-N 3.15Å; L368-V385 HydrophobicContact CD2-CG2 4.28Å; L368-V406 HydrophobicContact CD1-CG1 3.59Å; L368-N410 HydrophobicContact CD1-CB 3.92Å; L368-N410 HydrophobicContact CD2-CB 4.21Å; L368-A417 HydrophobicContact CD2-CB 3.8Å
369	D	87.3	Confident	77	Confident	87 Å²	87	53.9 Å²	53.9	47%	0.465	28%	0.279	S	S	.	.	H	α-helix	trans	-59.9	-39.4	175.8	-67.6	-24.2	0	0	0	111.8	S365 T366 D372 N373	S365-D369 PolarHBondContact O-N 2.66Å; T366-D369 PolarHBondContact O-N 3.32Å; D369-D372 PolarHBondContact O-N 3.16Å; D369-N373 WeakPolarHBondContact O-CB 3.43Å; D369-N373 PolarHBondContact O-N 2.94Å; D369-N373 PolarHBondContact O-ND2 3.21Å; D369-N373 VanDerWaalsContact O-ND2 3.12Å; D369-N373 PolarHBondContact O-OD1 3.09Å
370	V	86.8	Confident	75.8	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.018	29%	0.294	C	S	.	.	H	α-helix	trans	-66	-37.4	176.7	167	0	0	0	0	111.7	V278 F313 T333 T366 L368 N373 G374	V278-V370 HydrophobicContact CG2-CB 4.44Å; V278-V370 HydrophobicContact CG2-CG1 3.93Å; F313-V370 HydrophobicContact CB-CG1 3.79Å; F313-V370 HydrophobicContact CD1-CG1 3.76Å; F313-V370 HydrophobicContact CD1-CG2 4.26Å; F313-V370 HydrophobicContact CE1-CG1 4.48Å; F313-V370 HydrophobicContact CE1-CG2 4.26Å; F313-V370 HydrophobicContact CG-CG1 3.79Å; T333-V370 HydrophobicContact CG2-CG1 3.91Å; T366-V370 HydrophobicContact CG2-CG2 4.31Å; T366-V370 WeakPolarHBondContact O-CB 3.34Å; T366-V370 VanDerWaalsContact O-CG2 3.22Å; T366-V370 WeakPolarHBondContact O-CG2 3.19Å; T366-V370 PolarHBondContact O-N 2.91Å; L368-V370 VanDerWaalsContact C-N 3.29Å; L368-V370 PolarHBondContact O-N 2.96Å; V370-N373 PolarHBondContact O-N 3.28Å; V370-G374 PolarHBondContact O-N 3.21Å
371	L	86.1	Confident	74.9	Confident	8 Å²	8	56 Å²	56	4%	0.042	29%	0.292	C	S	.	.	H	α-helix	trans	-64.8	-46	174	-72.2	167.3	0	0	0	111	Q276 V278 T333 A367 L368 N373 G374 P383 V385 A417	Q276-L371 HydrophobicContact CB-CD2 4.2Å; Q276-L371 HydrophobicContact CG-CD2 3.63Å; Q276-L371 PolarHBondContact NE2-O 2.83Å; V278-L371 HydrophobicContact CG2-CD1 4.45Å; V278-L371 HydrophobicContact CG2-CD2 3.67Å; V278-L371 HydrophobicContact CG2-CG 3.69Å; T333-L371 HydrophobicContact CG2-CD2 4.29Å; A367-L371 WeakPolarHBondContact O-CG 3.48Å; A367-L371 PolarHBondContact O-N 2.76Å; L368-L371 HydrophobicContact CD2-CD1 4.42Å; L368-L371 WeakPolarHBondContact O-CB 3.3Å; L368-L371 PolarHBondContact O-N 3.17Å; L368-L371 VanDerWaalsContact O-N 3.13Å; L371-N373 PolarHBondContact O-N 2.95Å; L371-G374 PolarHBondContact O-N 3.33Å; L371-G374 VanDerWaalsContact O-N 3.08Å; L371-P383 HydrophobicContact CD1-CB 4.01Å; L371-P383 HydrophobicContact CD2-CB 4Å; L371-P383 HydrophobicContact CG-CB 4.44Å; L371-V385 HydrophobicContact CD1-CG2 3.58Å; L371-A417 HydrophobicContact CD1-CB 3.77Å
372	D	81.3	Confident	74.4	Confident	112 Å²	112	59.3 Å²	59.3	60%	0.599	31%	0.305	S	S	*	.	H	α-helix	trans	-64.9	-27.8	178	-75.6	-13.6	0	0	0	112.8	L368 D369	L368-D372 PolarHBondContact O-N 3.15Å; D369-D372 PolarHBondContact O-N 3.16Å
373	N	76.3	Confident	74.4	Confident	35 Å²	35	56.7 Å²	56.7	19%	0.187	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-11.4	175.9	-67.9	-23.2	0	0	0	114	N331 A332 D369 V370 L371 R1042	N331-N373 WeakPolarHBondContact O-CB 3.23Å; N331-N373 PolarHBondContact O-ND2 2.78Å; A332-N373 HydrophobicContact CB-CB 4.1Å; A332-N373 WeakPolarHBondContact CB-O 3.27Å; D369-N373 WeakPolarHBondContact O-CB 3.43Å; D369-N373 PolarHBondContact O-N 2.94Å; D369-N373 PolarHBondContact O-ND2 3.21Å; D369-N373 VanDerWaalsContact O-ND2 3.12Å; D369-N373 PolarHBondContact O-OD1 3.09Å; V370-N373 PolarHBondContact O-N 3.28Å; L371-N373 PolarHBondContact O-N 2.95Å; N373-R1042 PolarHBondContact OD1-NH1 3.09Å
374	G	67	Low	74.5	Confident	11 Å²	11	57.2 Å²	57.2	11%	0.113	29%	0.294	C	S	.	.	S	Bend	trans	-65.9	-178.9	177	0	0	0	0	0	113.3	T333 V370 L371	T333-G374 VanDerWaalsContact OG1-CA 3.31Å; T333-G374 WeakPolarHBondContact OG1-CA 3.34Å; V370-G374 PolarHBondContact O-N 3.21Å; L371-G374 PolarHBondContact O-N 3.33Å; L371-G374 VanDerWaalsContact O-N 3.08Å
375	R	60.5	Low	74.7	Confident	96 Å²	96	56.7 Å²	56.7	36%	0.362	29%	0.291	S	S	.	.			trans	-66.3	142	172	-72.6	178.1	171.4	-170	-8.9	107.1	E311 L377 S1038 Y1039 P1041	E311-R375 WeakPolarHBondContact OE1-CB 3.2Å; E311-R375 WeakPolarHBondContact OE1-CD 3.16Å; E311-R375 WeakPolarHBondContact OE1-CG 3.42Å; R375-L377 HydrophobicContact CB-CG 4.27Å; R375-L377 PolarHBondContact O-N 2.79Å; R375-S1038 PolarHBondContact NH2-O 3.27Å; R375-Y1039 PolarHBondContact NE-O 2.56Å; R375-P1041 HydrophobicContact CB-CB 4.31Å; R375-P1041 HydrophobicContact CB-CG 4.47Å; R375-P1041 HydrophobicContact CG-CB 3.55Å; R375-P1041 HydrophobicContact CG-CG 3.77Å; R375-P1041 VanDerWaalsContact N-CG 3.29Å
376	S	52.6	Low	74.9	Confident	127 Å²	127	55.2 Å²	55.2	89%	0.888	28%	0.281	S	S	*	.			trans	-66.7	74.2	158.4	177.5	0	0	0	0	107
377	L	51.8	Low	75	Confident	52 Å²	52	55 Å²	55	27%	0.272	28%	0.277	S	S	.	.			trans	-55.7	161.7	166.7	-78.8	157.4	0	0	0	108.4	Q276 E311 R375 R379 A381	Q276-L377 HydrophobicContact CB-CD1 4.48Å; E311-L377 HydrophobicContact CB-CD1 4.22Å; E311-L377 VanDerWaalsContact CD-CD1 3.41Å; E311-L377 HydrophobicContact CG-CD1 3.74Å; R375-L377 HydrophobicContact CB-CG 4.27Å; R375-L377 PolarHBondContact O-N 2.79Å; L377-R379 PolarHBondContact O-N 3.23Å; L377-A381 HydrophobicContact CB-CB 3.75Å
378	D	51.6	Low	75	Confident	124 Å²	124	55 Å²	55	66%	0.663	28%	0.277	S	S	*	.			trans	-37.4	140.5	-179.9	-154	-6	0	0	0	111.1	D380 A381	D378-D380 PolarHBondContact O-N 3.44Å; D378-A381 WeakPolarHBondContact O-CB 3.36Å; D378-A381 PolarHBondContact O-N 2.79Å
379	R	50.5	Low	74.8	Confident	232 Å²	232	54.3 Å²	54.3	88%	0.875	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-12.3	-174.3	-75.6	-173.5	179.5	-163.5	0.4	113.3	L377	L377-R379 PolarHBondContact O-N 3.23Å
380	D	56.8	Low	74.2	Confident	115 Å²	115	52.8 Å²	52.8	62%	0.615	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-13.2	177.6	-66.1	-23.1	0	0	0	114.9	D378 K382	D378-D380 PolarHBondContact O-N 3.44Å; D380-K382 PolarHBondContact O-N 2.87Å
381	A	65	Low	73.2	Confident	8 Å²	8	54.4 Å²	54.4	7%	0.066	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-68.8	122.7	178.3	0	0	0	0	0	110.5	L377 D378 P383	L377-A381 HydrophobicContact CB-CB 3.75Å; D378-A381 WeakPolarHBondContact O-CB 3.36Å; D378-A381 PolarHBondContact O-N 2.79Å; A381-P383 VanDerWaalsContact O-CD 3.31Å; A381-P383 WeakPolarHBondContact O-CD 3.46Å
382	K	71.7	Confident	71.8	Confident	89 Å²	89	57.2 Å²	57.2	39%	0.387	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	117.6	-176	-71.2	159.1	-165.7	-78.4	0	109.9	Q276 D380	Q276-K382 PolarHBondContact N-O 2.92Å; D380-K382 PolarHBondContact O-N 2.87Å
383	P	86.7	Confident	70.2	Confident	7 Å²	7	55.1 Å²	55.1	5%	0.045	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	132.3	170.9	21.1	-21.4	0	0	0	110.3	Q276 L371 A381 A417 E418	Q276-P383 CarbonylContact O-C 3.55Å; Q276-P383 WeakPolarHBondContact O-CA 2.95Å; L371-P383 HydrophobicContact CD1-CB 4.01Å; L371-P383 HydrophobicContact CD2-CB 4Å; L371-P383 HydrophobicContact CG-CB 4.44Å; A381-P383 VanDerWaalsContact O-CD 3.31Å; A381-P383 WeakPolarHBondContact O-CD 3.46Å; P383-A417 HydrophobicContact CB-CB 3.99Å; P383-A417 HydrophobicContact CG-CB 4.25Å; P383-A417 CarbonylContact O-C 3.53Å; P383-A417 VanDerWaalsContact O-CA 3.31Å; P383-A417 WeakPolarHBondContact O-CA 3.5Å; P383-E418 PolarHBondContact O-N 3.5Å
384	I	89.7	Confident	68.4	Low	11 Å²	11	62 Å²	62	6%	0.056	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	125.3	-176.4	-53.6	173.2	0	0	0	109.2	K275 Q276 V277 V278 L386 E418 V420 F503	K275-I384 HydrophobicContact CB-CD1 4.49Å; K275-I384 HydrophobicContact CD-CD1 4.43Å; K275-I384 HydrophobicContact CG-CD1 4.3Å; Q276-I384 PolarHBondContact O-N 3.17Å; V277-I384 WeakPolarHBondContact CA-O 3.4Å; V277-I384 HydrophobicContact CG2-CB 4.45Å; V278-I384 PolarHBondContact N-O 2.83Å; I384-L386 HydrophobicContact CG2-CD2 3.57Å; I384-L386 HydrophobicContact CG2-CG 3.98Å; I384-E418 CarbonylContact C-O 3.52Å; I384-E418 WeakPolarHBondContact CA-O 3.15Å; I384-V420 HydrophobicContact CG2-CG2 4.14Å; I384-F503 HydrophobicContact CD1-CD1 4.25Å; I384-F503 HydrophobicContact CD1-CE1 4.36Å
385	V	90.8	Very high	67.3	Low	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	111.2	170	-179.1	0	0	0	0	108.5	V280 L364 A367 L368 L371 A417 E418 I419 V420	V280-V385 HydrophobicContact CG2-CG1 4.26Å; L364-V385 HydrophobicContact CD1-CG1 4.21Å; A367-V385 HydrophobicContact CB-CG1 3.95Å; A367-V385 HydrophobicContact CB-CG2 4.21Å; L368-V385 HydrophobicContact CD2-CG2 4.28Å; L371-V385 HydrophobicContact CD1-CG2 3.58Å; V385-A417 HydrophobicContact CG2-CB 4.21Å; V385-E418 PolarHBondContact N-O 2.96Å; V385-I419 HydrophobicContact CB-CG1 4.43Å; V385-V420 PolarHBondContact O-N 3.11Å
386	L	92.2	Very high	66.6	Low	1 Å²	1	59.4 Å²	59.4	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	94.8	175.7	-59.3	-179.7	0	0	0	109.1	V277 V278 I279 V280 L302 I384 V420 L422 L502 F503	V277-L386 HydrophobicContact CG1-CD1 3.51Å; V277-L386 HydrophobicContact CG1-CG 3.89Å; V278-L386 PolarHBondContact O-N 3.31Å; I279-L386 WeakPolarHBondContact CA-O 3.36Å; I279-L386 HydrophobicContact CG1-CB 4.38Å; I279-L386 HydrophobicContact CG1-CD1 4.32Å; V280-L386 PolarHBondContact N-O 2.92Å; L302-L386 HydrophobicContact CB-CD1 4.29Å; L302-L386 HydrophobicContact CD1-CB 4.37Å; L302-L386 HydrophobicContact CD1-CD1 3.85Å; L302-L386 HydrophobicContact CD2-CD1 4Å; L302-L386 HydrophobicContact CG-CD1 4.26Å; I384-L386 HydrophobicContact CG2-CD2 3.57Å; I384-L386 HydrophobicContact CG2-CG 3.98Å; L386-V420 HydrophobicContact CD2-CB 3.79Å; L386-V420 HydrophobicContact CD2-CG1 4.47Å; L386-V420 HydrophobicContact CD2-CG2 3.97Å; L386-L422 HydrophobicContact CB-CD1 4.25Å; L386-L422 HydrophobicContact CD2-CD1 4.38Å; L386-L502 HydrophobicContact CD1-CD2 4.42Å; L386-L502 HydrophobicContact CD2-CD1 3.83Å; L386-L502 HydrophobicContact CD2-CD2 4.08Å; L386-L502 HydrophobicContact CD2-CG 4.37Å; L386-F503 HydrophobicContact CD1-CZ 4.42Å
387	Y	90.5	Very high	66.3	Low	17 Å²	17	57.9 Å²	57.9	7%	0.067	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	110.8	-178.3	-158	-61.9	0	0	0	110.4	V280 Q282 H360 A363 V420 N421 L422	V280-Y387 HydrophobicContact CB-CD2 3.9Å; V280-Y387 HydrophobicContact CB-CE2 4.18Å; V280-Y387 HydrophobicContact CB-CG 4.18Å; V280-Y387 HydrophobicContact CG1-CD2 3.94Å; V280-Y387 HydrophobicContact CG1-CE1 4.44Å; V280-Y387 HydrophobicContact CG1-CE2 3.68Å; V280-Y387 HydrophobicContact CG1-CG 4.44Å; V280-Y387 HydrophobicContact CG2-CD2 4.27Å; Q282-Y387 HydrophobicContact CB-CE1 4.39Å; H360-Y387 AromaticContact ND1-CZ 3.64Å; H360-Y387 PolarHBondContact ND1-OH 2.88Å; A363-Y387 HydrophobicContact CB-CE2 3.96Å; Y387-V420 PolarHBondContact N-O 2.99Å; Y387-N421 CarbonylContact O-C 3.55Å; Y387-N421 WeakPolarHBondContact O-CA 3.37Å; Y387-N421 PolarHBondContact O-OD1 2.69Å; Y387-L422 PolarHBondContact O-N 3.22Å
388	I	91.3	Very high	66.1	Low	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	112.2	178.3	-55.3	173	0	0	0	108.8	I279 V280 V281 Q282 A295 V298 A299 L302 L422 I424	I279-I388 HydrophobicContact CG2-CD1 4Å; V280-I388 PolarHBondContact O-N 2.89Å; V281-I388 HydrophobicContact CG2-CD1 4.36Å; Q282-I388 VanDerWaalsContact CB-O 3.29Å; Q282-I388 WeakPolarHBondContact CB-O 3.2Å; Q282-I388 PolarHBondContact N-O 3.17Å; A295-I388 HydrophobicContact CB-CG2 3.77Å; V298-I388 HydrophobicContact CB-CD1 4.23Å; V298-I388 HydrophobicContact CG1-CD1 3.83Å; V298-I388 HydrophobicContact CG1-CG1 4.32Å; A299-I388 HydrophobicContact CB-CD1 3.73Å; L302-I388 HydrophobicContact CD1-CD1 4.25Å; I388-L422 WeakPolarHBondContact CA-O 3.4Å; I388-L422 HydrophobicContact CG1-CB 4.34Å; I388-L422 HydrophobicContact CG1-CD1 4.37Å; I388-I424 HydrophobicContact CG2-CD1 3.57Å; I388-I424 HydrophobicContact CG2-CG1 4.1Å
389	S	85.4	Confident	66	Low	6 Å²	6	60.6 Å²	60.6	4%	0.042	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	168	-173.2	78.3	0	0	0	0	113.1	Q282 G391 N421 L422 V423 I424	Q282-S389 VanDerWaalsContact OE1-CB 3.25Å; S389-G391 PolarHBondContact OG-N 3.44Å; S389-N421 PolarHBondContact OG-OD1 2.7Å; S389-L422 PolarHBondContact N-O 2.87Å; S389-V423 CarbonylContact O-C 3.2Å; S389-V423 WeakPolarHBondContact O-CA 3.46Å; S389-I424 PolarHBondContact O-N 3.26Å
390	R	74.7	Confident	66.4	Low	54 Å²	54	51 Å²	51	20%	0.204	27%	0.269	C	S	.	.			trans	-81.7	-14.2	168.9	-173.7	173.9	168.6	179.9	-0.3	113.2	G286 M287 Q291 L392	G286-R390 WeakPolarHBondContact O-CD 3.25Å; G286-R390 PolarHBondContact O-NH1 3.46Å; M287-R390 HydrophobicContact SD-CB 3.86Å; Q291-R390 VanDerWaalsContact OE1-CD 3.32Å; R390-L392 VanDerWaalsContact C-N 3.31Å; R390-L392 HydrophobicContact CG-CD1 4.16Å; R390-L392 HydrophobicContact CG-CG 4.04Å; R390-L392 VanDerWaalsContact CZ-CD1 3.44Å; R390-L392 VanDerWaalsContact NE-CD1 3.26Å; R390-L392 PolarHBondContact O-N 3.19Å
391	G	65.3	Low	66.5	Low	38 Å²	38	50.3 Å²	50.3	39%	0.392	27%	0.269	S	S	.	.			trans	69.8	17	-175.8	0	0	0	0	0	115.9	S389	S389-G391 PolarHBondContact OG-N 3.44Å
392	L	55.9	Low	66.6	Low	67 Å²	67	58 Å²	58	35%	0.351	30%	0.297	S	S	.	.			trans	-85.2	114.3	175.4	-75.4	178.8	0	0	0	111.8	R390 F394	R390-L392 VanDerWaalsContact C-N 3.31Å; R390-L392 HydrophobicContact CG-CD1 4.16Å; R390-L392 HydrophobicContact CG-CG 4.04Å; R390-L392 VanDerWaalsContact CZ-CD1 3.44Å; R390-L392 VanDerWaalsContact NE-CD1 3.26Å; R390-L392 PolarHBondContact O-N 3.19Å; L392-F394 VanDerWaalsContact C-N 3.33Å; L392-F394 PolarHBondContact O-N 2.91Å
393	Q	48.2	Very low	66.5	Low	67 Å²	67	55.2 Å²	55.2	31%	0.313	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-69.9	-17.2	-179.4	-169.2	73.3	14.7	0	0	115	Q395 L396 N400 L437	Q393-Q395 PolarHBondContact O-N 3.21Å; Q393-L396 VanDerWaalsContact CD-CD1 3.44Å; Q393-L396 HydrophobicContact CG-CB 4.35Å; Q393-L396 HydrophobicContact CG-CD1 4.45Å; Q393-L396 VanDerWaalsContact NE2-CB 3.35Å; Q393-L396 VanDerWaalsContact NE2-CD1 3.32Å; Q393-L396 PolarHBondContact O-N 3.19Å; Q393-N400 PolarHBondContact NE2-OD1 2.88Å; Q393-L437 HydrophobicContact CB-CD1 3.35Å; Q393-L437 HydrophobicContact CB-CD2 4.48Å; Q393-L437 HydrophobicContact CG-CD1 3.29Å
394	F	38.2	Very low	65.7	Low	179 Å²	179	57 Å²	57	79%	0.785	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-57.4	-9.3	-162.2	-157.9	-94.7	0	0	0	115	L392	L392-F394 VanDerWaalsContact C-N 3.33Å; L392-F394 PolarHBondContact O-N 2.91Å
395	Q	44.3	Very low	65	Low	37 Å²	37	61.3 Å²	61.3	17%	0.173	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-100.9	3.6	-179.4	-49.8	-170.6	-15.9	0	0	114.9	L285 F357 T358 Q393	L285-Q395 PolarHBondContact O-NE2 2.79Å; F357-Q395 HydrophobicContact CD1-CB 4.07Å; F357-Q395 HydrophobicContact CD1-CG 3.42Å; F357-Q395 VanDerWaalsContact CD1-CG 3.42Å; F357-Q395 HydrophobicContact CE1-CG 3.8Å; T358-Q395 VanDerWaalsContact N-OE1 3.13Å; Q393-Q395 PolarHBondContact O-N 3.21Å
396	L	45.3	Very low	64.3	Low	17 Å²	17	62.4 Å²	62.4	9%	0.089	33%	0.325	C	S	.	.			trans	-105.2	-2.9	-168.3	-81.1	169	0	0	0	116.3	H360 Q393 E398 N399 N400 L403	H360-L396 HydrophobicContact CB-CD2 4.49Å; Q393-L396 VanDerWaalsContact CD-CD1 3.44Å; Q393-L396 HydrophobicContact CG-CB 4.35Å; Q393-L396 HydrophobicContact CG-CD1 4.45Å; Q393-L396 VanDerWaalsContact NE2-CB 3.35Å; Q393-L396 VanDerWaalsContact NE2-CD1 3.32Å; Q393-L396 PolarHBondContact O-N 3.19Å; L396-E398 PolarHBondContact O-N 2.94Å; L396-N399 HydrophobicContact CD2-CB 4.15Å; L396-N399 PolarHBondContact O-N 3.45Å; L396-N400 WeakPolarHBondContact CB-OD1 3.32Å; L396-N400 WeakPolarHBondContact O-CA 3.47Å; L396-N400 WeakPolarHBondContact O-CB 3.4Å; L396-N400 PolarHBondContact O-N 3.17Å; L396-N400 PolarHBondContact O-OD1 3.11Å; L396-L403 HydrophobicContact CD2-CD2 3.79Å
397	A	46.9	Very low	63.5	Low	94 Å²	94	63.5 Å²	63.5	78%	0.777	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-41.1	-175.6	0	0	0	0	0	113.7
398	E	47.1	Very low	62.8	Low	186 Å²	186	64.9 Å²	64.9	87%	0.869	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-24.8	174.3	-79.3	-177.5	152	0	0	113.6	L396	L396-E398 PolarHBondContact O-N 2.94Å
399	N	50.4	Low	62.3	Low	47 Å²	47	67.8 Å²	67.8	25%	0.251	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-12.9	-175.6	-74.8	-27.4	0	0	0	114.3	L396 V401 R402 L403	L396-N399 HydrophobicContact CD2-CB 4.15Å; L396-N399 PolarHBondContact O-N 3.45Å; N399-V401 PolarHBondContact O-N 3.46Å; N399-R402 PolarHBondContact O-N 2.98Å; N399-L403 WeakPolarHBondContact O-CB 3.45Å; N399-L403 PolarHBondContact O-N 3.2Å
400	N	57.7	Low	62.1	Low	30 Å²	30	68.2 Å²	68.2	16%	0.16	37%	0.367	C	S	.	.	H	α-helix	trans	-57.8	-46.1	-175.5	-97.2	-13.3	0	0	0	112.7	Q393 L396 R402 L403 N404 L444	Q393-N400 PolarHBondContact NE2-OD1 2.88Å; L396-N400 WeakPolarHBondContact CB-OD1 3.32Å; L396-N400 WeakPolarHBondContact O-CA 3.47Å; L396-N400 WeakPolarHBondContact O-CB 3.4Å; L396-N400 PolarHBondContact O-N 3.17Å; L396-N400 PolarHBondContact O-OD1 3.11Å; N400-R402 VanDerWaalsContact C-N 3.35Å; N400-R402 PolarHBondContact O-N 2.87Å; N400-L403 PolarHBondContact O-N 3.28Å; N400-N404 PolarHBondContact O-N 3.36Å; N400-N404 PolarHBondContact O-ND2 3.37Å; N400-N404 PolarHBondContact O-OD1 3.01Å; N400-L444 HydrophobicContact CB-CD1 4.46Å
401	V	59.2	Low	62.4	Low	102 Å²	102	69.8 Å²	69.8	62%	0.618	38%	0.377	S	S	*	.	H	α-helix	trans	-58	-49.8	-178.9	-178.5	0	0	0	0	110.1	N399 L403 N404 D405	N399-V401 PolarHBondContact O-N 3.46Å; V401-L403 PolarHBondContact O-N 2.68Å; V401-N404 PolarHBondContact O-N 3.4Å; V401-D405 VanDerWaalsContact O-CG 3.25Å; V401-D405 PolarHBondContact O-N 3.23Å; V401-D405 VanDerWaalsContact O-N 3.11Å
402	R	67.9	Low	63.1	Low	170 Å²	170	77.7 Å²	77.7	64%	0.642	40%	0.395	S	S	*	.	H	α-helix	trans	-67.4	-36.2	179.6	-65.6	-175.7	173.8	-179.8	-0.9	113.1	T361 N399 N400 N404 D405 V406	T361-R402 HydrophobicContact CG2-CB 3.87Å; N399-R402 PolarHBondContact O-N 2.98Å; N400-R402 VanDerWaalsContact C-N 3.35Å; N400-R402 PolarHBondContact O-N 2.87Å; R402-N404 VanDerWaalsContact C-N 3.35Å; R402-D405 WeakPolarHBondContact O-CB 3.15Å; R402-D405 PolarHBondContact O-N 3.38Å; R402-V406 WeakPolarHBondContact O-CG2 3.41Å; R402-V406 PolarHBondContact O-N 3.28Å
403	L	69.4	Low	64.1	Low	30 Å²	30	76.6 Å²	76.6	16%	0.157	39%	0.393	C	S	.	.	H	α-helix	trans	-66.4	-40.2	177.8	-171.9	67.6	0	0	0	111.1	H360 L364 L396 N399 N400 V401 D405 V406 V407	H360-L403 HydrophobicContact CB-CD1 4.42Å; L364-L403 HydrophobicContact CB-CD1 4.24Å; L364-L403 HydrophobicContact CD2-CD1 3.79Å; L396-L403 HydrophobicContact CD2-CD2 3.79Å; N399-L403 WeakPolarHBondContact O-CB 3.45Å; N399-L403 PolarHBondContact O-N 3.2Å; N400-L403 PolarHBondContact O-N 3.28Å; V401-L403 PolarHBondContact O-N 2.68Å; L403-D405 VanDerWaalsContact C-N 3.3Å; L403-D405 PolarHBondContact O-N 3.18Å; L403-V406 WeakPolarHBondContact O-CB 3.43Å; L403-V406 PolarHBondContact O-N 3.03Å; L403-V407 WeakPolarHBondContact O-CG2 3.47Å; L403-V407 PolarHBondContact O-N 3.17Å
404	N	70.2	Confident	65.4	Low	45 Å²	45	78.7 Å²	78.7	24%	0.241	42%	0.421	C	S	.	.	H	α-helix	trans	-63.9	-37.6	175.1	-63	-26.9	0	0	0	111.9	N400 V401 R402 V406 V407 T408 L444	N400-N404 PolarHBondContact O-N 3.36Å; N400-N404 PolarHBondContact O-ND2 3.37Å; N400-N404 PolarHBondContact O-OD1 3.01Å; V401-N404 PolarHBondContact O-N 3.4Å; R402-N404 VanDerWaalsContact C-N 3.35Å; N404-V406 VanDerWaalsContact C-N 3.28Å; N404-V406 PolarHBondContact O-N 2.89Å; N404-V407 PolarHBondContact O-N 2.96Å; N404-T408 VanDerWaalsContact O-CB 3.27Å; N404-T408 WeakPolarHBondContact O-CB 3.18Å; N404-T408 PolarHBondContact O-N 2.81Å; N404-T408 PolarHBondContact O-OG1 3.02Å; N404-L444 HydrophobicContact CB-CD2 4.34Å; N404-L444 WeakPolarHBondContact ND2-CD1 3.41Å; N404-L444 WeakPolarHBondContact ND2-CD2 3.34Å; N404-L444 VanDerWaalsContact OD1-CD2 3.23Å; N404-L444 WeakPolarHBondContact OD1-CD2 3.29Å
405	D	73.6	Confident	67.2	Low	101 Å²	101	73.8 Å²	73.8	54%	0.54	40%	0.403	S	S	.	.	H	α-helix	trans	-59.4	-42.2	174.7	-63.4	-29.5	0	0	0	110.9	V401 R402 L403 T408 A409	V401-D405 VanDerWaalsContact O-CG 3.25Å; V401-D405 PolarHBondContact O-N 3.23Å; V401-D405 VanDerWaalsContact O-N 3.11Å; R402-D405 WeakPolarHBondContact O-CB 3.15Å; R402-D405 PolarHBondContact O-N 3.38Å; L403-D405 VanDerWaalsContact C-N 3.3Å; L403-D405 PolarHBondContact O-N 3.18Å; D405-T408 PolarHBondContact O-N 3.21Å; D405-A409 WeakPolarHBondContact O-CB 3.35Å; D405-A409 PolarHBondContact O-N 3.14Å
406	V	76.5	Confident	69	Low	23 Å²	23	73 Å²	73	14%	0.139	40%	0.401	C	S	.	.	H	α-helix	trans	-65.3	-44.6	176.4	177.4	0	0	0	0	111.7	T361 L364 L368 R402 L403 N404 A409 N410	T361-V406 HydrophobicContact CG2-CG2 3.96Å; L364-V406 HydrophobicContact CB-CG1 4.3Å; L364-V406 HydrophobicContact CD2-CB 4.49Å; L364-V406 HydrophobicContact CD2-CG1 3.88Å; L364-V406 HydrophobicContact CG-CG1 3.86Å; L368-V406 HydrophobicContact CD1-CG1 3.59Å; R402-V406 WeakPolarHBondContact O-CG2 3.41Å; R402-V406 PolarHBondContact O-N 3.28Å; L403-V406 WeakPolarHBondContact O-CB 3.43Å; L403-V406 PolarHBondContact O-N 3.03Å; N404-V406 VanDerWaalsContact C-N 3.28Å; N404-V406 PolarHBondContact O-N 2.89Å; V406-A409 PolarHBondContact O-N 3.4Å; V406-N410 PolarHBondContact O-N 3.31Å
407	V	76	Confident	70.9	Confident	24 Å²	24	72.3 Å²	72.3	15%	0.145	40%	0.398	C	S	.	.	H	α-helix	trans	-64	-44.2	177.2	174.2	0	0	0	0	111	L364 L403 N404 A409 N410 E411 I419 I481	L364-V407 HydrophobicContact CD2-CG2 3.87Å; L403-V407 WeakPolarHBondContact O-CG2 3.47Å; L403-V407 PolarHBondContact O-N 3.17Å; N404-V407 PolarHBondContact O-N 2.96Å; V407-A409 VanDerWaalsContact C-N 3.33Å; V407-A409 PolarHBondContact O-N 2.87Å; V407-N410 WeakPolarHBondContact O-CB 3.5Å; V407-N410 PolarHBondContact O-N 2.71Å; V407-E411 PolarHBondContact O-N 3.06Å; V407-I419 HydrophobicContact CG2-CD1 4.5Å; V407-I481 HydrophobicContact CG1-CD1 4.08Å
408	T	76.4	Confident	72.7	Confident	46 Å²	46	69.7 Å²	69.7	28%	0.282	37%	0.37	S	S	.	.	H	α-helix	trans	-66.4	-36.6	178.4	-48.8	0	0	0	0	111.1	N404 D405 E411 R412	N404-T408 VanDerWaalsContact O-CB 3.27Å; N404-T408 WeakPolarHBondContact O-CB 3.18Å; N404-T408 PolarHBondContact O-N 2.81Å; N404-T408 PolarHBondContact O-OG1 3.02Å; D405-T408 PolarHBondContact O-N 3.21Å; T408-E411 PolarHBondContact O-N 3.04Å; T408-R412 WeakPolarHBondContact O-CG 3.33Å; T408-R412 PolarHBondContact O-N 3.13Å; T408-R412 VanDerWaalsContact O-N 3.12Å
409	A	79.5	Confident	74.4	Confident	60 Å²	60	61.5 Å²	61.5	50%	0.496	33%	0.332	S	S	.	.	H	α-helix	trans	-63.5	-42.3	173.8	0	0	0	0	0	111.5	D405 V406 V407 R412 S413	D405-A409 WeakPolarHBondContact O-CB 3.35Å; D405-A409 PolarHBondContact O-N 3.14Å; V406-A409 PolarHBondContact O-N 3.4Å; V407-A409 VanDerWaalsContact C-N 3.33Å; V407-A409 PolarHBondContact O-N 2.87Å; A409-R412 PolarHBondContact O-N 2.63Å; A409-S413 PolarHBondContact O-N 3.34Å; A409-S413 VanDerWaalsContact O-N 3.14Å
410	N	82.3	Confident	76.1	Confident	15 Å²	15	59.3 Å²	59.3	8%	0.08	32%	0.32	C	S	.	.	H	α-helix	trans	-60.9	-46.1	173.1	179	52.8	0	0	0	111.7	L368 V406 V407 R412 S413 P416 A417	L368-N410 HydrophobicContact CD1-CB 3.92Å; L368-N410 HydrophobicContact CD2-CB 4.21Å; V406-N410 PolarHBondContact O-N 3.31Å; V407-N410 WeakPolarHBondContact O-CB 3.5Å; V407-N410 PolarHBondContact O-N 2.71Å; N410-R412 PolarHBondContact O-N 2.78Å; N410-S413 VanDerWaalsContact O-CB 3.23Å; N410-S413 WeakPolarHBondContact O-CB 3.46Å; N410-S413 PolarHBondContact O-N 3.4Å; N410-P416 VanDerWaalsContact O-CB 3.25Å; N410-P416 WeakPolarHBondContact O-CB 3.21Å; N410-A417 PolarHBondContact ND2-O 2.98Å; N410-A417 PolarHBondContact OD1-N 3.23Å
411	E	80.8	Confident	77.3	Confident	87 Å²	87	60 Å²	60	41%	0.407	32%	0.324	S	S	.	.	H	α-helix	trans	-59	-29.5	177	-72.7	-176.5	165.2	0	0	113.4	V407 T408	V407-E411 PolarHBondContact O-N 3.06Å; T408-E411 PolarHBondContact O-N 3.04Å
412	R	79.6	Confident	78.6	Confident	205 Å²	205	55.2 Å²	55.2	77%	0.774	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-7.6	177.2	-68.2	175.7	-175.1	172.1	4.6	113.9	T408 A409 N410	T408-R412 WeakPolarHBondContact O-CG 3.33Å; T408-R412 PolarHBondContact O-N 3.13Å; T408-R412 VanDerWaalsContact O-N 3.12Å; A409-R412 PolarHBondContact O-N 2.63Å; N410-R412 PolarHBondContact O-N 2.78Å
413	S	76.9	Confident	79.2	Confident	44 Å²	44	47.9 Å²	47.9	31%	0.308	27%	0.269	S	S	.	.	S	Bend	trans	-65.7	152	178	-178.4	0	0	0	0	111.4	A409 N410 N415 P416	A409-S413 PolarHBondContact O-N 3.34Å; A409-S413 VanDerWaalsContact O-N 3.14Å; N410-S413 VanDerWaalsContact O-CB 3.23Å; N410-S413 WeakPolarHBondContact O-CB 3.46Å; N410-S413 PolarHBondContact O-N 3.4Å; S413-N415 PolarHBondContact O-N 3.3Å; S413-N415 PolarHBondContact OG-N 2.73Å; S413-P416 WeakPolarHBondContact O-CD 3.49Å; S413-P416 WeakPolarHBondContact O-CG 3.18Å
414	A	74.6	Confident	79.8	Confident	111 Å²	111	46.5 Å²	46.5	92%	0.917	26%	0.262	S	S	*	.	S	Bend	trans	-62.6	-28.6	175.4	0	0	0	0	0	112.4
415	N	77.5	Confident	79.9	Confident	76 Å²	76	48.4 Å²	48.4	41%	0.406	27%	0.266	S	S	.	.	S	Bend	trans	-132.1	79.6	174.6	-167.5	18.3	0	0	0	110.2	S413 A417	S413-N415 PolarHBondContact O-N 3.3Å; S413-N415 PolarHBondContact OG-N 2.73Å; N415-A417 PolarHBondContact O-N 3.03Å
416	P	81.6	Confident	79.6	Confident	20 Å²	20	45.4 Å²	45.4	13%	0.13	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-65.4	130.3	-174.4	-14.2	25.7	0	0	0	111.4	N410 S413 R480	N410-P416 VanDerWaalsContact O-CB 3.25Å; N410-P416 WeakPolarHBondContact O-CB 3.21Å; S413-P416 WeakPolarHBondContact O-CD 3.49Å; S413-P416 WeakPolarHBondContact O-CG 3.18Å; P416-R480 VanDerWaalsContact CB-NH1 3.34Å; P416-R480 VanDerWaalsContact CG-NH1 3.29Å
417	A	85	Confident	78.7	Confident	3 Å²	3	48.2 Å²	48.2	3%	0.025	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-69.9	140.6	174.4	0	0	0	0	0	111.9	L368 L371 P383 V385 N410 N415	L368-A417 HydrophobicContact CD2-CB 3.8Å; L371-A417 HydrophobicContact CD1-CB 3.77Å; P383-A417 HydrophobicContact CB-CB 3.99Å; P383-A417 HydrophobicContact CG-CB 4.25Å; P383-A417 CarbonylContact O-C 3.53Å; P383-A417 VanDerWaalsContact O-CA 3.31Å; P383-A417 WeakPolarHBondContact O-CA 3.5Å; V385-A417 HydrophobicContact CG2-CB 4.21Å; N410-A417 PolarHBondContact ND2-O 2.98Å; N410-A417 PolarHBondContact OD1-N 3.23Å; N415-A417 PolarHBondContact O-N 3.03Å
418	E	84.9	Confident	77.6	Confident	38 Å²	38	52 Å²	52	18%	0.178	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	118.8	169.2	-171.9	174.2	178.7	0	0	109.3	P383 I384 V385 V420 K482	P383-E418 PolarHBondContact O-N 3.5Å; I384-E418 CarbonylContact C-O 3.52Å; I384-E418 WeakPolarHBondContact CA-O 3.15Å; V385-E418 PolarHBondContact N-O 2.96Å; E418-V420 HydrophobicContact CG-CG2 4.37Å; E418-K482 WeakPolarHBondContact OE1-CD 3.37Å; E418-K482 WeakPolarHBondContact OE1-CE 3.19Å; E418-K482 IonicContact OE1-NZ 2.71Å; E418-K482 PolarHBondContact OE1-NZ 2.68Å
419	I	82.6	Confident	76	Confident	15 Å²	15	55.5 Å²	55.5	8%	0.077	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	116	-177.2	-59.3	170.4	0	0	0	108.2	L364 V385 V407 R480 I481 K482	L364-I419 HydrophobicContact CD1-CD1 4.1Å; L364-I419 HydrophobicContact CD1-CG1 4.5Å; L364-I419 HydrophobicContact CD2-CD1 4.31Å; V385-I419 HydrophobicContact CB-CG1 4.43Å; V407-I419 HydrophobicContact CG2-CD1 4.5Å; I419-R480 PolarHBondContact N-O 2.82Å; I419-I481 HydrophobicContact CB-CG1 4.49Å; I419-I481 CarbonylContact O-C 3.56Å; I419-I481 VanDerWaalsContact O-CA 3.26Å; I419-I481 WeakPolarHBondContact O-CA 3.48Å; I419-K482 PolarHBondContact O-N 2.75Å
420	V	85.1	Confident	74	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.006	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	112.7	176.7	-169.8	0	0	0	0	110	I384 V385 L386 Y387 E418 L422 K482 I484 L502	I384-V420 HydrophobicContact CG2-CG2 4.14Å; V385-V420 PolarHBondContact O-N 3.11Å; L386-V420 HydrophobicContact CD2-CB 3.79Å; L386-V420 HydrophobicContact CD2-CG1 4.47Å; L386-V420 HydrophobicContact CD2-CG2 3.97Å; Y387-V420 PolarHBondContact N-O 2.99Å; E418-V420 HydrophobicContact CG-CG2 4.37Å; V420-L422 HydrophobicContact CG1-CD1 4.13Å; V420-K482 CarbonylContact C-O 3.56Å; V420-K482 WeakPolarHBondContact CA-O 3.49Å; V420-K482 HydrophobicContact CB-CB 4.29Å; V420-K482 HydrophobicContact CG1-CB 3.86Å; V420-K482 HydrophobicContact CG2-CB 4.08Å; V420-K482 HydrophobicContact CG2-CD 4.4Å; V420-I484 HydrophobicContact CG1-CD1 3.97Å; V420-I484 HydrophobicContact CG1-CG1 4.11Å; V420-L502 HydrophobicContact CB-CD1 4.04Å; V420-L502 HydrophobicContact CG1-CD1 3.54Å; V420-L502 HydrophobicContact CG2-CD1 3.85Å
421	N	83.5	Confident	71.8	Confident	44 Å²	44	60.3 Å²	60.3	24%	0.235	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	110.6	174.2	-171.1	8.7	0	0	0	110.3	Y387 S389 K482 V483 I484	Y387-N421 CarbonylContact O-C 3.55Å; Y387-N421 WeakPolarHBondContact O-CA 3.37Å; Y387-N421 PolarHBondContact O-OD1 2.69Å; S389-N421 PolarHBondContact OG-OD1 2.7Å; N421-K482 PolarHBondContact N-O 2.72Å; N421-V483 WeakPolarHBondContact O-CA 3.22Å; N421-I484 PolarHBondContact O-N 3.32Å
422	L	86	Confident	69.6	Low	1 Å²	1	62.1 Å²	62.1	1%	0.005	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	105.9	173.3	-65.3	97.4	0	0	0	109.1	V298 L302 L386 Y387 I388 S389 V420 I484 V486 L494	V298-L422 HydrophobicContact CG1-CD2 3.84Å; L302-L422 HydrophobicContact CD1-CD1 4.46Å; L302-L422 HydrophobicContact CD1-CD2 4.31Å; L386-L422 HydrophobicContact CB-CD1 4.25Å; L386-L422 HydrophobicContact CD2-CD1 4.38Å; Y387-L422 PolarHBondContact O-N 3.22Å; I388-L422 WeakPolarHBondContact CA-O 3.4Å; I388-L422 HydrophobicContact CG1-CB 4.34Å; I388-L422 HydrophobicContact CG1-CD1 4.37Å; S389-L422 PolarHBondContact N-O 2.87Å; V420-L422 HydrophobicContact CG1-CD1 4.13Å; L422-I484 CarbonylContact C-O 3.53Å; L422-I484 WeakPolarHBondContact CA-O 3.41Å; L422-V486 HydrophobicContact CB-CG2 4.36Å; L422-V486 HydrophobicContact CD2-CG2 4.25Å; L422-L494 HydrophobicContact CD2-CD1 4.34Å
423	V	81.9	Confident	67.4	Low	17 Å²	17	55.2 Å²	55.2	10%	0.103	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	115.2	-175.1	177	0	0	0	0	110.3	S389 V483 I484 V486	S389-V423 CarbonylContact O-C 3.2Å; S389-V423 WeakPolarHBondContact O-CA 3.46Å; V423-V483 HydrophobicContact CG2-CG1 3.97Å; V423-I484 PolarHBondContact N-O 2.92Å; V423-V486 PolarHBondContact O-N 2.89Å
424	I	81.1	Confident	65.2	Low	1 Å²	1	56.3 Å²	56.3	1%	0.005	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	118.3	178.9	-58.7	175.6	0	0	0	110.3	M287 Q291 V294 A295 I388 S389 V486 A488	M287-I424 HydrophobicContact CE-CD1 4.25Å; Q291-I424 HydrophobicContact CB-CG2 4.15Å; Q291-I424 HydrophobicContact CG-CG2 4.07Å; Q291-I424 WeakPolarHBondContact O-CD1 3.4Å; V294-I424 HydrophobicContact CB-CG2 4.19Å; V294-I424 HydrophobicContact CG1-CD1 4.36Å; V294-I424 HydrophobicContact CG1-CG2 4.04Å; A295-I424 VanDerWaalsContact CA-CD1 3.42Å; A295-I424 HydrophobicContact CB-CD1 3.36Å; I388-I424 HydrophobicContact CG2-CD1 3.57Å; I388-I424 HydrophobicContact CG2-CG1 4.1Å; S389-I424 PolarHBondContact O-N 3.26Å; I424-V486 WeakPolarHBondContact CA-O 3.47Å; I424-A488 HydrophobicContact CG2-CB 3.9Å
425	W	73	Confident	63.2	Low	85 Å²	85	60.9 Å²	60.9	32%	0.322	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	125.7	-173	-175.7	-92.2	0	0	0	112.3	Q429 P431 V485 V486 A488	W425-Q429 WeakPolarHBondContact CH2-O 3.45Å; W425-Q429 WeakPolarHBondContact CZ2-O 3.35Å; W425-P431 HydrophobicContact CH2-CB 3.48Å; W425-P431 VanDerWaalsContact CH2-CB 3.48Å; W425-P431 HydrophobicContact CH2-CG 3.27Å; W425-P431 VanDerWaalsContact CH2-N 3.31Å; W425-P431 HydrophobicContact CZ2-CG 4.05Å; W425-P431 HydrophobicContact CZ3-CB 3.83Å; W425-P431 HydrophobicContact CZ3-CG 3.83Å; W425-V485 HydrophobicContact CB-CG1 3.92Å; W425-V486 PolarHBondContact N-O 2.95Å; W425-A488 WeakPolarHBondContact O-CB 3.4Å; W425-A488 PolarHBondContact O-N 3.18Å
426	D	67.3	Low	61.1	Low	38 Å²	38	60.9 Å²	60.9	20%	0.203	34%	0.344	C	S	.	.			trans	-102.6	129.6	175	-161.2	3.7	0	0	0	110.7	K290 C428 A488	K290-D426 IonicContact NZ-OD1 4Å; K290-D426 PolarHBondContact NZ-OD1 2.96Å; K290-D426 IonicContact NZ-OD2 3.18Å; K290-D426 PolarHBondContact NZ-OD2 3.48Å; D426-C428 PolarHBondContact O-N 3.13Å; D426-A488 HydrophobicContact CB-CB 4.19Å
427	C	57.4	Low	58.8	Low	81 Å²	81	62.2 Å²	62.2	55%	0.547	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-1.6	-165.3	62.3	0	0	0	0	115.6	S489	C427-S489 PolarHBondContact SG-OG 3.07Å
428	C	51.8	Low	56.2	Low	103 Å²	103	65 Å²	65	70%	0.696	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	2.6	-172.1	-61.2	0	0	0	0	114.8	D426	D426-C428 PolarHBondContact O-N 3.13Å
429	Q	44.1	Very low	53.8	Low	121 Å²	121	66 Å²	66	57%	0.565	39%	0.388	S	S	*	.	S	Bend	trans	-124.1	103.6	166.2	-74.4	-176.6	-7.8	0	0	108	W425	W425-Q429 WeakPolarHBondContact CH2-O 3.45Å; W425-Q429 WeakPolarHBondContact CZ2-O 3.35Å
430	P	36.6	Very low	51.3	Low	101 Å²	101	67.3 Å²	67.3	66%	0.656	40%	0.398	S	S	*	.			trans	-54.5	145.9	165.5	25	-31.8	0	0	0	107.5	T432	P430-T432 PolarHBondContact O-N 3.08Å
431	P	37	Very low	48.8	Very low	74 Å²	74	69.2 Å²	69.2	48%	0.481	41%	0.414	S	S	.	.			trans	-62.8	110.7	-173.5	9	-5.2	0	0	0	105.7	W425 V433	W425-P431 HydrophobicContact CH2-CB 3.48Å; W425-P431 VanDerWaalsContact CH2-CB 3.48Å; W425-P431 HydrophobicContact CH2-CG 3.27Å; W425-P431 VanDerWaalsContact CH2-N 3.31Å; W425-P431 HydrophobicContact CZ2-CG 4.05Å; W425-P431 HydrophobicContact CZ3-CB 3.83Å; W425-P431 HydrophobicContact CZ3-CG 3.83Å; P431-V433 HydrophobicContact CB-CB 4.22Å; P431-V433 HydrophobicContact CB-CG2 3.64Å; P431-V433 PolarHBondContact O-N 2.75Å
432	T	33.7	Very low	46.3	Very low	126 Å²	126	70 Å²	70	77%	0.773	43%	0.427	S	S	*	.			trans	-72.6	58	165	52.3	0	0	0	0	107.1	P430 S434	P430-T432 PolarHBondContact O-N 3.08Å; T432-S434 PolarHBondContact O-N 2.82Å
433	V	33.6	Very low	43.8	Very low	60 Å²	60	78.2 Å²	78.2	36%	0.364	47%	0.465	S	S	.	.			trans	-85	102.7	170.1	167.7	0	0	0	0	103.7	P431 L437	P431-V433 HydrophobicContact CB-CB 4.22Å; P431-V433 HydrophobicContact CB-CG2 3.64Å; P431-V433 PolarHBondContact O-N 2.75Å; V433-L437 HydrophobicContact CB-CD2 4.34Å; V433-L437 HydrophobicContact CG1-CB 3.15Å; V433-L437 HydrophobicContact CG1-CD2 3.29Å; V433-L437 HydrophobicContact CG1-CG 3.77Å; V433-L437 HydrophobicContact CG2-CD2 4.12Å
434	S	31.3	Very low	41.5	Very low	67 Å²	67	81.7 Å²	81.7	47%	0.469	48%	0.483	S	S	.	.			trans	-54.5	148.5	173.1	53.5	0	0	0	0	109.5	T432 P436 L437	T432-S434 PolarHBondContact O-N 2.82Å; S434-P436 WeakPolarHBondContact O-CD 3.19Å; S434-L437 PolarHBondContact O-N 3.38Å
435	K	32	Very low	39.2	Very low	206 Å²	206	83.5 Å²	83.5	90%	0.896	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.1	-19.5	-175.1	-73.9	175.9	175.5	175.5	0	117.5	L437	K435-L437 VanDerWaalsContact C-N 3.3Å; K435-L437 PolarHBondContact O-N 2.9Å
436	P	32.7	Very low	37.3	Very low	76 Å²	76	90.7 Å²	90.7	49%	0.494	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-18.5	176.5	-18.9	32.8	0	0	0	115.1	S434 A438 A439 S440	S434-P436 WeakPolarHBondContact O-CD 3.19Å; P436-A438 VanDerWaalsContact C-N 3.29Å; P436-A438 PolarHBondContact O-N 2.91Å; P436-A439 WeakPolarHBondContact O-CA 3.46Å; P436-A439 WeakPolarHBondContact O-CB 3.4Å; P436-A439 PolarHBondContact O-N 2.84Å; P436-S440 PolarHBondContact O-N 3.01Å; P436-S440 PolarHBondContact O-OG 2.78Å
437	L	33.2	Very low	35.7	Very low	49 Å²	49	92.9 Å²	92.9	26%	0.257	54%	0.537	S	S	.	.	H	α-helix	trans	-67.2	-29.2	-178.7	-164.3	70.3	0	0	0	113.4	Q393 V433 S434 K435 A439 S440 A441	Q393-L437 HydrophobicContact CB-CD1 3.35Å; Q393-L437 HydrophobicContact CB-CD2 4.48Å; Q393-L437 HydrophobicContact CG-CD1 3.29Å; V433-L437 HydrophobicContact CB-CD2 4.34Å; V433-L437 HydrophobicContact CG1-CB 3.15Å; V433-L437 HydrophobicContact CG1-CD2 3.29Å; V433-L437 HydrophobicContact CG1-CG 3.77Å; V433-L437 HydrophobicContact CG2-CD2 4.12Å; S434-L437 PolarHBondContact O-N 3.38Å; K435-L437 VanDerWaalsContact C-N 3.3Å; K435-L437 PolarHBondContact O-N 2.9Å; L437-A439 PolarHBondContact O-N 3.12Å; L437-S440 PolarHBondContact O-N 2.84Å; L437-A441 WeakPolarHBondContact O-CB 3.4Å; L437-A441 PolarHBondContact O-N 3.04Å
438	A	32.1	Very low	34.6	Very low	60 Å²	60	91.9 Å²	91.9	50%	0.496	53%	0.53	S	S	.	.	H	α-helix	trans	-66	-22.8	172.4	0	0	0	0	0	112.2	P436	P436-A438 VanDerWaalsContact C-N 3.29Å; P436-A438 PolarHBondContact O-N 2.91Å
439	A	33.2	Very low	33.8	Very low	60 Å²	60	94.4 Å²	94.4	50%	0.496	53%	0.526	S	S	.	.	H	α-helix	trans	-88.7	-40.9	174.4	0	0	0	0	0	112.1	P436 L437 A442 E443	P436-A439 WeakPolarHBondContact O-CA 3.46Å; P436-A439 WeakPolarHBondContact O-CB 3.4Å; P436-A439 PolarHBondContact O-N 2.84Å; L437-A439 PolarHBondContact O-N 3.12Å; A439-A442 WeakPolarHBondContact O-CB 3.35Å; A439-A442 PolarHBondContact O-N 3.43Å; A439-E443 PolarHBondContact O-N 2.84Å
440	S	30.3	Very low	33.4	Very low	43 Å²	43	96.2 Å²	96.2	30%	0.301	54%	0.535	S	S	.	.	H	α-helix	trans	-76.9	-31.6	-175.7	-46.4	0	0	0	0	114.1	P436 L437 A442 E443 L444	P436-S440 PolarHBondContact O-N 3.01Å; P436-S440 PolarHBondContact O-OG 2.78Å; L437-S440 PolarHBondContact O-N 2.84Å; S440-A442 VanDerWaalsContact C-N 3.25Å; S440-E443 PolarHBondContact O-N 2.93Å; S440-L444 PolarHBondContact O-N 2.96Å
441	A	32.2	Very low	33.4	Very low	40 Å²	40	97 Å²	97	33%	0.331	53%	0.53	S	S	.	.	H	α-helix	trans	-70.6	-25.3	170.3	0	0	0	0	0	111.9	L437 G445	L437-A441 WeakPolarHBondContact O-CB 3.4Å; L437-A441 PolarHBondContact O-N 3.04Å; A441-G445 PolarHBondContact O-N 3.21Å
442	A	31.4	Very low	33.3	Very low	61 Å²	61	97.3 Å²	97.3	50%	0.504	53%	0.527	S	S	.	.	H	α-helix	trans	-71.5	-29.9	172	0	0	0	0	0	112.3	A439 S440	A439-A442 WeakPolarHBondContact O-CB 3.35Å; A439-A442 PolarHBondContact O-N 3.43Å; S440-A442 VanDerWaalsContact C-N 3.25Å
443	E	33.6	Very low	33.3	Very low	173 Å²	173	95.5 Å²	95.5	81%	0.808	51%	0.512	S	S	*	.	H	α-helix	trans	-79.2	-21.4	176.9	-78.6	-176	162.8	0	0	114.1	A439 S440	A439-E443 PolarHBondContact O-N 2.84Å; S440-E443 PolarHBondContact O-N 2.93Å
444	L	34.1	Very low	33.2	Very low	91 Å²	91	95.9 Å²	95.9	48%	0.476	53%	0.528	S	S	.	.	H	α-helix	trans	-114.8	0.5	-175.9	-93.8	156.7	0	0	0	117.6	N400 N404 S440	N400-L444 HydrophobicContact CB-CD1 4.46Å; N404-L444 HydrophobicContact CB-CD2 4.34Å; N404-L444 WeakPolarHBondContact ND2-CD1 3.41Å; N404-L444 WeakPolarHBondContact ND2-CD2 3.34Å; N404-L444 VanDerWaalsContact OD1-CD2 3.23Å; N404-L444 WeakPolarHBondContact OD1-CD2 3.29Å; S440-L444 PolarHBondContact O-N 2.96Å
445	G	31.8	Very low	33.2	Very low	39 Å²	39	99.4 Å²	99.4	40%	0.402	54%	0.541	S	S	.	.	H	α-helix	trans	165.4	79.4	166.8	0	0	0	0	0	112.5	A441 F447	A441-G445 PolarHBondContact O-N 3.21Å; G445-F447 VanDerWaalsContact C-N 3.26Å; G445-F447 WeakPolarHBondContact O-CD2 3.25Å; G445-F447 PolarHBondContact O-N 2.73Å
446	R	34.5	Very low	33	Very low	235 Å²	235	99 Å²	99	89%	0.887	54%	0.539	S	S	*	.			trans	30.1	44.2	148.1	-73.1	-172.5	171.8	140.7	-1.5	118.6
447	F	34	Very low	32.9	Very low	85 Å²	85	99.9 Å²	99.9	37%	0.373	55%	0.547	S	S	.	.			trans	-123.1	121.9	159.8	-64.8	-78.9	0	0	0	109.6	G445 Q451 L452 A478	G445-F447 VanDerWaalsContact C-N 3.26Å; G445-F447 WeakPolarHBondContact O-CD2 3.25Å; G445-F447 PolarHBondContact O-N 2.73Å; F447-Q451 HydrophobicContact CD1-CB 4.45Å; F447-L452 HydrophobicContact CB-CD1 4.42Å; F447-A478 HydrophobicContact CD2-CB 4.39Å; F447-A478 HydrophobicContact CE2-CB 3.24Å; F447-A478 HydrophobicContact CZ-CB 3.59Å
448	S	33.1	Very low	32.7	Very low	59 Å²	59	104.3 Å²	104.3	41%	0.413	58%	0.582	S	S	.	*			trans	-64.8	141.2	166.6	163.5	0	0	0	0	108.6	E450 Q451 L452	S448-E450 PolarHBondContact O-N 3.11Å; S448-E450 PolarHBondContact OG-N 3.03Å; S448-Q451 VanDerWaalsContact N-OE1 3.11Å; S448-Q451 WeakPolarHBondContact O-CA 3.41Å; S448-Q451 WeakPolarHBondContact O-CB 3.34Å; S448-Q451 PolarHBondContact O-N 3.11Å; S448-L452 PolarHBondContact O-N 3.16Å
449	Y	35	Very low	32.5	Very low	156 Å²	156	105.5 Å²	105.5	61%	0.612	59%	0.592	S	S	*	*	H	α-helix	trans	-44.5	-32.5	169.1	175.9	-100.8	0	0	0	113	L452 L453	Y449-L452 PolarHBondContact O-N 3.2Å; Y449-L453 HydrophobicContact CD2-CD1 4.26Å; Y449-L453 HydrophobicContact CE1-CD1 3.87Å; Y449-L453 HydrophobicContact CE2-CD1 3.58Å; Y449-L453 PolarHBondContact O-N 3.09Å; Y449-L453 WeakPolarHBondContact OH-CD1 3.49Å
450	E	36.2	Very low	32.3	Very low	160 Å²	160	111.9 Å²	111.9	75%	0.748	61%	0.609	S	S	*	*	H	α-helix	trans	-71.7	-27.1	177.6	-60.6	-171.1	157.4	0	0	113.5	S448 G454	S448-E450 PolarHBondContact O-N 3.11Å; S448-E450 PolarHBondContact OG-N 3.03Å; E450-G454 PolarHBondContact O-N 3.07Å
451	Q	35.6	Very low	32.2	Very low	117 Å²	117	120 Å²	120	55%	0.547	64%	0.638	S	S	.	*	H	α-helix	trans	-77.1	-32.1	176	-69	174.2	-37.9	0	0	112.4	F447 S448	F447-Q451 HydrophobicContact CD1-CB 4.45Å; S448-Q451 VanDerWaalsContact N-OE1 3.11Å; S448-Q451 WeakPolarHBondContact O-CA 3.41Å; S448-Q451 WeakPolarHBondContact O-CB 3.34Å; S448-Q451 PolarHBondContact O-N 3.11Å
452	L	36.4	Very low	32	Very low	80 Å²	80	123.5 Å²	123.5	42%	0.419	66%	0.661	S	S	.	*	H	α-helix	trans	-76.3	-30.4	178.1	-97.1	156.1	0	0	0	113	F447 S448 Y449 F476	F447-L452 HydrophobicContact CB-CD1 4.42Å; S448-L452 PolarHBondContact O-N 3.16Å; Y449-L452 PolarHBondContact O-N 3.2Å; L452-F476 HydrophobicContact CD2-CD1 4.04Å; L452-F476 HydrophobicContact CD2-CD2 4.08Å; L452-F476 HydrophobicContact CD2-CE1 4.13Å; L452-F476 HydrophobicContact CD2-CE2 4.17Å; L452-F476 HydrophobicContact CD2-CG 4.02Å; L452-F476 HydrophobicContact CD2-CZ 4.19Å; L452-F476 WeakPolarHBondContact O-CZ 3.3Å
453	L	33.8	Very low	31.8	Very low	88 Å²	88	125.9 Å²	125.9	46%	0.461	67%	0.674	S	S	.	*	H	α-helix	trans	-97.5	-21.9	-177	-80.6	167.2	0	0	0	114.7	Y449 L455	Y449-L453 HydrophobicContact CD2-CD1 4.26Å; Y449-L453 HydrophobicContact CE1-CD1 3.87Å; Y449-L453 HydrophobicContact CE2-CD1 3.58Å; Y449-L453 PolarHBondContact O-N 3.09Å; Y449-L453 WeakPolarHBondContact OH-CD1 3.49Å; L453-L455 WeakPolarHBondContact O-CA 3.31Å; L453-L455 WeakPolarHBondContact O-CB 3.42Å; L453-L455 WeakPolarHBondContact O-CG 3.36Å; L453-L455 PolarHBondContact O-N 3.01Å
454	G	31.3	Very low	31.4	Very low	68 Å²	68	122.9 Å²	122.9	70%	0.701	67%	0.672	S	S	*	*			trans	49.2	14.2	173	0	0	0	0	0	115.9	E450	E450-G454 PolarHBondContact O-N 3.07Å
455	L	29.7	Very low	31	Very low	142 Å²	142	123.7 Å²	123.7	74%	0.743	69%	0.685	S	S	*	*			trans	-136.6	74.6	-165.5	-77.3	166.3	0	0	0	106.4	L453	L453-L455 WeakPolarHBondContact O-CA 3.31Å; L453-L455 WeakPolarHBondContact O-CB 3.42Å; L453-L455 WeakPolarHBondContact O-CG 3.36Å; L453-L455 PolarHBondContact O-N 3.01Å
456	K	28.3	Very low	30.8	Very low	197 Å²	197	127.1 Å²	127.1	86%	0.857	70%	0.703	S	S	*	*	S	Bend	trans	-160.7	88.8	144.4	-106.5	167.8	-166.2	-173.9	0	110.3
457	S	32	Very low	30.3	Very low	95 Å²	95	122 Å²	122	66%	0.664	70%	0.703	S	S	*	*			trans	53.5	79.6	135.4	65.7	0	0	0	0	116.9	A459	S457-A459 PolarHBondContact O-N 3.36Å
458	S	27.4	Very low	30	Very low	142 Å²	142	123 Å²	123	99%	0.993	72%	0.721	S	S	*	*			trans	-65.7	58.2	131.8	-86.2	0	0	0	0	109.5
459	A	29.4	Very low	29.6	Very low	84 Å²	84	125.7 Å²	125.7	69%	0.694	74%	0.739	S	S	*	*			trans	-108.7	49.6	166.5	0	0	0	0	0	107.8	S457	S457-A459 PolarHBondContact O-N 3.36Å
460	K	28.2	Very low	29.2	Very low	195 Å²	195	123.6 Å²	123.6	85%	0.848	75%	0.747	S	S	*	*	S	Bend	trans	-114.8	93.1	158.7	-91.7	-176.1	176.9	175.8	0	107.4
461	K	28.1	Very low	29	Very low	212 Å²	212	120.3 Å²	120.3	92%	0.922	74%	0.742	S	S	*	*			trans	39.2	85.2	151.7	-65.3	179.7	176.2	-179.4	0	115.2
462	S	28.1	Very low	29	Very low	115 Å²	115	120 Å²	120	80%	0.804	75%	0.753	S	S	*	*			trans	-139.8	114	138.5	49.6	0	0	0	0	108.5
463	S	26.6	Very low	29.2	Very low	111 Å²	111	120.4 Å²	120.4	78%	0.776	76%	0.762	S	S	*	*			trans	-55.3	144.5	168.3	45	0	0	0	0	111
464	S	25.5	Very low	30.1	Very low	110 Å²	110	118 Å²	118	77%	0.769	75%	0.753	S	S	*	*			trans	83.5	131.5	162.4	75.8	0	0	0	0	118.8
465	S	26.5	Very low	31.1	Very low	108 Å²	108	116.5 Å²	116.5	76%	0.755	73%	0.73	S	S	*	*			trans	91.9	109.6	161.6	71.4	0	0	0	0	119.9
466	S	26.8	Very low	32.2	Very low	110 Å²	110	112.6 Å²	112.6	77%	0.769	71%	0.707	S	S	*	*			trans	57.4	95.5	149.3	52	0	0	0	0	119.3	S468	S466-S468 PolarHBondContact O-N 3.37Å; S466-S468 VanDerWaalsContact O-N 3.14Å
467	S	24.7	Very low	33.2	Very low	127 Å²	127	107.7 Å²	107.7	89%	0.888	69%	0.694	S	S	*	*			trans	-61.5	97	159.4	50.6	0	0	0	0	112
468	S	26.4	Very low	34.2	Very low	107 Å²	107	104.9 Å²	104.9	75%	0.748	68%	0.677	S	S	*	*			trans	-84.5	112.7	152.8	56.7	0	0	0	0	107.8	S466 S470	S466-S468 PolarHBondContact O-N 3.37Å; S466-S468 VanDerWaalsContact O-N 3.14Å; S468-S470 PolarHBondContact O-N 3.08Å
469	S	26	Very low	35.6	Very low	115 Å²	115	104.3 Å²	104.3	80%	0.804	66%	0.663	S	S	*	*			trans	-58.7	93.2	172.6	51.1	0	0	0	0	110.3	S471	S469-S471 PolarHBondContact O-N 2.97Å
470	S	26.4	Very low	37.2	Very low	112 Å²	112	107.6 Å²	107.6	78%	0.783	66%	0.657	S	S	*	*			trans	-70.6	83.8	165.4	54.6	0	0	0	0	108	S468 S472	S468-S470 PolarHBondContact O-N 3.08Å; S470-S472 PolarHBondContact O-N 3.15Å; S470-S472 VanDerWaalsContact O-N 3.09Å
471	S	32.1	Very low	39.1	Very low	92 Å²	92	101 Å²	101	64%	0.643	63%	0.63	S	S	*	*			trans	-54.3	114	168	48	0	0	0	0	108.4	S469 S473	S469-S471 PolarHBondContact O-N 2.97Å; S471-S473 PolarHBondContact O-N 2.89Å; S471-S473 VanDerWaalsContact O-N 3.12Å
472	S	34.7	Very low	41.2	Very low	110 Å²	110	92.7 Å²	92.7	77%	0.769	59%	0.594	S	S	*	*			trans	-37.6	112.2	177.4	49.7	0	0	0	0	111.6	S470 S474	S470-S472 PolarHBondContact O-N 3.15Å; S470-S472 VanDerWaalsContact O-N 3.09Å; S472-S474 PolarHBondContact O-N 3.44Å; S472-S474 VanDerWaalsContact O-N 3.08Å
473	S	41	Very low	43.3	Very low	88 Å²	88	89.1 Å²	89.1	62%	0.615	57%	0.568	S	S	*	*			trans	-64.9	111.4	173.7	55.7	0	0	0	0	108.5	S471 V475	S471-S473 PolarHBondContact O-N 2.89Å; S471-S473 VanDerWaalsContact O-N 3.12Å; S473-V475 PolarHBondContact O-N 3.15Å
474	S	53.7	Low	45.6	Very low	39 Å²	39	83.9 Å²	83.9	27%	0.273	53%	0.531	S	S	.	.			trans	-74.8	0.5	175.9	51.5	0	0	0	0	113.4	S472 I484 V485	S472-S474 PolarHBondContact O-N 3.44Å; S472-S474 VanDerWaalsContact O-N 3.08Å; S474-I484 WeakPolarHBondContact O-CA 3.4Å; S474-V485 PolarHBondContact O-N 3.29Å
475	V	51.5	Low	48	Very low	36 Å²	36	81.6 Å²	81.6	22%	0.218	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.6	-170.7	-174.5	0	0	0	0	110.3	S473 V483 I484 Q501	S473-V475 PolarHBondContact O-N 3.15Å; V475-V483 WeakPolarHBondContact CA-O 3.4Å; V475-I484 HydrophobicContact CG1-CG1 4.35Å; V475-I484 HydrophobicContact CG2-CG1 4.17Å; V475-Q501 HydrophobicContact CG2-CB 4.49Å
476	F	52.9	Low	50.5	Low	59 Å²	59	76.8 Å²	76.8	26%	0.259	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	132.6	175	-56.5	-90.5	0	0	0	109.4	L452 K482 V483	L452-F476 HydrophobicContact CD2-CD1 4.04Å; L452-F476 HydrophobicContact CD2-CD2 4.08Å; L452-F476 HydrophobicContact CD2-CE1 4.13Å; L452-F476 HydrophobicContact CD2-CE2 4.17Å; L452-F476 HydrophobicContact CD2-CG 4.02Å; L452-F476 HydrophobicContact CD2-CZ 4.19Å; L452-F476 WeakPolarHBondContact O-CZ 3.3Å; F476-K482 CarbonylContact O-C 3.52Å; F476-K482 WeakPolarHBondContact O-CA 3.32Å; F476-V483 HydrophobicContact CB-CB 4.41Å; F476-V483 PolarHBondContact N-O 3.45Å; F476-V483 PolarHBondContact O-N 2.73Å
477	T	50.2	Low	52.7	Low	94 Å²	94	74.9 Å²	74.9	58%	0.577	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	128.3	-176.6	25	0	0	0	0	111	K482	T477-K482 HydrophobicContact CG2-CD 4.17Å; T477-K482 HydrophobicContact CG2-CG 3.53Å
478	A	52.3	Low	54.7	Low	36 Å²	36	69.1 Å²	69.1	30%	0.298	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	127.5	173.6	0	0	0	0	0	111.2	F447 R480 I481	F447-A478 HydrophobicContact CD2-CB 4.39Å; F447-A478 HydrophobicContact CE2-CB 3.24Å; F447-A478 HydrophobicContact CZ-CB 3.59Å; A478-R480 VanDerWaalsContact C-N 3.3Å; A478-R480 PolarHBondContact O-N 2.95Å; A478-R480 VanDerWaalsContact O-N 3.12Å; A478-I481 PolarHBondContact N-O 2.65Å; A478-I481 WeakPolarHBondContact O-CA 3.39Å; A478-I481 WeakPolarHBondContact O-CB 3.18Å; A478-I481 PolarHBondContact O-N 3.18Å
479	N	56.9	Low	56.7	Low	131 Å²	131	66.7 Å²	66.7	70%	0.701	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.7	49.6	176.3	-71.5	5.9	0	0	0	114.6	I481	N479-I481 PolarHBondContact O-N 3.48Å; N479-I481 VanDerWaalsContact O-N 3.11Å
480	R	63.5	Low	58.5	Low	152 Å²	152	64.2 Å²	64.2	57%	0.574	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	6.6	-176.8	-50	-174.2	-179.5	-158.9	4.4	116.1	P416 I419 A478	P416-R480 VanDerWaalsContact CB-NH1 3.34Å; P416-R480 VanDerWaalsContact CG-NH1 3.29Å; I419-R480 PolarHBondContact N-O 2.82Å; A478-R480 VanDerWaalsContact C-N 3.3Å; A478-R480 PolarHBondContact O-N 2.95Å; A478-R480 VanDerWaalsContact O-N 3.12Å
481	I	66.8	Low	60.4	Low	57 Å²	57	65.4 Å²	65.4	29%	0.292	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	120.9	166.2	-55.1	177.3	0	0	0	108.1	V407 I419 A478 N479	V407-I481 HydrophobicContact CG1-CD1 4.08Å; I419-I481 HydrophobicContact CB-CG1 4.49Å; I419-I481 CarbonylContact O-C 3.56Å; I419-I481 VanDerWaalsContact O-CA 3.26Å; I419-I481 WeakPolarHBondContact O-CA 3.48Å; A478-I481 PolarHBondContact N-O 2.65Å; A478-I481 WeakPolarHBondContact O-CA 3.39Å; A478-I481 WeakPolarHBondContact O-CB 3.18Å; A478-I481 PolarHBondContact O-N 3.18Å; N479-I481 PolarHBondContact O-N 3.48Å; N479-I481 VanDerWaalsContact O-N 3.11Å
482	K	72.3	Confident	62.1	Low	37 Å²	37	61.6 Å²	61.6	16%	0.161	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	132.7	170.8	-72.9	-174.9	176	153.8	0	109.3	E418 I419 V420 N421 F476 T477	E418-K482 WeakPolarHBondContact OE1-CD 3.37Å; E418-K482 WeakPolarHBondContact OE1-CE 3.19Å; E418-K482 IonicContact OE1-NZ 2.71Å; E418-K482 PolarHBondContact OE1-NZ 2.68Å; I419-K482 PolarHBondContact O-N 2.75Å; V420-K482 CarbonylContact C-O 3.56Å; V420-K482 WeakPolarHBondContact CA-O 3.49Å; V420-K482 HydrophobicContact CB-CB 4.29Å; V420-K482 HydrophobicContact CG1-CB 3.86Å; V420-K482 HydrophobicContact CG2-CB 4.08Å; V420-K482 HydrophobicContact CG2-CD 4.4Å; N421-K482 PolarHBondContact N-O 2.72Å; F476-K482 CarbonylContact O-C 3.52Å; F476-K482 WeakPolarHBondContact O-CA 3.32Å; T477-K482 HydrophobicContact CG2-CD 4.17Å; T477-K482 HydrophobicContact CG2-CG 3.53Å
483	V	71.9	Confident	64.1	Low	41 Å²	41	57 Å²	57	25%	0.248	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123.1	170.2	-176.7	0	0	0	0	108.2	N421 V423 V475 F476	N421-V483 WeakPolarHBondContact O-CA 3.22Å; V423-V483 HydrophobicContact CG2-CG1 3.97Å; V475-V483 WeakPolarHBondContact CA-O 3.4Å; F476-V483 HydrophobicContact CB-CB 4.41Å; F476-V483 PolarHBondContact N-O 3.45Å; F476-V483 PolarHBondContact O-N 2.73Å
484	I	76.3	Confident	66	Low	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.8	176.6	-55.8	-175	0	0	0	108.3	V420 N421 L422 V423 S474 V475 T498 L502	V420-I484 HydrophobicContact CG1-CD1 3.97Å; V420-I484 HydrophobicContact CG1-CG1 4.11Å; N421-I484 PolarHBondContact O-N 3.32Å; L422-I484 CarbonylContact C-O 3.53Å; L422-I484 WeakPolarHBondContact CA-O 3.41Å; V423-I484 PolarHBondContact N-O 2.92Å; S474-I484 WeakPolarHBondContact O-CA 3.4Å; V475-I484 HydrophobicContact CG1-CG1 4.35Å; V475-I484 HydrophobicContact CG2-CG1 4.17Å; I484-T498 HydrophobicContact CD1-CG2 4.44Å; I484-T498 HydrophobicContact CG2-CG2 3.63Å; I484-L502 HydrophobicContact CD1-CB 4.32Å; I484-L502 HydrophobicContact CD1-CD1 3.8Å
485	V	75.9	Confident	67	Low	63 Å²	63	52.5 Å²	52.5	38%	0.382	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	122.4	175.5	-175.8	0	0	0	0	109.5	W425 S474	W425-V485 HydrophobicContact CB-CG1 3.92Å; S474-V485 PolarHBondContact O-N 3.29Å
486	V	77.6	Confident	68.1	Low	7 Å²	7	50.8 Å²	50.8	4%	0.042	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	121.9	176.7	-179	0	0	0	0	108.7	V294 V298 L422 V423 I424 W425 A488 C493 L494	V294-V486 HydrophobicContact CG1-CG1 4.34Å; V298-V486 HydrophobicContact CG2-CG1 3.99Å; L422-V486 HydrophobicContact CB-CG2 4.36Å; L422-V486 HydrophobicContact CD2-CG2 4.25Å; V423-V486 PolarHBondContact O-N 2.89Å; I424-V486 WeakPolarHBondContact CA-O 3.47Å; W425-V486 PolarHBondContact N-O 2.95Å; V486-A488 PolarHBondContact O-N 2.93Å; V486-C493 WeakPolarHBondContact CG1-O 3.18Å; V486-L494 HydrophobicContact CG2-CD1 4.25Å
487	N	73.7	Confident	69	Low	69 Å²	69	52.4 Å²	52.4	37%	0.369	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	123.7	176.8	-174.7	-3.4	0	0	0	109.9	S489 D490	N487-S489 PolarHBondContact O-N 3.05Å; N487-S489 VanDerWaalsContact O-N 3.17Å; N487-S489 WeakPolarHBondContact OD1-CB 3.16Å; N487-S489 PolarHBondContact OD1-N 3.37Å; N487-S489 PolarHBondContact OD1-OG 3.26Å; N487-S489 VanDerWaalsContact OD1-OG 3.05Å; N487-D490 HydrophobicContact CB-CB 4.33Å; N487-D490 VanDerWaalsContact O-CB 3.22Å; N487-D490 WeakPolarHBondContact O-CB 3.21Å; N487-D490 PolarHBondContact O-N 3.25Å
488	A	67.8	Low	70.2	Confident	7 Å²	7	49 Å²	49	6%	0.058	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-8.8	177.6	0	0	0	0	0	113.6	V294 I424 W425 D426 V486	V294-A488 HydrophobicContact CG2-CB 4.07Å; I424-A488 HydrophobicContact CG2-CB 3.9Å; W425-A488 WeakPolarHBondContact O-CB 3.4Å; W425-A488 PolarHBondContact O-N 3.18Å; D426-A488 HydrophobicContact CB-CB 4.19Å; V486-A488 PolarHBondContact O-N 2.93Å
489	S	66.5	Low	71.4	Confident	55 Å²	55	47.4 Å²	47.4	39%	0.385	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-4.9	174.2	-38.6	0	0	0	0	112.6	C427 N487 E491	C427-S489 PolarHBondContact SG-OG 3.07Å; N487-S489 PolarHBondContact O-N 3.05Å; N487-S489 VanDerWaalsContact O-N 3.17Å; N487-S489 WeakPolarHBondContact OD1-CB 3.16Å; N487-S489 PolarHBondContact OD1-N 3.37Å; N487-S489 PolarHBondContact OD1-OG 3.26Å; N487-S489 VanDerWaalsContact OD1-OG 3.05Å; S489-E491 PolarHBondContact O-N 2.99Å
490	D	65.5	Low	72.1	Confident	63 Å²	63	43.3 Å²	43.3	34%	0.337	22%	0.223	S	C	.	.			trans	-79.9	114	-178.8	-161.2	-10.9	0	0	0	109.8	N487 E492 C493	N487-D490 HydrophobicContact CB-CB 4.33Å; N487-D490 VanDerWaalsContact O-CB 3.22Å; N487-D490 WeakPolarHBondContact O-CB 3.21Å; N487-D490 PolarHBondContact O-N 3.25Å; D490-E492 PolarHBondContact O-N 3.31Å; D490-C493 PolarHBondContact O-N 3.37Å; D490-C493 VanDerWaalsContact O-N 3.07Å
491	E	65	Low	72.4	Confident	137 Å²	137	40 Å²	40	64%	0.64	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-26.3	-177.3	-72	-159.7	-161.6	0	0	112.8	K199 S489 C493	K199-E491 HydrophobicContact CD-CB 3.93Å; K199-E491 HydrophobicContact CD-CG 4.37Å; K199-E491 WeakPolarHBondContact CD-OE2 3.3Å; K199-E491 WeakPolarHBondContact CE-OE2 3.41Å; K199-E491 IonicContact NZ-OE2 3.3Å; K199-E491 PolarHBondContact NZ-OE2 3.36Å; S489-E491 PolarHBondContact O-N 2.99Å; E491-C493 PolarHBondContact O-N 3.48Å
492	E	68.4	Low	72.8	Confident	13 Å²	13	37.7 Å²	37.7	6%	0.061	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-12.2	175.8	-75.8	-145	147.6	0	0	113.1	P198 L259 R262 R263 D490 L494	P198-E492 VanDerWaalsContact CA-OE1 3.23Å; P198-E492 WeakPolarHBondContact CA-OE1 3.39Å; P198-E492 VanDerWaalsContact CB-CD 3.48Å; P198-E492 WeakPolarHBondContact CB-OE1 3.41Å; L259-E492 WeakPolarHBondContact CD2-OE1 3.04Å; R262-E492 IonicContact CZ-OE1 3.65Å; R262-E492 IonicContact NH1-OE1 3.62Å; R262-E492 IonicContact NH2-OE1 3.11Å; R262-E492 PolarHBondContact NH2-OE1 2.85Å; R262-E492 IonicContact NH2-OE2 3.66Å; R262-E492 PolarHBondContact NH2-OE2 2.86Å; R263-E492 PolarHBondContact NH2-O 3Å; R263-E492 IonicContact NH2-OE2 2.79Å; D490-E492 PolarHBondContact O-N 3.31Å; E492-L494 PolarHBondContact O-N 3.26Å
493	C	77.3	Confident	72.7	Confident	12 Å²	12	36.9 Å²	36.9	8%	0.081	20%	0.199	C	C	.	.	S	Bend	trans	62	-43.4	-172.3	-44.9	0	0	0	0	114.7	C297 V298 V486 D490 E491	C297-C493 HydrophobicContact CB-CB 3.66Å; C297-C493 WeakPolarHBondContact CB-SG 3.35Å; C297-C493 WeakPolarHBondContact SG-CB 3.38Å; C297-C493 CovalentContact SG-SG 2.01Å; C297-C493 PolarHBondContact SG-SG 3.07Å; V298-C493 HydrophobicContact CG2-CB 4.06Å; V486-C493 WeakPolarHBondContact CG1-O 3.18Å; D490-C493 PolarHBondContact O-N 3.37Å; D490-C493 VanDerWaalsContact O-N 3.07Å; E491-C493 PolarHBondContact O-N 3.48Å
494	L	80.1	Confident	72.2	Confident	3 Å²	3	36.3 Å²	36.3	2%	0.016	20%	0.201	C	C	.	.	S	Bend	trans	-148.6	112.8	175.5	-162.5	70.3	0	0	0	111.1	R263 L302 L422 V486 E492 T498 L499	R263-L494 PolarHBondContact NH2-O 3.16Å; L302-L494 HydrophobicContact CD2-CD2 3.64Å; L302-L494 HydrophobicContact CG-CD2 4.09Å; L422-L494 HydrophobicContact CD2-CD1 4.34Å; V486-L494 HydrophobicContact CG2-CD1 4.25Å; E492-L494 PolarHBondContact O-N 3.26Å; L494-T498 HydrophobicContact CD1-CG2 3.57Å; L494-T498 HydrophobicContact CG-CG2 4.4Å; L494-L499 HydrophobicContact CD2-CD2 3.49Å; L494-L499 VanDerWaalsContact CD2-CD2 3.49Å; L494-L499 HydrophobicContact CD2-CG 3.81Å; L494-L499 HydrophobicContact CG-CD2 4.43Å; L494-L499 HydrophobicContact CG-CG 4.21Å
495	S	75.6	Confident	70.8	Confident	30 Å²	30	41.2 Å²	41.2	21%	0.21	23%	0.226	C	C	.	.			trans	-68.2	154.5	178.5	79.5	0	0	0	0	112.8	K497 T498 L499	S495-K497 PolarHBondContact O-N 3.43Å; S495-T498 PolarHBondContact O-N 2.77Å; S495-T498 VanDerWaalsContact O-N 3.09Å; S495-T498 PolarHBondContact OG-N 3.11Å; S495-T498 VanDerWaalsContact OG-N 3.12Å; S495-T498 PolarHBondContact OG-OG1 3.05Å; S495-L499 PolarHBondContact O-N 2.98Å
496	V	73.7	Confident	69.2	Low	1 Å²	1	44.1 Å²	44.1	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-56.5	-36.7	173.2	174.9	0	0	0	0	111.4	F266 T498 L499 T500	F266-V496 HydrophobicContact CD1-CG1 3.73Å; F266-V496 HydrophobicContact CD2-CG1 3.7Å; F266-V496 HydrophobicContact CE1-CG1 3.61Å; F266-V496 HydrophobicContact CE2-CG1 3.57Å; F266-V496 HydrophobicContact CG-CG1 3.81Å; F266-V496 HydrophobicContact CZ-CG1 3.53Å; V496-T498 PolarHBondContact O-N 3.32Å; V496-L499 WeakPolarHBondContact O-CB 3.45Å; V496-L499 PolarHBondContact O-N 3.3Å; V496-T500 WeakPolarHBondContact O-CG2 3.23Å; V496-T500 PolarHBondContact O-N 3.41Å
497	K	72.3	Confident	67.3	Low	93 Å²	93	52.4 Å²	52.4	40%	0.404	27%	0.265	S	S	.	.	H	α-helix	trans	-61.5	-44.7	175.8	-172.6	174.5	-177.2	171.2	0	111.8	S495 L499 T500 Q501	S495-K497 PolarHBondContact O-N 3.43Å; K497-L499 VanDerWaalsContact C-N 3.33Å; K497-L499 PolarHBondContact O-N 2.98Å; K497-T500 PolarHBondContact O-N 2.82Å; K497-T500 PolarHBondContact O-OG1 2.84Å; K497-Q501 WeakPolarHBondContact O-CG 3.41Å; K497-Q501 PolarHBondContact O-N 3Å
498	T	75.6	Confident	65.5	Low	21 Å²	21	56 Å²	56	13%	0.129	28%	0.28	C	S	.	.	H	α-helix	trans	-64.1	-39.6	175.9	-47.1	0	0	0	0	111.4	I484 L494 S495 V496 Q501 L502	I484-T498 HydrophobicContact CD1-CG2 4.44Å; I484-T498 HydrophobicContact CG2-CG2 3.63Å; L494-T498 HydrophobicContact CD1-CG2 3.57Å; L494-T498 HydrophobicContact CG-CG2 4.4Å; S495-T498 PolarHBondContact O-N 2.77Å; S495-T498 VanDerWaalsContact O-N 3.09Å; S495-T498 PolarHBondContact OG-N 3.11Å; S495-T498 VanDerWaalsContact OG-N 3.12Å; S495-T498 PolarHBondContact OG-OG1 3.05Å; V496-T498 PolarHBondContact O-N 3.32Å; T498-Q501 PolarHBondContact O-N 2.97Å; T498-L502 WeakPolarHBondContact O-CB 3.31Å; T498-L502 PolarHBondContact O-N 3.35Å
499	L	76.8	Confident	63.8	Low	3 Å²	3	65 Å²	65	2%	0.016	32%	0.318	C	S	.	.	H	α-helix	trans	-61	-43.5	175.2	-75.2	165	0	0	0	112.3	F271 L302 C305 L494 S495 V496 K497 Q501 L502 F503	F271-L499 HydrophobicContact CZ-CB 4.31Å; F271-L499 WeakPolarHBondContact CZ-O 3.3Å; L302-L499 HydrophobicContact CD2-CD2 4.02Å; C305-L499 HydrophobicContact CB-CD2 4.28Å; C305-L499 WeakPolarHBondContact SG-CD1 3.4Å; C305-L499 VanDerWaalsContact SG-CD2 3.56Å; L494-L499 HydrophobicContact CD2-CD2 3.49Å; L494-L499 VanDerWaalsContact CD2-CD2 3.49Å; L494-L499 HydrophobicContact CD2-CG 3.81Å; L494-L499 HydrophobicContact CG-CD2 4.43Å; L494-L499 HydrophobicContact CG-CG 4.21Å; S495-L499 PolarHBondContact O-N 2.98Å; V496-L499 WeakPolarHBondContact O-CB 3.45Å; V496-L499 PolarHBondContact O-N 3.3Å; K497-L499 VanDerWaalsContact C-N 3.33Å; K497-L499 PolarHBondContact O-N 2.98Å; L499-Q501 PolarHBondContact O-N 2.87Å; L499-L502 PolarHBondContact O-N 3.3Å; L499-F503 HydrophobicContact CD2-CD2 4.46Å; L499-F503 HydrophobicContact CD2-CE2 4.05Å; L499-F503 PolarHBondContact O-N 3.44Å; L499-F503 VanDerWaalsContact O-N 3.1Å
500	T	71.7	Confident	62.3	Low	46 Å²	46	65.8 Å²	65.8	28%	0.282	33%	0.327	S	S	.	.	H	α-helix	trans	-63.3	-30	175.8	57.3	0	0	0	0	113.3	F266 V496 K497 G504	F266-T500 HydrophobicContact CE1-CG2 3.31Å; F266-T500 HydrophobicContact CZ-CG2 3.38Å; V496-T500 WeakPolarHBondContact O-CG2 3.23Å; V496-T500 PolarHBondContact O-N 3.41Å; K497-T500 PolarHBondContact O-N 2.82Å; K497-T500 PolarHBondContact O-OG1 2.84Å; T500-G504 WeakPolarHBondContact O-CA 3.47Å; T500-G504 PolarHBondContact O-N 3.21Å
501	Q	70.6	Confident	60.7	Low	83 Å²	83	67.3 Å²	67.3	39%	0.388	35%	0.349	S	S	.	.	H	α-helix	trans	-78	-36.6	176.1	-68.7	172.6	-11	0	0	111.6	V475 K497 T498 L499	V475-Q501 HydrophobicContact CG2-CB 4.49Å; K497-Q501 WeakPolarHBondContact O-CG 3.41Å; K497-Q501 PolarHBondContact O-N 3Å; T498-Q501 PolarHBondContact O-N 2.97Å; L499-Q501 PolarHBondContact O-N 2.87Å
502	L	73.5	Confident	59.1	Low	7 Å²	7	65 Å²	65	4%	0.037	36%	0.362	C	S	.	.	H	α-helix	trans	-63	-59.2	179.6	179.2	66.4	0	0	0	111.5	L302 L386 V420 I484 T498 L499 G504	L302-L502 HydrophobicContact CD2-CD2 3.3Å; L386-L502 HydrophobicContact CD1-CD2 4.42Å; L386-L502 HydrophobicContact CD2-CD1 3.83Å; L386-L502 HydrophobicContact CD2-CD2 4.08Å; L386-L502 HydrophobicContact CD2-CG 4.37Å; V420-L502 HydrophobicContact CB-CD1 4.04Å; V420-L502 HydrophobicContact CG1-CD1 3.54Å; V420-L502 HydrophobicContact CG2-CD1 3.85Å; I484-L502 HydrophobicContact CD1-CB 4.32Å; I484-L502 HydrophobicContact CD1-CD1 3.8Å; T498-L502 WeakPolarHBondContact O-CB 3.31Å; T498-L502 PolarHBondContact O-N 3.35Å; L499-L502 PolarHBondContact O-N 3.3Å; L502-G504 PolarHBondContact O-N 3.31Å
503	F	71.5	Confident	57.3	Low	20 Å²	20	74.1 Å²	74.1	9%	0.088	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	22	-179	-60.6	-62.3	0	0	0	112.6	F271 K275 L302 C305 L306 I384 L386 L499	F271-F503 HydrophobicContact CD1-CB 3.48Å; F271-F503 VanDerWaalsContact CD1-CB 3.48Å; F271-F503 HydrophobicContact CD1-CG 4.42Å; F271-F503 HydrophobicContact CD2-CB 4.12Å; F271-F503 AromaticContact CD2-CD2 3.78Å; F271-F503 HydrophobicContact CD2-CD2 3.78Å; F271-F503 HydrophobicContact CD2-CG 4.21Å; F271-F503 HydrophobicContact CE1-CB 3.6Å; F271-F503 HydrophobicContact CE1-CD2 4.42Å; F271-F503 HydrophobicContact CE1-CG 4.5Å; F271-F503 HydrophobicContact CE2-CB 4.22Å; F271-F503 AromaticContact CE2-CD2 3.57Å; F271-F503 HydrophobicContact CE2-CD2 3.57Å; F271-F503 HydrophobicContact CE2-CE2 4.39Å; F271-F503 HydrophobicContact CE2-CG 4.3Å; F271-F503 HydrophobicContact CG-CB 3.79Å; F271-F503 HydrophobicContact CG-CD2 4.32Å; F271-F503 HydrophobicContact CG-CG 4.3Å; F271-F503 HydrophobicContact CZ-CB 3.98Å; F271-F503 AromaticContact CZ-CD2 3.92Å; F271-F503 HydrophobicContact CZ-CD2 3.92Å; F271-F503 HydrophobicContact CZ-CG 4.45Å; K275-F503 HydrophobicContact CD-CD1 3.56Å; K275-F503 HydrophobicContact CD-CE1 3.94Å; K275-F503 HydrophobicContact CD-CG 4.31Å; L302-F503 HydrophobicContact CD2-CE2 4.48Å; L302-F503 HydrophobicContact CD2-CZ 4.46Å; C305-F503 HydrophobicContact CB-CE2 4.08Å; L306-F503 HydrophobicContact CD2-CE1 4.49Å; L306-F503 HydrophobicContact CD2-CZ 4.19Å; I384-F503 HydrophobicContact CD1-CD1 4.25Å; I384-F503 HydrophobicContact CD1-CE1 4.36Å; L386-F503 HydrophobicContact CD1-CZ 4.42Å; L499-F503 HydrophobicContact CD2-CD2 4.46Å; L499-F503 HydrophobicContact CD2-CE2 4.05Å; L499-F503 PolarHBondContact O-N 3.44Å; L499-F503 VanDerWaalsContact O-N 3.1Å
504	G	60.2	Low	55.1	Low	29 Å²	29	77.4 Å²	77.4	30%	0.299	42%	0.424	S	S	.	.			trans	-39.9	137.8	-165.6	0	0	0	0	0	115.1	T500 L502 Q506	T500-G504 WeakPolarHBondContact O-CA 3.47Å; T500-G504 PolarHBondContact O-N 3.21Å; L502-G504 PolarHBondContact O-N 3.31Å; G504-Q506 VanDerWaalsContact C-N 3.29Å; G504-Q506 PolarHBondContact O-N 2.87Å
505	M	47.6	Very low	53	Low	104 Å²	104	82.1 Å²	82.1	51%	0.512	46%	0.455	S	S	.	.			trans	-54.6	85.5	-179.3	-59.8	-166	88.5	0	0	111.3	R507 L540	M505-R507 VanDerWaalsContact C-N 3.31Å; M505-R507 PolarHBondContact O-N 2.71Å; M505-L540 HydrophobicContact CE-CD1 3.31Å; M505-L540 HydrophobicContact SD-CD1 3.95Å
506	Q	41.5	Very low	51.1	Low	124 Å²	124	87.9 Å²	87.9	58%	0.579	48%	0.484	S	S	*	.			trans	-68.4	100.1	166.1	-79.6	-170.6	-49	0	0	106.9	G504 Q508	G504-Q506 VanDerWaalsContact C-N 3.29Å; G504-Q506 PolarHBondContact O-N 2.87Å; Q506-Q508 PolarHBondContact O-N 2.7Å
507	R	39.5	Very low	50.1	Low	180 Å²	180	93.3 Å²	93.3	68%	0.679	52%	0.517	S	S	*	.			trans	-37.6	105.5	167	-77.6	176.1	166.1	165.9	-4.7	109.4	M505 K509 N545	M505-R507 VanDerWaalsContact C-N 3.31Å; M505-R507 PolarHBondContact O-N 2.71Å; R507-K509 PolarHBondContact O-N 2.72Å; R507-N545 PolarHBondContact NH2-OD1 3.22Å
508	Q	34.7	Very low	50	Low	145 Å²	145	93 Å²	93	68%	0.678	52%	0.52	S	S	*	.			trans	-64.2	99.2	144.5	-77.3	-172.3	-4.2	0	0	105.1	Q506 A510	Q506-Q508 PolarHBondContact O-N 2.7Å; Q508-A510 HydrophobicContact CB-CB 4.03Å; Q508-A510 PolarHBondContact O-N 2.92Å
509	K	33.2	Very low	50.3	Low	197 Å²	197	93.5 Å²	93.5	86%	0.857	52%	0.523	S	S	*	.			trans	-65.8	65.7	152.5	-80.5	-176.9	172.6	-179.3	0	107	R507	R507-K509 PolarHBondContact O-N 2.72Å
510	A	34.1	Very low	50.4	Low	70 Å²	70	97 Å²	97	58%	0.579	54%	0.538	S	S	*	.			trans	-102.3	101.9	171.9	0	0	0	0	0	107.6	Q508	Q508-A510 HydrophobicContact CB-CB 4.03Å; Q508-A510 PolarHBondContact O-N 2.92Å
511	A	31.9	Very low	50.9	Low	96 Å²	96	95.6 Å²	95.6	79%	0.793	53%	0.528	S	S	*	.			trans	7.7	113.3	165.2	0	0	0	0	0	119	K513	A511-K513 PolarHBondContact O-N 2.87Å; A511-K513 VanDerWaalsContact O-N 3.09Å
512	G	31	Very low	51.2	Low	88 Å²	88	93.8 Å²	93.8	91%	0.907	53%	0.528	S	S	*	.			trans	71.4	13.9	131.4	0	0	0	0	0	119.7
513	K	32.1	Very low	51.3	Low	204 Å²	204	94.8 Å²	94.8	89%	0.887	54%	0.537	S	S	*	.			trans	-83.4	128.3	170.1	-76.8	-175.9	177.8	179	0	111.2	A511	A511-K513 PolarHBondContact O-N 2.87Å; A511-K513 VanDerWaalsContact O-N 3.09Å
514	S	31.1	Very low	51.3	Low	81 Å²	81	95.8 Å²	95.8	57%	0.566	54%	0.543	S	S	*	.			trans	-57.3	135.7	178.6	176.7	0	0	0	0	111.4	N516	S514-N516 PolarHBondContact O-N 2.92Å
515	P	35.1	Very low	51.5	Low	102 Å²	102	96 Å²	96	66%	0.662	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-69.3	1.9	-177.5	27.2	-34.2	0	0	0	114.9
516	N	36.4	Very low	52	Low	151 Å²	151	92 Å²	92	81%	0.807	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-89.2	3	-172	-131.5	17.1	0	0	0	114.7	S514	S514-N516 PolarHBondContact O-N 2.92Å
517	T	52.4	Low	52.3	Low	115 Å²	115	88.7 Å²	88.7	71%	0.706	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-136.4	41.1	177.1	53.1	0	0	0	0	112.7	V519	T517-V519 PolarHBondContact O-N 2.86Å; T517-V519 VanDerWaalsContact O-N 3.15Å
518	D	70.7	Confident	52.5	Low	87 Å²	87	81.2 Å²	81.2	47%	0.465	48%	0.482	S	S	.	.			trans	-73.2	6.1	-179.3	-72.2	-12.9	0	0	0	114.8	K520	D518-K520 PolarHBondContact O-N 3.02Å
519	V	80.9	Confident	53	Low	31 Å²	31	76 Å²	76	19%	0.188	46%	0.46	C	S	.	.			trans	-76.1	115.4	-179.8	-176.4	0	0	0	0	109.2	V140 V143 T517 A537 S538	V140-V519 HydrophobicContact CG1-CB 4.12Å; V140-V519 HydrophobicContact CG1-CG2 3.95Å; V140-V519 HydrophobicContact CG2-CB 4.3Å; V140-V519 HydrophobicContact CG2-CG1 4.02Å; V143-V519 HydrophobicContact CB-CG1 4.41Å; V143-V519 HydrophobicContact CB-CG2 4.23Å; V143-V519 HydrophobicContact CG1-CG1 4.34Å; V143-V519 HydrophobicContact CG1-CG2 3.87Å; V143-V519 HydrophobicContact CG2-CG1 4.35Å; T517-V519 PolarHBondContact O-N 2.86Å; T517-V519 VanDerWaalsContact O-N 3.15Å; V519-A537 HydrophobicContact CG1-CB 4.17Å; V519-S538 CarbonylContact C-O 3.54Å; V519-S538 WeakPolarHBondContact CA-O 3.42Å
520	K	79.7	Confident	53.7	Low	78 Å²	78	76.3 Å²	76.3	34%	0.339	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	141	173.9	-62.7	-172.7	-174.5	-175.7	0	109.8	D272 D518 A537 S538	D272-K520 WeakPolarHBondContact OD2-CE 3.29Å; D272-K520 IonicContact OD2-NZ 3.44Å; D272-K520 PolarHBondContact OD2-NZ 3.19Å; D518-K520 PolarHBondContact O-N 3.02Å; K520-A537 CarbonylContact O-C 3.43Å; K520-A537 WeakPolarHBondContact O-CA 3.32Å; K520-S538 PolarHBondContact N-O 2.88Å; K520-S538 PolarHBondContact O-N 3.23Å
521	I	80.9	Confident	54.5	Low	15 Å²	15	75.6 Å²	75.6	8%	0.077	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	117.9	178.9	-62.5	173.9	0	0	0	107.2	V140 L535 L536 A537 T654 Y656	V140-I521 HydrophobicContact CG2-CD1 3.96Å; I521-L535 HydrophobicContact CG2-CD1 3.94Å; I521-L535 HydrophobicContact CG2-CD2 3.49Å; I521-L535 VanDerWaalsContact CG2-CD2 3.49Å; I521-L535 HydrophobicContact CG2-CG 3.8Å; I521-L536 WeakPolarHBondContact CA-O 3.41Å; I521-A537 HydrophobicContact CG1-CB 4.34Å; I521-T654 HydrophobicContact CD1-CG2 3.8Å; I521-Y656 HydrophobicContact CG2-CE2 3.98Å
522	A	77	Confident	56	Low	46 Å²	46	72.9 Å²	72.9	38%	0.38	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	144.5	179.1	0	0	0	0	0	110.4	L536	A522-L536 PolarHBondContact N-O 3.02Å; A522-L536 PolarHBondContact O-N 3.36Å
523	A	76.3	Confident	58.1	Low	27 Å²	27	68.9 Å²	68.9	22%	0.223	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	132.1	171.5	0	0	0	0	0	108.4	L535 L557 L599 Y656	A523-L535 HydrophobicContact CB-CD1 4.02Å; A523-L557 HydrophobicContact CB-CD2 4.33Å; A523-L599 HydrophobicContact CB-CD1 3.44Å; A523-L599 VanDerWaalsContact CB-CD1 3.44Å; A523-L599 HydrophobicContact CB-CD2 3.75Å; A523-L599 HydrophobicContact CB-CG 4.24Å; A523-Y656 PolarHBondContact N-OH 3.01Å
524	I	71.2	Confident	60.4	Low	42 Å²	42	59.8 Å²	59.8	22%	0.215	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	129.1	-174.7	-54.1	-178.4	0	0	0	108.6	V534 L536	I524-V534 PolarHBondContact N-O 2.85Å; I524-V534 PolarHBondContact O-N 2.72Å; I524-L536 HydrophobicContact CD1-CB 3.53Å; I524-L536 HydrophobicContact CD1-CD2 3.39Å; I524-L536 HydrophobicContact CD1-CG 4.07Å; I524-L536 HydrophobicContact CG1-CB 4.18Å
525	D	64.4	Low	63	Low	32 Å²	32	56 Å²	56	17%	0.171	32%	0.315	C	S	.	.			trans	-73.8	135.8	167.9	-84.7	-9.1	0	0	0	109.2	P527 S533 L599	D525-P527 WeakPolarHBondContact O-CD 3.07Å; D525-S533 WeakPolarHBondContact OD1-CB 3.19Å; D525-S533 PolarHBondContact OD1-OG 3.18Å; D525-L599 WeakPolarHBondContact OD1-CB 3.34Å; D525-L599 WeakPolarHBondContact OD1-CG 3.38Å; D525-L599 PolarHBondContact OD1-N 3.4Å
526	N	58.2	Low	65.4	Low	21 Å²	21	51.3 Å²	51.3	11%	0.112	28%	0.284	C	S	.	.			trans	-100.9	92.8	178.5	-172.1	-15	0	0	0	109.9	C528 T529	N526-C528 VanDerWaalsContact C-N 3.32Å; N526-C528 PolarHBondContact O-N 2.83Å; N526-C528 PolarHBondContact OD1-N 3.02Å; N526-T529 PolarHBondContact ND2-OG1 2.91Å; N526-T529 VanDerWaalsContact O-O 3.1Å; N526-T529 PolarHBondContact OD1-OG1 2.97Å
527	P	47.5	Very low	68	Low	55 Å²	55	44.2 Å²	44.2	36%	0.357	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-23.6	-172.9	29.7	-36.9	0	0	0	113.4	E264 V338 D525 T529	E264-P527 WeakPolarHBondContact OE2-CG 3.43Å; V338-P527 HydrophobicContact CG1-CB 3.8Å; V338-P527 HydrophobicContact CG2-CB 4.31Å; D525-P527 WeakPolarHBondContact O-CD 3.07Å; P527-T529 VanDerWaalsContact C-N 3.26Å; P527-T529 PolarHBondContact O-N 2.9Å
528	C	44.1	Very low	69.7	Low	23 Å²	23	39 Å²	39	16%	0.155	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-9.5	-170.1	-70.1	0	0	0	0	114.2	L257 N526	L257-C528 HydrophobicContact CD2-CB 4.18Å; N526-C528 VanDerWaalsContact C-N 3.32Å; N526-C528 PolarHBondContact O-N 2.83Å; N526-C528 PolarHBondContact OD1-N 3.02Å
529	T	44	Very low	70.5	Confident	34 Å²	34	35 Å²	35	21%	0.209	19%	0.193	C	C	.	.	S	Bend	trans	-141.2	150.8	-177.5	52.3	0	0	0	0	107.4	N526 P527 R531	N526-T529 PolarHBondContact ND2-OG1 2.91Å; N526-T529 VanDerWaalsContact O-O 3.1Å; N526-T529 PolarHBondContact OD1-OG1 2.97Å; P527-T529 VanDerWaalsContact C-N 3.26Å; P527-T529 PolarHBondContact O-N 2.9Å; T529-R531 HydrophobicContact CG2-CG 4.43Å; T529-R531 PolarHBondContact O-N 3.49Å; T529-R531 WeakPolarHBondContact OG1-CB 3.33Å; T529-R531 WeakPolarHBondContact OG1-CD 3.49Å; T529-R531 WeakPolarHBondContact OG1-CG 3.4Å
530	H	47.9	Very low	70.8	Confident	204 Å²	204	34.9 Å²	34.9	94%	0.944	19%	0.191	S	C	*	.	S	Bend	trans	-62.4	17.1	168	-81.3	-86.9	0	0	0	113.3
531	R	52.4	Low	71.1	Confident	55 Å²	55	31.1 Å²	31.1	21%	0.208	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-70.2	150.8	-178.3	-70.8	177.7	-170	176.1	2.3	111.1	A186 T529	A186-R531 VanDerWaalsContact CB-NH2 3.34Å; T529-R531 HydrophobicContact CG2-CG 4.43Å; T529-R531 PolarHBondContact O-N 3.49Å; T529-R531 WeakPolarHBondContact OG1-CB 3.33Å; T529-R531 WeakPolarHBondContact OG1-CD 3.49Å; T529-R531 WeakPolarHBondContact OG1-CG 3.4Å
532	S	61.7	Low	71	Confident	40 Å²	40	34.5 Å²	34.5	28%	0.28	19%	0.19	S	C	.	.	P	Polyproline II helix	trans	-55.4	149.1	168.8	-49.3	0	0	0	0	111.6
533	S	75.7	Confident	71.1	Confident	4 Å²	4	35.1 Å²	35.1	3%	0.028	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-52.3	144.6	167.3	-50.3	0	0	0	0	110.4	D525 L557 V597	D525-S533 WeakPolarHBondContact OD1-CB 3.19Å; D525-S533 PolarHBondContact OD1-OG 3.18Å; S533-L557 WeakPolarHBondContact O-CB 3.41Å; S533-L557 PolarHBondContact O-N 3.36Å; S533-V597 PolarHBondContact OG-O 3.46Å
534	V	80.6	Confident	71.1	Confident	12 Å²	12	37.1 Å²	37.1	7%	0.073	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	154.5	-179.4	-64.9	0	0	0	0	110.6	L227 I524 E554 V555	L227-V534 HydrophobicContact CD1-CG1 4.47Å; I524-V534 PolarHBondContact N-O 2.85Å; I524-V534 PolarHBondContact O-N 2.72Å; V534-E554 HydrophobicContact CB-CB 4.42Å; V534-E554 HydrophobicContact CG2-CG 4.33Å; V534-V555 WeakPolarHBondContact CA-O 3.37Å; V534-V555 WeakPolarHBondContact CB-O 3.45Å
535	L	86.2	Confident	71	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.4	165.3	-165.2	88	0	0	0	109.2	L136 I521 A523 E554 V555 L557 L560 Y656	L136-L535 HydrophobicContact CD2-CD2 3.16Å; L136-L535 HydrophobicContact CG-CD2 4.47Å; I521-L535 HydrophobicContact CG2-CD1 3.94Å; I521-L535 HydrophobicContact CG2-CD2 3.49Å; I521-L535 VanDerWaalsContact CG2-CD2 3.49Å; I521-L535 HydrophobicContact CG2-CG 3.8Å; A523-L535 HydrophobicContact CB-CD1 4.02Å; L535-E554 WeakPolarHBondContact O-CA 3.45Å; L535-V555 HydrophobicContact CB-CB 4.44Å; L535-V555 PolarHBondContact N-O 2.89Å; L535-V555 PolarHBondContact O-N 3.27Å; L535-L557 HydrophobicContact CB-CD1 4.38Å; L535-L557 HydrophobicContact CD1-CD1 4.26Å; L535-L560 HydrophobicContact CD2-CD2 3.68Å; L535-Y656 HydrophobicContact CD1-CE2 3.91Å
536	L	86.1	Confident	71.3	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	114.4	176.8	178.6	61.7	0	0	0	110.3	F230 V265 V269 I521 A522 I524 E554	F230-L536 HydrophobicContact CE1-CD1 3.75Å; F230-L536 HydrophobicContact CZ-CD1 3.53Å; F230-L536 HydrophobicContact CZ-CD2 4.39Å; V265-L536 HydrophobicContact CG1-CD2 4.3Å; V269-L536 HydrophobicContact CG2-CD2 3.55Å; I521-L536 WeakPolarHBondContact CA-O 3.41Å; A522-L536 PolarHBondContact N-O 3.02Å; A522-L536 PolarHBondContact O-N 3.36Å; I524-L536 HydrophobicContact CD1-CB 3.53Å; I524-L536 HydrophobicContact CD1-CD2 3.39Å; I524-L536 HydrophobicContact CD1-CG 4.07Å; I524-L536 HydrophobicContact CG1-CB 4.18Å; L536-E554 HydrophobicContact CD1-CG 4.13Å
537	A	89.4	Confident	72.1	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.008	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	120	163.7	0	0	0	0	0	108.8	C139 V143 V519 K520 I521 G552 V553	C139-A537 HydrophobicContact CB-CB 4.14Å; V143-A537 HydrophobicContact CG2-CB 4.21Å; V143-A537 WeakPolarHBondContact CG2-O 3.5Å; V519-A537 HydrophobicContact CG1-CB 4.17Å; K520-A537 CarbonylContact O-C 3.43Å; K520-A537 WeakPolarHBondContact O-CA 3.32Å; I521-A537 HydrophobicContact CG1-CB 4.34Å; A537-G552 CarbonylContact O-C 3.59Å; A537-G552 VanDerWaalsContact O-CA 3.29Å; A537-G552 WeakPolarHBondContact O-CA 3.48Å; A537-V553 PolarHBondContact N-O 3.07Å; A537-V553 PolarHBondContact O-N 2.67Å
538	S	88.8	Confident	73.8	Confident	6 Å²	6	44.7 Å²	44.7	4%	0.042	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	154.6	-172.7	62.9	0	0	0	0	113.9	V269 V519 K520 V551	V269-S538 WeakPolarHBondContact CG1-OG 3.31Å; V269-S538 VanDerWaalsContact CG2-OG 3.25Å; V269-S538 WeakPolarHBondContact CG2-OG 3.47Å; V519-S538 CarbonylContact C-O 3.54Å; V519-S538 WeakPolarHBondContact CA-O 3.42Å; K520-S538 PolarHBondContact N-O 2.88Å; K520-S538 PolarHBondContact O-N 3.23Å; S538-V551 CarbonylContact C-O 3.5Å; S538-V551 WeakPolarHBondContact CA-O 3.27Å; S538-V551 WeakPolarHBondContact CB-O 3.19Å
539	S	88.1	Confident	75.8	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.014	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	143.1	174.7	173.7	0	0	0	0	110.3	K147 L550 V551	K147-S539 PolarHBondContact NZ-OG 3.12Å; S539-L550 WeakPolarHBondContact O-CA 3.25Å; S539-V551 PolarHBondContact N-O 2.79Å; S539-V551 PolarHBondContact O-N 2.96Å
540	L	85.7	Confident	77.9	Confident	29 Å²	29	42 Å²	42	15%	0.152	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	143.5	165.7	-68.4	166.5	0	0	0	110.3	K147 M505 Q542 V547 L550	K147-L540 WeakPolarHBondContact CE-O 3.33Å; K147-L540 PolarHBondContact NZ-O 2.8Å; M505-L540 HydrophobicContact CE-CD1 3.31Å; M505-L540 HydrophobicContact SD-CD1 3.95Å; L540-Q542 HydrophobicContact CB-CG 4.21Å; L540-V547 HydrophobicContact CD2-CG1 4.34Å; L540-L550 HydrophobicContact CD2-CB 4.12Å
541	V	86.3	Confident	80	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	113.3	172.3	-171.5	0	0	0	0	107.5	K147 I150 L151 V548 G549 V551	K147-V541 HydrophobicContact CG-CG2 4.24Å; I150-V541 HydrophobicContact CD1-CG2 4.41Å; I150-V541 HydrophobicContact CG2-CG1 3.9Å; L151-V541 HydrophobicContact CD2-CG1 3.74Å; L151-V541 HydrophobicContact CG-CG1 4.05Å; V541-V548 HydrophobicContact CB-CB 4.46Å; V541-V548 HydrophobicContact CG1-CB 4.24Å; V541-V548 PolarHBondContact O-N 3.41Å; V541-G549 PolarHBondContact N-O 3.03Å; V541-G549 PolarHBondContact O-N 3.44Å; V541-V551 HydrophobicContact CG2-CG2 3.68Å
542	Q	80	Confident	81.8	Confident	85 Å²	85	29.6 Å²	29.6	40%	0.397	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	143.4	-174	-60	-175.1	-17.6	0	0	110.4	L540 N546 V547	L540-Q542 HydrophobicContact CB-CG 4.21Å; Q542-N546 WeakPolarHBondContact CA-O 3.36Å; Q542-V547 HydrophobicContact CG-CG2 4.14Å
543	I	79.1	Confident	83.2	Confident	59 Å²	59	27.7 Å²	27.7	30%	0.303	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	110.5	172.9	-62.6	173.3	0	0	0	107.1	L151 F154 N545 N546 V548	L151-I543 HydrophobicContact CD2-CD1 4.01Å; L151-I543 HydrophobicContact CD2-CG1 3.66Å; F154-I543 HydrophobicContact CB-CD1 4.22Å; F154-I543 HydrophobicContact CD1-CD1 3.12Å; F154-I543 HydrophobicContact CE1-CD1 3.53Å; F154-I543 HydrophobicContact CG-CD1 3.75Å; F154-I543 HydrophobicContact CZ-CD1 4.44Å; I543-N545 PolarHBondContact O-N 3.21Å; I543-N546 PolarHBondContact N-O 3.13Å; I543-N546 PolarHBondContact O-N 2.93Å; I543-V548 HydrophobicContact CB-CG2 4.38Å; I543-V548 HydrophobicContact CD1-CG2 3.75Å; I543-V548 HydrophobicContact CG1-CG2 3.89Å
544	G	75.5	Confident	83.9	Confident	69 Å²	69	28.1 Å²	28.1	71%	0.711	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	-118.9	-169.9	0	0	0	0	0	110.9
545	N	68.9	Low	84.1	Confident	122 Å²	122	27.7 Å²	27.7	65%	0.652	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-2.3	176.4	-66.4	-22.8	0	0	0	113.4	R507 I543	R507-N545 PolarHBondContact NH2-OD1 3.22Å; I543-N545 PolarHBondContact O-N 3.21Å
546	N	70.6	Confident	84	Confident	124 Å²	124	28.5 Å²	28.5	66%	0.663	17%	0.168	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	123.9	-174.6	-67.4	-11.9	0	0	0	110.1	Q542 I543 V548	Q542-N546 WeakPolarHBondContact CA-O 3.36Å; I543-N546 PolarHBondContact N-O 3.13Å; I543-N546 PolarHBondContact O-N 2.93Å; N546-V548 PolarHBondContact O-N 3.17Å
547	V	76.5	Confident	84	Confident	52 Å²	52	28.4 Å²	28.4	32%	0.315	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	119.9	172.2	-173.8	0	0	0	0	108.3	A234 L540 Q542	A234-V547 VanDerWaalsContact CB-O 3.27Å; A234-V547 WeakPolarHBondContact CB-O 3.48Å; L540-V547 HydrophobicContact CD2-CG1 4.34Å; Q542-V547 HydrophobicContact CG-CG2 4.14Å
548	V	82.7	Confident	83.8	Confident	11 Å²	11	28.4 Å²	28.4	7%	0.067	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	-36	175.5	177.3	0	0	0	0	110.1	I150 F154 F206 A234 V541 I543 N546	I150-V548 HydrophobicContact CG2-CG1 4.41Å; F154-V548 HydrophobicContact CD2-CB 4.47Å; F154-V548 HydrophobicContact CD2-CG1 3.5Å; F154-V548 HydrophobicContact CD2-CG2 4.1Å; F154-V548 HydrophobicContact CE1-CG2 4.48Å; F154-V548 HydrophobicContact CE2-CB 4.48Å; F154-V548 HydrophobicContact CE2-CG1 3.79Å; F154-V548 HydrophobicContact CE2-CG2 3.97Å; F154-V548 HydrophobicContact CG-CG1 4.29Å; F154-V548 HydrophobicContact CG-CG2 4.42Å; F154-V548 HydrophobicContact CZ-CG2 4.16Å; F206-V548 HydrophobicContact CD1-CG1 3.68Å; F206-V548 HydrophobicContact CE1-CG1 3.72Å; F206-V548 HydrophobicContact CG-CG1 4.47Å; A234-V548 PolarHBondContact N-O 3.17Å; V541-V548 HydrophobicContact CB-CB 4.46Å; V541-V548 HydrophobicContact CG1-CB 4.24Å; V541-V548 PolarHBondContact O-N 3.41Å; I543-V548 HydrophobicContact CB-CG2 4.38Å; I543-V548 HydrophobicContact CD1-CG2 3.75Å; I543-V548 HydrophobicContact CG1-CG2 3.89Å; N546-V548 PolarHBondContact O-N 3.17Å
549	G	84.9	Confident	83.6	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.9	-158.9	179	0	0	0	0	0	111.6	I232 V541	I232-G549 CarbonylContact O-C 3.6Å; I232-G549 WeakPolarHBondContact O-CA 3.34Å; V541-G549 PolarHBondContact N-O 3.03Å; V541-G549 PolarHBondContact O-N 3.44Å
550	L	88.9	Confident	83.5	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	152.7	174.3	68.9	90.7	0	0	0	110.9	F230 F231 I232 F266 V269 S539 L540	F230-L550 HydrophobicContact CD2-CD1 4.21Å; F230-L550 HydrophobicContact CE2-CD1 3.58Å; F231-L550 CarbonylContact C-O 3.52Å; F231-L550 WeakPolarHBondContact CA-O 3.37Å; F231-L550 WeakPolarHBondContact CD2-O 3Å; I232-L550 HydrophobicContact CB-CD1 4.25Å; I232-L550 HydrophobicContact CB-CD2 4.4Å; I232-L550 HydrophobicContact CB-CG 4.01Å; I232-L550 HydrophobicContact CD1-CD1 4.07Å; I232-L550 HydrophobicContact CD1-CD2 4.48Å; I232-L550 HydrophobicContact CG1-CD1 4.05Å; I232-L550 HydrophobicContact CG1-CG 4.36Å; I232-L550 PolarHBondContact N-O 3.23Å; I232-L550 PolarHBondContact O-N 2.93Å; F266-L550 HydrophobicContact CB-CD2 4.08Å; F266-L550 HydrophobicContact CD2-CD2 3.18Å; F266-L550 HydrophobicContact CD2-CG 4.19Å; F266-L550 HydrophobicContact CE2-CD2 3.59Å; F266-L550 HydrophobicContact CE2-CG 4.47Å; F266-L550 HydrophobicContact CG-CD2 3.7Å; F266-L550 HydrophobicContact CZ-CD2 4.39Å; V269-L550 HydrophobicContact CB-CD2 4.32Å; V269-L550 HydrophobicContact CG1-CB 4.44Å; V269-L550 HydrophobicContact CG1-CD2 4.43Å; S539-L550 WeakPolarHBondContact O-CA 3.25Å; L540-L550 HydrophobicContact CD2-CB 4.12Å
551	V	91.7	Very high	83.7	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	140.4	175.8	172.1	0	0	0	0	108.4	V143 I146 I150 F230 F231 S538 S539 V541	V143-V551 HydrophobicContact CG1-CB 4.46Å; V143-V551 HydrophobicContact CG1-CG1 4.09Å; I146-V551 HydrophobicContact CB-CG1 3.73Å; I146-V551 HydrophobicContact CB-CG2 4.49Å; I146-V551 HydrophobicContact CD1-CG1 3.95Å; I146-V551 HydrophobicContact CG1-CG1 4.49Å; I146-V551 HydrophobicContact CG2-CB 4.34Å; I146-V551 HydrophobicContact CG2-CG1 3.58Å; I146-V551 HydrophobicContact CG2-CG2 3.74Å; I150-V551 HydrophobicContact CD1-CG2 3.21Å; F230-V551 WeakPolarHBondContact O-CA 3.29Å; F231-V551 HydrophobicContact CD2-CG2 4.14Å; S538-V551 CarbonylContact C-O 3.5Å; S538-V551 WeakPolarHBondContact CA-O 3.27Å; S538-V551 WeakPolarHBondContact CB-O 3.19Å; S539-V551 PolarHBondContact N-O 2.79Å; S539-V551 PolarHBondContact O-N 2.96Å; V541-V551 HydrophobicContact CG2-CG2 3.68Å
552	G	91.2	Very high	83.8	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	152.7	176.1	0	0	0	0	0	113.4	Q229 F230 A537	Q229-G552 WeakPolarHBondContact CA-O 3.47Å; F230-G552 PolarHBondContact N-O 3.49Å; F230-G552 PolarHBondContact O-N 3.31Å; A537-G552 CarbonylContact O-C 3.59Å; A537-G552 VanDerWaalsContact O-CA 3.29Å; A537-G552 WeakPolarHBondContact O-CA 3.48Å
553	V	91.3	Very high	84.1	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	125.7	173.9	179.2	0	0	0	0	107.9	A142 V143 I146 I226 K228 Q229 A537	A142-V553 HydrophobicContact CB-CG2 4.16Å; V143-V553 HydrophobicContact CG2-CB 4.16Å; V143-V553 HydrophobicContact CG2-CG2 3.64Å; I146-V553 HydrophobicContact CD1-CG2 4.29Å; I226-V553 HydrophobicContact CB-CG1 4.18Å; I226-V553 HydrophobicContact CD1-CG1 3.9Å; I226-V553 HydrophobicContact CG1-CG1 3.69Å; I226-V553 HydrophobicContact CG2-CG1 3.59Å; K228-V553 CarbonylContact O-C 3.54Å; K228-V553 WeakPolarHBondContact O-CA 3.39Å; Q229-V553 HydrophobicContact CG-CG1 4.37Å; Q229-V553 HydrophobicContact CG-CG2 4.19Å; A537-V553 PolarHBondContact N-O 3.07Å; A537-V553 PolarHBondContact O-N 2.67Å
554	E	88.9	Confident	84.7	Confident	12 Å²	12	24.4 Å²	24.4	6%	0.056	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.5	176.7	-65.1	169.6	-161.8	0	0	109.8	L227 K228 F230 R238 V534 L535 L536	L227-E554 PolarHBondContact N-O 2.81Å; K228-E554 HydrophobicContact CB-CB 3.96Å; K228-E554 HydrophobicContact CB-CG 4.31Å; K228-E554 PolarHBondContact N-O 2.84Å; K228-E554 PolarHBondContact O-N 3.13Å; F230-E554 HydrophobicContact CE1-CG 3.99Å; F230-E554 WeakPolarHBondContact CE1-OE1 3.36Å; R238-E554 IonicContact NH2-OE1 3.85Å; V534-E554 HydrophobicContact CB-CB 4.42Å; V534-E554 HydrophobicContact CG2-CG 4.33Å; L535-E554 WeakPolarHBondContact O-CA 3.45Å; L536-E554 HydrophobicContact CD1-CG 4.13Å
555	V	86.4	Confident	85.2	Confident	4 Å²	4	21.9 Å²	21.9	2%	0.024	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	143.9	176.5	179.5	0	0	0	0	108.8	C139 S225 V534 L535 L557	C139-V555 HydrophobicContact CB-CG2 4.43Å; C139-V555 WeakPolarHBondContact SG-CG2 3.28Å; S225-V555 WeakPolarHBondContact O-CG1 3.24Å; V534-V555 WeakPolarHBondContact CA-O 3.37Å; V534-V555 WeakPolarHBondContact CB-O 3.45Å; L535-V555 HydrophobicContact CB-CB 4.44Å; L535-V555 PolarHBondContact N-O 2.89Å; L535-V555 PolarHBondContact O-N 3.27Å; V555-L557 PolarHBondContact O-N 3.46Å; V555-L557 VanDerWaalsContact O-N 3.09Å
556	D	82.7	Confident	85.9	Confident	19 Å²	19	16.8 Å²	16.8	10%	0.102	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	113.1	171.4	-172.3	2	0	0	0	110	L227 A558 E559 L560	L227-D556 HydrophobicContact CD1-CB 3.73Å; L227-D556 HydrophobicContact CG-CB 4.2Å; D556-A558 PolarHBondContact O-N 3.34Å; D556-A558 VanDerWaalsContact OD1-CB 3.23Å; D556-A558 WeakPolarHBondContact OD1-CB 3.31Å; D556-A558 PolarHBondContact OD1-N 3.02Å; D556-E559 HydrophobicContact CB-CB 4.08Å; D556-E559 PolarHBondContact O-N 3.25Å; D556-L560 PolarHBondContact O-N 3.35Å
557	L	86.1	Confident	86.5	Confident	2 Å²	2	12.5 Å²	12.5	1%	0.01	7%	0.067	C	C	.	.	H	α-helix	trans	-62.1	-33.2	177.7	-175.1	63.2	0	0	0	110.6	A523 S533 L535 V555 E559 L560 V561 V597 L599	A523-L557 HydrophobicContact CB-CD2 4.33Å; S533-L557 WeakPolarHBondContact O-CB 3.41Å; S533-L557 PolarHBondContact O-N 3.36Å; L535-L557 HydrophobicContact CB-CD1 4.38Å; L535-L557 HydrophobicContact CD1-CD1 4.26Å; V555-L557 PolarHBondContact O-N 3.46Å; V555-L557 VanDerWaalsContact O-N 3.09Å; L557-E559 VanDerWaalsContact C-N 3.35Å; L557-E559 PolarHBondContact O-N 2Å; L557-L560 HydrophobicContact CD1-CD2 4.4Å; L557-L560 PolarHBondContact O-N 3.01Å; L557-V561 HydrophobicContact CD1-CG1 3.88Å; L557-V561 HydrophobicContact CG-CG1 4.2Å; L557-V561 WeakPolarHBondContact O-CG2 3.45Å; L557-V561 PolarHBondContact O-N 3.27Å; L557-V597 HydrophobicContact CD2-CG1 3.75Å; L557-V597 HydrophobicContact CG-CG1 4.31Å; L557-L599 HydrophobicContact CD2-CD1 4.47Å; L557-L599 HydrophobicContact CD2-CD2 3.52Å; L557-L599 HydrophobicContact CD2-CG 4.13Å
558	A	84.9	Confident	86.3	Confident	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-62	-41.4	179.2	0	0	0	0	0	111.8	D556 A562 L594 P595 V597 M725	D556-A558 PolarHBondContact O-N 3.34Å; D556-A558 VanDerWaalsContact OD1-CB 3.23Å; D556-A558 WeakPolarHBondContact OD1-CB 3.31Å; D556-A558 PolarHBondContact OD1-N 3.02Å; A558-A562 VanDerWaalsContact O-CB 3.25Å; A558-A562 WeakPolarHBondContact O-CB 3.31Å; A558-A562 PolarHBondContact O-N 2.94Å; A558-L594 HydrophobicContact CB-CD2 3.71Å; A558-P595 WeakPolarHBondContact CB-O 3.45Å; A558-V597 HydrophobicContact CB-CG2 3.87Å; A558-M725 HydrophobicContact CB-CE 3.55Å; A558-M725 HydrophobicContact CB-SD 4.18Å
559	E	85	Confident	85.5	Confident	38 Å²	38	13.5 Å²	13.5	18%	0.178	7%	0.071	C	C	.	.	H	α-helix	trans	-66.9	-34.9	174.4	-174.3	174.6	-171.5	0	0	113.5	K135 D556 L557 M725	K135-E559 PolarHBondContact NZ-O 3.36Å; K135-E559 IonicContact NZ-OE1 2.77Å; D556-E559 HydrophobicContact CB-CB 4.08Å; D556-E559 PolarHBondContact O-N 3.25Å; L557-E559 VanDerWaalsContact C-N 3.35Å; L557-E559 PolarHBondContact O-N 2Å; E559-M725 HydrophobicContact CB-CG 4.25Å
560	L	86.8	Confident	84.2	Confident	6 Å²	6	14.7 Å²	14.7	3%	0.031	8%	0.083	C	C	.	.	H	α-helix	trans	-70.9	-42.9	179	-171	66.5	0	0	0	112.1	M132 K135 L136 L535 D556 L557 P563	M132-L560 HydrophobicContact CE-CD2 3.61Å; M132-L560 HydrophobicContact CE-CG 3.92Å; M132-L560 HydrophobicContact CG-CD1 3.79Å; M132-L560 HydrophobicContact CG-CD2 4.49Å; M132-L560 HydrophobicContact CG-CG 4.08Å; K135-L560 HydrophobicContact CB-CD1 4.1Å; K135-L560 HydrophobicContact CD-CD1 4.13Å; L136-L560 HydrophobicContact CD1-CD2 4.43Å; L136-L560 HydrophobicContact CD2-CD1 4.26Å; L136-L560 HydrophobicContact CD2-CD2 3.89Å; L136-L560 HydrophobicContact CG-CD1 4.25Å; L136-L560 HydrophobicContact CG-CD2 4.42Å; L535-L560 HydrophobicContact CD2-CD2 3.68Å; D556-L560 PolarHBondContact O-N 3.35Å; L557-L560 HydrophobicContact CD1-CD2 4.4Å; L557-L560 PolarHBondContact O-N 3.01Å; L560-P563 WeakPolarHBondContact O-CD 3.49Å
561	V	88.9	Confident	82.7	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-90.5	-10.2	-176.1	-53.6	0	0	0	0	113.8	L557 P563 I564 M565 L578 V587 L594 V597	L557-V561 HydrophobicContact CD1-CG1 3.88Å; L557-V561 HydrophobicContact CG-CG1 4.2Å; L557-V561 WeakPolarHBondContact O-CG2 3.45Å; L557-V561 PolarHBondContact O-N 3.27Å; V561-P563 VanDerWaalsContact C-CD 3.47Å; V561-I564 WeakPolarHBondContact O-CA 2.86Å; V561-I564 WeakPolarHBondContact O-CB 3.01Å; V561-I564 PolarHBondContact O-N 2.98Å; V561-M565 HydrophobicContact CG2-CG 4.12Å; V561-M565 WeakPolarHBondContact O-CG 3.33Å; V561-M565 PolarHBondContact O-N 3.09Å; V561-L578 HydrophobicContact CG1-CD2 4.24Å; V561-V587 HydrophobicContact CB-CG1 4.23Å; V561-V587 HydrophobicContact CB-CG2 4.43Å; V561-V587 HydrophobicContact CG1-CB 4.47Å; V561-V587 HydrophobicContact CG1-CG2 4.04Å; V561-V587 HydrophobicContact CG2-CG1 4.1Å; V561-V587 HydrophobicContact CG2-CG2 4.28Å; V561-L594 HydrophobicContact CG2-CD2 4.42Å; V561-V597 HydrophobicContact CG2-CG2 4.24Å
562	A	88.3	Confident	81.2	Confident	2 Å²	2	17.7 Å²	17.7	2%	0.017	11%	0.108	C	C	.	.	H	α-helix	trans	-51.1	-43.5	178.9	0	0	0	0	0	114.6	A558 I564 M565 Y566 L594 M725	A558-A562 VanDerWaalsContact O-CB 3.25Å; A558-A562 WeakPolarHBondContact O-CB 3.31Å; A558-A562 PolarHBondContact O-N 2.94Å; A562-I564 VanDerWaalsContact C-N 3.27Å; A562-I564 PolarHBondContact O-N 3.34Å; A562-M565 PolarHBondContact O-N 3.3Å; A562-Y566 HydrophobicContact CB-CD2 4.38Å; A562-Y566 WeakPolarHBondContact O-CB 3.48Å; A562-Y566 WeakPolarHBondContact O-CD2 3.38Å; A562-Y566 PolarHBondContact O-N 2.73Å; A562-L594 HydrophobicContact CB-CD1 3.93Å; A562-M725 HydrophobicContact CB-CG 3.74Å; A562-M725 HydrophobicContact CB-SD 4.28Å
563	P	87.9	Confident	80.1	Confident	48 Å²	48	19.3 Å²	19.3	31%	0.312	12%	0.118	S	C	.	.	H	α-helix	trans	-60.7	-34.8	175.4	-24	35.6	0	0	0	113.5	L128 L560 V561 Y567	L128-P563 HydrophobicContact CD2-CB 3.94Å; L560-P563 WeakPolarHBondContact O-CD 3.49Å; V561-P563 VanDerWaalsContact C-CD 3.47Å; P563-Y567 WeakPolarHBondContact O-CB 3.18Å; P563-Y567 PolarHBondContact O-N 3.01Å; P563-Y567 VanDerWaalsContact O-N 3.11Å
564	I	89.6	Confident	79.6	Confident	4 Å²	4	19.6 Å²	19.6	2%	0.021	12%	0.119	C	C	.	.	H	α-helix	trans	-71.6	-47.7	177.8	-56.2	173.8	0	0	0	109.6	M132 V561 A562 Y566 Y567 A576 L578 I658	M132-I564 HydrophobicContact SD-CD1 4.22Å; V561-I564 WeakPolarHBondContact O-CA 2.86Å; V561-I564 WeakPolarHBondContact O-CB 3.01Å; V561-I564 PolarHBondContact O-N 2.98Å; A562-I564 VanDerWaalsContact C-N 3.27Å; A562-I564 PolarHBondContact O-N 3.34Å; I564-Y566 VanDerWaalsContact C-N 3.31Å; I564-Y566 PolarHBondContact O-N 3.07Å; I564-Y567 VanDerWaalsContact O-CB 3.27Å; I564-Y567 WeakPolarHBondContact O-CB 3.39Å; I564-Y567 PolarHBondContact O-N 3.49Å; I564-A576 HydrophobicContact CG2-CB 3.75Å; I564-L578 HydrophobicContact CD1-CB 4.3Å; I564-L578 HydrophobicContact CD1-CD1 4.06Å; I564-I658 HydrophobicContact CD1-CD1 3.82Å; I564-I658 HydrophobicContact CD1-CG1 4.02Å; I564-I658 HydrophobicContact CG1-CD1 4.21Å
565	M	86.3	Confident	79.5	Confident	16 Å²	16	19.6 Å²	19.6	8%	0.079	12%	0.119	C	C	.	.	H	α-helix	trans	-65.8	-33.2	-178.4	-68.6	-58.9	-68.9	0	0	113.4	V561 A562 V587 P589 V592 L594	V561-M565 HydrophobicContact CG2-CG 4.12Å; V561-M565 WeakPolarHBondContact O-CG 3.33Å; V561-M565 PolarHBondContact O-N 3.09Å; A562-M565 PolarHBondContact O-N 3.3Å; M565-V587 HydrophobicContact CE-CG1 4.39Å; M565-V587 HydrophobicContact CG-CG1 3.8Å; M565-V587 HydrophobicContact SD-CG1 3.18Å; M565-V587 WeakPolarHBondContact SD-CG1 3.28Å; M565-P589 HydrophobicContact CE-CB 4.37Å; M565-V592 HydrophobicContact CE-CB 3.67Å; M565-V592 HydrophobicContact CE-CG1 4Å; M565-V592 WeakPolarHBondContact CE-O 3.35Å; M565-V592 HydrophobicContact SD-CB 4.35Å; M565-L594 HydrophobicContact CB-CD1 3.81Å; M565-L594 HydrophobicContact CG-CD1 4.2Å
566	Y	85	Confident	79.7	Confident	14 Å²	14	19.4 Å²	19.4	6%	0.055	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	14.8	177.7	-68.8	-64.7	0	0	0	113.8	A562 I564 L594 R719 P724 F728 K757	A562-Y566 HydrophobicContact CB-CD2 4.38Å; A562-Y566 WeakPolarHBondContact O-CB 3.48Å; A562-Y566 WeakPolarHBondContact O-CD2 3.38Å; A562-Y566 PolarHBondContact O-N 2.73Å; I564-Y566 VanDerWaalsContact C-N 3.31Å; I564-Y566 PolarHBondContact O-N 3.07Å; Y566-L594 HydrophobicContact CD2-CD1 3.89Å; Y566-L594 HydrophobicContact CE2-CD1 3.42Å; Y566-L594 VanDerWaalsContact CE2-CD1 3.42Å; Y566-R719 HydrophobicContact CD1-CB 3.38Å; Y566-R719 HydrophobicContact CE1-CB 3.77Å; Y566-R719 HydrophobicContact CG-CB 4.22Å; Y566-P724 HydrophobicContact CD2-CB 3.42Å; Y566-P724 VanDerWaalsContact CD2-CB 3.42Å; Y566-P724 HydrophobicContact CD2-CG 3.42Å; Y566-P724 VanDerWaalsContact CD2-CG 3.42Å; Y566-P724 HydrophobicContact CE2-CB 3.34Å; Y566-P724 HydrophobicContact CE2-CG 3.93Å; Y566-P724 HydrophobicContact CG-CB 4.28Å; Y566-P724 HydrophobicContact CG-CG 3.98Å; Y566-F728 WeakPolarHBondContact OH-CE2 3.38Å; Y566-F728 WeakPolarHBondContact OH-CZ 3.17Å; Y566-K757 PolarHBondContact O-NZ 2.55Å
567	Y	83.2	Confident	80.1	Confident	35 Å²	35	18.5 Å²	18.5	14%	0.137	11%	0.113	C	C	.	.			trans	-68.7	-36.7	167.9	173.8	-95	0	0	0	110.9	H121 E124 L128 P563 I564 D569 S574 A576 V660	H121-Y567 PolarHBondContact ND1-OH 3.49Å; H121-Y567 VanDerWaalsContact ND1-OH 3.15Å; E124-Y567 HydrophobicContact CB-CE2 4.05Å; E124-Y567 WeakPolarHBondContact OE2-CE2 3.21Å; E124-Y567 PolarHBondContact OE2-OH 3.36Å; L128-Y567 HydrophobicContact CD1-CD2 3.75Å; L128-Y567 HydrophobicContact CD1-CE2 4.32Å; L128-Y567 HydrophobicContact CD1-CG 4.13Å; P563-Y567 WeakPolarHBondContact O-CB 3.18Å; P563-Y567 PolarHBondContact O-N 3.01Å; P563-Y567 VanDerWaalsContact O-N 3.11Å; I564-Y567 VanDerWaalsContact O-CB 3.27Å; I564-Y567 WeakPolarHBondContact O-CB 3.39Å; I564-Y567 PolarHBondContact O-N 3.49Å; Y567-D569 PolarHBondContact O-N 3.11Å; Y567-S574 WeakPolarHBondContact CE1-OG 3.43Å; Y567-S574 PolarHBondContact OH-OG 2.85Å; Y567-A576 HydrophobicContact CD1-CB 3.58Å; Y567-A576 HydrophobicContact CE1-CB 4.37Å; Y567-A576 HydrophobicContact CG-CB 3.8Å; Y567-V660 HydrophobicContact CD1-CG2 4.5Å; Y567-V660 HydrophobicContact CE1-CB 4.44Å; Y567-V660 HydrophobicContact CE1-CG1 3.64Å; Y567-V660 HydrophobicContact CE1-CG2 4.01Å; Y567-V660 HydrophobicContact CE2-CG2 4.48Å; Y567-V660 WeakPolarHBondContact OH-CG1 3.5Å
568	S	72.1	Confident	80.4	Confident	14 Å²	14	18.5 Å²	18.5	10%	0.098	11%	0.113	C	C	.	.	S	Bend	trans	-68.8	133.4	-175.7	98.2	0	0	0	0	112.3	G570 G571 S574	S568-G570 PolarHBondContact O-N 3.37Å; S568-G570 PolarHBondContact OG-N 2.7Å; S568-G571 PolarHBondContact OG-N 3.46Å; S568-S574 WeakPolarHBondContact CA-O 3.46Å; S568-S574 WeakPolarHBondContact CB-O 3.33Å
569	D	65.1	Low	80.7	Confident	70 Å²	70	18.5 Å²	18.5	37%	0.374	11%	0.113	S	C	.	.	S	Bend	trans	-77.2	58.7	164.7	-75.9	-24.5	0	0	0	109	Y567 G571 V572 P795	Y567-D569 PolarHBondContact O-N 3.11Å; D569-G571 PolarHBondContact O-N 2.85Å; D569-V572 VanDerWaalsContact O-CG2 3.29Å; D569-V572 WeakPolarHBondContact O-CG2 3.21Å; D569-V572 PolarHBondContact O-N 3.44Å; D569-P795 HydrophobicContact CB-CB 4.07Å; D569-P795 VanDerWaalsContact O-CB 3.32Å; D569-P795 WeakPolarHBondContact O-CB 3.48Å
570	G	57.5	Low	80.7	Confident	24 Å²	24	17.6 Å²	17.6	25%	0.247	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	20	-179.1	0	0	0	0	0	115.4	S568 V572	S568-G570 PolarHBondContact O-N 3.37Å; S568-G570 PolarHBondContact OG-N 2.7Å; G570-V572 VanDerWaalsContact C-N 3.29Å; G570-V572 PolarHBondContact O-N 3.44Å
571	G	56.8	Low	80.6	Confident	31 Å²	31	21 Å²	21	32%	0.32	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	11.5	-178.1	0	0	0	0	0	114.7	S568 D569	S568-G571 PolarHBondContact OG-N 3.46Å; D569-G571 PolarHBondContact O-N 2.85Å
572	V	61.1	Low	80.1	Confident	33 Å²	33	26.2 Å²	26.2	20%	0.2	15%	0.153	C	C	.	.	S	Bend	trans	-74.2	-35.6	-174.8	-174.9	0	0	0	0	112	D569 G570 P795 V823 L865 V866	D569-V572 VanDerWaalsContact O-CG2 3.29Å; D569-V572 WeakPolarHBondContact O-CG2 3.21Å; D569-V572 PolarHBondContact O-N 3.44Å; G570-V572 VanDerWaalsContact C-N 3.29Å; G570-V572 PolarHBondContact O-N 3.44Å; V572-P795 HydrophobicContact CG2-CB 4.4Å; V572-P795 HydrophobicContact CG2-CG 4.33Å; V572-V823 HydrophobicContact CG2-CG1 4.29Å; V572-L865 HydrophobicContact CG1-CD1 3.76Å; V572-V866 HydrophobicContact CG1-CB 4.42Å
573	T	67.9	Low	79.8	Confident	34 Å²	34	26.1 Å²	26.1	21%	0.209	15%	0.152	C	C	.	.	S	Bend	trans	-126.8	-54	-173.8	49.5	0	0	0	0	112.6	R663 L865	T573-R663 PolarHBondContact O-N 3.08Å; T573-L865 HydrophobicContact CG2-CD1 3.31Å
574	S	80.3	Confident	79.5	Confident	5 Å²	5	25.2 Å²	25.2	4%	0.035	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	158.3	-179.7	63.5	0	0	0	0	111.7	Y567 S568 A661	Y567-S574 WeakPolarHBondContact CE1-OG 3.43Å; Y567-S574 PolarHBondContact OH-OG 2.85Å; S568-S574 WeakPolarHBondContact CA-O 3.46Å; S568-S574 WeakPolarHBondContact CB-O 3.33Å; S574-A661 CarbonylContact C-O 3.53Å; S574-A661 WeakPolarHBondContact CA-O 2.96Å; S574-A661 VanDerWaalsContact CB-O 3.23Å; S574-A661 WeakPolarHBondContact CB-O 3.18Å
575	Y	87.1	Confident	79.2	Confident	13 Å²	13	25 Å²	25	5%	0.051	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	158.1	172.7	61.2	-87.7	0	0	0	110.3	F577 H588 P589 E608 V660 A661	Y575-F577 HydrophobicContact CD2-CD1 4.07Å; Y575-F577 AromaticContact CE2-CD1 3.85Å; Y575-F577 HydrophobicContact CE2-CD1 3.85Å; Y575-F577 HydrophobicContact CE2-CE1 4.11Å; Y575-H588 AromaticContact CE2-CE1 3.78Å; Y575-H588 AromaticContact CE2-NE2 3.46Å; Y575-H588 WeakPolarHBondContact CE2-NE2 3.4Å; Y575-P589 HydrophobicContact CD2-CG 3.64Å; Y575-P589 HydrophobicContact CG-CG 4.14Å; Y575-E608 WeakPolarHBondContact CE2-OE1 3.42Å; Y575-E608 PolarHBondContact OH-OE1 2.91Å; Y575-E608 PolarHBondContact OH-OE2 2.98Å; Y575-V660 CarbonylContact O-C 3.5Å; Y575-V660 WeakPolarHBondContact O-CA 3.5Å; Y575-A661 HydrophobicContact CD1-CB 4.25Å; Y575-A661 HydrophobicContact CD2-CB 4.3Å; Y575-A661 HydrophobicContact CE1-CB 3.82Å; Y575-A661 HydrophobicContact CE2-CB 3.89Å; Y575-A661 HydrophobicContact CG-CB 4.47Å; Y575-A661 PolarHBondContact N-O 2.99Å; Y575-A661 PolarHBondContact O-N 3.45Å
576	A	91.4	Very high	79.1	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	151.4	179.4	0	0	0	0	0	111	L128 I564 Y567 P589 V659 V660	L128-A576 HydrophobicContact CD1-CB 4.21Å; I564-A576 HydrophobicContact CG2-CB 3.75Å; Y567-A576 HydrophobicContact CD1-CB 3.58Å; Y567-A576 HydrophobicContact CE1-CB 4.37Å; Y567-A576 HydrophobicContact CG-CB 3.8Å; A576-P589 VanDerWaalsContact O-CD 3.23Å; A576-P589 WeakPolarHBondContact O-CD 3.32Å; A576-V659 CarbonylContact C-O 3.53Å; A576-V659 WeakPolarHBondContact CA-O 3.25Å; A576-V660 HydrophobicContact CB-CG2 3.99Å
577	F	91.9	Very high	79.1	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	165.7	174.7	59.2	-89.3	0	0	0	110.9	Y575 L579 V587 H588 V604 E608 F611 Y646 V659 A661	Y575-F577 HydrophobicContact CD2-CD1 4.07Å; Y575-F577 AromaticContact CE2-CD1 3.85Å; Y575-F577 HydrophobicContact CE2-CD1 3.85Å; Y575-F577 HydrophobicContact CE2-CE1 4.11Å; F577-L579 HydrophobicContact CD2-CD2 3.83Å; F577-L579 HydrophobicContact CD2-CG 4Å; F577-L579 HydrophobicContact CE2-CD1 4Å; F577-L579 HydrophobicContact CE2-CD2 3.73Å; F577-L579 HydrophobicContact CE2-CG 3.8Å; F577-V587 WeakPolarHBondContact CB-O 3.35Å; F577-H588 VanDerWaalsContact CB-CD2 3.44Å; F577-H588 WeakPolarHBondContact CB-CD2 3.36Å; F577-H588 AromaticContact CD1-NE2 3.92Å; F577-H588 AromaticContact CG-CD2 3.66Å; F577-V604 HydrophobicContact CE2-CG2 4.28Å; F577-E608 HydrophobicContact CE1-CG 4.49Å; F577-E608 HydrophobicContact CZ-CG 4.23Å; F577-F611 HydrophobicContact CZ-CD2 4.49Å; F577-F611 HydrophobicContact CZ-CE2 4.28Å; F577-Y646 HydrophobicContact CE1-CD1 4.24Å; F577-Y646 HydrophobicContact CE1-CE1 4.26Å; F577-Y646 HydrophobicContact CZ-CD1 4.19Å; F577-Y646 HydrophobicContact CZ-CE1 4.29Å; F577-V659 HydrophobicContact CD1-CB 4.36Å; F577-V659 HydrophobicContact CD2-CB 4.09Å; F577-V659 HydrophobicContact CD2-CG2 4.47Å; F577-V659 HydrophobicContact CE1-CB 3.95Å; F577-V659 HydrophobicContact CE1-CG1 3.79Å; F577-V659 HydrophobicContact CE2-CB 3.65Å; F577-V659 HydrophobicContact CE2-CG1 4.01Å; F577-V659 HydrophobicContact CE2-CG2 3.92Å; F577-V659 HydrophobicContact CG-CB 4.43Å; F577-V659 HydrophobicContact CZ-CB 3.58Å; F577-V659 HydrophobicContact CZ-CG1 3.44Å; F577-V659 VanDerWaalsContact CZ-CG1 3.44Å; F577-V659 HydrophobicContact CZ-CG2 4.22Å; F577-V659 PolarHBondContact N-O 3.38Å; F577-V659 PolarHBondContact O-N 2.97Å; F577-A661 HydrophobicContact CE1-CB 4.2Å
578	L	92.2	Very high	79.3	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128	-175	-172	69.6	0	0	0	110.5	M132 V561 I564 I586 V587 Y656 I658	M132-L578 HydrophobicContact CE-CD1 4.16Å; M132-L578 HydrophobicContact CE-CD2 3.95Å; M132-L578 HydrophobicContact SD-CD1 4.07Å; V561-L578 HydrophobicContact CG1-CD2 4.24Å; I564-L578 HydrophobicContact CD1-CB 4.3Å; I564-L578 HydrophobicContact CD1-CD1 4.06Å; L578-I586 HydrophobicContact CB-CB 4.36Å; L578-I586 HydrophobicContact CD2-CB 4Å; L578-I586 HydrophobicContact CD2-CG2 3.98Å; L578-I586 HydrophobicContact CG-CB 4.16Å; L578-I586 PolarHBondContact O-N 3.11Å; L578-V587 HydrophobicContact CB-CB 4.36Å; L578-V587 PolarHBondContact N-O 3.34Å; L578-V587 PolarHBondContact O-N 3.45Å; L578-Y656 HydrophobicContact CD2-CD1 4.46Å; L578-I658 HydrophobicContact CD1-CG1 3.81Å
579	L	90.5	Very high	79.7	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	158.3	174.3	-59.6	-177.2	0	0	0	111.2	F577 N584 V585 V604 F611 W616 Y656 V657 V659	F577-L579 HydrophobicContact CD2-CD2 3.83Å; F577-L579 HydrophobicContact CD2-CG 4Å; F577-L579 HydrophobicContact CE2-CD1 4Å; F577-L579 HydrophobicContact CE2-CD2 3.73Å; F577-L579 HydrophobicContact CE2-CG 3.8Å; L579-N584 CarbonylContact C-O 3.44Å; L579-N584 VanDerWaalsContact CA-O 3.26Å; L579-N584 WeakPolarHBondContact CA-O 3.5Å; L579-V585 HydrophobicContact CD2-CB 4.06Å; L579-V585 HydrophobicContact CD2-CG1 4.26Å; L579-V585 HydrophobicContact CD2-CG2 3.65Å; L579-V604 HydrophobicContact CD1-CG2 4.37Å; L579-V604 HydrophobicContact CD2-CB 4.06Å; L579-V604 HydrophobicContact CD2-CG2 4Å; L579-F611 HydrophobicContact CD1-CZ 4.21Å; L579-W616 HydrophobicContact CD1-CH2 4.19Å; L579-W616 HydrophobicContact CD1-CZ2 3.97Å; L579-Y656 CarbonylContact O-C 3.58Å; L579-Y656 WeakPolarHBondContact O-CA 3.23Å; L579-V657 HydrophobicContact CB-CB 4.45Å; L579-V657 PolarHBondContact N-O 3Å; L579-V657 PolarHBondContact O-N 3.03Å; L579-V659 HydrophobicContact CD1-CG2 3.69Å; L579-V659 HydrophobicContact CG-CG2 4.01Å
580	N	85.8	Confident	80.1	Confident	20 Å²	20	23.7 Å²	23.7	11%	0.107	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	172.3	156.8	69.8	5.7	0	0	0	111.3	D582 G583 N584 I586 P655	N580-D582 PolarHBondContact O-N 3.11Å; N580-D582 PolarHBondContact OD1-N 3.22Å; N580-D582 VanDerWaalsContact OD1-N 3.16Å; N580-G583 PolarHBondContact O-N 3.28Å; N580-G583 PolarHBondContact OD1-N 3.48Å; N580-N584 PolarHBondContact N-O 3.11Å; N580-N584 WeakPolarHBondContact OD1-CA 3.25Å; N580-N584 PolarHBondContact OD1-N 3.01Å; N580-N584 PolarHBondContact OD1-O 3.15Å; N580-I586 HydrophobicContact CB-CD1 4.15Å; N580-I586 HydrophobicContact CB-CG1 4.4Å; N580-P655 CarbonylContact C-O 3.55Å; N580-P655 VanDerWaalsContact CA-O 3.26Å; N580-P655 WeakPolarHBondContact CA-O 3.46Å
581	E	84.2	Confident	80.8	Confident	78 Å²	78	22.9 Å²	22.9	36%	0.364	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-21.8	177.1	-62.3	-168.8	-176.6	0	0	113.8	G583 L620 R650 P655	E581-G583 VanDerWaalsContact C-N 3.27Å; E581-G583 PolarHBondContact O-N 3.36Å; E581-L620 HydrophobicContact CB-CD2 4.5Å; E581-R650 IonicContact OE1-NH1 2.77Å; E581-R650 PolarHBondContact OE1-NH1 3.37Å; E581-R650 IonicContact OE2-NH1 2.98Å; E581-R650 PolarHBondContact OE2-NH1 3.37Å; E581-R650 VanDerWaalsContact OE2-NH1 3.11Å; E581-P655 HydrophobicContact CG-CB 4.44Å; E581-P655 WeakPolarHBondContact CG-O 3.14Å; E581-P655 PolarHBondContact N-O 3.35Å
582	D	77.6	Confident	81.7	Confident	108 Å²	108	21.7 Å²	21.7	58%	0.578	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-15.6	177.8	-59	-50.8	0	0	0	113	N580 K617	N580-D582 PolarHBondContact O-N 3.11Å; N580-D582 PolarHBondContact OD1-N 3.22Å; N580-D582 VanDerWaalsContact OD1-N 3.16Å; D582-K617 WeakPolarHBondContact O-CE 3.03Å; D582-K617 PolarHBondContact O-NZ 2.89Å
583	G	82	Confident	82.2	Confident	1 Å²	1	21.8 Å²	21.8	1%	0.01	12%	0.115	C	C	.	.	S	Bend	trans	91.1	22.2	-177.7	0	0	0	0	0	113.9	N580 E581 V604	N580-G583 PolarHBondContact O-N 3.28Å; N580-G583 PolarHBondContact OD1-N 3.48Å; E581-G583 VanDerWaalsContact C-N 3.27Å; E581-G583 PolarHBondContact O-N 3.36Å; G583-V604 VanDerWaalsContact O-CB 3.3Å; G583-V604 WeakPolarHBondContact O-CB 3.47Å; G583-V604 VanDerWaalsContact O-CG1 3.31Å; G583-V604 WeakPolarHBondContact O-CG1 3.49Å; G583-V604 PolarHBondContact O-N 3.23Å
584	N	81.2	Confident	82.6	Confident	29 Å²	29	20.4 Å²	20.4	16%	0.155	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	143.5	171.2	-55.3	-23	0	0	0	110.4	L579 N580 D601 V602	L579-N584 CarbonylContact C-O 3.44Å; L579-N584 VanDerWaalsContact CA-O 3.26Å; L579-N584 WeakPolarHBondContact CA-O 3.5Å; N580-N584 PolarHBondContact N-O 3.11Å; N580-N584 WeakPolarHBondContact OD1-CA 3.25Å; N580-N584 PolarHBondContact OD1-N 3.01Å; N580-N584 PolarHBondContact OD1-O 3.15Å; N584-D601 WeakPolarHBondContact CB-OD1 3.12Å; N584-D601 PolarHBondContact ND2-OD1 3.3Å; N584-D601 PolarHBondContact ND2-OD2 3.48Å; N584-V602 CarbonylContact C-O 3.51Å; N584-V602 WeakPolarHBondContact CA-O 3.31Å
585	V	85.1	Confident	82.3	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	113.7	-176.3	-167.9	0	0	0	0	109.9	L579 H588 Y591 V602 V604 V607	L579-V585 HydrophobicContact CD2-CB 4.06Å; L579-V585 HydrophobicContact CD2-CG1 4.26Å; L579-V585 HydrophobicContact CD2-CG2 3.65Å; V585-H588 HydrophobicContact CG1-CB 3.91Å; V585-Y591 VanDerWaalsContact CB-OH 3.29Å; V585-Y591 WeakPolarHBondContact CB-OH 3.48Å; V585-Y591 WeakPolarHBondContact CG1-OH 3.49Å; V585-V602 PolarHBondContact N-O 3.42Å; V585-V604 HydrophobicContact CG2-CB 3.94Å; V585-V604 HydrophobicContact CG2-CG2 4.15Å; V585-V607 HydrophobicContact CG2-CB 4.23Å; V585-V607 HydrophobicContact CG2-CG2 4.01Å
586	I	84	Confident	81.5	Confident	19 Å²	19	24.7 Å²	24.7	10%	0.097	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	-44.7	178.3	-53.7	-57.9	0	0	0	110.4	L578 N580 L599 Y656	L578-I586 HydrophobicContact CB-CB 4.36Å; L578-I586 HydrophobicContact CD2-CB 4Å; L578-I586 HydrophobicContact CD2-CG2 3.98Å; L578-I586 HydrophobicContact CG-CB 4.16Å; L578-I586 PolarHBondContact O-N 3.11Å; N580-I586 HydrophobicContact CB-CD1 4.15Å; N580-I586 HydrophobicContact CB-CG1 4.4Å; I586-L599 HydrophobicContact CG2-CD2 3.83Å; I586-Y656 HydrophobicContact CD1-CE1 4.32Å; I586-Y656 HydrophobicContact CG1-CD1 4.09Å; I586-Y656 HydrophobicContact CG1-CE1 3.95Å
587	V	84.5	Confident	80.6	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	137.6	-179.1	169	0	0	0	0	110.4	V561 M565 F577 L578 V592 V597	V561-V587 HydrophobicContact CB-CG1 4.23Å; V561-V587 HydrophobicContact CB-CG2 4.43Å; V561-V587 HydrophobicContact CG1-CB 4.47Å; V561-V587 HydrophobicContact CG1-CG2 4.04Å; V561-V587 HydrophobicContact CG2-CG1 4.1Å; V561-V587 HydrophobicContact CG2-CG2 4.28Å; M565-V587 HydrophobicContact CE-CG1 4.39Å; M565-V587 HydrophobicContact CG-CG1 3.8Å; M565-V587 HydrophobicContact SD-CG1 3.18Å; M565-V587 WeakPolarHBondContact SD-CG1 3.28Å; F577-V587 WeakPolarHBondContact CB-O 3.35Å; L578-V587 HydrophobicContact CB-CB 4.36Å; L578-V587 PolarHBondContact N-O 3.34Å; L578-V587 PolarHBondContact O-N 3.45Å; V587-V592 HydrophobicContact CG1-CB 4.17Å; V587-V592 HydrophobicContact CG1-CG1 4.19Å; V587-V592 HydrophobicContact CG1-CG2 4.12Å; V587-V597 HydrophobicContact CG2-CG1 4.05Å
588	H	86.2	Confident	79.5	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.165	C	C	.	.			trans	-142.6	139.6	-179.6	-162	-89.5	0	0	0	113.1	Y575 F577 V585 H590 Y591 V592 E608	Y575-H588 AromaticContact CE2-CE1 3.78Å; Y575-H588 AromaticContact CE2-NE2 3.46Å; Y575-H588 WeakPolarHBondContact CE2-NE2 3.4Å; F577-H588 VanDerWaalsContact CB-CD2 3.44Å; F577-H588 WeakPolarHBondContact CB-CD2 3.36Å; F577-H588 AromaticContact CD1-NE2 3.92Å; F577-H588 AromaticContact CG-CD2 3.66Å; V585-H588 HydrophobicContact CG1-CB 3.91Å; H588-H590 AromaticContact CE1-CE1 3.97Å; H588-H590 AromaticContact CE1-CG 3.58Å; H588-H590 AromaticContact CE1-ND1 3.41Å; H588-H590 PolarHBondContact CE1-ND1 2.88Å; H588-H590 WeakPolarHBondContact ND1-CB 3.32Å; H588-H590 AromaticContact ND1-CG 3.68Å; H588-H590 PolarHBondContact ND1-N 3.18Å; H588-H590 VanDerWaalsContact ND1-N 3.19Å; H588-H590 AromaticContact ND1-ND1 3.92Å; H588-H590 PolarHBondContact O-N 3.11Å; H588-H590 VanDerWaalsContact O-N 3.17Å; H588-Y591 HydrophobicContact CB-CD1 3.79Å; H588-Y591 HydrophobicContact CB-CE1 3.2Å; H588-Y591 HydrophobicContact CB-CE2 4.03Å; H588-Y591 HydrophobicContact CB-CG 4.42Å; H588-Y591 AromaticContact CG-CE1 3.77Å; H588-Y591 PolarHBondContact O-N 2.94Å; H588-V592 PolarHBondContact O-N 3.32Å; H588-E608 IonicContact CE1-OE1 2.69Å; H588-E608 IonicContact NE2-OE1 3.63Å; H588-E608 PolarHBondContact NE2-OE1 3.36Å
589	P	80.9	Confident	78.4	Confident	24 Å²	24	32.7 Å²	32.7	16%	0.156	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.3	-177.3	23	-33.4	0	0	0	115.2	M565 Y575 A576	M565-P589 HydrophobicContact CE-CB 4.37Å; Y575-P589 HydrophobicContact CD2-CG 3.64Å; Y575-P589 HydrophobicContact CG-CG 4.14Å; A576-P589 VanDerWaalsContact O-CD 3.23Å; A576-P589 WeakPolarHBondContact O-CD 3.32Å
590	H	74.7	Confident	77	Confident	77 Å²	77	33.4 Å²	33.4	36%	0.356	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-18.2	179.7	-64.9	166.2	0	0	0	114.7	H588	H588-H590 AromaticContact CE1-CE1 3.97Å; H588-H590 AromaticContact CE1-CG 3.58Å; H588-H590 AromaticContact CE1-ND1 3.41Å; H588-H590 PolarHBondContact CE1-ND1 2.88Å; H588-H590 WeakPolarHBondContact ND1-CB 3.32Å; H588-H590 AromaticContact ND1-CG 3.68Å; H588-H590 PolarHBondContact ND1-N 3.18Å; H588-H590 VanDerWaalsContact ND1-N 3.19Å; H588-H590 AromaticContact ND1-ND1 3.92Å; H588-H590 PolarHBondContact O-N 3.11Å; H588-H590 VanDerWaalsContact O-N 3.17Å
591	Y	72.3	Confident	76	Confident	7 Å²	7	35.4 Å²	35.4	3%	0.027	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-140	-5.3	-177	61.5	-105.1	0	0	0	115.5	V585 H588 L600 V607 F953 S954	V585-Y591 VanDerWaalsContact CB-OH 3.29Å; V585-Y591 WeakPolarHBondContact CB-OH 3.48Å; V585-Y591 WeakPolarHBondContact CG1-OH 3.49Å; H588-Y591 HydrophobicContact CB-CD1 3.79Å; H588-Y591 HydrophobicContact CB-CE1 3.2Å; H588-Y591 HydrophobicContact CB-CE2 4.03Å; H588-Y591 HydrophobicContact CB-CG 4.42Å; H588-Y591 AromaticContact CG-CE1 3.77Å; H588-Y591 PolarHBondContact O-N 2.94Å; Y591-L600 HydrophobicContact CD2-CD1 3.73Å; Y591-L600 HydrophobicContact CE2-CB 4.48Å; Y591-L600 HydrophobicContact CE2-CD1 3.75Å; Y591-V607 HydrophobicContact CE1-CB 4.46Å; Y591-V607 HydrophobicContact CE1-CG1 3.81Å; Y591-V607 HydrophobicContact CE1-CG2 3.72Å; Y591-F953 HydrophobicContact CD1-CB 4.28Å; Y591-F953 AromaticContact CD1-CD2 3.88Å; Y591-F953 HydrophobicContact CD1-CD2 3.88Å; Y591-F953 HydrophobicContact CD1-CG 4.42Å; Y591-F953 HydrophobicContact CD2-CB 3.92Å; Y591-F953 HydrophobicContact CE1-CD2 4.26Å; Y591-F953 HydrophobicContact CE2-CB 4.49Å; Y591-F953 HydrophobicContact CG-CB 3.81Å; Y591-F953 HydrophobicContact CG-CD2 4.25Å; Y591-F953 HydrophobicContact CG-CG 4.43Å; Y591-S954 WeakPolarHBondContact O-CB 3.39Å
592	V	74.5	Confident	75.4	Confident	6 Å²	6	32.1 Å²	32.1	4%	0.036	17%	0.168	C	C	.	.			trans	-100.5	132.2	169.1	177.9	0	0	0	0	108.6	M565 V587 H588 V597	M565-V592 HydrophobicContact CE-CB 3.67Å; M565-V592 HydrophobicContact CE-CG1 4Å; M565-V592 WeakPolarHBondContact CE-O 3.35Å; M565-V592 HydrophobicContact SD-CB 4.35Å; V587-V592 HydrophobicContact CG1-CB 4.17Å; V587-V592 HydrophobicContact CG1-CG1 4.19Å; V587-V592 HydrophobicContact CG1-CG2 4.12Å; H588-V592 PolarHBondContact O-N 3.32Å; V592-V597 HydrophobicContact CG1-CB 4.32Å; V592-V597 HydrophobicContact CG1-CG1 4.09Å; V592-V597 HydrophobicContact CG1-CG2 4.01Å
593	T	72.6	Confident	75.2	Confident	36 Å²	36	30.1 Å²	30.1	22%	0.221	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-126.4	113.4	177.6	55.6	0	0	0	0	110.6	S596	T593-S596 CarbonylContact O-C 3.41Å; T593-S596 PolarHBondContact O-N 3.04Å; T593-S596 VanDerWaalsContact O-N 3.17Å
594	L	76.5	Confident	75.2	Confident	5 Å²	5	30 Å²	30	3%	0.026	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	148.7	178.4	-66	169.3	0	0	0	111.9	A558 V561 A562 M565 Y566 V597 M725 K1061	A558-L594 HydrophobicContact CB-CD2 3.71Å; V561-L594 HydrophobicContact CG2-CD2 4.42Å; A562-L594 HydrophobicContact CB-CD1 3.93Å; M565-L594 HydrophobicContact CB-CD1 3.81Å; M565-L594 HydrophobicContact CG-CD1 4.2Å; Y566-L594 HydrophobicContact CD2-CD1 3.89Å; Y566-L594 HydrophobicContact CE2-CD1 3.42Å; Y566-L594 VanDerWaalsContact CE2-CD1 3.42Å; L594-V597 HydrophobicContact CD2-CG2 3.6Å; L594-M725 HydrophobicContact CB-SD 4.45Å; L594-M725 HydrophobicContact CD1-SD 4.34Å; L594-M725 HydrophobicContact CD2-SD 4.26Å; L594-K1061 PolarHBondContact O-NZ 3.24Å
595	P	73	Confident	75	Confident	32 Å²	32	30.1 Å²	30.1	21%	0.208	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	cis	-81.3	-10.7	3.8	34.4	-34.4	0	0	0	114.2	A558 V597 M725 F728	A558-P595 WeakPolarHBondContact CB-O 3.45Å; P595-V597 PolarHBondContact O-N 3.25Å; P595-V597 VanDerWaalsContact O-N 3.15Å; P595-M725 HydrophobicContact CB-CE 3.92Å; P595-F728 HydrophobicContact CB-CB 4.33Å; P595-F728 HydrophobicContact CB-CD1 4.32Å; P595-F728 HydrophobicContact CB-CG 4.25Å; P595-F728 HydrophobicContact CG-CD1 4.01Å; P595-F728 HydrophobicContact CG-CG 4.4Å
596	S	70.7	Confident	74.4	Confident	75 Å²	75	31.4 Å²	31.4	52%	0.524	18%	0.176	S	C	.	.	B	Isolated β-bridge	trans	-77.4	100.6	-177.5	-51.6	0	0	0	0	111.9	T593	T593-S596 CarbonylContact O-C 3.41Å; T593-S596 PolarHBondContact O-N 3.04Å; T593-S596 VanDerWaalsContact O-N 3.17Å
597	V	73.3	Confident	74	Confident	4 Å²	4	31 Å²	31	2%	0.024	17%	0.174	C	C	.	.			trans	-94.7	131.5	168.2	-173.5	0	0	0	0	108.3	S533 L557 A558 V561 V587 V592 L594 P595	S533-V597 PolarHBondContact OG-O 3.46Å; L557-V597 HydrophobicContact CD2-CG1 3.75Å; L557-V597 HydrophobicContact CG-CG1 4.31Å; A558-V597 HydrophobicContact CB-CG2 3.87Å; V561-V597 HydrophobicContact CG2-CG2 4.24Å; V587-V597 HydrophobicContact CG2-CG1 4.05Å; V592-V597 HydrophobicContact CG1-CB 4.32Å; V592-V597 HydrophobicContact CG1-CG1 4.09Å; V592-V597 HydrophobicContact CG1-CG2 4.01Å; L594-V597 HydrophobicContact CD2-CG2 3.6Å; P595-V597 PolarHBondContact O-N 3.25Å; P595-V597 VanDerWaalsContact O-N 3.15Å
598	R	68.8	Low	73.8	Confident	151 Å²	151	31.9 Å²	31.9	57%	0.57	18%	0.178	S	C	*	.			trans	-123.3	128.8	168.3	-71	-174.8	176.8	178.9	-1.1	107.7
599	L	67.1	Low	73.1	Confident	15 Å²	15	36.4 Å²	36.4	8%	0.079	20%	0.198	C	C	.	.			trans	-75.1	138.9	179.4	-66.4	168.3	0	0	0	110.3	A523 D525 L557 I586 R956	A523-L599 HydrophobicContact CB-CD1 3.44Å; A523-L599 VanDerWaalsContact CB-CD1 3.44Å; A523-L599 HydrophobicContact CB-CD2 3.75Å; A523-L599 HydrophobicContact CB-CG 4.24Å; D525-L599 WeakPolarHBondContact OD1-CB 3.34Å; D525-L599 WeakPolarHBondContact OD1-CG 3.38Å; D525-L599 PolarHBondContact OD1-N 3.4Å; L557-L599 HydrophobicContact CD2-CD1 4.47Å; L557-L599 HydrophobicContact CD2-CD2 3.52Å; L557-L599 HydrophobicContact CD2-CG 4.13Å; I586-L599 HydrophobicContact CG2-CD2 3.83Å; L599-R956 PolarHBondContact O-NH2 2.95Å
600	L	62.8	Low	72.8	Confident	14 Å²	14	39.1 Å²	39.1	7%	0.073	21%	0.205	C	C	.	.			trans	-139.9	106.4	-178	-78.5	148.1	0	0	0	107	Y591 V602 F953 R956	Y591-L600 HydrophobicContact CD2-CD1 3.73Å; Y591-L600 HydrophobicContact CE2-CB 4.48Å; Y591-L600 HydrophobicContact CE2-CD1 3.75Å; L600-V602 VanDerWaalsContact C-N 3.26Å; L600-V602 HydrophobicContact CB-CG2 3.99Å; L600-V602 PolarHBondContact O-N 3.38Å; L600-F953 HydrophobicContact CD1-CB 3.69Å; L600-F953 WeakPolarHBondContact CD1-O 3.47Å; L600-F953 HydrophobicContact CD2-CB 4.28Å; L600-R956 HydrophobicContact CD2-CG 4.14Å
601	D	64.3	Low	73.3	Confident	62 Å²	62	36 Å²	36	33%	0.332	19%	0.19	S	C	.	.			trans	-79.1	78	177.4	-164.1	27.4	0	0	0	110.4	N584 Y1039	N584-D601 WeakPolarHBondContact CB-OD1 3.12Å; N584-D601 PolarHBondContact ND2-OD1 3.3Å; N584-D601 PolarHBondContact ND2-OD2 3.48Å; D601-Y1039 PolarHBondContact O-OH 3.49Å
602	V	71.3	Confident	73.9	Confident	9 Å²	9	36.9 Å²	36.9	6%	0.055	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	126.6	-174	178.4	0	0	0	0	109.7	N584 V585 L600 V604 A606 V607 F953	N584-V602 CarbonylContact C-O 3.51Å; N584-V602 WeakPolarHBondContact CA-O 3.31Å; V585-V602 PolarHBondContact N-O 3.42Å; L600-V602 VanDerWaalsContact C-N 3.26Å; L600-V602 HydrophobicContact CB-CG2 3.99Å; L600-V602 PolarHBondContact O-N 3.38Å; V602-V604 PolarHBondContact O-N 3.21Å; V602-A606 HydrophobicContact CG1-CB 3.71Å; V602-V607 HydrophobicContact CB-CG2 4.49Å; V602-V607 HydrophobicContact CG1-CG2 3.81Å; V602-F953 HydrophobicContact CB-CE1 4.42Å; V602-F953 HydrophobicContact CG1-CE1 3.8Å; V602-F953 HydrophobicContact CG1-CZ 3.9Å; V602-F953 HydrophobicContact CG2-CD1 3.81Å; V602-F953 HydrophobicContact CG2-CE1 3.72Å
603	P	74.3	Confident	74.4	Confident	66 Å²	66	38.8 Å²	38.8	43%	0.429	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56	138.1	174.9	-25.3	33.9	0	0	0	111.6	A605 A606	P603-A605 PolarHBondContact O-N 3.15Å; P603-A605 VanDerWaalsContact O-N 3.08Å; P603-A606 WeakPolarHBondContact O-CB 3.25Å; P603-A606 PolarHBondContact O-N 3.17Å
604	V	81.6	Confident	75	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-53.6	-35.3	-178.7	66.8	0	0	0	0	112.7	F577 L579 G583 V585 V602 A606 V607 E608 F611 I613	F577-V604 HydrophobicContact CE2-CG2 4.28Å; L579-V604 HydrophobicContact CD1-CG2 4.37Å; L579-V604 HydrophobicContact CD2-CB 4.06Å; L579-V604 HydrophobicContact CD2-CG2 4Å; G583-V604 VanDerWaalsContact O-CB 3.3Å; G583-V604 WeakPolarHBondContact O-CB 3.47Å; G583-V604 VanDerWaalsContact O-CG1 3.31Å; G583-V604 WeakPolarHBondContact O-CG1 3.49Å; G583-V604 PolarHBondContact O-N 3.23Å; V585-V604 HydrophobicContact CG2-CB 3.94Å; V585-V604 HydrophobicContact CG2-CG2 4.15Å; V602-V604 PolarHBondContact O-N 3.21Å; V604-A606 PolarHBondContact O-N 2.9Å; V604-V607 PolarHBondContact O-N 3.44Å; V604-E608 HydrophobicContact CG2-CB 4.11Å; V604-E608 HydrophobicContact CG2-CG 4.31Å; V604-E608 WeakPolarHBondContact O-CA 3.47Å; V604-E608 PolarHBondContact O-N 2.96Å; V604-F611 HydrophobicContact CB-CD1 4.37Å; V604-F611 HydrophobicContact CG1-CB 4.43Å; V604-F611 HydrophobicContact CG1-CD1 3.54Å; V604-F611 HydrophobicContact CG1-CE1 4.07Å; V604-F611 HydrophobicContact CG1-CG 4.16Å; V604-F611 HydrophobicContact CG2-CB 4.02Å; V604-F611 HydrophobicContact CG2-CD1 3.86Å; V604-F611 HydrophobicContact CG2-CD2 4.11Å; V604-F611 HydrophobicContact CG2-CE1 4.35Å; V604-F611 HydrophobicContact CG2-CG 3.72Å; V604-I613 HydrophobicContact CG1-CD1 3.85Å; V604-I613 HydrophobicContact CG1-CG1 4.22Å
605	A	77	Confident	75.5	Confident	30 Å²	30	49.2 Å²	49.2	25%	0.248	26%	0.257	C	S	.	.	H	α-helix	trans	-64.3	-19.3	177.8	0	0	0	0	0	114.5	P603 K609 Q1052	P603-A605 PolarHBondContact O-N 3.15Å; P603-A605 VanDerWaalsContact O-N 3.08Å; A605-K609 WeakPolarHBondContact O-CA 3.49Å; A605-Q1052 PolarHBondContact O-NE2 2.92Å
606	A	71.7	Confident	76.3	Confident	28 Å²	28	47.7 Å²	47.7	23%	0.231	25%	0.247	C	C	.	.	H	α-helix	trans	-83.2	-23.1	175	0	0	0	0	0	112.5	V602 P603 V604	V602-A606 HydrophobicContact CG1-CB 3.71Å; P603-A606 WeakPolarHBondContact O-CB 3.25Å; P603-A606 PolarHBondContact O-N 3.17Å; V604-A606 PolarHBondContact O-N 2.9Å
607	V	75.8	Confident	77.1	Confident	10 Å²	10	48 Å²	48	6%	0.061	24%	0.239	C	C	.	.	H	α-helix	trans	-96.3	-57.5	178.7	178.2	0	0	0	0	109.4	V585 Y591 V602 V604 F953 I1055	V585-V607 HydrophobicContact CG2-CB 4.23Å; V585-V607 HydrophobicContact CG2-CG2 4.01Å; Y591-V607 HydrophobicContact CE1-CB 4.46Å; Y591-V607 HydrophobicContact CE1-CG1 3.81Å; Y591-V607 HydrophobicContact CE1-CG2 3.72Å; V602-V607 HydrophobicContact CB-CG2 4.49Å; V602-V607 HydrophobicContact CG1-CG2 3.81Å; V604-V607 PolarHBondContact O-N 3.44Å; V607-F953 HydrophobicContact CG2-CE2 4.24Å; V607-I1055 HydrophobicContact CB-CD1 4.08Å; V607-I1055 HydrophobicContact CG1-CD1 3.54Å; V607-I1055 WeakPolarHBondContact O-CD1 3.36Å
608	E	81	Confident	77.8	Confident	19 Å²	19	54.3 Å²	54.3	9%	0.089	27%	0.268	C	S	.	.	S	Bend	trans	-98.2	85.8	175.8	-64.3	-61.7	164	0	0	109.5	Y575 F577 H588 V604 R610 F611 Y646	Y575-E608 WeakPolarHBondContact CE2-OE1 3.42Å; Y575-E608 PolarHBondContact OH-OE1 2.91Å; Y575-E608 PolarHBondContact OH-OE2 2.98Å; F577-E608 HydrophobicContact CE1-CG 4.49Å; F577-E608 HydrophobicContact CZ-CG 4.23Å; H588-E608 IonicContact CE1-OE1 2.69Å; H588-E608 IonicContact NE2-OE1 3.63Å; H588-E608 PolarHBondContact NE2-OE1 3.36Å; V604-E608 HydrophobicContact CG2-CB 4.11Å; V604-E608 HydrophobicContact CG2-CG 4.31Å; V604-E608 WeakPolarHBondContact O-CA 3.47Å; V604-E608 PolarHBondContact O-N 2.96Å; E608-R610 PolarHBondContact O-N 2.63Å; E608-F611 HydrophobicContact CB-CB 3.75Å; E608-F611 WeakPolarHBondContact O-CB 3.48Å; E608-F611 PolarHBondContact O-N 3.2Å; E608-Y646 PolarHBondContact OE2-OH 3.44Å
609	K	71.4	Confident	78.7	Confident	95 Å²	95	48.4 Å²	48.4	41%	0.413	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.3	-29.8	-170.5	-69.5	-170.7	179	-166.6	0	115.7	A605 Q1052	A605-K609 WeakPolarHBondContact O-CA 3.49Å; K609-Q1052 PolarHBondContact NZ-O 2.96Å
610	R	74.7	Confident	79.7	Confident	80 Å²	80	48.1 Å²	48.1	30%	0.302	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.5	19.3	-174.7	-65.4	-174.1	-168.9	152	11.3	112.9	E608 Q630 E636 D641	E608-R610 PolarHBondContact O-N 2.63Å; R610-Q630 HydrophobicContact CB-CG 3.83Å; R610-Q630 WeakPolarHBondContact O-CG 3.47Å; R610-Q630 PolarHBondContact O-OE1 3.38Å; R610-E636 IonicContact CZ-OE2 2.66Å; R610-E636 IonicContact NH1-OE2 3.84Å; R610-E636 IonicContact NH2-OE1 3.8Å; R610-E636 IonicContact NH2-OE2 2.7Å; R610-E636 PolarHBondContact NH2-OE2 3.32Å; R610-D641 IonicContact CZ-OD2 3.93Å; R610-D641 IonicContact NH1-OD2 3.33Å; R610-D641 PolarHBondContact NH1-OD2 3.22Å; R610-D641 IonicContact NH2-OD2 2.75Å; R610-D641 PolarHBondContact NH2-OD2 3.34Å
611	F	83.8	Confident	80.9	Confident	11 Å²	11	56 Å²	56	5%	0.048	28%	0.282	C	S	.	.			trans	-57.2	125.2	174.5	-173.8	-96.6	0	0	0	110.2	F577 L579 V604 E608 I613 W616 Y646 V659	F577-F611 HydrophobicContact CZ-CD2 4.49Å; F577-F611 HydrophobicContact CZ-CE2 4.28Å; L579-F611 HydrophobicContact CD1-CZ 4.21Å; V604-F611 HydrophobicContact CB-CD1 4.37Å; V604-F611 HydrophobicContact CG1-CB 4.43Å; V604-F611 HydrophobicContact CG1-CD1 3.54Å; V604-F611 HydrophobicContact CG1-CE1 4.07Å; V604-F611 HydrophobicContact CG1-CG 4.16Å; V604-F611 HydrophobicContact CG2-CB 4.02Å; V604-F611 HydrophobicContact CG2-CD1 3.86Å; V604-F611 HydrophobicContact CG2-CD2 4.11Å; V604-F611 HydrophobicContact CG2-CE1 4.35Å; V604-F611 HydrophobicContact CG2-CG 3.72Å; E608-F611 HydrophobicContact CB-CB 3.75Å; E608-F611 WeakPolarHBondContact O-CB 3.48Å; E608-F611 PolarHBondContact O-N 3.2Å; F611-I613 HydrophobicContact CD1-CB 4.13Å; F611-I613 PolarHBondContact O-N 3.2Å; F611-W616 HydrophobicContact CE1-CB 3.85Å; F611-W616 AromaticContact CE1-CD2 3.9Å; F611-W616 HydrophobicContact CE1-CD2 3.9Å; F611-W616 HydrophobicContact CE1-CE3 4.05Å; F611-W616 AromaticContact CE1-CG 3.81Å; F611-W616 HydrophobicContact CE1-CG 3.81Å; F611-W616 HydrophobicContact CZ-CB 4.1Å; F611-W616 HydrophobicContact CZ-CD2 4.11Å; F611-W616 AromaticContact CZ-CG 3.82Å; F611-W616 HydrophobicContact CZ-CG 3.82Å; F611-Y646 AromaticContact CD2-CD1 3.94Å; F611-Y646 HydrophobicContact CD2-CD1 3.94Å; F611-Y646 HydrophobicContact CD2-CD2 4.23Å; F611-Y646 AromaticContact CD2-CE1 3.92Å; F611-Y646 HydrophobicContact CD2-CE1 3.92Å; F611-Y646 HydrophobicContact CD2-CE2 4.21Å; F611-Y646 HydrophobicContact CD2-CG 4.09Å; F611-Y646 AromaticContact CE2-CD1 3.9Å; F611-Y646 HydrophobicContact CE2-CD1 3.9Å; F611-Y646 HydrophobicContact CE2-CD2 4.39Å; F611-Y646 HydrophobicContact CE2-CE1 4.34Å; F611-Y646 AromaticContact CE2-CG 3.92Å; F611-Y646 HydrophobicContact CE2-CG 3.92Å; F611-V659 HydrophobicContact CE2-CG1 4.3Å
612	P	85.6	Confident	82	Confident	26 Å²	26	57.2 Å²	57.2	17%	0.169	29%	0.292	C	S	.	.			trans	-75.2	69.4	-176	31.4	-36.1	0	0	0	111.3	L614 E615 W616 V628	P612-L614 VanDerWaalsContact C-N 3.32Å; P612-L614 PolarHBondContact O-N 2.93Å; P612-E615 HydrophobicContact CB-CB 4.35Å; P612-E615 PolarHBondContact O-N 3.1Å; P612-W616 WeakPolarHBondContact O-CB 3.43Å; P612-W616 PolarHBondContact O-N 2.65Å; P612-V628 HydrophobicContact CG-CB 3.69Å; P612-V628 HydrophobicContact CG-CG2 3.58Å
613	I	84.9	Confident	82.8	Confident	47 Å²	47	61.9 Å²	61.9	24%	0.241	31%	0.313	C	S	.	.	H	α-helix	trans	-61.1	-35.8	-170.2	-165.9	173	0	0	0	113.4	V604 F611 W616 K617	V604-I613 HydrophobicContact CG1-CD1 3.85Å; V604-I613 HydrophobicContact CG1-CG1 4.22Å; F611-I613 HydrophobicContact CD1-CB 4.13Å; F611-I613 PolarHBondContact O-N 3.2Å; I613-W616 HydrophobicContact CG1-CE3 4.28Å; I613-K617 HydrophobicContact CG1-CD 4.36Å; I613-K617 HydrophobicContact CG1-CG 4.36Å; I613-K617 VanDerWaalsContact O-CB 3.3Å; I613-K617 WeakPolarHBondContact O-CB 3.34Å; I613-K617 VanDerWaalsContact O-CG 3.31Å; I613-K617 WeakPolarHBondContact O-CG 3.32Å; I613-K617 PolarHBondContact O-N 2.93Å
614	L	85.2	Confident	83.6	Confident	149 Å²	149	64 Å²	64	78%	0.78	32%	0.32	S	S	*	.	H	α-helix	trans	-68.7	-46.1	-179.4	-68.8	172.5	0	0	0	111.4	P612 K617 H618	P612-L614 VanDerWaalsContact C-N 3.32Å; P612-L614 PolarHBondContact O-N 2.93Å; L614-K617 PolarHBondContact O-N 2.67Å; L614-H618 WeakPolarHBondContact O-CB 3.07Å; L614-H618 PolarHBondContact O-N 3.34Å
615	E	86.3	Confident	84.1	Confident	111 Å²	111	66.4 Å²	66.4	52%	0.519	34%	0.337	S	S	.	.	H	α-helix	trans	-64.8	-45.6	177	-173	-178.7	176.9	0	0	110.6	P612 K617 H618 S619 V628	P612-E615 HydrophobicContact CB-CB 4.35Å; P612-E615 PolarHBondContact O-N 3.1Å; E615-K617 PolarHBondContact O-N 2.77Å; E615-H618 PolarHBondContact O-N 3.23Å; E615-S619 PolarHBondContact O-N 3.24Å; E615-V628 HydrophobicContact CB-CG1 4.49Å; E615-V628 HydrophobicContact CG-CG1 4.07Å
616	W	89.9	Confident	84.8	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-58.6	-49.3	175	173.1	74.8	0	0	0	111.7	L579 F611 P612 I613 H618 S619 L620 V628 W648 V657	L579-W616 HydrophobicContact CD1-CH2 4.19Å; L579-W616 HydrophobicContact CD1-CZ2 3.97Å; F611-W616 HydrophobicContact CE1-CB 3.85Å; F611-W616 AromaticContact CE1-CD2 3.9Å; F611-W616 HydrophobicContact CE1-CD2 3.9Å; F611-W616 HydrophobicContact CE1-CE3 4.05Å; F611-W616 AromaticContact CE1-CG 3.81Å; F611-W616 HydrophobicContact CE1-CG 3.81Å; F611-W616 HydrophobicContact CZ-CB 4.1Å; F611-W616 HydrophobicContact CZ-CD2 4.11Å; F611-W616 AromaticContact CZ-CG 3.82Å; F611-W616 HydrophobicContact CZ-CG 3.82Å; P612-W616 WeakPolarHBondContact O-CB 3.43Å; P612-W616 PolarHBondContact O-N 2.65Å; I613-W616 HydrophobicContact CG1-CE3 4.28Å; W616-H618 VanDerWaalsContact C-N 3.3Å; W616-H618 PolarHBondContact O-N 2.87Å; W616-S619 PolarHBondContact O-N 3.21Å; W616-L620 HydrophobicContact CH2-CD2 3.75Å; W616-L620 HydrophobicContact CZ2-CD1 4.37Å; W616-L620 HydrophobicContact CZ2-CD2 3.73Å; W616-L620 HydrophobicContact CZ3-CD2 4.27Å; W616-L620 WeakPolarHBondContact O-CB 3.38Å; W616-L620 PolarHBondContact O-N 3.22Å; W616-V628 HydrophobicContact CB-CG1 4.21Å; W616-V628 HydrophobicContact CB-CG2 4.43Å; W616-W648 AromaticContact CD1-CD1 3.66Å; W616-W648 AromaticContact CD1-CD2 3.98Å; W616-W648 AromaticContact CD1-CE2 3.95Å; W616-W648 AromaticContact CD1-CG 3.81Å; W616-W648 AromaticContact CD1-NE1 3.72Å; W616-W648 AromaticContact NE1-CD2 3.79Å; W616-W648 AromaticContact NE1-CG 3.75Å; W616-V657 HydrophobicContact CZ2-CB 4.29Å; W616-V657 HydrophobicContact CZ2-CG1 4.25Å; W616-V657 HydrophobicContact CZ2-CG2 4.2Å
617	K	87.8	Confident	85.6	Confident	81 Å²	81	70.4 Å²	70.4	35%	0.352	35%	0.354	S	S	.	.	H	α-helix	trans	-60.8	-36.8	177.6	-79.6	-169.9	176.4	-168.2	0	112.5	D582 I613 L614 E615 K621	D582-K617 WeakPolarHBondContact O-CE 3.03Å; D582-K617 PolarHBondContact O-NZ 2.89Å; I613-K617 HydrophobicContact CG1-CD 4.36Å; I613-K617 HydrophobicContact CG1-CG 4.36Å; I613-K617 VanDerWaalsContact O-CB 3.3Å; I613-K617 WeakPolarHBondContact O-CB 3.34Å; I613-K617 VanDerWaalsContact O-CG 3.31Å; I613-K617 WeakPolarHBondContact O-CG 3.32Å; I613-K617 PolarHBondContact O-N 2.93Å; L614-K617 PolarHBondContact O-N 2.67Å; E615-K617 PolarHBondContact O-N 2.77Å; K617-K621 WeakPolarHBondContact O-CG 3.45Å; K617-K621 PolarHBondContact O-N 2.75Å
618	H	87.5	Confident	86.1	Confident	137 Å²	137	70 Å²	70	63%	0.634	35%	0.351	S	S	*	.	H	α-helix	trans	-67.1	-45.3	175.6	-175.8	-90.5	0	0	0	111.7	L614 E615 W616 L620 K621 T622	L614-H618 WeakPolarHBondContact O-CB 3.07Å; L614-H618 PolarHBondContact O-N 3.34Å; E615-H618 PolarHBondContact O-N 3.23Å; W616-H618 VanDerWaalsContact C-N 3.3Å; W616-H618 PolarHBondContact O-N 2.87Å; H618-L620 VanDerWaalsContact C-N 3.33Å; H618-L620 PolarHBondContact O-N 3.4Å; H618-K621 PolarHBondContact O-N 3.27Å; H618-T622 PolarHBondContact O-OG1 3.23Å
619	S	89	Confident	86.1	Confident	27 Å²	27	72.6 Å²	72.6	19%	0.189	37%	0.365	C	S	.	.	H	α-helix	trans	-66.5	-35.9	177.2	-162.9	0	0	0	0	112.3	E615 W616 K621 T622 H623 W648	E615-S619 PolarHBondContact O-N 3.24Å; W616-S619 PolarHBondContact O-N 3.21Å; S619-K621 VanDerWaalsContact C-N 3.27Å; S619-K621 PolarHBondContact O-N 3.37Å; S619-T622 PolarHBondContact O-N 3.23Å; S619-T622 VanDerWaalsContact O-N 3.14Å; S619-T622 PolarHBondContact O-OG1 2.62Å; S619-T622 VanDerWaalsContact O-OG1 3.07Å; S619-H623 PolarHBondContact O-N 3.4Å; S619-W648 WeakPolarHBondContact OG-CZ2 3.23Å
620	L	88.4	Confident	86.3	Confident	9 Å²	9	69.2 Å²	69.2	5%	0.047	35%	0.351	C	S	.	.	H	α-helix	trans	-61.1	-36.1	178.6	-173.6	67.6	0	0	0	111.4	E581 W616 H618 T622 W648 R650 V657	E581-L620 HydrophobicContact CB-CD2 4.5Å; W616-L620 HydrophobicContact CH2-CD2 3.75Å; W616-L620 HydrophobicContact CZ2-CD1 4.37Å; W616-L620 HydrophobicContact CZ2-CD2 3.73Å; W616-L620 HydrophobicContact CZ3-CD2 4.27Å; W616-L620 WeakPolarHBondContact O-CB 3.38Å; W616-L620 PolarHBondContact O-N 3.22Å; H618-L620 VanDerWaalsContact C-N 3.33Å; H618-L620 PolarHBondContact O-N 3.4Å; L620-T622 PolarHBondContact O-N 2.79Å; L620-W648 HydrophobicContact CB-CH2 4.49Å; L620-W648 HydrophobicContact CD1-CE3 4.15Å; L620-W648 HydrophobicContact CD1-CH2 4.17Å; L620-W648 HydrophobicContact CD1-CZ3 3.65Å; L620-R650 HydrophobicContact CD1-CG 3.81Å; L620-R650 VanDerWaalsContact CD1-NE 3.28Å; L620-R650 PolarHBondContact O-NE 3.04Å; L620-R650 PolarHBondContact O-NH2 2.92Å; L620-V657 HydrophobicContact CD1-CG2 3.96Å
621	K	87.8	Confident	85.8	Confident	179 Å²	179	71.1 Å²	71.1	78%	0.778	37%	0.366	S	S	*	.	H	α-helix	trans	-65.6	-25.4	177.3	-72.4	176.6	-178.1	-176.3	0	113.9	K617 H618 S619	K617-K621 WeakPolarHBondContact O-CG 3.45Å; K617-K621 PolarHBondContact O-N 2.75Å; H618-K621 PolarHBondContact O-N 3.27Å; S619-K621 VanDerWaalsContact C-N 3.27Å; S619-K621 PolarHBondContact O-N 3.37Å
622	T	86.5	Confident	84.8	Confident	88 Å²	88	76.3 Å²	76.3	54%	0.54	39%	0.386	S	S	.	.	H	α-helix	trans	-110.6	-26.1	-170.3	46.7	0	0	0	0	113.1	H618 S619 L620	H618-T622 PolarHBondContact O-OG1 3.23Å; S619-T622 PolarHBondContact O-N 3.23Å; S619-T622 VanDerWaalsContact O-N 3.14Å; S619-T622 PolarHBondContact O-OG1 2.62Å; S619-T622 VanDerWaalsContact O-OG1 3.07Å; L620-T622 PolarHBondContact O-N 2.79Å
623	H	88.3	Confident	83.5	Confident	107 Å²	107	78.5 Å²	78.5	50%	0.495	40%	0.398	S	S	.	.			trans	-128.9	154.3	-174	-58.1	81.2	0	0	0	111.9	S619 S625 W648	S619-H623 PolarHBondContact O-N 3.4Å; H623-S625 WeakPolarHBondContact CB-O 3.44Å; H623-W648 HydrophobicContact CB-CH2 4.15Å; H623-W648 WeakPolarHBondContact O-CH2 3.37Å
624	N	91.1	Very high	81.7	Confident	109 Å²	109	82.3 Å²	82.3	58%	0.583	43%	0.426	S	S	*	.	S	Bend	trans	-90.6	-11.5	172.4	-73.6	-18.7	0	0	0	113.1	K649 R650	N624-K649 WeakPolarHBondContact O-CD 3.17Å; N624-R650 PolarHBondContact O-N 2.83Å
625	S	92.1	Very high	79.9	Confident	52 Å²	52	78.8 Å²	78.8	36%	0.364	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	156.1	175.5	44	0	0	0	0	109.8	H623 W648	H623-S625 WeakPolarHBondContact CB-O 3.44Å; S625-W648 WeakPolarHBondContact CA-O 3.47Å; S625-W648 WeakPolarHBondContact CB-O 3.46Å
626	G	91.2	Very high	77.9	Confident	28 Å²	28	77.9 Å²	77.9	29%	0.289	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.4	-169.3	175.7	0	0	0	0	0	112.2	W648	G626-W648 VanDerWaalsContact C-NE1 3.34Å; G626-W648 PolarHBondContact N-O 3.28Å; G626-W648 VanDerWaalsContact O-CD1 3.3Å; G626-W648 PolarHBondContact O-N 2.86Å
627	Q	89.2	Confident	75.7	Confident	114 Å²	114	84 Å²	84	53%	0.533	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	148.3	174	67.2	-174.1	10.1	0	0	109.8	L645 Y646 Y647	Q627-L645 HydrophobicContact CB-CD1 4.17Å; Q627-L645 HydrophobicContact CG-CD1 4.43Å; Q627-Y646 CarbonylContact C-O 3.55Å; Q627-Y646 WeakPolarHBondContact CA-O 3.4Å; Q627-Y647 HydrophobicContact CB-CD1 4.08Å; Q627-Y647 HydrophobicContact CB-CE1 4.37Å
628	V	87.5	Confident	73.6	Confident	2 Å²	2	85.2 Å²	85.2	1%	0.012	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	135.1	173.7	-66.7	0	0	0	0	109.1	P612 E615 W616 Y646	P612-V628 HydrophobicContact CG-CB 3.69Å; P612-V628 HydrophobicContact CG-CG2 3.58Å; E615-V628 HydrophobicContact CB-CG1 4.49Å; E615-V628 HydrophobicContact CG-CG1 4.07Å; W616-V628 HydrophobicContact CB-CG1 4.21Å; W616-V628 HydrophobicContact CB-CG2 4.43Å; V628-Y646 HydrophobicContact CG2-CD2 4.41Å; V628-Y646 PolarHBondContact N-O 2.99Å; V628-Y646 PolarHBondContact O-N 2.91Å
629	L	80	Confident	71.5	Confident	72 Å²	72	90.5 Å²	90.5	38%	0.377	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	126.2	-175	-179.2	65.7	0	0	0	110.2	L631 L645	L629-L631 HydrophobicContact CD2-CD2 3.85Å; L629-L631 HydrophobicContact CD2-CG 4.22Å; L629-L631 HydrophobicContact CG-CD2 4.42Å; L629-L631 HydrophobicContact CG-CG 4.39Å; L629-L645 HydrophobicContact CB-CD1 4.04Å; L629-L645 HydrophobicContact CD1-CB 4.1Å; L629-L645 HydrophobicContact CD1-CD1 4.03Å
630	Q	75.9	Confident	69.5	Low	25 Å²	25	93.9 Å²	93.9	12%	0.117	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	110.7	167.9	179.5	-167.5	-49.9	0	0	109.6	R610 V644 Y646	R610-Q630 HydrophobicContact CB-CG 3.83Å; R610-Q630 WeakPolarHBondContact O-CG 3.47Å; R610-Q630 PolarHBondContact O-OE1 3.38Å; Q630-V644 WeakPolarHBondContact CB-O 3.45Å; Q630-V644 PolarHBondContact N-O 2.77Å; Q630-V644 PolarHBondContact O-N 3.02Å; Q630-Y646 HydrophobicContact CB-CE2 3.83Å; Q630-Y646 PolarHBondContact OE1-OH 2.91Å
631	L	63.6	Low	67.8	Low	120 Å²	120	95.8 Å²	95.8	63%	0.628	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-83.6	143.4	177.2	-70.2	161.3	0	0	0	112.2	L629	L629-L631 HydrophobicContact CD2-CD2 3.85Å; L629-L631 HydrophobicContact CD2-CG 4.22Å; L629-L631 HydrophobicContact CG-CD2 4.42Å; L629-L631 HydrophobicContact CG-CG 4.39Å
632	R	63.8	Low	66.3	Low	120 Å²	120	89.7 Å²	89.7	45%	0.453	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-61	140.2	168.9	-177.8	176.3	-178.6	149.7	3.5	111.9	E636 D643	R632-E636 PolarHBondContact NH2-O 2.02Å; R632-D643 VanDerWaalsContact CB-OD1 3.31Å; R632-D643 WeakPolarHBondContact CB-OD1 3.27Å; R632-D643 PolarHBondContact N-OD1 3.18Å
633	V	56.8	Low	65.5	Low	72 Å²	72	89 Å²	89	44%	0.436	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-77.8	129.4	172.6	-175.7	0	0	0	0	109.9	G635	V633-G635 PolarHBondContact O-N 3.17Å
634	P	48	Very low	65.1	Low	127 Å²	127	84.2 Å²	84.2	83%	0.825	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	119.5	171.4	-17.3	29.2	0	0	0	110.4
635	G	47.5	Very low	64.8	Low	75 Å²	75	79.7 Å²	79.7	77%	0.773	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.6	-18.6	173	0	0	0	0	0	116.5	V633 T637	V633-G635 PolarHBondContact O-N 3.17Å; G635-T637 PolarHBondContact O-N 3.45Å
636	E	45.2	Very low	64.7	Low	91 Å²	91	77.3 Å²	77.3	43%	0.425	43%	0.427	S	S	.	.			trans	-83.9	112.6	172.6	-87.8	-178.6	139.5	0	0	110.7	R610 R632 N638	R610-E636 IonicContact CZ-OE2 2.66Å; R610-E636 IonicContact NH1-OE2 3.84Å; R610-E636 IonicContact NH2-OE1 3.8Å; R610-E636 IonicContact NH2-OE2 2.7Å; R610-E636 PolarHBondContact NH2-OE2 3.32Å; R632-E636 PolarHBondContact NH2-O 2.02Å; E636-N638 VanDerWaalsContact C-N 3.29Å; E636-N638 PolarHBondContact O-N 2.81Å
637	T	42.4	Very low	64.8	Low	130 Å²	130	77.7 Å²	77.7	80%	0.798	42%	0.42	S	S	*	.			trans	-81.5	-1.1	179.9	48.5	0	0	0	0	113.9	G635 R639	G635-T637 PolarHBondContact O-N 3.45Å; T637-R639 PolarHBondContact O-N 3.26Å; T637-R639 VanDerWaalsContact O-N 3.08Å
638	N	43	Very low	65	Low	105 Å²	105	72.3 Å²	72.3	56%	0.561	39%	0.394	S	S	*	.			trans	-63.4	115.5	179.3	-95.8	-18.4	0	0	0	110.5	E636 T640	E636-N638 VanDerWaalsContact C-N 3.29Å; E636-N638 PolarHBondContact O-N 2.81Å; N638-T640 PolarHBondContact O-N 2.5Å
639	R	43.6	Very low	65.4	Low	248 Å²	248	73.8 Å²	73.8	94%	0.936	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-8	-175.3	-76.1	178.9	166.7	172.7	-3.9	115	T637	T637-R639 PolarHBondContact O-N 3.26Å; T637-R639 VanDerWaalsContact O-N 3.08Å
640	T	48.6	Very low	66	Low	99 Å²	99	72.8 Å²	72.8	61%	0.607	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-13.6	-170.7	51.2	0	0	0	0	115.1	N638 A642 R663	N638-T640 PolarHBondContact O-N 2.5Å; T640-A642 PolarHBondContact O-N 3.26Å; T640-R663 PolarHBondContact O-NH1 3.32Å
641	D	50.8	Low	66.8	Low	49 Å²	49	71.6 Å²	71.6	26%	0.262	39%	0.387	S	S	.	.			trans	-96.1	82.1	-177.7	-75.4	-5.8	0	0	0	110.5	R610	R610-D641 IonicContact CZ-OD2 3.93Å; R610-D641 IonicContact NH1-OD2 3.33Å; R610-D641 PolarHBondContact NH1-OD2 3.22Å; R610-D641 IonicContact NH2-OD2 2.75Å; R610-D641 PolarHBondContact NH2-OD2 3.34Å
642	A	57.7	Low	67.9	Low	50 Å²	50	71.7 Å²	71.7	41%	0.413	38%	0.384	S	S	.	.			trans	-73.8	153.4	163	0	0	0	0	0	110.1	T640 V644	T640-A642 PolarHBondContact O-N 3.26Å; A642-V644 PolarHBondContact O-N 3.28Å
643	D	69.4	Low	68.6	Low	75 Å²	75	71.1 Å²	71.1	40%	0.401	40%	0.398	S	S	.	.			trans	-59.1	137	169	-64	-28	0	0	0	109.1	R632	R632-D643 VanDerWaalsContact CB-OD1 3.31Å; R632-D643 WeakPolarHBondContact CB-OD1 3.27Å; R632-D643 PolarHBondContact N-OD1 3.18Å
644	V	79.1	Confident	69.9	Low	5 Å²	5	68.4 Å²	68.4	3%	0.03	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	121.8	-179.8	-173.4	0	0	0	0	108.3	Q630 A642 Y646 A661 R663	Q630-V644 WeakPolarHBondContact CB-O 3.45Å; Q630-V644 PolarHBondContact N-O 2.77Å; Q630-V644 PolarHBondContact O-N 3.02Å; A642-V644 PolarHBondContact O-N 3.28Å; V644-Y646 HydrophobicContact CB-CE2 3.92Å; V644-Y646 HydrophobicContact CG1-CD1 4.39Å; V644-Y646 HydrophobicContact CG1-CD2 4.27Å; V644-Y646 HydrophobicContact CG1-CE1 3.9Å; V644-Y646 HydrophobicContact CG1-CE2 3.76Å; V644-A661 HydrophobicContact CG1-CB 3.99Å; V644-R663 HydrophobicContact CG2-CG 4.18Å
645	L	85.2	Confident	71.6	Confident	14 Å²	14	64.9 Å²	64.9	7%	0.073	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122.5	174.9	-175.9	57.3	0	0	0	108.7	Q627 L629 Y647 S662	Q627-L645 HydrophobicContact CB-CD1 4.17Å; Q627-L645 HydrophobicContact CG-CD1 4.43Å; L629-L645 HydrophobicContact CB-CD1 4.04Å; L629-L645 HydrophobicContact CD1-CB 4.1Å; L629-L645 HydrophobicContact CD1-CD1 4.03Å; L645-Y647 HydrophobicContact CB-CE2 4.31Å; L645-Y647 HydrophobicContact CD2-CE1 4.21Å; L645-Y647 HydrophobicContact CD2-CE2 3.78Å; L645-Y647 VanDerWaalsContact CD2-CZ 3.44Å; L645-Y647 WeakPolarHBondContact CD2-OH 3.45Å; L645-Y647 HydrophobicContact CG-CD2 4.4Å; L645-Y647 HydrophobicContact CG-CE1 4.5Å; L645-Y647 HydrophobicContact CG-CE2 3.74Å; L645-S662 PolarHBondContact N-O 3.4Å; L645-S662 PolarHBondContact O-N 3.38Å
646	Y	90.5	Very high	73.7	Confident	2 Å²	2	61.9 Å²	61.9	1%	0.008	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	116.6	179.8	-59.7	-90.7	0	0	0	109.8	F577 E608 F611 Q627 V628 Q630 V644 V659 V660 A661	F577-Y646 HydrophobicContact CE1-CD1 4.24Å; F577-Y646 HydrophobicContact CE1-CE1 4.26Å; F577-Y646 HydrophobicContact CZ-CD1 4.19Å; F577-Y646 HydrophobicContact CZ-CE1 4.29Å; E608-Y646 PolarHBondContact OE2-OH 3.44Å; F611-Y646 AromaticContact CD2-CD1 3.94Å; F611-Y646 HydrophobicContact CD2-CD1 3.94Å; F611-Y646 HydrophobicContact CD2-CD2 4.23Å; F611-Y646 AromaticContact CD2-CE1 3.92Å; F611-Y646 HydrophobicContact CD2-CE1 3.92Å; F611-Y646 HydrophobicContact CD2-CE2 4.21Å; F611-Y646 HydrophobicContact CD2-CG 4.09Å; F611-Y646 AromaticContact CE2-CD1 3.9Å; F611-Y646 HydrophobicContact CE2-CD1 3.9Å; F611-Y646 HydrophobicContact CE2-CD2 4.39Å; F611-Y646 HydrophobicContact CE2-CE1 4.34Å; F611-Y646 AromaticContact CE2-CG 3.92Å; F611-Y646 HydrophobicContact CE2-CG 3.92Å; Q627-Y646 CarbonylContact C-O 3.55Å; Q627-Y646 WeakPolarHBondContact CA-O 3.4Å; V628-Y646 HydrophobicContact CG2-CD2 4.41Å; V628-Y646 PolarHBondContact N-O 2.99Å; V628-Y646 PolarHBondContact O-N 2.91Å; Q630-Y646 HydrophobicContact CB-CE2 3.83Å; Q630-Y646 PolarHBondContact OE1-OH 2.91Å; V644-Y646 HydrophobicContact CB-CE2 3.92Å; V644-Y646 HydrophobicContact CG1-CD1 4.39Å; V644-Y646 HydrophobicContact CG1-CD2 4.27Å; V644-Y646 HydrophobicContact CG1-CE1 3.9Å; V644-Y646 HydrophobicContact CG1-CE2 3.76Å; Y646-V659 HydrophobicContact CD1-CG1 3.94Å; Y646-V659 HydrophobicContact CG-CG1 4.42Å; Y646-V660 CarbonylContact C-O 3.39Å; Y646-V660 WeakPolarHBondContact CA-O 3.48Å; Y646-A661 HydrophobicContact CD1-CB 3.69Å; Y646-A661 HydrophobicContact CE1-CB 3.6Å
647	Y	92.1	Very high	76	Confident	36 Å²	36	57.5 Å²	57.5	14%	0.141	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	136.6	171	-59.7	-91.9	0	0	0	108.8	H121 Q627 L645 V659 V660	H121-Y647 HydrophobicContact CB-CD2 3.6Å; H121-Y647 HydrophobicContact CB-CE2 3.61Å; H121-Y647 HydrophobicContact CB-CG 4.13Å; Q627-Y647 HydrophobicContact CB-CD1 4.08Å; Q627-Y647 HydrophobicContact CB-CE1 4.37Å; L645-Y647 HydrophobicContact CB-CE2 4.31Å; L645-Y647 HydrophobicContact CD2-CE1 4.21Å; L645-Y647 HydrophobicContact CD2-CE2 3.78Å; L645-Y647 VanDerWaalsContact CD2-CZ 3.44Å; L645-Y647 WeakPolarHBondContact CD2-OH 3.45Å; L645-Y647 HydrophobicContact CG-CD2 4.4Å; L645-Y647 HydrophobicContact CG-CE1 4.5Å; L645-Y647 HydrophobicContact CG-CE2 3.74Å; Y647-V659 CarbonylContact O-C 3.5Å; Y647-V659 VanDerWaalsContact O-CA 3.29Å; Y647-V659 WeakPolarHBondContact O-CA 3.09Å; Y647-V660 PolarHBondContact N-O 2.94Å; Y647-V660 PolarHBondContact O-N 3.33Å
648	W	94.7	Very high	78.5	Confident	1 Å²	1	51.3 Å²	51.3	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	150	-177.6	64	-91.2	0	0	0	112.9	W616 S619 L620 H623 S625 G626 R650 V657 I658 V659	W616-W648 AromaticContact CD1-CD1 3.66Å; W616-W648 AromaticContact CD1-CD2 3.98Å; W616-W648 AromaticContact CD1-CE2 3.95Å; W616-W648 AromaticContact CD1-CG 3.81Å; W616-W648 AromaticContact CD1-NE1 3.72Å; W616-W648 AromaticContact NE1-CD2 3.79Å; W616-W648 AromaticContact NE1-CG 3.75Å; S619-W648 WeakPolarHBondContact OG-CZ2 3.23Å; L620-W648 HydrophobicContact CB-CH2 4.49Å; L620-W648 HydrophobicContact CD1-CE3 4.15Å; L620-W648 HydrophobicContact CD1-CH2 4.17Å; L620-W648 HydrophobicContact CD1-CZ3 3.65Å; H623-W648 HydrophobicContact CB-CH2 4.15Å; H623-W648 WeakPolarHBondContact O-CH2 3.37Å; S625-W648 WeakPolarHBondContact CA-O 3.47Å; S625-W648 WeakPolarHBondContact CB-O 3.46Å; G626-W648 VanDerWaalsContact C-NE1 3.34Å; G626-W648 PolarHBondContact N-O 3.28Å; G626-W648 VanDerWaalsContact O-CD1 3.3Å; G626-W648 PolarHBondContact O-N 2.86Å; W648-R650 HydrophobicContact CZ3-CG 4.33Å; W648-V657 HydrophobicContact CB-CG1 4.05Å; W648-V657 HydrophobicContact CE3-CG1 4Å; W648-I658 CarbonylContact C-O 3.5Å; W648-I658 VanDerWaalsContact CA-O 3.22Å; W648-I658 WeakPolarHBondContact CA-O 3.39Å; W648-V659 HydrophobicContact CB-CG2 4.01Å
649	K	95.4	Very high	80.9	Confident	34 Å²	34	46.3 Å²	46.3	15%	0.148	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	130	178.7	178.8	68.1	179.3	-169.2	0	110.5	V125 V126 A129 N624 V657 I658	V125-K649 HydrophobicContact CG1-CB 4.23Å; V125-K649 HydrophobicContact CG2-CB 4.24Å; V126-K649 HydrophobicContact CG2-CD 4.2Å; V126-K649 HydrophobicContact CG2-CG 4.47Å; A129-K649 HydrophobicContact CB-CB 3.91Å; A129-K649 HydrophobicContact CB-CG 3.33Å; N624-K649 WeakPolarHBondContact O-CD 3.17Å; K649-V657 WeakPolarHBondContact O-CA 3.1Å; K649-I658 PolarHBondContact N-O 3.08Å; K649-I658 PolarHBondContact O-N 2.91Å
650	R	93.8	Very high	83.2	Confident	50 Å²	50	34.5 Å²	34.5	19%	0.189	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	132.6	169.3	-72.3	-176.6	-178.2	-110.7	13.3	109.9	E581 L620 N624 W648 V657	E581-R650 IonicContact OE1-NH1 2.77Å; E581-R650 PolarHBondContact OE1-NH1 3.37Å; E581-R650 IonicContact OE2-NH1 2.98Å; E581-R650 PolarHBondContact OE2-NH1 3.37Å; E581-R650 VanDerWaalsContact OE2-NH1 3.11Å; L620-R650 HydrophobicContact CD1-CG 3.81Å; L620-R650 VanDerWaalsContact CD1-NE 3.28Å; L620-R650 PolarHBondContact O-NE 3.04Å; L620-R650 PolarHBondContact O-NH2 2.92Å; N624-R650 PolarHBondContact O-N 2.83Å; W648-R650 HydrophobicContact CZ3-CG 4.33Å; R650-V657 HydrophobicContact CG-CG2 4.13Å
651	V	91.6	Very high	85	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.006	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-80.4	121.2	171.6	179.1	0	0	0	0	107.9	A129 M132 A133 L136 S653 T654 Y656 I658	A129-V651 HydrophobicContact CB-CG2 4.19Å; M132-V651 HydrophobicContact CB-CG1 4.24Å; M132-V651 HydrophobicContact CG-CG1 4.12Å; M132-V651 HydrophobicContact SD-CG1 4.32Å; M132-V651 HydrophobicContact SD-CG2 3.91Å; A133-V651 HydrophobicContact CB-CG1 4Å; L136-V651 HydrophobicContact CD1-CG1 4.31Å; V651-S653 PolarHBondContact O-N 2.56Å; V651-T654 VanDerWaalsContact CB-OG1 3.24Å; V651-T654 WeakPolarHBondContact CB-OG1 3.27Å; V651-T654 HydrophobicContact CG1-CG2 4.01Å; V651-T654 WeakPolarHBondContact CG1-OG1 3.35Å; V651-T654 PolarHBondContact O-N 3.11Å; V651-T654 PolarHBondContact O-OG1 3.18Å; V651-Y656 PolarHBondContact N-O 2.89Å; V651-I658 HydrophobicContact CG2-CD1 3.97Å; V651-I658 HydrophobicContact CG2-CG1 3.77Å
652	Q	86.6	Confident	86.6	Confident	121 Å²	121	27.9 Å²	27.9	57%	0.565	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	139.6	-171.3	-59.5	-175.5	21.2	0	0	111.8	A133 T654	A133-Q652 HydrophobicContact CB-CB 4.22Å; Q652-T654 PolarHBondContact O-N 3.02Å
653	S	78.6	Confident	87.4	Confident	109 Å²	109	30.2 Å²	30.2	76%	0.762	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.6	23.3	178.5	-53.1	0	0	0	0	115.1	V651	V651-S653 PolarHBondContact O-N 2.56Å
654	T	84	Confident	86.7	Confident	15 Å²	15	32.1 Å²	32.1	9%	0.092	16%	0.161	C	C	.	.	S	Bend	trans	-138.4	159.7	178.7	73.2	0	0	0	0	110.3	L136 I521 V651 Q652 Y656	L136-T654 HydrophobicContact CD1-CG2 3.46Å; L136-T654 VanDerWaalsContact CD1-CG2 3.46Å; I521-T654 HydrophobicContact CD1-CG2 3.8Å; V651-T654 VanDerWaalsContact CB-OG1 3.24Å; V651-T654 WeakPolarHBondContact CB-OG1 3.27Å; V651-T654 HydrophobicContact CG1-CG2 4.01Å; V651-T654 WeakPolarHBondContact CG1-OG1 3.35Å; V651-T654 PolarHBondContact O-N 3.11Å; V651-T654 PolarHBondContact O-OG1 3.18Å; Q652-T654 PolarHBondContact O-N 3.02Å; T654-Y656 PolarHBondContact O-N 2.91Å; T654-Y656 PolarHBondContact OG1-N 3.15Å
655	P	84.3	Confident	85.3	Confident	53 Å²	53	38.5 Å²	38.5	34%	0.344	19%	0.188	S	C	.	.	S	Bend	trans	-82.3	20	173.7	36.4	-37.2	0	0	0	112.8	N580 E581	N580-P655 CarbonylContact C-O 3.55Å; N580-P655 VanDerWaalsContact CA-O 3.26Å; N580-P655 WeakPolarHBondContact CA-O 3.46Å; E581-P655 HydrophobicContact CG-CB 4.44Å; E581-P655 WeakPolarHBondContact CG-O 3.14Å; E581-P655 PolarHBondContact N-O 3.35Å
656	Y	90.6	Very high	83.1	Confident	11 Å²	11	44.4 Å²	44.4	4%	0.043	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	145.6	-172.7	-59.2	-56.8	0	0	0	112.9	M132 I521 A523 L535 L578 L579 I586 V651 T654	M132-Y656 HydrophobicContact CE-CD2 4.13Å; I521-Y656 HydrophobicContact CG2-CE2 3.98Å; A523-Y656 PolarHBondContact N-OH 3.01Å; L535-Y656 HydrophobicContact CD1-CE2 3.91Å; L578-Y656 HydrophobicContact CD2-CD1 4.46Å; L579-Y656 CarbonylContact O-C 3.58Å; L579-Y656 WeakPolarHBondContact O-CA 3.23Å; I586-Y656 HydrophobicContact CD1-CE1 4.32Å; I586-Y656 HydrophobicContact CG1-CD1 4.09Å; I586-Y656 HydrophobicContact CG1-CE1 3.95Å; V651-Y656 PolarHBondContact N-O 2.89Å; T654-Y656 PolarHBondContact O-N 2.91Å; T654-Y656 PolarHBondContact OG1-N 3.15Å
657	V	93.4	Very high	80.6	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	123.6	177.8	-175.3	0	0	0	0	108.3	L579 W616 L620 W648 K649 R650 V659	L579-V657 HydrophobicContact CB-CB 4.45Å; L579-V657 PolarHBondContact N-O 3Å; L579-V657 PolarHBondContact O-N 3.03Å; W616-V657 HydrophobicContact CZ2-CB 4.29Å; W616-V657 HydrophobicContact CZ2-CG1 4.25Å; W616-V657 HydrophobicContact CZ2-CG2 4.2Å; L620-V657 HydrophobicContact CD1-CG2 3.96Å; W648-V657 HydrophobicContact CB-CG1 4.05Å; W648-V657 HydrophobicContact CE3-CG1 4Å; K649-V657 WeakPolarHBondContact O-CA 3.1Å; R650-V657 HydrophobicContact CG-CG2 4.13Å; V657-V659 HydrophobicContact CG1-CG2 4.37Å
658	I	94.9	Very high	78.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	136	171.8	-59.6	-178.3	0	0	0	107.9	V125 L128 A129 M132 I564 L578 W648 K649 V651	V125-I658 HydrophobicContact CG2-CB 4.3Å; V125-I658 HydrophobicContact CG2-CG2 3.94Å; L128-I658 HydrophobicContact CB-CD1 3.99Å; L128-I658 HydrophobicContact CB-CG2 4.35Å; L128-I658 HydrophobicContact CD1-CG2 4.37Å; A129-I658 HydrophobicContact CB-CD1 4.18Å; M132-I658 HydrophobicContact CB-CD1 4.38Å; M132-I658 HydrophobicContact SD-CD1 4.07Å; M132-I658 HydrophobicContact SD-CG1 4.43Å; I564-I658 HydrophobicContact CD1-CD1 3.82Å; I564-I658 HydrophobicContact CD1-CG1 4.02Å; I564-I658 HydrophobicContact CG1-CD1 4.21Å; L578-I658 HydrophobicContact CD1-CG1 3.81Å; W648-I658 CarbonylContact C-O 3.5Å; W648-I658 VanDerWaalsContact CA-O 3.22Å; W648-I658 WeakPolarHBondContact CA-O 3.39Å; K649-I658 PolarHBondContact N-O 3.08Å; K649-I658 PolarHBondContact O-N 2.91Å; V651-I658 HydrophobicContact CG2-CD1 3.97Å; V651-I658 HydrophobicContact CG2-CG1 3.77Å
659	V	93.7	Very high	75.7	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	134.1	176.4	-173	0	0	0	0	109.4	A576 F577 L579 F611 Y646 Y647 W648 V657	A576-V659 CarbonylContact C-O 3.53Å; A576-V659 WeakPolarHBondContact CA-O 3.25Å; F577-V659 HydrophobicContact CD1-CB 4.36Å; F577-V659 HydrophobicContact CD2-CB 4.09Å; F577-V659 HydrophobicContact CD2-CG2 4.47Å; F577-V659 HydrophobicContact CE1-CB 3.95Å; F577-V659 HydrophobicContact CE1-CG1 3.79Å; F577-V659 HydrophobicContact CE2-CB 3.65Å; F577-V659 HydrophobicContact CE2-CG1 4.01Å; F577-V659 HydrophobicContact CE2-CG2 3.92Å; F577-V659 HydrophobicContact CG-CB 4.43Å; F577-V659 HydrophobicContact CZ-CB 3.58Å; F577-V659 HydrophobicContact CZ-CG1 3.44Å; F577-V659 VanDerWaalsContact CZ-CG1 3.44Å; F577-V659 HydrophobicContact CZ-CG2 4.22Å; F577-V659 PolarHBondContact N-O 3.38Å; F577-V659 PolarHBondContact O-N 2.97Å; L579-V659 HydrophobicContact CD1-CG2 3.69Å; L579-V659 HydrophobicContact CG-CG2 4.01Å; F611-V659 HydrophobicContact CE2-CG1 4.3Å; Y646-V659 HydrophobicContact CD1-CG1 3.94Å; Y646-V659 HydrophobicContact CG-CG1 4.42Å; Y647-V659 CarbonylContact O-C 3.5Å; Y647-V659 VanDerWaalsContact O-CA 3.29Å; Y647-V659 WeakPolarHBondContact O-CA 3.09Å; W648-V659 HydrophobicContact CB-CG2 4.01Å; V657-V659 HydrophobicContact CG1-CG2 4.37Å
660	V	91.5	Very high	73.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	114.1	169.9	169	0	0	0	0	107.9	H121 V125 L128 Y567 Y575 A576 Y646 Y647	H121-V660 HydrophobicContact CB-CG1 4.25Å; V125-V660 HydrophobicContact CB-CB 4.4Å; V125-V660 HydrophobicContact CB-CG2 3.84Å; V125-V660 HydrophobicContact CG2-CB 4.39Å; V125-V660 HydrophobicContact CG2-CG2 3.81Å; L128-V660 HydrophobicContact CD1-CG2 4.34Å; Y567-V660 HydrophobicContact CD1-CG2 4.5Å; Y567-V660 HydrophobicContact CE1-CB 4.44Å; Y567-V660 HydrophobicContact CE1-CG1 3.64Å; Y567-V660 HydrophobicContact CE1-CG2 4.01Å; Y567-V660 HydrophobicContact CE2-CG2 4.48Å; Y567-V660 WeakPolarHBondContact OH-CG1 3.5Å; Y575-V660 CarbonylContact O-C 3.5Å; Y575-V660 WeakPolarHBondContact O-CA 3.5Å; A576-V660 HydrophobicContact CB-CG2 3.99Å; Y646-V660 CarbonylContact C-O 3.39Å; Y646-V660 WeakPolarHBondContact CA-O 3.48Å; Y647-V660 PolarHBondContact N-O 2.94Å; Y647-V660 PolarHBondContact O-N 3.33Å
661	A	88.2	Confident	70.9	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.008	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	124.8	169.7	0	0	0	0	0	109.1	S574 Y575 F577 V644 Y646	S574-A661 CarbonylContact C-O 3.53Å; S574-A661 WeakPolarHBondContact CA-O 2.96Å; S574-A661 VanDerWaalsContact CB-O 3.23Å; S574-A661 WeakPolarHBondContact CB-O 3.18Å; Y575-A661 HydrophobicContact CD1-CB 4.25Å; Y575-A661 HydrophobicContact CD2-CB 4.3Å; Y575-A661 HydrophobicContact CE1-CB 3.82Å; Y575-A661 HydrophobicContact CE2-CB 3.89Å; Y575-A661 HydrophobicContact CG-CB 4.47Å; Y575-A661 PolarHBondContact N-O 2.99Å; Y575-A661 PolarHBondContact O-N 3.45Å; F577-A661 HydrophobicContact CE1-CB 4.2Å; V644-A661 HydrophobicContact CG1-CB 3.99Å; Y646-A661 HydrophobicContact CD1-CB 3.69Å; Y646-A661 HydrophobicContact CE1-CB 3.6Å
662	S	83.6	Confident	68.5	Low	7 Å²	7	56.2 Å²	56.2	5%	0.049	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	129.2	174.7	-175.4	0	0	0	0	110.2	H121 L645 E664	H121-S662 VanDerWaalsContact CD2-CB 3.47Å; H121-S662 WeakPolarHBondContact CD2-CB 3.47Å; H121-S662 PolarHBondContact CD2-OG 3.32Å; H121-S662 PolarHBondContact NE2-OG 2.95Å; L645-S662 PolarHBondContact N-O 3.4Å; L645-S662 PolarHBondContact O-N 3.38Å; S662-E664 PolarHBondContact O-N 3.31Å
663	R	73.9	Confident	66.7	Low	99 Å²	99	53.7 Å²	53.7	37%	0.374	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	95.4	169.2	-65.3	174	-178.1	-94.8	-2.8	105.7	T573 T640 V644 K665	T573-R663 PolarHBondContact O-N 3.08Å; T640-R663 PolarHBondContact O-NH1 3.32Å; V644-R663 HydrophobicContact CG2-CG 4.18Å; R663-K665 PolarHBondContact O-N 3.07Å
664	E	56.1	Low	65.2	Low	115 Å²	115	51.4 Å²	51.4	54%	0.537	26%	0.256	S	S	.	.			trans	-58.4	102.8	-172.5	-166.6	173.6	-168	0	0	110.5	S662 L666	S662-E664 PolarHBondContact O-N 3.31Å; E664-L666 HydrophobicContact CG-CD1 4.33Å
665	K	49.5	Very low	63.3	Low	139 Å²	139	56.9 Å²	56.9	60%	0.604	29%	0.285	S	S	*	.			trans	-117.7	113.6	148.6	-77.4	-179	-177.3	152.9	0	105.3	R663 N863	R663-K665 PolarHBondContact O-N 3.07Å; K665-N863 PolarHBondContact NZ-O 2.82Å
666	L	38.4	Very low	61.8	Low	138 Å²	138	56.6 Å²	56.6	72%	0.723	28%	0.278	S	S	*	.	S	Bend	trans	-45.6	145.6	174.9	-90.1	87	0	0	0	110.6	E664	E664-L666 HydrophobicContact CG-CD1 4.33Å
667	S	38.5	Very low	59.7	Low	51 Å²	51	61.5 Å²	61.5	36%	0.357	31%	0.314	S	S	.	.			trans	61	97.9	173.1	49.4	0	0	0	0	114.8	E669	S667-E669 PolarHBondContact O-N 3.39Å
668	V	41.5	Very low	57.9	Low	56 Å²	56	63 Å²	63	34%	0.339	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	89.7	147.8	-173.8	0	0	0	0	105.4	D117 R670	D117-V668 PolarHBondContact N-O 3.1Å; D117-V668 VanDerWaalsContact N-O 3.15Å; V668-R670 VanDerWaalsContact C-N 3.31Å; V668-R670 HydrophobicContact CG1-CG 3.66Å; V668-R670 PolarHBondContact O-N 2.95Å
669	E	41.6	Very low	56.1	Low	76 Å²	76	69.9 Å²	69.9	36%	0.355	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	98.2	166.5	-84.9	-170.3	-164.9	0	0	105.7	Y114 Q115 V116 S667	Y114-E669 HydrophobicContact CD1-CB 4.16Å; Y114-E669 WeakPolarHBondContact CD1-O 3.2Å; Y114-E669 HydrophobicContact CG-CB 4.31Å; Q115-E669 CarbonylContact O-C 3.45Å; V116-E669 HydrophobicContact CG2-CG 3.93Å; S667-E669 PolarHBondContact O-N 3.39Å
670	R	46.7	Very low	54.6	Low	95 Å²	95	70.6 Å²	70.6	36%	0.358	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	118.5	173.5	-70.2	-172.9	176.6	156.6	2	107.2	Q115 D117 V668 N672	Q115-R670 PolarHBondContact N-O 3.02Å; Q115-R670 PolarHBondContact O-N 3.21Å; D117-R670 HydrophobicContact CB-CG 4.31Å; D117-R670 IonicContact OD2-CZ 3.63Å; D117-R670 IonicContact OD2-NE 3.7Å; D117-R670 IonicContact OD2-NH1 3.07Å; D117-R670 PolarHBondContact OD2-NH1 3.12Å; V668-R670 VanDerWaalsContact C-N 3.31Å; V668-R670 HydrophobicContact CG1-CG 3.66Å; V668-R670 PolarHBondContact O-N 2.95Å; R670-N672 PolarHBondContact O-N 3.34Å; R670-N672 VanDerWaalsContact O-N 3.17Å
671	A	43.1	Very low	53.2	Low	13 Å²	13	71.5 Å²	71.5	11%	0.107	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-45.4	127.2	173.6	0	0	0	0	0	110.7	M112 T113 Y114 R673	M112-A671 HydrophobicContact CB-CB 4.11Å; M112-A671 HydrophobicContact SD-CB 4.37Å; T113-A671 CarbonylContact O-C 3.54Å; T113-A671 VanDerWaalsContact O-C 3.27Å; T113-A671 WeakPolarHBondContact O-CA 3.28Å; T113-A671 WeakPolarHBondContact O-CB 3.38Å; Y114-A671 HydrophobicContact CD1-CB 3.73Å; Y114-A671 HydrophobicContact CE1-CB 3.7Å; Y114-A671 HydrophobicContact CG-CB 4.23Å; A671-R673 HydrophobicContact CB-CB 4.42Å; A671-R673 HydrophobicContact CB-CG 3.37Å; A671-R673 WeakPolarHBondContact O-CG 3.28Å; A671-R673 PolarHBondContact O-N 3.39Å
672	N	41	Very low	52.5	Low	81 Å²	81	81.3 Å²	81.3	43%	0.433	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	77.1	146.4	-106.4	-8.1	0	0	0	105.4	T113 Q115 R670	T113-N672 WeakPolarHBondContact O-CA 3.29Å; T113-N672 PolarHBondContact O-N 2.86Å; T113-N672 PolarHBondContact OG1-O 3.38Å; Q115-N672 VanDerWaalsContact CD-CG 3.46Å; Q115-N672 VanDerWaalsContact CD-ND2 3.29Å; Q115-N672 VanDerWaalsContact CD-OD1 3.27Å; Q115-N672 HydrophobicContact CG-CB 4.32Å; Q115-N672 PolarHBondContact NE2-ND2 2.74Å; Q115-N672 PolarHBondContact OE1-OD1 3.24Å; R670-N672 PolarHBondContact O-N 3.34Å; R670-N672 VanDerWaalsContact O-N 3.17Å
673	R	48.9	Very low	52.5	Low	68 Å²	68	82.9 Å²	82.9	26%	0.257	42%	0.417	S	S	.	.			trans	-66.2	132.2	-172.2	-76.8	-177.6	179.3	162.4	0.8	106.4	M112 A671 D675 F676	M112-R673 HydrophobicContact SD-CG 4.31Å; A671-R673 HydrophobicContact CB-CB 4.42Å; A671-R673 HydrophobicContact CB-CG 3.37Å; A671-R673 WeakPolarHBondContact O-CG 3.28Å; A671-R673 PolarHBondContact O-N 3.39Å; R673-D675 PolarHBondContact O-N 2.98Å; R673-F676 HydrophobicContact CB-CE2 4.31Å
674	P	46.4	Very low	53.3	Low	62 Å²	62	78.3 Å²	78.3	40%	0.403	40%	0.4	S	S	.	.			trans	-47.2	142.8	-171.2	-24.4	26.2	0	0	0	111.3	F676	P674-F676 HydrophobicContact CB-CD1 4.01Å; P674-F676 HydrophobicContact CB-CD2 4.4Å; P674-F676 HydrophobicContact CB-CE1 3.74Å; P674-F676 HydrophobicContact CB-CE2 4.14Å; P674-F676 HydrophobicContact CB-CG 4.34Å; P674-F676 HydrophobicContact CB-CZ 3.81Å; P674-F676 VanDerWaalsContact CD-CZ 3.47Å; P674-F676 HydrophobicContact CG-CD1 4.5Å; P674-F676 HydrophobicContact CG-CE1 3.73Å; P674-F676 HydrophobicContact CG-CE2 4.1Å; P674-F676 HydrophobicContact CG-CZ 3.5Å; P674-F676 WeakPolarHBondContact O-CD2 3.31Å; P674-F676 WeakPolarHBondContact O-CE2 3.49Å; P674-F676 VanDerWaalsContact O-CG 3.31Å; P674-F676 WeakPolarHBondContact O-CG 3.46Å; P674-F676 PolarHBondContact O-N 2.93Å
675	D	44.4	Very low	54.9	Low	129 Å²	129	73 Å²	73	69%	0.69	38%	0.376	S	S	*	.			trans	-64.9	91.9	169.1	-150.8	-4.5	0	0	0	107.6	R673 S677 R749	R673-D675 PolarHBondContact O-N 2.98Å; D675-S677 VanDerWaalsContact C-N 3.27Å; D675-S677 PolarHBondContact O-N 2.97Å; D675-R749 IonicContact OD1-CZ 2.68Å; D675-R749 IonicContact OD1-NH2 3.68Å; D675-R749 PolarHBondContact OD1-NH2 2.68Å
676	F	52.4	Low	56.9	Low	48 Å²	48	66.6 Å²	66.6	21%	0.211	35%	0.348	C	S	.	.			trans	-78.6	78.6	-168.4	-72.1	-69.3	0	0	0	109.7	R673 P674 G678	R673-F676 HydrophobicContact CB-CE2 4.31Å; P674-F676 HydrophobicContact CB-CD1 4.01Å; P674-F676 HydrophobicContact CB-CD2 4.4Å; P674-F676 HydrophobicContact CB-CE1 3.74Å; P674-F676 HydrophobicContact CB-CE2 4.14Å; P674-F676 HydrophobicContact CB-CG 4.34Å; P674-F676 HydrophobicContact CB-CZ 3.81Å; P674-F676 VanDerWaalsContact CD-CZ 3.47Å; P674-F676 HydrophobicContact CG-CD1 4.5Å; P674-F676 HydrophobicContact CG-CE1 3.73Å; P674-F676 HydrophobicContact CG-CE2 4.1Å; P674-F676 HydrophobicContact CG-CZ 3.5Å; P674-F676 WeakPolarHBondContact O-CD2 3.31Å; P674-F676 WeakPolarHBondContact O-CE2 3.49Å; P674-F676 VanDerWaalsContact O-CG 3.31Å; P674-F676 WeakPolarHBondContact O-CG 3.46Å; P674-F676 PolarHBondContact O-N 2.93Å; F676-G678 PolarHBondContact O-N 3.41Å; F676-G678 VanDerWaalsContact O-N 3.08Å
677	S	46.2	Very low	59.5	Low	114 Å²	114	60 Å²	60	80%	0.797	31%	0.313	S	S	*	.			trans	-65.4	-0.5	174.7	168.2	0	0	0	0	114.7	D675	D675-S677 VanDerWaalsContact C-N 3.27Å; D675-S677 PolarHBondContact O-N 2.97Å
678	G	54.9	Low	62	Low	30 Å²	30	58.9 Å²	58.9	31%	0.309	30%	0.301	S	S	.	.	S	Bend	trans	-93.4	145.1	-177.4	0	0	0	0	0	112.9	F676 I680 R768	F676-G678 PolarHBondContact O-N 3.41Å; F676-G678 VanDerWaalsContact O-N 3.08Å; G678-I680 PolarHBondContact O-N 3.19Å; G678-R768 PolarHBondContact O-NH1 2.93Å
679	M	58	Low	64.3	Low	146 Å²	146	56.3 Å²	56.3	72%	0.719	29%	0.285	S	S	*	.			trans	-56	105.4	174	-151.5	-179.7	-158.6	0	0	110.3	T681	M679-T681 PolarHBondContact O-N 3.17Å; M679-T681 VanDerWaalsContact O-N 3.07Å
680	I	61.2	Low	66.6	Low	15 Å²	15	53 Å²	53	8%	0.077	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-22.8	-174	-67.9	165.4	0	0	0	112.1	G678 L684 V744 I764	G678-I680 PolarHBondContact O-N 3.19Å; I680-L684 HydrophobicContact CG2-CD1 4.01Å; I680-L684 WeakPolarHBondContact O-CD1 3.33Å; I680-V744 VanDerWaalsContact CD1-O 3.31Å; I680-V744 WeakPolarHBondContact CD1-O 3.48Å; I680-V744 HydrophobicContact CG2-CG1 4.45Å; I680-I764 HydrophobicContact CG2-CG2 4.23Å
681	T	63.8	Low	68.5	Low	19 Å²	19	49.1 Å²	49.1	12%	0.117	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-11	-158.2	52.4	0	0	0	0	116.9	M679 N683 L684 R711 W741	M679-T681 PolarHBondContact O-N 3.17Å; M679-T681 VanDerWaalsContact O-N 3.07Å; T681-N683 PolarHBondContact O-N 3.28Å; T681-L684 PolarHBondContact O-N 3.09Å; T681-R711 PolarHBondContact O-NH1 3.07Å; T681-W741 HydrophobicContact CG2-CH2 3.63Å; T681-W741 HydrophobicContact CG2-CZ2 3.39Å; T681-W741 HydrophobicContact CG2-CZ3 4.43Å
682	R	71.7	Confident	70.4	Confident	206 Å²	206	49.8 Å²	49.8	78%	0.777	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-25.9	-164.8	-163.5	172.6	-178.3	168	0.6	114.2	R711	R682-R711 PolarHBondContact O-NH1 2.93Å
683	N	84.5	Confident	72	Confident	41 Å²	41	49.6 Å²	49.6	22%	0.219	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.1	3.1	176.8	-64.7	-26.6	0	0	0	114.2	T681 V712 S771 T772	T681-N683 PolarHBondContact O-N 3.28Å; N683-V712 PolarHBondContact O-N 3.35Å; N683-S771 WeakPolarHBondContact CB-OG 3.43Å; N683-T772 PolarHBondContact ND2-OG1 2.98Å
684	L	89.8	Confident	73.2	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	150.2	179.1	-65.8	179.3	0	0	0	110.2	I680 T681 V712 W741 I764 R768 L800	I680-L684 HydrophobicContact CG2-CD1 4.01Å; I680-L684 WeakPolarHBondContact O-CD1 3.33Å; T681-L684 PolarHBondContact O-N 3.09Å; L684-V712 CarbonylContact C-O 3.51Å; L684-V712 VanDerWaalsContact CA-O 3.3Å; L684-V712 WeakPolarHBondContact CA-O 3.49Å; L684-V712 HydrophobicContact CD2-CB 3.91Å; L684-V712 HydrophobicContact CD2-CG1 3.86Å; L684-W741 HydrophobicContact CB-CH2 3.81Å; L684-W741 HydrophobicContact CB-CZ3 4.31Å; L684-W741 WeakPolarHBondContact O-CH2 3.47Å; L684-I764 HydrophobicContact CD1-CG2 4.32Å; L684-R768 HydrophobicContact CD1-CB 4.29Å; L684-L800 HydrophobicContact CD2-CD1 4.4Å; L684-L800 HydrophobicContact CD2-CD2 4.08Å
685	A	90.4	Very high	74.3	Confident	3 Å²	3	55.6 Å²	55.6	3%	0.025	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	145.5	166.9	0	0	0	0	0	108.6	L689 F697 R711 V712 G713 L714	A685-L689 HydrophobicContact CB-CD2 4.02Å; A685-F697 HydrophobicContact CB-CE1 4.35Å; A685-R711 HydrophobicContact CB-CB 3.81Å; A685-R711 HydrophobicContact CB-CG 4.04Å; A685-V712 PolarHBondContact N-O 3.3Å; A685-G713 CarbonylContact O-C 3.54Å; A685-G713 WeakPolarHBondContact O-CA 3.23Å; A685-L714 PolarHBondContact O-N 2.97Å
686	Y	92.6	Very high	75.9	Confident	5 Å²	5	55.1 Å²	55.1	2%	0.02	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	144.2	171.7	-167.8	-107.8	0	0	0	110.2	R688 L692 E732 A737 F740	Y686-R688 HydrophobicContact CD1-CB 3.93Å; Y686-R688 HydrophobicContact CD1-CG 4.28Å; Y686-R688 HydrophobicContact CE1-CB 4.06Å; Y686-R688 HydrophobicContact CE1-CG 3.89Å; Y686-R688 PolarHBondContact O-N 3.36Å; Y686-R688 VanDerWaalsContact O-N 3.14Å; Y686-L692 HydrophobicContact CD1-CD1 4.18Å; Y686-L692 HydrophobicContact CG-CD1 4.27Å; Y686-E732 WeakPolarHBondContact CE1-OE1 3.09Å; Y686-E732 VanDerWaalsContact CZ-OE1 3.31Å; Y686-E732 PolarHBondContact OH-OE1 3.46Å; Y686-E732 PolarHBondContact OH-OE2 3.03Å; Y686-A737 HydrophobicContact CD1-CB 4.11Å; Y686-A737 HydrophobicContact CE1-CB 4Å; Y686-F740 HydrophobicContact CE2-CB 4.18Å
687	H	92	Very high	77.5	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.276	C	S	.	.	S	Bend	trans	-59.1	-27.1	-173	77	-65.8	0	0	0	115.3	L689 L714 Y715 E732 L806 T807	H687-L689 PolarHBondContact O-N 3.26Å; H687-L714 PolarHBondContact N-O 2.86Å; H687-Y715 HydrophobicContact CB-CD2 4.38Å; H687-Y715 AromaticContact CD2-CD2 3.61Å; H687-Y715 AromaticContact CE1-CD2 3.95Å; H687-Y715 AromaticContact CG-CD2 3.72Å; H687-Y715 AromaticContact ND1-CD2 3.94Å; H687-Y715 AromaticContact NE2-CD2 3.76Å; H687-Y715 AromaticContact NE2-CE2 3.98Å; H687-E732 IonicContact CE1-OE2 3.7Å; H687-L806 WeakPolarHBondContact O-CA 3.46Å; H687-L806 WeakPolarHBondContact O-CD1 3.44Å; H687-T807 PolarHBondContact CD2-O 3.37Å; H687-T807 VanDerWaalsContact CD2-O 3.27Å
688	R	92	Very high	79.4	Confident	28 Å²	28	54 Å²	54	11%	0.106	27%	0.267	C	S	.	.			trans	-77.3	66.7	175.1	-65.9	-59.7	-58.7	-84.4	3.5	112	Y686 D690 L691 L692 E732	Y686-R688 HydrophobicContact CD1-CB 3.93Å; Y686-R688 HydrophobicContact CD1-CG 4.28Å; Y686-R688 HydrophobicContact CE1-CB 4.06Å; Y686-R688 HydrophobicContact CE1-CG 3.89Å; Y686-R688 PolarHBondContact O-N 3.36Å; Y686-R688 VanDerWaalsContact O-N 3.14Å; R688-D690 VanDerWaalsContact CA-OD1 3.28Å; R688-D690 WeakPolarHBondContact CA-OD1 3.47Å; R688-D690 WeakPolarHBondContact CB-OD1 3.45Å; R688-D690 IonicContact CZ-OD1 3.89Å; R688-D690 IonicContact CZ-OD2 3.78Å; R688-D690 IonicContact NE-OD1 2.65Å; R688-D690 PolarHBondContact NE-OD1 3.46Å; R688-D690 IonicContact NE-OD2 3.9Å; R688-D690 PolarHBondContact NE-OD2 3.09Å; R688-D690 IonicContact NH2-OD1 3.82Å; R688-D690 IonicContact NH2-OD2 2.67Å; R688-D690 PolarHBondContact NH2-OD2 3.34Å; R688-D690 PolarHBondContact O-N 3.28Å; R688-L691 HydrophobicContact CB-CB 4.15Å; R688-L691 HydrophobicContact CB-CD1 4.05Å; R688-L691 HydrophobicContact CB-CG 4.2Å; R688-L691 HydrophobicContact CG-CD1 4.17Å; R688-L691 PolarHBondContact O-N 3.25Å; R688-L691 VanDerWaalsContact O-N 3.14Å; R688-L692 PolarHBondContact O-N 2.94Å; R688-E732 HydrophobicContact CG-CG 4.47Å; R688-E732 PolarHBondContact NH1-O 3.19Å
689	L	89.6	Confident	81	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-27.4	178.6	-60.2	178	0	0	0	112.7	A685 H687 F697 L699 L706 A804	A685-L689 HydrophobicContact CB-CD2 4.02Å; H687-L689 PolarHBondContact O-N 3.26Å; L689-F697 HydrophobicContact CD2-CE2 3.96Å; L689-F697 HydrophobicContact CD2-CZ 4.1Å; L689-L699 HydrophobicContact CB-CD2 3.96Å; L689-L699 HydrophobicContact CD1-CD2 4.45Å; L689-L706 HydrophobicContact CB-CD2 4.2Å; L689-L706 HydrophobicContact CB-CG 4.48Å; L689-A804 HydrophobicContact CD1-CB 4.37Å; L689-A804 HydrophobicContact CD2-CB 4.43Å
690	D	88.2	Confident	82.6	Confident	8 Å²	8	48 Å²	48	4%	0.043	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-37	175.5	58.5	-32.7	0	0	0	112.9	R688 L706 L806 P1068 D1069 F1072	R688-D690 VanDerWaalsContact CA-OD1 3.28Å; R688-D690 WeakPolarHBondContact CA-OD1 3.47Å; R688-D690 WeakPolarHBondContact CB-OD1 3.45Å; R688-D690 IonicContact CZ-OD1 3.89Å; R688-D690 IonicContact CZ-OD2 3.78Å; R688-D690 IonicContact NE-OD1 2.65Å; R688-D690 PolarHBondContact NE-OD1 3.46Å; R688-D690 IonicContact NE-OD2 3.9Å; R688-D690 PolarHBondContact NE-OD2 3.09Å; R688-D690 IonicContact NH2-OD1 3.82Å; R688-D690 IonicContact NH2-OD2 2.67Å; R688-D690 PolarHBondContact NH2-OD2 3.34Å; R688-D690 PolarHBondContact O-N 3.28Å; D690-L706 HydrophobicContact CB-CD2 3.96Å; D690-L806 WeakPolarHBondContact OD1-CD1 3.44Å; D690-P1068 HydrophobicContact CB-CB 4.23Å; D690-D1069 WeakPolarHBondContact OD2-CB 3.45Å; D690-D1069 PolarHBondContact OD2-N 3.29Å; D690-F1072 HydrophobicContact CB-CB 4.47Å; D690-F1072 HydrophobicContact CB-CD2 4.02Å; D690-F1072 HydrophobicContact CB-CG 4.34Å
691	L	87.3	Confident	83.9	Confident	13 Å²	13	49.3 Å²	49.3	7%	0.068	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-37.6	-179	-62.4	-179.2	0	0	0	113.5	R688 L693 E732 K734 A737 D1069	R688-L691 HydrophobicContact CB-CB 4.15Å; R688-L691 HydrophobicContact CB-CD1 4.05Å; R688-L691 HydrophobicContact CB-CG 4.2Å; R688-L691 HydrophobicContact CG-CD1 4.17Å; R688-L691 PolarHBondContact O-N 3.25Å; R688-L691 VanDerWaalsContact O-N 3.14Å; L691-L693 PolarHBondContact O-N 2.96Å; L691-E732 HydrophobicContact CD1-CG 4.49Å; L691-E732 VanDerWaalsContact CD1-O 3.3Å; L691-E732 WeakPolarHBondContact CD1-O 3.15Å; L691-K734 HydrophobicContact CB-CB 4.37Å; L691-K734 HydrophobicContact CD2-CB 4.44Å; L691-K734 WeakPolarHBondContact O-CE 3.35Å; L691-A737 HydrophobicContact CD1-CB 4.29Å; L691-D1069 HydrophobicContact CD2-CB 4.07Å
692	L	83.6	Confident	85	Confident	26 Å²	26	49 Å²	49	14%	0.136	23%	0.234	C	C	.	.	S	Bend	trans	-99	59.1	-178	-59.8	-169	0	0	0	111.4	Y686 R688 S694 F697 A737 Q738 W741	Y686-L692 HydrophobicContact CD1-CD1 4.18Å; Y686-L692 HydrophobicContact CG-CD1 4.27Å; R688-L692 PolarHBondContact O-N 2.94Å; L692-S694 PolarHBondContact O-N 3.26Å; L692-F697 WeakPolarHBondContact O-CZ 3.48Å; L692-A737 HydrophobicContact CD1-CB 4.25Å; L692-A737 HydrophobicContact CD2-CB 4.01Å; L692-A737 HydrophobicContact CG-CB 4.04Å; L692-Q738 HydrophobicContact CD2-CB 4.29Å; L692-Q738 HydrophobicContact CD2-CG 3.34Å; L692-W741 HydrophobicContact CD1-CB 3.89Å; L692-W741 HydrophobicContact CD1-CG 4.17Å
693	L	74.5	Confident	85.6	Confident	78 Å²	78	39.9 Å²	39.9	41%	0.408	21%	0.205	S	C	.	.			trans	-59.9	109.3	174	-57.9	174.6	0	0	0	109.5	L691 L699 F1072	L691-L693 PolarHBondContact O-N 2.96Å; L693-L699 HydrophobicContact CD2-CD1 3.71Å; L693-F1072 HydrophobicContact CD2-CD2 4.19Å; L693-F1072 HydrophobicContact CD2-CE2 3.81Å
694	S	73.2	Confident	85.5	Confident	41 Å²	41	42.8 Å²	42.8	29%	0.287	22%	0.216	S	C	.	.			trans	-116.7	145.1	171.8	-177.3	0	0	0	0	109.9	L692 D696	L692-S694 PolarHBondContact O-N 3.26Å; S694-D696 PolarHBondContact O-N 3.35Å; S694-D696 WeakPolarHBondContact OG-CB 3.26Å; S694-D696 PolarHBondContact OG-N 3.07Å; S694-D696 PolarHBondContact OG-OD2 3Å
695	K	70.7	Confident	85.3	Confident	215 Å²	215	43.7 Å²	43.7	94%	0.935	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-7.3	168.6	-65.4	-174.7	178.8	-179.1	0	112.4	F697	K695-F697 VanDerWaalsContact C-N 3.26Å; K695-F697 PolarHBondContact O-N 3.43Å
696	D	78.1	Confident	85.3	Confident	118 Å²	118	43.6 Å²	43.6	63%	0.631	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-8.1	-176.6	-56.1	-36.6	0	0	0	113.9	S694 R711	S694-D696 PolarHBondContact O-N 3.35Å; S694-D696 WeakPolarHBondContact OG-CB 3.26Å; S694-D696 PolarHBondContact OG-N 3.07Å; S694-D696 PolarHBondContact OG-OD2 3Å; D696-R711 PolarHBondContact O-NH2 3.2Å
697	F	84.4	Confident	85.2	Confident	24 Å²	24	43.3 Å²	43.3	11%	0.105	22%	0.218	C	C	.	.	S	Bend	trans	-148.2	150.5	177.4	56.1	-99.8	0	0	0	111.4	A685 L689 L692 K695 L699 D710 R711	A685-F697 HydrophobicContact CB-CE1 4.35Å; L689-F697 HydrophobicContact CD2-CE2 3.96Å; L689-F697 HydrophobicContact CD2-CZ 4.1Å; L692-F697 WeakPolarHBondContact O-CZ 3.48Å; K695-F697 VanDerWaalsContact C-N 3.26Å; K695-F697 PolarHBondContact O-N 3.43Å; F697-L699 HydrophobicContact CD2-CD2 4.18Å; F697-L699 HydrophobicContact CE2-CD2 3.79Å; F697-L699 HydrophobicContact CE2-CG 4.42Å; F697-D710 HydrophobicContact CB-CB 4.47Å; F697-R711 HydrophobicContact CB-CG 3.55Å; F697-R711 HydrophobicContact CD1-CG 4.13Å; F697-R711 HydrophobicContact CG-CG 3.96Å
698	N	87.4	Confident	85.3	Confident	114 Å²	114	43.3 Å²	43.3	61%	0.61	22%	0.218	S	C	*	.			trans	-89.1	136.5	177.9	-59.2	-60.3	0	0	0	110.6	S708 D710	N698-S708 VanDerWaalsContact O-CB 3.28Å; N698-S708 WeakPolarHBondContact O-CB 3.35Å; N698-S708 PolarHBondContact O-OG 3.25Å; N698-D710 WeakPolarHBondContact CB-OD2 3.34Å; N698-D710 PolarHBondContact N-OD2 3.07Å; N698-D710 PolarHBondContact ND2-OD2 3.47Å
699	L	89	Confident	85.2	Confident	33 Å²	33	44 Å²	44	17%	0.173	23%	0.227	C	C	.	.			trans	-89	139.2	172.8	-67.3	176.4	0	0	0	110.1	L689 L693 F697 L706 A707 F1072 V1080	L689-L699 HydrophobicContact CB-CD2 3.96Å; L689-L699 HydrophobicContact CD1-CD2 4.45Å; L693-L699 HydrophobicContact CD2-CD1 3.71Å; F697-L699 HydrophobicContact CD2-CD2 4.18Å; F697-L699 HydrophobicContact CE2-CD2 3.79Å; F697-L699 HydrophobicContact CE2-CG 4.42Å; L699-L706 HydrophobicContact CB-CD1 4.28Å; L699-L706 HydrophobicContact CD2-CD1 4.29Å; L699-L706 HydrophobicContact CD2-CG 4.44Å; L699-A707 WeakPolarHBondContact CA-O 3.48Å; L699-F1072 HydrophobicContact CD1-CE2 3.96Å; L699-F1072 HydrophobicContact CD1-CZ 4.15Å; L699-V1080 HydrophobicContact CB-CG1 4.46Å
700	C	90.3	Very high	85.1	Confident	17 Å²	17	46.6 Å²	46.6	12%	0.115	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	164.5	175.6	60.6	0	0	0	0	110.3	A707 V1080 R1081 C1083	C700-A707 PolarHBondContact N-O 2.83Å; C700-A707 CarbonylContact O-C 3.2Å; C700-A707 WeakPolarHBondContact O-CA 3.41Å; C700-A707 PolarHBondContact O-N 3.45Å; C700-V1080 VanDerWaalsContact CA-CG1 3.46Å; C700-R1081 CarbonylContact C-O 3.46Å; C700-R1081 WeakPolarHBondContact CA-O 3.06Å; C700-R1081 WeakPolarHBondContact CB-O 3.24Å; C700-C1083 HydrophobicContact CB-CB 3.81Å; C700-C1083 WeakPolarHBondContact CB-SG 3.23Å; C700-C1083 WeakPolarHBondContact SG-CA 3.22Å; C700-C1083 WeakPolarHBondContact SG-CB 3.37Å; C700-C1083 CovalentContact SG-SG 2.03Å; C700-C1083 PolarHBondContact SG-SG 3.23Å
701	F	88	Confident	85.3	Confident	43 Å²	43	48.2 Å²	48.2	19%	0.189	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	121	172.1	-76.7	-65.7	0	0	0	110.4	M705 L706 F1073 V1080 R1081 Q1082 C1083	F701-M705 CarbonylContact C-O 3.53Å; F701-M705 WeakPolarHBondContact CA-O 3.11Å; F701-L706 HydrophobicContact CE1-CB 4.45Å; F701-L706 HydrophobicContact CE1-CD1 4.45Å; F701-F1073 HydrophobicContact CZ-CE1 4.17Å; F701-F1073 HydrophobicContact CZ-CZ 4.38Å; F701-V1080 HydrophobicContact CD2-CB 3.91Å; F701-V1080 HydrophobicContact CD2-CG1 3.56Å; F701-V1080 HydrophobicContact CE2-CB 3.6Å; F701-V1080 HydrophobicContact CE2-CG1 3.67Å; F701-V1080 HydrophobicContact CG-CG1 4.13Å; F701-V1080 HydrophobicContact CZ-CB 4.33Å; F701-V1080 HydrophobicContact CZ-CG1 4.29Å; F701-R1081 PolarHBondContact N-O 3.05Å; F701-Q1082 CarbonylContact O-C 3.54Å; F701-Q1082 WeakPolarHBondContact O-CA 3.46Å; F701-Q1082 PolarHBondContact O-NE2 3.28Å; F701-Q1082 PolarHBondContact O-OE1 3.35Å; F701-Q1082 VanDerWaalsContact O-OE1 3.04Å; F701-C1083 PolarHBondContact O-N 3.09Å; F701-C1083 PolarHBondContact O-SG 3.21Å; F701-C1083 VanDerWaalsContact O-SG 3.35Å
702	H	87.6	Confident	85.6	Confident	12 Å²	12	47.7 Å²	47.7	6%	0.056	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	93.4	170.6	-178.5	77.5	0	0	0	108.3	K704 M705 A707 L788 R789 P803 F841	H702-K704 PolarHBondContact O-N 3.5Å; H702-M705 PolarHBondContact N-O 2.89Å; H702-M705 PolarHBondContact O-N 2.9Å; H702-M705 VanDerWaalsContact O-N 3.16Å; H702-A707 HydrophobicContact CB-CB 3.53Å; H702-L788 PolarHBondContact CE1-O 2.6Å; H702-L788 VanDerWaalsContact CE1-O 3.23Å; H702-L788 WeakPolarHBondContact NE2-CD1 3.39Å; H702-L788 PolarHBondContact NE2-O 3.37Å; H702-R789 PolarHBondContact NE2-NE 2.84Å; H702-P803 HydrophobicContact CB-CG 4.48Å; H702-F841 AromaticContact CD2-CE2 3.73Å; H702-F841 AromaticContact CE1-CZ 3.99Å; H702-F841 AromaticContact NE2-CE2 3.66Å; H702-F841 AromaticContact NE2-CZ 3.95Å
703	G	84.5	Confident	86.1	Confident	16 Å²	16	46.5 Å²	46.5	17%	0.165	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	-121.3	-164.5	0	0	0	0	0	108.8	S839 Q1082	G703-S839 CarbonylContact C-O 3.58Å; G703-S839 WeakPolarHBondContact CA-O 3.38Å; G703-Q1082 PolarHBondContact O-OE1 3.24Å
704	K	82.2	Confident	87	Confident	102 Å²	102	42.8 Å²	42.8	44%	0.443	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-2	173.2	-62.6	175.9	-178.3	178.4	0	113.7	H702 S839 L1065	H702-K704 PolarHBondContact O-N 3.5Å; K704-S839 WeakPolarHBondContact CG-O 3.32Å; K704-S839 PolarHBondContact N-O 3.3Å; K704-L1065 HydrophobicContact CB-CD2 4.36Å
705	M	86	Confident	88.1	Confident	20 Å²	20	40.8 Å²	40.8	10%	0.099	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	136.4	-178.2	-71	179	177.3	0	0	111.5	F701 H702 A707 V805 P838 S839 L1065	F701-M705 CarbonylContact C-O 3.53Å; F701-M705 WeakPolarHBondContact CA-O 3.11Å; H702-M705 PolarHBondContact N-O 2.89Å; H702-M705 PolarHBondContact O-N 2.9Å; H702-M705 VanDerWaalsContact O-N 3.16Å; M705-A707 PolarHBondContact O-N 2.04Å; M705-V805 HydrophobicContact SD-CB 4.48Å; M705-P838 HydrophobicContact CE-CG 4.19Å; M705-S839 WeakPolarHBondContact CE-OG 3.13Å; M705-S839 PolarHBondContact SD-OG 2.92Å; M705-L1065 HydrophobicContact CE-CD1 3.45Å; M705-L1065 VanDerWaalsContact CE-CD1 3.45Å; M705-L1065 HydrophobicContact CG-CD1 3.43Å; M705-L1065 VanDerWaalsContact CG-CD1 3.43Å; M705-L1065 HydrophobicContact SD-CD1 4.29Å
706	L	89.4	Confident	89.2	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	129.1	167.2	-176.5	66.6	0	0	0	109.5	L689 D690 L699 F701 L806 P1068 F1072 V1080	L689-L706 HydrophobicContact CB-CD2 4.2Å; L689-L706 HydrophobicContact CB-CG 4.48Å; D690-L706 HydrophobicContact CB-CD2 3.96Å; L699-L706 HydrophobicContact CB-CD1 4.28Å; L699-L706 HydrophobicContact CD2-CD1 4.29Å; L699-L706 HydrophobicContact CD2-CG 4.44Å; F701-L706 HydrophobicContact CE1-CB 4.45Å; F701-L706 HydrophobicContact CE1-CD1 4.45Å; L706-L806 PolarHBondContact O-N 3.38Å; L706-P1068 HydrophobicContact CB-CG 4.37Å; L706-F1072 HydrophobicContact CD1-CE1 4.21Å; L706-F1072 HydrophobicContact CD1-CZ 3.78Å; L706-F1072 HydrophobicContact CD2-CD2 4.42Å; L706-F1072 HydrophobicContact CD2-CE1 4.13Å; L706-F1072 HydrophobicContact CD2-CE2 3.85Å; L706-F1072 HydrophobicContact CD2-CZ 3.69Å; L706-F1072 HydrophobicContact CG-CZ 4.41Å; L706-V1080 HydrophobicContact CD1-CG1 4.13Å
707	A	92.2	Very high	89.9	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	170.4	-170.6	0	0	0	0	0	113.2	L699 C700 H702 M705 A804 V805	L699-A707 WeakPolarHBondContact CA-O 3.48Å; C700-A707 PolarHBondContact N-O 2.83Å; C700-A707 CarbonylContact O-C 3.2Å; C700-A707 WeakPolarHBondContact O-CA 3.41Å; C700-A707 PolarHBondContact O-N 3.45Å; H702-A707 HydrophobicContact CB-CB 3.53Å; M705-A707 PolarHBondContact O-N 2.04Å; A707-A804 CarbonylContact C-O 3.49Å; A707-A804 WeakPolarHBondContact CA-O 3.43Å; A707-A804 VanDerWaalsContact CB-O 3.3Å; A707-A804 WeakPolarHBondContact CB-O 3.42Å; A707-V805 HydrophobicContact CB-CG1 3.96Å
708	S	92.3	Very high	90.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	119.4	167.3	-174.4	0	0	0	0	110.5	N698 D710 P803 A804	N698-S708 VanDerWaalsContact O-CB 3.28Å; N698-S708 WeakPolarHBondContact O-CB 3.35Å; N698-S708 PolarHBondContact O-OG 3.25Å; S708-D710 VanDerWaalsContact C-N 3.26Å; S708-D710 PolarHBondContact O-N 2.96Å; S708-P803 WeakPolarHBondContact O-CB 3.46Å; S708-A804 PolarHBondContact N-O 2.98Å; S708-A804 PolarHBondContact O-N 3.18Å
709	C	90.1	Very high	90.2	Very high	43 Å²	43	19.1 Å²	19.1	29%	0.291	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-8.8	177	-70.6	0	0	0	0	113.8	F802 C1083	C709-F802 WeakPolarHBondContact O-CE2 3.5Å; C709-F802 WeakPolarHBondContact O-CZ 3.36Å; C709-C1083 VanDerWaalsContact SG-CB 3.53Å
710	D	89	Confident	90.2	Very high	54 Å²	54	17.6 Å²	17.6	29%	0.289	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-13.9	180	-63.8	-37.4	0	0	0	112.8	F697 N698 S708 K775	F697-D710 HydrophobicContact CB-CB 4.47Å; N698-D710 WeakPolarHBondContact CB-OD2 3.34Å; N698-D710 PolarHBondContact N-OD2 3.07Å; N698-D710 PolarHBondContact ND2-OD2 3.47Å; S708-D710 VanDerWaalsContact C-N 3.26Å; S708-D710 PolarHBondContact O-N 2.96Å; D710-K775 PolarHBondContact O-NZ 2.83Å
711	R	91.3	Very high	90.3	Very high	43 Å²	43	17.2 Å²	17.2	16%	0.162	9%	0.086	C	C	.	.	S	Bend	trans	-132.4	157	-166.5	-60.3	-66.5	176.3	160.1	-9.9	112.2	T681 R682 A685 D696 F697 F802 A804	T681-R711 PolarHBondContact O-NH1 3.07Å; R682-R711 PolarHBondContact O-NH1 2.93Å; A685-R711 HydrophobicContact CB-CB 3.81Å; A685-R711 HydrophobicContact CB-CG 4.04Å; D696-R711 PolarHBondContact O-NH2 3.2Å; F697-R711 HydrophobicContact CB-CG 3.55Å; F697-R711 HydrophobicContact CD1-CG 4.13Å; F697-R711 HydrophobicContact CG-CG 3.96Å; R711-F802 WeakPolarHBondContact O-CD2 3.38Å; R711-A804 HydrophobicContact CB-CB 4.05Å; R711-A804 WeakPolarHBondContact O-CB 3.41Å; R711-A804 PolarHBondContact O-N 3.2Å
712	V	94	Very high	90.2	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.012	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	127.4	164.7	172.5	0	0	0	0	108.9	N683 L684 A685 W774 L800 T801 F802	N683-V712 PolarHBondContact O-N 3.35Å; L684-V712 CarbonylContact C-O 3.51Å; L684-V712 VanDerWaalsContact CA-O 3.3Å; L684-V712 WeakPolarHBondContact CA-O 3.49Å; L684-V712 HydrophobicContact CD2-CB 3.91Å; L684-V712 HydrophobicContact CD2-CG1 3.86Å; A685-V712 PolarHBondContact N-O 3.3Å; V712-W774 HydrophobicContact CG1-CE3 4.41Å; V712-W774 HydrophobicContact CG1-CZ3 4.34Å; V712-W774 HydrophobicContact CG2-CE3 4.34Å; V712-L800 HydrophobicContact CG1-CB 3.81Å; V712-L800 HydrophobicContact CG1-CD1 4.4Å; V712-L800 HydrophobicContact CG1-CD2 4.44Å; V712-L800 HydrophobicContact CG1-CG 4.46Å; V712-T801 CarbonylContact C-O 3.5Å; V712-T801 VanDerWaalsContact CA-O 3.3Å; V712-T801 WeakPolarHBondContact CA-O 3.18Å; V712-T801 WeakPolarHBondContact CG1-O 3.49Å; V712-F802 HydrophobicContact CG2-CB 4.14Å; V712-F802 HydrophobicContact CG2-CD2 3.74Å; V712-F802 HydrophobicContact CG2-CG 4.35Å
713	G	93.8	Very high	90.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	133.9	179.1	0	0	0	0	0	111.1	A685 L800 T801 A804	A685-G713 CarbonylContact O-C 3.54Å; A685-G713 WeakPolarHBondContact O-CA 3.23Å; G713-L800 CarbonylContact O-C 3.58Å; G713-L800 WeakPolarHBondContact O-CA 3.04Å; G713-T801 PolarHBondContact N-O 2.87Å; G713-T801 PolarHBondContact O-N 3.37Å; G713-A804 VanDerWaalsContact N-CB 3.29Å
714	L	94.5	Very high	90.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	117.5	168.6	171.4	64.2	0	0	0	108.9	A685 H687 L716 W741 V744 I764 V798 L800	A685-L714 PolarHBondContact O-N 2.97Å; H687-L714 PolarHBondContact N-O 2.86Å; L714-L716 HydrophobicContact CD1-CD2 4.13Å; L714-W741 HydrophobicContact CD2-CZ3 4.49Å; L714-V744 HydrophobicContact CD2-CG1 3.84Å; L714-V744 HydrophobicContact CD2-CG2 4.48Å; L714-I764 HydrophobicContact CD1-CD1 4.26Å; L714-I764 HydrophobicContact CD1-CG1 3.97Å; L714-I764 HydrophobicContact CD1-CG2 4.43Å; L714-I764 HydrophobicContact CD2-CD1 3.99Å; L714-I764 HydrophobicContact CD2-CG1 4.37Å; L714-I764 HydrophobicContact CD2-CG2 4.13Å; L714-V798 HydrophobicContact CD1-CG1 4Å; L714-L800 HydrophobicContact CB-CD2 4.05Å; L714-L800 HydrophobicContact CD1-CD2 3.66Å; L714-L800 HydrophobicContact CG-CD2 4.45Å
715	Y	94.8	Very high	90.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	141.6	172.6	174	-107.3	0	0	0	110.4	H687 A717 M799 T807 H808 Q809 Y811	H687-Y715 HydrophobicContact CB-CD2 4.38Å; H687-Y715 AromaticContact CD2-CD2 3.61Å; H687-Y715 AromaticContact CE1-CD2 3.95Å; H687-Y715 AromaticContact CG-CD2 3.72Å; H687-Y715 AromaticContact ND1-CD2 3.94Å; H687-Y715 AromaticContact NE2-CD2 3.76Å; H687-Y715 AromaticContact NE2-CE2 3.98Å; Y715-A717 HydrophobicContact CE1-CB 3.93Å; Y715-M799 HydrophobicContact CD1-CB 4.11Å; Y715-M799 HydrophobicContact CD1-SD 4.19Å; Y715-M799 PolarHBondContact N-O 3.36Å; Y715-M799 PolarHBondContact O-N 2.8Å; Y715-T807 HydrophobicContact CD1-CG2 3.94Å; Y715-T807 HydrophobicContact CD2-CG2 3.8Å; Y715-T807 HydrophobicContact CE1-CG2 4.09Å; Y715-T807 HydrophobicContact CE2-CG2 3.95Å; Y715-T807 HydrophobicContact CG-CG2 3.78Å; Y715-H808 PolarHBondContact OH-O 3.49Å; Y715-Q809 PolarHBondContact OH-O 3.07Å; Y715-Q809 VanDerWaalsContact OH-O 3.13Å; Y715-Y811 HydrophobicContact CD1-CD1 4.4Å; Y715-Y811 AromaticContact CE1-CD1 3.95Å; Y715-Y811 HydrophobicContact CE1-CD1 3.95Å; Y715-Y811 WeakPolarHBondContact CE1-O 3.4Å; Y715-Y811 VanDerWaalsContact CZ-O 3.31Å; Y715-Y811 PolarHBondContact OH-N 3.19Å; Y715-Y811 PolarHBondContact OH-O 2.66Å
716	L	93.9	Very high	90.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	108.9	178.4	-61.5	177.8	0	0	0	108.1	L714 C720 F721 L756 I760 I764 V798	L714-L716 HydrophobicContact CD1-CD2 4.13Å; L716-C720 HydrophobicContact CB-CB 4.24Å; L716-F721 HydrophobicContact CB-CE2 3.98Å; L716-F721 HydrophobicContact CB-CZ 3.91Å; L716-F721 HydrophobicContact CD1-CZ 4.45Å; L716-L756 HydrophobicContact CD1-CD1 4.18Å; L716-L756 HydrophobicContact CD1-CD2 3.81Å; L716-I760 HydrophobicContact CD2-CG2 3.94Å; L716-I764 HydrophobicContact CD2-CD1 4.19Å; L716-V798 HydrophobicContact CD2-CG1 4.43Å; L716-V798 HydrophobicContact CD2-CG2 4.11Å
717	A	92.4	Very high	89.9	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.116	C	C	.	.			trans	-66.4	159.3	177.1	0	0	0	0	0	111.3	Y715 R719 C720 F721 G797	Y715-A717 HydrophobicContact CE1-CB 3.93Å; A717-R719 HydrophobicContact CB-CG 3.87Å; A717-R719 PolarHBondContact O-N 3.35Å; A717-C720 WeakPolarHBondContact O-CB 3.17Å; A717-C720 PolarHBondContact O-N 2.79Å; A717-F721 WeakPolarHBondContact O-CD2 3.32Å; A717-F721 WeakPolarHBondContact O-CE2 3.22Å; A717-G797 WeakPolarHBondContact CB-O 3.5Å; A717-G797 PolarHBondContact N-O 2.73Å
718	P	89.7	Confident	89.3	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.006	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-50.4	-32.7	179.9	-30.4	36.4	0	0	0	114.8	C720 F721 P724 R727 F728	P718-C720 PolarHBondContact O-N 2.87Å; P718-F721 WeakPolarHBondContact O-CD2 3.44Å; P718-F721 PolarHBondContact O-N 3.14Å; P718-F721 VanDerWaalsContact O-N 3.17Å; P718-P724 HydrophobicContact CB-CB 4.15Å; P718-P724 WeakPolarHBondContact O-CB 3.06Å; P718-R727 HydrophobicContact CB-CB 4.31Å; P718-R727 HydrophobicContact CG-CB 4.23Å; P718-F728 HydrophobicContact CB-CE2 3.74Å; P718-F728 HydrophobicContact CB-CZ 4.06Å; P718-F728 HydrophobicContact CG-CE1 4.5Å; P718-F728 HydrophobicContact CG-CE2 3.87Å; P718-F728 HydrophobicContact CG-CZ 3.75Å
719	R	88.2	Confident	88.4	Confident	15 Å²	15	27.8 Å²	27.8	6%	0.057	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-62.1	-19.2	175.8	54.8	171.9	69.3	-142.5	-6.4	115.7	Y566 A717 F721 K757 P795 S796 G797 D812	Y566-R719 HydrophobicContact CD1-CB 3.38Å; Y566-R719 HydrophobicContact CE1-CB 3.77Å; Y566-R719 HydrophobicContact CG-CB 4.22Å; A717-R719 HydrophobicContact CB-CG 3.87Å; A717-R719 PolarHBondContact O-N 3.35Å; R719-F721 PolarHBondContact O-N 2.77Å; R719-K757 WeakPolarHBondContact O-CD 3.07Å; R719-K757 WeakPolarHBondContact O-CE 3.39Å; R719-K757 PolarHBondContact O-NZ 3.07Å; R719-P795 PolarHBondContact NH1-O 2.98Å; R719-S796 VanDerWaalsContact CD-C 3.45Å; R719-S796 WeakPolarHBondContact CD-O 3.18Å; R719-S796 WeakPolarHBondContact CG-O 3.38Å; R719-G797 VanDerWaalsContact CD-CA 3.43Å; R719-D812 IonicContact CZ-OD1 3.37Å; R719-D812 IonicContact CZ-OD2 3.91Å; R719-D812 VanDerWaalsContact CZ-OD2 3.3Å; R719-D812 IonicContact NE-OD1 3.92Å; R719-D812 PolarHBondContact NE-OD1 3.17Å; R719-D812 VanDerWaalsContact NE-OD1 3.11Å; R719-D812 IonicContact NE-OD2 3.33Å; R719-D812 PolarHBondContact NE-OD2 2.91Å; R719-D812 IonicContact NH2-OD1 3.72Å; R719-D812 IonicContact NH2-OD2 2.73Å; R719-D812 PolarHBondContact NH2-OD2 3.48Å
720	C	91	Very high	87.8	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-75.2	-13.2	176.6	-60.5	0	0	0	0	113	L716 A717 P718 K757 I760 S796 G797	L716-C720 HydrophobicContact CB-CB 4.24Å; A717-C720 WeakPolarHBondContact O-CB 3.17Å; A717-C720 PolarHBondContact O-N 2.79Å; P718-C720 PolarHBondContact O-N 2.87Å; C720-K757 PolarHBondContact O-N 2.95Å; C720-I760 HydrophobicContact CB-CD1 3.86Å; C720-I760 HydrophobicContact CB-CG1 4.11Å; C720-I760 HydrophobicContact CB-CG2 4.42Å; C720-S796 PolarHBondContact SG-O 3.36Å; C720-G797 PolarHBondContact SG-O 3.16Å
721	F	90.8	Very high	87.4	Confident	9 Å²	9	30.8 Å²	30.8	4%	0.039	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-100.6	152.5	-173.7	-59.6	-89.1	0	0	0	111.5	L716 A717 P718 R719 N723 R727 F740 G755 L756	L716-F721 HydrophobicContact CB-CE2 3.98Å; L716-F721 HydrophobicContact CB-CZ 3.91Å; L716-F721 HydrophobicContact CD1-CZ 4.45Å; A717-F721 WeakPolarHBondContact O-CD2 3.32Å; A717-F721 WeakPolarHBondContact O-CE2 3.22Å; P718-F721 WeakPolarHBondContact O-CD2 3.44Å; P718-F721 PolarHBondContact O-N 3.14Å; P718-F721 VanDerWaalsContact O-N 3.17Å; R719-F721 PolarHBondContact O-N 2.77Å; F721-N723 VanDerWaalsContact C-N 3.33Å; F721-R727 HydrophobicContact CD2-CG 3.79Å; F721-R727 HydrophobicContact CE2-CG 3.95Å; F721-R727 HydrophobicContact CG-CG 4.2Å; F721-F740 HydrophobicContact CD1-CE1 4.21Å; F721-F740 HydrophobicContact CD1-CZ 4.13Å; F721-F740 HydrophobicContact CE1-CD1 4.2Å; F721-F740 AromaticContact CE1-CE1 3.5Å; F721-F740 HydrophobicContact CE1-CE1 3.5Å; F721-F740 AromaticContact CE1-CE2 3.95Å; F721-F740 HydrophobicContact CE1-CE2 3.95Å; F721-F740 AromaticContact CE1-CZ 3.36Å; F721-F740 HydrophobicContact CE1-CZ 3.36Å; F721-F740 HydrophobicContact CZ-CE2 4.37Å; F721-F740 HydrophobicContact CZ-CZ 4.21Å; F721-G755 WeakPolarHBondContact CA-O 3.35Å; F721-L756 HydrophobicContact CD1-CD2 3.61Å; F721-L756 HydrophobicContact CE1-CD2 3.36Å; F721-L756 HydrophobicContact CE1-CG 4.48Å; F721-L756 HydrophobicContact CG-CD2 4.32Å; F721-L756 HydrophobicContact CZ-CD2 3.94Å
722	Q	86.4	Confident	87.1	Confident	125 Å²	125	29.1 Å²	29.1	58%	0.584	16%	0.158	S	C	*	.	S	Bend	trans	-68.9	-33.6	173.9	-66	179	2.1	0	0	111.9	P724 G755 L756	Q722-P724 WeakPolarHBondContact O-CD 3.08Å; Q722-G755 PolarHBondContact N-O 3.09Å; Q722-L756 PolarHBondContact NE2-O 2.85Å
723	N	85.6	Confident	86.8	Confident	48 Å²	48	31.6 Å²	31.6	26%	0.257	18%	0.176	S	C	.	.	S	Bend	trans	-119.6	89.9	171	-172.6	-23.1	0	0	0	109.7	F721 M725 K726	F721-N723 VanDerWaalsContact C-N 3.33Å; N723-M725 VanDerWaalsContact C-N 3.29Å; N723-M725 PolarHBondContact O-N 3.25Å; N723-M725 PolarHBondContact OD1-N 2.04Å; N723-K726 HydrophobicContact CB-CD 4.33Å; N723-K726 HydrophobicContact CB-CG 4.41Å
724	P	86.6	Confident	86.6	Confident	4 Å²	4	37 Å²	37	3%	0.026	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-31.7	-179	-27	37.8	0	0	0	114	Y566 P718 Q722 K726 R727	Y566-P724 HydrophobicContact CD2-CB 3.42Å; Y566-P724 VanDerWaalsContact CD2-CB 3.42Å; Y566-P724 HydrophobicContact CD2-CG 3.42Å; Y566-P724 VanDerWaalsContact CD2-CG 3.42Å; Y566-P724 HydrophobicContact CE2-CB 3.34Å; Y566-P724 HydrophobicContact CE2-CG 3.93Å; Y566-P724 HydrophobicContact CG-CB 4.28Å; Y566-P724 HydrophobicContact CG-CG 3.98Å; P718-P724 HydrophobicContact CB-CB 4.15Å; P718-P724 WeakPolarHBondContact O-CB 3.06Å; Q722-P724 WeakPolarHBondContact O-CD 3.08Å; P724-K726 VanDerWaalsContact C-N 3.31Å; P724-K726 PolarHBondContact O-N 2.92Å; P724-R727 WeakPolarHBondContact O-CB 3.4Å; P724-R727 PolarHBondContact O-N 3.32Å
725	M	84.5	Confident	86.3	Confident	9 Å²	9	47.2 Å²	47.2	4%	0.044	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-31.2	-174.8	-71.9	-51.8	-68.2	0	0	113.6	A558 E559 A562 L594 P595 N723 R727 F728 T729	A558-M725 HydrophobicContact CB-CE 3.55Å; A558-M725 HydrophobicContact CB-SD 4.18Å; E559-M725 HydrophobicContact CB-CG 4.25Å; A562-M725 HydrophobicContact CB-CG 3.74Å; A562-M725 HydrophobicContact CB-SD 4.28Å; L594-M725 HydrophobicContact CB-SD 4.45Å; L594-M725 HydrophobicContact CD1-SD 4.34Å; L594-M725 HydrophobicContact CD2-SD 4.26Å; P595-M725 HydrophobicContact CB-CE 3.92Å; N723-M725 VanDerWaalsContact C-N 3.29Å; N723-M725 PolarHBondContact O-N 3.25Å; N723-M725 PolarHBondContact OD1-N 2.04Å; M725-R727 PolarHBondContact O-N 2.99Å; M725-F728 PolarHBondContact O-N 2.95Å; M725-F728 HydrophobicContact SD-CD2 4.04Å; M725-F728 HydrophobicContact SD-CE2 4.5Å; M725-T729 PolarHBondContact O-N 3.42Å; M725-T729 PolarHBondContact O-OG1 3.43Å
726	K	82	Confident	86	Confident	140 Å²	140	50 Å²	50	61%	0.609	26%	0.255	S	S	*	.	H	α-helix	trans	-57.6	-22.4	173.2	-71.3	-174.1	176.1	-174.4	0	113.3	N723 P724 A730	N723-K726 HydrophobicContact CB-CD 4.33Å; N723-K726 HydrophobicContact CB-CG 4.41Å; P724-K726 VanDerWaalsContact C-N 3.31Å; P724-K726 PolarHBondContact O-N 2.92Å; K726-A730 WeakPolarHBondContact O-CB 3.41Å; K726-A730 PolarHBondContact O-N 2.99Å
727	R	84.9	Confident	85.8	Confident	14 Å²	14	50 Å²	50	5%	0.053	26%	0.255	C	S	.	.	H	α-helix	trans	-80.7	-17	175.5	-60.7	-68.7	-73.3	164.5	-9.2	113	P718 F721 P724 M725 E732 Q809	P718-R727 HydrophobicContact CB-CB 4.31Å; P718-R727 HydrophobicContact CG-CB 4.23Å; F721-R727 HydrophobicContact CD2-CG 3.79Å; F721-R727 HydrophobicContact CE2-CG 3.95Å; F721-R727 HydrophobicContact CG-CG 4.2Å; P724-R727 WeakPolarHBondContact O-CB 3.4Å; P724-R727 PolarHBondContact O-N 3.32Å; M725-R727 PolarHBondContact O-N 2.99Å; R727-E732 IonicContact CZ-OE2 3.11Å; R727-E732 VanDerWaalsContact CZ-OE2 3.25Å; R727-E732 VanDerWaalsContact NH1-CD 3.34Å; R727-E732 IonicContact NH1-OE2 3.56Å; R727-E732 PolarHBondContact NH1-OE2 3.44Å; R727-E732 IonicContact NH2-OE2 3.72Å; R727-E732 PolarHBondContact NH2-OE2 2.75Å; R727-Q809 VanDerWaalsContact O-CD 3.23Å; R727-Q809 VanDerWaalsContact O-CG 3.31Å; R727-Q809 WeakPolarHBondContact O-CG 3.37Å; R727-Q809 PolarHBondContact O-NE2 3.36Å
728	F	79.5	Confident	85.7	Confident	30 Å²	30	54.7 Å²	54.7	13%	0.132	28%	0.277	C	S	.	.	H	α-helix	trans	-91.1	-33.1	176.7	-67.6	-82.9	0	0	0	112.1	Y566 P595 P718 M725 Q810	Y566-F728 WeakPolarHBondContact OH-CE2 3.38Å; Y566-F728 WeakPolarHBondContact OH-CZ 3.17Å; P595-F728 HydrophobicContact CB-CB 4.33Å; P595-F728 HydrophobicContact CB-CD1 4.32Å; P595-F728 HydrophobicContact CB-CG 4.25Å; P595-F728 HydrophobicContact CG-CD1 4.01Å; P595-F728 HydrophobicContact CG-CG 4.4Å; P718-F728 HydrophobicContact CB-CE2 3.74Å; P718-F728 HydrophobicContact CB-CZ 4.06Å; P718-F728 HydrophobicContact CG-CE1 4.5Å; P718-F728 HydrophobicContact CG-CE2 3.87Å; P718-F728 HydrophobicContact CG-CZ 3.75Å; M725-F728 PolarHBondContact O-N 2.95Å; M725-F728 HydrophobicContact SD-CD2 4.04Å; M725-F728 HydrophobicContact SD-CE2 4.5Å; F728-Q810 HydrophobicContact CD1-CB 4.25Å; F728-Q810 HydrophobicContact CD1-CG 3.65Å; F728-Q810 HydrophobicContact CE1-CB 3.91Å; F728-Q810 HydrophobicContact CE1-CG 3.85Å
729	T	74.3	Confident	85.7	Confident	46 Å²	46	56.1 Å²	56.1	28%	0.282	29%	0.292	S	S	.	.	H	α-helix	trans	-90.8	-37.1	-174.3	54.9	0	0	0	0	113.8	P182 M725	P182-T729 WeakPolarHBondContact CB-O 3.15Å; M725-T729 PolarHBondContact O-N 3.42Å; M725-T729 PolarHBondContact O-OG1 3.43Å
730	A	77.3	Confident	85.7	Confident	54 Å²	54	56 Å²	56	45%	0.446	29%	0.291	S	S	.	.	S	Bend	trans	-102.8	124.9	-177.8	0	0	0	0	0	111.2	K726 Q809	K726-A730 WeakPolarHBondContact O-CB 3.41Å; K726-A730 PolarHBondContact O-N 2.99Å; A730-Q809 PolarHBondContact O-NE2 3.47Å
731	S	79.5	Confident	85.6	Confident	107 Å²	107	58.7 Å²	58.7	75%	0.748	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-63.2	137.1	167.8	58	0	0	0	0	109.8	S733	S731-S733 PolarHBondContact O-N 3.32Å
732	E	85.4	Confident	85.4	Confident	7 Å²	7	59.8 Å²	59.8	3%	0.033	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-69.3	120.7	179.5	176.9	166.3	-174.4	0	0	111.1	Y686 H687 R688 L691 R727 T736 A737 Q809	Y686-E732 WeakPolarHBondContact CE1-OE1 3.09Å; Y686-E732 VanDerWaalsContact CZ-OE1 3.31Å; Y686-E732 PolarHBondContact OH-OE1 3.46Å; Y686-E732 PolarHBondContact OH-OE2 3.03Å; H687-E732 IonicContact CE1-OE2 3.7Å; R688-E732 HydrophobicContact CG-CG 4.47Å; R688-E732 PolarHBondContact NH1-O 3.19Å; L691-E732 HydrophobicContact CD1-CG 4.49Å; L691-E732 VanDerWaalsContact CD1-O 3.3Å; L691-E732 WeakPolarHBondContact CD1-O 3.15Å; R727-E732 IonicContact CZ-OE2 3.11Å; R727-E732 VanDerWaalsContact CZ-OE2 3.25Å; R727-E732 VanDerWaalsContact NH1-CD 3.34Å; R727-E732 IonicContact NH1-OE2 3.56Å; R727-E732 PolarHBondContact NH1-OE2 3.44Å; R727-E732 IonicContact NH2-OE2 3.72Å; R727-E732 PolarHBondContact NH2-OE2 2.75Å; E732-T736 HydrophobicContact CG-CG2 4.27Å; E732-A737 HydrophobicContact CG-CB 4.35Å; E732-A737 VanDerWaalsContact OE1-CA 3.29Å; E732-A737 WeakPolarHBondContact OE1-CA 3.08Å; E732-A737 WeakPolarHBondContact OE1-CB 3.45Å; E732-Q809 VanDerWaalsContact N-OE1 3.15Å
733	S	87.8	Confident	85.5	Confident	54 Å²	54	54.8 Å²	54.8	38%	0.378	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-86.2	161.7	177.2	80.9	0	0	0	0	112.5	S731 R735 T736 A737	S731-S733 PolarHBondContact O-N 3.32Å; S733-R735 VanDerWaalsContact C-N 3.3Å; S733-R735 PolarHBondContact O-N 2.03Å; S733-R735 PolarHBondContact OG-N 2.9Å; S733-T736 WeakPolarHBondContact O-CB 3.35Å; S733-T736 PolarHBondContact O-N 3.2Å; S733-T736 VanDerWaalsContact O-N 3.14Å; S733-T736 PolarHBondContact OG-N 3Å; S733-T736 VanDerWaalsContact OG-N 3.16Å; S733-T736 PolarHBondContact OG-OG1 3.03Å; S733-A737 PolarHBondContact O-N 3.08Å
734	K	88.7	Confident	85.5	Confident	115 Å²	115	52.6 Å²	52.6	50%	0.5	28%	0.277	S	S	.	.	H	α-helix	trans	-54.7	-43.5	174.1	-177.1	175	-177.3	178.6	0	112.6	L691 T736 A737 Q738	L691-K734 HydrophobicContact CB-CB 4.37Å; L691-K734 HydrophobicContact CD2-CB 4.44Å; L691-K734 WeakPolarHBondContact O-CE 3.35Å; K734-T736 VanDerWaalsContact C-N 3.34Å; K734-T736 PolarHBondContact O-N 3.43Å; K734-A737 PolarHBondContact O-N 3.12Å; K734-Q738 HydrophobicContact CG-CG 4.5Å; K734-Q738 WeakPolarHBondContact O-CB 3.39Å; K734-Q738 VanDerWaalsContact O-CG 3.28Å; K734-Q738 WeakPolarHBondContact O-CG 3.35Å; K734-Q738 PolarHBondContact O-N 3.16Å
735	R	89.1	Confident	85.3	Confident	214 Å²	214	53.9 Å²	53.9	81%	0.808	29%	0.286	S	S	*	.	H	α-helix	trans	-63.5	-41.3	178.7	-174.1	178.3	-177.5	177.3	1.4	111.5	S733 Q738 G739	S733-R735 VanDerWaalsContact C-N 3.3Å; S733-R735 PolarHBondContact O-N 2.03Å; S733-R735 PolarHBondContact OG-N 2.9Å; R735-Q738 PolarHBondContact O-N 3.02Å; R735-G739 PolarHBondContact O-N 2.04Å
736	T	88.5	Confident	85.2	Confident	59 Å²	59	54.2 Å²	54.2	36%	0.362	29%	0.288	S	S	.	.	H	α-helix	trans	-63.3	-48.1	176.9	-54.6	0	0	0	0	111	E732 S733 K734 Q738 G739 F740	E732-T736 HydrophobicContact CG-CG2 4.27Å; S733-T736 WeakPolarHBondContact O-CB 3.35Å; S733-T736 PolarHBondContact O-N 3.2Å; S733-T736 VanDerWaalsContact O-N 3.14Å; S733-T736 PolarHBondContact OG-N 3Å; S733-T736 VanDerWaalsContact OG-N 3.16Å; S733-T736 PolarHBondContact OG-OG1 3.03Å; K734-T736 VanDerWaalsContact C-N 3.34Å; K734-T736 PolarHBondContact O-N 3.43Å; T736-Q738 VanDerWaalsContact C-N 3.35Å; T736-Q738 PolarHBondContact O-N 2.06Å; T736-G739 PolarHBondContact O-N 2.74Å; T736-G739 VanDerWaalsContact O-N 3.15Å; T736-F740 HydrophobicContact CG2-CD2 3.94Å; T736-F740 HydrophobicContact CG2-CE2 3.34Å; T736-F740 HydrophobicContact CG2-CZ 3.98Å; T736-F740 VanDerWaalsContact O-CD2 3.32Å; T736-F740 WeakPolarHBondContact O-CD2 3.1Å; T736-F740 PolarHBondContact O-N 2.86Å
737	A	89.4	Confident	84.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.6	-42.9	176.9	0	0	0	0	0	111.9	Y686 L691 L692 E732 S733 K734 G739 F740 W741	Y686-A737 HydrophobicContact CD1-CB 4.11Å; Y686-A737 HydrophobicContact CE1-CB 4Å; L691-A737 HydrophobicContact CD1-CB 4.29Å; L692-A737 HydrophobicContact CD1-CB 4.25Å; L692-A737 HydrophobicContact CD2-CB 4.01Å; L692-A737 HydrophobicContact CG-CB 4.04Å; E732-A737 HydrophobicContact CG-CB 4.35Å; E732-A737 VanDerWaalsContact OE1-CA 3.29Å; E732-A737 WeakPolarHBondContact OE1-CA 3.08Å; E732-A737 WeakPolarHBondContact OE1-CB 3.45Å; S733-A737 PolarHBondContact O-N 3.08Å; K734-A737 PolarHBondContact O-N 3.12Å; A737-G739 VanDerWaalsContact C-N 3.34Å; A737-G739 PolarHBondContact O-N 3.5Å; A737-F740 PolarHBondContact O-N 3.09Å; A737-W741 WeakPolarHBondContact O-CB 3.03Å; A737-W741 PolarHBondContact O-N 3.42Å
738	Q	89.5	Confident	84.7	Confident	98 Å²	98	54.7 Å²	54.7	46%	0.458	31%	0.305	S	S	.	.	H	α-helix	trans	-61.8	-41.4	174.6	-75.3	177.4	-26.9	0	0	111.6	L692 K734 R735 T736 W741 A742	L692-Q738 HydrophobicContact CD2-CB 4.29Å; L692-Q738 HydrophobicContact CD2-CG 3.34Å; K734-Q738 HydrophobicContact CG-CG 4.5Å; K734-Q738 WeakPolarHBondContact O-CB 3.39Å; K734-Q738 VanDerWaalsContact O-CG 3.28Å; K734-Q738 WeakPolarHBondContact O-CG 3.35Å; K734-Q738 PolarHBondContact O-N 3.16Å; R735-Q738 PolarHBondContact O-N 3.02Å; T736-Q738 VanDerWaalsContact C-N 3.35Å; T736-Q738 PolarHBondContact O-N 2.06Å; Q738-W741 PolarHBondContact O-N 2.68Å; Q738-A742 WeakPolarHBondContact O-CB 3.2Å; Q738-A742 PolarHBondContact O-N 3.05Å
739	G	90.1	Very high	84.6	Confident	30 Å²	30	61.4 Å²	61.4	31%	0.309	33%	0.329	S	S	.	.	H	α-helix	trans	-62.2	-45.4	177	0	0	0	0	0	112.8	R735 T736 A737 A742 F743	R735-G739 PolarHBondContact O-N 2.04Å; T736-G739 PolarHBondContact O-N 2.74Å; T736-G739 VanDerWaalsContact O-N 3.15Å; A737-G739 VanDerWaalsContact C-N 3.34Å; A737-G739 PolarHBondContact O-N 3.5Å; G739-A742 PolarHBondContact O-N 2.84Å; G739-F743 PolarHBondContact O-N 2.89Å
740	F	89.7	Confident	84.9	Confident	12 Å²	12	66 Å²	66	5%	0.053	35%	0.352	C	S	.	.	H	α-helix	trans	-63.6	-46.2	175	-69.1	-47.9	0	0	0	112	Y686 F721 T736 A737 A742 F743 V744 P754	Y686-F740 HydrophobicContact CE2-CB 4.18Å; F721-F740 HydrophobicContact CD1-CE1 4.21Å; F721-F740 HydrophobicContact CD1-CZ 4.13Å; F721-F740 HydrophobicContact CE1-CD1 4.2Å; F721-F740 AromaticContact CE1-CE1 3.5Å; F721-F740 HydrophobicContact CE1-CE1 3.5Å; F721-F740 AromaticContact CE1-CE2 3.95Å; F721-F740 HydrophobicContact CE1-CE2 3.95Å; F721-F740 AromaticContact CE1-CZ 3.36Å; F721-F740 HydrophobicContact CE1-CZ 3.36Å; F721-F740 HydrophobicContact CZ-CE2 4.37Å; F721-F740 HydrophobicContact CZ-CZ 4.21Å; T736-F740 HydrophobicContact CG2-CD2 3.94Å; T736-F740 HydrophobicContact CG2-CE2 3.34Å; T736-F740 HydrophobicContact CG2-CZ 3.98Å; T736-F740 VanDerWaalsContact O-CD2 3.32Å; T736-F740 WeakPolarHBondContact O-CD2 3.1Å; T736-F740 PolarHBondContact O-N 2.86Å; A737-F740 PolarHBondContact O-N 3.09Å; F740-A742 PolarHBondContact O-N 3.33Å; F740-F743 PolarHBondContact O-N 2.9Å; F740-V744 WeakPolarHBondContact O-CG2 3.05Å; F740-V744 PolarHBondContact O-N 3.32Å; F740-P754 HydrophobicContact CD1-CB 3.91Å; F740-P754 HydrophobicContact CD1-CG 3.36Å; F740-P754 HydrophobicContact CE1-CB 3.72Å; F740-P754 HydrophobicContact CE1-CG 3.58Å; F740-P754 HydrophobicContact CG-CG 4.5Å
741	W	88.7	Confident	85.2	Confident	58 Å²	58	66.8 Å²	66.8	22%	0.22	35%	0.347	C	S	.	.	H	α-helix	trans	-62.9	-43.2	178.7	-174.1	-120.2	0	0	0	111.9	T681 L684 L692 L714 A737 Q738 V744 S745	T681-W741 HydrophobicContact CG2-CH2 3.63Å; T681-W741 HydrophobicContact CG2-CZ2 3.39Å; T681-W741 HydrophobicContact CG2-CZ3 4.43Å; L684-W741 HydrophobicContact CB-CH2 3.81Å; L684-W741 HydrophobicContact CB-CZ3 4.31Å; L684-W741 WeakPolarHBondContact O-CH2 3.47Å; L692-W741 HydrophobicContact CD1-CB 3.89Å; L692-W741 HydrophobicContact CD1-CG 4.17Å; L714-W741 HydrophobicContact CD2-CZ3 4.49Å; A737-W741 WeakPolarHBondContact O-CB 3.03Å; A737-W741 PolarHBondContact O-N 3.42Å; Q738-W741 PolarHBondContact O-N 2.68Å; W741-V744 PolarHBondContact O-N 3.05Å; W741-S745 WeakPolarHBondContact O-CB 3.42Å; W741-S745 PolarHBondContact O-N 3.5Å; W741-S745 PolarHBondContact O-OG 2.87Å
742	A	86.8	Confident	85.6	Confident	32 Å²	32	67.5 Å²	67.5	26%	0.264	35%	0.347	S	S	.	.	H	α-helix	trans	-59.1	-49.4	175.6	0	0	0	0	0	111.2	Q738 G739 F740 V744 S745 D746 I751	Q738-A742 WeakPolarHBondContact O-CB 3.2Å; Q738-A742 PolarHBondContact O-N 3.05Å; G739-A742 PolarHBondContact O-N 2.84Å; F740-A742 PolarHBondContact O-N 3.33Å; A742-V744 PolarHBondContact O-N 3.47Å; A742-S745 WeakPolarHBondContact CA-OG 3.03Å; A742-S745 PolarHBondContact O-N 2.79Å; A742-S745 PolarHBondContact O-OG 2.88Å; A742-S745 VanDerWaalsContact O-OG 3.08Å; A742-D746 VanDerWaalsContact O-CB 3.29Å; A742-D746 WeakPolarHBondContact O-CB 3.49Å; A742-D746 PolarHBondContact O-N 3.39Å; A742-I751 HydrophobicContact CB-CD1 3.87Å
743	F	88.1	Confident	85.8	Confident	19 Å²	19	69.8 Å²	69.8	8%	0.083	36%	0.36	C	S	.	.	H	α-helix	trans	-62.2	-40.9	179.4	176.2	-103.2	0	0	0	113.7	G739 F740 I751 N753 P754 L756 R761	G739-F743 PolarHBondContact O-N 2.89Å; F740-F743 PolarHBondContact O-N 2.9Å; F743-I751 HydrophobicContact CB-CG2 4.1Å; F743-I751 HydrophobicContact CD2-CB 4.48Å; F743-I751 HydrophobicContact CD2-CG2 4.26Å; F743-I751 WeakPolarHBondContact CD2-O 3.33Å; F743-I751 WeakPolarHBondContact CE2-O 3.46Å; F743-N753 HydrophobicContact CD2-CB 4.44Å; F743-N753 VanDerWaalsContact CE2-CA 3.44Å; F743-N753 HydrophobicContact CE2-CB 3.74Å; F743-N753 HydrophobicContact CZ-CB 3.77Å; F743-P754 HydrophobicContact CB-CG 3.99Å; F743-P754 HydrophobicContact CD1-CG 4.38Å; F743-P754 HydrophobicContact CG-CG 4.21Å; F743-L756 HydrophobicContact CD1-CD1 3.77Å; F743-L756 HydrophobicContact CE1-CD1 3.89Å; F743-R761 HydrophobicContact CE1-CB 4.1Å; F743-R761 PolarHBondContact O-NE 3.34Å; F743-R761 PolarHBondContact O-NH1 2.91Å
744	V	85.5	Confident	85.9	Confident	3 Å²	3	69.9 Å²	69.9	2%	0.018	36%	0.359	C	S	.	.	H	α-helix	trans	-71.4	-37.7	178.8	170.9	0	0	0	0	111.5	I680 L714 F740 W741 A742 L756 I764	I680-V744 VanDerWaalsContact CD1-O 3.31Å; I680-V744 WeakPolarHBondContact CD1-O 3.48Å; I680-V744 HydrophobicContact CG2-CG1 4.45Å; L714-V744 HydrophobicContact CD2-CG1 3.84Å; L714-V744 HydrophobicContact CD2-CG2 4.48Å; F740-V744 WeakPolarHBondContact O-CG2 3.05Å; F740-V744 PolarHBondContact O-N 3.32Å; W741-V744 PolarHBondContact O-N 3.05Å; A742-V744 PolarHBondContact O-N 3.47Å; V744-L756 HydrophobicContact CG2-CD1 4.48Å; V744-I764 HydrophobicContact CG1-CD1 3.96Å; V744-I764 HydrophobicContact CG1-CG2 3.98Å; V744-I764 HydrophobicContact CG2-CD1 3.83Å
745	S	81.5	Confident	85.9	Confident	31 Å²	31	65.5 Å²	65.5	22%	0.217	35%	0.346	C	S	.	.	H	α-helix	trans	-80.9	-20.1	-177.8	62.6	0	0	0	0	114.3	W741 A742 T747	W741-S745 WeakPolarHBondContact O-CB 3.42Å; W741-S745 PolarHBondContact O-N 3.5Å; W741-S745 PolarHBondContact O-OG 2.87Å; A742-S745 WeakPolarHBondContact CA-OG 3.03Å; A742-S745 PolarHBondContact O-N 2.79Å; A742-S745 PolarHBondContact O-OG 2.88Å; A742-S745 VanDerWaalsContact O-OG 3.08Å; S745-T747 PolarHBondContact O-N 3.07Å
746	D	82.3	Confident	86	Confident	15 Å²	15	55.3 Å²	55.3	8%	0.08	31%	0.308	C	S	.	.			trans	-55.9	136.7	-179.5	-179.5	28.3	0	0	0	111	A742 T748 R749 L750 I751 R761	A742-D746 VanDerWaalsContact O-CB 3.29Å; A742-D746 WeakPolarHBondContact O-CB 3.49Å; A742-D746 PolarHBondContact O-N 3.39Å; D746-T748 WeakPolarHBondContact OD1-CB 3.08Å; D746-T748 PolarHBondContact OD1-N 2.83Å; D746-T748 PolarHBondContact OD1-OG1 2.74Å; D746-T748 PolarHBondContact OD2-OG1 2.81Å; D746-R749 WeakPolarHBondContact OD2-CA 3.39Å; D746-R749 PolarHBondContact OD2-N 3.46Å; D746-L750 PolarHBondContact OD2-N 3.27Å; D746-L750 VanDerWaalsContact OD2-N 3.13Å; D746-I751 HydrophobicContact CB-CB 4.25Å; D746-I751 HydrophobicContact CB-CD1 3.85Å; D746-I751 HydrophobicContact CB-CG1 3.99Å; D746-I751 PolarHBondContact OD2-N 3.15Å; D746-R761 PolarHBondContact O-NH2 2.87Å; D746-R761 IonicContact OD2-NH1 2.65Å; D746-R761 IonicContact OD2-NH2 2.72Å
747	T	76.8	Confident	85.9	Confident	81 Å²	81	56 Å²	56	50%	0.497	31%	0.306	S	S	.	.	S	Bend	trans	-109.7	-19.5	172.8	49.5	0	0	0	0	111.5	S745 R749	S745-T747 PolarHBondContact O-N 3.07Å; T747-R749 VanDerWaalsContact C-N 3.33Å; T747-R749 PolarHBondContact O-N 2.78Å
748	T	79.9	Confident	85.4	Confident	83 Å²	83	61.1 Å²	61.1	51%	0.509	34%	0.337	S	S	.	.	S	Bend	trans	-76.4	-21.2	-177.2	69.5	0	0	0	0	112.9	D746 L750	D746-T748 WeakPolarHBondContact OD1-CB 3.08Å; D746-T748 PolarHBondContact OD1-N 2.83Å; D746-T748 PolarHBondContact OD1-OG1 2.74Å; D746-T748 PolarHBondContact OD2-OG1 2.81Å; T748-L750 PolarHBondContact O-N 3.41Å; T748-L750 WeakPolarHBondContact OG1-CB 3.47Å; T748-L750 WeakPolarHBondContact OG1-CG 3.21Å; T748-L750 PolarHBondContact OG1-N 3.46Å
749	R	76.8	Confident	84.9	Confident	171 Å²	171	58.7 Å²	58.7	65%	0.645	33%	0.327	S	S	*	.	S	Bend	trans	61.5	21.2	-171.9	-53.1	-176.1	179.5	-166.3	2.8	113.3	D675 D746 T747	D675-R749 IonicContact OD1-CZ 2.68Å; D675-R749 IonicContact OD1-NH2 3.68Å; D675-R749 PolarHBondContact OD1-NH2 2.68Å; D746-R749 WeakPolarHBondContact OD2-CA 3.39Å; D746-R749 PolarHBondContact OD2-N 3.46Å; T747-R749 VanDerWaalsContact C-N 3.33Å; T747-R749 PolarHBondContact O-N 2.78Å
750	L	81.3	Confident	84.7	Confident	144 Å²	144	57.4 Å²	57.4	75%	0.754	31%	0.313	S	S	*	.			trans	-90.3	-17.6	177.9	-61	174.9	0	0	0	112.6	D746 T748 T752	D746-L750 PolarHBondContact OD2-N 3.27Å; D746-L750 VanDerWaalsContact OD2-N 3.13Å; T748-L750 PolarHBondContact O-N 3.41Å; T748-L750 WeakPolarHBondContact OG1-CB 3.47Å; T748-L750 WeakPolarHBondContact OG1-CG 3.21Å; T748-L750 PolarHBondContact OG1-N 3.46Å; L750-T752 PolarHBondContact O-N 3.43Å
751	I	84.1	Confident	84.4	Confident	69 Å²	69	58.9 Å²	58.9	35%	0.354	32%	0.318	S	S	.	.	S	Bend	trans	-77.4	124.2	179.7	-58.3	-169.2	0	0	0	110	A742 F743 D746	A742-I751 HydrophobicContact CB-CD1 3.87Å; F743-I751 HydrophobicContact CB-CG2 4.1Å; F743-I751 HydrophobicContact CD2-CB 4.48Å; F743-I751 HydrophobicContact CD2-CG2 4.26Å; F743-I751 WeakPolarHBondContact CD2-O 3.33Å; F743-I751 WeakPolarHBondContact CE2-O 3.46Å; D746-I751 HydrophobicContact CB-CB 4.25Å; D746-I751 HydrophobicContact CB-CD1 3.85Å; D746-I751 HydrophobicContact CB-CG1 3.99Å; D746-I751 PolarHBondContact OD2-N 3.15Å
752	T	87.6	Confident	83.9	Confident	123 Å²	123	62.6 Å²	62.6	76%	0.755	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-59.1	137.1	175.6	-51.7	0	0	0	0	111.1	L750 P754	L750-T752 PolarHBondContact O-N 3.43Å; T752-P754 WeakPolarHBondContact O-CD 3.48Å
753	N	89	Confident	83.8	Confident	54 Å²	54	62.5 Å²	62.5	29%	0.289	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-62.7	119.1	177.4	-178.4	-1.3	0	0	0	110.9	F743 G755 L756	F743-N753 HydrophobicContact CD2-CB 4.44Å; F743-N753 VanDerWaalsContact CE2-CA 3.44Å; F743-N753 HydrophobicContact CE2-CB 3.74Å; F743-N753 HydrophobicContact CZ-CB 3.77Å; N753-G755 PolarHBondContact O-N 3.4Å; N753-G755 PolarHBondContact OD1-N 2.85Å; N753-L756 PolarHBondContact ND2-O 2.89Å; N753-L756 WeakPolarHBondContact OD1-CB 3.09Å; N753-L756 PolarHBondContact OD1-N 3.31Å
754	P	89.7	Confident	83.7	Confident	56 Å²	56	61.6 Å²	61.6	36%	0.364	32%	0.323	S	S	.	.			trans	-75.9	18	-176.5	33.1	-38.5	0	0	0	114.2	F740 F743 T752	F740-P754 HydrophobicContact CD1-CB 3.91Å; F740-P754 HydrophobicContact CD1-CG 3.36Å; F740-P754 HydrophobicContact CE1-CB 3.72Å; F740-P754 HydrophobicContact CE1-CG 3.58Å; F740-P754 HydrophobicContact CG-CG 4.5Å; F743-P754 HydrophobicContact CB-CG 3.99Å; F743-P754 HydrophobicContact CD1-CG 4.38Å; F743-P754 HydrophobicContact CG-CG 4.21Å; T752-P754 WeakPolarHBondContact O-CD 3.48Å
755	G	89.5	Confident	83.6	Confident	23 Å²	23	61.6 Å²	61.6	24%	0.237	32%	0.323	C	S	.	.	S	Bend	trans	107.8	18.3	179	0	0	0	0	0	115.2	F721 Q722 N753	F721-G755 WeakPolarHBondContact CA-O 3.35Å; Q722-G755 PolarHBondContact N-O 3.09Å; N753-G755 PolarHBondContact O-N 3.4Å; N753-G755 PolarHBondContact OD1-N 2.85Å
756	L	90.4	Very high	83.5	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.005	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-77.5	151.5	171.5	-62.7	174.6	0	0	0	111.2	L716 F721 Q722 F743 V744 N753 I760	L716-L756 HydrophobicContact CD1-CD1 4.18Å; L716-L756 HydrophobicContact CD1-CD2 3.81Å; F721-L756 HydrophobicContact CD1-CD2 3.61Å; F721-L756 HydrophobicContact CE1-CD2 3.36Å; F721-L756 HydrophobicContact CE1-CG 4.48Å; F721-L756 HydrophobicContact CG-CD2 4.32Å; F721-L756 HydrophobicContact CZ-CD2 3.94Å; Q722-L756 PolarHBondContact NE2-O 2.85Å; F743-L756 HydrophobicContact CD1-CD1 3.77Å; F743-L756 HydrophobicContact CE1-CD1 3.89Å; V744-L756 HydrophobicContact CG2-CD1 4.48Å; N753-L756 PolarHBondContact ND2-O 2.89Å; N753-L756 WeakPolarHBondContact OD1-CB 3.09Å; N753-L756 PolarHBondContact OD1-N 3.31Å; L756-I760 HydrophobicContact CB-CB 4.42Å; L756-I760 HydrophobicContact CD1-CG2 4.32Å
757	K	87.4	Confident	83.8	Confident	73 Å²	73	59.8 Å²	59.8	32%	0.317	31%	0.312	S	S	.	.			trans	-61.3	148.3	167.1	-69.2	178.3	175.9	174	0	109.8	Y566 R719 C720 N759 I760	Y566-K757 PolarHBondContact O-NZ 2.55Å; R719-K757 WeakPolarHBondContact O-CD 3.07Å; R719-K757 WeakPolarHBondContact O-CE 3.39Å; R719-K757 PolarHBondContact O-NZ 3.07Å; C720-K757 PolarHBondContact O-N 2.95Å; K757-N759 PolarHBondContact O-N 3.44Å; K757-N759 VanDerWaalsContact O-N 3.09Å; K757-I760 HydrophobicContact CB-CG1 3.92Å; K757-I760 WeakPolarHBondContact O-CG1 3.48Å; K757-I760 PolarHBondContact O-N 3.24Å
758	V	79	Confident	84.2	Confident	108 Å²	108	57.9 Å²	57.9	66%	0.655	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-34.6	-166.8	-178.6	0	0	0	0	113.5
759	N	78.1	Confident	84.5	Confident	47 Å²	47	58.7 Å²	58.7	25%	0.251	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-8.7	-173	-70.5	-32.4	0	0	0	115.3	K757 R761 R762 E763	K757-N759 PolarHBondContact O-N 3.44Å; K757-N759 VanDerWaalsContact O-N 3.09Å; N759-R761 PolarHBondContact O-N 3.09Å; N759-R762 WeakPolarHBondContact O-CB 3.4Å; N759-R762 PolarHBondContact O-N 3.39Å; N759-R762 VanDerWaalsContact O-N 3.08Å; N759-E763 PolarHBondContact O-N 3.38Å; N759-E763 VanDerWaalsContact O-N 3.1Å
760	I	86.3	Confident	85.2	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.015	26%	0.261	C	S	.	.	H	α-helix	trans	-61.4	-45.5	-172.2	-63	-60.6	0	0	0	112.3	L716 C720 L756 K757 R762 E763 I764 S796 V798	L716-I760 HydrophobicContact CD2-CG2 3.94Å; C720-I760 HydrophobicContact CB-CD1 3.86Å; C720-I760 HydrophobicContact CB-CG1 4.11Å; C720-I760 HydrophobicContact CB-CG2 4.42Å; L756-I760 HydrophobicContact CB-CB 4.42Å; L756-I760 HydrophobicContact CD1-CG2 4.32Å; K757-I760 HydrophobicContact CB-CG1 3.92Å; K757-I760 WeakPolarHBondContact O-CG1 3.48Å; K757-I760 PolarHBondContact O-N 3.24Å; I760-R762 PolarHBondContact O-N 3.47Å; I760-E763 WeakPolarHBondContact O-CB 3.35Å; I760-E763 PolarHBondContact O-N 2.96Å; I760-E763 VanDerWaalsContact O-N 3.12Å; I760-I764 HydrophobicContact CG2-CD1 4.01Å; I760-I764 WeakPolarHBondContact O-CG1 3.34Å; I760-I764 PolarHBondContact O-N 3.4Å; I760-I764 VanDerWaalsContact O-N 3.07Å; I760-S796 WeakPolarHBondContact CD1-OG 3.1Å; I760-V798 HydrophobicContact CD1-CG2 4.08Å; I760-V798 HydrophobicContact CG2-CG2 3.9Å
761	R	84.2	Confident	85.6	Confident	42 Å²	42	44 Å²	44	16%	0.158	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-35.5	177.8	-176.7	170	168.9	-172.6	-7.1	112.2	F743 D746 N759 G765	F743-R761 HydrophobicContact CE1-CB 4.1Å; F743-R761 PolarHBondContact O-NE 3.34Å; F743-R761 PolarHBondContact O-NH1 2.91Å; D746-R761 PolarHBondContact O-NH2 2.87Å; D746-R761 IonicContact OD2-NH1 2.65Å; D746-R761 IonicContact OD2-NH2 2.72Å; N759-R761 PolarHBondContact O-N 3.09Å; R761-G765 PolarHBondContact O-N 2.95Å; R761-G765 VanDerWaalsContact O-N 3.14Å
762	R	78.2	Confident	85.9	Confident	137 Å²	137	44.8 Å²	44.8	52%	0.517	24%	0.236	S	C	.	.	H	α-helix	trans	-70.5	-36.7	177.7	-57.9	179.8	-177.7	172.1	-2	111.6	N759 I760 G765 A766	N759-R762 WeakPolarHBondContact O-CB 3.4Å; N759-R762 PolarHBondContact O-N 3.39Å; N759-R762 VanDerWaalsContact O-N 3.08Å; I760-R762 PolarHBondContact O-N 3.47Å; R762-G765 PolarHBondContact O-N 2.92Å; R762-A766 PolarHBondContact O-N 3.32Å; R762-A766 VanDerWaalsContact O-N 3.14Å
763	E	83.2	Confident	86.1	Confident	29 Å²	29	40.7 Å²	40.7	14%	0.136	21%	0.208	C	C	.	.	H	α-helix	trans	-64.2	-46.2	174.9	-72.3	-177.4	-150.1	0	0	111.8	N759 I760 G765 A766 L767 T794 S796 V798	N759-E763 PolarHBondContact O-N 3.38Å; N759-E763 VanDerWaalsContact O-N 3.1Å; I760-E763 WeakPolarHBondContact O-CB 3.35Å; I760-E763 PolarHBondContact O-N 2.96Å; I760-E763 VanDerWaalsContact O-N 3.12Å; E763-G765 PolarHBondContact O-N 3.41Å; E763-A766 WeakPolarHBondContact O-CB 3.48Å; E763-A766 PolarHBondContact O-N 3.42Å; E763-L767 WeakPolarHBondContact O-CG 3.29Å; E763-L767 PolarHBondContact O-N 3.29Å; E763-T794 WeakPolarHBondContact OE2-CB 3.27Å; E763-T794 PolarHBondContact OE2-OG1 3Å; E763-S796 PolarHBondContact OE1-OG 3.34Å; E763-S796 PolarHBondContact OE2-OG 3.24Å; E763-V798 HydrophobicContact CB-CG2 4.25Å
764	I	87.3	Confident	86.4	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-56.6	-43.9	175.7	-62.7	159.2	0	0	0	110.3	I680 L684 L714 L716 V744 I760 A766 L767 R768 V798	I680-I764 HydrophobicContact CG2-CG2 4.23Å; L684-I764 HydrophobicContact CD1-CG2 4.32Å; L714-I764 HydrophobicContact CD1-CD1 4.26Å; L714-I764 HydrophobicContact CD1-CG1 3.97Å; L714-I764 HydrophobicContact CD1-CG2 4.43Å; L714-I764 HydrophobicContact CD2-CD1 3.99Å; L714-I764 HydrophobicContact CD2-CG1 4.37Å; L714-I764 HydrophobicContact CD2-CG2 4.13Å; L716-I764 HydrophobicContact CD2-CD1 4.19Å; V744-I764 HydrophobicContact CG1-CD1 3.96Å; V744-I764 HydrophobicContact CG1-CG2 3.98Å; V744-I764 HydrophobicContact CG2-CD1 3.83Å; I760-I764 HydrophobicContact CG2-CD1 4.01Å; I760-I764 WeakPolarHBondContact O-CG1 3.34Å; I760-I764 PolarHBondContact O-N 3.4Å; I760-I764 VanDerWaalsContact O-N 3.07Å; I764-A766 VanDerWaalsContact C-N 3.32Å; I764-A766 PolarHBondContact O-N 3.11Å; I764-L767 PolarHBondContact O-N 3.05Å; I764-R768 PolarHBondContact O-N 2.86Å; I764-V798 HydrophobicContact CG1-CG1 3.77Å; I764-V798 HydrophobicContact CG1-CG2 4.44Å
765	G	82.3	Confident	86.4	Confident	2 Å²	2	39 Å²	39	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-58.1	-40.4	176.4	0	0	0	0	0	113.6	R761 R762 E763 R768	R761-G765 PolarHBondContact O-N 2.95Å; R761-G765 VanDerWaalsContact O-N 3.14Å; R762-G765 PolarHBondContact O-N 2.92Å; E763-G765 PolarHBondContact O-N 3.41Å; G765-R768 WeakPolarHBondContact O-CG 3.38Å
766	A	81	Confident	86.5	Confident	7 Å²	7	42.7 Å²	42.7	6%	0.058	20%	0.199	C	C	.	.	H	α-helix	trans	-68.8	-38.1	178	0	0	0	0	0	112.5	M112 R762 E763 I764	M112-A766 HydrophobicContact CE-CB 4.08Å; M112-A766 HydrophobicContact SD-CB 4.14Å; R762-A766 PolarHBondContact O-N 3.32Å; R762-A766 VanDerWaalsContact O-N 3.14Å; E763-A766 WeakPolarHBondContact O-CB 3.48Å; E763-A766 PolarHBondContact O-N 3.42Å; I764-A766 VanDerWaalsContact C-N 3.32Å; I764-A766 PolarHBondContact O-N 3.11Å
767	L	88.6	Confident	86.6	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-80.9	-25.3	-175.3	-64.9	170.7	0	0	0	113.7	L105 F109 E763 I764 K769 I770 L792 T794 V798 L800	L105-L767 HydrophobicContact CD2-CD2 4.33Å; F109-L767 HydrophobicContact CE2-CD2 4.02Å; F109-L767 HydrophobicContact CZ-CD2 3.92Å; E763-L767 WeakPolarHBondContact O-CG 3.29Å; E763-L767 PolarHBondContact O-N 3.29Å; I764-L767 PolarHBondContact O-N 3.05Å; L767-K769 PolarHBondContact O-N 3.32Å; L767-I770 WeakPolarHBondContact O-CG2 3.43Å; L767-I770 PolarHBondContact O-N 2.96Å; L767-I770 VanDerWaalsContact O-N 3.12Å; L767-L792 HydrophobicContact CB-CD1 4.48Å; L767-L792 HydrophobicContact CD1-CD1 3.51Å; L767-L792 HydrophobicContact CD2-CD1 3.69Å; L767-L792 HydrophobicContact CD2-CD2 4.43Å; L767-L792 HydrophobicContact CG-CD1 4.07Å; L767-T794 HydrophobicContact CD1-CG2 3.48Å; L767-T794 VanDerWaalsContact CD1-CG2 3.48Å; L767-T794 HydrophobicContact CG-CG2 4.48Å; L767-V798 HydrophobicContact CD1-CG1 4.07Å; L767-L800 HydrophobicContact CB-CD1 3.9Å
768	R	84.3	Confident	86.7	Confident	41 Å²	41	40.4 Å²	40.4	16%	0.155	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-31.7	-168.8	78.4	-174.1	179.7	167.7	0.5	115.4	G678 L684 I764 G765 I770 S771	G678-R768 PolarHBondContact O-NH1 2.93Å; L684-R768 HydrophobicContact CD1-CB 4.29Å; I764-R768 PolarHBondContact O-N 2.86Å; G765-R768 WeakPolarHBondContact O-CG 3.38Å; R768-I770 PolarHBondContact O-N 2.91Å; R768-S771 WeakPolarHBondContact O-CB 3.37Å; R768-S771 PolarHBondContact O-N 3.45Å; R768-S771 VanDerWaalsContact O-N 3.07Å; R768-S771 PolarHBondContact O-OG 2.89Å
769	K	85.9	Confident	87.1	Confident	101 Å²	101	39.4 Å²	39.4	44%	0.439	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-26.5	-174.9	-76.5	-174.2	177	177.4	0	112.2	F104 K108 L767 S771 T772	F104-K769 HydrophobicContact CE1-CB 4.26Å; F104-K769 HydrophobicContact CZ-CB 4.23Å; K108-K769 HydrophobicContact CD-CD 4.2Å; K108-K769 HydrophobicContact CG-CD 4.29Å; L767-K769 PolarHBondContact O-N 3.32Å; K769-S771 PolarHBondContact O-N 2.8Å; K769-T772 PolarHBondContact O-N 2.84Å
770	I	91.4	Very high	87.6	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.3	-24.6	177.2	-158.1	163.2	0	0	0	112.9	L105 L767 R768 T772 E773 W774 L792 L800 L870	L105-I770 HydrophobicContact CB-CD1 4.34Å; L105-I770 HydrophobicContact CD2-CD1 3.99Å; L767-I770 WeakPolarHBondContact O-CG2 3.43Å; L767-I770 PolarHBondContact O-N 2.96Å; L767-I770 VanDerWaalsContact O-N 3.12Å; R768-I770 PolarHBondContact O-N 2.91Å; I770-T772 PolarHBondContact O-N 2.98Å; I770-E773 PolarHBondContact O-N 2.56Å; I770-E773 VanDerWaalsContact O-N 3.09Å; I770-W774 HydrophobicContact CD1-CD2 4.27Å; I770-W774 HydrophobicContact CD1-CH2 4.27Å; I770-W774 HydrophobicContact CD1-CZ2 3.53Å; I770-W774 HydrophobicContact CG1-CD2 3.96Å; I770-W774 HydrophobicContact CG1-CG 4.17Å; I770-W774 HydrophobicContact CG1-CZ2 4.14Å; I770-W774 HydrophobicContact CG2-CE3 4.41Å; I770-W774 HydrophobicContact CG2-CZ3 4.44Å; I770-W774 PolarHBondContact O-N 3.49Å; I770-L792 HydrophobicContact CD1-CD2 3.85Å; I770-L792 HydrophobicContact CG2-CD2 3.65Å; I770-L800 HydrophobicContact CG2-CD1 3.95Å; I770-L870 HydrophobicContact CD1-CD2 3.51Å
771	S	91	Very high	87.6	Confident	7 Å²	7	44.1 Å²	44.1	5%	0.049	21%	0.212	C	C	.	.	H	α-helix	trans	-60.9	-33.9	-178.2	62.1	0	0	0	0	113.8	N683 R768 K769 K775	N683-S771 WeakPolarHBondContact CB-OG 3.43Å; R768-S771 WeakPolarHBondContact O-CB 3.37Å; R768-S771 PolarHBondContact O-N 3.45Å; R768-S771 VanDerWaalsContact O-N 3.07Å; R768-S771 PolarHBondContact O-OG 2.89Å; K769-S771 PolarHBondContact O-N 2.8Å; S771-K775 WeakPolarHBondContact O-CB 3.32Å; S771-K775 PolarHBondContact O-N 2.93Å
772	T	89.4	Confident	87.6	Confident	85 Å²	85	49.2 Å²	49.2	52%	0.521	24%	0.238	S	C	.	.	H	α-helix	trans	-74	-38.8	178.3	-49.4	0	0	0	0	110.2	N683 K769 I770 K775 R776	N683-T772 PolarHBondContact ND2-OG1 2.98Å; K769-T772 PolarHBondContact O-N 2.84Å; I770-T772 PolarHBondContact O-N 2.98Å; T772-K775 PolarHBondContact O-N 2.98Å; T772-R776 PolarHBondContact O-N 2.92Å
773	E	92	Very high	87.9	Confident	37 Å²	37	44.1 Å²	44.1	17%	0.173	22%	0.22	C	C	.	.	H	α-helix	trans	-71.1	-44.9	-177.7	-169.2	57.1	-157.4	0	0	112.3	A101 F104 I770 K775 R776 L777	A101-E773 HydrophobicContact CB-CB 4.49Å; A101-E773 HydrophobicContact CB-CG 3.69Å; F104-E773 HydrophobicContact CB-CG 4.44Å; F104-E773 HydrophobicContact CD1-CB 4.12Å; F104-E773 HydrophobicContact CD1-CG 4.21Å; F104-E773 HydrophobicContact CD2-CG 4.41Å; F104-E773 HydrophobicContact CE1-CB 4.07Å; F104-E773 HydrophobicContact CG-CB 4.44Å; F104-E773 HydrophobicContact CG-CG 4.1Å; F104-E773 HydrophobicContact CZ-CB 4.33Å; I770-E773 PolarHBondContact O-N 2.56Å; I770-E773 VanDerWaalsContact O-N 3.09Å; E773-K775 VanDerWaalsContact C-N 3.31Å; E773-K775 PolarHBondContact O-N 3.24Å; E773-R776 WeakPolarHBondContact O-CB 3.46Å; E773-R776 PolarHBondContact O-N 3.21Å; E773-R776 IonicContact OE1-CZ 3.42Å; E773-R776 IonicContact OE1-NE 3.36Å; E773-R776 PolarHBondContact OE1-NE 2.86Å; E773-R776 IonicContact OE1-NH2 3.36Å; E773-R776 PolarHBondContact OE1-NH2 3.4Å; E773-R776 IonicContact OE2-NE 2.7Å; E773-R776 PolarHBondContact OE2-NE 3.19Å; E773-L777 HydrophobicContact CG-CD1 4.4Å; E773-L777 WeakPolarHBondContact O-CG 3.42Å; E773-L777 PolarHBondContact O-N 2.77Å
774	W	94.7	Very high	87.8	Confident	1 Å²	1	47.1 Å²	47.1	0%	0.004	23%	0.234	C	C	.	.	H	α-helix	trans	-63.5	-36.4	175.2	-76.2	-11.1	0	0	0	113	M100 V712 I770 L777 A778 R790 Y791 L792 L800 F802 L870	M100-W774 PolarHBondContact O-NE1 3.3Å; V712-W774 HydrophobicContact CG1-CE3 4.41Å; V712-W774 HydrophobicContact CG1-CZ3 4.34Å; V712-W774 HydrophobicContact CG2-CE3 4.34Å; I770-W774 HydrophobicContact CD1-CD2 4.27Å; I770-W774 HydrophobicContact CD1-CH2 4.27Å; I770-W774 HydrophobicContact CD1-CZ2 3.53Å; I770-W774 HydrophobicContact CG1-CD2 3.96Å; I770-W774 HydrophobicContact CG1-CG 4.17Å; I770-W774 HydrophobicContact CG1-CZ2 4.14Å; I770-W774 HydrophobicContact CG2-CE3 4.41Å; I770-W774 HydrophobicContact CG2-CZ3 4.44Å; I770-W774 PolarHBondContact O-N 3.49Å; W774-L777 PolarHBondContact O-N 2.74Å; W774-A778 VanDerWaalsContact O-CB 3.29Å; W774-A778 WeakPolarHBondContact O-CB 3.29Å; W774-A778 PolarHBondContact O-N 3.16Å; W774-R790 HydrophobicContact CD2-CB 3.82Å; W774-R790 HydrophobicContact CE3-CB 4.18Å; W774-R790 HydrophobicContact CG-CB 4.22Å; W774-R790 HydrophobicContact CH2-CB 4.36Å; W774-R790 HydrophobicContact CZ2-CB 4.01Å; W774-R790 HydrophobicContact CZ3-CB 4.44Å; W774-Y791 VanDerWaalsContact CH2-C 3.48Å; W774-Y791 VanDerWaalsContact CH2-CA 3.48Å; W774-L792 HydrophobicContact CH2-CB 3.94Å; W774-L792 HydrophobicContact CH2-CD2 3.7Å; W774-L792 HydrophobicContact CH2-CG 4.06Å; W774-L792 HydrophobicContact CZ2-CB 4.32Å; W774-L792 HydrophobicContact CZ2-CD2 4.16Å; W774-L792 HydrophobicContact CZ3-CD2 4.38Å; W774-L800 HydrophobicContact CZ3-CB 4.16Å; W774-F802 HydrophobicContact CB-CB 4.38Å; W774-F802 HydrophobicContact CB-CG 4.38Å; W774-F802 HydrophobicContact CD2-CB 4.41Å; W774-F802 HydrophobicContact CE3-CB 3.7Å; W774-F802 HydrophobicContact CZ3-CB 4.34Å; W774-L870 HydrophobicContact CZ2-CD2 3.85Å
775	K	90.6	Very high	87.5	Confident	73 Å²	73	49.2 Å²	49.2	32%	0.317	25%	0.248	S	C	.	.	H	α-helix	trans	-62.9	-45.8	174.5	-172.9	168.4	-174.5	163	0	110.8	D710 S771 T772 E773 A778 T779	D710-K775 PolarHBondContact O-NZ 2.83Å; S771-K775 WeakPolarHBondContact O-CB 3.32Å; S771-K775 PolarHBondContact O-N 2.93Å; T772-K775 PolarHBondContact O-N 2.98Å; E773-K775 VanDerWaalsContact C-N 3.31Å; E773-K775 PolarHBondContact O-N 3.24Å; K775-A778 PolarHBondContact O-N 2.79Å; K775-T779 WeakPolarHBondContact O-CG2 3.33Å; K775-T779 PolarHBondContact O-N 2.95Å; K775-T779 VanDerWaalsContact O-N 3.1Å; K775-T779 PolarHBondContact O-OG1 2.82Å; K775-T779 VanDerWaalsContact O-OG1 3.08Å
776	R	91.5	Very high	87.7	Confident	100 Å²	100	49.5 Å²	49.5	38%	0.377	25%	0.25	S	S	.	.	H	α-helix	trans	-58.5	-48.8	175.5	-168.5	-167.9	69.6	72.5	0.8	111.7	T772 E773 A778 T779 E780	T772-R776 PolarHBondContact O-N 2.92Å; E773-R776 WeakPolarHBondContact O-CB 3.46Å; E773-R776 PolarHBondContact O-N 3.21Å; E773-R776 IonicContact OE1-CZ 3.42Å; E773-R776 IonicContact OE1-NE 3.36Å; E773-R776 PolarHBondContact OE1-NE 2.86Å; E773-R776 IonicContact OE1-NH2 3.36Å; E773-R776 PolarHBondContact OE1-NH2 3.4Å; E773-R776 IonicContact OE2-NE 2.7Å; E773-R776 PolarHBondContact OE2-NE 3.19Å; R776-A778 VanDerWaalsContact C-N 3.3Å; R776-A778 PolarHBondContact O-N 3.46Å; R776-T779 PolarHBondContact O-N 3.34Å; R776-T779 PolarHBondContact O-OG1 3.03Å; R776-T779 VanDerWaalsContact O-OG1 3.11Å; R776-E780 HydrophobicContact CG-CG 4.46Å; R776-E780 WeakPolarHBondContact CG-OE2 3.4Å; R776-E780 IonicContact NH1-OE2 2.7Å; R776-E780 PolarHBondContact NH1-OE2 3.43Å; R776-E780 WeakPolarHBondContact O-CB 3.5Å; R776-E780 PolarHBondContact O-N 3.01Å
777	L	91.9	Very high	88.2	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.021	25%	0.25	C	S	.	.	H	α-helix	trans	-61.8	-36.4	177.3	-71.6	170.4	0	0	0	112.5	E98 A101 E773 W774 T779 G781	E98-L777 WeakPolarHBondContact O-CD1 3.46Å; A101-L777 HydrophobicContact CB-CD1 4.1Å; E773-L777 HydrophobicContact CG-CD1 4.4Å; E773-L777 WeakPolarHBondContact O-CG 3.42Å; E773-L777 PolarHBondContact O-N 2.77Å; W774-L777 PolarHBondContact O-N 2.74Å; L777-T779 VanDerWaalsContact C-N 3.33Å; L777-T779 PolarHBondContact O-N 3.32Å; L777-G781 WeakPolarHBondContact O-CA 3.41Å; L777-G781 PolarHBondContact O-N 2.73Å
778	A	89.5	Confident	88.3	Confident	23 Å²	23	50 Å²	50	19%	0.19	25%	0.252	C	S	.	.	H	α-helix	trans	-72.2	-24	177.4	0	0	0	0	0	114.2	W774 K775 R776 Q784 F802	W774-A778 VanDerWaalsContact O-CB 3.29Å; W774-A778 WeakPolarHBondContact O-CB 3.29Å; W774-A778 PolarHBondContact O-N 3.16Å; K775-A778 PolarHBondContact O-N 2.79Å; R776-A778 VanDerWaalsContact C-N 3.3Å; R776-A778 PolarHBondContact O-N 3.46Å; A778-Q784 VanDerWaalsContact O-CD 3.3Å; A778-Q784 VanDerWaalsContact O-CG 3.24Å; A778-Q784 WeakPolarHBondContact O-CG 3.43Å; A778-Q784 PolarHBondContact O-OE1 3.24Å; A778-F802 HydrophobicContact CB-CD1 4.18Å; A778-F802 HydrophobicContact CB-CE1 3.21Å; A778-F802 HydrophobicContact CB-CZ 3.64Å
779	T	87.2	Confident	88.7	Confident	86 Å²	86	49 Å²	49	53%	0.528	25%	0.248	S	C	.	.	H	α-helix	trans	-100.1	-30.4	179.7	53.9	0	0	0	0	113.8	K775 R776 L777 Q784	K775-T779 WeakPolarHBondContact O-CG2 3.33Å; K775-T779 PolarHBondContact O-N 2.95Å; K775-T779 VanDerWaalsContact O-N 3.1Å; K775-T779 PolarHBondContact O-OG1 2.82Å; K775-T779 VanDerWaalsContact O-OG1 3.08Å; R776-T779 PolarHBondContact O-N 3.34Å; R776-T779 PolarHBondContact O-OG1 3.03Å; R776-T779 VanDerWaalsContact O-OG1 3.11Å; L777-T779 VanDerWaalsContact C-N 3.33Å; L777-T779 PolarHBondContact O-N 3.32Å; T779-Q784 PolarHBondContact O-NE2 3.33Å
780	E	88.6	Confident	89.2	Confident	133 Å²	133	44.6 Å²	44.6	62%	0.621	23%	0.229	S	C	*	.	H	α-helix	trans	-116	-13.9	-174	-61	173.4	-175.5	0	0	113.5	R776 Q784	R776-E780 HydrophobicContact CG-CG 4.46Å; R776-E780 WeakPolarHBondContact CG-OE2 3.4Å; R776-E780 IonicContact NH1-OE2 2.7Å; R776-E780 PolarHBondContact NH1-OE2 3.43Å; R776-E780 WeakPolarHBondContact O-CB 3.5Å; R776-E780 PolarHBondContact O-N 3.01Å; E780-Q784 VanDerWaalsContact C-NE2 3.29Å
781	G	86.3	Confident	89.4	Confident	16 Å²	16	45.2 Å²	45.2	17%	0.165	23%	0.231	C	C	.	.			trans	-67	161.3	-175.2	0	0	0	0	0	113.8	L777 Q784	L777-G781 WeakPolarHBondContact O-CA 3.41Å; L777-G781 PolarHBondContact O-N 2.73Å; G781-Q784 VanDerWaalsContact O-CG 3.25Å; G781-Q784 WeakPolarHBondContact O-CG 3.44Å; G781-Q784 PolarHBondContact O-NE2 2.92Å
782	E	85.5	Confident	89.7	Confident	149 Å²	149	44.9 Å²	44.9	70%	0.696	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-30.3	178.3	-172.2	-177.4	162.3	0	0	112
783	F	84.1	Confident	89.9	Confident	31 Å²	31	40.9 Å²	40.9	14%	0.136	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	27.1	-168.6	-58.6	-71.1	0	0	0	114.7	F95 E99 S785 C786 V787 F878	F95-F783 AromaticContact CD2-CD2 3.76Å; F95-F783 HydrophobicContact CD2-CD2 3.76Å; F95-F783 AromaticContact CD2-CE2 3.9Å; F95-F783 HydrophobicContact CD2-CE2 3.9Å; F95-F783 HydrophobicContact CD2-CG 4.2Å; F95-F783 HydrophobicContact CD2-CZ 4.43Å; F95-F783 HydrophobicContact CE2-CB 4.05Å; F95-F783 HydrophobicContact CE2-CD1 4.36Å; F95-F783 AromaticContact CE2-CD2 3.77Å; F95-F783 HydrophobicContact CE2-CD2 3.77Å; F95-F783 HydrophobicContact CE2-CE2 4.33Å; F95-F783 AromaticContact CE2-CG 3.79Å; F95-F783 HydrophobicContact CE2-CG 3.79Å; E99-F783 HydrophobicContact CG-CD2 4.35Å; E99-F783 WeakPolarHBondContact OE1-CD2 3.38Å; F783-S785 PolarHBondContact O-N 3.4Å; F783-S785 VanDerWaalsContact O-N 3.15Å; F783-C786 HydrophobicContact CB-CB 4.3Å; F783-C786 PolarHBondContact O-N 3.21Å; F783-V787 HydrophobicContact CB-CG2 4.28Å; F783-V787 PolarHBondContact O-N 2.97Å; F783-V787 VanDerWaalsContact O-N 3.11Å; F783-F878 HydrophobicContact CD1-CE2 4.07Å; F783-F878 HydrophobicContact CD1-CZ 4.03Å; F783-F878 HydrophobicContact CE1-CZ 4.35Å
784	Q	80.8	Confident	89.9	Confident	92 Å²	92	39.3 Å²	39.3	43%	0.43	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-36.4	-175.4	-61.7	172	25.1	0	0	113.7	A778 T779 E780 G781 C786	A778-Q784 VanDerWaalsContact O-CD 3.3Å; A778-Q784 VanDerWaalsContact O-CG 3.24Å; A778-Q784 WeakPolarHBondContact O-CG 3.43Å; A778-Q784 PolarHBondContact O-OE1 3.24Å; T779-Q784 PolarHBondContact O-NE2 3.33Å; E780-Q784 VanDerWaalsContact C-NE2 3.29Å; G781-Q784 VanDerWaalsContact O-CG 3.25Å; G781-Q784 WeakPolarHBondContact O-CG 3.44Å; G781-Q784 PolarHBondContact O-NE2 2.92Å; Q784-C786 VanDerWaalsContact C-N 3.31Å
785	S	81.1	Confident	89.6	Confident	44 Å²	44	40 Å²	40	31%	0.308	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-2.2	179.9	61.2	0	0	0	0	114.4	F783 V1101	F783-S785 PolarHBondContact O-N 3.4Å; F783-S785 VanDerWaalsContact O-N 3.15Å; S785-V1101 VanDerWaalsContact O-CG2 3.32Å; S785-V1101 WeakPolarHBondContact O-CG2 3.48Å; S785-V1101 PolarHBondContact O-N 3.28Å
786	C	85.8	Confident	89.4	Confident	9 Å²	9	37.2 Å²	37.2	6%	0.061	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-33.1	-172.5	-58.2	0	0	0	0	112.6	F783 Q784 L788 P875 F878	F783-C786 HydrophobicContact CB-CB 4.3Å; F783-C786 PolarHBondContact O-N 3.21Å; Q784-C786 VanDerWaalsContact C-N 3.31Å; C786-L788 PolarHBondContact O-N 3.38Å; C786-P875 VanDerWaalsContact O-CD 3.23Å; C786-P875 WeakPolarHBondContact O-CD 3.44Å; C786-F878 HydrophobicContact CB-CD2 3.59Å; C786-F878 HydrophobicContact CB-CE2 3.52Å; C786-F878 HydrophobicContact CB-CG 4.42Å; C786-F878 HydrophobicContact CB-CZ 4.31Å
787	V	91.7	Very high	89.4	Confident	10 Å²	10	32.4 Å²	32.4	6%	0.061	17%	0.174	C	C	.	.			trans	-82.8	115.3	177	179.5	0	0	0	0	109.5	F95 E99 F783 R790 I872 V874	F95-V787 HydrophobicContact CE2-CG2 4.34Å; F95-V787 HydrophobicContact CZ-CG2 4.05Å; E99-V787 HydrophobicContact CB-CG2 4.45Å; E99-V787 HydrophobicContact CG-CG2 4.21Å; F783-V787 HydrophobicContact CB-CG2 4.28Å; F783-V787 PolarHBondContact O-N 2.97Å; F783-V787 VanDerWaalsContact O-N 3.11Å; V787-R790 HydrophobicContact CG1-CG 4.02Å; V787-I872 HydrophobicContact CG1-CB 4.33Å; V787-I872 HydrophobicContact CG1-CG2 4.3Å; V787-V874 HydrophobicContact CG2-CG1 4.47Å
788	L	90.7	Very high	89.4	Confident	7 Å²	7	32.2 Å²	32.2	4%	0.037	17%	0.173	C	C	.	.			trans	-74.8	-51.9	-178.4	-176.2	64.3	0	0	0	111.1	H702 C786 F841 V844 D873 V1101	H702-L788 PolarHBondContact CE1-O 2.6Å; H702-L788 VanDerWaalsContact CE1-O 3.23Å; H702-L788 WeakPolarHBondContact NE2-CD1 3.39Å; H702-L788 PolarHBondContact NE2-O 3.37Å; C786-L788 PolarHBondContact O-N 3.38Å; L788-F841 HydrophobicContact CD1-CB 4.37Å; L788-F841 HydrophobicContact CD1-CD1 3.78Å; L788-F841 HydrophobicContact CD1-CD2 3.51Å; L788-F841 HydrophobicContact CD1-CE1 3.8Å; L788-F841 HydrophobicContact CD1-CE2 3.54Å; L788-F841 HydrophobicContact CD1-CG 3.62Å; L788-F841 HydrophobicContact CD1-CZ 3.66Å; L788-F841 HydrophobicContact CD2-CB 4.01Å; L788-F841 HydrophobicContact CD2-CD2 3.84Å; L788-F841 HydrophobicContact CD2-CG 4.02Å; L788-F841 HydrophobicContact CG-CD2 4.23Å; L788-F841 HydrophobicContact CG-CE2 4.49Å; L788-F841 HydrophobicContact CG-CG 4.49Å; L788-V844 HydrophobicContact CD2-CG1 4.5Å; L788-V844 HydrophobicContact CD2-CG2 3.8Å; L788-D873 HydrophobicContact CB-CB 4.04Å; L788-D873 WeakPolarHBondContact CB-O 3.03Å; L788-D873 HydrophobicContact CD2-CB 4.32Å; L788-D873 PolarHBondContact N-O 2.85Å; L788-V1101 HydrophobicContact CB-CG2 4.44Å; L788-V1101 HydrophobicContact CD1-CG1 3.53Å; L788-V1101 HydrophobicContact CD1-CG2 4.4Å
789	R	93.1	Very high	89.7	Confident	22 Å²	22	31.5 Å²	31.5	8%	0.083	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	152.6	-178.3	-65.4	171	-150.9	117.5	-1.3	110.9	H702 Y791 F802 D837 S839 I872 D873	H702-R789 PolarHBondContact NE2-NE 2.84Å; R789-Y791 HydrophobicContact CB-CD1 4.17Å; R789-F802 CarbonylContact C-O 3.57Å; R789-F802 WeakPolarHBondContact CA-O 3.45Å; R789-D837 IonicContact CZ-OD1 3.18Å; R789-D837 VanDerWaalsContact CZ-OD1 3.26Å; R789-D837 IonicContact NH1-OD1 2.93Å; R789-D837 PolarHBondContact NH1-OD1 3.45Å; R789-D837 VanDerWaalsContact NH2-CG 3.29Å; R789-D837 IonicContact NH2-OD1 3.37Å; R789-D837 PolarHBondContact NH2-OD1 2.79Å; R789-D837 IonicContact NH2-OD2 3.91Å; R789-D837 PolarHBondContact NH2-OD2 2.78Å; R789-S839 PolarHBondContact NH2-OG 3.5Å; R789-I872 VanDerWaalsContact O-CA 3.25Å; R789-I872 WeakPolarHBondContact O-CA 3.35Å; R789-D873 HydrophobicContact CB-CB 4.38Å; R789-D873 IonicContact NH1-OD2 3.12Å; R789-D873 PolarHBondContact NH1-OD2 2.86Å; R789-D873 PolarHBondContact O-N 2.74Å
790	R	95.9	Very high	90.1	Very high	8 Å²	8	27.4 Å²	27.4	3%	0.03	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.8	167.1	-52.9	-179.4	174.3	69.3	1.2	108.1	E99 W774 V787 T801 F802 I872	E99-R790 WeakPolarHBondContact O-CD 3.46Å; E99-R790 PolarHBondContact O-NE 2.03Å; E99-R790 VanDerWaalsContact O-NE 3.1Å; E99-R790 IonicContact OE2-CZ 3.78Å; E99-R790 IonicContact OE2-NE 3.47Å; E99-R790 IonicContact OE2-NH2 3.62Å; E99-R790 PolarHBondContact OE2-NH2 2.04Å; W774-R790 HydrophobicContact CD2-CB 3.82Å; W774-R790 HydrophobicContact CE3-CB 4.18Å; W774-R790 HydrophobicContact CG-CB 4.22Å; W774-R790 HydrophobicContact CH2-CB 4.36Å; W774-R790 HydrophobicContact CZ2-CB 4.01Å; W774-R790 HydrophobicContact CZ3-CB 4.44Å; V787-R790 HydrophobicContact CG1-CG 4.02Å; R790-T801 CarbonylContact O-C 3.58Å; R790-T801 WeakPolarHBondContact O-CA 3.35Å; R790-F802 HydrophobicContact CB-CB 4.4Å; R790-F802 PolarHBondContact N-O 3.41Å; R790-F802 PolarHBondContact O-N 3.31Å; R790-I872 HydrophobicContact CB-CG2 4.26Å; R790-I872 HydrophobicContact CG-CG2 3.86Å
791	Y	96.2	Very high	90.5	Very high	13 Å²	13	21.5 Å²	21.5	5%	0.051	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	159.2	179.9	51.6	-85.1	0	0	0	111.7	W774 R789 M799 L800 W818 S846 A871 D873	W774-Y791 VanDerWaalsContact CH2-C 3.48Å; W774-Y791 VanDerWaalsContact CH2-CA 3.48Å; R789-Y791 HydrophobicContact CB-CD1 4.17Å; Y791-M799 HydrophobicContact CD2-CE 3.99Å; Y791-M799 HydrophobicContact CG-CE 4.15Å; Y791-L800 CarbonylContact C-O 3.58Å; Y791-L800 WeakPolarHBondContact CA-O 3.44Å; Y791-L800 WeakPolarHBondContact CB-O 3.5Å; Y791-W818 HydrophobicContact CD2-CD2 4.44Å; Y791-W818 AromaticContact CD2-CH2 3.88Å; Y791-W818 HydrophobicContact CD2-CH2 3.88Å; Y791-W818 AromaticContact CD2-CZ2 3.74Å; Y791-W818 HydrophobicContact CD2-CZ2 3.74Å; Y791-W818 HydrophobicContact CD2-CZ3 4.3Å; Y791-W818 AromaticContact CE2-CD2 3.64Å; Y791-W818 HydrophobicContact CE2-CD2 3.64Å; Y791-W818 AromaticContact CE2-CE2 3.45Å; Y791-W818 VanDerWaalsContact CE2-CE2 3.45Å; Y791-W818 HydrophobicContact CE2-CE3 4.03Å; Y791-W818 HydrophobicContact CE2-CG 4.08Å; Y791-W818 HydrophobicContact CE2-CH2 4.05Å; Y791-W818 AromaticContact CE2-CZ2 3.7Å; Y791-W818 HydrophobicContact CE2-CZ2 3.7Å; Y791-W818 HydrophobicContact CE2-CZ3 4.2Å; Y791-W818 AromaticContact CE2-NE1 3.72Å; Y791-S846 VanDerWaalsContact OH-CB 3.26Å; Y791-S846 WeakPolarHBondContact OH-CB 3.33Å; Y791-S846 PolarHBondContact OH-OG 3.48Å; Y791-S846 VanDerWaalsContact OH-OG 3.09Å; Y791-A871 HydrophobicContact CD2-CB 3.81Å; Y791-A871 HydrophobicContact CE1-CB 4.28Å; Y791-A871 HydrophobicContact CE2-CB 3.25Å; Y791-A871 PolarHBondContact N-O 2.88Å; Y791-A871 PolarHBondContact O-N 3.16Å; Y791-A871 VanDerWaalsContact O-O 3.08Å; Y791-D873 HydrophobicContact CE1-CB 4.37Å; Y791-D873 PolarHBondContact OH-OD1 3Å
792	L	96.4	Very high	90.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	147.9	178.1	79.1	89.3	0	0	0	108.6	L767 I770 W774 M799 L800 V869 L870	L767-L792 HydrophobicContact CB-CD1 4.48Å; L767-L792 HydrophobicContact CD1-CD1 3.51Å; L767-L792 HydrophobicContact CD2-CD1 3.69Å; L767-L792 HydrophobicContact CD2-CD2 4.43Å; L767-L792 HydrophobicContact CG-CD1 4.07Å; I770-L792 HydrophobicContact CD1-CD2 3.85Å; I770-L792 HydrophobicContact CG2-CD2 3.65Å; W774-L792 HydrophobicContact CH2-CB 3.94Å; W774-L792 HydrophobicContact CH2-CD2 3.7Å; W774-L792 HydrophobicContact CH2-CG 4.06Å; W774-L792 HydrophobicContact CZ2-CB 4.32Å; W774-L792 HydrophobicContact CZ2-CD2 4.16Å; W774-L792 HydrophobicContact CZ3-CD2 4.38Å; L792-M799 CarbonylContact O-C 3.59Å; L792-M799 WeakPolarHBondContact O-CA 3.33Å; L792-M799 VanDerWaalsContact O-CG 3.28Å; L792-M799 WeakPolarHBondContact O-CG 3.14Å; L792-L800 HydrophobicContact CD1-CG 4.49Å; L792-L800 HydrophobicContact CD2-CB 3.99Å; L792-L800 HydrophobicContact CD2-CD1 4.03Å; L792-L800 HydrophobicContact CD2-CG 4.26Å; L792-L800 HydrophobicContact CG-CB 3.91Å; L792-L800 HydrophobicContact CG-CG 4.31Å; L792-L800 PolarHBondContact N-O 2.72Å; L792-L800 PolarHBondContact O-N 3.14Å; L792-V869 CarbonylContact C-O 3.58Å; L792-V869 WeakPolarHBondContact CA-O 3.43Å; L792-L870 HydrophobicContact CB-CD2 3.6Å; L792-L870 HydrophobicContact CB-CG 4.48Å; L792-L870 HydrophobicContact CD2-CD2 4.23Å
793	A	95.1	Very high	91.3	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	151.1	170.1	0	0	0	0	0	112.1	V798 M799 P813 W818 F819 A868 V869	A793-V798 CarbonylContact C-O 3.56Å; A793-V798 WeakPolarHBondContact CA-O 3.39Å; A793-M799 HydrophobicContact CB-CB 4.46Å; A793-M799 HydrophobicContact CB-CG 4.41Å; A793-P813 HydrophobicContact CB-CB 3.5Å; A793-P813 VanDerWaalsContact CB-CB 3.5Å; A793-P813 HydrophobicContact CB-CG 3.67Å; A793-W818 HydrophobicContact CB-CH2 3.63Å; A793-W818 HydrophobicContact CB-CZ2 4.26Å; A793-F819 HydrophobicContact CB-CD2 4.06Å; A793-F819 HydrophobicContact CB-CE2 4.07Å; A793-A868 CarbonylContact O-C 3.58Å; A793-A868 VanDerWaalsContact O-CA 3.29Å; A793-A868 WeakPolarHBondContact O-CA 3.22Å; A793-V869 PolarHBondContact N-O 3.41Å; A793-V869 PolarHBondContact O-N 3.06Å
794	T	92	Very high	91.7	Very high	5 Å²	5	13.2 Å²	13.2	3%	0.031	7%	0.071	C	C	.	.			trans	-96.9	158.7	169.4	67.9	0	0	0	0	110.7	E763 L767 S796 G797 V798 A868	E763-T794 WeakPolarHBondContact OE2-CB 3.27Å; E763-T794 PolarHBondContact OE2-OG1 3Å; L767-T794 HydrophobicContact CD1-CG2 3.48Å; L767-T794 VanDerWaalsContact CD1-CG2 3.48Å; L767-T794 HydrophobicContact CG-CG2 4.48Å; T794-S796 PolarHBondContact O-N 3.18Å; T794-S796 PolarHBondContact OG1-OG 3.09Å; T794-G797 PolarHBondContact O-N 2.9Å; T794-V798 HydrophobicContact CG2-CB 4.25Å; T794-V798 PolarHBondContact N-O 2.69Å; T794-V798 WeakPolarHBondContact OG1-CB 3.32Å; T794-V798 PolarHBondContact OG1-N 3.27Å; T794-A868 HydrophobicContact CG2-CB 4.45Å
795	P	87.3	Confident	92.3	Very high	14 Å²	14	9.2 Å²	9.2	9%	0.091	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-27.5	173.6	-23	31.9	0	0	0	114.1	D569 V572 R719 G797 F819 V866 V867	D569-P795 HydrophobicContact CB-CB 4.07Å; D569-P795 VanDerWaalsContact O-CB 3.32Å; D569-P795 WeakPolarHBondContact O-CB 3.48Å; V572-P795 HydrophobicContact CG2-CB 4.4Å; V572-P795 HydrophobicContact CG2-CG 4.33Å; R719-P795 PolarHBondContact NH1-O 2.98Å; P795-G797 VanDerWaalsContact C-N 3.28Å; P795-G797 PolarHBondContact O-N 3.28Å; P795-F819 HydrophobicContact CG-CZ 4.33Å; P795-V866 WeakPolarHBondContact CG-O 3.45Å; P795-V867 WeakPolarHBondContact CD-O 3.31Å
796	S	86.1	Confident	92.8	Very high	15 Å²	15	7.4 Å²	7.4	11%	0.105	4%	0.04	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-9.1	175.9	84.3	0	0	0	0	113.9	R719 C720 I760 E763 T794	R719-S796 VanDerWaalsContact CD-C 3.45Å; R719-S796 WeakPolarHBondContact CD-O 3.18Å; R719-S796 WeakPolarHBondContact CG-O 3.38Å; C720-S796 PolarHBondContact SG-O 3.36Å; I760-S796 WeakPolarHBondContact CD1-OG 3.1Å; E763-S796 PolarHBondContact OE1-OG 3.34Å; E763-S796 PolarHBondContact OE2-OG 3.24Å; T794-S796 PolarHBondContact O-N 3.18Å; T794-S796 PolarHBondContact OG1-OG 3.09Å
797	G	91.3	Very high	93	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.041	C	C	.	.			trans	97.3	8	175	0	0	0	0	0	116.9	A717 R719 C720 T794 P795 M799	A717-G797 WeakPolarHBondContact CB-O 3.5Å; A717-G797 PolarHBondContact N-O 2.73Å; R719-G797 VanDerWaalsContact CD-CA 3.43Å; C720-G797 PolarHBondContact SG-O 3.16Å; T794-G797 PolarHBondContact O-N 2.9Å; P795-G797 VanDerWaalsContact C-N 3.28Å; P795-G797 PolarHBondContact O-N 3.28Å; G797-M799 PolarHBondContact O-N 3.44Å
798	V	93.8	Very high	92.8	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	126.8	171.5	179	0	0	0	0	108.2	L714 L716 I760 E763 I764 L767 A793 T794	L714-V798 HydrophobicContact CD1-CG1 4Å; L716-V798 HydrophobicContact CD2-CG1 4.43Å; L716-V798 HydrophobicContact CD2-CG2 4.11Å; I760-V798 HydrophobicContact CD1-CG2 4.08Å; I760-V798 HydrophobicContact CG2-CG2 3.9Å; E763-V798 HydrophobicContact CB-CG2 4.25Å; I764-V798 HydrophobicContact CG1-CG1 3.77Å; I764-V798 HydrophobicContact CG1-CG2 4.44Å; L767-V798 HydrophobicContact CD1-CG1 4.07Å; A793-V798 CarbonylContact C-O 3.56Å; A793-V798 WeakPolarHBondContact CA-O 3.39Å; T794-V798 HydrophobicContact CG2-CB 4.25Å; T794-V798 PolarHBondContact N-O 2.69Å; T794-V798 WeakPolarHBondContact OG1-CB 3.32Å; T794-V798 PolarHBondContact OG1-N 3.27Å
799	M	95.3	Very high	92.6	Very high	7 Å²	7	11.1 Å²	11.1	3%	0.034	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	134.1	-179.5	-171.4	-174.5	-174.7	0	0	111.2	Y715 Y791 L792 A793 G797 T801 Y811 P813	Y715-M799 HydrophobicContact CD1-CB 4.11Å; Y715-M799 HydrophobicContact CD1-SD 4.19Å; Y715-M799 PolarHBondContact N-O 3.36Å; Y715-M799 PolarHBondContact O-N 2.8Å; Y791-M799 HydrophobicContact CD2-CE 3.99Å; Y791-M799 HydrophobicContact CG-CE 4.15Å; L792-M799 CarbonylContact O-C 3.59Å; L792-M799 WeakPolarHBondContact O-CA 3.33Å; L792-M799 VanDerWaalsContact O-CG 3.28Å; L792-M799 WeakPolarHBondContact O-CG 3.14Å; A793-M799 HydrophobicContact CB-CB 4.46Å; A793-M799 HydrophobicContact CB-CG 4.41Å; G797-M799 PolarHBondContact O-N 3.44Å; M799-T801 HydrophobicContact CE-CG2 3.65Å; M799-T801 HydrophobicContact CG-CG2 4.23Å; M799-T801 HydrophobicContact SD-CG2 4.17Å; M799-Y811 HydrophobicContact CE-CE1 3.87Å; M799-Y811 HydrophobicContact SD-CD1 4.11Å; M799-Y811 HydrophobicContact SD-CE1 3.53Å; M799-Y811 VanDerWaalsContact SD-CE1 3.53Å; M799-P813 HydrophobicContact CB-CG 4.35Å; M799-P813 HydrophobicContact SD-CB 4.15Å; M799-P813 HydrophobicContact SD-CG 4.44Å
800	L	95.9	Very high	92	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	139.9	167.7	-57.7	-175.3	0	0	0	110.4	L684 V712 G713 L714 L767 I770 W774 Y791 L792	L684-L800 HydrophobicContact CD2-CD1 4.4Å; L684-L800 HydrophobicContact CD2-CD2 4.08Å; V712-L800 HydrophobicContact CG1-CB 3.81Å; V712-L800 HydrophobicContact CG1-CD1 4.4Å; V712-L800 HydrophobicContact CG1-CD2 4.44Å; V712-L800 HydrophobicContact CG1-CG 4.46Å; G713-L800 CarbonylContact O-C 3.58Å; G713-L800 WeakPolarHBondContact O-CA 3.04Å; L714-L800 HydrophobicContact CB-CD2 4.05Å; L714-L800 HydrophobicContact CD1-CD2 3.66Å; L714-L800 HydrophobicContact CG-CD2 4.45Å; L767-L800 HydrophobicContact CB-CD1 3.9Å; I770-L800 HydrophobicContact CG2-CD1 3.95Å; W774-L800 HydrophobicContact CZ3-CB 4.16Å; Y791-L800 CarbonylContact C-O 3.58Å; Y791-L800 WeakPolarHBondContact CA-O 3.44Å; Y791-L800 WeakPolarHBondContact CB-O 3.5Å; L792-L800 HydrophobicContact CD1-CG 4.49Å; L792-L800 HydrophobicContact CD2-CB 3.99Å; L792-L800 HydrophobicContact CD2-CD1 4.03Å; L792-L800 HydrophobicContact CD2-CG 4.26Å; L792-L800 HydrophobicContact CG-CB 3.91Å; L792-L800 HydrophobicContact CG-CG 4.31Å; L792-L800 PolarHBondContact N-O 2.72Å; L792-L800 PolarHBondContact O-N 3.14Å
801	T	95.6	Very high	91.6	Very high	9 Å²	9	14.8 Å²	14.8	6%	0.055	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	138.4	-179.7	54.5	0	0	0	0	111.7	V712 G713 R790 M799 P803 V805	V712-T801 CarbonylContact C-O 3.5Å; V712-T801 VanDerWaalsContact CA-O 3.3Å; V712-T801 WeakPolarHBondContact CA-O 3.18Å; V712-T801 WeakPolarHBondContact CG1-O 3.49Å; G713-T801 PolarHBondContact N-O 2.87Å; G713-T801 PolarHBondContact O-N 3.37Å; R790-T801 CarbonylContact O-C 3.58Å; R790-T801 WeakPolarHBondContact O-CA 3.35Å; M799-T801 HydrophobicContact CE-CG2 3.65Å; M799-T801 HydrophobicContact CG-CG2 4.23Å; M799-T801 HydrophobicContact SD-CG2 4.17Å; T801-P803 CarbonylContact C-O 3.6Å; T801-P803 CarbonylContact O-C 3.44Å; T801-V805 HydrophobicContact CG2-CG2 4.46Å
802	F	95.2	Very high	91.2	Very high	15 Å²	15	14.5 Å²	14.5	7%	0.066	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	128.3	171.1	-174.8	-90.4	0	0	0	110.6	C709 R711 V712 W774 A778 R789 R790	C709-F802 WeakPolarHBondContact O-CE2 3.5Å; C709-F802 WeakPolarHBondContact O-CZ 3.36Å; R711-F802 WeakPolarHBondContact O-CD2 3.38Å; V712-F802 HydrophobicContact CG2-CB 4.14Å; V712-F802 HydrophobicContact CG2-CD2 3.74Å; V712-F802 HydrophobicContact CG2-CG 4.35Å; W774-F802 HydrophobicContact CB-CB 4.38Å; W774-F802 HydrophobicContact CB-CG 4.38Å; W774-F802 HydrophobicContact CD2-CB 4.41Å; W774-F802 HydrophobicContact CE3-CB 3.7Å; W774-F802 HydrophobicContact CZ3-CB 4.34Å; A778-F802 HydrophobicContact CB-CD1 4.18Å; A778-F802 HydrophobicContact CB-CE1 3.21Å; A778-F802 HydrophobicContact CB-CZ 3.64Å; R789-F802 CarbonylContact C-O 3.57Å; R789-F802 WeakPolarHBondContact CA-O 3.45Å; R790-F802 HydrophobicContact CB-CB 4.4Å; R790-F802 PolarHBondContact N-O 3.41Å; R790-F802 PolarHBondContact O-N 3.31Å
803	P	93.9	Very high	90.9	Very high	8 Å²	8	14.5 Å²	14.5	5%	0.052	7%	0.073	C	C	.	.	S	Bend	cis	-59.5	162.3	-7.3	28.6	-36.1	0	0	0	111.6	H702 S708 T801 V805	H702-P803 HydrophobicContact CB-CG 4.48Å; S708-P803 WeakPolarHBondContact O-CB 3.46Å; T801-P803 CarbonylContact C-O 3.6Å; T801-P803 CarbonylContact O-C 3.44Å; P803-V805 HydrophobicContact CG-CG1 4.3Å; P803-V805 PolarHBondContact O-N 2.93Å
804	A	93.7	Very high	90.6	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	122.7	171.6	0	0	0	0	0	108.2	L689 A707 S708 R711 G713	L689-A804 HydrophobicContact CD1-CB 4.37Å; L689-A804 HydrophobicContact CD2-CB 4.43Å; A707-A804 CarbonylContact C-O 3.49Å; A707-A804 WeakPolarHBondContact CA-O 3.43Å; A707-A804 VanDerWaalsContact CB-O 3.3Å; A707-A804 WeakPolarHBondContact CB-O 3.42Å; S708-A804 PolarHBondContact N-O 2.98Å; S708-A804 PolarHBondContact O-N 3.18Å; R711-A804 HydrophobicContact CB-CB 4.05Å; R711-A804 WeakPolarHBondContact O-CB 3.41Å; R711-A804 PolarHBondContact O-N 3.2Å; G713-A804 VanDerWaalsContact N-CB 3.29Å
805	V	92.2	Very high	90.2	Very high	8 Å²	8	16 Å²	16	5%	0.048	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	148.1	-179.1	-68.9	0	0	0	0	110.9	M705 A707 T801 P803 T807	M705-V805 HydrophobicContact SD-CB 4.48Å; A707-V805 HydrophobicContact CB-CG1 3.96Å; T801-V805 HydrophobicContact CG2-CG2 4.46Å; P803-V805 HydrophobicContact CG-CG1 4.3Å; P803-V805 PolarHBondContact O-N 2.93Å; V805-T807 PolarHBondContact O-N 2.91Å; V805-T807 PolarHBondContact O-OG1 3.38Å
806	L	91.3	Very high	90.2	Very high	5 Å²	5	16.8 Å²	16.8	3%	0.026	8%	0.081	C	C	.	.			trans	-60.5	125.1	167.6	-169.2	66.2	0	0	0	109.4	H687 D690 L706 A1066 M1067 P1068	H687-L806 WeakPolarHBondContact O-CA 3.46Å; H687-L806 WeakPolarHBondContact O-CD1 3.44Å; D690-L806 WeakPolarHBondContact OD1-CD1 3.44Å; L706-L806 PolarHBondContact O-N 3.38Å; L806-A1066 HydrophobicContact CB-CB 4.16Å; L806-A1066 HydrophobicContact CD2-CB 4.03Å; L806-A1066 HydrophobicContact CG-CB 3.69Å; L806-A1066 WeakPolarHBondContact O-CB 3.46Å; L806-M1067 VanDerWaalsContact CD2-C 3.49Å; L806-P1068 HydrophobicContact CD2-CB 4.45Å; L806-P1068 HydrophobicContact CD2-CG 4.21Å
807	T	90.1	Very high	90.3	Very high	16 Å²	16	18.6 Å²	18.6	10%	0.098	9%	0.089	C	C	.	.			trans	-116.5	139.3	-177.3	-54.5	0	0	0	0	109.8	H687 Y715 V805 Y811	H687-T807 PolarHBondContact CD2-O 3.37Å; H687-T807 VanDerWaalsContact CD2-O 3.27Å; Y715-T807 HydrophobicContact CD1-CG2 3.94Å; Y715-T807 HydrophobicContact CD2-CG2 3.8Å; Y715-T807 HydrophobicContact CE1-CG2 4.09Å; Y715-T807 HydrophobicContact CE2-CG2 3.95Å; Y715-T807 HydrophobicContact CG-CG2 3.78Å; V805-T807 PolarHBondContact O-N 2.91Å; V805-T807 PolarHBondContact O-OG1 3.38Å; T807-Y811 HydrophobicContact CG2-CD1 4.07Å; T807-Y811 HydrophobicContact CG2-CG 3.99Å
808	H	87.1	Confident	90.4	Very high	56 Å²	56	19.1 Å²	19.1	26%	0.259	9%	0.091	S	C	.	.			trans	-68.8	138.3	-178	-171.9	-93.5	0	0	0	110.6	Y715 Q810 Y811 L1064 A1066	Y715-H808 PolarHBondContact OH-O 3.49Å; H808-Q810 PolarHBondContact ND1-N 2.95Å; H808-Q810 PolarHBondContact O-N 3.49Å; H808-Q810 VanDerWaalsContact O-N 3.1Å; H808-Y811 WeakPolarHBondContact O-CB 3.44Å; H808-Y811 PolarHBondContact O-N 3.08Å; H808-L1064 HydrophobicContact CB-CB 4.34Å; H808-A1066 HydrophobicContact CB-CB 4.26Å
809	Q	86.2	Confident	90.3	Very high	32 Å²	32	19.2 Å²	19.2	15%	0.15	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.7	-172.5	-173.6	169.6	-18.7	0	0	114.3	Y715 R727 A730 E732	Y715-Q809 PolarHBondContact OH-O 3.07Å; Y715-Q809 VanDerWaalsContact OH-O 3.13Å; R727-Q809 VanDerWaalsContact O-CD 3.23Å; R727-Q809 VanDerWaalsContact O-CG 3.31Å; R727-Q809 WeakPolarHBondContact O-CG 3.37Å; R727-Q809 PolarHBondContact O-NE2 3.36Å; A730-Q809 PolarHBondContact O-NE2 3.47Å; E732-Q809 VanDerWaalsContact N-OE1 3.15Å
810	Q	81.8	Confident	89.9	Confident	67 Å²	67	20.6 Å²	20.6	31%	0.313	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	2.9	177.9	-55.2	-177.5	-15.6	0	0	113.7	F728 H808 D812	F728-Q810 HydrophobicContact CD1-CB 4.25Å; F728-Q810 HydrophobicContact CD1-CG 3.65Å; F728-Q810 HydrophobicContact CE1-CB 3.91Å; F728-Q810 HydrophobicContact CE1-CG 3.85Å; H808-Q810 PolarHBondContact ND1-N 2.95Å; H808-Q810 PolarHBondContact O-N 3.49Å; H808-Q810 VanDerWaalsContact O-N 3.1Å; Q810-D812 PolarHBondContact O-N 3.47Å
811	Y	87.4	Confident	89.7	Confident	40 Å²	40	21.3 Å²	21.3	16%	0.157	10%	0.101	C	C	.	.			trans	-67.5	127.4	-179.3	-175.6	-87.7	0	0	0	110.1	Y715 M799 T807 H808 P813 R816	Y715-Y811 HydrophobicContact CD1-CD1 4.4Å; Y715-Y811 AromaticContact CE1-CD1 3.95Å; Y715-Y811 HydrophobicContact CE1-CD1 3.95Å; Y715-Y811 WeakPolarHBondContact CE1-O 3.4Å; Y715-Y811 VanDerWaalsContact CZ-O 3.31Å; Y715-Y811 PolarHBondContact OH-N 3.19Å; Y715-Y811 PolarHBondContact OH-O 2.66Å; M799-Y811 HydrophobicContact CE-CE1 3.87Å; M799-Y811 HydrophobicContact SD-CD1 4.11Å; M799-Y811 HydrophobicContact SD-CE1 3.53Å; M799-Y811 VanDerWaalsContact SD-CE1 3.53Å; T807-Y811 HydrophobicContact CG2-CD1 4.07Å; T807-Y811 HydrophobicContact CG2-CG 3.99Å; H808-Y811 WeakPolarHBondContact O-CB 3.44Å; H808-Y811 PolarHBondContact O-N 3.08Å; Y811-P813 HydrophobicContact CE1-CB 3.94Å; Y811-R816 HydrophobicContact CE2-CG 4.47Å; Y811-R816 VanDerWaalsContact CE2-CZ 3.45Å
812	D	88	Confident	89.6	Confident	7 Å²	7	20.9 Å²	20.9	4%	0.037	10%	0.098	C	C	.	.			trans	-119.4	110.3	171.8	-170.5	-13.6	0	0	0	109.3	R719 Q810 V814 Q815	R719-D812 IonicContact CZ-OD1 3.37Å; R719-D812 IonicContact CZ-OD2 3.91Å; R719-D812 VanDerWaalsContact CZ-OD2 3.3Å; R719-D812 IonicContact NE-OD1 3.92Å; R719-D812 PolarHBondContact NE-OD1 3.17Å; R719-D812 VanDerWaalsContact NE-OD1 3.11Å; R719-D812 IonicContact NE-OD2 3.33Å; R719-D812 PolarHBondContact NE-OD2 2.91Å; R719-D812 IonicContact NH2-OD1 3.72Å; R719-D812 IonicContact NH2-OD2 2.73Å; R719-D812 PolarHBondContact NH2-OD2 3.48Å; Q810-D812 PolarHBondContact O-N 3.47Å; D812-V814 PolarHBondContact O-N 3.16Å; D812-V814 WeakPolarHBondContact OD1-CB 3.46Å; D812-V814 PolarHBondContact OD1-N 3Å; D812-Q815 HydrophobicContact CB-CB 4.31Å; D812-Q815 HydrophobicContact CB-CG 4.11Å; D812-Q815 PolarHBondContact O-N 3.09Å
813	P	90.5	Very high	89.2	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-63.7	-28.2	-179.2	25.5	-33.3	0	0	0	112.6	A793 M799 Y811 Q815 R816 W818 F819	A793-P813 HydrophobicContact CB-CB 3.5Å; A793-P813 VanDerWaalsContact CB-CB 3.5Å; A793-P813 HydrophobicContact CB-CG 3.67Å; M799-P813 HydrophobicContact CB-CG 4.35Å; M799-P813 HydrophobicContact SD-CB 4.15Å; M799-P813 HydrophobicContact SD-CG 4.44Å; Y811-P813 HydrophobicContact CE1-CB 3.94Å; P813-Q815 PolarHBondContact O-N 3.39Å; P813-R816 WeakPolarHBondContact O-CB 3.43Å; P813-R816 PolarHBondContact O-N 2.93Å; P813-W818 HydrophobicContact CB-CH2 4.37Å; P813-W818 HydrophobicContact CB-CZ2 3.8Å; P813-F819 WeakPolarHBondContact O-CB 3.49Å
814	V	87.7	Confident	88.8	Confident	5 Å²	5	25.6 Å²	25.6	3%	0.03	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-75.7	-18.2	-175.5	-177.9	0	0	0	0	112	D812 R816 F819 Q820	D812-V814 PolarHBondContact O-N 3.16Å; D812-V814 WeakPolarHBondContact OD1-CB 3.46Å; D812-V814 PolarHBondContact OD1-N 3Å; V814-R816 VanDerWaalsContact C-N 3.34Å; V814-F819 HydrophobicContact CB-CD1 4.25Å; V814-F819 HydrophobicContact CB-CE1 4.23Å; V814-F819 HydrophobicContact CG1-CD1 3.93Å; V814-F819 HydrophobicContact CG1-CE1 3.68Å; V814-F819 HydrophobicContact CG1-CZ 4.35Å; V814-F819 HydrophobicContact CG2-CE1 4.18Å; V814-F819 HydrophobicContact CG2-CE2 4.3Å; V814-F819 HydrophobicContact CG2-CZ 4.06Å; V814-Q820 WeakPolarHBondContact O-CG 3.45Å
815	Q	83.9	Confident	88.5	Confident	33 Å²	33	26.9 Å²	26.9	15%	0.154	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-88.8	0.6	173.8	-65.7	-177.3	-13.4	0	0	113	D812 P813	D812-Q815 HydrophobicContact CB-CB 4.31Å; D812-Q815 HydrophobicContact CB-CG 4.11Å; D812-Q815 PolarHBondContact O-N 3.09Å; P813-Q815 PolarHBondContact O-N 3.39Å
816	R	87	Confident	88.2	Confident	29 Å²	29	27.6 Å²	27.6	11%	0.109	13%	0.133	C	C	.	.	S	Bend	trans	-89.6	147.7	-178.2	-60.9	-64.5	-170.9	161.6	-17.4	111.8	Y811 P813 V814 W818 F819 Q820 K1061 E1062	Y811-R816 HydrophobicContact CE2-CG 4.47Å; Y811-R816 VanDerWaalsContact CE2-CZ 3.45Å; P813-R816 WeakPolarHBondContact O-CB 3.43Å; P813-R816 PolarHBondContact O-N 2.93Å; V814-R816 VanDerWaalsContact C-N 3.34Å; R816-W818 VanDerWaalsContact C-N 3.31Å; R816-W818 VanDerWaalsContact CB-CD1 3.45Å; R816-W818 HydrophobicContact CB-CG 4.29Å; R816-W818 VanDerWaalsContact CB-NE1 3.28Å; R816-W818 PolarHBondContact O-N 2.9Å; R816-F819 PolarHBondContact O-N 2.78Å; R816-Q820 PolarHBondContact O-N 2.97Å; R816-K1061 PolarHBondContact NH1-O 2.91Å; R816-E1062 PolarHBondContact NH2-O 2.83Å; R816-E1062 VanDerWaalsContact NH2-O 3.13Å
817	D	88.4	Confident	88	Confident	54 Å²	54	29.4 Å²	29.4	29%	0.289	15%	0.146	S	C	.	.	H	α-helix	trans	-57.8	-40.9	-178.5	-67.7	-46.1	0	0	0	112.9	F819 Q820 R821 T832 S1060	D817-F819 PolarHBondContact O-N 3.23Å; D817-Q820 PolarHBondContact O-N 3.46Å; D817-R821 WeakPolarHBondContact O-CB 3.42Å; D817-R821 VanDerWaalsContact O-CG 3.27Å; D817-R821 WeakPolarHBondContact O-CG 3.24Å; D817-R821 PolarHBondContact O-N 3.02Å; D817-T832 HydrophobicContact CB-CG2 4.48Å; D817-S1060 VanDerWaalsContact OD2-CB 3.28Å; D817-S1060 WeakPolarHBondContact OD2-CB 3.43Å; D817-S1060 PolarHBondContact OD2-OG 3.31Å
818	W	92.5	Very high	88.1	Confident	10 Å²	10	30.7 Å²	30.7	4%	0.038	15%	0.15	C	C	.	.	H	α-helix	trans	-59.3	-35.6	177.8	69.3	-100.5	0	0	0	112.1	Y791 A793 P813 R816 A822 T832 S848 V869 A871	Y791-W818 HydrophobicContact CD2-CD2 4.44Å; Y791-W818 AromaticContact CD2-CH2 3.88Å; Y791-W818 HydrophobicContact CD2-CH2 3.88Å; Y791-W818 AromaticContact CD2-CZ2 3.74Å; Y791-W818 HydrophobicContact CD2-CZ2 3.74Å; Y791-W818 HydrophobicContact CD2-CZ3 4.3Å; Y791-W818 AromaticContact CE2-CD2 3.64Å; Y791-W818 HydrophobicContact CE2-CD2 3.64Å; Y791-W818 AromaticContact CE2-CE2 3.45Å; Y791-W818 VanDerWaalsContact CE2-CE2 3.45Å; Y791-W818 HydrophobicContact CE2-CE3 4.03Å; Y791-W818 HydrophobicContact CE2-CG 4.08Å; Y791-W818 HydrophobicContact CE2-CH2 4.05Å; Y791-W818 AromaticContact CE2-CZ2 3.7Å; Y791-W818 HydrophobicContact CE2-CZ2 3.7Å; Y791-W818 HydrophobicContact CE2-CZ3 4.2Å; Y791-W818 AromaticContact CE2-NE1 3.72Å; A793-W818 HydrophobicContact CB-CH2 3.63Å; A793-W818 HydrophobicContact CB-CZ2 4.26Å; P813-W818 HydrophobicContact CB-CH2 4.37Å; P813-W818 HydrophobicContact CB-CZ2 3.8Å; R816-W818 VanDerWaalsContact C-N 3.31Å; R816-W818 VanDerWaalsContact CB-CD1 3.45Å; R816-W818 HydrophobicContact CB-CG 4.29Å; R816-W818 VanDerWaalsContact CB-NE1 3.28Å; R816-W818 PolarHBondContact O-N 2.9Å; W818-A822 WeakPolarHBondContact O-CB 3.38Å; W818-A822 PolarHBondContact O-N 2.9Å; W818-T832 HydrophobicContact CB-CG2 4.49Å; W818-S848 PolarHBondContact O-OG 2.91Å; W818-V869 HydrophobicContact CE3-CB 4.45Å; W818-V869 HydrophobicContact CE3-CG1 3.78Å; W818-V869 HydrophobicContact CZ3-CB 3.82Å; W818-V869 HydrophobicContact CZ3-CG1 3.6Å; W818-A871 HydrophobicContact CD2-CB 4.18Å; W818-A871 HydrophobicContact CE3-CB 3.65Å; W818-A871 HydrophobicContact CZ3-CB 4.03Å
819	F	92.6	Very high	88.6	Confident	2 Å²	2	28 Å²	28	1%	0.009	14%	0.138	C	C	.	.	H	α-helix	trans	-77.9	-53.2	178.4	-171	-80.1	0	0	0	110.4	A793 P795 P813 V814 R816 D817 R821 A822 V823 V869	A793-F819 HydrophobicContact CB-CD2 4.06Å; A793-F819 HydrophobicContact CB-CE2 4.07Å; P795-F819 HydrophobicContact CG-CZ 4.33Å; P813-F819 WeakPolarHBondContact O-CB 3.49Å; V814-F819 HydrophobicContact CB-CD1 4.25Å; V814-F819 HydrophobicContact CB-CE1 4.23Å; V814-F819 HydrophobicContact CG1-CD1 3.93Å; V814-F819 HydrophobicContact CG1-CE1 3.68Å; V814-F819 HydrophobicContact CG1-CZ 4.35Å; V814-F819 HydrophobicContact CG2-CE1 4.18Å; V814-F819 HydrophobicContact CG2-CE2 4.3Å; V814-F819 HydrophobicContact CG2-CZ 4.06Å; R816-F819 PolarHBondContact O-N 2.78Å; D817-F819 PolarHBondContact O-N 3.23Å; F819-R821 PolarHBondContact O-N 2.87Å; F819-A822 PolarHBondContact O-N 2.96Å; F819-V823 HydrophobicContact CD1-CG2 4.13Å; F819-V823 HydrophobicContact CE1-CG2 3.83Å; F819-V823 HydrophobicContact CZ-CG2 4.47Å; F819-V823 WeakPolarHBondContact O-CG2 3.38Å; F819-V823 PolarHBondContact O-N 3.27Å; F819-V869 HydrophobicContact CD2-CB 3.73Å; F819-V869 HydrophobicContact CD2-CG2 3.71Å; F819-V869 HydrophobicContact CE1-CG2 4.45Å; F819-V869 HydrophobicContact CE2-CB 3.88Å; F819-V869 HydrophobicContact CE2-CG2 3.6Å; F819-V869 HydrophobicContact CG-CB 4.48Å; F819-V869 HydrophobicContact CG-CG2 4.2Å; F819-V869 HydrophobicContact CZ-CG2 3.99Å
820	Q	88	Confident	89.1	Confident	37 Å²	37	26.5 Å²	26.5	17%	0.173	13%	0.131	C	C	.	.	H	α-helix	trans	-62.3	-42.6	-176.3	-67.3	-175.6	-7.9	0	0	112.2	V814 R816 D817 V823 Q824	V814-Q820 WeakPolarHBondContact O-CG 3.45Å; R816-Q820 PolarHBondContact O-N 2.97Å; D817-Q820 PolarHBondContact O-N 3.46Å; Q820-V823 PolarHBondContact O-N 2.72Å; Q820-Q824 VanDerWaalsContact O-CG 3.29Å; Q820-Q824 WeakPolarHBondContact O-CG 3.11Å; Q820-Q824 PolarHBondContact O-N 3.21Å
821	R	90.3	Very high	89.8	Confident	15 Å²	15	23.3 Å²	23.3	6%	0.057	12%	0.116	C	C	.	.	H	α-helix	trans	-72.7	-31.7	179.9	-63.9	-142.3	-59.7	-167.8	-14	112.7	D817 F819 Q824 H825 V830 I831 T832 D901 D902	D817-R821 WeakPolarHBondContact O-CB 3.42Å; D817-R821 VanDerWaalsContact O-CG 3.27Å; D817-R821 WeakPolarHBondContact O-CG 3.24Å; D817-R821 PolarHBondContact O-N 3.02Å; F819-R821 PolarHBondContact O-N 2.87Å; R821-Q824 PolarHBondContact O-N 2.85Å; R821-H825 PolarHBondContact O-N 3.48Å; R821-H825 PolarHBondContact O-ND1 2.91Å; R821-V830 HydrophobicContact CB-CG1 3.62Å; R821-I831 PolarHBondContact NH2-O 3.43Å; R821-T832 HydrophobicContact CB-CG2 4.14Å; R821-T832 HydrophobicContact CG-CG2 4.39Å; R821-T832 VanDerWaalsContact NE-CG2 3.25Å; R821-D901 IonicContact CZ-OD2 2.71Å; R821-D901 IonicContact NH1-OD2 3.65Å; R821-D901 PolarHBondContact NH1-OD2 2.77Å; R821-D901 IonicContact NH2-OD2 2.78Å; R821-D901 PolarHBondContact NH2-OD2 3.01Å; R821-D902 IonicContact CZ-OD1 2.91Å; R821-D902 IonicContact NE-OD1 2.98Å; R821-D902 IonicContact NH1-OD1 2.74Å; R821-D902 PolarHBondContact NH1-OD1 3.16Å; R821-D902 IonicContact NH1-OD2 2.72Å
822	A	93.1	Very high	90	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.1	-42.8	171.3	0	0	0	0	0	111.4	W818 F819 Q824 H825 T850 V869	W818-A822 WeakPolarHBondContact O-CB 3.38Å; W818-A822 PolarHBondContact O-N 2.9Å; F819-A822 PolarHBondContact O-N 2.96Å; A822-Q824 VanDerWaalsContact C-N 3.33Å; A822-Q824 PolarHBondContact O-N 3.31Å; A822-H825 CarbonylContact O-C 3.54Å; A822-H825 PolarHBondContact O-N 2.89Å; A822-T850 HydrophobicContact CB-CG2 4.13Å; A822-T850 WeakPolarHBondContact O-CG2 3.34Å; A822-V869 HydrophobicContact CB-CG1 3.49Å; A822-V869 VanDerWaalsContact CB-CG1 3.49Å; A822-V869 HydrophobicContact CB-CG2 4.3Å
823	V	88.2	Confident	89.8	Confident	39 Å²	39	21.8 Å²	21.8	24%	0.236	11%	0.114	C	C	.	.	H	α-helix	trans	-65.5	-34.7	174.7	175.1	0	0	0	0	111.8	V572 F819 Q820 H825 P826 V866 V869	V572-V823 HydrophobicContact CG2-CG1 4.29Å; F819-V823 HydrophobicContact CD1-CG2 4.13Å; F819-V823 HydrophobicContact CE1-CG2 3.83Å; F819-V823 HydrophobicContact CZ-CG2 4.47Å; F819-V823 WeakPolarHBondContact O-CG2 3.38Å; F819-V823 PolarHBondContact O-N 3.27Å; Q820-V823 PolarHBondContact O-N 2.72Å; V823-H825 VanDerWaalsContact C-N 3.34Å; V823-P826 WeakPolarHBondContact O-CD 3.15Å; V823-V866 HydrophobicContact CG2-CG1 4.4Å; V823-V869 HydrophobicContact CG2-CG2 4.11Å
824	Q	84.4	Confident	89.5	Confident	82 Å²	82	22 Å²	22	38%	0.383	12%	0.115	S	C	.	.	H	α-helix	trans	-71.3	-26.5	175.2	-72.2	165.1	20.6	0	0	113.6	Q820 R821 A822 P826 N1057	Q820-Q824 VanDerWaalsContact O-CG 3.29Å; Q820-Q824 WeakPolarHBondContact O-CG 3.11Å; Q820-Q824 PolarHBondContact O-N 3.21Å; R821-Q824 PolarHBondContact O-N 2.85Å; A822-Q824 VanDerWaalsContact C-N 3.33Å; A822-Q824 PolarHBondContact O-N 3.31Å; Q824-P826 WeakPolarHBondContact O-CD 3.32Å; Q824-N1057 PolarHBondContact NE2-ND2 3.3Å; Q824-N1057 VanDerWaalsContact NE2-ND2 3.11Å
825	H	88.4	Confident	89.3	Confident	27 Å²	27	24.8 Å²	24.8	13%	0.125	13%	0.13	C	C	.	.	S	Bend	trans	-122.5	65.8	178.3	-60.6	96.6	0	0	0	111.3	R821 A822 V823 K828 V830 D902	R821-H825 PolarHBondContact O-N 3.48Å; R821-H825 PolarHBondContact O-ND1 2.91Å; A822-H825 CarbonylContact O-C 3.54Å; A822-H825 PolarHBondContact O-N 2.89Å; V823-H825 VanDerWaalsContact C-N 3.34Å; H825-K828 HydrophobicContact CB-CB 4.3Å; H825-K828 HydrophobicContact CB-CD 4.25Å; H825-K828 PolarHBondContact O-N 2.99Å; H825-V830 HydrophobicContact CB-CG2 3.59Å; H825-D902 IonicContact CE1-OD2 3.26Å
826	P	86.1	Confident	89.1	Confident	24 Å²	24	25.3 Å²	25.3	16%	0.156	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	147.9	-179	5.8	-5.6	0	0	0	111.5	V823 Q824 K828 Y852 V862	V823-P826 WeakPolarHBondContact O-CD 3.15Å; Q824-P826 WeakPolarHBondContact O-CD 3.32Å; P826-K828 PolarHBondContact O-N 2.87Å; P826-K828 VanDerWaalsContact O-N 3.11Å; P826-Y852 VanDerWaalsContact C-OH 3.31Å; P826-Y852 HydrophobicContact CB-CE1 4.35Å; P826-Y852 WeakPolarHBondContact CB-OH 3.44Å; P826-V862 HydrophobicContact CB-CG1 4Å; P826-V862 HydrophobicContact CG-CG1 3.64Å
827	S	87	Confident	89.1	Confident	43 Å²	43	24.5 Å²	24.5	30%	0.301	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	6.3	-179.2	-63.7	0	0	0	0	115.8	T850 Y852	S827-T850 PolarHBondContact N-OG1 3.05Å; S827-T850 VanDerWaalsContact N-OG1 3.17Å; S827-Y852 PolarHBondContact N-OH 2.84Å; S827-Y852 WeakPolarHBondContact OG-CE2 3.27Å; S827-Y852 PolarHBondContact OG-OH 2.85Å
828	K	92.6	Very high	88.7	Confident	42 Å²	42	23.2 Å²	23.2	18%	0.183	13%	0.126	C	C	.	.	S	Bend	trans	-107.7	154.5	175.3	-59.5	-171.5	-175.6	-179.1	0	110.5	H825 P826 V830 Q988	H825-K828 HydrophobicContact CB-CB 4.3Å; H825-K828 HydrophobicContact CB-CD 4.25Å; H825-K828 PolarHBondContact O-N 2.99Å; P826-K828 PolarHBondContact O-N 2.87Å; P826-K828 VanDerWaalsContact O-N 3.11Å; K828-V830 PolarHBondContact O-N 3.48Å; K828-Q988 WeakPolarHBondContact CA-O 3.15Å; K828-Q988 WeakPolarHBondContact CB-O 3.07Å
829	V	96	Very high	88.2	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.006	12%	0.124	C	C	.	.	B	Isolated β-bridge	trans	-80.1	115.4	164.8	174.9	0	0	0	0	108.1	R93 A96 L847 Q988 T989	R93-V829 HydrophobicContact CG-CG2 3.98Å; A96-V829 HydrophobicContact CB-CB 4.45Å; A96-V829 HydrophobicContact CB-CG1 3.68Å; A96-V829 HydrophobicContact CB-CG2 3.83Å; V829-L847 HydrophobicContact CG1-CD2 4.36Å; V829-Q988 PolarHBondContact N-O 3.04Å; V829-Q988 VanDerWaalsContact N-O 3.11Å; V829-T989 HydrophobicContact CB-CG2 4.42Å; V829-T989 WeakPolarHBondContact O-CA 3.49Å; V829-T989 WeakPolarHBondContact O-CB 2.93Å
830	V	96.7	Very high	87.7	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	122.9	-177.2	177.3	0	0	0	0	109.8	R821 H825 K828 T832 L847 S848 N990	R821-V830 HydrophobicContact CB-CG1 3.62Å; H825-V830 HydrophobicContact CB-CG2 3.59Å; K828-V830 PolarHBondContact O-N 3.48Å; V830-T832 HydrophobicContact CG1-CG2 3.94Å; V830-L847 CarbonylContact O-C 3.54Å; V830-L847 WeakPolarHBondContact O-CA 3.43Å; V830-S848 WeakPolarHBondContact CB-OG 3.46Å; V830-S848 PolarHBondContact N-O 3.43Å; V830-S848 PolarHBondContact O-N 2.9Å; V830-S848 PolarHBondContact O-OG 2.84Å; V830-N990 WeakPolarHBondContact CA-OD1 2.98Å
831	I	96.3	Very high	87.5	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	129.1	177.6	-48.9	-169.2	0	0	0	108.4	L92 R821 V845 S846 L847 L879 V907 N990 V991	L92-I831 HydrophobicContact CD1-CD1 3.98Å; L92-I831 HydrophobicContact CD2-CD1 4.09Å; R821-I831 PolarHBondContact NH2-O 3.43Å; I831-V845 HydrophobicContact CG2-CB 4.38Å; I831-S846 CarbonylContact C-O 3.45Å; I831-S846 WeakPolarHBondContact CA-O 2.99Å; I831-L847 HydrophobicContact CD1-CD2 4.46Å; I831-L847 HydrophobicContact CD1-CG 4.41Å; I831-L847 HydrophobicContact CG1-CG 4.16Å; I831-L879 HydrophobicContact CD1-CD1 4.11Å; I831-L879 HydrophobicContact CG2-CD1 4Å; I831-V907 HydrophobicContact CG2-CB 3.99Å; I831-V907 HydrophobicContact CG2-CG1 4.13Å; I831-V907 HydrophobicContact CG2-CG2 4.05Å; I831-N990 PolarHBondContact N-OD1 3.07Å; I831-N990 PolarHBondContact O-ND2 3.33Å; I831-V991 HydrophobicContact CB-CG1 3.81Å; I831-V991 HydrophobicContact CD1-CG1 3.99Å; I831-V991 HydrophobicContact CD1-CG2 4.3Å; I831-V991 HydrophobicContact CG1-CG1 4.04Å
832	T	93	Very high	87.2	Confident	2 Å²	2	21.8 Å²	21.8	1%	0.012	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	150.7	179.2	70.5	0	0	0	0	113	D817 W818 R821 V830 V845 S846	D817-T832 HydrophobicContact CB-CG2 4.48Å; W818-T832 HydrophobicContact CB-CG2 4.49Å; R821-T832 HydrophobicContact CB-CG2 4.14Å; R821-T832 HydrophobicContact CG-CG2 4.39Å; R821-T832 VanDerWaalsContact NE-CG2 3.25Å; V830-T832 HydrophobicContact CG1-CG2 3.94Å; T832-V845 WeakPolarHBondContact O-CA 3.4Å; T832-S846 PolarHBondContact N-O 3.07Å; T832-S846 PolarHBondContact O-N 2.92Å
833	G	82.6	Confident	86.7	Confident	12 Å²	12	22.4 Å²	22.4	12%	0.124	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	114.6	-158.7	-175.9	0	0	0	0	0	111.1
834	P	84.9	Confident	86.8	Confident	4 Å²	4	21 Å²	21	3%	0.026	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-73.9	143.4	1.3	28.8	-33.8	0	0	0	112.7	H843 V844 V845 V876 I906 L925	P834-H843 HydrophobicContact CB-CB 4.32Å; P834-V844 WeakPolarHBondContact CA-O 3.49Å; P834-V845 HydrophobicContact CB-CG1 4.05Å; P834-V876 HydrophobicContact CB-CG2 4.31Å; P834-I906 WeakPolarHBondContact CD-O 3.32Å; P834-I906 WeakPolarHBondContact CG-O 3.41Å; P834-L925 HydrophobicContact CB-CD1 4.25Å; P834-L925 HydrophobicContact CG-CB 4.12Å; P834-L925 HydrophobicContact CG-CD1 3.37Å; P834-L925 HydrophobicContact CG-CG 4.33Å
835	N	83.1	Confident	87.2	Confident	64 Å²	64	17 Å²	17	34%	0.342	10%	0.098	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	146.9	174.3	-67.7	-43	0	0	0	110	D837 H843 V844	N835-D837 PolarHBondContact O-N 3.35Å; N835-H843 WeakPolarHBondContact O-CA 2.97Å; N835-V844 PolarHBondContact N-O 3.44Å; N835-V844 PolarHBondContact O-N 2.97Å
836	I	80.7	Confident	87.5	Confident	44 Å²	44	16.3 Å²	16.3	23%	0.226	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	118.8	171.9	-62.9	168.9	0	0	0	108	P1136 Y1137	I836-P1136 HydrophobicContact CD1-CB 4.05Å; I836-P1136 HydrophobicContact CG1-CB 4.45Å; I836-P1136 HydrophobicContact CG2-CB 4.19Å; I836-P1136 HydrophobicContact CG2-CG 4.46Å; I836-Y1137 HydrophobicContact CG2-CD1 4.23Å; I836-Y1137 HydrophobicContact CG2-CE1 3.49Å; I836-Y1137 VanDerWaalsContact CG2-CE1 3.49Å
837	D	85.7	Confident	88	Confident	12 Å²	12	15.1 Å²	15.1	6%	0.064	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	122.7	179.8	-178.8	76.5	0	0	0	110.7	R789 N835 S839 G840 F841 G842 V844 Y1137	R789-D837 IonicContact CZ-OD1 3.18Å; R789-D837 VanDerWaalsContact CZ-OD1 3.26Å; R789-D837 IonicContact NH1-OD1 2.93Å; R789-D837 PolarHBondContact NH1-OD1 3.45Å; R789-D837 VanDerWaalsContact NH2-CG 3.29Å; R789-D837 IonicContact NH2-OD1 3.37Å; R789-D837 PolarHBondContact NH2-OD1 2.79Å; R789-D837 IonicContact NH2-OD2 3.91Å; R789-D837 PolarHBondContact NH2-OD2 2.78Å; N835-D837 PolarHBondContact O-N 3.35Å; D837-S839 PolarHBondContact O-N 3.04Å; D837-S839 VanDerWaalsContact O-N 3.09Å; D837-S839 VanDerWaalsContact OD2-CA 3.3Å; D837-S839 WeakPolarHBondContact OD2-CA 3.49Å; D837-S839 WeakPolarHBondContact OD2-CB 3.21Å; D837-S839 PolarHBondContact OD2-N 3.18Å; D837-S839 PolarHBondContact OD2-OG 2.89Å; D837-G840 PolarHBondContact O-N 3.45Å; D837-F841 HydrophobicContact CB-CB 4.24Å; D837-F841 WeakPolarHBondContact OD2-CD2 3.41Å; D837-G842 PolarHBondContact N-O 2.94Å; D837-V844 HydrophobicContact CB-CB 4.44Å; D837-V844 HydrophobicContact CB-CG2 3.75Å; D837-Y1137 VanDerWaalsContact O-CE1 3.23Å; D837-Y1137 WeakPolarHBondContact O-CE1 3.25Å; D837-Y1137 VanDerWaalsContact O-CZ 3.27Å; D837-Y1137 PolarHBondContact O-OH 2.82Å
838	P	80.6	Confident	88.5	Confident	28 Å²	28	13.1 Å²	13.1	18%	0.182	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-16	-175.8	29.8	-38.4	0	0	0	113.2	M705 G840 P1063 L1065	M705-P838 HydrophobicContact CE-CG 4.19Å; P838-G840 PolarHBondContact O-N 2.73Å; P838-P1063 HydrophobicContact CG-CB 3.95Å; P838-P1063 HydrophobicContact CG-CG 4.32Å; P838-P1063 WeakPolarHBondContact CG-O 3.4Å; P838-L1065 HydrophobicContact CB-CB 4.15Å; P838-L1065 HydrophobicContact CB-CD1 4.38Å
839	S	81.7	Confident	88.7	Confident	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-1.3	179.5	-19	0	0	0	0	113.1	G703 K704 M705 R789 D837	G703-S839 CarbonylContact C-O 3.58Å; G703-S839 WeakPolarHBondContact CA-O 3.38Å; K704-S839 WeakPolarHBondContact CG-O 3.32Å; K704-S839 PolarHBondContact N-O 3.3Å; M705-S839 WeakPolarHBondContact CE-OG 3.13Å; M705-S839 PolarHBondContact SD-OG 2.92Å; R789-S839 PolarHBondContact NH2-OG 3.5Å; D837-S839 PolarHBondContact O-N 3.04Å; D837-S839 VanDerWaalsContact O-N 3.09Å; D837-S839 VanDerWaalsContact OD2-CA 3.3Å; D837-S839 WeakPolarHBondContact OD2-CA 3.49Å; D837-S839 WeakPolarHBondContact OD2-CB 3.21Å; D837-S839 PolarHBondContact OD2-N 3.18Å; D837-S839 PolarHBondContact OD2-OG 2.89Å
840	G	82	Confident	88.6	Confident	8 Å²	8	12.1 Å²	12.1	8%	0.082	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.3	13.8	175.7	0	0	0	0	0	115.4	D837 P838 V1124 Y1137	D837-G840 PolarHBondContact O-N 3.45Å; P838-G840 PolarHBondContact O-N 2.73Å; G840-V1124 WeakPolarHBondContact O-CG1 3.38Å; G840-Y1137 VanDerWaalsContact CA-CZ 3.47Å; G840-Y1137 WeakPolarHBondContact CA-OH 3.38Å; G840-Y1137 PolarHBondContact N-OH 3.31Å
841	F	85.2	Confident	88.3	Confident	25 Å²	25	12.1 Å²	12.1	11%	0.11	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	3.1	-178.1	-67.3	-70.2	0	0	0	115.1	H702 L788 D837 V1101 Y1137	H702-F841 AromaticContact CD2-CE2 3.73Å; H702-F841 AromaticContact CE1-CZ 3.99Å; H702-F841 AromaticContact NE2-CE2 3.66Å; H702-F841 AromaticContact NE2-CZ 3.95Å; L788-F841 HydrophobicContact CD1-CB 4.37Å; L788-F841 HydrophobicContact CD1-CD1 3.78Å; L788-F841 HydrophobicContact CD1-CD2 3.51Å; L788-F841 HydrophobicContact CD1-CE1 3.8Å; L788-F841 HydrophobicContact CD1-CE2 3.54Å; L788-F841 HydrophobicContact CD1-CG 3.62Å; L788-F841 HydrophobicContact CD1-CZ 3.66Å; L788-F841 HydrophobicContact CD2-CB 4.01Å; L788-F841 HydrophobicContact CD2-CD2 3.84Å; L788-F841 HydrophobicContact CD2-CG 4.02Å; L788-F841 HydrophobicContact CG-CD2 4.23Å; L788-F841 HydrophobicContact CG-CE2 4.49Å; L788-F841 HydrophobicContact CG-CG 4.49Å; D837-F841 HydrophobicContact CB-CB 4.24Å; D837-F841 WeakPolarHBondContact OD2-CD2 3.41Å; F841-V1101 HydrophobicContact CD1-CG1 3.71Å; F841-V1101 HydrophobicContact CE1-CG1 3.57Å; F841-V1101 HydrophobicContact CZ-CG1 4.42Å; F841-Y1137 PolarHBondContact N-OH 3.01Å
842	G	82.7	Confident	87.9	Confident	1 Å²	1	12.5 Å²	12.5	1%	0.01	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	78.5	-144.6	-179.3	0	0	0	0	0	113	D837 Y1137	D837-G842 PolarHBondContact N-O 2.94Å; G842-Y1137 PolarHBondContact N-OH 3.48Å
843	H	84	Confident	87.3	Confident	13 Å²	13	13.5 Å²	13.5	6%	0.06	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	124.2	179	-62.8	108.8	0	0	0	112.2	P834 N835 V876 I919 F1128	P834-H843 HydrophobicContact CB-CB 4.32Å; N835-H843 WeakPolarHBondContact O-CA 2.97Å; H843-V876 HydrophobicContact CB-CB 4.09Å; H843-V876 HydrophobicContact CB-CG1 3.69Å; H843-V876 PolarHBondContact O-N 3.08Å; H843-I919 WeakPolarHBondContact CE1-CG2 3.03Å; H843-F1128 AromaticContact CE1-CE1 3.53Å; H843-F1128 AromaticContact CE1-CZ 3.2Å; H843-F1128 WeakPolarHBondContact CE1-CZ 3.48Å; H843-F1128 AromaticContact ND1-CE2 4Å; H843-F1128 AromaticContact ND1-CZ 3.27Å; H843-F1128 VanDerWaalsContact ND1-CZ 3.27Å; H843-F1128 WeakPolarHBondContact ND1-CZ 3.31Å
844	V	88.8	Confident	86.9	Confident	8 Å²	8	13 Å²	13	5%	0.048	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	143.6	177.3	174.7	0	0	0	0	109.4	L788 P834 N835 D837 D873 V874	L788-V844 HydrophobicContact CD2-CG1 4.5Å; L788-V844 HydrophobicContact CD2-CG2 3.8Å; P834-V844 WeakPolarHBondContact CA-O 3.49Å; N835-V844 PolarHBondContact N-O 3.44Å; N835-V844 PolarHBondContact O-N 2.97Å; D837-V844 HydrophobicContact CB-CB 4.44Å; D837-V844 HydrophobicContact CB-CG2 3.75Å; V844-D873 HydrophobicContact CG1-CB 3.5Å; V844-D873 VanDerWaalsContact CG1-CB 3.5Å; V844-V874 WeakPolarHBondContact CA-O 3.46Å
845	V	92.6	Very high	86.4	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	138.3	168.4	-66.9	0	0	0	0	108.6	I831 T832 P834 L847 V874 V876 L879 V907	I831-V845 HydrophobicContact CG2-CB 4.38Å; T832-V845 WeakPolarHBondContact O-CA 3.4Å; P834-V845 HydrophobicContact CB-CG1 4.05Å; V845-L847 HydrophobicContact CG2-CD1 4.5Å; V845-V874 HydrophobicContact CG2-CG2 3.58Å; V845-V874 PolarHBondContact N-O 3.32Å; V845-V874 PolarHBondContact O-N 2.79Å; V845-V876 HydrophobicContact CG1-CB 4.25Å; V845-V876 HydrophobicContact CG1-CG2 3.94Å; V845-L879 HydrophobicContact CB-CD1 4.46Å; V845-L879 HydrophobicContact CG2-CD1 3.59Å; V845-L879 HydrophobicContact CG2-CG 3.94Å; V845-V907 HydrophobicContact CG1-CB 4.09Å; V845-V907 HydrophobicContact CG1-CG1 4.4Å
846	S	95.4	Very high	85.7	Confident	11 Å²	11	18.8 Å²	18.8	8%	0.077	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	128.5	179	-50.6	0	0	0	0	109.5	Y791 I831 T832 I872 D873	Y791-S846 VanDerWaalsContact OH-CB 3.26Å; Y791-S846 WeakPolarHBondContact OH-CB 3.33Å; Y791-S846 PolarHBondContact OH-OG 3.48Å; Y791-S846 VanDerWaalsContact OH-OG 3.09Å; I831-S846 CarbonylContact C-O 3.45Å; I831-S846 WeakPolarHBondContact CA-O 2.99Å; T832-S846 PolarHBondContact N-O 3.07Å; T832-S846 PolarHBondContact O-N 2.92Å; S846-I872 CarbonylContact C-O 3.45Å; S846-I872 VanDerWaalsContact CA-O 3.26Å; S846-I872 WeakPolarHBondContact CA-O 3.26Å; S846-D873 WeakPolarHBondContact CB-OD1 3.29Å; S846-D873 PolarHBondContact OG-OD1 3.43Å
847	L	97.3	Very high	85.3	Confident	0 Å²	0	20 Å²	20	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	135.8	169.7	-67.3	78.2	0	0	0	107.7	F95 A96 M100 V829 V830 I831 V845 A871 I872 V874 L879	F95-L847 HydrophobicContact CD1-CD2 4.06Å; F95-L847 HydrophobicContact CE1-CD2 4.18Å; A96-L847 HydrophobicContact CB-CD2 4.12Å; M100-L847 HydrophobicContact CE-CB 4.35Å; V829-L847 HydrophobicContact CG1-CD2 4.36Å; V830-L847 CarbonylContact O-C 3.54Å; V830-L847 WeakPolarHBondContact O-CA 3.43Å; I831-L847 HydrophobicContact CD1-CD2 4.46Å; I831-L847 HydrophobicContact CD1-CG 4.41Å; I831-L847 HydrophobicContact CG1-CG 4.16Å; V845-L847 HydrophobicContact CG2-CD1 4.5Å; L847-A871 CarbonylContact O-C 3.42Å; L847-A871 WeakPolarHBondContact O-CA 3.46Å; L847-A871 VanDerWaalsContact O-CB 3.31Å; L847-A871 WeakPolarHBondContact O-CB 3.47Å; L847-I872 HydrophobicContact CB-CD1 4.45Å; L847-I872 HydrophobicContact CB-CG1 3.89Å; L847-I872 PolarHBondContact N-O 2.63Å; L847-I872 PolarHBondContact O-N 3.1Å; L847-V874 HydrophobicContact CD1-CG2 3.65Å; L847-L879 HydrophobicContact CD1-CD2 4.38Å
848	S	97.3	Very high	84.7	Confident	0 Å²	0	22 Å²	22	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	152.4	-173.1	54.8	0	0	0	0	112.7	W818 V830 L870	W818-S848 PolarHBondContact O-OG 2.91Å; V830-S848 WeakPolarHBondContact CB-OG 3.46Å; V830-S848 PolarHBondContact N-O 3.43Å; V830-S848 PolarHBondContact O-N 2.9Å; V830-S848 PolarHBondContact O-OG 2.84Å; S848-L870 CarbonylContact C-O 3.49Å; S848-L870 WeakPolarHBondContact CA-O 3.24Å; S848-L870 WeakPolarHBondContact CB-O 3.45Å
849	H	96	Very high	84.5	Confident	22 Å²	22	27.9 Å²	27.9	10%	0.102	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	143.3	179.4	-160.5	-69.6	0	0	0	111.2	N97 M100 T102 V869 L870	N97-H849 PolarHBondContact OD1-CD2 2.91Å; M100-H849 HydrophobicContact CE-CB 4.12Å; M100-H849 HydrophobicContact SD-CB 4.17Å; T102-H849 HydrophobicContact CG2-CB 4.46Å; H849-V869 WeakPolarHBondContact O-CA 3.43Å; H849-L870 PolarHBondContact N-O 2.84Å; H849-L870 PolarHBondContact O-N 2.89Å
850	T	93.7	Very high	84.4	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	148.5	178.3	41.6	0	0	0	0	112.3	A822 S827 V866 V869	A822-T850 HydrophobicContact CB-CG2 4.13Å; A822-T850 WeakPolarHBondContact O-CG2 3.34Å; S827-T850 PolarHBondContact N-OG1 3.05Å; S827-T850 VanDerWaalsContact N-OG1 3.17Å; T850-V866 HydrophobicContact CG2-CG1 3.8Å; T850-V866 HydrophobicContact CG2-CG2 3.94Å; T850-V869 HydrophobicContact CG2-CG2 4.25Å
851	I	91.8	Very high	84.2	Confident	0 Å²	0	35 Å²	35	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133.5	170	-63.6	-65.9	0	0	0	107.9	T102 L105 Q106 F109 V866 V867 A868 L870	T102-I851 HydrophobicContact CG2-CD1 3.89Å; L105-I851 HydrophobicContact CB-CD1 4.33Å; L105-I851 HydrophobicContact CD2-CG1 4.06Å; Q106-I851 HydrophobicContact CB-CD1 4.19Å; F109-I851 HydrophobicContact CD2-CG2 3.79Å; F109-I851 HydrophobicContact CE2-CG2 4.11Å; F109-I851 HydrophobicContact CG-CG2 4.18Å; I851-V866 CarbonylContact O-C 3.57Å; I851-V866 WeakPolarHBondContact O-CA 3.22Å; I851-V867 HydrophobicContact CB-CG2 4.43Å; I851-V867 HydrophobicContact CG2-CG2 3.81Å; I851-V867 WeakPolarHBondContact O-CG2 3.49Å; I851-V867 PolarHBondContact O-N 2.92Å; I851-A868 HydrophobicContact CB-CB 4.2Å; I851-A868 PolarHBondContact N-O 2.69Å; I851-A868 PolarHBondContact O-N 2.75Å; I851-L870 HydrophobicContact CD1-CD1 3.71Å; I851-L870 HydrophobicContact CG1-CD1 3.81Å; I851-L870 HydrophobicContact CG1-CG 4.11Å
852	Y	87.7	Confident	83.7	Confident	8 Å²	8	37.5 Å²	37.5	3%	0.031	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	157.7	-176.8	-61.6	-75.3	0	0	0	112	Q106 P826 S827 H860 D864 L865 V866 V867	Q106-Y852 PolarHBondContact NE2-O 3.25Å; P826-Y852 VanDerWaalsContact C-OH 3.31Å; P826-Y852 HydrophobicContact CB-CE1 4.35Å; P826-Y852 WeakPolarHBondContact CB-OH 3.44Å; S827-Y852 PolarHBondContact N-OH 2.84Å; S827-Y852 WeakPolarHBondContact OG-CE2 3.27Å; S827-Y852 PolarHBondContact OG-OH 2.85Å; Y852-H860 HydrophobicContact CD2-CB 3.82Å; Y852-H860 HydrophobicContact CE2-CB 4.4Å; Y852-H860 HydrophobicContact CG-CB 4.05Å; Y852-D864 HydrophobicContact CD1-CB 3.79Å; Y852-D864 HydrophobicContact CE1-CB 4.43Å; Y852-D864 HydrophobicContact CG-CB 4.4Å; Y852-L865 CarbonylContact C-O 3.59Å; Y852-L865 VanDerWaalsContact CA-O 3.32Å; Y852-L865 WeakPolarHBondContact CA-O 3.41Å; Y852-V866 HydrophobicContact CD1-CG2 4.41Å; Y852-V866 HydrophobicContact CE1-CG2 4.11Å; Y852-V867 WeakPolarHBondContact O-CG2 3.49Å
853	E	79.6	Confident	83.2	Confident	23 Å²	23	41.9 Å²	41.9	11%	0.107	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-53.5	145.4	162.8	71	-168.1	148	0	0	110.8	Y114 H860 L865 V867	Y114-E853 HydrophobicContact CE1-CB 4.41Å; E853-H860 PolarHBondContact O-CE1 2.95Å; E853-H860 PolarHBondContact O-ND1 2.92Å; E853-L865 HydrophobicContact CB-CB 4.36Å; E853-L865 HydrophobicContact CG-CB 4.18Å; E853-L865 PolarHBondContact N-O 3.22Å; E853-L865 WeakPolarHBondContact OE1-CB 3.29Å; E853-L865 PolarHBondContact OE1-N 2.92Å; E853-V867 HydrophobicContact CB-CG1 3.83Å
854	G	74.6	Confident	82.8	Confident	2 Å²	2	42.3 Å²	42.3	2%	0.021	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-74.6	135.1	-176.7	0	0	0	0	0	111.8	F109 D110 Y114	F109-G854 WeakPolarHBondContact O-CA 3.07Å; D110-G854 WeakPolarHBondContact OD1-CA 3.45Å; Y114-G854 WeakPolarHBondContact CD2-O 3.48Å; Y114-G854 WeakPolarHBondContact CE2-O 3.48Å; Y114-G854 WeakPolarHBondContact OH-CA 3.46Å; Y114-G854 PolarHBondContact OH-N 3.09Å
855	K	74.3	Confident	82.3	Confident	70 Å²	70	43.9 Å²	43.9	30%	0.304	26%	0.258	S	S	.	.			trans	-121.8	143.5	174.2	-70.1	-176.5	173	-179.3	0	109.7	A857 A858 D864	K855-A857 PolarHBondContact O-N 3.25Å; K855-A858 PolarHBondContact O-N 3.48Å; K855-D864 VanDerWaalsContact CE-OD2 3.23Å; K855-D864 WeakPolarHBondContact CE-OD2 3.49Å; K855-D864 IonicContact NZ-OD1 3.03Å; K855-D864 PolarHBondContact NZ-OD1 2.79Å; K855-D864 IonicContact NZ-OD2 3.87Å; K855-D864 PolarHBondContact NZ-OD2 3.3Å
856	A	67.3	Low	82	Confident	118 Å²	118	44.2 Å²	44.2	98%	0.975	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-31.3	-177.1	0	0	0	0	0	113.8
857	A	72.4	Confident	81.5	Confident	69 Å²	69	44.9 Å²	44.9	57%	0.57	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-2.3	178.3	0	0	0	0	0	114.5	K855 M859	K855-A857 PolarHBondContact O-N 3.25Å; A857-M859 HydrophobicContact CB-CB 4.46Å; A857-M859 HydrophobicContact CB-CG 4.28Å; A857-M859 PolarHBondContact O-N 2.91Å
858	A	74.8	Confident	81.2	Confident	55 Å²	55	44.9 Å²	44.9	46%	0.455	26%	0.264	S	S	.	.			trans	51.7	20	-171.5	0	0	0	0	0	114.6	D110 K855	D110-A858 HydrophobicContact CB-CB 4.35Å; D110-A858 WeakPolarHBondContact OD2-CB 3.35Å; K855-A858 PolarHBondContact O-N 3.48Å
859	M	76.5	Confident	81.1	Confident	152 Å²	152	44.9 Å²	44.9	75%	0.749	26%	0.264	S	S	*	.			trans	-97.3	100.1	176.9	-66.2	-170.7	-163.8	0	0	109.2	A857	A857-M859 HydrophobicContact CB-CB 4.46Å; A857-M859 HydrophobicContact CB-CG 4.28Å; A857-M859 PolarHBondContact O-N 2.91Å
860	H	79.3	Confident	81.2	Confident	49 Å²	49	43.8 Å²	43.8	23%	0.227	26%	0.259	C	S	.	.			trans	-92.8	137.1	179.7	-59.9	-63	0	0	0	111.2	Q106 D110 Y852 E853 D864	Q106-H860 PolarHBondContact NE2-NE2 3.39Å; Q106-H860 VanDerWaalsContact NE2-NE2 3.15Å; D110-H860 IonicContact OD1-CE1 2.67Å; D110-H860 PolarHBondContact OD1-CE1 3.14Å; D110-H860 IonicContact OD1-NE2 3.89Å; D110-H860 PolarHBondContact OD1-NE2 3.23Å; D110-H860 IonicContact OD2-NE2 3.98Å; D110-H860 PolarHBondContact OD2-NE2 3.46Å; Y852-H860 HydrophobicContact CD2-CB 3.82Å; Y852-H860 HydrophobicContact CE2-CB 4.4Å; Y852-H860 HydrophobicContact CG-CB 4.05Å; E853-H860 PolarHBondContact O-CE1 2.95Å; E853-H860 PolarHBondContact O-ND1 2.92Å; H860-D864 VanDerWaalsContact CA-OD2 3.25Å; H860-D864 WeakPolarHBondContact CA-OD2 3.44Å; H860-D864 IonicContact ND1-OD2 2.91Å
861	H	77.1	Confident	81.3	Confident	109 Å²	109	43.8 Å²	43.8	51%	0.505	26%	0.258	S	S	.	.			trans	-98.4	153.6	169	-166.8	-84.7	0	0	0	109.8	N863 D864	H861-N863 PolarHBondContact CE1-ND2 2.94Å; H861-N863 VanDerWaalsContact ND1-CB 3.35Å; H861-N863 WeakPolarHBondContact ND1-CB 3.21Å; H861-N863 PolarHBondContact ND1-N 3.49Å; H861-N863 VanDerWaalsContact ND1-N 3.11Å; H861-N863 PolarHBondContact O-N 3.18Å; H861-D864 PolarHBondContact N-OD2 3.26Å; H861-D864 VanDerWaalsContact O-CB 3.31Å; H861-D864 WeakPolarHBondContact O-CB 3.19Å; H861-D864 VanDerWaalsContact O-CG 3.28Å; H861-D864 PolarHBondContact O-N 3.01Å
862	V	75.1	Confident	81.5	Confident	76 Å²	76	43.8 Å²	43.8	46%	0.461	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-15.2	175.2	-175.2	0	0	0	0	113	P826	P826-V862 HydrophobicContact CB-CG1 4Å; P826-V862 HydrophobicContact CG-CG1 3.64Å
863	N	71.7	Confident	81.9	Confident	93 Å²	93	44 Å²	44	50%	0.497	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-3.1	-178.3	-74	-13.9	0	0	0	112.6	K665 H861	K665-N863 PolarHBondContact NZ-O 2.82Å; H861-N863 PolarHBondContact CE1-ND2 2.94Å; H861-N863 VanDerWaalsContact ND1-CB 3.35Å; H861-N863 WeakPolarHBondContact ND1-CB 3.21Å; H861-N863 PolarHBondContact ND1-N 3.49Å; H861-N863 VanDerWaalsContact ND1-N 3.11Å; H861-N863 PolarHBondContact O-N 3.18Å
864	D	76.4	Confident	82.6	Confident	23 Å²	23	43 Å²	43	12%	0.123	26%	0.255	C	S	.	.	S	Bend	trans	-73	157.9	-178.4	-65.5	-10	0	0	0	111.2	Y852 K855 H860 H861 V866	Y852-D864 HydrophobicContact CD1-CB 3.79Å; Y852-D864 HydrophobicContact CE1-CB 4.43Å; Y852-D864 HydrophobicContact CG-CB 4.4Å; K855-D864 VanDerWaalsContact CE-OD2 3.23Å; K855-D864 WeakPolarHBondContact CE-OD2 3.49Å; K855-D864 IonicContact NZ-OD1 3.03Å; K855-D864 PolarHBondContact NZ-OD1 2.79Å; K855-D864 IonicContact NZ-OD2 3.87Å; K855-D864 PolarHBondContact NZ-OD2 3.3Å; H860-D864 VanDerWaalsContact CA-OD2 3.25Å; H860-D864 WeakPolarHBondContact CA-OD2 3.44Å; H860-D864 IonicContact ND1-OD2 2.91Å; H861-D864 PolarHBondContact N-OD2 3.26Å; H861-D864 VanDerWaalsContact O-CB 3.31Å; H861-D864 WeakPolarHBondContact O-CB 3.19Å; H861-D864 VanDerWaalsContact O-CG 3.28Å; H861-D864 PolarHBondContact O-N 3.01Å; D864-V866 PolarHBondContact O-N 2.91Å
865	L	77.6	Confident	83.3	Confident	41 Å²	41	43.5 Å²	43.5	22%	0.215	26%	0.258	C	S	.	.			trans	-65.4	126.8	-177.3	-177.7	62.6	0	0	0	111	V572 T573 Y852 E853 V867	V572-L865 HydrophobicContact CG1-CD1 3.76Å; T573-L865 HydrophobicContact CG2-CD1 3.31Å; Y852-L865 CarbonylContact C-O 3.59Å; Y852-L865 VanDerWaalsContact CA-O 3.32Å; Y852-L865 WeakPolarHBondContact CA-O 3.41Å; E853-L865 HydrophobicContact CB-CB 4.36Å; E853-L865 HydrophobicContact CG-CB 4.18Å; E853-L865 PolarHBondContact N-O 3.22Å; E853-L865 WeakPolarHBondContact OE1-CB 3.29Å; E853-L865 PolarHBondContact OE1-N 2.92Å; L865-V867 HydrophobicContact CD2-CG1 4.48Å; L865-V867 HydrophobicContact CG-CG1 4.43Å; L865-V867 PolarHBondContact O-N 2.9Å
866	V	85.4	Confident	83.9	Confident	7 Å²	7	40.4 Å²	40.4	4%	0.042	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	114.3	171.5	178.8	0	0	0	0	109.1	V572 P795 V823 T850 I851 Y852 D864 A868 V869	V572-V866 HydrophobicContact CG1-CB 4.42Å; P795-V866 WeakPolarHBondContact CG-O 3.45Å; V823-V866 HydrophobicContact CG2-CG1 4.4Å; T850-V866 HydrophobicContact CG2-CG1 3.8Å; T850-V866 HydrophobicContact CG2-CG2 3.94Å; I851-V866 CarbonylContact O-C 3.57Å; I851-V866 WeakPolarHBondContact O-CA 3.22Å; Y852-V866 HydrophobicContact CD1-CG2 4.41Å; Y852-V866 HydrophobicContact CE1-CG2 4.11Å; D864-V866 PolarHBondContact O-N 2.91Å; V866-A868 WeakPolarHBondContact CG1-O 3.42Å; V866-V869 HydrophobicContact CG1-CG2 4.15Å
867	V	86	Confident	84.9	Confident	24 Å²	24	35 Å²	35	15%	0.145	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-21.4	-178.4	-63	0	0	0	0	113.2	F109 P795 I851 Y852 E853 L865	F109-V867 HydrophobicContact CD1-CB 4.49Å; F109-V867 HydrophobicContact CD1-CG2 3.61Å; F109-V867 HydrophobicContact CE1-CB 4.07Å; F109-V867 HydrophobicContact CE1-CG2 3.46Å; F109-V867 VanDerWaalsContact CE1-CG2 3.46Å; F109-V867 HydrophobicContact CG-CG2 4.24Å; F109-V867 HydrophobicContact CZ-CG2 3.98Å; P795-V867 WeakPolarHBondContact CD-O 3.31Å; I851-V867 HydrophobicContact CB-CG2 4.43Å; I851-V867 HydrophobicContact CG2-CG2 3.81Å; I851-V867 WeakPolarHBondContact O-CG2 3.49Å; I851-V867 PolarHBondContact O-N 2.92Å; Y852-V867 WeakPolarHBondContact O-CG2 3.49Å; E853-V867 HydrophobicContact CB-CG1 3.83Å; L865-V867 HydrophobicContact CD2-CG1 4.48Å; L865-V867 HydrophobicContact CG-CG1 4.43Å; L865-V867 PolarHBondContact O-N 2.9Å
868	A	91.5	Very high	85.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	161.4	173.9	0	0	0	0	0	111.3	A793 T794 I851 V866	A793-A868 CarbonylContact O-C 3.58Å; A793-A868 VanDerWaalsContact O-CA 3.29Å; A793-A868 WeakPolarHBondContact O-CA 3.22Å; T794-A868 HydrophobicContact CG2-CB 4.45Å; I851-A868 HydrophobicContact CB-CB 4.2Å; I851-A868 PolarHBondContact N-O 2.69Å; I851-A868 PolarHBondContact O-N 2.75Å; V866-A868 WeakPolarHBondContact CG1-O 3.42Å
869	V	95.2	Very high	86.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	128.7	168.8	-177.7	0	0	0	0	108.2	L792 A793 W818 F819 A822 V823 H849 T850 V866	L792-V869 CarbonylContact C-O 3.58Å; L792-V869 WeakPolarHBondContact CA-O 3.43Å; A793-V869 PolarHBondContact N-O 3.41Å; A793-V869 PolarHBondContact O-N 3.06Å; W818-V869 HydrophobicContact CE3-CB 4.45Å; W818-V869 HydrophobicContact CE3-CG1 3.78Å; W818-V869 HydrophobicContact CZ3-CB 3.82Å; W818-V869 HydrophobicContact CZ3-CG1 3.6Å; F819-V869 HydrophobicContact CD2-CB 3.73Å; F819-V869 HydrophobicContact CD2-CG2 3.71Å; F819-V869 HydrophobicContact CE1-CG2 4.45Å; F819-V869 HydrophobicContact CE2-CB 3.88Å; F819-V869 HydrophobicContact CE2-CG2 3.6Å; F819-V869 HydrophobicContact CG-CB 4.48Å; F819-V869 HydrophobicContact CG-CG2 4.2Å; F819-V869 HydrophobicContact CZ-CG2 3.99Å; A822-V869 HydrophobicContact CB-CG1 3.49Å; A822-V869 VanDerWaalsContact CB-CG1 3.49Å; A822-V869 HydrophobicContact CB-CG2 4.3Å; V823-V869 HydrophobicContact CG2-CG2 4.11Å; H849-V869 WeakPolarHBondContact O-CA 3.43Å; T850-V869 HydrophobicContact CG2-CG2 4.25Å; V866-V869 HydrophobicContact CG1-CG2 4.15Å
870	L	96.9	Very high	87.3	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	149.7	171.2	-70.3	164.5	0	0	0	109.8	M100 T102 L105 I770 W774 L792 S848 H849 I851	M100-L870 HydrophobicContact CB-CB 4.13Å; M100-L870 HydrophobicContact CB-CD1 4.39Å; M100-L870 HydrophobicContact CG-CB 4.26Å; M100-L870 VanDerWaalsContact SD-C 3.58Å; M100-L870 HydrophobicContact SD-CB 3.82Å; T102-L870 HydrophobicContact CG2-CD1 4.4Å; L105-L870 HydrophobicContact CB-CD1 4.36Å; L105-L870 HydrophobicContact CD2-CD1 4.13Å; L105-L870 HydrophobicContact CD2-CD2 3.92Å; L105-L870 HydrophobicContact CD2-CG 4.17Å; I770-L870 HydrophobicContact CD1-CD2 3.51Å; W774-L870 HydrophobicContact CZ2-CD2 3.85Å; L792-L870 HydrophobicContact CB-CD2 3.6Å; L792-L870 HydrophobicContact CB-CG 4.48Å; L792-L870 HydrophobicContact CD2-CD2 4.23Å; S848-L870 CarbonylContact C-O 3.49Å; S848-L870 WeakPolarHBondContact CA-O 3.24Å; S848-L870 WeakPolarHBondContact CB-O 3.45Å; H849-L870 PolarHBondContact N-O 2.84Å; H849-L870 PolarHBondContact O-N 2.89Å; I851-L870 HydrophobicContact CD1-CD1 3.71Å; I851-L870 HydrophobicContact CG1-CD1 3.81Å; I851-L870 HydrophobicContact CG1-CG 4.11Å
871	A	97.2	Very high	87.8	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	158.4	173.4	0	0	0	0	0	113.7	Y791 W818 L847	Y791-A871 HydrophobicContact CD2-CB 3.81Å; Y791-A871 HydrophobicContact CE1-CB 4.28Å; Y791-A871 HydrophobicContact CE2-CB 3.25Å; Y791-A871 PolarHBondContact N-O 2.88Å; Y791-A871 PolarHBondContact O-N 3.16Å; Y791-A871 VanDerWaalsContact O-O 3.08Å; W818-A871 HydrophobicContact CD2-CB 4.18Å; W818-A871 HydrophobicContact CE3-CB 3.65Å; W818-A871 HydrophobicContact CZ3-CB 4.03Å; L847-A871 CarbonylContact O-C 3.42Å; L847-A871 WeakPolarHBondContact O-CA 3.46Å; L847-A871 VanDerWaalsContact O-CB 3.31Å; L847-A871 WeakPolarHBondContact O-CB 3.47Å
872	I	96	Very high	88.4	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	146.8	171.9	56.8	178.5	0	0	0	110.8	F95 E99 M100 V787 R789 R790 S846 L847	F95-I872 HydrophobicContact CD1-CD1 4.29Å; F95-I872 HydrophobicContact CE1-CD1 3.55Å; F95-I872 HydrophobicContact CZ-CD1 3.92Å; E99-I872 HydrophobicContact CB-CD1 3.89Å; M100-I872 HydrophobicContact CG-CB 4.47Å; M100-I872 HydrophobicContact CG-CG1 4.27Å; M100-I872 HydrophobicContact CG-CG2 3.69Å; V787-I872 HydrophobicContact CG1-CB 4.33Å; V787-I872 HydrophobicContact CG1-CG2 4.3Å; R789-I872 VanDerWaalsContact O-CA 3.25Å; R789-I872 WeakPolarHBondContact O-CA 3.35Å; R790-I872 HydrophobicContact CB-CG2 4.26Å; R790-I872 HydrophobicContact CG-CG2 3.86Å; S846-I872 CarbonylContact C-O 3.45Å; S846-I872 VanDerWaalsContact CA-O 3.26Å; S846-I872 WeakPolarHBondContact CA-O 3.26Å; L847-I872 HydrophobicContact CB-CD1 4.45Å; L847-I872 HydrophobicContact CB-CG1 3.89Å; L847-I872 PolarHBondContact N-O 2.63Å; L847-I872 PolarHBondContact O-N 3.1Å
873	D	94.7	Very high	89.2	Confident	14 Å²	14	14.5 Å²	14.5	8%	0.075	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	132.8	172.8	-81.2	-20	0	0	0	110.3	L788 R789 Y791 V844 S846	L788-D873 HydrophobicContact CB-CB 4.04Å; L788-D873 WeakPolarHBondContact CB-O 3.03Å; L788-D873 HydrophobicContact CD2-CB 4.32Å; L788-D873 PolarHBondContact N-O 2.85Å; R789-D873 HydrophobicContact CB-CB 4.38Å; R789-D873 IonicContact NH1-OD2 3.12Å; R789-D873 PolarHBondContact NH1-OD2 2.86Å; R789-D873 PolarHBondContact O-N 2.74Å; Y791-D873 HydrophobicContact CE1-CB 4.37Å; Y791-D873 PolarHBondContact OH-OD1 3Å; V844-D873 HydrophobicContact CG1-CB 3.5Å; V844-D873 VanDerWaalsContact CG1-CB 3.5Å; S846-D873 WeakPolarHBondContact CB-OD1 3.29Å; S846-D873 PolarHBondContact OG-OD1 3.43Å
874	V	93.8	Very high	90	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	152.7	173.3	-61.3	0	0	0	0	110.8	F95 V787 V844 V845 L847 F878 L879	F95-V874 HydrophobicContact CE1-CG1 4.14Å; F95-V874 HydrophobicContact CZ-CG1 3.92Å; V787-V874 HydrophobicContact CG2-CG1 4.47Å; V844-V874 WeakPolarHBondContact CA-O 3.46Å; V845-V874 HydrophobicContact CG2-CG2 3.58Å; V845-V874 PolarHBondContact N-O 3.32Å; V845-V874 PolarHBondContact O-N 2.79Å; L847-V874 HydrophobicContact CD1-CG2 3.65Å; V874-F878 HydrophobicContact CB-CB 4.3Å; V874-F878 HydrophobicContact CB-CD1 3.95Å; V874-F878 HydrophobicContact CB-CG 4.34Å; V874-F878 HydrophobicContact CG1-CD1 4.11Å; V874-F878 HydrophobicContact CG1-CE1 4.44Å; V874-F878 HydrophobicContact CG2-CD1 3.95Å; V874-L879 HydrophobicContact CG2-CD2 4.35Å; V874-L879 HydrophobicContact CG2-CG 4.32Å
875	P	89.7	Confident	90.6	Very high	13 Å²	13	18.2 Å²	18.2	8%	0.084	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	141.9	171.2	-22.5	33	0	0	0	111.3	C786 T877 F878 V1101	C786-P875 VanDerWaalsContact O-CD 3.23Å; C786-P875 WeakPolarHBondContact O-CD 3.44Å; P875-T877 PolarHBondContact O-N 2.82Å; P875-T877 VanDerWaalsContact O-N 3.13Å; P875-F878 WeakPolarHBondContact O-CB 3.45Å; P875-F878 PolarHBondContact O-N 2.96Å; P875-V1101 HydrophobicContact CG-CG2 4.21Å
876	V	88	Confident	91.1	Very high	5 Å²	5	19.8 Å²	19.8	3%	0.03	9%	0.091	C	C	.	.	H	α-helix	trans	-56.4	-34.1	178.9	72.5	0	0	0	0	112.7	P834 H843 V845 F878 L879 V907 Y909	P834-V876 HydrophobicContact CB-CG2 4.31Å; H843-V876 HydrophobicContact CB-CB 4.09Å; H843-V876 HydrophobicContact CB-CG1 3.69Å; H843-V876 PolarHBondContact O-N 3.08Å; V845-V876 HydrophobicContact CG1-CB 4.25Å; V845-V876 HydrophobicContact CG1-CG2 3.94Å; V876-F878 PolarHBondContact O-N 3.38Å; V876-L879 PolarHBondContact O-N 3.37Å; V876-V907 VanDerWaalsContact CG2-O 3.28Å; V876-V907 WeakPolarHBondContact CG2-O 3.45Å; V876-Y909 HydrophobicContact CB-CE1 4.34Å; V876-Y909 HydrophobicContact CG1-CE1 3.74Å; V876-Y909 HydrophobicContact CG2-CD1 3.88Å; V876-Y909 HydrophobicContact CG2-CE1 3.64Å
877	T	87.8	Confident	91.3	Very high	5 Å²	5	19.4 Å²	19.4	3%	0.031	9%	0.089	C	C	.	.	H	α-helix	trans	-68.4	-19.6	177.6	56	0	0	0	0	113.2	P875 Y880 K881 L1098 G1099	P875-T877 PolarHBondContact O-N 2.82Å; P875-T877 VanDerWaalsContact O-N 3.13Å; T877-Y880 PolarHBondContact O-N 2.95Å; T877-K881 PolarHBondContact O-N 2.76Å; T877-L1098 HydrophobicContact CG2-CD2 4.05Å; T877-G1099 PolarHBondContact OG1-N 2.99Å
878	F	91.4	Very high	91.4	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.018	11%	0.107	C	C	.	.	H	α-helix	trans	-66.7	-45.9	174.9	176.4	-99.9	0	0	0	111.5	F95 F783 C786 V874 P875 V876 Y880 K881 M882	F95-F878 HydrophobicContact CD1-CE1 4.21Å; F95-F878 HydrophobicContact CD2-CE1 4.28Å; F95-F878 HydrophobicContact CD2-CZ 4.14Å; F95-F878 HydrophobicContact CE1-CD1 4.48Å; F95-F878 AromaticContact CE1-CE1 3.62Å; F95-F878 HydrophobicContact CE1-CE1 3.62Å; F95-F878 HydrophobicContact CE1-CZ 4.34Å; F95-F878 AromaticContact CE2-CE1 3.69Å; F95-F878 HydrophobicContact CE2-CE1 3.69Å; F95-F878 AromaticContact CE2-CZ 3.55Å; F95-F878 HydrophobicContact CE2-CZ 3.55Å; F95-F878 HydrophobicContact CZ-CD1 4.31Å; F95-F878 AromaticContact CZ-CE1 3.33Å; F95-F878 HydrophobicContact CZ-CE1 3.33Å; F95-F878 AromaticContact CZ-CZ 3.68Å; F95-F878 HydrophobicContact CZ-CZ 3.68Å; F783-F878 HydrophobicContact CD1-CE2 4.07Å; F783-F878 HydrophobicContact CD1-CZ 4.03Å; F783-F878 HydrophobicContact CE1-CZ 4.35Å; C786-F878 HydrophobicContact CB-CD2 3.59Å; C786-F878 HydrophobicContact CB-CE2 3.52Å; C786-F878 HydrophobicContact CB-CG 4.42Å; C786-F878 HydrophobicContact CB-CZ 4.31Å; V874-F878 HydrophobicContact CB-CB 4.3Å; V874-F878 HydrophobicContact CB-CD1 3.95Å; V874-F878 HydrophobicContact CB-CG 4.34Å; V874-F878 HydrophobicContact CG1-CD1 4.11Å; V874-F878 HydrophobicContact CG1-CE1 4.44Å; V874-F878 HydrophobicContact CG2-CD1 3.95Å; P875-F878 WeakPolarHBondContact O-CB 3.45Å; P875-F878 PolarHBondContact O-N 2.96Å; V876-F878 PolarHBondContact O-N 3.38Å; F878-Y880 VanDerWaalsContact C-N 3.26Å; F878-Y880 PolarHBondContact O-N 2.89Å; F878-K881 WeakPolarHBondContact O-CB 3.25Å; F878-K881 PolarHBondContact O-N 3.33Å; F878-M882 HydrophobicContact CD1-CG 4.38Å; F878-M882 HydrophobicContact CE1-CG 3.91Å; F878-M882 HydrophobicContact CE2-CG 4.35Å; F878-M882 HydrophobicContact CE2-SD 4.43Å; F878-M882 HydrophobicContact CZ-CG 3.9Å; F878-M882 HydrophobicContact CZ-SD 4.08Å; F878-M882 WeakPolarHBondContact O-CG 3.34Å; F878-M882 PolarHBondContact O-N 2.77Å
879	L	91.7	Very high	91.2	Very high	3 Å²	3	22.6 Å²	22.6	2%	0.016	11%	0.108	C	C	.	.	H	α-helix	trans	-63.8	-36.1	177.7	-66.3	-169.8	0	0	0	111.5	L92 I831 V845 L847 V874 V876 M882 L883 A908	L92-L879 HydrophobicContact CD2-CD2 3.95Å; I831-L879 HydrophobicContact CD1-CD1 4.11Å; I831-L879 HydrophobicContact CG2-CD1 4Å; V845-L879 HydrophobicContact CB-CD1 4.46Å; V845-L879 HydrophobicContact CG2-CD1 3.59Å; V845-L879 HydrophobicContact CG2-CG 3.94Å; L847-L879 HydrophobicContact CD1-CD2 4.38Å; V874-L879 HydrophobicContact CG2-CD2 4.35Å; V874-L879 HydrophobicContact CG2-CG 4.32Å; V876-L879 PolarHBondContact O-N 3.37Å; L879-M882 PolarHBondContact O-N 3.3Å; L879-L883 PolarHBondContact O-N 2.97Å; L879-A908 HydrophobicContact CB-CB 3.64Å
880	Y	90.7	Very high	90.9	Very high	11 Å²	11	22.8 Å²	22.8	4%	0.043	11%	0.11	C	C	.	.	H	α-helix	trans	-66.2	-41.9	173.9	-177.7	-100.6	0	0	0	112.3	T877 F878 M882 L883 Y884 C897 Y909 D910 L1098	T877-Y880 PolarHBondContact O-N 2.95Å; F878-Y880 VanDerWaalsContact C-N 3.26Å; F878-Y880 PolarHBondContact O-N 2.89Å; Y880-M882 VanDerWaalsContact C-N 3.27Å; Y880-M882 PolarHBondContact O-N 2.9Å; Y880-L883 HydrophobicContact CD2-CD2 4.48Å; Y880-L883 WeakPolarHBondContact O-CB 3.43Å; Y880-L883 PolarHBondContact O-N 2.87Å; Y880-L883 VanDerWaalsContact O-N 3.1Å; Y880-Y884 WeakPolarHBondContact O-CB 3.48Å; Y880-Y884 PolarHBondContact O-N 3.29Å; Y880-C897 WeakPolarHBondContact CE2-O 3.32Å; Y880-Y909 WeakPolarHBondContact CB-O 3.41Å; Y880-Y909 VanDerWaalsContact CD2-C 3.43Å; Y880-D910 HydrophobicContact CD2-CB 4.43Å; Y880-D910 HydrophobicContact CE1-CB 3.89Å; Y880-D910 HydrophobicContact CE2-CB 3.76Å; Y880-D910 VanDerWaalsContact CZ-CB 3.46Å; Y880-L1098 HydrophobicContact CD1-CD1 4.22Å; Y880-L1098 HydrophobicContact CE1-CD1 4.46Å
881	K	90.8	Very high	90.4	Very high	47 Å²	47	28.5 Å²	28.5	20%	0.204	13%	0.131	C	C	.	.	H	α-helix	trans	-57.3	-41.6	172.8	174.4	169.6	177.7	174.1	0	112.2	T877 F878 Y884 K885 I1095 S1096 L1098	T877-K881 PolarHBondContact O-N 2.76Å; F878-K881 WeakPolarHBondContact O-CB 3.25Å; F878-K881 PolarHBondContact O-N 3.33Å; K881-Y884 PolarHBondContact O-N 3.47Å; K881-K885 WeakPolarHBondContact O-CB 3.28Å; K881-K885 PolarHBondContact O-N 3.48Å; K881-I1095 WeakPolarHBondContact CE-O 3.43Å; K881-I1095 HydrophobicContact CG-CD1 4.2Å; K881-I1095 PolarHBondContact NZ-O 3.19Å; K881-S1096 PolarHBondContact NZ-O 3.32Å; K881-L1098 HydrophobicContact CB-CB 4.06Å; K881-L1098 HydrophobicContact CD-CB 4.09Å; K881-L1098 WeakPolarHBondContact CD-O 3.4Å; K881-L1098 PolarHBondContact NZ-O 3.22Å
882	M	89.5	Confident	89.8	Confident	14 Å²	14	32.4 Å²	32.4	7%	0.069	15%	0.149	C	C	.	.	H	α-helix	trans	-64.8	-41.4	175.8	-67.3	-61.1	-71.9	0	0	111.5	M91 F878 L879 Y880 K885 H886	M91-M882 HydrophobicContact CE-CB 3.65Å; M91-M882 WeakPolarHBondContact CE-O 3.24Å; M91-M882 HydrophobicContact CG-CE 3.4Å; M91-M882 HydrophobicContact SD-CB 3.64Å; M91-M882 HydrophobicContact SD-CE 3.64Å; M91-M882 HydrophobicContact SD-CG 4.28Å; F878-M882 HydrophobicContact CD1-CG 4.38Å; F878-M882 HydrophobicContact CE1-CG 3.91Å; F878-M882 HydrophobicContact CE2-CG 4.35Å; F878-M882 HydrophobicContact CE2-SD 4.43Å; F878-M882 HydrophobicContact CZ-CG 3.9Å; F878-M882 HydrophobicContact CZ-SD 4.08Å; F878-M882 WeakPolarHBondContact O-CG 3.34Å; F878-M882 PolarHBondContact O-N 2.77Å; L879-M882 PolarHBondContact O-N 3.3Å; Y880-M882 VanDerWaalsContact C-N 3.27Å; Y880-M882 PolarHBondContact O-N 2.9Å; M882-K885 PolarHBondContact O-N 2.89Å; M882-H886 PolarHBondContact O-CD2 3.05Å; M882-H886 VanDerWaalsContact O-CD2 3.32Å; M882-H886 PolarHBondContact O-N 3.33Å
883	L	90.9	Very high	89	Confident	1 Å²	1	41 Å²	41	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-60.5	-49.9	174.4	-172.5	63.7	0	0	0	111.6	V88 L879 Y880 K885 H886 V887 C897 L899 L993	V88-L883 HydrophobicContact CG2-CD1 3.75Å; L879-L883 PolarHBondContact O-N 2.97Å; Y880-L883 HydrophobicContact CD2-CD2 4.48Å; Y880-L883 WeakPolarHBondContact O-CB 3.43Å; Y880-L883 PolarHBondContact O-N 2.87Å; Y880-L883 VanDerWaalsContact O-N 3.1Å; L883-K885 VanDerWaalsContact C-N 3.3Å; L883-K885 PolarHBondContact O-N 3.43Å; L883-H886 PolarHBondContact O-N 2.93Å; L883-V887 HydrophobicContact CD1-CB 4.21Å; L883-V887 HydrophobicContact CD1-CG2 3.72Å; L883-V887 WeakPolarHBondContact O-CB 3.34Å; L883-V887 PolarHBondContact O-N 2.97Å; L883-C897 HydrophobicContact CD2-CB 3.68Å; L883-C897 HydrophobicContact CG-CB 4.31Å; L883-L899 HydrophobicContact CD1-CD2 4.43Å; L883-L899 HydrophobicContact CD2-CG 4.37Å; L883-L993 HydrophobicContact CD1-CD1 3.64Å; L883-L993 HydrophobicContact CD2-CD1 4.29Å
884	Y	89.4	Confident	88.2	Confident	78 Å²	78	46 Å²	46	31%	0.306	22%	0.217	S	C	.	.	H	α-helix	trans	-59.5	-37	177.2	-173.2	-86.4	0	0	0	112.9	Y880 K881 R891 I1095	Y880-Y884 WeakPolarHBondContact O-CB 3.48Å; Y880-Y884 PolarHBondContact O-N 3.29Å; K881-Y884 PolarHBondContact O-N 3.47Å; Y884-R891 HydrophobicContact CD1-CG 4.35Å; Y884-R891 HydrophobicContact CD2-CG 4.17Å; Y884-R891 HydrophobicContact CE1-CG 3.99Å; Y884-R891 HydrophobicContact CE2-CB 4.15Å; Y884-R891 HydrophobicContact CE2-CG 3.79Å; Y884-R891 HydrophobicContact CG-CG 4.43Å; Y884-R891 PolarHBondContact O-NE 3.43Å; Y884-R891 PolarHBondContact O-NH2 3.47Å; Y884-I1095 HydrophobicContact CD1-CD1 3.45Å; Y884-I1095 VanDerWaalsContact CD1-CD1 3.45Å; Y884-I1095 HydrophobicContact CD1-CG1 4.17Å; Y884-I1095 HydrophobicContact CE1-CD1 3.9Å; Y884-I1095 HydrophobicContact CE1-CG1 4.22Å; Y884-I1095 HydrophobicContact CG-CD1 4.06Å
885	K	89	Confident	87.9	Confident	116 Å²	116	46.7 Å²	46.7	50%	0.504	22%	0.22	S	C	.	.	H	α-helix	trans	-71.5	-42.8	178.4	-173.3	-179.3	177.9	-173.9	0	112.3	K881 M882 L883 R891	K881-K885 WeakPolarHBondContact O-CB 3.28Å; K881-K885 PolarHBondContact O-N 3.48Å; M882-K885 PolarHBondContact O-N 2.89Å; L883-K885 VanDerWaalsContact C-N 3.3Å; L883-K885 PolarHBondContact O-N 3.43Å; K885-R891 PolarHBondContact O-NH2 2.81Å
886	H	88.1	Confident	87.7	Confident	73 Å²	73	47 Å²	47	34%	0.338	22%	0.22	S	C	.	.	H	α-helix	trans	-97.9	-19.3	-170.6	-72.4	-84.1	0	0	0	114.9	M91 M882 L883	M91-H886 HydrophobicContact CE-CB 4.15Å; M882-H886 PolarHBondContact O-CD2 3.05Å; M882-H886 VanDerWaalsContact O-CD2 3.32Å; M882-H886 PolarHBondContact O-N 3.33Å; L883-H886 PolarHBondContact O-N 2.93Å
887	V	90.2	Very high	87.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.219	C	C	.	.			trans	-113.9	99.8	179.6	-176.2	0	0	0	0	108.9	N84 V88 L883 I889 C890	N84-V887 HydrophobicContact CB-CG1 4.09Å; N84-V887 HydrophobicContact CB-CG2 4.34Å; V88-V887 HydrophobicContact CG2-CG2 3.53Å; L883-V887 HydrophobicContact CD1-CB 4.21Å; L883-V887 HydrophobicContact CD1-CG2 3.72Å; L883-V887 WeakPolarHBondContact O-CB 3.34Å; L883-V887 PolarHBondContact O-N 2.97Å; V887-I889 VanDerWaalsContact C-N 3.3Å; V887-I889 HydrophobicContact CG1-CG2 3.71Å; V887-I889 PolarHBondContact O-N 3.4Å; V887-C890 WeakPolarHBondContact CG1-SG 3.29Å; V887-C890 WeakPolarHBondContact O-CB 3.46Å; V887-C890 PolarHBondContact O-N 3.43Å
888	T	87.7	Confident	88.2	Confident	85 Å²	85	46.7 Å²	46.7	52%	0.521	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-64.2	-30.8	-169.9	50.3	0	0	0	0	114	C890 R891	T888-C890 PolarHBondContact O-N 2.99Å; T888-R891 WeakPolarHBondContact O-CB 3.47Å; T888-R891 WeakPolarHBondContact O-CG 3.39Å; T888-R891 PolarHBondContact O-N 3.44Å
889	I	86.4	Confident	88.3	Confident	6 Å²	6	46.6 Å²	46.6	3%	0.031	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-64.9	-27	179.2	-168.4	174.8	0	0	0	112.5	L76 L79 V887 R891 E892 I895 V995	L76-I889 HydrophobicContact CD1-CD1 4.16Å; L79-I889 HydrophobicContact CD1-CD1 3.42Å; L79-I889 VanDerWaalsContact CD1-CD1 3.42Å; L79-I889 HydrophobicContact CD2-CB 4.43Å; L79-I889 HydrophobicContact CD2-CD1 3.41Å; L79-I889 VanDerWaalsContact CD2-CD1 3.41Å; L79-I889 HydrophobicContact CD2-CG1 4.49Å; L79-I889 HydrophobicContact CD2-CG2 3.99Å; L79-I889 HydrophobicContact CG-CD1 4Å; V887-I889 VanDerWaalsContact C-N 3.3Å; V887-I889 HydrophobicContact CG1-CG2 3.71Å; V887-I889 PolarHBondContact O-N 3.4Å; I889-R891 PolarHBondContact O-N 2.94Å; I889-E892 HydrophobicContact CG1-CG 4.49Å; I889-E892 WeakPolarHBondContact O-CB 3.37Å; I889-E892 PolarHBondContact O-N 2.7Å; I889-I895 HydrophobicContact CD1-CD1 3.58Å; I889-I895 HydrophobicContact CG1-CD1 3.41Å; I889-I895 VanDerWaalsContact CG1-CD1 3.41Å; I889-I895 HydrophobicContact CG1-CG2 4.24Å; I889-V995 HydrophobicContact CD1-CG1 4.24Å; I889-V995 HydrophobicContact CG2-CG1 4.36Å
890	C	88.4	Confident	88.5	Confident	4 Å²	4	46.4 Å²	46.4	3%	0.027	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-68.8	1.6	178.7	-54.8	0	0	0	0	113.5	V887 T888 C897	V887-C890 WeakPolarHBondContact CG1-SG 3.29Å; V887-C890 WeakPolarHBondContact O-CB 3.46Å; V887-C890 PolarHBondContact O-N 3.43Å; T888-C890 PolarHBondContact O-N 2.99Å; C890-C897 WeakPolarHBondContact CA-SG 3.18Å; C890-C897 HydrophobicContact CB-CB 3.66Å; C890-C897 WeakPolarHBondContact CB-SG 3.38Å; C890-C897 WeakPolarHBondContact SG-CB 3.09Å; C890-C897 CovalentContact SG-SG 2.03Å; C890-C897 PolarHBondContact SG-SG 3.3Å
891	R	86.7	Confident	88.7	Confident	120 Å²	120	46 Å²	46	45%	0.453	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-101.6	-11.3	176	-50.5	-177.2	-174.4	164.6	1.7	112.7	Y884 K885 T888 I889	Y884-R891 HydrophobicContact CD1-CG 4.35Å; Y884-R891 HydrophobicContact CD2-CG 4.17Å; Y884-R891 HydrophobicContact CE1-CG 3.99Å; Y884-R891 HydrophobicContact CE2-CB 4.15Å; Y884-R891 HydrophobicContact CE2-CG 3.79Å; Y884-R891 HydrophobicContact CG-CG 4.43Å; Y884-R891 PolarHBondContact O-NE 3.43Å; Y884-R891 PolarHBondContact O-NH2 3.47Å; K885-R891 PolarHBondContact O-NH2 2.81Å; T888-R891 WeakPolarHBondContact O-CB 3.47Å; T888-R891 WeakPolarHBondContact O-CG 3.39Å; T888-R891 PolarHBondContact O-N 3.44Å; I889-R891 PolarHBondContact O-N 2.94Å
892	E	85.7	Confident	88.9	Confident	82 Å²	82	44.1 Å²	44.1	38%	0.383	21%	0.208	S	C	.	.	S	Bend	trans	-70.6	147.8	178.3	-64.1	-172.6	-177.2	0	0	110.2	Q74 I889 I895	Q74-E892 PolarHBondContact OE1-OE1 3.41Å; I889-E892 HydrophobicContact CG1-CG 4.49Å; I889-E892 WeakPolarHBondContact O-CB 3.37Å; I889-E892 PolarHBondContact O-N 2.7Å; E892-I895 HydrophobicContact CB-CB 4.33Å; E892-I895 HydrophobicContact CB-CD1 3.82Å; E892-I895 HydrophobicContact CB-CG1 4.03Å; E892-I895 HydrophobicContact CG-CD1 4.43Å; E892-I895 PolarHBondContact O-N 2.82Å; E892-I895 VanDerWaalsContact OE2-CD1 3.3Å; E892-I895 WeakPolarHBondContact OE2-CD1 3.31Å
893	Q	78.2	Confident	89	Confident	180 Å²	180	45.8 Å²	45.8	84%	0.841	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	145	174.1	-67.3	178.2	-9.9	0	0	109	I895	Q893-I895 PolarHBondContact O-N 3.43Å
894	D	79.2	Confident	89.1	Confident	120 Å²	120	45.7 Å²	45.7	64%	0.642	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.3	4	-178	-50.7	-43.1	0	0	0	116.2	R998	D894-R998 PolarHBondContact O-N 3.05Å
895	I	86.2	Confident	89.2	Confident	14 Å²	14	44 Å²	44	7%	0.072	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	117.9	173.5	-57.8	-167.6	0	0	0	110.6	I889 E892 Q893 V995 V996 N997	I889-I895 HydrophobicContact CD1-CD1 3.58Å; I889-I895 HydrophobicContact CG1-CD1 3.41Å; I889-I895 VanDerWaalsContact CG1-CD1 3.41Å; I889-I895 HydrophobicContact CG1-CG2 4.24Å; E892-I895 HydrophobicContact CB-CB 4.33Å; E892-I895 HydrophobicContact CB-CD1 3.82Å; E892-I895 HydrophobicContact CB-CG1 4.03Å; E892-I895 HydrophobicContact CG-CD1 4.43Å; E892-I895 PolarHBondContact O-N 2.82Å; E892-I895 VanDerWaalsContact OE2-CD1 3.3Å; E892-I895 WeakPolarHBondContact OE2-CD1 3.31Å; Q893-I895 PolarHBondContact O-N 3.43Å; I895-V995 HydrophobicContact CG2-CG1 3.7Å; I895-V996 CarbonylContact C-O 3.6Å; I895-V996 WeakPolarHBondContact CA-O 3.29Å; I895-N997 HydrophobicContact CG1-CB 4.33Å
896	N	86.3	Confident	89.3	Confident	18 Å²	18	38.9 Å²	38.9	10%	0.096	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	127	172.2	-170.1	21.1	0	0	0	110.2	V996	N896-V996 PolarHBondContact N-O 2.94Å; N896-V996 PolarHBondContact O-N 3.38Å
897	C	92	Very high	89.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	138.3	174.3	-65.5	0	0	0	0	110.3	Y880 L883 C890 A994	Y880-C897 WeakPolarHBondContact CE2-O 3.32Å; L883-C897 HydrophobicContact CD2-CB 3.68Å; L883-C897 HydrophobicContact CG-CB 4.31Å; C890-C897 WeakPolarHBondContact CA-SG 3.18Å; C890-C897 HydrophobicContact CB-CB 3.66Å; C890-C897 WeakPolarHBondContact CB-SG 3.38Å; C890-C897 WeakPolarHBondContact SG-CB 3.09Å; C890-C897 CovalentContact SG-SG 2.03Å; C890-C897 PolarHBondContact SG-SG 3.3Å; C897-A994 WeakPolarHBondContact CA-O 3.41Å
898	F	93.2	Very high	89.6	Confident	4 Å²	4	35.4 Å²	35.4	2%	0.018	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	161.4	174.7	59.5	-89.2	0	0	0	111.6	F900 I906 A908 I927 E931 A994 V996	F898-F900 HydrophobicContact CD2-CD1 4.07Å; F898-F900 AromaticContact CE2-CD1 3.69Å; F898-F900 HydrophobicContact CE2-CD1 3.69Å; F898-F900 HydrophobicContact CE2-CE1 4.3Å; F898-I906 HydrophobicContact CB-CG2 4.14Å; F898-I906 HydrophobicContact CD2-CD1 4.11Å; F898-I906 HydrophobicContact CD2-CG1 4.22Å; F898-I906 HydrophobicContact CD2-CG2 4.3Å; F898-I906 HydrophobicContact CE2-CD1 4.29Å; F898-A908 WeakPolarHBondContact CA-O 3.41Å; F898-A908 WeakPolarHBondContact CB-O 3.36Å; F898-I927 HydrophobicContact CE2-CD1 4.38Å; F898-E931 HydrophobicContact CE1-CG 3.98Å; F898-E931 HydrophobicContact CZ-CG 3.8Å; F898-A994 HydrophobicContact CD1-CB 4.13Å; F898-A994 HydrophobicContact CD2-CB 3.99Å; F898-A994 HydrophobicContact CE1-CB 3.71Å; F898-A994 HydrophobicContact CE2-CB 3.54Å; F898-A994 HydrophobicContact CG-CB 4.26Å; F898-A994 HydrophobicContact CZ-CB 3.38Å; F898-A994 PolarHBondContact N-O 3.27Å; F898-A994 VanDerWaalsContact N-O 3.12Å; F898-A994 PolarHBondContact O-N 2.91Å; F898-V996 HydrophobicContact CE1-CG2 3.75Å; F898-V996 HydrophobicContact CZ-CG2 4.46Å
899	L	95.2	Very high	89.4	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.01	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	137	170.2	-57.6	178.7	0	0	0	109.3	V88 L92 L883 I906 V907 A908 F992 L993	V88-L899 HydrophobicContact CG1-CD1 4.32Å; V88-L899 HydrophobicContact CG1-CD2 4.38Å; L92-L899 HydrophobicContact CD1-CD1 4.48Å; L883-L899 HydrophobicContact CD1-CD2 4.43Å; L883-L899 HydrophobicContact CD2-CG 4.37Å; L899-I906 CarbonylContact O-C 3.55Å; L899-I906 WeakPolarHBondContact O-CA 3.28Å; L899-I906 WeakPolarHBondContact O-CG2 3.23Å; L899-V907 HydrophobicContact CB-CG2 3.86Å; L899-V907 PolarHBondContact O-N 3.41Å; L899-A908 HydrophobicContact CB-CB 3.79Å; L899-A908 HydrophobicContact CD1-CB 4Å; L899-A908 HydrophobicContact CG-CB 3.9Å; L899-A908 PolarHBondContact N-O 3.28Å; L899-A908 PolarHBondContact O-N 2.81Å; L899-F992 VanDerWaalsContact CA-O 3.32Å; L899-F992 WeakPolarHBondContact CA-O 3.46Å; L899-L993 HydrophobicContact CD2-CB 4.03Å; L899-L993 HydrophobicContact CD2-CD1 3.78Å
900	F	95	Very high	89	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	152.6	170.3	66.8	-86.4	0	0	0	110.6	F898 Y905 I906 I927 F944 F964 I983 V991 F992 A994	F898-F900 HydrophobicContact CD2-CD1 4.07Å; F898-F900 AromaticContact CE2-CD1 3.69Å; F898-F900 HydrophobicContact CE2-CD1 3.69Å; F898-F900 HydrophobicContact CE2-CE1 4.3Å; F900-Y905 CarbonylContact C-O 3.53Å; F900-Y905 WeakPolarHBondContact CA-O 3.28Å; F900-Y905 WeakPolarHBondContact CB-O 3.21Å; F900-I906 HydrophobicContact CB-CG1 4.26Å; F900-I927 HydrophobicContact CD1-CD1 4.3Å; F900-I927 HydrophobicContact CE1-CD1 4.15Å; F900-I927 HydrophobicContact CZ-CD1 4.25Å; F900-F944 HydrophobicContact CZ-CZ 4.33Å; F900-F964 AromaticContact CE2-CD1 3.78Å; F900-F964 HydrophobicContact CE2-CD1 3.78Å; F900-F964 HydrophobicContact CE2-CD2 4.31Å; F900-F964 AromaticContact CE2-CE1 3.8Å; F900-F964 HydrophobicContact CE2-CE1 3.8Å; F900-F964 HydrophobicContact CE2-CE2 4.36Å; F900-F964 HydrophobicContact CE2-CG 4.04Å; F900-F964 HydrophobicContact CE2-CZ 4.1Å; F900-F964 HydrophobicContact CZ-CD1 4.42Å; F900-F964 HydrophobicContact CZ-CE1 4.35Å; F900-I983 HydrophobicContact CE1-CG2 3.89Å; F900-I983 HydrophobicContact CZ-CG2 3.86Å; F900-V991 CarbonylContact O-C 3.52Å; F900-V991 VanDerWaalsContact O-CA 3.25Å; F900-V991 WeakPolarHBondContact O-CA 3.5Å; F900-V991 WeakPolarHBondContact O-CB 3.12Å; F900-F992 HydrophobicContact CD1-CB 4.1Å; F900-F992 HydrophobicContact CD2-CB 4.3Å; F900-F992 HydrophobicContact CD2-CD2 4.07Å; F900-F992 HydrophobicContact CD2-CG 4.47Å; F900-F992 HydrophobicContact CE1-CB 3.6Å; F900-F992 HydrophobicContact CE1-CG 4.46Å; F900-F992 HydrophobicContact CE2-CB 3.81Å; F900-F992 AromaticContact CE2-CD2 3.71Å; F900-F992 HydrophobicContact CE2-CD2 3.71Å; F900-F992 AromaticContact CE2-CG 3.83Å; F900-F992 HydrophobicContact CE2-CG 3.83Å; F900-F992 HydrophobicContact CG-CB 4.44Å; F900-F992 HydrophobicContact CZ-CB 3.45Å; F900-F992 VanDerWaalsContact CZ-CB 3.45Å; F900-F992 HydrophobicContact CZ-CD2 4.21Å; F900-F992 AromaticContact CZ-CG 3.84Å; F900-F992 HydrophobicContact CZ-CG 3.84Å; F900-F992 PolarHBondContact N-O 3.36Å; F900-F992 PolarHBondContact O-N 3.4Å; F900-A994 HydrophobicContact CD1-CB 4.5Å; F900-A994 HydrophobicContact CE1-CB 4.21Å
901	D	94.8	Very high	87.9	Confident	3 Å²	3	33.5 Å²	33.5	2%	0.016	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	179.3	-176.7	77.9	-6.1	0	0	0	113.4	R821 R903 G904 Y905 V907 N990 V991	R821-D901 IonicContact CZ-OD2 2.71Å; R821-D901 IonicContact NH1-OD2 3.65Å; R821-D901 PolarHBondContact NH1-OD2 2.77Å; R821-D901 IonicContact NH2-OD2 2.78Å; R821-D901 PolarHBondContact NH2-OD2 3.01Å; D901-R903 PolarHBondContact O-N 2.73Å; D901-R903 VanDerWaalsContact OD1-C 3.32Å; D901-R903 WeakPolarHBondContact OD1-CA 3.28Å; D901-R903 PolarHBondContact OD1-N 2.76Å; D901-G904 PolarHBondContact O-N 3.11Å; D901-G904 PolarHBondContact OD1-N 3.15Å; D901-Y905 PolarHBondContact N-O 3.23Å; D901-Y905 PolarHBondContact OD1-N 3.05Å; D901-V907 HydrophobicContact CB-CG1 4.27Å; D901-N990 CarbonylContact C-O 3.51Å; D901-V991 HydrophobicContact CB-CG1 4.41Å
902	D	94.4	Very high	86.4	Confident	6 Å²	6	32 Å²	32	3%	0.032	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-5.9	177.7	65.2	-63.2	0	0	0	114.9	R821 H825 V963 F964 T966 N990 F992	R821-D902 IonicContact CZ-OD1 2.91Å; R821-D902 IonicContact NE-OD1 2.98Å; R821-D902 IonicContact NH1-OD1 2.74Å; R821-D902 PolarHBondContact NH1-OD1 3.16Å; R821-D902 IonicContact NH1-OD2 2.72Å; H825-D902 IonicContact CE1-OD2 3.26Å; D902-V963 WeakPolarHBondContact O-CA 3.39Å; D902-F964 PolarHBondContact O-N 3.17Å; D902-T966 HydrophobicContact CB-CG2 3.71Å; D902-N990 HydrophobicContact CB-CB 4.4Å; D902-N990 PolarHBondContact N-O 2.89Å; D902-N990 PolarHBondContact OD1-ND2 3.14Å; D902-F992 HydrophobicContact CB-CE2 4.46Å
903	R	92.2	Very high	84.9	Confident	49 Å²	49	32.3 Å²	32.3	19%	0.185	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-0.6	175.8	-58.2	-54.7	-177.2	106.5	1	113.3	D901 Y905 H926 M961 Y962	D901-R903 PolarHBondContact O-N 2.73Å; D901-R903 VanDerWaalsContact OD1-C 3.32Å; D901-R903 WeakPolarHBondContact OD1-CA 3.28Å; D901-R903 PolarHBondContact OD1-N 2.76Å; R903-Y905 HydrophobicContact CB-CD2 3.93Å; R903-Y905 HydrophobicContact CB-CE2 4.19Å; R903-H926 PolarHBondContact O-CD2 3.26Å; R903-H926 PolarHBondContact O-NE2 2.83Å; R903-M961 PolarHBondContact NH1-SD 3.44Å; R903-Y962 WeakPolarHBondContact CD-O 3.33Å
904	G	92.7	Very high	83.4	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.131	C	C	.	.	S	Bend	trans	90.3	5.5	177.3	0	0	0	0	0	115.2	D901 H926 I927 F964	D901-G904 PolarHBondContact O-N 3.11Å; D901-G904 PolarHBondContact OD1-N 3.15Å; G904-H926 VanDerWaalsContact C-CD2 3.42Å; G904-H926 PolarHBondContact O-CD2 2.87Å; G904-I927 PolarHBondContact O-N 3.08Å; G904-F964 VanDerWaalsContact CA-CE2 3.43Å
905	Y	91.9	Very high	82	Confident	43 Å²	43	24.2 Å²	24.2	17%	0.169	11%	0.114	C	C	.	.	B	Isolated β-bridge	trans	-83.1	133.6	176.9	-68.2	-81.2	0	0	0	111	F900 D901 R903 V907 P922 H926	F900-Y905 CarbonylContact C-O 3.53Å; F900-Y905 WeakPolarHBondContact CA-O 3.28Å; F900-Y905 WeakPolarHBondContact CB-O 3.21Å; D901-Y905 PolarHBondContact N-O 3.23Å; D901-Y905 PolarHBondContact OD1-N 3.05Å; R903-Y905 HydrophobicContact CB-CD2 3.93Å; R903-Y905 HydrophobicContact CB-CE2 4.19Å; Y905-V907 PolarHBondContact O-N 3.02Å; Y905-P922 HydrophobicContact CD1-CB 4.45Å; Y905-P922 WeakPolarHBondContact CD1-O 3.35Å; Y905-P922 HydrophobicContact CE1-CB 3.93Å; Y905-P922 WeakPolarHBondContact CE1-O 3.45Å; Y905-H926 HydrophobicContact CD1-CB 4.12Å; Y905-H926 HydrophobicContact CE1-CB 4.09Å
906	I	91.4	Very high	80.1	Confident	8 Å²	8	26.1 Å²	26.1	4%	0.041	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	114.8	-177.6	-59.7	-178	0	0	0	109.9	P834 F898 L899 F900 Y909 L925 K930	P834-I906 WeakPolarHBondContact CD-O 3.32Å; P834-I906 WeakPolarHBondContact CG-O 3.41Å; F898-I906 HydrophobicContact CB-CG2 4.14Å; F898-I906 HydrophobicContact CD2-CD1 4.11Å; F898-I906 HydrophobicContact CD2-CG1 4.22Å; F898-I906 HydrophobicContact CD2-CG2 4.3Å; F898-I906 HydrophobicContact CE2-CD1 4.29Å; L899-I906 CarbonylContact O-C 3.55Å; L899-I906 WeakPolarHBondContact O-CA 3.28Å; L899-I906 WeakPolarHBondContact O-CG2 3.23Å; F900-I906 HydrophobicContact CB-CG1 4.26Å; I906-Y909 HydrophobicContact CG2-CD1 4.13Å; I906-Y909 HydrophobicContact CG2-CG 4.33Å; I906-L925 WeakPolarHBondContact CB-O 3.05Å; I906-L925 WeakPolarHBondContact CG1-O 3.14Å; I906-L925 PolarHBondContact N-O 3.23Å; I906-K930 HydrophobicContact CD1-CB 3.53Å; I906-K930 HydrophobicContact CD1-CG 3.86Å
907	V	91.9	Very high	78.3	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	-8	-176	-63.3	0	0	0	0	113.6	I831 V845 V876 L899 D901 Y905 V991	I831-V907 HydrophobicContact CG2-CB 3.99Å; I831-V907 HydrophobicContact CG2-CG1 4.13Å; I831-V907 HydrophobicContact CG2-CG2 4.05Å; V845-V907 HydrophobicContact CG1-CB 4.09Å; V845-V907 HydrophobicContact CG1-CG1 4.4Å; V876-V907 VanDerWaalsContact CG2-O 3.28Å; V876-V907 WeakPolarHBondContact CG2-O 3.45Å; L899-V907 HydrophobicContact CB-CG2 3.86Å; L899-V907 PolarHBondContact O-N 3.41Å; D901-V907 HydrophobicContact CB-CG1 4.27Å; Y905-V907 PolarHBondContact O-N 3.02Å; V907-V991 HydrophobicContact CG2-CG1 4.01Å
908	A	91.5	Very high	76.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	118	170.9	0	0	0	0	0	108.9	L879 F898 L899	L879-A908 HydrophobicContact CB-CB 3.64Å; F898-A908 WeakPolarHBondContact CA-O 3.41Å; F898-A908 WeakPolarHBondContact CB-O 3.36Å; L899-A908 HydrophobicContact CB-CB 3.79Å; L899-A908 HydrophobicContact CD1-CB 4Å; L899-A908 HydrophobicContact CG-CB 3.9Å; L899-A908 PolarHBondContact N-O 3.28Å; L899-A908 PolarHBondContact O-N 2.81Å
909	Y	84.5	Confident	74.5	Confident	26 Å²	26	33.4 Å²	33.4	10%	0.102	18%	0.177	C	C	.	.			trans	-145.6	159.4	-178.9	65.6	-87	0	0	0	111.9	V876 Y880 I906 N911 L925	V876-Y909 HydrophobicContact CB-CE1 4.34Å; V876-Y909 HydrophobicContact CG1-CE1 3.74Å; V876-Y909 HydrophobicContact CG2-CD1 3.88Å; V876-Y909 HydrophobicContact CG2-CE1 3.64Å; Y880-Y909 WeakPolarHBondContact CB-O 3.41Å; Y880-Y909 VanDerWaalsContact CD2-C 3.43Å; I906-Y909 HydrophobicContact CG2-CD1 4.13Å; I906-Y909 HydrophobicContact CG2-CG 4.33Å; Y909-N911 HydrophobicContact CE2-CB 4.27Å; Y909-L925 HydrophobicContact CE1-CD2 4.17Å
910	D	78.3	Confident	72.6	Confident	25 Å²	25	40.2 Å²	40.2	13%	0.134	21%	0.207	C	C	.	.			trans	-81.1	122.1	171	-167.8	0.2	0	0	0	110.7	Y880 M912	Y880-D910 HydrophobicContact CD2-CB 4.43Å; Y880-D910 HydrophobicContact CE1-CB 3.89Å; Y880-D910 HydrophobicContact CE2-CB 3.76Å; Y880-D910 VanDerWaalsContact CZ-CB 3.46Å; D910-M912 PolarHBondContact O-N 3.36Å; D910-M912 WeakPolarHBondContact OD1-CB 3.4Å; D910-M912 WeakPolarHBondContact OD1-CG 3.4Å; D910-M912 PolarHBondContact OD1-N 2.73Å; D910-M912 WeakPolarHBondContact OD2-CB 3.19Å; D910-M912 WeakPolarHBondContact OD2-CG 3.38Å
911	N	65.8	Low	71.1	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.016	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	0.9	175.8	66.3	-10.8	0	0	0	113.1	Y909 Q913 E1104	Y909-N911 HydrophobicContact CE2-CB 4.27Å; N911-Q913 VanDerWaalsContact C-N 3.3Å; N911-Q913 PolarHBondContact O-N 3.39Å; N911-E1104 PolarHBondContact ND2-OE1 2.87Å
912	M	53.8	Low	69.8	Low	89 Å²	89	47.3 Å²	47.3	44%	0.438	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-32.2	177.3	-75.2	-179.9	162.9	0	0	113.9	D910 L914 H1107	D910-M912 PolarHBondContact O-N 3.36Å; D910-M912 WeakPolarHBondContact OD1-CB 3.4Å; D910-M912 WeakPolarHBondContact OD1-CG 3.4Å; D910-M912 PolarHBondContact OD1-N 2.73Å; D910-M912 WeakPolarHBondContact OD2-CB 3.19Å; D910-M912 WeakPolarHBondContact OD2-CG 3.38Å; M912-L914 PolarHBondContact O-N 3.18Å; M912-H1107 PolarHBondContact O-NE2 2.88Å; M912-H1107 VanDerWaalsContact O-NE2 3.1Å
913	Q	55.2	Low	68.9	Low	89 Å²	89	47.2 Å²	47.2	42%	0.416	24%	0.239	S	C	.	.	S	Bend	trans	-86.5	102.6	-175.4	-71.9	-179.6	8.1	0	0	111.4	N911 Q915	N911-Q913 VanDerWaalsContact C-N 3.3Å; N911-Q913 PolarHBondContact O-N 3.39Å; Q913-Q915 PolarHBondContact O-N 3.38Å
914	L	45.7	Very low	68.1	Low	68 Å²	68	45 Å²	45	36%	0.356	23%	0.232	S	C	.	.			trans	-47.6	107.5	166.3	-103.5	138.4	0	0	0	111.1	M912 V1108 R1112 V1131	M912-L914 PolarHBondContact O-N 3.18Å; L914-V1108 HydrophobicContact CD1-CB 4.14Å; L914-V1108 HydrophobicContact CD1-CG1 3.73Å; L914-V1108 HydrophobicContact CD1-CG2 3.29Å; L914-V1108 HydrophobicContact CD2-CG1 4.16Å; L914-V1108 HydrophobicContact CG-CG1 4.33Å; L914-V1108 HydrophobicContact CG-CG2 3.91Å; L914-R1112 HydrophobicContact CD2-CB 4.41Å; L914-R1112 WeakPolarHBondContact CD2-O 3.48Å; L914-V1131 HydrophobicContact CD2-CG2 4.43Å
915	Q	49.5	Very low	67.6	Low	62 Å²	62	45.2 Å²	45.2	29%	0.29	23%	0.233	S	C	.	.			trans	-129.8	113.7	165	-71	-176.4	-2.1	0	0	107.3	Q913	Q913-Q915 PolarHBondContact O-N 3.38Å
916	G	47.6	Very low	67.5	Low	54 Å²	54	43.1 Å²	43.1	56%	0.557	23%	0.225	S	C	*	.			trans	-58.8	157.2	-168	0	0	0	0	0	115.4	V918	G916-V918 WeakPolarHBondContact O-CG2 3.46Å; G916-V918 PolarHBondContact O-N 3.47Å
917	D	47.5	Very low	67.5	Low	114 Å²	114	42.8 Å²	42.8	61%	0.61	22%	0.223	S	C	*	.	S	Bend	trans	40.7	-17	164	-87.9	-51.8	0	0	0	123.2	I919 R1112	D917-I919 VanDerWaalsContact C-N 3.27Å; D917-I919 PolarHBondContact O-N 3.28Å; D917-R1112 IonicContact OD1-CZ 2.75Å; D917-R1112 IonicContact OD1-NH1 3.72Å; D917-R1112 PolarHBondContact OD1-NH1 2.97Å; D917-R1112 IonicContact OD1-NH2 3.27Å; D917-R1112 PolarHBondContact OD1-NH2 2.99Å; D917-R1112 IonicContact OD2-CZ 3.43Å; D917-R1112 IonicContact OD2-NH1 3.72Å; D917-R1112 PolarHBondContact OD2-NH1 2.68Å
918	V	50.2	Low	67.3	Low	36 Å²	36	43 Å²	43	22%	0.218	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-88	4.5	-162.4	-174.5	0	0	0	0	113.5	G916 K920 V1011	G916-V918 WeakPolarHBondContact O-CG2 3.46Å; G916-V918 PolarHBondContact O-N 3.47Å; V918-K920 PolarHBondContact O-N 3.19Å; V918-V1011 HydrophobicContact CG1-CB 3.79Å; V918-V1011 HydrophobicContact CG1-CG1 3.31Å; V918-V1011 HydrophobicContact CG1-CG2 4.1Å
919	I	55.1	Low	67	Low	24 Å²	24	45.7 Å²	45.7	12%	0.123	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-70.6	-11.4	-166.7	-53.6	-178.3	0	0	0	113.6	H843 D917 R921 F1128 S1129 L1134	H843-I919 WeakPolarHBondContact CE1-CG2 3.03Å; D917-I919 VanDerWaalsContact C-N 3.27Å; D917-I919 PolarHBondContact O-N 3.28Å; I919-R921 PolarHBondContact O-N 3.25Å; I919-F1128 HydrophobicContact CG2-CD1 4.49Å; I919-F1128 HydrophobicContact CG2-CE1 3.65Å; I919-F1128 HydrophobicContact CG2-CZ 4.46Å; I919-S1129 WeakPolarHBondContact CD1-OG 3.36Å; I919-L1134 HydrophobicContact CD1-CD2 4.32Å
920	K	55.3	Low	67	Low	146 Å²	146	46.2 Å²	46.2	64%	0.635	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-68.7	-32.2	-175.6	-67.5	-173.6	-179.6	-179.2	0	114.3	V918	V918-K920 PolarHBondContact O-N 3.19Å
921	R	63.3	Low	67.4	Low	96 Å²	96	45.4 Å²	45.4	36%	0.362	24%	0.235	S	C	.	.	S	Bend	trans	-115.8	146.7	-175.4	-71.7	-155.4	-174.5	-137.2	-3.7	112.5	I919 E923 G924 V1011 T1012	I919-R921 PolarHBondContact O-N 3.25Å; R921-E923 WeakPolarHBondContact CB-OE2 3.34Å; R921-E923 PolarHBondContact O-N 3.04Å; R921-E923 VanDerWaalsContact O-N 3.13Å; R921-G924 PolarHBondContact O-N 3.03Å; R921-V1011 WeakPolarHBondContact CD-O 2.96Å; R921-V1011 WeakPolarHBondContact CG-O 3.21Å; R921-V1011 PolarHBondContact NE-O 3.41Å; R921-T1012 PolarHBondContact NE-O 3.07Å; R921-T1012 PolarHBondContact NH2-O 3.03Å
922	P	69.1	Low	68.4	Low	56 Å²	56	46.8 Å²	46.8	36%	0.364	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-55.1	-32.1	-179.8	-24.7	33.8	0	0	0	113.9	Y905 G924 L925	Y905-P922 HydrophobicContact CD1-CB 4.45Å; Y905-P922 WeakPolarHBondContact CD1-O 3.35Å; Y905-P922 HydrophobicContact CE1-CB 3.93Å; Y905-P922 WeakPolarHBondContact CE1-O 3.45Å; P922-G924 PolarHBondContact O-N 3.42Å; P922-G924 VanDerWaalsContact O-N 3.17Å; P922-L925 PolarHBondContact O-N 3.24Å
923	E	74.3	Confident	70	Confident	3 Å²	3	44.3 Å²	44.3	1%	0.014	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-57.7	-29.2	178.2	-68.5	71	-152.4	0	0	112.7	R921 L925 H926 R1014	R921-E923 WeakPolarHBondContact CB-OE2 3.34Å; R921-E923 PolarHBondContact O-N 3.04Å; R921-E923 VanDerWaalsContact O-N 3.13Å; E923-L925 PolarHBondContact O-N 3.21Å; E923-H926 WeakPolarHBondContact O-CB 3.41Å; E923-H926 PolarHBondContact O-N 2.93Å; E923-R1014 IonicContact OE1-CZ 2.68Å; E923-R1014 IonicContact OE1-NE 3.58Å; E923-R1014 PolarHBondContact OE1-NE 3.43Å; E923-R1014 IonicContact OE1-NH2 2.78Å; E923-R1014 PolarHBondContact OE1-NH2 2.67Å; E923-R1014 IonicContact OE2-NE 3.19Å
924	G	76.2	Confident	71.6	Confident	2 Å²	2	40.1 Å²	40.1	2%	0.021	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-64.6	-17.1	174.7	0	0	0	0	0	114.6	R921 P922 H929 K930	R921-G924 PolarHBondContact O-N 3.03Å; P922-G924 PolarHBondContact O-N 3.42Å; P922-G924 VanDerWaalsContact O-N 3.17Å; G924-H929 PolarHBondContact O-CD2 2.92Å; G924-H929 VanDerWaalsContact O-CD2 3.25Å; G924-K930 WeakPolarHBondContact O-CE 3.36Å
925	L	82.3	Confident	73.8	Confident	5 Å²	5	37 Å²	37	3%	0.026	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-109.9	9.4	-179.9	-63.2	170.4	0	0	0	112.1	P834 I906 Y909 P922 E923	P834-L925 HydrophobicContact CB-CD1 4.25Å; P834-L925 HydrophobicContact CG-CB 4.12Å; P834-L925 HydrophobicContact CG-CD1 3.37Å; P834-L925 HydrophobicContact CG-CG 4.33Å; I906-L925 WeakPolarHBondContact CB-O 3.05Å; I906-L925 WeakPolarHBondContact CG1-O 3.14Å; I906-L925 PolarHBondContact N-O 3.23Å; Y909-L925 HydrophobicContact CE1-CD2 4.17Å; P922-L925 PolarHBondContact O-N 3.24Å; E923-L925 PolarHBondContact O-N 3.21Å
926	H	89.4	Confident	75.6	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-80.4	146.7	174.3	-169.3	-95.3	0	0	0	111.3	R903 G904 Y905 E923 T928 H929 K930 Y962	R903-H926 PolarHBondContact O-CD2 3.26Å; R903-H926 PolarHBondContact O-NE2 2.83Å; G904-H926 VanDerWaalsContact C-CD2 3.42Å; G904-H926 PolarHBondContact O-CD2 2.87Å; Y905-H926 HydrophobicContact CD1-CB 4.12Å; Y905-H926 HydrophobicContact CE1-CB 4.09Å; E923-H926 WeakPolarHBondContact O-CB 3.41Å; E923-H926 PolarHBondContact O-N 2.93Å; H926-T928 VanDerWaalsContact CE1-CG2 3.49Å; H926-T928 WeakPolarHBondContact CE1-CG2 3.26Å; H926-T928 WeakPolarHBondContact ND1-CG2 3.31Å; H926-T928 PolarHBondContact ND1-N 3.35Å; H926-T928 PolarHBondContact ND1-OG1 3.24Å; H926-T928 PolarHBondContact O-N 3.26Å; H926-H929 PolarHBondContact O-N 2.87Å; H926-K930 PolarHBondContact O-N 3.4Å; H926-Y962 AromaticContact CE1-CD2 3.38Å; H926-Y962 WeakPolarHBondContact CE1-CD2 3.23Å; H926-Y962 AromaticContact CE1-CE2 3.94Å; H926-Y962 AromaticContact NE2-CD2 3.72Å
927	I	90.1	Very high	77.5	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-56.6	-33.7	-178	-167.9	172.2	0	0	0	113	F898 F900 G904 H929 K930 E931 I938 F964	F898-I927 HydrophobicContact CE2-CD1 4.38Å; F900-I927 HydrophobicContact CD1-CD1 4.3Å; F900-I927 HydrophobicContact CE1-CD1 4.15Å; F900-I927 HydrophobicContact CZ-CD1 4.25Å; G904-I927 PolarHBondContact O-N 3.08Å; I927-H929 PolarHBondContact O-N 2.83Å; I927-K930 PolarHBondContact O-N 3.37Å; I927-E931 HydrophobicContact CG1-CB 4.01Å; I927-E931 CarbonylContact O-C 3.53Å; I927-E931 VanDerWaalsContact O-CA 3.31Å; I927-E931 WeakPolarHBondContact O-CA 3.38Å; I927-E931 PolarHBondContact O-N 3.42Å; I927-I938 HydrophobicContact CD1-CD1 3.98Å; I927-F964 HydrophobicContact CG2-CZ 4.09Å
928	T	89.4	Confident	79.6	Confident	4 Å²	4	30.9 Å²	30.9	3%	0.025	15%	0.154	C	C	.	.	H	α-helix	trans	-65.6	-25.5	176.4	58.8	0	0	0	0	113.2	H926 A935 Y962 C1007 E1028 C1029	H926-T928 VanDerWaalsContact CE1-CG2 3.49Å; H926-T928 WeakPolarHBondContact CE1-CG2 3.26Å; H926-T928 WeakPolarHBondContact ND1-CG2 3.31Å; H926-T928 PolarHBondContact ND1-N 3.35Å; H926-T928 PolarHBondContact ND1-OG1 3.24Å; H926-T928 PolarHBondContact O-N 3.26Å; T928-A935 HydrophobicContact CG2-CB 3.99Å; T928-Y962 HydrophobicContact CG2-CD2 4.38Å; T928-Y962 HydrophobicContact CG2-CE2 3.86Å; T928-C1007 WeakPolarHBondContact O-CB 3.44Å; T928-E1028 WeakPolarHBondContact CG2-O 3.5Å; T928-C1029 WeakPolarHBondContact OG1-CA 3.3Å; T928-C1029 PolarHBondContact OG1-SG 2.93Å; T928-C1029 VanDerWaalsContact OG1-SG 3.34Å
929	H	85.5	Confident	81.5	Confident	57 Å²	57	29.7 Å²	29.7	26%	0.264	15%	0.147	S	C	.	.	H	α-helix	trans	-90.6	-45.4	175.5	-173	72.5	0	0	0	111.5	G924 H926 I927	G924-H929 PolarHBondContact O-CD2 2.92Å; G924-H929 VanDerWaalsContact O-CD2 3.25Å; H926-H929 PolarHBondContact O-N 2.87Å; I927-H929 PolarHBondContact O-N 2.83Å
930	K	82.9	Confident	83.1	Confident	37 Å²	37	35.6 Å²	35.6	16%	0.161	17%	0.174	C	C	.	.	H	α-helix	trans	-77.3	-32.9	-174.7	-74.5	-66.3	-170.7	-177.4	0	113.7	I906 G924 H926 I927	I906-K930 HydrophobicContact CD1-CB 3.53Å; I906-K930 HydrophobicContact CD1-CG 3.86Å; G924-K930 WeakPolarHBondContact O-CE 3.36Å; H926-K930 PolarHBondContact O-N 3.4Å; I927-K930 PolarHBondContact O-N 3.37Å
931	E	87.4	Confident	84.7	Confident	8 Å²	8	32.1 Å²	32.1	4%	0.037	16%	0.159	C	C	.	.			trans	-136.8	62.1	-176.6	-65.8	-66.4	166.8	0	0	110.9	F898 I927 L933 I934 A935 R998	F898-E931 HydrophobicContact CE1-CG 3.98Å; F898-E931 HydrophobicContact CZ-CG 3.8Å; I927-E931 HydrophobicContact CG1-CB 4.01Å; I927-E931 CarbonylContact O-C 3.53Å; I927-E931 VanDerWaalsContact O-CA 3.31Å; I927-E931 WeakPolarHBondContact O-CA 3.38Å; I927-E931 PolarHBondContact O-N 3.42Å; E931-L933 VanDerWaalsContact C-N 3.3Å; E931-L933 PolarHBondContact O-N 2.83Å; E931-I934 HydrophobicContact CB-CB 4.14Å; E931-I934 HydrophobicContact CB-CD1 4.14Å; E931-I934 HydrophobicContact CB-CG1 4.29Å; E931-I934 HydrophobicContact CG-CD1 4.24Å; E931-I934 PolarHBondContact O-N 3.47Å; E931-A935 WeakPolarHBondContact O-CB 3.37Å; E931-A935 PolarHBondContact O-N 3.34Å; E931-R998 IonicContact OE1-CZ 2.74Å; E931-R998 IonicContact OE1-NH2 2.81Å; E931-R998 PolarHBondContact OE1-NH2 3.25Å; E931-R998 IonicContact OE2-CZ 3.51Å; E931-R998 IonicContact OE2-NH2 3.86Å; E931-R998 PolarHBondContact OE2-NH2 2.93Å
932	P	87.5	Confident	85.8	Confident	31 Å²	31	32.4 Å²	32.4	20%	0.201	18%	0.175	C	C	.	.	H	α-helix	trans	-62.4	-33.6	-171.9	24.2	-34.2	0	0	0	113.5	S936 A1005 C1007	P932-S936 WeakPolarHBondContact O-CB 3.01Å; P932-S936 PolarHBondContact O-N 3.28Å; P932-S936 PolarHBondContact O-OG 3.24Å; P932-A1005 HydrophobicContact CB-CB 4.17Å; P932-A1005 WeakPolarHBondContact CG-O 3.38Å; P932-C1007 HydrophobicContact CB-CB 4.47Å
933	L	86	Confident	86.8	Confident	38 Å²	38	33.9 Å²	33.9	20%	0.199	18%	0.181	C	C	.	.	H	α-helix	trans	-61.6	-55.6	175.4	-74.3	162.2	0	0	0	110.5	E931 A935 S936 E937 L979 Q1003 A1005	E931-L933 VanDerWaalsContact C-N 3.3Å; E931-L933 PolarHBondContact O-N 2.83Å; L933-A935 VanDerWaalsContact C-N 3.31Å; L933-A935 PolarHBondContact O-N 3.35Å; L933-S936 PolarHBondContact O-N 3.42Å; L933-S936 PolarHBondContact O-OG 2.96Å; L933-E937 PolarHBondContact O-N 3.38Å; L933-L979 HydrophobicContact CB-CD2 3.7Å; L933-L979 HydrophobicContact CD1-CD2 4.06Å; L933-Q1003 HydrophobicContact CD1-CB 3.94Å; L933-Q1003 HydrophobicContact CD2-CB 4.25Å; L933-A1005 HydrophobicContact CB-CB 4.25Å; L933-A1005 HydrophobicContact CD2-CB 3.4Å; L933-A1005 VanDerWaalsContact CD2-CB 3.4Å; L933-A1005 HydrophobicContact CG-CB 3.62Å
934	I	89.9	Confident	87.7	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-59.4	-46.2	178.9	-55.6	-178.4	0	0	0	109.7	E931 S936 E937 I938 L979 Y981 I983 V996	E931-I934 HydrophobicContact CB-CB 4.14Å; E931-I934 HydrophobicContact CB-CD1 4.14Å; E931-I934 HydrophobicContact CB-CG1 4.29Å; E931-I934 HydrophobicContact CG-CD1 4.24Å; E931-I934 PolarHBondContact O-N 3.47Å; I934-S936 VanDerWaalsContact C-N 3.33Å; I934-S936 PolarHBondContact O-N 2.82Å; I934-E937 PolarHBondContact O-N 3.29Å; I934-I938 HydrophobicContact CG2-CD1 4.48Å; I934-I938 HydrophobicContact CG2-CG2 4Å; I934-I938 WeakPolarHBondContact O-CG1 3.28Å; I934-I938 WeakPolarHBondContact O-CG2 3.34Å; I934-I938 PolarHBondContact O-N 2.88Å; I934-L979 HydrophobicContact CG1-CD2 3.81Å; I934-Y981 HydrophobicContact CD1-CD1 4.37Å; I934-Y981 HydrophobicContact CD1-CG 4.3Å; I934-Y981 HydrophobicContact CG1-CD1 4.07Å; I934-Y981 HydrophobicContact CG1-CE1 4.3Å; I934-Y981 HydrophobicContact CG1-CG 4.41Å; I934-Y981 HydrophobicContact CG2-CD2 4.16Å; I934-Y981 HydrophobicContact CG2-CE1 4.38Å; I934-Y981 HydrophobicContact CG2-CE2 4.01Å; I934-Y981 HydrophobicContact CG2-CG 4.43Å; I934-I983 HydrophobicContact CG2-CD1 3.99Å; I934-V996 HydrophobicContact CD1-CB 4.44Å; I934-V996 HydrophobicContact CD1-CG1 4.03Å; I934-V996 HydrophobicContact CD1-CG2 3.48Å; I934-V996 VanDerWaalsContact CD1-CG2 3.48Å
935	A	90.7	Very high	88.5	Confident	2 Å²	2	34 Å²	34	2%	0.017	18%	0.18	C	C	.	.	H	α-helix	trans	-56.9	-44.7	178.9	0	0	0	0	0	112.3	T928 E931 L933 E937 I938 L939	T928-A935 HydrophobicContact CG2-CB 3.99Å; E931-A935 WeakPolarHBondContact O-CB 3.37Å; E931-A935 PolarHBondContact O-N 3.34Å; L933-A935 VanDerWaalsContact C-N 3.31Å; L933-A935 PolarHBondContact O-N 3.35Å; A935-E937 VanDerWaalsContact C-N 3.32Å; A935-E937 PolarHBondContact O-N 3.1Å; A935-I938 WeakPolarHBondContact O-CG1 3.48Å; A935-L939 WeakPolarHBondContact O-CB 3.44Å; A935-L939 WeakPolarHBondContact O-CD1 3.4Å; A935-L939 WeakPolarHBondContact O-CG 3.25Å; A935-L939 PolarHBondContact O-N 2.85Å
936	S	87.9	Confident	88.9	Confident	40 Å²	40	40.8 Å²	40.8	28%	0.28	21%	0.206	S	C	.	.	H	α-helix	trans	-64	-35.4	179.2	73	0	0	0	0	113.4	P932 L933 I934	P932-S936 WeakPolarHBondContact O-CB 3.01Å; P932-S936 PolarHBondContact O-N 3.28Å; P932-S936 PolarHBondContact O-OG 3.24Å; L933-S936 PolarHBondContact O-N 3.42Å; L933-S936 PolarHBondContact O-OG 2.96Å; I934-S936 VanDerWaalsContact C-N 3.33Å; I934-S936 PolarHBondContact O-N 2.82Å
937	E	88.4	Confident	88.9	Confident	59 Å²	59	42.3 Å²	42.3	28%	0.276	21%	0.212	S	C	.	.	H	α-helix	trans	-77.3	-46.3	179.1	-70.6	-178	-171.5	0	0	112	L933 I934 A935 L939 Q940 N974 Y981	L933-E937 PolarHBondContact O-N 3.38Å; I934-E937 PolarHBondContact O-N 3.29Å; A935-E937 VanDerWaalsContact C-N 3.32Å; A935-E937 PolarHBondContact O-N 3.1Å; E937-L939 PolarHBondContact O-N 3.33Å; E937-Q940 WeakPolarHBondContact O-CB 3.47Å; E937-Q940 PolarHBondContact O-N 2.97Å; E937-Q940 VanDerWaalsContact O-N 3.07Å; E937-N974 VanDerWaalsContact CD-ND2 3.35Å; E937-N974 PolarHBondContact OE1-ND2 3.44Å; E937-N974 PolarHBondContact OE2-ND2 3.32Å; E937-Y981 WeakPolarHBondContact CB-OH 3.23Å; E937-Y981 WeakPolarHBondContact OE2-CE1 2.94Å; E937-Y981 VanDerWaalsContact OE2-CZ 3.29Å; E937-Y981 PolarHBondContact OE2-OH 3.32Å
938	I	91.5	Very high	88.7	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-65.2	-26.7	-178.8	67.6	-173.7	0	0	0	111.8	I927 I934 A935 Q940 K941 F944 V945 F964 I972 Y981 I983	I927-I938 HydrophobicContact CD1-CD1 3.98Å; I934-I938 HydrophobicContact CG2-CD1 4.48Å; I934-I938 HydrophobicContact CG2-CG2 4Å; I934-I938 WeakPolarHBondContact O-CG1 3.28Å; I934-I938 WeakPolarHBondContact O-CG2 3.34Å; I934-I938 PolarHBondContact O-N 2.88Å; A935-I938 WeakPolarHBondContact O-CG1 3.48Å; I938-Q940 PolarHBondContact O-N 3.13Å; I938-K941 WeakPolarHBondContact O-CB 3.38Å; I938-K941 PolarHBondContact O-N 3.11Å; I938-F944 HydrophobicContact CB-CD1 4.37Å; I938-F944 HydrophobicContact CB-CE1 4.45Å; I938-F944 HydrophobicContact CD1-CE1 4.44Å; I938-V945 HydrophobicContact CB-CG1 4.48Å; I938-V945 HydrophobicContact CG1-CG1 4.27Å; I938-V945 WeakPolarHBondContact O-CG1 3.02Å; I938-F964 HydrophobicContact CD1-CE1 3.89Å; I938-F964 HydrophobicContact CD1-CZ 4.31Å; I938-I972 HydrophobicContact CG2-CG2 3.98Å; I938-Y981 HydrophobicContact CG2-CE2 4.18Å; I938-I983 HydrophobicContact CG2-CD1 4.05Å
939	L	89.4	Confident	88.4	Confident	11 Å²	11	44.8 Å²	44.8	6%	0.058	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.2	174.8	-76.3	171.2	0	0	0	114.1	A935 E937 K941 V945 Y962 C1027	A935-L939 WeakPolarHBondContact O-CB 3.44Å; A935-L939 WeakPolarHBondContact O-CD1 3.4Å; A935-L939 WeakPolarHBondContact O-CG 3.25Å; A935-L939 PolarHBondContact O-N 2.85Å; E937-L939 PolarHBondContact O-N 3.33Å; L939-K941 PolarHBondContact O-N 3.01Å; L939-V945 HydrophobicContact CD2-CG1 4.1Å; L939-V945 HydrophobicContact CD2-CG2 4.26Å; L939-Y962 HydrophobicContact CD1-CE1 4.14Å; L939-Y962 HydrophobicContact CD2-CD1 3.7Å; L939-Y962 HydrophobicContact CD2-CE1 3.37Å; L939-Y962 HydrophobicContact CG-CE1 4.36Å; L939-C1027 HydrophobicContact CD1-CB 3.82Å
940	Q	88.2	Confident	88.2	Confident	148 Å²	148	42.2 Å²	42.2	69%	0.692	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-17.8	172.7	-58.1	179.9	4	0	0	112.1	E937 I938 S942	E937-Q940 WeakPolarHBondContact O-CB 3.47Å; E937-Q940 PolarHBondContact O-N 2.97Å; E937-Q940 VanDerWaalsContact O-N 3.07Å; I938-Q940 PolarHBondContact O-N 3.13Å; Q940-S942 PolarHBondContact O-N 2.64Å
941	K	90.2	Very high	88	Confident	73 Å²	73	41.8 Å²	41.8	32%	0.317	22%	0.215	S	C	.	.			trans	-97.5	84.4	-179.8	-62.9	-174.9	177.2	-174.4	0	111.1	I938 L939 D943 F944 V945 I972	I938-K941 WeakPolarHBondContact O-CB 3.38Å; I938-K941 PolarHBondContact O-N 3.11Å; L939-K941 PolarHBondContact O-N 3.01Å; K941-D943 PolarHBondContact O-N 3.28Å; K941-F944 HydrophobicContact CB-CB 4.22Å; K941-F944 PolarHBondContact O-N 3.33Å; K941-F944 VanDerWaalsContact O-N 3.09Å; K941-V945 PolarHBondContact O-N 2.92Å; K941-I972 HydrophobicContact CD-CD1 3.71Å; K941-I972 HydrophobicContact CD-CG2 4.14Å
942	S	86.5	Confident	87.5	Confident	102 Å²	102	43.2 Å²	43.2	71%	0.713	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-19.5	-173.8	61	0	0	0	0	115.2	Q940 V945	Q940-S942 PolarHBondContact O-N 2.64Å; S942-V945 WeakPolarHBondContact CA-O 3.34Å
943	D	88.8	Confident	86.8	Confident	88 Å²	88	42.2 Å²	42.2	47%	0.471	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-28.4	173.7	58.7	-28	0	0	0	113.1	K941 N965 Y968	K941-D943 PolarHBondContact O-N 3.28Å; D943-N965 PolarHBondContact O-ND2 3.4Å; D943-Y968 HydrophobicContact CB-CE2 4.34Å; D943-Y968 VanDerWaalsContact OD2-CE2 3.29Å; D943-Y968 WeakPolarHBondContact OD2-CE2 3.19Å; D943-Y968 PolarHBondContact OD2-OH 2.9Å
944	F	93	Very high	85.8	Confident	3 Å²	3	42 Å²	42	1%	0.013	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-49.4	178.5	176.7	-113.5	0	0	0	112.9	F900 I938 K941 F964 N965 Y968 I972 I983 F992	F900-F944 HydrophobicContact CZ-CZ 4.33Å; I938-F944 HydrophobicContact CB-CD1 4.37Å; I938-F944 HydrophobicContact CB-CE1 4.45Å; I938-F944 HydrophobicContact CD1-CE1 4.44Å; K941-F944 HydrophobicContact CB-CB 4.22Å; K941-F944 PolarHBondContact O-N 3.33Å; K941-F944 VanDerWaalsContact O-N 3.09Å; F944-F964 HydrophobicContact CD1-CD1 4.24Å; F944-F964 HydrophobicContact CD1-CE1 4.48Å; F944-F964 AromaticContact CE1-CD1 3.63Å; F944-F964 HydrophobicContact CE1-CD1 3.63Å; F944-F964 AromaticContact CE1-CE1 3.83Å; F944-F964 HydrophobicContact CE1-CE1 3.83Å; F944-F964 AromaticContact CZ-CD1 3.82Å; F944-F964 HydrophobicContact CZ-CD1 3.82Å; F944-F964 HydrophobicContact CZ-CE1 4.35Å; F944-N965 PolarHBondContact O-N 2.8Å; F944-Y968 HydrophobicContact CB-CD2 4.27Å; F944-Y968 HydrophobicContact CB-CE2 4.12Å; F944-Y968 AromaticContact CD2-CD1 3.85Å; F944-Y968 HydrophobicContact CD2-CD1 3.85Å; F944-Y968 HydrophobicContact CD2-CD2 4.28Å; F944-Y968 HydrophobicContact CD2-CE1 4.28Å; F944-Y968 AromaticContact CD2-CG 3.84Å; F944-Y968 HydrophobicContact CD2-CG 3.84Å; F944-Y968 HydrophobicContact CE2-CD1 4.48Å; F944-I972 HydrophobicContact CB-CD1 3.91Å; F944-I972 HydrophobicContact CD1-CD1 4.16Å; F944-I972 HydrophobicContact CD1-CG1 3.92Å; F944-I972 HydrophobicContact CD2-CD1 4.08Å; F944-I972 HydrophobicContact CD2-CG1 3.95Å; F944-I972 HydrophobicContact CE1-CG1 4.06Å; F944-I972 HydrophobicContact CE2-CG1 4.1Å; F944-I972 HydrophobicContact CG-CD1 3.78Å; F944-I972 HydrophobicContact CG-CG1 3.86Å; F944-I972 HydrophobicContact CZ-CG1 4.16Å; F944-I983 HydrophobicContact CZ-CG2 3.92Å; F944-F992 AromaticContact CE2-CD1 3.78Å; F944-F992 HydrophobicContact CE2-CD1 3.78Å; F944-F992 AromaticContact CE2-CE1 3.66Å; F944-F992 HydrophobicContact CE2-CE1 3.66Å; F944-F992 AromaticContact CZ-CD1 4Å; F944-F992 HydrophobicContact CZ-CD1 4Å; F944-F992 HydrophobicContact CZ-CE1 4.18Å
945	V	93.3	Very high	84.7	Confident	3 Å²	3	44.5 Å²	44.5	2%	0.018	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.7	-179.4	61.7	0	0	0	0	110.4	I938 L939 K941 S942 Y962 F964	I938-V945 HydrophobicContact CB-CG1 4.48Å; I938-V945 HydrophobicContact CG1-CG1 4.27Å; I938-V945 WeakPolarHBondContact O-CG1 3.02Å; L939-V945 HydrophobicContact CD2-CG1 4.1Å; L939-V945 HydrophobicContact CD2-CG2 4.26Å; K941-V945 PolarHBondContact O-N 2.92Å; S942-V945 WeakPolarHBondContact CA-O 3.34Å; V945-Y962 HydrophobicContact CG2-CD1 4.23Å; V945-F964 HydrophobicContact CB-CD1 3.74Å; V945-F964 HydrophobicContact CB-CE1 3.67Å; V945-F964 HydrophobicContact CB-CG 4.43Å; V945-F964 HydrophobicContact CB-CZ 4.29Å; V945-F964 HydrophobicContact CG1-CE1 4.44Å; V945-F964 HydrophobicContact CG2-CD1 3.81Å; V945-F964 HydrophobicContact CG2-CD2 4.27Å; V945-F964 HydrophobicContact CG2-CE1 3.52Å; V945-F964 HydrophobicContact CG2-CE2 3.99Å; V945-F964 HydrophobicContact CG2-CG 4.18Å; V945-F964 HydrophobicContact CG2-CZ 3.62Å
946	R	90	Very high	83.7	Confident	148 Å²	148	47.2 Å²	47.2	56%	0.558	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	133.3	172.7	53.4	174.7	-172.5	-156.3	1.7	110.6	V948 V963	R946-V948 HydrophobicContact CB-CG1 4.29Å; R946-V948 HydrophobicContact CG-CG1 3.73Å; R946-V948 PolarHBondContact O-N 3.14Å; R946-V963 HydrophobicContact CG-CB 4.09Å; R946-V963 WeakPolarHBondContact CG-O 3.4Å; R946-V963 PolarHBondContact N-O 2.92Å; R946-V963 PolarHBondContact O-N 2.74Å
947	K	89.3	Confident	83	Confident	32 Å²	32	46.1 Å²	46.1	14%	0.139	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	113.3	163.6	-167.9	176	-175.7	179.1	0	107.7	Y962 E1023 E1026 E1028	K947-Y962 HydrophobicContact CB-CD1 4.29Å; K947-Y962 HydrophobicContact CB-CE1 3.95Å; K947-Y962 HydrophobicContact CD-CE1 4.22Å; K947-Y962 HydrophobicContact CG-CD1 4.46Å; K947-Y962 HydrophobicContact CG-CE1 3.86Å; K947-E1023 PolarHBondContact NZ-O 3.22Å; K947-E1026 PolarHBondContact NZ-O 3.15Å; K947-E1028 WeakPolarHBondContact CE-OE1 3.46Å; K947-E1028 VanDerWaalsContact NZ-CD 3.34Å; K947-E1028 IonicContact NZ-OE1 3.49Å; K947-E1028 PolarHBondContact NZ-OE1 3.38Å
948	V	86.1	Confident	82.6	Confident	26 Å²	26	44.4 Å²	44.4	16%	0.158	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	146.8	-179.7	-59.3	0	0	0	0	110.1	R946 M961 V963	R946-V948 HydrophobicContact CB-CG1 4.29Å; R946-V948 HydrophobicContact CG-CG1 3.73Å; R946-V948 PolarHBondContact O-N 3.14Å; V948-M961 HydrophobicContact CG2-CE 3.53Å; V948-M961 HydrophobicContact CG2-CG 3.46Å; V948-M961 VanDerWaalsContact CG2-CG 3.46Å; V948-M961 HydrophobicContact CG2-SD 4.39Å; V948-M961 PolarHBondContact N-O 2.72Å; V948-M961 PolarHBondContact O-N 3.5Å; V948-V963 HydrophobicContact CG1-CG2 4.27Å; V948-V963 HydrophobicContact CG2-CG2 3.67Å
949	V	83.7	Confident	82.2	Confident	31 Å²	31	45 Å²	45	19%	0.188	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	130.6	175.4	-177.1	0	0	0	0	107.2	V958 Q959 R960 L1053 P1054	V949-V958 HydrophobicContact CG1-CG1 3.24Å; V949-Q959 WeakPolarHBondContact CA-O 3.19Å; V949-R960 HydrophobicContact CG2-CG 4.33Å; V949-L1053 HydrophobicContact CB-CD2 3.75Å; V949-L1053 HydrophobicContact CG1-CD1 4.05Å; V949-L1053 HydrophobicContact CG1-CD2 3.86Å; V949-P1054 WeakPolarHBondContact O-CD 3.44Å
950	C	82	Confident	82.1	Confident	3 Å²	3	45 Å²	45	2%	0.02	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	155.9	174.8	66.9	0	0	0	0	110.6	V958 Q959 P1054 C1056	C950-V958 CarbonylContact O-C 3.27Å; C950-V958 WeakPolarHBondContact O-CA 3.24Å; C950-Q959 PolarHBondContact N-O 3.12Å; C950-Q959 PolarHBondContact O-N 2.77Å; C950-P1054 CarbonylContact C-O 3.4Å; C950-P1054 WeakPolarHBondContact CA-O 3.31Å; C950-P1054 HydrophobicContact CB-CG 4.35Å; C950-P1054 WeakPolarHBondContact CB-O 3.41Å; C950-C1056 HydrophobicContact CB-CB 3.99Å; C950-C1056 WeakPolarHBondContact CB-SG 3.22Å; C950-C1056 PolarHBondContact O-SG 3.5Å; C950-C1056 VanDerWaalsContact O-SG 3.38Å; C950-C1056 WeakPolarHBondContact SG-CA 3.43Å; C950-C1056 WeakPolarHBondContact SG-CB 3.02Å; C950-C1056 CovalentContact SG-SG 2.04Å; C950-C1056 PolarHBondContact SG-SG 3.34Å
951	M	77.8	Confident	82.1	Confident	29 Å²	29	40.1 Å²	40.1	14%	0.143	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	130.7	176.9	-61.8	-176.5	-61.6	0	0	109.9	F953 V958 L1035 L1053 P1054 I1055 C1056	M951-F953 HydrophobicContact CE-CZ 4.06Å; M951-V958 HydrophobicContact CG-CG2 4.42Å; M951-L1035 HydrophobicContact CG-CD1 4.08Å; M951-L1035 HydrophobicContact SD-CD1 3.96Å; M951-L1053 HydrophobicContact CE-CB 4.04Å; M951-L1053 WeakPolarHBondContact CE-O 2.93Å; M951-L1053 HydrophobicContact CG-CB 3.93Å; M951-L1053 HydrophobicContact CG-CD1 4.13Å; M951-L1053 HydrophobicContact SD-CB 4.15Å; M951-L1053 HydrophobicContact SD-CD1 4.32Å; M951-P1054 PolarHBondContact N-O 3.44Å; M951-I1055 CarbonylContact O-C 3.55Å; M951-I1055 WeakPolarHBondContact O-CA 3.33Å; M951-I1055 WeakPolarHBondContact O-CG2 3.36Å; M951-C1056 VanDerWaalsContact C-SG 3.54Å; M951-C1056 PolarHBondContact O-N 2.81Å
952	R	77.9	Confident	82.2	Confident	37 Å²	37	36.8 Å²	36.8	14%	0.14	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	108	171.7	-175.3	180	-79.7	171.7	4	108.5	S954 D955 R956 T957 Q959 E1032 C1056	R952-S954 WeakPolarHBondContact CD-OG 3.46Å; R952-S954 VanDerWaalsContact CG-OG 3.26Å; R952-S954 WeakPolarHBondContact CG-OG 3.45Å; R952-D955 WeakPolarHBondContact CB-OD1 3.36Å; R952-D955 VanDerWaalsContact CD-CG 3.42Å; R952-D955 VanDerWaalsContact CD-OD1 3.24Å; R952-D955 WeakPolarHBondContact CD-OD1 3.2Å; R952-D955 WeakPolarHBondContact CD-OD2 3.32Å; R952-D955 VanDerWaalsContact CG-OD1 3.23Å; R952-D955 WeakPolarHBondContact CG-OD1 3.2Å; R952-D955 IonicContact NH1-OD2 3.45Å; R952-R956 WeakPolarHBondContact O-CA 3.48Å; R952-R956 PolarHBondContact O-N 2.89Å; R952-T957 PolarHBondContact N-O 3.48Å; R952-T957 PolarHBondContact O-N 3.35Å; R952-Q959 HydrophobicContact CB-CG 4.29Å; R952-Q959 VanDerWaalsContact CZ-CD 3.44Å; R952-Q959 VanDerWaalsContact CZ-OE1 3.26Å; R952-E1032 IonicContact NH1-OE1 3.9Å; R952-C1056 HydrophobicContact CB-CB 4.12Å
953	F	71.7	Confident	82.4	Confident	11 Å²	11	33.2 Å²	33.2	5%	0.048	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-29.9	-176.9	-65	-79.5	0	0	0	112.7	Y591 L600 V602 V607 M951 D955 R956 L1035 I1055	Y591-F953 HydrophobicContact CD1-CB 4.28Å; Y591-F953 AromaticContact CD1-CD2 3.88Å; Y591-F953 HydrophobicContact CD1-CD2 3.88Å; Y591-F953 HydrophobicContact CD1-CG 4.42Å; Y591-F953 HydrophobicContact CD2-CB 3.92Å; Y591-F953 HydrophobicContact CE1-CD2 4.26Å; Y591-F953 HydrophobicContact CE2-CB 4.49Å; Y591-F953 HydrophobicContact CG-CB 3.81Å; Y591-F953 HydrophobicContact CG-CD2 4.25Å; Y591-F953 HydrophobicContact CG-CG 4.43Å; L600-F953 HydrophobicContact CD1-CB 3.69Å; L600-F953 WeakPolarHBondContact CD1-O 3.47Å; L600-F953 HydrophobicContact CD2-CB 4.28Å; V602-F953 HydrophobicContact CB-CE1 4.42Å; V602-F953 HydrophobicContact CG1-CE1 3.8Å; V602-F953 HydrophobicContact CG1-CZ 3.9Å; V602-F953 HydrophobicContact CG2-CD1 3.81Å; V602-F953 HydrophobicContact CG2-CE1 3.72Å; V607-F953 HydrophobicContact CG2-CE2 4.24Å; M951-F953 HydrophobicContact CE-CZ 4.06Å; F953-D955 VanDerWaalsContact C-N 3.34Å; F953-D955 PolarHBondContact O-N 3.38Å; F953-R956 PolarHBondContact O-N 2.74Å; F953-R956 VanDerWaalsContact O-N 3.16Å; F953-L1035 HydrophobicContact CD1-CD2 4.38Å; F953-I1055 HydrophobicContact CD2-CG2 4.19Å; F953-I1055 HydrophobicContact CE2-CD1 4.37Å; F953-I1055 HydrophobicContact CE2-CG1 4.2Å; F953-I1055 HydrophobicContact CE2-CG2 4.35Å
954	S	65.4	Low	82.7	Confident	32 Å²	32	29.3 Å²	29.3	22%	0.224	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-43.9	-176.3	62	0	0	0	0	113.8	Y591 R952	Y591-S954 WeakPolarHBondContact O-CB 3.39Å; R952-S954 WeakPolarHBondContact CD-OG 3.46Å; R952-S954 VanDerWaalsContact CG-OG 3.26Å; R952-S954 WeakPolarHBondContact CG-OG 3.45Å
955	D	67.1	Low	82.7	Confident	55 Å²	55	32.4 Å²	32.4	29%	0.294	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108	5.6	179.3	57.3	12.1	0	0	0	112.4	R952 F953 T957	R952-D955 WeakPolarHBondContact CB-OD1 3.36Å; R952-D955 VanDerWaalsContact CD-CG 3.42Å; R952-D955 VanDerWaalsContact CD-OD1 3.24Å; R952-D955 WeakPolarHBondContact CD-OD1 3.2Å; R952-D955 WeakPolarHBondContact CD-OD2 3.32Å; R952-D955 VanDerWaalsContact CG-OD1 3.23Å; R952-D955 WeakPolarHBondContact CG-OD1 3.2Å; R952-D955 IonicContact NH1-OD2 3.45Å; F953-D955 VanDerWaalsContact C-N 3.34Å; F953-D955 PolarHBondContact O-N 3.38Å; D955-T957 VanDerWaalsContact C-N 3.29Å; D955-T957 HydrophobicContact CB-CG2 4.18Å; D955-T957 VanDerWaalsContact CG-OG1 3.23Å; D955-T957 PolarHBondContact O-N 3.36Å; D955-T957 WeakPolarHBondContact OD1-CB 3.41Å; D955-T957 WeakPolarHBondContact OD1-CG2 3.26Å; D955-T957 PolarHBondContact OD1-N 2.7Å; D955-T957 PolarHBondContact OD1-OG1 3.05Å; D955-T957 PolarHBondContact OD2-OG1 2.99Å
956	R	68.6	Low	82.6	Confident	58 Å²	58	33.3 Å²	33.3	22%	0.219	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	49.3	-175.2	-59	179.6	178.6	-165.2	-2	110.8	E339 L599 L600 R952 F953 L1035	E339-R956 IonicContact OE1-CZ 3.52Å; E339-R956 IonicContact OE1-NE 2.72Å; E339-R956 IonicContact OE1-NH1 3.88Å; E339-R956 PolarHBondContact OE1-NH1 2.94Å; E339-R956 IonicContact OE2-CZ 2.84Å; E339-R956 IonicContact OE2-NH1 2.65Å; E339-R956 PolarHBondContact OE2-NH1 3.39Å; L599-R956 PolarHBondContact O-NH2 2.95Å; L600-R956 HydrophobicContact CD2-CG 4.14Å; R952-R956 WeakPolarHBondContact O-CA 3.48Å; R952-R956 PolarHBondContact O-N 2.89Å; F953-R956 PolarHBondContact O-N 2.74Å; F953-R956 VanDerWaalsContact O-N 3.16Å; R956-L1035 VanDerWaalsContact C-CB 3.48Å; R956-L1035 HydrophobicContact CB-CB 4.45Å; R956-L1035 WeakPolarHBondContact O-CB 3.16Å; R956-L1035 PolarHBondContact O-N 3.12Å
957	T	74.1	Confident	82.5	Confident	18 Å²	18	30.2 Å²	30.2	11%	0.11	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	151.8	176.1	67.9	0	0	0	0	112.9	R952 D955 Q959 C1033	R952-T957 PolarHBondContact N-O 3.48Å; R952-T957 PolarHBondContact O-N 3.35Å; D955-T957 VanDerWaalsContact C-N 3.29Å; D955-T957 HydrophobicContact CB-CG2 4.18Å; D955-T957 VanDerWaalsContact CG-OG1 3.23Å; D955-T957 PolarHBondContact O-N 3.36Å; D955-T957 WeakPolarHBondContact OD1-CB 3.41Å; D955-T957 WeakPolarHBondContact OD1-CG2 3.26Å; D955-T957 PolarHBondContact OD1-N 2.7Å; D955-T957 PolarHBondContact OD1-OG1 3.05Å; D955-T957 PolarHBondContact OD2-OG1 2.99Å; T957-Q959 PolarHBondContact OG1-NE2 3.32Å; T957-C1033 CarbonylContact C-O 3.57Å; T957-C1033 WeakPolarHBondContact CA-O 3.36Å; T957-C1033 WeakPolarHBondContact CB-O 3.44Å
958	V	79	Confident	82.6	Confident	22 Å²	22	30.3 Å²	30.3	13%	0.133	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	124.4	163.2	176.3	0	0	0	0	107	V949 C950 M951 E1032 C1033 L1035	V949-V958 HydrophobicContact CG1-CG1 3.24Å; C950-V958 CarbonylContact O-C 3.27Å; C950-V958 WeakPolarHBondContact O-CA 3.24Å; M951-V958 HydrophobicContact CG-CG2 4.42Å; V958-E1032 WeakPolarHBondContact O-CA 3.49Å; V958-C1033 HydrophobicContact CB-CB 4.41Å; V958-C1033 PolarHBondContact N-O 3.01Å; V958-C1033 PolarHBondContact O-N 3.37Å; V958-L1035 HydrophobicContact CG2-CB 4.26Å; V958-L1035 HydrophobicContact CG2-CD1 3.34Å; V958-L1035 HydrophobicContact CG2-CG 4.4Å
959	Q	84.9	Confident	82.5	Confident	15 Å²	15	36.3 Å²	36.3	7%	0.07	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	136	-177.8	-45.8	-157	-29.9	0	0	110	V949 C950 R952 T957 E1032	V949-Q959 WeakPolarHBondContact CA-O 3.19Å; C950-Q959 PolarHBondContact N-O 3.12Å; C950-Q959 PolarHBondContact O-N 2.77Å; R952-Q959 HydrophobicContact CB-CG 4.29Å; R952-Q959 VanDerWaalsContact CZ-CD 3.44Å; R952-Q959 VanDerWaalsContact CZ-OE1 3.26Å; T957-Q959 PolarHBondContact OG1-NE2 3.32Å; Q959-E1032 HydrophobicContact CG-CG 4.1Å; Q959-E1032 VanDerWaalsContact NE2-CD 3.34Å; Q959-E1032 PolarHBondContact NE2-OE1 3.12Å
960	R	86.9	Confident	82.6	Confident	12 Å²	12	39.3 Å²	39.3	5%	0.045	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.5	173	-56.3	-175.2	-176.4	167.9	0	107.7	V949 N1018 C1019 R1021 E1028 P1030 C1031	V949-R960 HydrophobicContact CG2-CG 4.33Å; R960-N1018 PolarHBondContact NH1-O 2.91Å; R960-N1018 PolarHBondContact NH2-O 3.33Å; R960-C1019 VanDerWaalsContact NH2-C 3.34Å; R960-C1019 PolarHBondContact NH2-O 3.08Å; R960-C1019 VanDerWaalsContact NH2-O 3.1Å; R960-R1021 PolarHBondContact NH1-O 3.34Å; R960-R1021 PolarHBondContact NH2-O 3.32Å; R960-R1021 VanDerWaalsContact NH2-O 3.16Å; R960-E1028 WeakPolarHBondContact CD-OE1 3.42Å; R960-E1028 IonicContact CZ-OE1 2.63Å; R960-E1028 IonicContact NE-OE1 3Å; R960-E1028 IonicContact NH1-OE1 3.18Å; R960-E1028 PolarHBondContact NH1-OE1 3.12Å; R960-E1028 IonicContact NH1-OE2 2.87Å; R960-E1028 PolarHBondContact NH1-OE2 3.48Å; R960-P1030 VanDerWaalsContact O-CA 3.32Å; R960-P1030 WeakPolarHBondContact O-CA 3.34Å; R960-C1031 PolarHBondContact N-O 2.76Å; R960-C1031 PolarHBondContact O-N 3.02Å; R960-C1031 VanDerWaalsContact O-N 3.14Å
961	M	88.8	Confident	82.9	Confident	44 Å²	44	39.6 Å²	39.6	22%	0.217	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	172	-176.6	66.8	-179.3	-160	0	0	110.9	R903 V948 V963	R903-M961 PolarHBondContact NH1-SD 3.44Å; V948-M961 HydrophobicContact CG2-CE 3.53Å; V948-M961 HydrophobicContact CG2-CG 3.46Å; V948-M961 VanDerWaalsContact CG2-CG 3.46Å; V948-M961 HydrophobicContact CG2-SD 4.39Å; V948-M961 PolarHBondContact N-O 2.72Å; V948-M961 PolarHBondContact O-N 3.5Å; M961-V963 HydrophobicContact CE-CG2 4.09Å
962	Y	91.2	Very high	83.4	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.016	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	142	-179	-61.5	-81.7	0	0	0	110.2	R903 H926 T928 L939 V945 K947 E1028 P1030	R903-Y962 WeakPolarHBondContact CD-O 3.33Å; H926-Y962 AromaticContact CE1-CD2 3.38Å; H926-Y962 WeakPolarHBondContact CE1-CD2 3.23Å; H926-Y962 AromaticContact CE1-CE2 3.94Å; H926-Y962 AromaticContact NE2-CD2 3.72Å; T928-Y962 HydrophobicContact CG2-CD2 4.38Å; T928-Y962 HydrophobicContact CG2-CE2 3.86Å; L939-Y962 HydrophobicContact CD1-CE1 4.14Å; L939-Y962 HydrophobicContact CD2-CD1 3.7Å; L939-Y962 HydrophobicContact CD2-CE1 3.37Å; L939-Y962 HydrophobicContact CG-CE1 4.36Å; V945-Y962 HydrophobicContact CG2-CD1 4.23Å; K947-Y962 HydrophobicContact CB-CD1 4.29Å; K947-Y962 HydrophobicContact CB-CE1 3.95Å; K947-Y962 HydrophobicContact CD-CE1 4.22Å; K947-Y962 HydrophobicContact CG-CD1 4.46Å; K947-Y962 HydrophobicContact CG-CE1 3.86Å; Y962-E1028 WeakPolarHBondContact CE2-O 3.35Å; Y962-E1028 PolarHBondContact OH-N 3.47Å; Y962-E1028 PolarHBondContact OH-O 2.91Å; Y962-P1030 HydrophobicContact CD2-CG 4.26Å
963	V	91.9	Very high	83.9	Confident	26 Å²	26	41.2 Å²	41.2	16%	0.158	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	118.6	172.4	177.7	0	0	0	0	108.1	D902 R946 V948 M961	D902-V963 WeakPolarHBondContact O-CA 3.39Å; R946-V963 HydrophobicContact CG-CB 4.09Å; R946-V963 WeakPolarHBondContact CG-O 3.4Å; R946-V963 PolarHBondContact N-O 2.92Å; R946-V963 PolarHBondContact O-N 2.74Å; V948-V963 HydrophobicContact CG1-CG2 4.27Å; V948-V963 HydrophobicContact CG2-CG2 3.67Å; M961-V963 HydrophobicContact CE-CG2 4.09Å
964	F	93.9	Very high	84.5	Confident	7 Å²	7	42 Å²	42	3%	0.031	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	139.9	178	-66.8	-96.3	0	0	0	110.5	F900 D902 G904 I927 I938 F944 V945 T966 F992	F900-F964 AromaticContact CE2-CD1 3.78Å; F900-F964 HydrophobicContact CE2-CD1 3.78Å; F900-F964 HydrophobicContact CE2-CD2 4.31Å; F900-F964 AromaticContact CE2-CE1 3.8Å; F900-F964 HydrophobicContact CE2-CE1 3.8Å; F900-F964 HydrophobicContact CE2-CE2 4.36Å; F900-F964 HydrophobicContact CE2-CG 4.04Å; F900-F964 HydrophobicContact CE2-CZ 4.1Å; F900-F964 HydrophobicContact CZ-CD1 4.42Å; F900-F964 HydrophobicContact CZ-CE1 4.35Å; D902-F964 PolarHBondContact O-N 3.17Å; G904-F964 VanDerWaalsContact CA-CE2 3.43Å; I927-F964 HydrophobicContact CG2-CZ 4.09Å; I938-F964 HydrophobicContact CD1-CE1 3.89Å; I938-F964 HydrophobicContact CD1-CZ 4.31Å; F944-F964 HydrophobicContact CD1-CD1 4.24Å; F944-F964 HydrophobicContact CD1-CE1 4.48Å; F944-F964 AromaticContact CE1-CD1 3.63Å; F944-F964 HydrophobicContact CE1-CD1 3.63Å; F944-F964 AromaticContact CE1-CE1 3.83Å; F944-F964 HydrophobicContact CE1-CE1 3.83Å; F944-F964 AromaticContact CZ-CD1 3.82Å; F944-F964 HydrophobicContact CZ-CD1 3.82Å; F944-F964 HydrophobicContact CZ-CE1 4.35Å; V945-F964 HydrophobicContact CB-CD1 3.74Å; V945-F964 HydrophobicContact CB-CE1 3.67Å; V945-F964 HydrophobicContact CB-CG 4.43Å; V945-F964 HydrophobicContact CB-CZ 4.29Å; V945-F964 HydrophobicContact CG1-CE1 4.44Å; V945-F964 HydrophobicContact CG2-CD1 3.81Å; V945-F964 HydrophobicContact CG2-CD2 4.27Å; V945-F964 HydrophobicContact CG2-CE1 3.52Å; V945-F964 HydrophobicContact CG2-CE2 3.99Å; V945-F964 HydrophobicContact CG2-CG 4.18Å; V945-F964 HydrophobicContact CG2-CZ 3.62Å; F964-T966 PolarHBondContact O-N 2.96Å; F964-F992 HydrophobicContact CB-CD2 4.38Å; F964-F992 HydrophobicContact CB-CE1 4.23Å; F964-F992 HydrophobicContact CB-CE2 3.57Å; F964-F992 HydrophobicContact CB-CZ 3.46Å; F964-F992 VanDerWaalsContact CB-CZ 3.46Å; F964-F992 HydrophobicContact CG-CE2 4.45Å
965	N	92.6	Very high	85.1	Confident	68 Å²	68	43.9 Å²	43.9	36%	0.364	22%	0.222	S	C	.	.			trans	-79.3	101.6	-177.1	-173.3	-5.1	0	0	0	111.3	D943 F944 S967 Y968 F992	D943-N965 PolarHBondContact O-ND2 3.4Å; F944-N965 PolarHBondContact O-N 2.8Å; N965-S967 PolarHBondContact O-N 3.2Å; N965-S967 VanDerWaalsContact O-N 3.11Å; N965-S967 PolarHBondContact OD1-N 3.44Å; N965-Y968 WeakPolarHBondContact O-CB 3.26Å; N965-Y968 PolarHBondContact O-N 3.29Å; N965-Y968 VanDerWaalsContact O-N 3.15Å; N965-F992 WeakPolarHBondContact O-CE1 3.46Å
966	T	91.3	Very high	85.3	Confident	21 Å²	21	47.5 Å²	47.5	13%	0.129	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-3	178.4	63.2	0	0	0	0	114.1	D902 F964 V985 N990 F992	D902-T966 HydrophobicContact CB-CG2 3.71Å; F964-T966 PolarHBondContact O-N 2.96Å; T966-V985 VanDerWaalsContact O-CG1 3.31Å; T966-V985 WeakPolarHBondContact O-CG1 3.48Å; T966-N990 HydrophobicContact CG2-CB 4.41Å; T966-F992 HydrophobicContact CG2-CE2 4.19Å; T966-F992 HydrophobicContact CG2-CZ 4.01Å
967	S	89.3	Confident	85.5	Confident	83 Å²	83	47.7 Å²	47.7	58%	0.58	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	15.1	175.3	-51.3	0	0	0	0	112.3	N965 E969	N965-S967 PolarHBondContact O-N 3.2Å; N965-S967 VanDerWaalsContact O-N 3.11Å; N965-S967 PolarHBondContact OD1-N 3.44Å; S967-E969 PolarHBondContact O-N 2.87Å
968	Y	90.5	Very high	85.7	Confident	35 Å²	35	48 Å²	48	14%	0.137	26%	0.264	C	S	.	.			trans	-65.7	129.2	175.2	-165.5	-103.8	0	0	0	110.9	D943 F944 N965 D970 I972 V985	D943-Y968 HydrophobicContact CB-CE2 4.34Å; D943-Y968 VanDerWaalsContact OD2-CE2 3.29Å; D943-Y968 WeakPolarHBondContact OD2-CE2 3.19Å; D943-Y968 PolarHBondContact OD2-OH 2.9Å; F944-Y968 HydrophobicContact CB-CD2 4.27Å; F944-Y968 HydrophobicContact CB-CE2 4.12Å; F944-Y968 AromaticContact CD2-CD1 3.85Å; F944-Y968 HydrophobicContact CD2-CD1 3.85Å; F944-Y968 HydrophobicContact CD2-CD2 4.28Å; F944-Y968 HydrophobicContact CD2-CE1 4.28Å; F944-Y968 AromaticContact CD2-CG 3.84Å; F944-Y968 HydrophobicContact CD2-CG 3.84Å; F944-Y968 HydrophobicContact CE2-CD1 4.48Å; N965-Y968 WeakPolarHBondContact O-CB 3.26Å; N965-Y968 PolarHBondContact O-N 3.29Å; N965-Y968 VanDerWaalsContact O-N 3.15Å; Y968-D970 HydrophobicContact CD1-CB 4.44Å; Y968-D970 WeakPolarHBondContact CD1-O 3.42Å; Y968-D970 HydrophobicContact CE1-CB 3.68Å; Y968-D970 VanDerWaalsContact CE1-O 3.25Å; Y968-D970 WeakPolarHBondContact CE1-O 3.42Å; Y968-I972 HydrophobicContact CD1-CD1 4.39Å; Y968-I972 HydrophobicContact CE1-CD1 3.49Å; Y968-I972 VanDerWaalsContact CE1-CD1 3.49Å; Y968-I972 HydrophobicContact CE1-CG1 4.21Å; Y968-V985 WeakPolarHBondContact O-CG2 3.26Å
969	E	85	Confident	85.7	Confident	152 Å²	152	47.6 Å²	47.6	71%	0.71	26%	0.261	S	S	*	.			trans	-93.4	-25.2	-172.9	-63.9	-166.3	158	0	0	113.9	F82 S967	F82-E969 WeakPolarHBondContact CE1-O 3.34Å; F82-E969 VanDerWaalsContact CZ-O 3.25Å; F82-E969 WeakPolarHBondContact CZ-O 3.37Å; S967-E969 PolarHBondContact O-N 2.87Å
970	D	85.3	Confident	85.8	Confident	94 Å²	94	51.3 Å²	51.3	50%	0.503	28%	0.275	S	S	.	.	S	Bend	trans	-93.5	173.2	-174.8	-158.4	4	0	0	0	112.8	Y968	Y968-D970 HydrophobicContact CD1-CB 4.44Å; Y968-D970 WeakPolarHBondContact CD1-O 3.42Å; Y968-D970 HydrophobicContact CE1-CB 3.68Å; Y968-D970 VanDerWaalsContact CE1-O 3.25Å; Y968-D970 WeakPolarHBondContact CE1-O 3.42Å
971	V	87.7	Confident	86	Confident	8 Å²	8	51 Å²	51	5%	0.048	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-100.6	127.6	173.7	-171.6	0	0	0	0	109.8	I81 F82 R973 Q982 I983	I81-V971 HydrophobicContact CG2-CB 4.32Å; I81-V971 HydrophobicContact CG2-CG1 3.6Å; I81-V971 HydrophobicContact CG2-CG2 3.67Å; F82-V971 HydrophobicContact CD1-CG2 4.4Å; F82-V971 HydrophobicContact CD2-CG2 3.82Å; F82-V971 HydrophobicContact CE1-CG2 3.84Å; F82-V971 HydrophobicContact CE2-CG2 3.19Å; F82-V971 HydrophobicContact CG-CG2 4.39Å; F82-V971 HydrophobicContact CZ-CB 4.47Å; F82-V971 HydrophobicContact CZ-CG2 3.2Å; V971-R973 HydrophobicContact CB-CG 3.99Å; V971-R973 HydrophobicContact CG1-CG 3.5Å; V971-R973 VanDerWaalsContact CG1-CG 3.5Å; V971-R973 PolarHBondContact O-N 3.1Å; V971-Q982 HydrophobicContact CG1-CB 4.15Å; V971-I983 WeakPolarHBondContact CG1-O 3.49Å
972	I	89.4	Confident	86.1	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	116	167.5	-49.4	-59.1	0	0	0	107.8	I938 K941 F944 Y968 Y981 Q982 I983	I938-I972 HydrophobicContact CG2-CG2 3.98Å; K941-I972 HydrophobicContact CD-CD1 3.71Å; K941-I972 HydrophobicContact CD-CG2 4.14Å; F944-I972 HydrophobicContact CB-CD1 3.91Å; F944-I972 HydrophobicContact CD1-CD1 4.16Å; F944-I972 HydrophobicContact CD1-CG1 3.92Å; F944-I972 HydrophobicContact CD2-CD1 4.08Å; F944-I972 HydrophobicContact CD2-CG1 3.95Å; F944-I972 HydrophobicContact CE1-CG1 4.06Å; F944-I972 HydrophobicContact CE2-CG1 4.1Å; F944-I972 HydrophobicContact CG-CD1 3.78Å; F944-I972 HydrophobicContact CG-CG1 3.86Å; F944-I972 HydrophobicContact CZ-CG1 4.16Å; Y968-I972 HydrophobicContact CD1-CD1 4.39Å; Y968-I972 HydrophobicContact CE1-CD1 3.49Å; Y968-I972 VanDerWaalsContact CE1-CD1 3.49Å; Y968-I972 HydrophobicContact CE1-CG1 4.21Å; I972-Y981 HydrophobicContact CG2-CE2 3.97Å; I972-Q982 CarbonylContact O-C 3.6Å; I972-Q982 VanDerWaalsContact O-CA 3.24Å; I972-Q982 WeakPolarHBondContact O-CA 3.19Å; I972-I983 HydrophobicContact CB-CB 4.12Å; I972-I983 PolarHBondContact N-O 3.03Å; I972-I983 PolarHBondContact O-N 2.65Å
973	R	88.1	Confident	86.3	Confident	101 Å²	101	48.9 Å²	48.9	38%	0.381	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	141.9	178.5	-54.5	-173.8	167.6	128	-7	110.8	V971 Y981 Q982	V971-R973 HydrophobicContact CB-CG 3.99Å; V971-R973 HydrophobicContact CG1-CG 3.5Å; V971-R973 VanDerWaalsContact CG1-CG 3.5Å; V971-R973 PolarHBondContact O-N 3.1Å; R973-Y981 WeakPolarHBondContact CA-O 3.39Å; R973-Q982 HydrophobicContact CB-CG 4.44Å; R973-Q982 HydrophobicContact CG-CB 4.49Å; R973-Q982 HydrophobicContact CG-CG 3.94Å
974	N	84.3	Confident	86.4	Confident	28 Å²	28	47.7 Å²	47.7	15%	0.15	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	121.7	160.2	-173.6	-5.2	0	0	0	107.9	E937 D976 R980 Y981	E937-N974 VanDerWaalsContact CD-ND2 3.35Å; E937-N974 PolarHBondContact OE1-ND2 3.44Å; E937-N974 PolarHBondContact OE2-ND2 3.32Å; N974-D976 PolarHBondContact OD1-N 2.01Å; N974-D976 PolarHBondContact OD1-O 3.45Å; N974-R980 VanDerWaalsContact O-CA 3.31Å; N974-R980 WeakPolarHBondContact O-CA 3.3Å; N974-Y981 HydrophobicContact CB-CD1 3.78Å; N974-Y981 HydrophobicContact CB-CE1 3.29Å; N974-Y981 HydrophobicContact CB-CE2 4.3Å; N974-Y981 HydrophobicContact CB-CG 4.46Å; N974-Y981 PolarHBondContact N-O 3.29Å; N974-Y981 PolarHBondContact O-N 3.27Å
975	N	77.6	Confident	86.4	Confident	70 Å²	70	48 Å²	48	37%	0.374	26%	0.258	S	S	.	.			trans	-107	-8.1	178.5	-73.8	-15	0	0	0	112.5
976	D	70.2	Confident	86.5	Confident	132 Å²	132	44.7 Å²	44.7	71%	0.706	24%	0.241	S	C	*	.	S	Bend	trans	-94.4	143.5	-172.4	-67	-26.8	0	0	0	111	N974	N974-D976 PolarHBondContact OD1-N 2.01Å; N974-D976 PolarHBondContact OD1-O 3.45Å
977	G	73	Confident	86.6	Confident	61 Å²	61	51 Å²	51	63%	0.629	26%	0.263	S	S	*	.	S	Bend	trans	74.6	-162.7	-177.7	0	0	0	0	0	113.9
978	C	77.7	Confident	86.7	Confident	25 Å²	25	52 Å²	52	17%	0.169	26%	0.258	C	S	.	.	S	Bend	trans	-94.4	-5.5	-169.4	66.6	0	0	0	0	113.9	S999 C1000 Q1003	C978-S999 WeakPolarHBondContact CA-OG 3.49Å; C978-S999 PolarHBondContact O-N 2.78Å; C978-S999 PolarHBondContact O-OG 3.33Å; C978-C1000 HydrophobicContact CB-CB 3.43Å; C978-C1000 VanDerWaalsContact CB-CB 3.43Å; C978-C1000 WeakPolarHBondContact CB-SG 3.13Å; C978-C1000 WeakPolarHBondContact SG-CB 3.45Å; C978-C1000 CovalentContact SG-SG 2Å; C978-C1000 PolarHBondContact SG-SG 3.24Å; C978-Q1003 PolarHBondContact SG-NE2 2.6Å; C978-Q1003 VanDerWaalsContact SG-NE2 3.35Å
979	L	80.9	Confident	87	Confident	14 Å²	14	50.3 Å²	50.3	7%	0.073	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	96.9	173.7	-175.7	75.9	0	0	0	108.5	L933 I934 V996 R998	L933-L979 HydrophobicContact CB-CD2 3.7Å; L933-L979 HydrophobicContact CD1-CD2 4.06Å; I934-L979 HydrophobicContact CG1-CD2 3.81Å; L979-V996 HydrophobicContact CD1-CG1 3.54Å; L979-V996 HydrophobicContact CG-CG1 4.38Å; L979-R998 HydrophobicContact CD1-CG 3.65Å
980	R	86.5	Confident	87.5	Confident	92 Å²	92	43.1 Å²	43.1	35%	0.347	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128.8	178.2	-60.7	176.2	-175.6	170.7	-1.6	109	L76 N974 N997	L76-R980 HydrophobicContact CD2-CB 4.02Å; N974-R980 VanDerWaalsContact O-CA 3.31Å; N974-R980 WeakPolarHBondContact O-CA 3.3Å; R980-N997 HydrophobicContact CB-CB 4.42Å; R980-N997 PolarHBondContact N-O 3.36Å; R980-N997 PolarHBondContact O-N 2.7Å
981	Y	90.6	Very high	88	Confident	6 Å²	6	38.7 Å²	38.7	2%	0.024	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	156.2	-179.8	66.7	-92.8	0	0	0	113.3	I934 E937 I938 I972 R973 N974 I983 V995	I934-Y981 HydrophobicContact CD1-CD1 4.37Å; I934-Y981 HydrophobicContact CD1-CG 4.3Å; I934-Y981 HydrophobicContact CG1-CD1 4.07Å; I934-Y981 HydrophobicContact CG1-CE1 4.3Å; I934-Y981 HydrophobicContact CG1-CG 4.41Å; I934-Y981 HydrophobicContact CG2-CD2 4.16Å; I934-Y981 HydrophobicContact CG2-CE1 4.38Å; I934-Y981 HydrophobicContact CG2-CE2 4.01Å; I934-Y981 HydrophobicContact CG2-CG 4.43Å; E937-Y981 WeakPolarHBondContact CB-OH 3.23Å; E937-Y981 WeakPolarHBondContact OE2-CE1 2.94Å; E937-Y981 VanDerWaalsContact OE2-CZ 3.29Å; E937-Y981 PolarHBondContact OE2-OH 3.32Å; I938-Y981 HydrophobicContact CG2-CE2 4.18Å; I972-Y981 HydrophobicContact CG2-CE2 3.97Å; R973-Y981 WeakPolarHBondContact CA-O 3.39Å; N974-Y981 HydrophobicContact CB-CD1 3.78Å; N974-Y981 HydrophobicContact CB-CE1 3.29Å; N974-Y981 HydrophobicContact CB-CE2 4.3Å; N974-Y981 HydrophobicContact CB-CG 4.46Å; N974-Y981 PolarHBondContact N-O 3.29Å; N974-Y981 PolarHBondContact O-N 3.27Å; Y981-I983 HydrophobicContact CD2-CD1 4.14Å; Y981-I983 HydrophobicContact CD2-CG1 4.1Å; Y981-I983 HydrophobicContact CE2-CD1 4.23Å; Y981-V995 CarbonylContact C-O 3.57Å; Y981-V995 WeakPolarHBondContact CA-O 3.46Å
982	Q	91.9	Very high	88.4	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	134.8	171	-59.5	-167.8	-2.9	0	0	110.3	L76 I81 V971 I972 R973 A994 V995	L76-Q982 HydrophobicContact CD2-CG 3.93Å; L76-Q982 HydrophobicContact CG-CG 4.4Å; L76-Q982 PolarHBondContact O-NE2 2.98Å; I81-Q982 HydrophobicContact CD1-CB 3.49Å; I81-Q982 VanDerWaalsContact CD1-CB 3.49Å; I81-Q982 WeakPolarHBondContact CD1-O 3.27Å; V971-Q982 HydrophobicContact CG1-CB 4.15Å; I972-Q982 CarbonylContact O-C 3.6Å; I972-Q982 VanDerWaalsContact O-CA 3.24Å; I972-Q982 WeakPolarHBondContact O-CA 3.19Å; R973-Q982 HydrophobicContact CB-CG 4.44Å; R973-Q982 HydrophobicContact CG-CB 4.49Å; R973-Q982 HydrophobicContact CG-CG 3.94Å; Q982-A994 WeakPolarHBondContact O-CA 3.28Å; Q982-V995 PolarHBondContact N-O 3.48Å; Q982-V995 PolarHBondContact O-N 3.43Å
983	I	94	Very high	88.7	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	129.9	176.6	-52.4	170.3	0	0	0	109.2	F900 I934 I938 F944 V971 I972 Y981 F992 L993 A994	F900-I983 HydrophobicContact CE1-CG2 3.89Å; F900-I983 HydrophobicContact CZ-CG2 3.86Å; I934-I983 HydrophobicContact CG2-CD1 3.99Å; I938-I983 HydrophobicContact CG2-CD1 4.05Å; F944-I983 HydrophobicContact CZ-CG2 3.92Å; V971-I983 WeakPolarHBondContact CG1-O 3.49Å; I972-I983 HydrophobicContact CB-CB 4.12Å; I972-I983 PolarHBondContact N-O 3.03Å; I972-I983 PolarHBondContact O-N 2.65Å; Y981-I983 HydrophobicContact CD2-CD1 4.14Å; Y981-I983 HydrophobicContact CD2-CG1 4.1Å; Y981-I983 HydrophobicContact CE2-CD1 4.23Å; I983-F992 HydrophobicContact CG2-CB 4.13Å; I983-L993 VanDerWaalsContact CA-O 3.3Å; I983-L993 WeakPolarHBondContact CA-O 3.2Å; I983-A994 HydrophobicContact CG1-CB 4.08Å
984	A	93.8	Very high	89	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.008	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	147.7	177.5	0	0	0	0	0	111.8	I81 A85 F992 L993	I81-A984 HydrophobicContact CD1-CB 3.9Å; I81-A984 HydrophobicContact CG1-CB 3.82Å; I81-A984 HydrophobicContact CG2-CB 4.17Å; A85-A984 HydrophobicContact CB-CB 4.25Å; A984-F992 WeakPolarHBondContact O-CA 3.47Å; A984-L993 PolarHBondContact N-O 3.2Å; A984-L993 PolarHBondContact O-N 3.3Å
985	V	95	Very high	89.3	Confident	13 Å²	13	32.2 Å²	32.2	8%	0.079	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	132.5	174.1	-179.7	0	0	0	0	110.5	T966 Y968 R987 F992	T966-V985 VanDerWaalsContact O-CG1 3.31Å; T966-V985 WeakPolarHBondContact O-CG1 3.48Å; Y968-V985 WeakPolarHBondContact O-CG2 3.26Å; V985-R987 PolarHBondContact O-N 2.67Å; V985-F992 HydrophobicContact CB-CD1 4.49Å; V985-F992 HydrophobicContact CG2-CD1 3.89Å; V985-F992 HydrophobicContact CG2-CE1 3.66Å
986	V	95.1	Very high	89.9	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.149	C	C	.	.			trans	-85.9	101.3	168.4	-177.6	0	0	0	0	108.3	V88 L92 T989 V991 L993	V88-V986 HydrophobicContact CG1-CG1 4.15Å; V88-V986 HydrophobicContact CG1-CG2 4.29Å; L92-V986 HydrophobicContact CD1-CG1 4.34Å; V986-T989 WeakPolarHBondContact CB-OG1 3.48Å; V986-T989 HydrophobicContact CG1-CG2 3.92Å; V986-T989 PolarHBondContact O-N 3.15Å; V986-T989 PolarHBondContact O-OG1 3.36Å; V986-V991 HydrophobicContact CB-CG2 3.99Å; V986-V991 WeakPolarHBondContact CB-O 3.25Å; V986-V991 HydrophobicContact CG1-CG2 4.38Å; V986-V991 HydrophobicContact CG2-CG2 4.14Å; V986-V991 PolarHBondContact N-O 2.92Å; V986-L993 HydrophobicContact CG2-CB 3.99Å
987	R	92.5	Very high	90.7	Very high	154 Å²	154	24.3 Å²	24.3	58%	0.581	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	149.5	-174.6	-65.5	-165.5	179.2	-139.6	-1.5	112.1	S89 V985 T989	S89-R987 WeakPolarHBondContact CB-O 3.49Å; S89-R987 PolarHBondContact OG-O 3.19Å; V985-R987 PolarHBondContact O-N 2.67Å; R987-T989 PolarHBondContact O-N 3.12Å
988	Q	92.3	Very high	91	Very high	102 Å²	102	24.8 Å²	24.8	48%	0.477	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	20.6	-177.9	-56.8	-63.7	0.6	0	0	114.9	K828 V829	K828-Q988 WeakPolarHBondContact CA-O 3.15Å; K828-Q988 WeakPolarHBondContact CB-O 3.07Å; V829-Q988 PolarHBondContact N-O 3.04Å; V829-Q988 VanDerWaalsContact N-O 3.11Å
989	T	95.6	Very high	91.1	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.006	13%	0.128	C	C	.	.	B	Isolated β-bridge	trans	-134.9	-179	171	76.6	0	0	0	0	110	L92 V829 V986 R987 V991	L92-T989 HydrophobicContact CD1-CG2 4.36Å; V829-T989 HydrophobicContact CB-CG2 4.42Å; V829-T989 WeakPolarHBondContact O-CA 3.49Å; V829-T989 WeakPolarHBondContact O-CB 2.93Å; V986-T989 WeakPolarHBondContact CB-OG1 3.48Å; V986-T989 HydrophobicContact CG1-CG2 3.92Å; V986-T989 PolarHBondContact O-N 3.15Å; V986-T989 PolarHBondContact O-OG1 3.36Å; R987-T989 PolarHBondContact O-N 3.12Å; T989-V991 WeakPolarHBondContact OG1-CG2 3.32Å; T989-V991 PolarHBondContact OG1-N 3.01Å
990	N	95.4	Very high	90.7	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	14%	0.139	C	C	.	.	S	Bend	trans	-103.5	12.5	170.1	72.6	-45.5	0	0	0	113.5	V830 I831 D901 D902 T966	V830-N990 WeakPolarHBondContact CA-OD1 2.98Å; I831-N990 PolarHBondContact N-OD1 3.07Å; I831-N990 PolarHBondContact O-ND2 3.33Å; D901-N990 CarbonylContact C-O 3.51Å; D902-N990 HydrophobicContact CB-CB 4.4Å; D902-N990 PolarHBondContact N-O 2.89Å; D902-N990 PolarHBondContact OD1-ND2 3.14Å; T966-N990 HydrophobicContact CG2-CB 4.41Å
991	V	96.3	Very high	89.8	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	162.2	-174.7	-57.5	0	0	0	0	113.1	L92 I831 F900 D901 V907 V986 T989	L92-V991 HydrophobicContact CD1-CG2 4.2Å; I831-V991 HydrophobicContact CB-CG1 3.81Å; I831-V991 HydrophobicContact CD1-CG1 3.99Å; I831-V991 HydrophobicContact CD1-CG2 4.3Å; I831-V991 HydrophobicContact CG1-CG1 4.04Å; F900-V991 CarbonylContact O-C 3.52Å; F900-V991 VanDerWaalsContact O-CA 3.25Å; F900-V991 WeakPolarHBondContact O-CA 3.5Å; F900-V991 WeakPolarHBondContact O-CB 3.12Å; D901-V991 HydrophobicContact CB-CG1 4.41Å; V907-V991 HydrophobicContact CG2-CG1 4.01Å; V986-V991 HydrophobicContact CB-CG2 3.99Å; V986-V991 WeakPolarHBondContact CB-O 3.25Å; V986-V991 HydrophobicContact CG1-CG2 4.38Å; V986-V991 HydrophobicContact CG2-CG2 4.14Å; V986-V991 PolarHBondContact N-O 2.92Å; T989-V991 WeakPolarHBondContact OG1-CG2 3.32Å; T989-V991 PolarHBondContact OG1-N 3.01Å
992	F	96.1	Very high	88.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	142.1	-179.7	-57.1	-101.2	0	0	0	109.1	L899 F900 D902 F944 F964 N965 T966 I983 A984 V985	L899-F992 VanDerWaalsContact CA-O 3.32Å; L899-F992 WeakPolarHBondContact CA-O 3.46Å; F900-F992 HydrophobicContact CD1-CB 4.1Å; F900-F992 HydrophobicContact CD2-CB 4.3Å; F900-F992 HydrophobicContact CD2-CD2 4.07Å; F900-F992 HydrophobicContact CD2-CG 4.47Å; F900-F992 HydrophobicContact CE1-CB 3.6Å; F900-F992 HydrophobicContact CE1-CG 4.46Å; F900-F992 HydrophobicContact CE2-CB 3.81Å; F900-F992 AromaticContact CE2-CD2 3.71Å; F900-F992 HydrophobicContact CE2-CD2 3.71Å; F900-F992 AromaticContact CE2-CG 3.83Å; F900-F992 HydrophobicContact CE2-CG 3.83Å; F900-F992 HydrophobicContact CG-CB 4.44Å; F900-F992 HydrophobicContact CZ-CB 3.45Å; F900-F992 VanDerWaalsContact CZ-CB 3.45Å; F900-F992 HydrophobicContact CZ-CD2 4.21Å; F900-F992 AromaticContact CZ-CG 3.84Å; F900-F992 HydrophobicContact CZ-CG 3.84Å; F900-F992 PolarHBondContact N-O 3.36Å; F900-F992 PolarHBondContact O-N 3.4Å; D902-F992 HydrophobicContact CB-CE2 4.46Å; F944-F992 AromaticContact CE2-CD1 3.78Å; F944-F992 HydrophobicContact CE2-CD1 3.78Å; F944-F992 AromaticContact CE2-CE1 3.66Å; F944-F992 HydrophobicContact CE2-CE1 3.66Å; F944-F992 AromaticContact CZ-CD1 4Å; F944-F992 HydrophobicContact CZ-CD1 4Å; F944-F992 HydrophobicContact CZ-CE1 4.18Å; F964-F992 HydrophobicContact CB-CD2 4.38Å; F964-F992 HydrophobicContact CB-CE1 4.23Å; F964-F992 HydrophobicContact CB-CE2 3.57Å; F964-F992 HydrophobicContact CB-CZ 3.46Å; F964-F992 VanDerWaalsContact CB-CZ 3.46Å; F964-F992 HydrophobicContact CG-CE2 4.45Å; N965-F992 WeakPolarHBondContact O-CE1 3.46Å; T966-F992 HydrophobicContact CG2-CE2 4.19Å; T966-F992 HydrophobicContact CG2-CZ 4.01Å; I983-F992 HydrophobicContact CG2-CB 4.13Å; A984-F992 WeakPolarHBondContact O-CA 3.47Å; V985-F992 HydrophobicContact CB-CD1 4.49Å; V985-F992 HydrophobicContact CG2-CD1 3.89Å; V985-F992 HydrophobicContact CG2-CE1 3.66Å
993	L	95.4	Very high	86.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	120.6	174.1	173.5	61.7	0	0	0	109	I81 N84 A85 V88 L883 L899 I983 A984 V986 V995	I81-L993 HydrophobicContact CG1-CD2 4.41Å; N84-L993 HydrophobicContact CB-CD2 4.13Å; A85-L993 HydrophobicContact CB-CD2 4.33Å; V88-L993 HydrophobicContact CG2-CD2 4.46Å; L883-L993 HydrophobicContact CD1-CD1 3.64Å; L883-L993 HydrophobicContact CD2-CD1 4.29Å; L899-L993 HydrophobicContact CD2-CB 4.03Å; L899-L993 HydrophobicContact CD2-CD1 3.78Å; I983-L993 VanDerWaalsContact CA-O 3.3Å; I983-L993 WeakPolarHBondContact CA-O 3.2Å; A984-L993 PolarHBondContact N-O 3.2Å; A984-L993 PolarHBondContact O-N 3.3Å; V986-L993 HydrophobicContact CG2-CB 3.99Å; L993-V995 HydrophobicContact CG-CG2 4.4Å
994	A	93.6	Very high	84.9	Confident	1 Å²	1	55 Å²	55	1%	0.008	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	134.2	171.4	0	0	0	0	0	110.6	C897 F898 F900 Q982 I983	C897-A994 WeakPolarHBondContact CA-O 3.41Å; F898-A994 HydrophobicContact CD1-CB 4.13Å; F898-A994 HydrophobicContact CD2-CB 3.99Å; F898-A994 HydrophobicContact CE1-CB 3.71Å; F898-A994 HydrophobicContact CE2-CB 3.54Å; F898-A994 HydrophobicContact CG-CB 4.26Å; F898-A994 HydrophobicContact CZ-CB 3.38Å; F898-A994 PolarHBondContact N-O 3.27Å; F898-A994 VanDerWaalsContact N-O 3.12Å; F898-A994 PolarHBondContact O-N 2.91Å; F900-A994 HydrophobicContact CD1-CB 4.5Å; F900-A994 HydrophobicContact CE1-CB 4.21Å; Q982-A994 WeakPolarHBondContact O-CA 3.28Å; I983-A994 HydrophobicContact CG1-CB 4.08Å
995	V	91.9	Very high	83.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	121	172.5	-177.1	0	0	0	0	107.7	I81 I889 I895 Y981 Q982 L993	I81-V995 HydrophobicContact CD1-CG2 4.32Å; I889-V995 HydrophobicContact CD1-CG1 4.24Å; I889-V995 HydrophobicContact CG2-CG1 4.36Å; I895-V995 HydrophobicContact CG2-CG1 3.7Å; Y981-V995 CarbonylContact C-O 3.57Å; Y981-V995 WeakPolarHBondContact CA-O 3.46Å; Q982-V995 PolarHBondContact N-O 3.48Å; Q982-V995 PolarHBondContact O-N 3.43Å; L993-V995 HydrophobicContact CG-CG2 4.4Å
996	V	89.1	Confident	83.2	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.006	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	122.7	-173.4	-173.7	0	0	0	0	109.2	I895 N896 F898 I934 L979 R998	I895-V996 CarbonylContact C-O 3.6Å; I895-V996 WeakPolarHBondContact CA-O 3.29Å; N896-V996 PolarHBondContact N-O 2.94Å; N896-V996 PolarHBondContact O-N 3.38Å; F898-V996 HydrophobicContact CE1-CG2 3.75Å; F898-V996 HydrophobicContact CZ-CG2 4.46Å; I934-V996 HydrophobicContact CD1-CB 4.44Å; I934-V996 HydrophobicContact CD1-CG1 4.03Å; I934-V996 HydrophobicContact CD1-CG2 3.48Å; I934-V996 VanDerWaalsContact CD1-CG2 3.48Å; L979-V996 HydrophobicContact CD1-CG1 3.54Å; L979-V996 HydrophobicContact CG-CG1 4.38Å; V996-R998 HydrophobicContact CG1-CG 4.03Å
997	N	87.3	Confident	82.9	Confident	36 Å²	36	64 Å²	64	19%	0.193	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119.1	172.7	-178.6	-20.3	0	0	0	108.9	L76 I895 R980	L76-N997 HydrophobicContact CD1-CB 4.11Å; I895-N997 HydrophobicContact CG1-CB 4.33Å; R980-N997 HydrophobicContact CB-CB 4.42Å; R980-N997 PolarHBondContact N-O 3.36Å; R980-N997 PolarHBondContact O-N 2.7Å
998	R	80.2	Confident	82.6	Confident	70 Å²	70	58.2 Å²	58.2	26%	0.264	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	115	-176.7	-71.1	-177.9	175.1	-168	0.1	110.4	D894 E931 L979 V996	D894-R998 PolarHBondContact O-N 3.05Å; E931-R998 IonicContact OE1-CZ 2.74Å; E931-R998 IonicContact OE1-NH2 2.81Å; E931-R998 PolarHBondContact OE1-NH2 3.25Å; E931-R998 IonicContact OE2-CZ 3.51Å; E931-R998 IonicContact OE2-NH2 3.86Å; E931-R998 PolarHBondContact OE2-NH2 2.93Å; L979-R998 HydrophobicContact CD1-CG 3.65Å; V996-R998 HydrophobicContact CG1-CG 4.03Å
999	S	79.3	Confident	82	Confident	87 Å²	87	55.1 Å²	55.1	61%	0.608	28%	0.284	S	S	*	.			trans	-105	-2.5	176	43.6	0	0	0	0	114	C978	C978-S999 WeakPolarHBondContact CA-OG 3.49Å; C978-S999 PolarHBondContact O-N 2.78Å; C978-S999 PolarHBondContact O-OG 3.33Å
1000	C	73.6	Confident	81.1	Confident	44 Å²	44	56.4 Å²	56.4	30%	0.297	29%	0.293	S	S	.	.	S	Bend	trans	-130	150.9	-178.2	50.1	0	0	0	0	112.4	C978	C978-C1000 HydrophobicContact CB-CB 3.43Å; C978-C1000 VanDerWaalsContact CB-CB 3.43Å; C978-C1000 WeakPolarHBondContact CB-SG 3.13Å; C978-C1000 WeakPolarHBondContact SG-CB 3.45Å; C978-C1000 CovalentContact SG-SG 2Å; C978-C1000 PolarHBondContact SG-SG 3.24Å
1001	H	66.4	Low	79.8	Confident	194 Å²	194	58.4 Å²	58.4	90%	0.898	31%	0.305	S	S	*	.	S	Bend	trans	-76.1	128.4	171.1	-75.4	-46.9	0	0	0	110.8	Q1003	H1001-Q1003 PolarHBondContact O-N 3Å
1002	R	58.1	Low	78.4	Confident	210 Å²	210	63.3 Å²	63.3	79%	0.792	34%	0.335	S	S	*	.			trans	11.4	89.8	172	-64.9	-177.1	-175.5	170.5	1	115.3
1003	Q	53.3	Low	77.1	Confident	115 Å²	115	66.8 Å²	66.8	54%	0.537	35%	0.354	S	S	.	.			trans	-71.6	138.5	156.7	-71.6	-179.7	-7.5	0	0	109.1	L933 C978 H1001 A1005	L933-Q1003 HydrophobicContact CD1-CB 3.94Å; L933-Q1003 HydrophobicContact CD2-CB 4.25Å; C978-Q1003 PolarHBondContact SG-NE2 2.6Å; C978-Q1003 VanDerWaalsContact SG-NE2 3.35Å; H1001-Q1003 PolarHBondContact O-N 3Å; Q1003-A1005 PolarHBondContact O-N 3.5Å
1004	S	61.9	Low	76.4	Confident	125 Å²	125	69.5 Å²	69.5	87%	0.874	36%	0.364	S	S	*	.			trans	-89.2	84.3	-176.6	58.3	0	0	0	0	110.9
1005	A	72.6	Confident	75.8	Confident	26 Å²	26	76.8 Å²	76.8	22%	0.215	39%	0.391	C	S	.	.			trans	-83.8	139.5	148.9	0	0	0	0	0	108.4	P932 L933 Q1003	P932-A1005 HydrophobicContact CB-CB 4.17Å; P932-A1005 WeakPolarHBondContact CG-O 3.38Å; L933-A1005 HydrophobicContact CB-CB 4.25Å; L933-A1005 HydrophobicContact CD2-CB 3.4Å; L933-A1005 VanDerWaalsContact CD2-CB 3.4Å; L933-A1005 HydrophobicContact CG-CB 3.62Å; Q1003-A1005 PolarHBondContact O-N 3.5Å
1006	F	81.3	Confident	75.4	Confident	168 Å²	168	77.3 Å²	77.3	74%	0.737	40%	0.395	S	S	*	.			trans	-123.4	120.6	178.3	178.1	-103.4	0	0	0	108.9	P1008	F1006-P1008 HydrophobicContact CD1-CG 4.23Å; F1006-P1008 HydrophobicContact CE1-CB 4.08Å; F1006-P1008 HydrophobicContact CE1-CG 3.81Å
1007	C	88	Confident	75	Confident	8 Å²	8	84.1 Å²	84.1	5%	0.054	43%	0.431	C	S	.	.			trans	-104.2	121	165.8	-56.7	0	0	0	0	106.9	T928 P932 C1009 C1027	T928-C1007 WeakPolarHBondContact O-CB 3.44Å; P932-C1007 HydrophobicContact CB-CB 4.47Å; C1007-C1009 PolarHBondContact O-N 3.45Å; C1007-C1009 PolarHBondContact O-SG 2.85Å; C1007-C1027 HydrophobicContact CB-CB 3.95Å; C1007-C1027 WeakPolarHBondContact CB-SG 3.27Å; C1007-C1027 WeakPolarHBondContact SG-CB 3.35Å; C1007-C1027 CovalentContact SG-SG 2.04Å; C1007-C1027 PolarHBondContact SG-SG 2.95Å
1008	P	86.3	Confident	74.6	Confident	34 Å²	34	85.8 Å²	85.8	22%	0.221	44%	0.44	C	S	.	.			trans	-57.7	129.2	177.8	-23.9	33.6	0	0	0	111.3	F1006 L1017 C1027 C1029	F1006-P1008 HydrophobicContact CD1-CG 4.23Å; F1006-P1008 HydrophobicContact CE1-CB 4.08Å; F1006-P1008 HydrophobicContact CE1-CG 3.81Å; P1008-L1017 HydrophobicContact CB-CB 4.16Å; P1008-L1017 HydrophobicContact CB-CD2 4Å; P1008-L1017 HydrophobicContact CG-CD2 3.89Å; P1008-C1027 WeakPolarHBondContact CD-O 3.42Å; P1008-C1029 PolarHBondContact O-N 2.83Å
1009	C	80.9	Confident	74.4	Confident	37 Å²	37	84.3 Å²	84.3	25%	0.25	44%	0.439	C	S	.	.			trans	-141.8	116.5	-176.4	-64.2	0	0	0	0	110.4	C1007 C1029	C1007-C1009 PolarHBondContact O-N 3.45Å; C1007-C1009 PolarHBondContact O-SG 2.85Å; C1009-C1029 HydrophobicContact CB-CB 3.66Å; C1009-C1029 WeakPolarHBondContact CB-SG 3.34Å; C1009-C1029 WeakPolarHBondContact SG-CB 3.35Å; C1009-C1029 CovalentContact SG-SG 2.02Å; C1009-C1029 PolarHBondContact SG-SG 2.79Å
1010	S	76.4	Confident	73.9	Confident	27 Å²	27	88.4 Å²	88.4	19%	0.189	45%	0.446	C	S	.	.			trans	-88.8	115.7	165	179.6	0	0	0	0	109.9	D1013 R1014 R1015	S1010-D1013 WeakPolarHBondContact CB-OD1 3.31Å; S1010-D1013 PolarHBondContact OG-N 2.77Å; S1010-D1013 PolarHBondContact OG-OD1 3.45Å; S1010-R1014 PolarHBondContact OG-N 3.03Å; S1010-R1015 WeakPolarHBondContact CB-O 3.39Å
1011	V	68.2	Low	73.6	Confident	44 Å²	44	92.5 Å²	92.5	27%	0.267	46%	0.456	S	S	.	.	S	Bend	trans	-101.2	1	179.6	-60.5	0	0	0	0	112	V918 R921	V918-V1011 HydrophobicContact CG1-CB 3.79Å; V918-V1011 HydrophobicContact CG1-CG1 3.31Å; V918-V1011 HydrophobicContact CG1-CG2 4.1Å; R921-V1011 WeakPolarHBondContact CD-O 2.96Å; R921-V1011 WeakPolarHBondContact CG-O 3.21Å; R921-V1011 PolarHBondContact NE-O 3.41Å
1012	T	66	Low	74	Confident	103 Å²	103	86.2 Å²	86.2	63%	0.632	43%	0.434	S	S	*	.	S	Bend	trans	-107	-43.7	-179.2	51.3	0	0	0	0	112.3	R921	R921-T1012 PolarHBondContact NE-O 3.07Å; R921-T1012 PolarHBondContact NH2-O 3.03Å
1013	D	69.7	Low	74.9	Confident	72 Å²	72	79.5 Å²	79.5	39%	0.385	41%	0.411	S	S	.	.	S	Bend	trans	-128.3	3	-174.4	73	-1.5	0	0	0	114.5	S1010 R1015	S1010-D1013 WeakPolarHBondContact CB-OD1 3.31Å; S1010-D1013 PolarHBondContact OG-N 2.77Å; S1010-D1013 PolarHBondContact OG-OD1 3.45Å; D1013-R1015 HydrophobicContact CB-CG 4.32Å; D1013-R1015 PolarHBondContact O-N 3.29Å; D1013-R1015 WeakPolarHBondContact OD1-CB 3.21Å; D1013-R1015 PolarHBondContact OD1-N 2.58Å; D1013-R1015 WeakPolarHBondContact OD2-CD 3.3Å; D1013-R1015 WeakPolarHBondContact OD2-CG 3.05Å; D1013-R1015 IonicContact OD2-NE 3.33Å
1014	R	81.3	Confident	76.2	Confident	57 Å²	57	78.6 Å²	78.6	22%	0.215	42%	0.415	C	S	.	.			trans	57.1	11	-179.2	-49.4	176.2	79.3	-154.4	-3.6	114.4	E923 S1010 C1031 E1032	E923-R1014 IonicContact OE1-CZ 2.68Å; E923-R1014 IonicContact OE1-NE 3.58Å; E923-R1014 PolarHBondContact OE1-NE 3.43Å; E923-R1014 IonicContact OE1-NH2 2.78Å; E923-R1014 PolarHBondContact OE1-NH2 2.67Å; E923-R1014 IonicContact OE2-NE 3.19Å; S1010-R1014 PolarHBondContact OG-N 3.03Å; R1014-C1031 CarbonylContact O-C 3.53Å; R1014-C1031 WeakPolarHBondContact O-CA 3.36Å; R1014-C1031 WeakPolarHBondContact O-CB 3.42Å; R1014-E1032 IonicContact CZ-OE1 3.25Å; R1014-E1032 IonicContact NH1-OE1 3.37Å; R1014-E1032 PolarHBondContact NH1-OE1 3.37Å; R1014-E1032 IonicContact NH1-OE2 3.09Å; R1014-E1032 IonicContact NH2-OE1 2.77Å; R1014-E1032 PolarHBondContact O-N 2.91Å
1015	R	81	Confident	77.3	Confident	154 Å²	154	76.4 Å²	76.4	58%	0.581	40%	0.397	S	S	*	.	B	Isolated β-bridge	trans	-71.5	139.9	-177	-69.4	-173.2	178.9	172.8	-2.6	111.5	S1010 D1013 E1032	S1010-R1015 WeakPolarHBondContact CB-O 3.39Å; D1013-R1015 HydrophobicContact CB-CG 4.32Å; D1013-R1015 PolarHBondContact O-N 3.29Å; D1013-R1015 WeakPolarHBondContact OD1-CB 3.21Å; D1013-R1015 PolarHBondContact OD1-N 2.58Å; D1013-R1015 WeakPolarHBondContact OD2-CD 3.3Å; D1013-R1015 WeakPolarHBondContact OD2-CG 3.05Å; D1013-R1015 IonicContact OD2-NE 3.33Å; R1015-E1032 WeakPolarHBondContact CA-O 2.79Å
1016	C	83.4	Confident	77.9	Confident	12 Å²	12	78.6 Å²	78.6	8%	0.081	40%	0.403	C	S	.	.			trans	-68.5	145.5	170.8	-54.9	0	0	0	0	110.5	N1018 C1031 E1032 C1033	C1016-N1018 VanDerWaalsContact C-N 3.3Å; C1016-N1018 PolarHBondContact O-N 3.36Å; C1016-C1031 WeakPolarHBondContact CA-SG 3.1Å; C1016-C1031 HydrophobicContact CB-CB 3.88Å; C1016-C1031 WeakPolarHBondContact CB-SG 2.91Å; C1016-C1031 WeakPolarHBondContact SG-CB 3.22Å; C1016-C1031 CovalentContact SG-SG 2.03Å; C1016-C1031 PolarHBondContact SG-SG 2.94Å; C1016-E1032 PolarHBondContact N-O 3.39Å; C1016-E1032 VanDerWaalsContact N-O 3.14Å; C1016-C1033 WeakPolarHBondContact CB-SG 3.15Å; C1016-C1033 PolarHBondContact SG-SG 3.12Å
1017	L	80.8	Confident	78.2	Confident	144 Å²	144	71.5 Å²	71.5	75%	0.754	37%	0.374	S	S	*	.	S	Bend	trans	-61.8	-39.3	177.2	-176.2	69.5	0	0	0	111.8	P1008	P1008-L1017 HydrophobicContact CB-CB 4.16Å; P1008-L1017 HydrophobicContact CB-CD2 4Å; P1008-L1017 HydrophobicContact CG-CD2 3.89Å
1018	N	78.2	Confident	78.2	Confident	71 Å²	71	71.9 Å²	71.9	38%	0.38	38%	0.375	S	S	.	.			trans	-138.1	113.1	176.9	-173.2	-15.5	0	0	0	111.1	R960 C1016 F1020 R1021	R960-N1018 PolarHBondContact NH1-O 2.91Å; R960-N1018 PolarHBondContact NH2-O 3.33Å; C1016-N1018 VanDerWaalsContact C-N 3.3Å; C1016-N1018 PolarHBondContact O-N 3.36Å; N1018-F1020 PolarHBondContact OD1-N 2.84Å; N1018-R1021 VanDerWaalsContact O-O 3.08Å; N1018-R1021 PolarHBondContact OD1-N 2.82Å
1019	C	76.3	Confident	78.3	Confident	38 Å²	38	70.4 Å²	70.4	26%	0.257	37%	0.365	S	S	.	.	S	Bend	trans	-79.4	-17.3	179.5	-71.1	0	0	0	0	114.9	R960 C1033	R960-C1019 VanDerWaalsContact NH2-C 3.34Å; R960-C1019 PolarHBondContact NH2-O 3.08Å; R960-C1019 VanDerWaalsContact NH2-O 3.1Å; C1019-C1033 WeakPolarHBondContact CA-SG 3.03Å; C1019-C1033 HydrophobicContact CB-CB 3.78Å; C1019-C1033 WeakPolarHBondContact CB-SG 3.41Å; C1019-C1033 VanDerWaalsContact SG-CA 3.56Å; C1019-C1033 WeakPolarHBondContact SG-CB 3.43Å; C1019-C1033 CovalentContact SG-SG 2.04Å; C1019-C1033 PolarHBondContact SG-SG 2.04Å
1020	F	69	Low	78.8	Confident	173 Å²	173	69 Å²	69	76%	0.759	36%	0.356	S	S	*	.	S	Bend	trans	-93	-20.6	-176.1	-59.9	-76.2	0	0	0	113.9	N1018 L1036	N1018-F1020 PolarHBondContact OD1-N 2.84Å; F1020-L1036 HydrophobicContact CD1-CD1 4.05Å; F1020-L1036 HydrophobicContact CE1-CD1 3.66Å; F1020-L1036 HydrophobicContact CE1-CD2 4.07Å; F1020-L1036 HydrophobicContact CZ-CD1 4.38Å; F1020-L1036 HydrophobicContact CZ-CD2 4.38Å
1021	R	67.7	Low	79.4	Confident	130 Å²	130	68.1 Å²	68.1	49%	0.491	35%	0.349	S	S	.	.			trans	-118.7	130.2	177	-169	-178.5	-177.9	-167.3	2.1	109.2	R960 N1018 E1023 E1026	R960-R1021 PolarHBondContact NH1-O 3.34Å; R960-R1021 PolarHBondContact NH2-O 3.32Å; R960-R1021 VanDerWaalsContact NH2-O 3.16Å; N1018-R1021 VanDerWaalsContact O-O 3.08Å; N1018-R1021 PolarHBondContact OD1-N 2.82Å; R1021-E1023 HydrophobicContact CG-CG 4.39Å; R1021-E1023 IonicContact CZ-OE1 3.11Å; R1021-E1023 IonicContact NE-OE1 3.64Å; R1021-E1023 PolarHBondContact NE-OE1 2.99Å; R1021-E1023 IonicContact NH2-OE1 2.73Å; R1021-E1023 PolarHBondContact NH2-OE1 2.91Å; R1021-E1023 IonicContact NH2-OE2 2.82Å; R1021-E1026 IonicContact CZ-OE1 3.38Å; R1021-E1026 IonicContact NE-OE1 3.8Å; R1021-E1026 IonicContact NH1-OE1 2.74Å; R1021-E1026 IonicContact NH2-OE1 3.82Å
1022	S	73.1	Confident	80.2	Confident	63 Å²	63	67.5 Å²	67.5	44%	0.441	34%	0.343	S	S	.	.			trans	-140.5	94.5	171.8	63.6	0	0	0	0	109.3
1023	E	78.2	Confident	81	Confident	68 Å²	68	62.9 Å²	62.9	32%	0.318	32%	0.315	S	S	.	.			trans	-81.2	140.4	171.7	-60.9	-171.2	172.2	0	0	110.1	K947 R1021 T1025 E1026	K947-E1023 PolarHBondContact NZ-O 3.22Å; R1021-E1023 HydrophobicContact CG-CG 4.39Å; R1021-E1023 IonicContact CZ-OE1 3.11Å; R1021-E1023 IonicContact NE-OE1 3.64Å; R1021-E1023 PolarHBondContact NE-OE1 2.99Å; R1021-E1023 IonicContact NH2-OE1 2.73Å; R1021-E1023 PolarHBondContact NH2-OE1 2.91Å; R1021-E1023 IonicContact NH2-OE2 2.82Å; E1023-T1025 PolarHBondContact O-N 3.18Å; E1023-E1026 HydrophobicContact CB-CB 3.99Å; E1023-E1026 HydrophobicContact CB-CG 3.71Å; E1023-E1026 HydrophobicContact CG-CG 4.26Å; E1023-E1026 PolarHBondContact O-N 3.45Å
1024	P	79.9	Confident	80.9	Confident	96 Å²	96	62.8 Å²	62.8	62%	0.623	32%	0.319	S	S	*	.	S	Bend	trans	-59.4	-31.4	178.2	-24.8	34.1	0	0	0	113.5
1025	T	84.4	Confident	80.2	Confident	80 Å²	80	62.1 Å²	62.1	49%	0.491	32%	0.319	S	S	.	.	S	Bend	trans	-96.5	-12	-175.5	49	0	0	0	0	113.9	E1023 C1027	E1023-T1025 PolarHBondContact O-N 3.18Å; T1025-C1027 PolarHBondContact O-N 2.9Å
1026	E	85.2	Confident	79	Confident	71 Å²	71	58.2 Å²	58.2	33%	0.332	31%	0.31	S	S	.	.	S	Bend	trans	-74.4	118.9	175.3	-80.9	175.5	163.8	0	0	110.2	K947 R1021 E1023	K947-E1026 PolarHBondContact NZ-O 3.15Å; R1021-E1026 IonicContact CZ-OE1 3.38Å; R1021-E1026 IonicContact NE-OE1 3.8Å; R1021-E1026 IonicContact NH1-OE1 2.74Å; R1021-E1026 IonicContact NH2-OE1 3.82Å; E1023-E1026 HydrophobicContact CB-CB 3.99Å; E1023-E1026 HydrophobicContact CB-CG 3.71Å; E1023-E1026 HydrophobicContact CG-CG 4.26Å; E1023-E1026 PolarHBondContact O-N 3.45Å
1027	C	88.7	Confident	77.2	Confident	19 Å²	19	59.2 Å²	59.2	13%	0.128	32%	0.317	C	S	.	.			trans	-72.5	128.1	178	-169.5	0	0	0	0	111.3	L939 C1007 P1008 T1025	L939-C1027 HydrophobicContact CD1-CB 3.82Å; C1007-C1027 HydrophobicContact CB-CB 3.95Å; C1007-C1027 WeakPolarHBondContact CB-SG 3.27Å; C1007-C1027 WeakPolarHBondContact SG-CB 3.35Å; C1007-C1027 CovalentContact SG-SG 2.04Å; C1007-C1027 PolarHBondContact SG-SG 2.95Å; P1008-C1027 WeakPolarHBondContact CD-O 3.42Å; T1025-C1027 PolarHBondContact O-N 2.9Å
1028	E	88.1	Confident	75.5	Confident	17 Å²	17	56.8 Å²	56.8	8%	0.079	31%	0.311	C	S	.	.			trans	-147	159.2	170.3	61.9	-173.8	161.4	0	0	108.8	T928 K947 R960 Y962	T928-E1028 WeakPolarHBondContact CG2-O 3.5Å; K947-E1028 WeakPolarHBondContact CE-OE1 3.46Å; K947-E1028 VanDerWaalsContact NZ-CD 3.34Å; K947-E1028 IonicContact NZ-OE1 3.49Å; K947-E1028 PolarHBondContact NZ-OE1 3.38Å; R960-E1028 WeakPolarHBondContact CD-OE1 3.42Å; R960-E1028 IonicContact CZ-OE1 2.63Å; R960-E1028 IonicContact NE-OE1 3Å; R960-E1028 IonicContact NH1-OE1 3.18Å; R960-E1028 PolarHBondContact NH1-OE1 3.12Å; R960-E1028 IonicContact NH1-OE2 2.87Å; R960-E1028 PolarHBondContact NH1-OE2 3.48Å; Y962-E1028 WeakPolarHBondContact CE2-O 3.35Å; Y962-E1028 PolarHBondContact OH-N 3.47Å; Y962-E1028 PolarHBondContact OH-O 2.91Å
1029	C	88.5	Confident	74.1	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.014	31%	0.306	C	S	.	.			trans	-68.1	158.4	168.3	-81.8	0	0	0	0	111.4	T928 P1008 C1009 C1031	T928-C1029 WeakPolarHBondContact OG1-CA 3.3Å; T928-C1029 PolarHBondContact OG1-SG 2.93Å; T928-C1029 VanDerWaalsContact OG1-SG 3.34Å; P1008-C1029 PolarHBondContact O-N 2.83Å; C1009-C1029 HydrophobicContact CB-CB 3.66Å; C1009-C1029 WeakPolarHBondContact CB-SG 3.34Å; C1009-C1029 WeakPolarHBondContact SG-CB 3.35Å; C1009-C1029 CovalentContact SG-SG 2.02Å; C1009-C1029 PolarHBondContact SG-SG 2.79Å; C1029-C1031 WeakPolarHBondContact O-CB 3.4Å; C1029-C1031 PolarHBondContact O-N 2.79Å; C1029-C1031 VanDerWaalsContact O-N 3.16Å
1030	P	90.2	Very high	72.8	Confident	8 Å²	8	55.7 Å²	55.7	5%	0.052	30%	0.3	C	S	.	.	S	Bend	trans	-48.3	126.2	165.3	-25.3	33.7	0	0	0	110.1	R960 Y962	R960-P1030 VanDerWaalsContact O-CA 3.32Å; R960-P1030 WeakPolarHBondContact O-CA 3.34Å; Y962-P1030 HydrophobicContact CD2-CG 4.26Å
1031	C	89.2	Confident	71.8	Confident	8 Å²	8	49 Å²	49	5%	0.054	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	161.3	-169.4	69.5	0	0	0	0	111.6	R960 R1014 C1016 C1029	R960-C1031 PolarHBondContact N-O 2.76Å; R960-C1031 PolarHBondContact O-N 3.02Å; R960-C1031 VanDerWaalsContact O-N 3.14Å; R1014-C1031 CarbonylContact O-C 3.53Å; R1014-C1031 WeakPolarHBondContact O-CA 3.36Å; R1014-C1031 WeakPolarHBondContact O-CB 3.42Å; C1016-C1031 WeakPolarHBondContact CA-SG 3.1Å; C1016-C1031 HydrophobicContact CB-CB 3.88Å; C1016-C1031 WeakPolarHBondContact CB-SG 2.91Å; C1016-C1031 WeakPolarHBondContact SG-CB 3.22Å; C1016-C1031 CovalentContact SG-SG 2.03Å; C1016-C1031 PolarHBondContact SG-SG 2.94Å; C1029-C1031 WeakPolarHBondContact O-CB 3.4Å; C1029-C1031 PolarHBondContact O-N 2.79Å; C1029-C1031 VanDerWaalsContact O-N 3.16Å
1032	E	86.4	Confident	70.5	Confident	31 Å²	31	51.2 Å²	51.2	15%	0.145	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	140.1	-175.7	-61.5	178.1	167.2	0	0	110	R952 V958 Q959 R1014 R1015 C1016	R952-E1032 IonicContact NH1-OE1 3.9Å; V958-E1032 WeakPolarHBondContact O-CA 3.49Å; Q959-E1032 HydrophobicContact CG-CG 4.1Å; Q959-E1032 VanDerWaalsContact NE2-CD 3.34Å; Q959-E1032 PolarHBondContact NE2-OE1 3.12Å; R1014-E1032 IonicContact CZ-OE1 3.25Å; R1014-E1032 IonicContact NH1-OE1 3.37Å; R1014-E1032 PolarHBondContact NH1-OE1 3.37Å; R1014-E1032 IonicContact NH1-OE2 3.09Å; R1014-E1032 IonicContact NH2-OE1 2.77Å; R1014-E1032 PolarHBondContact O-N 2.91Å; R1015-E1032 WeakPolarHBondContact CA-O 2.79Å; C1016-E1032 PolarHBondContact N-O 3.39Å; C1016-E1032 VanDerWaalsContact N-O 3.14Å
1033	C	81.3	Confident	68.9	Low	6 Å²	6	52.1 Å²	52.1	4%	0.041	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	146.8	172.2	-79.6	0	0	0	0	108.9	T957 V958 C1016 C1019 L1035	T957-C1033 CarbonylContact C-O 3.57Å; T957-C1033 WeakPolarHBondContact CA-O 3.36Å; T957-C1033 WeakPolarHBondContact CB-O 3.44Å; V958-C1033 HydrophobicContact CB-CB 4.41Å; V958-C1033 PolarHBondContact N-O 3.01Å; V958-C1033 PolarHBondContact O-N 3.37Å; C1016-C1033 WeakPolarHBondContact CB-SG 3.15Å; C1016-C1033 PolarHBondContact SG-SG 3.12Å; C1019-C1033 WeakPolarHBondContact CA-SG 3.03Å; C1019-C1033 HydrophobicContact CB-CB 3.78Å; C1019-C1033 WeakPolarHBondContact CB-SG 3.41Å; C1019-C1033 VanDerWaalsContact SG-CA 3.56Å; C1019-C1033 WeakPolarHBondContact SG-CB 3.43Å; C1019-C1033 CovalentContact SG-SG 2.04Å; C1019-C1033 PolarHBondContact SG-SG 2.04Å; C1033-L1035 PolarHBondContact O-N 2.78Å
1034	P	68.8	Low	66.8	Low	70 Å²	70	54.5 Å²	54.5	46%	0.455	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	134	167.2	27	-32.8	0	0	0	108.7	L1036	P1034-L1036 VanDerWaalsContact C-N 3.31Å; P1034-L1036 PolarHBondContact O-N 3.17Å
1035	L	65.4	Low	64.7	Low	43 Å²	43	54.8 Å²	54.8	23%	0.225	30%	0.3	C	S	.	.			trans	-62	98.2	171	-176.1	68.2	0	0	0	106.6	M951 F953 R956 V958 C1033 S1037	M951-L1035 HydrophobicContact CG-CD1 4.08Å; M951-L1035 HydrophobicContact SD-CD1 3.96Å; F953-L1035 HydrophobicContact CD1-CD2 4.38Å; R956-L1035 VanDerWaalsContact C-CB 3.48Å; R956-L1035 HydrophobicContact CB-CB 4.45Å; R956-L1035 WeakPolarHBondContact O-CB 3.16Å; R956-L1035 PolarHBondContact O-N 3.12Å; V958-L1035 HydrophobicContact CG2-CB 4.26Å; V958-L1035 HydrophobicContact CG2-CD1 3.34Å; V958-L1035 HydrophobicContact CG2-CG 4.4Å; C1033-L1035 PolarHBondContact O-N 2.78Å; L1035-S1037 VanDerWaalsContact C-N 3.34Å; L1035-S1037 PolarHBondContact O-N 3.1Å
1036	L	55.4	Low	62.2	Low	73 Å²	73	59.5 Å²	59.5	38%	0.382	31%	0.314	S	S	.	.			trans	-58.7	104.3	171.9	-77.2	151.1	0	0	0	105.5	Y328 F1020 P1034 S1038	Y328-L1036 HydrophobicContact CD1-CD2 3.79Å; Y328-L1036 HydrophobicContact CE1-CD2 3.92Å; F1020-L1036 HydrophobicContact CD1-CD1 4.05Å; F1020-L1036 HydrophobicContact CE1-CD1 3.66Å; F1020-L1036 HydrophobicContact CE1-CD2 4.07Å; F1020-L1036 HydrophobicContact CZ-CD1 4.38Å; F1020-L1036 HydrophobicContact CZ-CD2 4.38Å; P1034-L1036 VanDerWaalsContact C-N 3.31Å; P1034-L1036 PolarHBondContact O-N 3.17Å; L1036-S1038 PolarHBondContact O-N 2.93Å
1037	S	46.9	Very low	59.8	Low	33 Å²	33	61.4 Å²	61.4	23%	0.231	33%	0.33	C	S	.	.			trans	-41.1	113.5	-179.4	123.9	0	0	0	0	108.6	L1035 Y1039	L1035-S1037 VanDerWaalsContact C-N 3.34Å; L1035-S1037 PolarHBondContact O-N 3.1Å; S1037-Y1039 PolarHBondContact O-N 2.68Å; S1037-Y1039 WeakPolarHBondContact OG-CB 3.47Å; S1037-Y1039 WeakPolarHBondContact OG-CD2 3.14Å; S1037-Y1039 PolarHBondContact OG-N 3.34Å
1038	S	44.8	Very low	57.4	Low	92 Å²	92	65.2 Å²	65.2	64%	0.643	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	18.3	172.1	51.8	0	0	0	0	112.1	R375 L1036	R375-S1038 PolarHBondContact NH2-O 3.27Å; L1036-S1038 PolarHBondContact O-N 2.93Å
1039	Y	48.1	Very low	54.8	Low	66 Å²	66	68.7 Å²	68.7	26%	0.259	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-7.7	-176.5	-58.6	-74.1	0	0	0	113.8	V335 R375 D601 S1037 P1041	V335-Y1039 HydrophobicContact CB-CG 4.46Å; V335-Y1039 HydrophobicContact CG2-CD1 3.79Å; V335-Y1039 HydrophobicContact CG2-CE1 4.49Å; V335-Y1039 HydrophobicContact CG2-CG 4Å; R375-Y1039 PolarHBondContact NE-O 2.56Å; D601-Y1039 PolarHBondContact O-OH 3.49Å; S1037-Y1039 PolarHBondContact O-N 2.68Å; S1037-Y1039 WeakPolarHBondContact OG-CB 3.47Å; S1037-Y1039 WeakPolarHBondContact OG-CD2 3.14Å; S1037-Y1039 PolarHBondContact OG-N 3.34Å; Y1039-P1041 VanDerWaalsContact O-CD 3.22Å; Y1039-P1041 WeakPolarHBondContact O-CD 3.3Å
1040	C	48.9	Very low	52.2	Low	20 Å²	20	73.3 Å²	73.3	14%	0.135	41%	0.411	C	S	.	.			trans	-67.8	116.7	172.6	-60.9	0	0	0	0	110.4	Y328 C329 R1042 V1043	Y328-C1040 PolarHBondContact O-SG 3.12Å; C329-C1040 VanDerWaalsContact CA-SG 3.56Å; C329-C1040 HydrophobicContact CB-CB 4.04Å; C329-C1040 WeakPolarHBondContact CB-SG 3.34Å; C329-C1040 WeakPolarHBondContact SG-CA 3.38Å; C329-C1040 WeakPolarHBondContact SG-CB 3.36Å; C329-C1040 CovalentContact SG-SG 2.04Å; C329-C1040 PolarHBondContact SG-SG 2.93Å; C1040-R1042 PolarHBondContact O-N 3.23Å; C1040-R1042 VanDerWaalsContact O-N 3.12Å; C1040-V1043 HydrophobicContact CB-CG2 3.82Å
1041	P	48.6	Very low	50.1	Low	34 Å²	34	81.3 Å²	81.3	22%	0.221	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-30.3	-173.4	-7.4	7.5	0	0	0	114.2	A332 R375 Y1039	A332-P1041 HydrophobicContact CB-CG 4.08Å; R375-P1041 HydrophobicContact CB-CB 4.31Å; R375-P1041 HydrophobicContact CB-CG 4.47Å; R375-P1041 HydrophobicContact CG-CB 3.55Å; R375-P1041 HydrophobicContact CG-CG 3.77Å; R375-P1041 VanDerWaalsContact N-CG 3.29Å; Y1039-P1041 VanDerWaalsContact O-CD 3.22Å; Y1039-P1041 WeakPolarHBondContact O-CD 3.3Å
1042	R	41.3	Very low	48.5	Very low	176 Å²	176	86.2 Å²	86.2	66%	0.664	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.7	9.8	-167.3	-94.1	-171.5	173.5	167	8.6	115.6	N373 C1040 D1044	N373-R1042 PolarHBondContact OD1-NH1 3.09Å; C1040-R1042 PolarHBondContact O-N 3.23Å; C1040-R1042 VanDerWaalsContact O-N 3.12Å; R1042-D1044 VanDerWaalsContact C-N 3.3Å; R1042-D1044 PolarHBondContact O-N 3.07Å
1043	V	39.7	Very low	47.5	Very low	81 Å²	81	87.7 Å²	87.7	49%	0.491	48%	0.476	S	S	.	.	S	Bend	trans	-68.6	105.3	159.7	178.6	0	0	0	0	104.5	C1040 T1045 V1048	C1040-V1043 HydrophobicContact CB-CG2 3.82Å; V1043-T1045 PolarHBondContact O-N 3.12Å; V1043-V1048 HydrophobicContact CG1-CG2 4.48Å
1044	D	33.1	Very low	46.9	Very low	119 Å²	119	90.1 Å²	90.1	64%	0.636	49%	0.492	S	S	*	.			trans	-36	103.3	-179.7	-104.6	-35.9	0	0	0	108.5	R1042 K1046 T1047	R1042-D1044 VanDerWaalsContact C-N 3.3Å; R1042-D1044 PolarHBondContact O-N 3.07Å; D1044-K1046 PolarHBondContact O-N 2.9Å; D1044-T1047 PolarHBondContact O-N 3.35Å; D1044-T1047 PolarHBondContact O-OG1 3.12Å
1045	T	35.8	Very low	47.1	Very low	102 Å²	102	88.3 Å²	88.3	63%	0.626	48%	0.478	S	S	*	.	H	α-helix	trans	-59.7	-20.6	-178.1	42.9	0	0	0	0	108.6	V1043 T1047 V1048 S1049	V1043-T1045 PolarHBondContact O-N 3.12Å; T1045-T1047 PolarHBondContact O-N 2.93Å; T1045-T1047 VanDerWaalsContact O-N 3.15Å; T1045-V1048 CarbonylContact O-C 3.58Å; T1045-V1048 PolarHBondContact O-N 3.39Å; T1045-S1049 WeakPolarHBondContact O-CA 3.43Å; T1045-S1049 WeakPolarHBondContact O-CB 3.22Å; T1045-S1049 PolarHBondContact O-N 3.12Å
1046	K	32.1	Very low	47.6	Very low	178 Å²	178	86.7 Å²	86.7	77%	0.774	47%	0.47	S	S	*	.	H	α-helix	trans	-52.9	-31.6	170.1	-68.6	-174.4	179.1	179.2	0	115.1	D1044	D1044-K1046 PolarHBondContact O-N 2.9Å
1047	T	34.2	Very low	48.1	Very low	111 Å²	111	86.6 Å²	86.6	68%	0.681	47%	0.47	S	S	*	.	H	α-helix	trans	-83.1	-21.7	175.1	43.8	0	0	0	0	113.6	D1044 T1045	D1044-T1047 PolarHBondContact O-N 3.35Å; D1044-T1047 PolarHBondContact O-OG1 3.12Å; T1045-T1047 PolarHBondContact O-N 2.93Å; T1045-T1047 VanDerWaalsContact O-N 3.15Å
1048	V	38.4	Very low	48.7	Very low	100 Å²	100	86 Å²	86	61%	0.606	47%	0.467	S	S	*	.	H	α-helix	trans	-99.8	-15.7	174	-173.9	0	0	0	0	112.7	V1043 T1045 S1050	V1043-V1048 HydrophobicContact CG1-CG2 4.48Å; T1045-V1048 CarbonylContact O-C 3.58Å; T1045-V1048 PolarHBondContact O-N 3.39Å; V1048-S1050 VanDerWaalsContact C-N 3.33Å; V1048-S1050 PolarHBondContact O-N 2.68Å
1049	S	33.5	Very low	49.4	Very low	90 Å²	90	83.2 Å²	83.2	63%	0.629	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-13.2	-168.4	175.7	0	0	0	0	112.6	T1045	T1045-S1049 WeakPolarHBondContact O-CA 3.43Å; T1045-S1049 WeakPolarHBondContact O-CB 3.22Å; T1045-S1049 PolarHBondContact O-N 3.12Å
1050	S	34.6	Very low	50	Low	98 Å²	98	82.3 Å²	82.3	69%	0.685	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-15.8	-173.2	60.5	0	0	0	0	115.5	V1048	V1048-S1050 VanDerWaalsContact C-N 3.33Å; V1048-S1050 PolarHBondContact O-N 2.68Å
1051	K	45	Very low	50.7	Low	177 Å²	177	84.6 Å²	84.6	77%	0.77	46%	0.46	S	S	*	.			trans	-151.8	99.8	172	-66.1	-173.6	-178.2	173.3	0	111.8	L1053	K1051-L1053 PolarHBondContact O-N 3.47Å
1052	Q	56.8	Low	51.4	Low	111 Å²	111	90.6 Å²	90.6	52%	0.519	49%	0.485	S	S	.	.			trans	-51.7	110.2	165.2	-83	174.4	-31.2	0	0	109.8	A605 K609	A605-Q1052 PolarHBondContact O-NE2 2.92Å; K609-Q1052 PolarHBondContact NZ-O 2.96Å
1053	L	64.2	Low	52.4	Low	62 Å²	62	84.7 Å²	84.7	33%	0.325	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-60.6	137.4	179.8	-69	168	0	0	0	109.7	V949 M951 K1051	V949-L1053 HydrophobicContact CB-CD2 3.75Å; V949-L1053 HydrophobicContact CG1-CD1 4.05Å; V949-L1053 HydrophobicContact CG1-CD2 3.86Å; M951-L1053 HydrophobicContact CE-CB 4.04Å; M951-L1053 WeakPolarHBondContact CE-O 2.93Å; M951-L1053 HydrophobicContact CG-CB 3.93Å; M951-L1053 HydrophobicContact CG-CD1 4.13Å; M951-L1053 HydrophobicContact SD-CB 4.15Å; M951-L1053 HydrophobicContact SD-CD1 4.32Å; K1051-L1053 PolarHBondContact O-N 3.47Å
1054	P	69.3	Low	53.7	Low	57 Å²	57	85.5 Å²	85.5	37%	0.37	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-66.4	155.4	174.8	29.1	-34.5	0	0	0	112.1	V949 C950 M951	V949-P1054 WeakPolarHBondContact O-CD 3.44Å; C950-P1054 CarbonylContact C-O 3.4Å; C950-P1054 WeakPolarHBondContact CA-O 3.31Å; C950-P1054 HydrophobicContact CB-CG 4.35Å; C950-P1054 WeakPolarHBondContact CB-O 3.41Å; M951-P1054 PolarHBondContact N-O 3.44Å
1055	I	72.4	Confident	55.6	Low	32 Å²	32	82.1 Å²	82.1	16%	0.164	45%	0.453	C	S	.	.	B	Isolated β-bridge	trans	-71.2	139.4	169.8	-42.6	-177.1	0	0	0	108.9	V607 M951 F953	V607-I1055 HydrophobicContact CB-CD1 4.08Å; V607-I1055 HydrophobicContact CG1-CD1 3.54Å; V607-I1055 WeakPolarHBondContact O-CD1 3.36Å; M951-I1055 CarbonylContact O-C 3.55Å; M951-I1055 WeakPolarHBondContact O-CA 3.33Å; M951-I1055 WeakPolarHBondContact O-CG2 3.36Å; F953-I1055 HydrophobicContact CD2-CG2 4.19Å; F953-I1055 HydrophobicContact CE2-CD1 4.37Å; F953-I1055 HydrophobicContact CE2-CG1 4.2Å; F953-I1055 HydrophobicContact CE2-CG2 4.35Å
1056	C	75.5	Confident	57.7	Low	8 Å²	8	77.6 Å²	77.6	5%	0.054	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-65.7	152.1	167.8	-57.2	0	0	0	0	110.4	C950 M951 R952	C950-C1056 HydrophobicContact CB-CB 3.99Å; C950-C1056 WeakPolarHBondContact CB-SG 3.22Å; C950-C1056 PolarHBondContact O-SG 3.5Å; C950-C1056 VanDerWaalsContact O-SG 3.38Å; C950-C1056 WeakPolarHBondContact SG-CA 3.43Å; C950-C1056 WeakPolarHBondContact SG-CB 3.02Å; C950-C1056 CovalentContact SG-SG 2.04Å; C950-C1056 PolarHBondContact SG-SG 3.34Å; M951-C1056 VanDerWaalsContact C-SG 3.54Å; M951-C1056 PolarHBondContact O-N 2.81Å; R952-C1056 HydrophobicContact CB-CB 4.12Å
1057	N	66.5	Low	59.8	Low	71 Å²	71	73.9 Å²	73.9	38%	0.38	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-58.9	147.8	166.7	-66.9	-12.9	0	0	0	109.6	Q824 A1059	Q824-N1057 PolarHBondContact NE2-ND2 3.3Å; Q824-N1057 VanDerWaalsContact NE2-ND2 3.11Å; N1057-A1059 PolarHBondContact O-N 3.49Å
1058	A	60.6	Low	61.9	Low	20 Å²	20	69.6 Å²	69.6	17%	0.165	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-51.7	133.3	175.6	0	0	0	0	0	109.7	S1060	A1058-S1060 PolarHBondContact O-N 2.91Å
1059	A	58.6	Low	63.8	Low	34 Å²	34	68.6 Å²	68.6	28%	0.281	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-57.2	125.8	-178.8	0	0	0	0	0	109.8	N1057 K1061	N1057-A1059 PolarHBondContact O-N 3.49Å; A1059-K1061 PolarHBondContact O-N 2.86Å
1060	S	61.6	Low	65.6	Low	47 Å²	47	69.8 Å²	69.8	33%	0.329	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-67	118	171.8	66.7	0	0	0	0	107.8	D817 A1058 E1062	D817-S1060 VanDerWaalsContact OD2-CB 3.28Å; D817-S1060 WeakPolarHBondContact OD2-CB 3.43Å; D817-S1060 PolarHBondContact OD2-OG 3.31Å; A1058-S1060 PolarHBondContact O-N 2.91Å; S1060-E1062 PolarHBondContact O-N 3.07Å
1061	K	63.5	Low	67.3	Low	68 Å²	68	66.7 Å²	66.7	30%	0.296	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-61.8	139.4	177.1	-69.7	-172.5	179.9	-176.4	0	108.8	L594 R816 A1059	L594-K1061 PolarHBondContact O-NZ 3.24Å; R816-K1061 PolarHBondContact NH1-O 2.91Å; A1059-K1061 PolarHBondContact O-N 2.86Å
1062	E	62.4	Low	68.7	Low	160 Å²	160	58.9 Å²	58.9	75%	0.748	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-56.6	147.8	175.6	-73.1	-173.2	176.4	0	0	111.3	R816 S1060 L1064	R816-E1062 PolarHBondContact NH2-O 2.83Å; R816-E1062 VanDerWaalsContact NH2-O 3.13Å; S1060-E1062 PolarHBondContact O-N 3.07Å; E1062-L1064 PolarHBondContact O-N 3.15Å; E1062-L1064 VanDerWaalsContact O-N 3.08Å
1063	P	63	Low	69.3	Low	52 Å²	52	56.5 Å²	56.5	34%	0.338	31%	0.312	S	S	.	.			trans	-68.1	106.3	177.2	28.7	-33.1	0	0	0	110.4	P838	P838-P1063 HydrophobicContact CG-CB 3.95Å; P838-P1063 HydrophobicContact CG-CG 4.32Å; P838-P1063 WeakPolarHBondContact CG-O 3.4Å
1064	L	67.2	Low	69.3	Low	98 Å²	98	61.1 Å²	61.1	51%	0.513	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-78.4	131.7	173.6	-67.2	171	0	0	0	110.4	H808 E1062	H808-L1064 HydrophobicContact CB-CB 4.34Å; E1062-L1064 PolarHBondContact O-N 3.15Å; E1062-L1064 VanDerWaalsContact O-N 3.08Å
1065	L	72.1	Confident	68.8	Low	49 Å²	49	60.9 Å²	60.9	26%	0.257	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-71.3	128.6	171	-167.5	62.4	0	0	0	109.3	K704 M705 P838 M1067	K704-L1065 HydrophobicContact CB-CD2 4.36Å; M705-L1065 HydrophobicContact CE-CD1 3.45Å; M705-L1065 VanDerWaalsContact CE-CD1 3.45Å; M705-L1065 HydrophobicContact CG-CD1 3.43Å; M705-L1065 VanDerWaalsContact CG-CD1 3.43Å; M705-L1065 HydrophobicContact SD-CD1 4.29Å; P838-L1065 HydrophobicContact CB-CB 4.15Å; P838-L1065 HydrophobicContact CB-CD1 4.38Å; L1065-M1067 HydrophobicContact CD2-SD 4.29Å
1066	A	80.3	Confident	67.9	Low	7 Å²	7	63 Å²	63	6%	0.058	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-80.7	124.4	172.6	0	0	0	0	0	109.7	L806 H808	L806-A1066 HydrophobicContact CB-CB 4.16Å; L806-A1066 HydrophobicContact CD2-CB 4.03Å; L806-A1066 HydrophobicContact CG-CB 3.69Å; L806-A1066 WeakPolarHBondContact O-CB 3.46Å; H808-A1066 HydrophobicContact CB-CB 4.26Å
1067	M	75.6	Confident	66.7	Low	100 Å²	100	68.4 Å²	68.4	49%	0.493	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-95.5	137.3	178	-65.4	-65.1	-76.3	0	0	110.1	L806 L1065 L1148	L806-M1067 VanDerWaalsContact CD2-C 3.49Å; L1065-M1067 HydrophobicContact CD2-SD 4.29Å; M1067-L1148 HydrophobicContact CE-CD2 4.27Å
1068	P	78.6	Confident	66.4	Low	21 Å²	21	69.3 Å²	69.3	14%	0.136	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-59.4	152.5	172.3	-21.4	32.9	0	0	0	111.6	D690 L706 L806 F1072 F1073	D690-P1068 HydrophobicContact CB-CB 4.23Å; L706-P1068 HydrophobicContact CB-CG 4.37Å; L806-P1068 HydrophobicContact CD2-CB 4.45Å; L806-P1068 HydrophobicContact CD2-CG 4.21Å; P1068-F1072 HydrophobicContact CB-CB 4.2Å; P1068-F1072 HydrophobicContact CB-CD1 4.06Å; P1068-F1072 HydrophobicContact CB-CG 4.25Å; P1068-F1073 HydrophobicContact CB-CE2 3.98Å; P1068-F1073 HydrophobicContact CB-CZ 4.46Å; P1068-F1073 HydrophobicContact CG-CE2 3.94Å; P1068-F1073 HydrophobicContact CG-CZ 4.04Å
1069	D	79.1	Confident	66.7	Low	79 Å²	79	77 Å²	77	42%	0.422	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-56.2	143.9	170.4	-168.2	28.5	0	0	0	111.6	D690 L691 G1071 F1072	D690-D1069 WeakPolarHBondContact OD2-CB 3.45Å; D690-D1069 PolarHBondContact OD2-N 3.29Å; L691-D1069 HydrophobicContact CD2-CB 4.07Å; D1069-G1071 PolarHBondContact O-N 3.17Å; D1069-F1072 WeakPolarHBondContact O-CB 3.43Å; D1069-F1072 PolarHBondContact O-N 3.46Å
1070	M	70.8	Confident	67.6	Low	114 Å²	114	76.7 Å²	76.7	56%	0.562	42%	0.423	S	S	*	.	H	α-helix	trans	-56.9	-39.2	-173.8	-74	-72.9	-68.6	0	0	112.2	F1072 L1148	M1070-F1072 PolarHBondContact O-N 3.04Å; M1070-L1148 HydrophobicContact CE-CD1 3.96Å; M1070-L1148 HydrophobicContact SD-CD1 3.96Å; M1070-L1148 HydrophobicContact SD-CD2 4.37Å; M1070-L1148 HydrophobicContact SD-CG 4.31Å
1071	G	69.5	Low	68.8	Low	33 Å²	33	83 Å²	83	34%	0.34	44%	0.44	S	S	.	.	H	α-helix	trans	-66.5	-15	178.8	0	0	0	0	0	114.5	D1069 F1073 S1075	D1069-G1071 PolarHBondContact O-N 3.17Å; G1071-F1073 PolarHBondContact O-N 3.49Å; G1071-S1075 PolarHBondContact O-OG 3.05Å; G1071-S1075 VanDerWaalsContact O-OG 3.1Å
1072	F	74.6	Confident	69.8	Low	14 Å²	14	83.6 Å²	83.6	6%	0.061	44%	0.444	C	S	.	.	H	α-helix	trans	-60.7	-46	178.9	179	-101.1	0	0	0	111.5	D690 L693 L699 L706 P1068 D1069 M1070 S1075 V1080	D690-F1072 HydrophobicContact CB-CB 4.47Å; D690-F1072 HydrophobicContact CB-CD2 4.02Å; D690-F1072 HydrophobicContact CB-CG 4.34Å; L693-F1072 HydrophobicContact CD2-CD2 4.19Å; L693-F1072 HydrophobicContact CD2-CE2 3.81Å; L699-F1072 HydrophobicContact CD1-CE2 3.96Å; L699-F1072 HydrophobicContact CD1-CZ 4.15Å; L706-F1072 HydrophobicContact CD1-CE1 4.21Å; L706-F1072 HydrophobicContact CD1-CZ 3.78Å; L706-F1072 HydrophobicContact CD2-CD2 4.42Å; L706-F1072 HydrophobicContact CD2-CE1 4.13Å; L706-F1072 HydrophobicContact CD2-CE2 3.85Å; L706-F1072 HydrophobicContact CD2-CZ 3.69Å; L706-F1072 HydrophobicContact CG-CZ 4.41Å; P1068-F1072 HydrophobicContact CB-CB 4.2Å; P1068-F1072 HydrophobicContact CB-CD1 4.06Å; P1068-F1072 HydrophobicContact CB-CG 4.25Å; D1069-F1072 WeakPolarHBondContact O-CB 3.43Å; D1069-F1072 PolarHBondContact O-N 3.46Å; M1070-F1072 PolarHBondContact O-N 3.04Å; F1072-S1075 WeakPolarHBondContact O-CB 3.42Å; F1072-S1075 PolarHBondContact O-OG 3.32Å; F1072-V1080 HydrophobicContact CE1-CG2 4.43Å; F1072-V1080 HydrophobicContact CZ-CG2 4.1Å
1073	F	69.9	Low	70.9	Confident	60 Å²	60	77.4 Å²	77.4	26%	0.263	42%	0.418	S	S	.	.	H	α-helix	trans	-80.1	-28.5	-177.4	-65.3	-72.8	0	0	0	113.7	F701 P1068 G1071 S1075 G1076 Y1149	F701-F1073 HydrophobicContact CZ-CE1 4.17Å; F701-F1073 HydrophobicContact CZ-CZ 4.38Å; P1068-F1073 HydrophobicContact CB-CE2 3.98Å; P1068-F1073 HydrophobicContact CB-CZ 4.46Å; P1068-F1073 HydrophobicContact CG-CE2 3.94Å; P1068-F1073 HydrophobicContact CG-CZ 4.04Å; G1071-F1073 PolarHBondContact O-N 3.49Å; F1073-S1075 PolarHBondContact O-N 3.46Å; F1073-G1076 PolarHBondContact O-N 3.48Å; F1073-Y1149 HydrophobicContact CE1-CE1 4.48Å; F1073-Y1149 HydrophobicContact CZ-CE1 4.29Å
1074	E	65.1	Low	71.7	Confident	160 Å²	160	78.9 Å²	78.9	75%	0.748	43%	0.426	S	S	*	.	H	α-helix	trans	-61.5	-27.2	176.5	-69.4	-178	169.3	0	0	112.3	G1076	E1074-G1076 PolarHBondContact O-N 3.31Å
1075	S	58.3	Low	72	Confident	52 Å²	52	81.5 Å²	81.5	36%	0.364	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-15.8	178.8	-37.9	0	0	0	0	114.5	G1071 F1072 F1073 T1077	G1071-S1075 PolarHBondContact O-OG 3.05Å; G1071-S1075 VanDerWaalsContact O-OG 3.1Å; F1072-S1075 WeakPolarHBondContact O-CB 3.42Å; F1072-S1075 PolarHBondContact O-OG 3.32Å; F1073-S1075 PolarHBondContact O-N 3.46Å; S1075-T1077 WeakPolarHBondContact O-CB 3.36Å; S1075-T1077 VanDerWaalsContact O-CG2 3.27Å; S1075-T1077 WeakPolarHBondContact O-CG2 3.49Å; S1075-T1077 PolarHBondContact O-N 2.84Å; S1075-T1077 PolarHBondContact O-OG1 2.98Å
1076	G	52.7	Low	72.4	Confident	76 Å²	76	81.2 Å²	81.2	78%	0.784	44%	0.436	S	S	*	.			trans	59.1	-8.1	172	0	0	0	0	0	117.2	F1073 E1074	F1073-G1076 PolarHBondContact O-N 3.48Å; E1074-G1076 PolarHBondContact O-N 3.31Å
1077	T	50.8	Low	72.7	Confident	122 Å²	122	84.3 Å²	84.3	75%	0.748	45%	0.454	S	S	*	.			trans	-108	-8.7	-160.7	43.5	0	0	0	0	113.5	S1075	S1075-T1077 WeakPolarHBondContact O-CB 3.36Å; S1075-T1077 VanDerWaalsContact O-CG2 3.27Å; S1075-T1077 WeakPolarHBondContact O-CG2 3.49Å; S1075-T1077 PolarHBondContact O-N 2.84Å; S1075-T1077 PolarHBondContact O-OG1 2.98Å
1078	Q	60.1	Low	73.4	Confident	90 Å²	90	80.1 Å²	80.1	42%	0.421	44%	0.435	S	S	.	.			trans	-114.4	96.4	-177.6	-71.5	-178.2	-10.9	0	0	111.4	V1080	Q1078-V1080 VanDerWaalsContact C-N 3.26Å; Q1078-V1080 HydrophobicContact CB-CG2 4.09Å; Q1078-V1080 PolarHBondContact O-N 3.44Å
1079	Q	67.2	Low	73.8	Confident	181 Å²	181	83.3 Å²	83.3	85%	0.846	46%	0.457	S	S	*	.			trans	-71.1	85.5	161.8	-74.4	-176.1	-2.1	0	0	109.1	R1081	Q1079-R1081 PolarHBondContact O-N 2.84Å
1080	V	78.4	Confident	74.4	Confident	27 Å²	27	85 Å²	85	16%	0.164	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-74	118.8	176.2	-175.5	0	0	0	0	109	L699 C700 F701 L706 F1072 Q1078	L699-V1080 HydrophobicContact CB-CG1 4.46Å; C700-V1080 VanDerWaalsContact CA-CG1 3.46Å; F701-V1080 HydrophobicContact CD2-CB 3.91Å; F701-V1080 HydrophobicContact CD2-CG1 3.56Å; F701-V1080 HydrophobicContact CE2-CB 3.6Å; F701-V1080 HydrophobicContact CE2-CG1 3.67Å; F701-V1080 HydrophobicContact CG-CG1 4.13Å; F701-V1080 HydrophobicContact CZ-CB 4.33Å; F701-V1080 HydrophobicContact CZ-CG1 4.29Å; L706-V1080 HydrophobicContact CD1-CG1 4.13Å; F1072-V1080 HydrophobicContact CE1-CG2 4.43Å; F1072-V1080 HydrophobicContact CZ-CG2 4.1Å; Q1078-V1080 VanDerWaalsContact C-N 3.26Å; Q1078-V1080 HydrophobicContact CB-CG2 4.09Å; Q1078-V1080 PolarHBondContact O-N 3.44Å
1081	R	85.4	Confident	75.3	Confident	179 Å²	179	82.6 Å²	82.6	68%	0.675	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	169.7	178.4	-62.3	-176.3	-177.6	178.4	0.9	111.2	C700 F701 Q1079	C700-R1081 CarbonylContact C-O 3.46Å; C700-R1081 WeakPolarHBondContact CA-O 3.06Å; C700-R1081 WeakPolarHBondContact CB-O 3.24Å; F701-R1081 PolarHBondContact N-O 3.05Å; Q1079-R1081 PolarHBondContact O-N 2.84Å
1082	Q	85.6	Confident	76.3	Confident	81 Å²	81	89.9 Å²	89.9	38%	0.379	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	140.7	170.7	-166	67.7	4.4	0	0	110.3	F701 G703 T1084	F701-Q1082 CarbonylContact O-C 3.54Å; F701-Q1082 WeakPolarHBondContact O-CA 3.46Å; F701-Q1082 PolarHBondContact O-NE2 3.28Å; F701-Q1082 PolarHBondContact O-OE1 3.35Å; F701-Q1082 VanDerWaalsContact O-OE1 3.04Å; G703-Q1082 PolarHBondContact O-OE1 3.24Å; Q1082-T1084 VanDerWaalsContact C-N 3.33Å; Q1082-T1084 WeakPolarHBondContact CG-O 3.32Å; Q1082-T1084 PolarHBondContact O-N 2.84Å
1083	C	85.1	Confident	76.9	Confident	31 Å²	31	91.9 Å²	91.9	21%	0.209	49%	0.489	C	S	.	.	S	Bend	trans	-63.9	-38.1	179.5	-66.2	0	0	0	0	112.9	C700 F701 C709	C700-C1083 HydrophobicContact CB-CB 3.81Å; C700-C1083 WeakPolarHBondContact CB-SG 3.23Å; C700-C1083 WeakPolarHBondContact SG-CA 3.22Å; C700-C1083 WeakPolarHBondContact SG-CB 3.37Å; C700-C1083 CovalentContact SG-SG 2.03Å; C700-C1083 PolarHBondContact SG-SG 3.23Å; F701-C1083 PolarHBondContact O-N 3.09Å; F701-C1083 PolarHBondContact O-SG 3.21Å; F701-C1083 VanDerWaalsContact O-SG 3.35Å; C709-C1083 VanDerWaalsContact SG-CB 3.53Å
1084	T	78.6	Confident	77.7	Confident	83 Å²	83	91 Å²	91	51%	0.509	49%	0.486	S	S	.	.			trans	-131.4	116.7	-179	-43.2	0	0	0	0	108.5	Q1082 V1086	Q1082-T1084 VanDerWaalsContact C-N 3.33Å; Q1082-T1084 WeakPolarHBondContact CG-O 3.32Å; Q1082-T1084 PolarHBondContact O-N 2.84Å; T1084-V1086 VanDerWaalsContact C-N 3.32Å; T1084-V1086 HydrophobicContact CG2-CG2 3.62Å; T1084-V1086 PolarHBondContact O-N 3.05Å; T1084-V1086 VanDerWaalsContact O-N 3.15Å
1085	E	74.3	Confident	78.6	Confident	153 Å²	153	86.7 Å²	86.7	72%	0.715	47%	0.467	S	S	*	.			trans	-86.4	74.5	174.8	-66.1	-172.8	173.3	0	0	109.7	T1087	E1085-T1087 PolarHBondContact O-N 3.13Å
1086	V	79.7	Confident	80.1	Confident	43 Å²	43	85.9 Å²	85.9	26%	0.261	46%	0.462	S	S	.	.			trans	-76.8	114.1	173.3	-174.8	0	0	0	0	108.9	T1084 C1088 Y1091 I1100	T1084-V1086 VanDerWaalsContact C-N 3.32Å; T1084-V1086 HydrophobicContact CG2-CG2 3.62Å; T1084-V1086 PolarHBondContact O-N 3.05Å; T1084-V1086 VanDerWaalsContact O-N 3.15Å; V1086-C1088 PolarHBondContact O-N 2.94Å; V1086-Y1091 HydrophobicContact CG1-CE2 4.19Å; V1086-I1100 HydrophobicContact CG1-CG2 3.55Å
1087	T	87.2	Confident	81.8	Confident	71 Å²	71	82.3 Å²	82.3	44%	0.436	43%	0.425	S	S	.	.			trans	-91.3	94.8	175.7	-57.4	0	0	0	0	109.5	E1085 S1089 N1090	E1085-T1087 PolarHBondContact O-N 3.13Å; T1087-S1089 VanDerWaalsContact CG2-OG 3.26Å; T1087-S1089 WeakPolarHBondContact CG2-OG 3.5Å; T1087-S1089 PolarHBondContact O-N 2.78Å; T1087-S1089 VanDerWaalsContact O-N 3.16Å; T1087-N1090 WeakPolarHBondContact O-CB 3.33Å; T1087-N1090 PolarHBondContact O-N 2.94Å; T1087-N1090 VanDerWaalsContact O-N 3.08Å
1088	C	89.8	Confident	83.5	Confident	13 Å²	13	76.9 Å²	76.9	9%	0.088	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-57	-32.3	-174.7	-57.9	0	0	0	0	113.5	V1086 N1090 Y1091 C1103 C1121 A1122	V1086-C1088 PolarHBondContact O-N 2.94Å; C1088-N1090 PolarHBondContact O-N 2.87Å; C1088-N1090 VanDerWaalsContact O-N 3.09Å; C1088-Y1091 WeakPolarHBondContact O-CD2 3.41Å; C1088-Y1091 PolarHBondContact O-N 3.31Å; C1088-C1103 WeakPolarHBondContact CA-SG 3.31Å; C1088-C1103 HydrophobicContact CB-CB 3.8Å; C1088-C1103 WeakPolarHBondContact CB-SG 3.42Å; C1088-C1103 VanDerWaalsContact SG-CA 3.52Å; C1088-C1103 WeakPolarHBondContact SG-CB 3.35Å; C1088-C1103 CovalentContact SG-SG 2.04Å; C1088-C1103 PolarHBondContact SG-SG 3.44Å; C1088-C1121 CarbonylContact C-O 3.51Å; C1088-C1121 VanDerWaalsContact O-CB 3.27Å; C1088-C1121 WeakPolarHBondContact O-CB 3.48Å; C1088-C1121 PolarHBondContact O-SG 2.84Å; C1088-A1122 PolarHBondContact SG-O 3.4Å
1089	S	88.4	Confident	84.7	Confident	87 Å²	87	72.6 Å²	72.6	61%	0.608	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-64.1	-14.8	179.1	54.4	0	0	0	0	114.6	T1087 Y1091	T1087-S1089 VanDerWaalsContact CG2-OG 3.26Å; T1087-S1089 WeakPolarHBondContact CG2-OG 3.5Å; T1087-S1089 PolarHBondContact O-N 2.78Å; T1087-S1089 VanDerWaalsContact O-N 3.16Å; S1089-Y1091 PolarHBondContact O-N 2.62Å
1090	N	90.6	Very high	85.7	Confident	116 Å²	116	64.2 Å²	64.2	62%	0.62	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-69.3	-22.7	173.8	-70	-16	0	0	0	112.5	T1087 C1088 K1092	T1087-N1090 WeakPolarHBondContact O-CB 3.33Å; T1087-N1090 PolarHBondContact O-N 2.94Å; T1087-N1090 VanDerWaalsContact O-N 3.08Å; C1088-N1090 PolarHBondContact O-N 2.87Å; C1088-N1090 VanDerWaalsContact O-N 3.09Å; N1090-K1092 PolarHBondContact O-N 2.95Å
1091	Y	90.3	Very high	86.1	Confident	63 Å²	63	63.9 Å²	63.9	25%	0.247	33%	0.33	C	S	.	.			trans	-91.3	90.5	-178.5	-58.3	-83.1	0	0	0	110.3	V1086 C1088 S1089 S1093 S1096 I1100 C1121	V1086-Y1091 HydrophobicContact CG1-CE2 4.19Å; C1088-Y1091 WeakPolarHBondContact O-CD2 3.41Å; C1088-Y1091 PolarHBondContact O-N 3.31Å; S1089-Y1091 PolarHBondContact O-N 2.62Å; Y1091-S1093 PolarHBondContact O-N 2.68Å; Y1091-S1096 WeakPolarHBondContact CD1-O 3.5Å; Y1091-I1100 HydrophobicContact CD1-CD1 4.41Å; Y1091-I1100 HydrophobicContact CD1-CG1 4.1Å; Y1091-I1100 HydrophobicContact CD2-CG1 4.41Å; Y1091-I1100 HydrophobicContact CD2-CG2 4.47Å; Y1091-I1100 HydrophobicContact CE1-CD1 3.69Å; Y1091-I1100 HydrophobicContact CE1-CG1 3.8Å; Y1091-I1100 HydrophobicContact CE2-CG1 4.15Å; Y1091-I1100 HydrophobicContact CE2-CG2 3.83Å; Y1091-I1100 HydrophobicContact CG-CG1 4.39Å; Y1091-C1121 WeakPolarHBondContact O-CB 3.41Å
1092	K	89.5	Confident	86	Confident	186 Å²	186	56 Å²	56	81%	0.809	31%	0.305	S	S	*	.			trans	-79.5	-13.2	-172.1	-62.4	-173.7	178.7	-177	0	115.1	N1090	N1090-K1092 PolarHBondContact O-N 2.95Å
1093	S	88.6	Confident	86.2	Confident	55 Å²	55	52.4 Å²	52.4	39%	0.385	29%	0.289	S	S	.	.	S	Bend	trans	-118.1	146.3	177	72.4	0	0	0	0	110.3	Y1091 I1095 S1096 C1097	Y1091-S1093 PolarHBondContact O-N 2.68Å; S1093-I1095 VanDerWaalsContact C-N 3.33Å; S1093-I1095 PolarHBondContact O-N 3.1Å; S1093-S1096 PolarHBondContact N-OG 2.92Å; S1093-S1096 WeakPolarHBondContact O-CB 3.45Å; S1093-S1096 PolarHBondContact O-N 3.33Å; S1093-S1096 PolarHBondContact O-OG 3.23Å; S1093-S1096 VanDerWaalsContact OG-CB 3.28Å; S1093-S1096 WeakPolarHBondContact OG-CB 3.35Å; S1093-S1096 PolarHBondContact OG-N 3.19Å; S1093-S1096 PolarHBondContact OG-OG 2.97Å; S1093-S1096 VanDerWaalsContact OG-OG 3.07Å; S1093-C1097 PolarHBondContact O-N 2.79Å
1094	Q	85.7	Confident	86.3	Confident	42 Å²	42	51.9 Å²	51.9	20%	0.196	28%	0.283	C	S	.	.	H	α-helix	trans	-52.4	-49.5	178.4	-178.5	176.8	-2.3	0	0	112.9	S1096 C1097 L1098 W1105	Q1094-S1096 PolarHBondContact O-N 3.36Å; Q1094-C1097 WeakPolarHBondContact O-CB 3.44Å; Q1094-C1097 PolarHBondContact O-N 3.47Å; Q1094-L1098 HydrophobicContact CG-CD1 4.47Å; Q1094-L1098 HydrophobicContact CG-CG 4.48Å; Q1094-L1098 WeakPolarHBondContact O-CG 3.42Å; Q1094-L1098 PolarHBondContact O-N 3.21Å; Q1094-W1105 HydrophobicContact CB-CD2 3.78Å; Q1094-W1105 HydrophobicContact CB-CE3 4.32Å; Q1094-W1105 HydrophobicContact CB-CG 4Å; Q1094-W1105 HydrophobicContact CB-CZ2 4.16Å; Q1094-W1105 HydrophobicContact CG-CB 4.24Å; Q1094-W1105 HydrophobicContact CG-CD2 4.07Å; Q1094-W1105 HydrophobicContact CG-CG 3.72Å
1095	I	84.8	Confident	86.8	Confident	69 Å²	69	49 Å²	49	35%	0.354	26%	0.263	S	S	.	.	H	α-helix	trans	-63	-29.2	-179.8	-166.7	58.6	0	0	0	112.9	K881 Y884 S1093 L1098	K881-I1095 WeakPolarHBondContact CE-O 3.43Å; K881-I1095 HydrophobicContact CG-CD1 4.2Å; K881-I1095 PolarHBondContact NZ-O 3.19Å; Y884-I1095 HydrophobicContact CD1-CD1 3.45Å; Y884-I1095 VanDerWaalsContact CD1-CD1 3.45Å; Y884-I1095 HydrophobicContact CD1-CG1 4.17Å; Y884-I1095 HydrophobicContact CE1-CD1 3.9Å; Y884-I1095 HydrophobicContact CE1-CG1 4.22Å; Y884-I1095 HydrophobicContact CG-CD1 4.06Å; S1093-I1095 VanDerWaalsContact C-N 3.33Å; S1093-I1095 PolarHBondContact O-N 3.1Å; I1095-L1098 HydrophobicContact CD1-CD1 4.06Å
1096	S	88.3	Confident	87.6	Confident	35 Å²	35	41.8 Å²	41.8	25%	0.245	23%	0.229	C	C	.	.	H	α-helix	trans	-73.1	-37.3	174.3	73	0	0	0	0	111.9	K881 Y1091 S1093 Q1094 I1100	K881-S1096 PolarHBondContact NZ-O 3.32Å; Y1091-S1096 WeakPolarHBondContact CD1-O 3.5Å; S1093-S1096 PolarHBondContact N-OG 2.92Å; S1093-S1096 WeakPolarHBondContact O-CB 3.45Å; S1093-S1096 PolarHBondContact O-N 3.33Å; S1093-S1096 PolarHBondContact O-OG 3.23Å; S1093-S1096 VanDerWaalsContact OG-CB 3.28Å; S1093-S1096 WeakPolarHBondContact OG-CB 3.35Å; S1093-S1096 PolarHBondContact OG-N 3.19Å; S1093-S1096 PolarHBondContact OG-OG 2.97Å; S1093-S1096 VanDerWaalsContact OG-OG 3.07Å; Q1094-S1096 PolarHBondContact O-N 3.36Å; S1096-I1100 WeakPolarHBondContact O-CG1 3.22Å
1097	C	90.2	Very high	88	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.007	23%	0.225	C	C	.	.	H	α-helix	trans	-72.3	-34.6	179.1	-175.8	0	0	0	0	112.8	S1093 Q1094 G1099 I1100 E1104 W1105 C1121	S1093-C1097 PolarHBondContact O-N 2.79Å; Q1094-C1097 WeakPolarHBondContact O-CB 3.44Å; Q1094-C1097 PolarHBondContact O-N 3.47Å; C1097-G1099 PolarHBondContact O-N 2.88Å; C1097-I1100 WeakPolarHBondContact O-CB 3.2Å; C1097-I1100 WeakPolarHBondContact O-CG1 3.3Å; C1097-I1100 PolarHBondContact O-N 3.12Å; C1097-E1104 VanDerWaalsContact SG-C 3.59Å; C1097-W1105 HydrophobicContact CB-CE3 3.82Å; C1097-C1121 HydrophobicContact CB-CB 3.66Å; C1097-C1121 WeakPolarHBondContact CB-SG 3.47Å; C1097-C1121 WeakPolarHBondContact SG-CB 3.45Å; C1097-C1121 CovalentContact SG-SG 2.04Å; C1097-C1121 PolarHBondContact SG-SG 2.85Å
1098	L	86.6	Confident	87.9	Confident	8 Å²	8	38.2 Å²	38.2	4%	0.042	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	134.2	179.7	-72.9	171.8	0	0	0	111.5	T877 Y880 K881 Q1094 I1095 I1100	T877-L1098 HydrophobicContact CG2-CD2 4.05Å; Y880-L1098 HydrophobicContact CD1-CD1 4.22Å; Y880-L1098 HydrophobicContact CE1-CD1 4.46Å; K881-L1098 HydrophobicContact CB-CB 4.06Å; K881-L1098 HydrophobicContact CD-CB 4.09Å; K881-L1098 WeakPolarHBondContact CD-O 3.4Å; K881-L1098 PolarHBondContact NZ-O 3.22Å; Q1094-L1098 HydrophobicContact CG-CD1 4.47Å; Q1094-L1098 HydrophobicContact CG-CG 4.48Å; Q1094-L1098 WeakPolarHBondContact O-CG 3.42Å; Q1094-L1098 PolarHBondContact O-N 3.21Å; I1095-L1098 HydrophobicContact CD1-CD1 4.06Å; L1098-I1100 VanDerWaalsContact C-N 3.26Å; L1098-I1100 PolarHBondContact O-N 3.17Å
1099	G	84	Confident	87.6	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	4.4	177.5	0	0	0	0	0	116.1	T877 C1097	T877-G1099 PolarHBondContact OG1-N 2.99Å; C1097-G1099 PolarHBondContact O-N 2.88Å
1100	I	88.4	Confident	87.3	Confident	5 Å²	5	38.6 Å²	38.6	3%	0.026	20%	0.201	C	C	.	.			trans	-79	129.2	172.6	-59.2	-59	0	0	0	109.4	V1086 Y1091 S1096 C1097 L1098 G1102 C1103	V1086-I1100 HydrophobicContact CG1-CG2 3.55Å; Y1091-I1100 HydrophobicContact CD1-CD1 4.41Å; Y1091-I1100 HydrophobicContact CD1-CG1 4.1Å; Y1091-I1100 HydrophobicContact CD2-CG1 4.41Å; Y1091-I1100 HydrophobicContact CD2-CG2 4.47Å; Y1091-I1100 HydrophobicContact CE1-CD1 3.69Å; Y1091-I1100 HydrophobicContact CE1-CG1 3.8Å; Y1091-I1100 HydrophobicContact CE2-CG1 4.15Å; Y1091-I1100 HydrophobicContact CE2-CG2 3.83Å; Y1091-I1100 HydrophobicContact CG-CG1 4.39Å; S1096-I1100 WeakPolarHBondContact O-CG1 3.22Å; C1097-I1100 WeakPolarHBondContact O-CB 3.2Å; C1097-I1100 WeakPolarHBondContact O-CG1 3.3Å; C1097-I1100 PolarHBondContact O-N 3.12Å; L1098-I1100 VanDerWaalsContact C-N 3.26Å; L1098-I1100 PolarHBondContact O-N 3.17Å; I1100-G1102 PolarHBondContact O-N 2.83Å; I1100-C1103 HydrophobicContact CB-CB 4.2Å; I1100-C1103 HydrophobicContact CG2-CB 4.15Å; I1100-C1103 PolarHBondContact O-N 3.48Å
1101	V	86.1	Confident	86.7	Confident	20 Å²	20	37.1 Å²	37.1	12%	0.121	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	123.8	-178.2	169.4	0	0	0	0	111.3	S785 L788 F841 P875 C1103	S785-V1101 VanDerWaalsContact O-CG2 3.32Å; S785-V1101 WeakPolarHBondContact O-CG2 3.48Å; S785-V1101 PolarHBondContact O-N 3.28Å; L788-V1101 HydrophobicContact CB-CG2 4.44Å; L788-V1101 HydrophobicContact CD1-CG1 3.53Å; L788-V1101 HydrophobicContact CD1-CG2 4.4Å; F841-V1101 HydrophobicContact CD1-CG1 3.71Å; F841-V1101 HydrophobicContact CE1-CG1 3.57Å; F841-V1101 HydrophobicContact CZ-CG1 4.42Å; P875-V1101 HydrophobicContact CG-CG2 4.21Å; V1101-C1103 VanDerWaalsContact C-N 3.31Å; V1101-C1103 PolarHBondContact O-N 3.06Å
1102	G	84.8	Confident	85.9	Confident	14 Å²	14	38 Å²	38	14%	0.144	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	4.7	175.7	0	0	0	0	0	115.6	I1100 S1123 V1124	I1100-G1102 PolarHBondContact O-N 2.83Å; G1102-S1123 WeakPolarHBondContact O-CA 3.37Å; G1102-S1123 PolarHBondContact O-OG 2.76Å; G1102-V1124 PolarHBondContact O-N 3.47Å
1103	C	89.1	Confident	85.2	Confident	6 Å²	6	34.6 Å²	34.6	4%	0.041	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	148.1	178.4	-58.3	0	0	0	0	112	C1088 I1100 V1101 A1122	C1088-C1103 WeakPolarHBondContact CA-SG 3.31Å; C1088-C1103 HydrophobicContact CB-CB 3.8Å; C1088-C1103 WeakPolarHBondContact CB-SG 3.42Å; C1088-C1103 VanDerWaalsContact SG-CA 3.52Å; C1088-C1103 WeakPolarHBondContact SG-CB 3.35Å; C1088-C1103 CovalentContact SG-SG 2.04Å; C1088-C1103 PolarHBondContact SG-SG 3.44Å; I1100-C1103 HydrophobicContact CB-CB 4.2Å; I1100-C1103 HydrophobicContact CG2-CB 4.15Å; I1100-C1103 PolarHBondContact O-N 3.48Å; V1101-C1103 VanDerWaalsContact C-N 3.31Å; V1101-C1103 PolarHBondContact O-N 3.06Å; C1103-A1122 CarbonylContact C-O 3.58Å; C1103-A1122 VanDerWaalsContact CA-O 3.23Å; C1103-A1122 WeakPolarHBondContact CA-O 3.15Å
1104	E	87.7	Confident	84.9	Confident	20 Å²	20	35.2 Å²	35.2	9%	0.093	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	144.2	177.1	-165.3	76.5	-176.2	0	0	109.1	N911 C1097 A1122 C1127 S1129	N911-E1104 PolarHBondContact ND2-OE1 2.87Å; C1097-E1104 VanDerWaalsContact SG-C 3.59Å; E1104-A1122 PolarHBondContact N-O 2.82Å; E1104-A1122 PolarHBondContact O-N 3.3Å; E1104-C1127 WeakPolarHBondContact CB-O 3.3Å; E1104-S1129 VanDerWaalsContact OE1-CA 3.28Å; E1104-S1129 WeakPolarHBondContact OE1-CA 3.29Å; E1104-S1129 PolarHBondContact OE1-N 2.72Å
1105	W	89.5	Confident	84.9	Confident	23 Å²	23	37.8 Å²	37.8	9%	0.087	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	129.1	173.2	-174.6	-102.6	0	0	0	110.1	Q1094 C1097 A1119 C1121 G1130	Q1094-W1105 HydrophobicContact CB-CD2 3.78Å; Q1094-W1105 HydrophobicContact CB-CE3 4.32Å; Q1094-W1105 HydrophobicContact CB-CG 4Å; Q1094-W1105 HydrophobicContact CB-CZ2 4.16Å; Q1094-W1105 HydrophobicContact CG-CB 4.24Å; Q1094-W1105 HydrophobicContact CG-CD2 4.07Å; Q1094-W1105 HydrophobicContact CG-CG 3.72Å; C1097-W1105 HydrophobicContact CB-CE3 3.82Å; W1105-A1119 WeakPolarHBondContact CH2-O 3.37Å; W1105-A1119 HydrophobicContact CZ2-CB 3.62Å; W1105-C1121 HydrophobicContact CE3-CB 3.83Å; W1105-C1121 HydrophobicContact CZ3-CB 4.03Å; W1105-G1130 VanDerWaalsContact O-CA 3.3Å; W1105-G1130 WeakPolarHBondContact O-CA 3.11Å
1106	C	89.4	Confident	84.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.7	-174.2	-52.1	0	0	0	0	110.3	L1116 A1119 Y1120 A1122 C1127	C1106-L1116 HydrophobicContact CB-CD1 4.12Å; C1106-A1119 WeakPolarHBondContact O-CA 3.4Å; C1106-A1119 VanDerWaalsContact O-CB 3.3Å; C1106-A1119 WeakPolarHBondContact O-CB 3.43Å; C1106-Y1120 HydrophobicContact CB-CE1 4.46Å; C1106-Y1120 WeakPolarHBondContact CB-O 3.36Å; C1106-Y1120 PolarHBondContact N-O 3.3Å; C1106-Y1120 PolarHBondContact O-N 3.39Å; C1106-Y1120 VanDerWaalsContact O-N 3.1Å; C1106-A1122 WeakPolarHBondContact SG-CB 3.22Å; C1106-C1127 WeakPolarHBondContact CA-SG 3.23Å; C1106-C1127 HydrophobicContact CB-CB 4.06Å; C1106-C1127 WeakPolarHBondContact CB-SG 3.35Å; C1106-C1127 WeakPolarHBondContact SG-CB 3.44Å; C1106-C1127 CovalentContact SG-SG 2.01Å; C1106-C1127 PolarHBondContact SG-SG 3.37Å
1107	H	88.6	Confident	84.7	Confident	39 Å²	39	43.3 Å²	43.3	18%	0.181	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	-2.6	-179.3	62.7	-76.5	0	0	0	113.3	M912 P1115 L1116 A1119 G1130	M912-H1107 PolarHBondContact O-NE2 2.88Å; M912-H1107 VanDerWaalsContact O-NE2 3.1Å; H1107-P1115 CarbonylContact O-C 3.54Å; H1107-P1115 VanDerWaalsContact O-CA 3.29Å; H1107-P1115 WeakPolarHBondContact O-CA 3.37Å; H1107-L1116 PolarHBondContact O-N 3.44Å; H1107-A1119 HydrophobicContact CB-CB 4.03Å; H1107-G1130 PolarHBondContact N-O 2.97Å; H1107-G1130 VanDerWaalsContact N-O 3.11Å
1108	V	84.9	Confident	84.6	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.006	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	136.5	-178.5	-167.2	0	0	0	0	109.8	L914 G1130 V1131 L1132	L914-V1108 HydrophobicContact CD1-CB 4.14Å; L914-V1108 HydrophobicContact CD1-CG1 3.73Å; L914-V1108 HydrophobicContact CD1-CG2 3.29Å; L914-V1108 HydrophobicContact CD2-CG1 4.16Å; L914-V1108 HydrophobicContact CG-CG1 4.33Å; L914-V1108 HydrophobicContact CG-CG2 3.91Å; V1108-G1130 WeakPolarHBondContact CB-O 3.22Å; V1108-G1130 PolarHBondContact N-O 3.05Å; V1108-V1131 HydrophobicContact CB-CG2 4.2Å; V1108-V1131 HydrophobicContact CG1-CG2 4.47Å; V1108-L1132 WeakPolarHBondContact O-CB 3.39Å; V1108-L1132 PolarHBondContact O-N 3.28Å
1109	D	84.5	Confident	84.8	Confident	39 Å²	39	51.3 Å²	51.3	21%	0.209	28%	0.282	C	S	.	.			trans	-74.9	176.1	177.8	-146.2	-19.3	0	0	0	111.9	D1111 R1112 T1114 L1116 K1165	D1109-D1111 PolarHBondContact O-N 3.15Å; D1109-R1112 PolarHBondContact O-N 3.05Å; D1109-T1114 PolarHBondContact N-O 2.72Å; D1109-L1116 HydrophobicContact CB-CD2 4.05Å; D1109-K1165 IonicContact OD1-NZ 3.08Å; D1109-K1165 PolarHBondContact OD1-NZ 2.78Å; D1109-K1165 IonicContact OD2-NZ 3.17Å; D1109-K1165 PolarHBondContact OD2-NZ 2.79Å; D1109-K1165 VanDerWaalsContact OD2-NZ 3.08Å
1110	V	81.2	Confident	85.2	Confident	69 Å²	69	55.9 Å²	55.9	42%	0.418	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.6	-174.4	-174.7	0	0	0	0	112.9	R1112 L1132	V1110-R1112 WeakPolarHBondContact O-CG 3.41Å; V1110-R1112 PolarHBondContact O-N 2.8Å; V1110-L1132 WeakPolarHBondContact CA-O 3.46Å; V1110-L1132 HydrophobicContact CG2-CB 4.19Å; V1110-L1132 HydrophobicContact CG2-CD2 4.06Å; V1110-L1132 HydrophobicContact CG2-CG 4.07Å
1111	D	77.5	Confident	85.4	Confident	84 Å²	84	55.8 Å²	55.8	45%	0.449	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-7.5	175.8	70	-6.1	0	0	0	113.5	D1109 V1113 T1114	D1109-D1111 PolarHBondContact O-N 3.15Å; D1111-V1113 PolarHBondContact O-N 3.34Å; D1111-V1113 PolarHBondContact OD1-N 3.43Å; D1111-T1114 PolarHBondContact OD1-N 3.43Å; D1111-T1114 WeakPolarHBondContact OD2-CB 3.31Å; D1111-T1114 PolarHBondContact OD2-N 3.41Å; D1111-T1114 PolarHBondContact OD2-OG1 2.78Å
1112	R	73.9	Confident	85.6	Confident	83 Å²	83	55.2 Å²	55.2	31%	0.313	30%	0.297	S	S	.	.	S	Bend	trans	60.5	20.4	179.8	-40.3	-172	176.4	-177	0.2	113.8	L914 D917 D1109 V1110 V1131	L914-R1112 HydrophobicContact CD2-CB 4.41Å; L914-R1112 WeakPolarHBondContact CD2-O 3.48Å; D917-R1112 IonicContact OD1-CZ 2.75Å; D917-R1112 IonicContact OD1-NH1 3.72Å; D917-R1112 PolarHBondContact OD1-NH1 2.97Å; D917-R1112 IonicContact OD1-NH2 3.27Å; D917-R1112 PolarHBondContact OD1-NH2 2.99Å; D917-R1112 IonicContact OD2-CZ 3.43Å; D917-R1112 IonicContact OD2-NH1 3.72Å; D917-R1112 PolarHBondContact OD2-NH1 2.68Å; D1109-R1112 PolarHBondContact O-N 3.05Å; V1110-R1112 WeakPolarHBondContact O-CG 3.41Å; V1110-R1112 PolarHBondContact O-N 2.8Å; R1112-V1131 HydrophobicContact CB-CG1 4.39Å; R1112-V1131 HydrophobicContact CG-CG1 3.87Å
1113	V	75.1	Confident	85.7	Confident	113 Å²	113	56.6 Å²	56.6	69%	0.685	31%	0.305	S	S	*	.	S	Bend	trans	-134	-44.4	-178.9	179.8	0	0	0	0	110	D1111	D1111-V1113 PolarHBondContact O-N 3.34Å; D1111-V1113 PolarHBondContact OD1-N 3.43Å
1114	T	82.2	Confident	85.3	Confident	68 Å²	68	56.6 Å²	56.6	42%	0.417	30%	0.304	S	S	.	.	S	Bend	trans	-79.9	124.6	-173.4	-59.5	0	0	0	0	110.6	D1109 D1111	D1109-T1114 PolarHBondContact N-O 2.72Å; D1111-T1114 PolarHBondContact OD1-N 3.43Å; D1111-T1114 WeakPolarHBondContact OD2-CB 3.31Å; D1111-T1114 PolarHBondContact OD2-N 3.41Å; D1111-T1114 PolarHBondContact OD2-OG1 2.78Å
1115	P	85.3	Confident	85	Confident	96 Å²	96	59.1 Å²	59.1	62%	0.623	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	140.5	172.8	27.4	-32.8	0	0	0	110.8	H1107	H1107-P1115 CarbonylContact O-C 3.54Å; H1107-P1115 VanDerWaalsContact O-CA 3.29Å; H1107-P1115 WeakPolarHBondContact O-CA 3.37Å
1116	L	85	Confident	84.7	Confident	27 Å²	27	59.7 Å²	59.7	14%	0.141	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	138.7	173.8	-70.5	166.4	0	0	0	110.1	C1106 H1107 D1109 D1118 Y1120	C1106-L1116 HydrophobicContact CB-CD1 4.12Å; H1107-L1116 PolarHBondContact O-N 3.44Å; D1109-L1116 HydrophobicContact CB-CD2 4.05Å; L1116-D1118 VanDerWaalsContact C-N 3.35Å; L1116-D1118 PolarHBondContact O-N 3.13Å; L1116-Y1120 HydrophobicContact CD1-CE1 4.2Å
1117	Q	84.1	Confident	84.5	Confident	193 Å²	193	59.7 Å²	59.7	90%	0.902	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.4	-45.7	176.5	-71.5	-175.2	-3.6	0	0	111.7
1118	D	88.4	Confident	84.2	Confident	138 Å²	138	58 Å²	58	74%	0.738	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.5	101	174.8	-68.2	-44.4	0	0	0	108.8	L1116 Y1120	L1116-D1118 VanDerWaalsContact C-N 3.35Å; L1116-D1118 PolarHBondContact O-N 3.13Å; D1118-Y1120 WeakPolarHBondContact O-CD1 3.18Å
1119	A	90.2	Very high	83.9	Confident	40 Å²	40	58.9 Å²	58.9	33%	0.331	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	142	172.9	0	0	0	0	0	110.8	W1105 C1106 H1107	W1105-A1119 WeakPolarHBondContact CH2-O 3.37Å; W1105-A1119 HydrophobicContact CZ2-CB 3.62Å; C1106-A1119 WeakPolarHBondContact O-CA 3.4Å; C1106-A1119 VanDerWaalsContact O-CB 3.3Å; C1106-A1119 WeakPolarHBondContact O-CB 3.43Å; H1107-A1119 HydrophobicContact CB-CB 4.03Å
1120	Y	93.4	Very high	83.9	Confident	95 Å²	95	57 Å²	57	37%	0.373	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	162.5	-174.6	66.9	-82	0	0	0	112.3	C1106 L1116 D1118 A1122 L1132	C1106-Y1120 HydrophobicContact CB-CE1 4.46Å; C1106-Y1120 WeakPolarHBondContact CB-O 3.36Å; C1106-Y1120 PolarHBondContact N-O 3.3Å; C1106-Y1120 PolarHBondContact O-N 3.39Å; C1106-Y1120 VanDerWaalsContact O-N 3.1Å; L1116-Y1120 HydrophobicContact CD1-CE1 4.2Å; D1118-Y1120 WeakPolarHBondContact O-CD1 3.18Å; Y1120-A1122 HydrophobicContact CD2-CB 4.06Å; Y1120-A1122 HydrophobicContact CE2-CB 3.59Å; Y1120-L1132 WeakPolarHBondContact OH-CD1 3.49Å
1121	C	92.5	Very high	83.9	Confident	4 Å²	4	54.2 Å²	54.2	3%	0.027	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	121	175.1	-169.4	0	0	0	0	109.8	C1088 Y1091 C1097 W1105	C1088-C1121 CarbonylContact C-O 3.51Å; C1088-C1121 VanDerWaalsContact O-CB 3.27Å; C1088-C1121 WeakPolarHBondContact O-CB 3.48Å; C1088-C1121 PolarHBondContact O-SG 2.84Å; Y1091-C1121 WeakPolarHBondContact O-CB 3.41Å; C1097-C1121 HydrophobicContact CB-CB 3.66Å; C1097-C1121 WeakPolarHBondContact CB-SG 3.47Å; C1097-C1121 WeakPolarHBondContact SG-CB 3.45Å; C1097-C1121 CovalentContact SG-SG 2.04Å; C1097-C1121 PolarHBondContact SG-SG 2.85Å; W1105-C1121 HydrophobicContact CE3-CB 3.83Å; W1105-C1121 HydrophobicContact CZ3-CB 4.03Å
1122	A	90.2	Very high	84.2	Confident	8 Å²	8	51.2 Å²	51.2	7%	0.066	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	172.6	-178.6	0	0	0	0	0	111.1	C1088 C1103 E1104 C1106 Y1120 V1126 C1127	C1088-A1122 PolarHBondContact SG-O 3.4Å; C1103-A1122 CarbonylContact C-O 3.58Å; C1103-A1122 VanDerWaalsContact CA-O 3.23Å; C1103-A1122 WeakPolarHBondContact CA-O 3.15Å; E1104-A1122 PolarHBondContact N-O 2.82Å; E1104-A1122 PolarHBondContact O-N 3.3Å; C1106-A1122 WeakPolarHBondContact SG-CB 3.22Å; Y1120-A1122 HydrophobicContact CD2-CB 4.06Å; Y1120-A1122 HydrophobicContact CE2-CB 3.59Å; A1122-V1126 HydrophobicContact CB-CB 4.39Å; A1122-V1126 HydrophobicContact CB-CG1 4.41Å; A1122-C1127 HydrophobicContact CB-CB 4.15Å
1123	S	86.3	Confident	84.4	Confident	43 Å²	43	49.3 Å²	49.3	30%	0.301	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	146.5	168.9	-178.7	0	0	0	0	110.7	G1102 L1125 V1126 C1127	G1102-S1123 WeakPolarHBondContact O-CA 3.37Å; G1102-S1123 PolarHBondContact O-OG 2.76Å; S1123-L1125 PolarHBondContact O-N 2.82Å; S1123-L1125 PolarHBondContact OG-N 2.89Å; S1123-V1126 PolarHBondContact O-N 2.97Å; S1123-C1127 PolarHBondContact O-N 2.91Å; S1123-C1127 VanDerWaalsContact O-N 3.13Å
1124	V	82.3	Confident	84.3	Confident	5 Å²	5	45.5 Å²	45.5	3%	0.03	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-22.7	174	74.9	0	0	0	0	113.9	G840 G1102 C1127 F1128	G840-V1124 WeakPolarHBondContact O-CG1 3.38Å; G1102-V1124 PolarHBondContact O-N 3.47Å; V1124-C1127 CarbonylContact C-O 3.52Å; V1124-C1127 VanDerWaalsContact CA-O 3.27Å; V1124-C1127 WeakPolarHBondContact CA-O 3.37Å; V1124-F1128 HydrophobicContact CG2-CD2 3.54Å; V1124-F1128 HydrophobicContact CG2-CE2 3.88Å
1125	L	79.6	Confident	83.9	Confident	73 Å²	73	43.6 Å²	43.6	38%	0.382	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-22	176.8	-63.7	173.5	0	0	0	113.4	S1123	S1123-L1125 PolarHBondContact O-N 2.82Å; S1123-L1125 PolarHBondContact OG-N 2.89Å
1126	V	84	Confident	83.1	Confident	36 Å²	36	39.9 Å²	39.9	22%	0.218	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-30.7	178.9	176.1	0	0	0	0	110.4	A1122 S1123 L1132 G1133	A1122-V1126 HydrophobicContact CB-CB 4.39Å; A1122-V1126 HydrophobicContact CB-CG1 4.41Å; S1123-V1126 PolarHBondContact O-N 2.97Å; V1126-L1132 HydrophobicContact CG1-CD1 3.91Å; V1126-G1133 PolarHBondContact O-N 2.82Å
1127	C	85.5	Confident	82.5	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	137.3	-171.2	164	0	0	0	0	109.6	E1104 C1106 A1122 S1123 V1124 V1131 L1132	E1104-C1127 WeakPolarHBondContact CB-O 3.3Å; C1106-C1127 WeakPolarHBondContact CA-SG 3.23Å; C1106-C1127 HydrophobicContact CB-CB 4.06Å; C1106-C1127 WeakPolarHBondContact CB-SG 3.35Å; C1106-C1127 WeakPolarHBondContact SG-CB 3.44Å; C1106-C1127 CovalentContact SG-SG 2.01Å; C1106-C1127 PolarHBondContact SG-SG 3.37Å; A1122-C1127 HydrophobicContact CB-CB 4.15Å; S1123-C1127 PolarHBondContact O-N 2.91Å; S1123-C1127 VanDerWaalsContact O-N 3.13Å; V1124-C1127 CarbonylContact C-O 3.52Å; V1124-C1127 VanDerWaalsContact CA-O 3.27Å; V1124-C1127 WeakPolarHBondContact CA-O 3.37Å; C1127-V1131 WeakPolarHBondContact CA-O 3.35Å; C1127-L1132 HydrophobicContact CB-CD1 4.41Å
1128	F	82.6	Confident	81.2	Confident	3 Å²	3	33.9 Å²	33.9	1%	0.013	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	135.9	-174.6	-170.2	-114.5	0	0	0	110.6	H843 I919 V1124 G1130 V1131 L1134 P1136	H843-F1128 AromaticContact CE1-CE1 3.53Å; H843-F1128 AromaticContact CE1-CZ 3.2Å; H843-F1128 WeakPolarHBondContact CE1-CZ 3.48Å; H843-F1128 AromaticContact ND1-CE2 4Å; H843-F1128 AromaticContact ND1-CZ 3.27Å; H843-F1128 VanDerWaalsContact ND1-CZ 3.27Å; H843-F1128 WeakPolarHBondContact ND1-CZ 3.31Å; I919-F1128 HydrophobicContact CG2-CD1 4.49Å; I919-F1128 HydrophobicContact CG2-CE1 3.65Å; I919-F1128 HydrophobicContact CG2-CZ 4.46Å; V1124-F1128 HydrophobicContact CG2-CD2 3.54Å; V1124-F1128 HydrophobicContact CG2-CE2 3.88Å; F1128-G1130 PolarHBondContact O-N 2.71Å; F1128-V1131 PolarHBondContact N-O 3.08Å; F1128-V1131 PolarHBondContact O-N 2.85Å; F1128-L1134 HydrophobicContact CB-CB 4.24Å; F1128-L1134 HydrophobicContact CB-CG 4.41Å; F1128-L1134 WeakPolarHBondContact CB-O 3.14Å; F1128-L1134 HydrophobicContact CD1-CD2 4.38Å; F1128-P1136 HydrophobicContact CD1-CB 4.19Å; F1128-P1136 HydrophobicContact CD1-CG 4.13Å; F1128-P1136 HydrophobicContact CD2-CG 4.09Å; F1128-P1136 HydrophobicContact CE1-CB 3.56Å; F1128-P1136 HydrophobicContact CE1-CG 3.74Å; F1128-P1136 HydrophobicContact CE2-CB 4.4Å; F1128-P1136 HydrophobicContact CE2-CG 3.73Å; F1128-P1136 HydrophobicContact CG-CG 4.26Å; F1128-P1136 HydrophobicContact CZ-CB 3.67Å; F1128-P1136 HydrophobicContact CZ-CG 3.5Å
1129	S	78.8	Confident	78.9	Confident	19 Å²	19	31 Å²	31	13%	0.133	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	36.6	-179	-168.2	0	0	0	0	113.4	I919 E1104 V1131	I919-S1129 WeakPolarHBondContact CD1-OG 3.36Å; E1104-S1129 VanDerWaalsContact OE1-CA 3.28Å; E1104-S1129 WeakPolarHBondContact OE1-CA 3.29Å; E1104-S1129 PolarHBondContact OE1-N 2.72Å; S1129-V1131 VanDerWaalsContact C-N 3.32Å; S1129-V1131 PolarHBondContact O-N 3.31Å
1130	G	82.8	Confident	76.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.4	-12.6	-178.8	0	0	0	0	0	116.1	W1105 H1107 V1108 F1128	W1105-G1130 VanDerWaalsContact O-CA 3.3Å; W1105-G1130 WeakPolarHBondContact O-CA 3.11Å; H1107-G1130 PolarHBondContact N-O 2.97Å; H1107-G1130 VanDerWaalsContact N-O 3.11Å; V1108-G1130 WeakPolarHBondContact CB-O 3.22Å; V1108-G1130 PolarHBondContact N-O 3.05Å; F1128-G1130 PolarHBondContact O-N 2.71Å
1131	V	82.8	Confident	73.5	Confident	10 Å²	10	37.5 Å²	37.5	6%	0.061	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.3	-170.1	-177.9	0	0	0	0	111.1	L914 V1108 R1112 C1127 F1128 S1129 L1134	L914-V1131 HydrophobicContact CD2-CG2 4.43Å; V1108-V1131 HydrophobicContact CB-CG2 4.2Å; V1108-V1131 HydrophobicContact CG1-CG2 4.47Å; R1112-V1131 HydrophobicContact CB-CG1 4.39Å; R1112-V1131 HydrophobicContact CG-CG1 3.87Å; C1127-V1131 WeakPolarHBondContact CA-O 3.35Å; F1128-V1131 PolarHBondContact N-O 3.08Å; F1128-V1131 PolarHBondContact O-N 2.85Å; S1129-V1131 VanDerWaalsContact C-N 3.32Å; S1129-V1131 PolarHBondContact O-N 3.31Å; V1131-L1134 HydrophobicContact CB-CB 3.96Å; V1131-L1134 HydrophobicContact CB-CD2 4.13Å; V1131-L1134 HydrophobicContact CG1-CB 4Å; V1131-L1134 HydrophobicContact CG2-CD2 4.48Å; V1131-L1134 PolarHBondContact O-N 2.98Å
1132	L	83.2	Confident	70.5	Confident	21 Å²	21	45.6 Å²	45.6	11%	0.11	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	135.8	175.7	-170.4	66.1	0	0	0	111.3	V1108 V1110 Y1120 V1126 C1127 L1134	V1108-L1132 WeakPolarHBondContact O-CB 3.39Å; V1108-L1132 PolarHBondContact O-N 3.28Å; V1110-L1132 WeakPolarHBondContact CA-O 3.46Å; V1110-L1132 HydrophobicContact CG2-CB 4.19Å; V1110-L1132 HydrophobicContact CG2-CD2 4.06Å; V1110-L1132 HydrophobicContact CG2-CG 4.07Å; Y1120-L1132 WeakPolarHBondContact OH-CD1 3.49Å; V1126-L1132 HydrophobicContact CG1-CD1 3.91Å; C1127-L1132 HydrophobicContact CB-CD1 4.41Å; L1132-L1134 PolarHBondContact O-N 3.24Å
1133	G	77	Confident	67.4	Low	44 Å²	44	48.4 Å²	48.4	45%	0.454	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	-6.9	178.7	0	0	0	0	0	115.1	V1126	V1126-G1133 PolarHBondContact O-N 2.82Å
1134	L	73.6	Confident	64.6	Low	32 Å²	32	52.7 Å²	52.7	17%	0.168	31%	0.313	C	S	.	.			trans	-76.1	137.8	174.1	-169.2	66	0	0	0	110.2	I919 F1128 V1131 L1132	I919-L1134 HydrophobicContact CD1-CD2 4.32Å; F1128-L1134 HydrophobicContact CB-CB 4.24Å; F1128-L1134 HydrophobicContact CB-CG 4.41Å; F1128-L1134 WeakPolarHBondContact CB-O 3.14Å; F1128-L1134 HydrophobicContact CD1-CD2 4.38Å; V1131-L1134 HydrophobicContact CB-CB 3.96Å; V1131-L1134 HydrophobicContact CB-CD2 4.13Å; V1131-L1134 HydrophobicContact CG1-CB 4Å; V1131-L1134 HydrophobicContact CG2-CD2 4.48Å; V1131-L1134 PolarHBondContact O-N 2.98Å; L1132-L1134 PolarHBondContact O-N 3.24Å
1135	S	74.2	Confident	61.9	Low	29 Å²	29	56.5 Å²	56.5	20%	0.203	34%	0.338	C	S	.	.			trans	-137.1	134.6	174.5	168.1	0	0	0	0	109.9	Y1137	S1135-Y1137 PolarHBondContact O-N 3.28Å; S1135-Y1137 PolarHBondContact OG-N 2.65Å; S1135-Y1137 VanDerWaalsContact OG-N 3.12Å
1136	P	69.4	Low	59.5	Low	18 Å²	18	59.9 Å²	59.9	12%	0.117	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-16.9	173.9	29	-31.8	0	0	0	112.1	I836 F1128	I836-P1136 HydrophobicContact CD1-CB 4.05Å; I836-P1136 HydrophobicContact CG1-CB 4.45Å; I836-P1136 HydrophobicContact CG2-CB 4.19Å; I836-P1136 HydrophobicContact CG2-CG 4.46Å; F1128-P1136 HydrophobicContact CD1-CB 4.19Å; F1128-P1136 HydrophobicContact CD1-CG 4.13Å; F1128-P1136 HydrophobicContact CD2-CG 4.09Å; F1128-P1136 HydrophobicContact CE1-CB 3.56Å; F1128-P1136 HydrophobicContact CE1-CG 3.74Å; F1128-P1136 HydrophobicContact CE2-CB 4.4Å; F1128-P1136 HydrophobicContact CE2-CG 3.73Å; F1128-P1136 HydrophobicContact CG-CG 4.26Å; F1128-P1136 HydrophobicContact CZ-CB 3.67Å; F1128-P1136 HydrophobicContact CZ-CG 3.5Å
1137	Y	70.6	Confident	56.9	Low	70 Å²	70	62.9 Å²	62.9	28%	0.275	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	7.1	-174.8	-51.5	-72.5	0	0	0	114	I836 D837 G840 F841 G842 S1135	I836-Y1137 HydrophobicContact CG2-CD1 4.23Å; I836-Y1137 HydrophobicContact CG2-CE1 3.49Å; I836-Y1137 VanDerWaalsContact CG2-CE1 3.49Å; D837-Y1137 VanDerWaalsContact O-CE1 3.23Å; D837-Y1137 WeakPolarHBondContact O-CE1 3.25Å; D837-Y1137 VanDerWaalsContact O-CZ 3.27Å; D837-Y1137 PolarHBondContact O-OH 2.82Å; G840-Y1137 VanDerWaalsContact CA-CZ 3.47Å; G840-Y1137 WeakPolarHBondContact CA-OH 3.38Å; G840-Y1137 PolarHBondContact N-OH 3.31Å; F841-Y1137 PolarHBondContact N-OH 3.01Å; G842-Y1137 PolarHBondContact N-OH 3.48Å; S1135-Y1137 PolarHBondContact O-N 3.28Å; S1135-Y1137 PolarHBondContact OG-N 2.65Å; S1135-Y1137 VanDerWaalsContact OG-N 3.12Å
1138	G	57.5	Low	54.3	Low	24 Å²	24	66.1 Å²	66.1	25%	0.247	40%	0.401	C	S	.	.			trans	93.9	164.5	-176	0	0	0	0	0	113.8
1139	S	41.1	Very low	51.8	Low	77 Å²	77	71.8 Å²	71.8	54%	0.538	42%	0.423	S	S	.	.			trans	-67.7	134.5	171	-166.9	0	0	0	0	108.5	D1141 Q1142	S1139-D1141 PolarHBondContact O-N 2.79Å; S1139-D1141 PolarHBondContact OG-OD2 2.91Å; S1139-Q1142 PolarHBondContact O-N 3.13Å
1140	I	39.8	Very low	49.4	Very low	127 Å²	127	76.1 Å²	76.1	65%	0.651	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-14.5	-179.7	-64.2	172.4	0	0	0	111.6	Q1142 I1158	I1140-Q1142 PolarHBondContact O-N 2.93Å; I1140-I1158 HydrophobicContact CD1-CG2 4.17Å
1141	D	30	Very low	46.7	Very low	144 Å²	144	80.1 Å²	80.1	77%	0.77	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-21.2	176.7	-55.9	-44	0	0	0	114.3	S1139 G1143	S1139-D1141 PolarHBondContact O-N 2.79Å; S1139-D1141 PolarHBondContact OG-OD2 2.91Å; D1141-G1143 VanDerWaalsContact C-N 3.34Å; D1141-G1143 PolarHBondContact O-N 3.18Å
1142	Q	29.3	Very low	44.3	Very low	175 Å²	175	85.1 Å²	85.1	82%	0.818	51%	0.512	S	S	*	.	S	Bend	trans	-86.7	77.6	177.2	-72.8	-175.8	-7.9	0	0	111.3	S1139 I1140 L1144	S1139-Q1142 PolarHBondContact O-N 3.13Å; I1140-Q1142 PolarHBondContact O-N 2.93Å; Q1142-L1144 PolarHBondContact O-N 3.43Å; Q1142-L1144 VanDerWaalsContact O-N 3.16Å
1143	G	25.7	Very low	41.7	Very low	66 Å²	66	93.9 Å²	93.9	68%	0.68	55%	0.545	S	S	*	.			trans	44.8	59	144.3	0	0	0	0	0	116.8	D1141 P1145	D1141-G1143 VanDerWaalsContact C-N 3.34Å; D1141-G1143 PolarHBondContact O-N 3.18Å; G1143-P1145 WeakPolarHBondContact O-CD 2.93Å
1144	L	26	Very low	39.4	Very low	133 Å²	133	100.3 Å²	100.3	70%	0.696	56%	0.56	S	S	*	*			trans	-70.3	116.9	151.6	-148.1	80.4	0	0	0	105.8	Q1142 T1146 Y1149	Q1142-L1144 PolarHBondContact O-N 3.43Å; Q1142-L1144 VanDerWaalsContact O-N 3.16Å; L1144-T1146 PolarHBondContact O-N 3.35Å; L1144-Y1149 HydrophobicContact CD2-CE2 4.47Å
1145	P	26.8	Very low	37.3	Very low	86 Å²	86	104.4 Å²	104.4	56%	0.558	59%	0.59	S	S	*	*			trans	-59.6	111.9	-178.4	21	-29.1	0	0	0	108.5	G1143 S1147 L1148	G1143-P1145 WeakPolarHBondContact O-CD 2.93Å; P1145-S1147 PolarHBondContact O-N 2.92Å; P1145-L1148 PolarHBondContact O-N 3.49Å
1146	T	29.1	Very low	35.1	Very low	143 Å²	143	109.2 Å²	109.2	88%	0.877	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-60.2	-2.8	178.8	30.8	0	0	0	0	113.2	L1144 L1148	L1144-T1146 PolarHBondContact O-N 3.35Å; T1146-L1148 VanDerWaalsContact C-N 3.32Å; T1146-L1148 PolarHBondContact O-N 3.12Å
1147	S	29.2	Very low	33.3	Very low	100 Å²	100	112.7 Å²	112.7	70%	0.699	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-76.6	-8.5	173.4	60.8	0	0	0	0	114.9	P1145	P1145-S1147 PolarHBondContact O-N 2.92Å
1148	L	31.6	Very low	31.7	Very low	68 Å²	68	112.7 Å²	112.7	36%	0.356	64%	0.635	S	S	.	*	G	3₁₀ helix	trans	-100.2	2.7	-178	-125.9	81.8	0	0	0	116.3	M1067 M1070 P1145 T1146	M1067-L1148 HydrophobicContact CE-CD2 4.27Å; M1070-L1148 HydrophobicContact CE-CD1 3.96Å; M1070-L1148 HydrophobicContact SD-CD1 3.96Å; M1070-L1148 HydrophobicContact SD-CD2 4.37Å; M1070-L1148 HydrophobicContact SD-CG 4.31Å; P1145-L1148 PolarHBondContact O-N 3.49Å; T1146-L1148 VanDerWaalsContact C-N 3.32Å; T1146-L1148 PolarHBondContact O-N 3.12Å
1149	Y	28.8	Very low	30.6	Very low	122 Å²	122	116.8 Å²	116.8	48%	0.478	65%	0.651	S	S	.	*			trans	-135.6	94.4	176	-74.4	-81.2	0	0	0	111.6	F1073 L1144 S1151	F1073-Y1149 HydrophobicContact CE1-CE1 4.48Å; F1073-Y1149 HydrophobicContact CZ-CE1 4.29Å; L1144-Y1149 HydrophobicContact CD2-CE2 4.47Å; Y1149-S1151 VanDerWaalsContact C-N 3.29Å; Y1149-S1151 PolarHBondContact O-N 2.98Å
1150	P	28	Very low	30.2	Very low	109 Å²	109	117.7 Å²	117.7	71%	0.708	65%	0.65	S	S	*	*			trans	-81.7	79.1	171.9	33	-29.7	0	0	0	109.1
1151	S	26.4	Very low	30.2	Very low	84 Å²	84	116.4 Å²	116.4	59%	0.587	64%	0.643	S	S	*	*			trans	-156.4	109.4	153.6	-161	0	0	0	0	109.9	Y1149 Y1153	Y1149-S1151 VanDerWaalsContact C-N 3.29Å; Y1149-S1151 PolarHBondContact O-N 2.98Å; S1151-Y1153 PolarHBondContact O-N 2.98Å; S1151-Y1153 VanDerWaalsContact O-N 3.09Å
1152	P	33.6	Very low	30.5	Very low	116 Å²	116	113.3 Å²	113.3	75%	0.753	63%	0.627	S	S	*	*			trans	-71.9	2.8	-178.2	3	6.4	0	0	0	114.4
1153	Y	27.9	Very low	30.9	Very low	205 Å²	205	108.5 Å²	108.5	80%	0.804	61%	0.606	S	S	*	*	S	Bend	trans	-109.9	55.2	-173.9	-67.3	-79.7	0	0	0	113.3	S1151	S1151-Y1153 PolarHBondContact O-N 2.98Å; S1151-Y1153 VanDerWaalsContact O-N 3.09Å
1154	K	28.6	Very low	31.3	Very low	178 Å²	178	108.1 Å²	108.1	77%	0.774	60%	0.603	S	S	*	*	S	Bend	trans	-167.3	-13.2	154.5	-119.7	171.1	-179.9	179.7	0	117.2	M1156	K1154-M1156 PolarHBondContact O-N 3.4Å
1155	C	30.4	Very low	31.6	Very low	118 Å²	118	107.9 Å²	107.9	80%	0.797	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-11.1	170.4	-81	0	0	0	0	113.8	V1157	C1155-V1157 VanDerWaalsContact C-N 3.33Å; C1155-V1157 PolarHBondContact O-N 2.78Å
1156	M	28.4	Very low	31.9	Very low	131 Å²	131	111.2 Å²	111.2	65%	0.645	60%	0.602	S	S	*	*	H	α-helix	trans	-71.7	-22.9	-179.6	-158	163.3	77.6	0	0	113.7	K1154 D1160	K1154-M1156 PolarHBondContact O-N 3.4Å; M1156-D1160 WeakPolarHBondContact O-CB 3.48Å; M1156-D1160 PolarHBondContact O-N 2.8Å; M1156-D1160 VanDerWaalsContact O-N 3.12Å
1157	V	31.6	Very low	32	Very low	90 Å²	90	107.6 Å²	107.6	55%	0.545	59%	0.586	S	S	.	*	H	α-helix	trans	-78.5	-29.2	-172.3	-174.8	0	0	0	0	113.4	C1155	C1155-V1157 VanDerWaalsContact C-N 3.33Å; C1155-V1157 PolarHBondContact O-N 2.78Å
1158	I	36.4	Very low	32.1	Very low	70 Å²	70	107.5 Å²	107.5	36%	0.359	59%	0.585	S	S	.	*	H	α-helix	trans	-82.6	-34.2	178.5	-61.8	177.4	0	0	0	110.8	I1140 D1160 I1161 L1162	I1140-I1158 HydrophobicContact CD1-CG2 4.17Å; I1158-D1160 VanDerWaalsContact C-N 3.31Å; I1158-D1160 PolarHBondContact O-N 3.4Å; I1158-I1161 PolarHBondContact O-N 3.49Å; I1158-L1162 HydrophobicContact CG2-CD1 4.47Å; I1158-L1162 PolarHBondContact O-N 3.14Å
1159	L	33.4	Very low	32.4	Very low	110 Å²	110	108.4 Å²	108.4	58%	0.576	60%	0.598	S	S	*	*	H	α-helix	trans	-66.6	-34.9	173	-141.8	82.6	0	0	0	111.2	I1161 N1163	L1159-I1161 VanDerWaalsContact C-N 3.34Å; L1159-I1161 PolarHBondContact O-N 2.92Å; L1159-N1163 WeakPolarHBondContact O-CA 2.83Å; L1159-N1163 WeakPolarHBondContact O-CB 3.44Å; L1159-N1163 PolarHBondContact O-N 3.08Å; L1159-N1163 PolarHBondContact O-ND2 2.87Å
1160	D	33.5	Very low	33	Very low	97 Å²	97	107.8 Å²	107.8	52%	0.519	61%	0.607	S	S	.	*	H	α-helix	trans	-66.6	-30.3	177.4	-85.2	-12.6	0	0	0	113.7	M1156 I1158 G1164	M1156-D1160 WeakPolarHBondContact O-CB 3.48Å; M1156-D1160 PolarHBondContact O-N 2.8Å; M1156-D1160 VanDerWaalsContact O-N 3.12Å; I1158-D1160 VanDerWaalsContact C-N 3.31Å; I1158-D1160 PolarHBondContact O-N 3.4Å; D1160-G1164 WeakPolarHBondContact O-CA 3.11Å; D1160-G1164 PolarHBondContact O-N 3.12Å
1161	I	39.3	Very low	33.8	Very low	99 Å²	99	105.7 Å²	105.7	51%	0.508	59%	0.593	S	S	.	*	H	α-helix	trans	-78	-40	178.6	-63.2	172.4	0	0	0	111.3	I1158 L1159 G1164	I1158-I1161 PolarHBondContact O-N 3.49Å; L1159-I1161 VanDerWaalsContact C-N 3.34Å; L1159-I1161 PolarHBondContact O-N 2.92Å; I1161-G1164 PolarHBondContact O-N 3.04Å
1162	L	36.4	Very low	35.4	Very low	80 Å²	80	106.3 Å²	106.3	42%	0.419	59%	0.593	S	S	.	*	H	α-helix	trans	-74.3	-36.3	175.5	-77.1	162.9	0	0	0	111.7	I1158 G1164 F1166	I1158-L1162 HydrophobicContact CG2-CD1 4.47Å; I1158-L1162 PolarHBondContact O-N 3.14Å; L1162-G1164 VanDerWaalsContact C-N 3.29Å; L1162-G1164 PolarHBondContact O-N 2.83Å; L1162-F1166 PolarHBondContact O-N 3.09Å
1163	N	37.4	Very low	36.9	Very low	74 Å²	74	103.5 Å²	103.5	40%	0.396	59%	0.585	S	S	.	*	H	α-helix	trans	-71.2	-23.9	170.6	-71.3	-17.8	0	0	0	111.6	L1159 K1165 F1166 A1167	L1159-N1163 WeakPolarHBondContact O-CA 2.83Å; L1159-N1163 WeakPolarHBondContact O-CB 3.44Å; L1159-N1163 PolarHBondContact O-N 3.08Å; L1159-N1163 PolarHBondContact O-ND2 2.87Å; N1163-K1165 PolarHBondContact O-N 2.9Å; N1163-K1165 VanDerWaalsContact O-N 3.14Å; N1163-F1166 CarbonylContact O-C 3.51Å; N1163-F1166 PolarHBondContact O-N 2.8Å; N1163-A1167 VanDerWaalsContact O-CA 3.32Å; N1163-A1167 WeakPolarHBondContact O-CA 3.31Å; N1163-A1167 WeakPolarHBondContact O-CB 3.35Å; N1163-A1167 PolarHBondContact O-N 3.26Å
1164	G	33.6	Very low	39.3	Very low	58 Å²	58	98.3 Å²	98.3	60%	0.598	58%	0.576	S	S	*	*	H	α-helix	trans	-58.8	-29	177.9	0	0	0	0	0	114.5	D1160 I1161 L1162	D1160-G1164 WeakPolarHBondContact O-CA 3.11Å; D1160-G1164 PolarHBondContact O-N 3.12Å; I1161-G1164 PolarHBondContact O-N 3.04Å; L1162-G1164 VanDerWaalsContact C-N 3.29Å; L1162-G1164 PolarHBondContact O-N 2.83Å
1165	K	33.2	Very low	41.7	Very low	128 Å²	128	93.7 Å²	93.7	56%	0.557	56%	0.563	S	S	*	*	H	α-helix	trans	-99.2	-23.4	174.3	-81.5	-172.2	176.3	-176.1	0	114.2	D1109 N1163	D1109-K1165 IonicContact OD1-NZ 3.08Å; D1109-K1165 PolarHBondContact OD1-NZ 2.78Å; D1109-K1165 IonicContact OD2-NZ 3.17Å; D1109-K1165 PolarHBondContact OD2-NZ 2.79Å; D1109-K1165 VanDerWaalsContact OD2-NZ 3.08Å; N1163-K1165 PolarHBondContact O-N 2.9Å; N1163-K1165 VanDerWaalsContact O-N 3.14Å
1166	F	33.5	Very low	44	Very low	156 Å²	156	90.3 Å²	90.3	68%	0.684	54%	0.543	S	S	*	.	H	α-helix	trans	-98.2	-1.6	175.3	-73.3	-72.3	0	0	0	114.6	L1162 N1163 S1168	L1162-F1166 PolarHBondContact O-N 3.09Å; N1163-F1166 CarbonylContact O-C 3.51Å; N1163-F1166 PolarHBondContact O-N 2.8Å; F1166-S1168 CarbonylContact O-C 3.46Å; F1166-S1168 PolarHBondContact O-N 2.83Å
1167	A	29.8	Very low	46.7	Very low	67 Å²	67	86.2 Å²	86.2	55%	0.554	54%	0.535	S	S	*	.			trans	-87.3	25.6	170.6	0	0	0	0	0	112.6	N1163 S1169	N1163-A1167 VanDerWaalsContact O-CA 3.32Å; N1163-A1167 WeakPolarHBondContact O-CA 3.31Å; N1163-A1167 WeakPolarHBondContact O-CB 3.35Å; N1163-A1167 PolarHBondContact O-N 3.26Å; A1167-S1169 PolarHBondContact O-N 2.82Å
1168	S	32.6	Very low	49.4	Very low	97 Å²	97	83.7 Å²	83.7	68%	0.678	53%	0.527	S	S	*	.	S	Bend	trans	-65.9	76.6	130.7	63.9	0	0	0	0	105.8	F1166 T1170	F1166-S1168 CarbonylContact O-C 3.46Å; F1166-S1168 PolarHBondContact O-N 2.83Å; S1168-T1170 PolarHBondContact O-N 2.88Å
1169	S	37.2	Very low	51.9	Low	87 Å²	87	84.7 Å²	84.7	61%	0.608	53%	0.532	S	S	*	.			trans	-46.7	109.8	-176	61.3	0	0	0	0	106.9	A1167 P1171	A1167-S1169 PolarHBondContact O-N 2.82Å; S1169-P1171 WeakPolarHBondContact O-CD 3.35Å
1170	T	40.8	Very low	54.6	Low	109 Å²	109	85.2 Å²	85.2	67%	0.669	53%	0.533	S	S	*	.			trans	-50.2	116.1	154.7	40.1	0	0	0	0	103.2	S1168 V1172	S1168-T1170 PolarHBondContact O-N 2.88Å; T1170-V1172 PolarHBondContact O-N 3.28Å
1171	P	46.4	Very low	57.4	Low	65 Å²	65	82 Å²	82	42%	0.422	52%	0.523	S	S	.	.			trans	-76.6	65.1	-168.2	29.2	-32.2	0	0	0	107.9	S1169 G1173 P1174 V1175	S1169-P1171 WeakPolarHBondContact O-CD 3.35Å; P1171-G1173 PolarHBondContact O-N 2.97Å; P1171-P1174 HydrophobicContact CB-CB 4.01Å; P1171-P1174 HydrophobicContact CB-CG 3.65Å; P1171-P1174 WeakPolarHBondContact O-CD 3.26Å; P1171-V1175 HydrophobicContact CG-CG2 4.33Å; P1171-V1175 VanDerWaalsContact O-CB 3.27Å; P1171-V1175 WeakPolarHBondContact O-CB 3.41Å; P1171-V1175 WeakPolarHBondContact O-CG2 3.39Å; P1171-V1175 PolarHBondContact O-N 3.4Å
1172	V	58.7	Low	60	Low	98 Å²	98	81.3 Å²	81.3	59%	0.594	52%	0.523	S	S	*	.	H	α-helix	trans	-63.6	-32.4	176.4	-176.3	0	0	0	0	108.6	T1170 A1176	T1170-V1172 PolarHBondContact O-N 3.28Å; V1172-A1176 WeakPolarHBondContact O-CA 3.21Å; V1172-A1176 WeakPolarHBondContact O-CB 3.42Å; V1172-A1176 PolarHBondContact O-N 3.3Å
1173	G	66.3	Low	62.7	Low	56 Å²	56	83.5 Å²	83.5	58%	0.577	53%	0.53	S	S	*	.	H	α-helix	trans	-60.8	-58.7	171.1	0	0	0	0	0	113.1	P1171 V1175 G1177	P1171-G1173 PolarHBondContact O-N 2.97Å; G1173-V1175 PolarHBondContact O-N 3.49Å; G1173-G1177 WeakPolarHBondContact O-CA 3.44Å; G1173-G1177 PolarHBondContact O-N 3.43Å
1174	P	78.1	Confident	65.4	Low	96 Å²	96	84.4 Å²	84.4	62%	0.623	54%	0.538	S	S	*	.	H	α-helix	trans	-63.3	-34.4	175.8	-26.8	33.7	0	0	0	114.7	P1171 G1178	P1171-P1174 HydrophobicContact CB-CB 4.01Å; P1171-P1174 HydrophobicContact CB-CG 3.65Å; P1171-P1174 WeakPolarHBondContact O-CD 3.26Å; P1174-G1178 WeakPolarHBondContact O-CA 3.33Å; P1174-G1178 PolarHBondContact O-N 2.89Å
1175	V	79	Confident	68.3	Low	82 Å²	82	87.8 Å²	87.8	50%	0.497	54%	0.541	S	S	.	.	H	α-helix	trans	-73.3	-46.6	178.1	174	0	0	0	0	110.7	P1171 G1173 G1178 I1179	P1171-V1175 HydrophobicContact CG-CG2 4.33Å; P1171-V1175 VanDerWaalsContact O-CB 3.27Å; P1171-V1175 WeakPolarHBondContact O-CB 3.41Å; P1171-V1175 WeakPolarHBondContact O-CG2 3.39Å; P1171-V1175 PolarHBondContact O-N 3.4Å; G1173-V1175 PolarHBondContact O-N 3.49Å; V1175-G1178 PolarHBondContact O-N 3.27Å; V1175-I1179 HydrophobicContact CG1-CD1 3.9Å; V1175-I1179 VanDerWaalsContact O-CG1 3.25Å; V1175-I1179 WeakPolarHBondContact O-CG1 3.18Å; V1175-I1179 PolarHBondContact O-N 2.66Å
1176	A	77.7	Confident	71.2	Confident	46 Å²	46	86.7 Å²	86.7	38%	0.38	54%	0.541	S	S	.	.	H	α-helix	trans	-66.1	-40.1	174.8	0	0	0	0	0	111.4	V1172 G1178 I1179 M1180	V1172-A1176 WeakPolarHBondContact O-CA 3.21Å; V1172-A1176 WeakPolarHBondContact O-CB 3.42Å; V1172-A1176 PolarHBondContact O-N 3.3Å; A1176-G1178 VanDerWaalsContact C-N 3.31Å; A1176-G1178 PolarHBondContact O-N 3.5Å; A1176-I1179 PolarHBondContact O-N 3.21Å; A1176-M1180 VanDerWaalsContact O-CB 3.29Å; A1176-M1180 WeakPolarHBondContact O-CB 3.25Å; A1176-M1180 VanDerWaalsContact O-CG 3.24Å; A1176-M1180 WeakPolarHBondContact O-CG 3.4Å; A1176-M1180 PolarHBondContact O-N 2.82Å
1177	G	85	Confident	74	Confident	45 Å²	45	84 Å²	84	46%	0.464	54%	0.537	S	S	.	.	H	α-helix	trans	-62.5	-37.5	171.9	0	0	0	0	0	112.3	G1173 G1181	G1173-G1177 WeakPolarHBondContact O-CA 3.44Å; G1173-G1177 PolarHBondContact O-N 3.43Å; G1177-G1181 PolarHBondContact O-N 3.25Å
1178	G	89.2	Confident	77	Confident	38 Å²	38	83 Å²	83	39%	0.392	53%	0.529	S	S	.	.	H	α-helix	trans	-66.2	-46.8	173.3	0	0	0	0	0	112.4	P1174 V1175 A1176 G1181 V1182	P1174-G1178 WeakPolarHBondContact O-CA 3.33Å; P1174-G1178 PolarHBondContact O-N 2.89Å; V1175-G1178 PolarHBondContact O-N 3.27Å; A1176-G1178 VanDerWaalsContact C-N 3.31Å; A1176-G1178 PolarHBondContact O-N 3.5Å; G1178-G1181 PolarHBondContact O-N 3.04Å; G1178-V1182 WeakPolarHBondContact O-CG2 3.23Å; G1178-V1182 PolarHBondContact O-N 3.33Å
1179	I	89.3	Confident	79.9	Confident	91 Å²	91	80.2 Å²	80.2	47%	0.467	52%	0.516	S	S	.	.	H	α-helix	trans	-61.6	-47.5	176.1	-68.5	164.8	0	0	0	110.2	V1175 A1176 G1181 V1182 F1183	V1175-I1179 HydrophobicContact CG1-CD1 3.9Å; V1175-I1179 VanDerWaalsContact O-CG1 3.25Å; V1175-I1179 WeakPolarHBondContact O-CG1 3.18Å; V1175-I1179 PolarHBondContact O-N 2.66Å; A1176-I1179 PolarHBondContact O-N 3.21Å; I1179-G1181 VanDerWaalsContact C-N 3.32Å; I1179-G1181 PolarHBondContact O-N 2.75Å; I1179-V1182 PolarHBondContact O-N 3.09Å; I1179-F1183 HydrophobicContact CG2-CD2 3.79Å; I1179-F1183 HydrophobicContact CG2-CE2 3.73Å; I1179-F1183 VanDerWaalsContact O-CD2 3.29Å; I1179-F1183 WeakPolarHBondContact O-CD2 3.42Å; I1179-F1183 PolarHBondContact O-N 3.11Å
1180	M	89.5	Confident	82.6	Confident	121 Å²	121	80.1 Å²	80.1	60%	0.596	51%	0.511	S	S	*	.	H	α-helix	trans	-61.9	-39.9	175.5	-73.8	-67.2	-72	0	0	111.7	A1176 V1182 F1183 V1184	A1176-M1180 VanDerWaalsContact O-CB 3.29Å; A1176-M1180 WeakPolarHBondContact O-CB 3.25Å; A1176-M1180 VanDerWaalsContact O-CG 3.24Å; A1176-M1180 WeakPolarHBondContact O-CG 3.4Å; A1176-M1180 PolarHBondContact O-N 2.82Å; M1180-V1182 PolarHBondContact O-N 3.48Å; M1180-F1183 PolarHBondContact O-N 3.4Å; M1180-V1184 VanDerWaalsContact O-CG2 3.3Å; M1180-V1184 WeakPolarHBondContact O-CG2 3.5Å; M1180-V1184 PolarHBondContact O-N 2.85Å
1181	G	93.3	Very high	84.9	Confident	30 Å²	30	81.7 Å²	81.7	31%	0.309	51%	0.506	S	S	.	.	H	α-helix	trans	-60.5	-41.8	173.6	0	0	0	0	0	112.7	G1177 G1178 I1179 V1184 L1185	G1177-G1181 PolarHBondContact O-N 3.25Å; G1178-G1181 PolarHBondContact O-N 3.04Å; I1179-G1181 VanDerWaalsContact C-N 3.32Å; I1179-G1181 PolarHBondContact O-N 2.75Å; G1181-V1184 PolarHBondContact O-N 2.85Å; G1181-L1185 WeakPolarHBondContact O-CB 3.36Å; G1181-L1185 VanDerWaalsContact O-CG 3.31Å; G1181-L1185 WeakPolarHBondContact O-CG 3.39Å; G1181-L1185 PolarHBondContact O-N 2.87Å
1182	V	94.1	Very high	87	Confident	84 Å²	84	87.2 Å²	87.2	51%	0.509	52%	0.518	S	S	.	.	H	α-helix	trans	-64.5	-42.9	174.5	171.7	0	0	0	0	111.2	G1178 I1179 M1180 L1185 L1186	G1178-V1182 WeakPolarHBondContact O-CG2 3.23Å; G1178-V1182 PolarHBondContact O-N 3.33Å; I1179-V1182 PolarHBondContact O-N 3.09Å; M1180-V1182 PolarHBondContact O-N 3.48Å; V1182-L1185 PolarHBondContact O-N 2.83Å; V1182-L1186 HydrophobicContact CG1-CD1 4.16Å; V1182-L1186 WeakPolarHBondContact O-CB 3.45Å; V1182-L1186 PolarHBondContact O-N 3.34Å
1183	F	92.9	Very high	88.4	Confident	125 Å²	125	90.5 Å²	90.5	55%	0.548	52%	0.521	S	S	.	.	H	α-helix	trans	-63.3	-43.3	175.6	-87.1	-73.1	0	0	0	112.2	I1179 M1180 L1185 L1186 V1187	I1179-F1183 HydrophobicContact CG2-CD2 3.79Å; I1179-F1183 HydrophobicContact CG2-CE2 3.73Å; I1179-F1183 VanDerWaalsContact O-CD2 3.29Å; I1179-F1183 WeakPolarHBondContact O-CD2 3.42Å; I1179-F1183 PolarHBondContact O-N 3.11Å; M1180-F1183 PolarHBondContact O-N 3.4Å; F1183-L1185 PolarHBondContact O-N 2.96Å; F1183-L1186 PolarHBondContact O-N 2.63Å; F1183-V1187 WeakPolarHBondContact O-CB 3.43Å; F1183-V1187 VanDerWaalsContact O-CG2 3.29Å; F1183-V1187 WeakPolarHBondContact O-CG2 3.43Å; F1183-V1187 PolarHBondContact O-N 3.19Å
1184	V	93.4	Very high	89.3	Confident	94 Å²	94	96 Å²	96	57%	0.57	53%	0.525	S	S	*	.	H	α-helix	trans	-64.2	-40.9	176.7	172	0	0	0	0	111	M1180 G1181 V1187 A1188	M1180-V1184 VanDerWaalsContact O-CG2 3.3Å; M1180-V1184 WeakPolarHBondContact O-CG2 3.5Å; M1180-V1184 PolarHBondContact O-N 2.85Å; G1181-V1184 PolarHBondContact O-N 2.85Å; V1184-V1187 PolarHBondContact O-N 2.89Å; V1184-A1188 VanDerWaalsContact O-CB 3.23Å; V1184-A1188 WeakPolarHBondContact O-CB 3.43Å; V1184-A1188 PolarHBondContact O-N 3.24Å
1185	L	94.1	Very high	89.6	Confident	128 Å²	128	95.2 Å²	95.2	67%	0.67	51%	0.513	S	S	*	.	H	α-helix	trans	-66.2	-38.6	175.3	-75.6	171.6	0	0	0	112.5	G1181 V1182 F1183 G1189	G1181-L1185 WeakPolarHBondContact O-CB 3.36Å; G1181-L1185 VanDerWaalsContact O-CG 3.31Å; G1181-L1185 WeakPolarHBondContact O-CG 3.39Å; G1181-L1185 PolarHBondContact O-N 2.87Å; V1182-L1185 PolarHBondContact O-N 2.83Å; F1183-L1185 PolarHBondContact O-N 2.96Å; L1185-G1189 PolarHBondContact O-N 2.81Å
1186	L	93.8	Very high	89.7	Confident	106 Å²	106	96.6 Å²	96.6	56%	0.555	51%	0.514	S	S	*	.	H	α-helix	trans	-64.7	-45.4	174	-85.1	170.1	0	0	0	111.4	V1182 F1183 G1189 V1190	V1182-L1186 HydrophobicContact CG1-CD1 4.16Å; V1182-L1186 WeakPolarHBondContact O-CB 3.45Å; V1182-L1186 PolarHBondContact O-N 3.34Å; F1183-L1186 PolarHBondContact O-N 2.63Å; L1186-G1189 PolarHBondContact O-N 2.77Å; L1186-V1190 WeakPolarHBondContact O-CB 3.33Å; L1186-V1190 VanDerWaalsContact O-CG2 3.28Å; L1186-V1190 WeakPolarHBondContact O-CG2 3.46Å; L1186-V1190 PolarHBondContact O-N 2.89Å
1187	V	92.9	Very high	89.7	Confident	99 Å²	99	96.3 Å²	96.3	60%	0.6	51%	0.507	S	S	*	.	H	α-helix	trans	-64.1	-43.2	177.1	172.2	0	0	0	0	110.8	F1183 V1184 G1189 V1190 Y1191	F1183-V1187 WeakPolarHBondContact O-CB 3.43Å; F1183-V1187 VanDerWaalsContact O-CG2 3.29Å; F1183-V1187 WeakPolarHBondContact O-CG2 3.43Å; F1183-V1187 PolarHBondContact O-N 3.19Å; V1184-V1187 PolarHBondContact O-N 2.89Å; V1187-G1189 VanDerWaalsContact C-N 3.34Å; V1187-G1189 PolarHBondContact O-N 3.24Å; V1187-V1190 PolarHBondContact O-N 3.1Å; V1187-Y1191 WeakPolarHBondContact O-CB 3.14Å; V1187-Y1191 PolarHBondContact O-N 3.44Å
1188	A	93	Very high	89.2	Confident	45 Å²	45	98.8 Å²	98.8	37%	0.372	51%	0.51	S	S	.	.	H	α-helix	trans	-63.6	-39.8	175.1	0	0	0	0	0	111.7	V1184 Y1191 W1192	V1184-A1188 VanDerWaalsContact O-CB 3.23Å; V1184-A1188 WeakPolarHBondContact O-CB 3.43Å; V1184-A1188 PolarHBondContact O-N 3.24Å; A1188-Y1191 PolarHBondContact O-N 2.91Å; A1188-W1192 WeakPolarHBondContact O-CB 3.36Å; A1188-W1192 PolarHBondContact O-N 3.06Å
1189	G	93.5	Very high	88.5	Confident	40 Å²	40	105.2 Å²	105.2	41%	0.412	52%	0.522	S	S	.	.	H	α-helix	trans	-65.2	-42.6	175.4	0	0	0	0	0	112.6	L1185 L1186 V1187 Y1191 W1192 Y1193	L1185-G1189 PolarHBondContact O-N 2.81Å; L1186-G1189 PolarHBondContact O-N 2.77Å; V1187-G1189 VanDerWaalsContact C-N 3.34Å; V1187-G1189 PolarHBondContact O-N 3.24Å; G1189-Y1191 VanDerWaalsContact C-N 3.34Å; G1189-W1192 PolarHBondContact O-N 3.15Å; G1189-Y1193 VanDerWaalsContact O-CB 3.24Å; G1189-Y1193 WeakPolarHBondContact O-CB 3.34Å; G1189-Y1193 PolarHBondContact O-N 3.02Å
1190	V	92.8	Very high	87.4	Confident	84 Å²	84	104.9 Å²	104.9	51%	0.509	52%	0.521	S	S	.	.	H	α-helix	trans	-65.1	-39.6	173.3	170.9	0	0	0	0	110.8	L1186 V1187 Y1193 R1194	L1186-V1190 WeakPolarHBondContact O-CB 3.33Å; L1186-V1190 VanDerWaalsContact O-CG2 3.28Å; L1186-V1190 WeakPolarHBondContact O-CG2 3.46Å; L1186-V1190 PolarHBondContact O-N 2.89Å; V1187-V1190 PolarHBondContact O-N 3.1Å; V1190-Y1193 PolarHBondContact O-N 3.43Å; V1190-R1194 WeakPolarHBondContact O-CB 3.27Å; V1190-R1194 PolarHBondContact O-N 3.27Å
1191	Y	90.3	Very high	85.8	Confident	143 Å²	143	104.7 Å²	104.7	56%	0.561	52%	0.52	S	S	*	.	H	α-helix	trans	-64.8	-47.6	175.8	-176.3	-93.1	0	0	0	111.4	V1187 A1188 G1189 Y1193 R1194 Q1195	V1187-Y1191 WeakPolarHBondContact O-CB 3.14Å; V1187-Y1191 PolarHBondContact O-N 3.44Å; A1188-Y1191 PolarHBondContact O-N 2.91Å; G1189-Y1191 VanDerWaalsContact C-N 3.34Å; Y1191-Y1193 PolarHBondContact O-N 2.69Å; Y1191-R1194 PolarHBondContact O-N 2.92Å; Y1191-Q1195 WeakPolarHBondContact O-CB 3.22Å; Y1191-Q1195 PolarHBondContact O-N 3.42Å
1192	W	89.5	Confident	83.9	Confident	180 Å²	180	109.9 Å²	109.9	68%	0.682	54%	0.536	S	S	*	.	H	α-helix	trans	-60.4	-44.3	174.6	-101.3	57.8	0	0	0	111.9	A1188 G1189 Q1195 Q1196	A1188-W1192 WeakPolarHBondContact O-CB 3.36Å; A1188-W1192 PolarHBondContact O-N 3.06Å; G1189-W1192 PolarHBondContact O-N 3.15Å; W1192-Q1195 PolarHBondContact O-N 3.02Å; W1192-Q1196 VanDerWaalsContact O-CB 3.29Å; W1192-Q1196 WeakPolarHBondContact O-CB 3.47Å; W1192-Q1196 PolarHBondContact O-N 3.42Å
1193	Y	89	Confident	81.9	Confident	167 Å²	167	110.1 Å²	110.1	66%	0.655	54%	0.541	S	S	*	.	H	α-helix	trans	-61.9	-46.2	176.2	-177.6	-101.1	0	0	0	111.3	G1189 V1190 Y1191 Q1195 Q1196 V1197	G1189-Y1193 VanDerWaalsContact O-CB 3.24Å; G1189-Y1193 WeakPolarHBondContact O-CB 3.34Å; G1189-Y1193 PolarHBondContact O-N 3.02Å; V1190-Y1193 PolarHBondContact O-N 3.43Å; Y1191-Y1193 PolarHBondContact O-N 2.69Å; Y1193-Q1195 VanDerWaalsContact C-N 3.31Å; Y1193-Q1195 PolarHBondContact O-N 2.7Å; Y1193-Q1196 PolarHBondContact O-N 3.27Å; Y1193-V1197 HydrophobicContact CD1-CG2 4.03Å; Y1193-V1197 HydrophobicContact CD2-CG2 4.4Å; Y1193-V1197 HydrophobicContact CE1-CG2 3.63Å; Y1193-V1197 HydrophobicContact CE2-CG2 4.04Å; Y1193-V1197 HydrophobicContact CG-CG2 4.4Å; Y1193-V1197 WeakPolarHBondContact O-CB 3.12Å; Y1193-V1197 VanDerWaalsContact O-CG2 3.26Å; Y1193-V1197 WeakPolarHBondContact O-CG2 3.23Å; Y1193-V1197 PolarHBondContact O-N 3.15Å
1194	R	84.2	Confident	79.7	Confident	173 Å²	173	113.3 Å²	113.3	65%	0.653	55%	0.55	S	S	*	.	H	α-helix	trans	-59.6	-41.7	173.8	-86.8	-173	167	-173.1	-2.5	111.9	V1190 Y1191 V1197 N1198	V1190-R1194 WeakPolarHBondContact O-CB 3.27Å; V1190-R1194 PolarHBondContact O-N 3.27Å; Y1191-R1194 PolarHBondContact O-N 2.92Å; R1194-V1197 PolarHBondContact O-N 2.92Å; R1194-N1198 VanDerWaalsContact O-CB 3.25Å; R1194-N1198 WeakPolarHBondContact O-CB 3.02Å; R1194-N1198 PolarHBondContact O-N 3.48Å
1195	Q	84.6	Confident	76.9	Confident	79 Å²	79	113.4 Å²	113.4	37%	0.369	55%	0.554	S	S	.	*	H	α-helix	trans	-69.5	-36.5	179.6	-158.6	169.3	22.2	0	0	111.7	Y1191 W1192 Y1193 R1199	Y1191-Q1195 WeakPolarHBondContact O-CB 3.22Å; Y1191-Q1195 PolarHBondContact O-N 3.42Å; W1192-Q1195 PolarHBondContact O-N 3.02Å; Y1193-Q1195 VanDerWaalsContact C-N 3.31Å; Y1193-Q1195 PolarHBondContact O-N 2.7Å; Q1195-R1199 WeakPolarHBondContact O-CB 3.12Å; Q1195-R1199 WeakPolarHBondContact O-CG 3.49Å; Q1195-R1199 PolarHBondContact O-N 2.91Å
1196	Q	81.5	Confident	74.2	Confident	110 Å²	110	117.9 Å²	117.9	51%	0.514	56%	0.563	S	S	.	*	H	α-helix	trans	-67.4	-45.2	173.7	-166	108.8	-12.5	0	0	111.3	W1192 Y1193 R1199 I1200	W1192-Q1196 VanDerWaalsContact O-CB 3.29Å; W1192-Q1196 WeakPolarHBondContact O-CB 3.47Å; W1192-Q1196 PolarHBondContact O-N 3.42Å; Y1193-Q1196 PolarHBondContact O-N 3.27Å; Q1196-R1199 PolarHBondContact O-N 3.36Å; Q1196-I1200 HydrophobicContact CG-CD1 4.27Å; Q1196-I1200 VanDerWaalsContact O-CG1 3.29Å; Q1196-I1200 WeakPolarHBondContact O-CG1 3.41Å; Q1196-I1200 PolarHBondContact O-N 2.8Å
1197	V	78.8	Confident	71.4	Confident	40 Å²	40	124.2 Å²	124.2	24%	0.242	58%	0.58	C	S	.	*	H	α-helix	trans	-63.5	-42.2	175.3	170.7	0	0	0	0	110.5	Y1193 R1194 R1199 I1200 M1201	Y1193-V1197 HydrophobicContact CD1-CG2 4.03Å; Y1193-V1197 HydrophobicContact CD2-CG2 4.4Å; Y1193-V1197 HydrophobicContact CE1-CG2 3.63Å; Y1193-V1197 HydrophobicContact CE2-CG2 4.04Å; Y1193-V1197 HydrophobicContact CG-CG2 4.4Å; Y1193-V1197 WeakPolarHBondContact O-CB 3.12Å; Y1193-V1197 VanDerWaalsContact O-CG2 3.26Å; Y1193-V1197 WeakPolarHBondContact O-CG2 3.23Å; Y1193-V1197 PolarHBondContact O-N 3.15Å; R1194-V1197 PolarHBondContact O-N 2.92Å; V1197-R1199 VanDerWaalsContact C-N 3.35Å; V1197-R1199 PolarHBondContact O-N 3.46Å; V1197-I1200 CarbonylContact O-C 3.51Å; V1197-I1200 PolarHBondContact O-N 3.42Å; V1197-M1201 HydrophobicContact CG1-CG 4.27Å; V1197-M1201 WeakPolarHBondContact O-CB 3.39Å; V1197-M1201 WeakPolarHBondContact O-CG 3.21Å; V1197-M1201 PolarHBondContact O-N 3.09Å
1198	N	74.5	Confident	68.5	Low	98 Å²	98	123.6 Å²	123.6	52%	0.524	59%	0.585	S	S	.	*	H	α-helix	trans	-62.6	-41.3	175	-76.2	-8.1	0	0	0	111.3	R1194 I1200 M1201 E1202	R1194-N1198 VanDerWaalsContact O-CB 3.25Å; R1194-N1198 WeakPolarHBondContact O-CB 3.02Å; R1194-N1198 PolarHBondContact O-N 3.48Å; N1198-I1200 PolarHBondContact O-N 3.5Å; N1198-M1201 PolarHBondContact O-N 3.08Å; N1198-E1202 WeakPolarHBondContact O-CB 3.5Å; N1198-E1202 WeakPolarHBondContact O-CG 3.01Å; N1198-E1202 PolarHBondContact O-N 3.35Å
1199	R	72.8	Confident	65.4	Low	172 Å²	172	129.1 Å²	129.1	65%	0.649	61%	0.608	S	S	*	*	H	α-helix	trans	-62.6	-40	172.4	-79.5	-177	175.9	-179.8	0.4	112.6	Q1195 Q1196 V1197 S1203	Q1195-R1199 WeakPolarHBondContact O-CB 3.12Å; Q1195-R1199 WeakPolarHBondContact O-CG 3.49Å; Q1195-R1199 PolarHBondContact O-N 2.91Å; Q1196-R1199 PolarHBondContact O-N 3.36Å; V1197-R1199 VanDerWaalsContact C-N 3.35Å; V1197-R1199 PolarHBondContact O-N 3.46Å; R1199-S1203 PolarHBondContact O-N 3.24Å
1200	I	66.7	Low	62.4	Low	84 Å²	84	134.6 Å²	134.6	43%	0.431	63%	0.628	S	S	.	*	H	α-helix	trans	-68.2	-38.3	176.2	-67.3	166.2	0	0	0	110.4	Q1196 V1197 N1198 S1203 R1204	Q1196-I1200 HydrophobicContact CG-CD1 4.27Å; Q1196-I1200 VanDerWaalsContact O-CG1 3.29Å; Q1196-I1200 WeakPolarHBondContact O-CG1 3.41Å; Q1196-I1200 PolarHBondContact O-N 2.8Å; V1197-I1200 CarbonylContact O-C 3.51Å; V1197-I1200 PolarHBondContact O-N 3.42Å; N1198-I1200 PolarHBondContact O-N 3.5Å; I1200-S1203 PolarHBondContact O-N 3.01Å; I1200-S1203 PolarHBondContact O-OG 2.91Å; I1200-R1204 PolarHBondContact O-N 3.36Å; I1200-R1204 VanDerWaalsContact O-N 3.14Å
1201	M	55.9	Low	59.3	Low	118 Å²	118	135.6 Å²	135.6	58%	0.581	64%	0.639	S	S	*	*	H	α-helix	trans	-69.6	-39.2	176.4	-75.1	-128.6	-179.1	0	0	112.4	V1197 N1198 S1203 R1204 C1205	V1197-M1201 HydrophobicContact CG1-CG 4.27Å; V1197-M1201 WeakPolarHBondContact O-CB 3.39Å; V1197-M1201 WeakPolarHBondContact O-CG 3.21Å; V1197-M1201 PolarHBondContact O-N 3.09Å; N1198-M1201 PolarHBondContact O-N 3.08Å; M1201-S1203 VanDerWaalsContact C-N 3.28Å; M1201-S1203 PolarHBondContact O-N 3.21Å; M1201-R1204 CarbonylContact O-C 3.4Å; M1201-R1204 PolarHBondContact O-N 3.31Å; M1201-C1205 PolarHBondContact O-N 3.46Å; M1201-C1205 PolarHBondContact O-SG 3.12Å
1202	E	53.3	Low	56.4	Low	138 Å²	138	134.6 Å²	134.6	65%	0.645	65%	0.652	S	S	*	*	H	α-helix	trans	-63	-36	171.5	-79.4	179.6	168	0	0	111.3	N1198 R1204 C1205	N1198-E1202 WeakPolarHBondContact O-CB 3.5Å; N1198-E1202 WeakPolarHBondContact O-CG 3.01Å; N1198-E1202 PolarHBondContact O-N 3.35Å; E1202-R1204 VanDerWaalsContact C-N 3.25Å; E1202-R1204 PolarHBondContact O-N 3.11Å; E1202-C1205 PolarHBondContact O-N 3.2Å
1203	S	52.8	Low	53.4	Low	89 Å²	89	130.7 Å²	130.7	62%	0.622	66%	0.659	S	S	*	*	H	α-helix	trans	-69.4	-20.1	173.4	78.2	0	0	0	0	114	R1199 I1200 M1201	R1199-S1203 PolarHBondContact O-N 3.24Å; I1200-S1203 PolarHBondContact O-N 3.01Å; I1200-S1203 PolarHBondContact O-OG 2.91Å; M1201-S1203 VanDerWaalsContact C-N 3.28Å; M1201-S1203 PolarHBondContact O-N 3.21Å
1204	R	45.9	Very low	50.4	Low	192 Å²	192	128.8 Å²	128.8	73%	0.725	67%	0.665	S	S	*	*	H	α-helix	trans	-97	-21.9	176.7	-74	-174.5	-178.3	-179	1	113.8	I1200 M1201 E1202 Y1206 R1207	I1200-R1204 PolarHBondContact O-N 3.36Å; I1200-R1204 VanDerWaalsContact O-N 3.14Å; M1201-R1204 CarbonylContact O-C 3.4Å; M1201-R1204 PolarHBondContact O-N 3.31Å; E1202-R1204 VanDerWaalsContact C-N 3.25Å; E1202-R1204 PolarHBondContact O-N 3.11Å; R1204-Y1206 VanDerWaalsContact C-N 3.26Å; R1204-Y1206 PolarHBondContact O-N 2.78Å; R1204-R1207 PolarHBondContact O-N 3.29Å
1205	C	35.3	Very low	47.5	Very low	97 Å²	97	131.4 Å²	131.4	66%	0.655	67%	0.674	S	S	*	*	H	α-helix	trans	-74.7	-8.2	-178.1	-75.2	0	0	0	0	114.7	M1201 E1202 R1207	M1201-C1205 PolarHBondContact O-N 3.46Å; M1201-C1205 PolarHBondContact O-SG 3.12Å; E1202-C1205 PolarHBondContact O-N 3.2Å; C1205-R1207 PolarHBondContact O-N 3Å
1206	Y	37.5	Very low	44.8	Very low	221 Å²	221	136.1 Å²	136.1	87%	0.867	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	2.3	168.6	-85.5	-76.9	0	0	0	114.6	R1204	R1204-Y1206 VanDerWaalsContact C-N 3.26Å; R1204-Y1206 PolarHBondContact O-N 2.78Å
1207	R	34.8	Very low	42.1	Very low	240 Å²	240	137.9 Å²	137.9	91%	0.906	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	11.8	-178.6	-101.4	-173.8	179	143.2	1	116.7	R1204 C1205	R1204-R1207 PolarHBondContact O-N 3.29Å; C1205-R1207 PolarHBondContact O-N 3Å
1208	A	31.6	Very low	39.5	Very low	85 Å²	85	142.4 Å²	142.4	70%	0.702	74%	0.737	S	S	*	*			trans	-117.6	53.6	179.2	0	0	0	0	0	112	D1210	A1208-D1210 PolarHBondContact O-N 3.37Å
1209	N	27.7	Very low	37.2	Very low	161 Å²	161	146.8 Å²	146.8	86%	0.861	76%	0.755	S	S	*	*			trans	-88.2	83.2	153.8	-126	16.5	0	0	0	105.9
1210	D	30.8	Very low	35	Very low	156 Å²	156	147.3 Å²	147.3	83%	0.834	77%	0.769	S	S	*	*			trans	-164	134.6	146.3	-107.9	-21.4	0	0	0	111.4	A1208	A1208-D1210 PolarHBondContact O-N 3.37Å
1211	S	28.4	Very low	33	Very low	105 Å²	105	152.4 Å²	152.4	73%	0.734	79%	0.791	S	S	*	*			trans	-56.9	129.4	-170.9	50.5	0	0	0	0	114.9
1212	S	29.9	Very low	31.5	Very low	121 Å²	121	155.5 Å²	155.5	85%	0.846	80%	0.804	S	S	*	*			trans	175.8	70.1	139.8	35.9	0	0	0	0	110.7
1213	A	25.8	Very low	30.4	Very low	99 Å²	99	155.5 Å²	155.5	82%	0.818	81%	0.808	S	S	*	*			trans	-96.9	93	170.7	0	0	0	0	0	109.8
1214	T	25.7	Very low	29	Very low	127 Å²	127	161.1 Å²	161.1	78%	0.779	82%	0.822	S	S	*	*			trans	-162.5	126.6	150.1	24.9	0	0	0	0	111
1215	R	23.4	Very low	28.1	Very low	227 Å²	227	159.9 Å²	159.9	86%	0.857	82%	0.824	S	S	*	*			trans	80.8	101.8	157.1	-62.7	177.3	173.2	145.4	-0.3	117.7
1216	L	28	Very low	27.6	Very low	179 Å²	179	164.6 Å²	164.6	94%	0.937	83%	0.834	S	S	*	*				-155.8	111	124.5	-107.9	131.7	0	0	0	108.9
1217	N	24.3	Very low	27.2	Very low	146 Å²	146	161.9 Å²	161.9	78%	0.781	83%	0.834	S	S	*	*			trans	-125.7	139.5	170.7	-152.3	31.2	0	0	0	105.4
1218	N	23.7	Very low	26.8	Very low	136 Å²	136	158.5 Å²	158.5	73%	0.727	84%	0.835	S	S	*	*			trans	77.3	107.1	174	-60.6	-1.9	0	0	0	117.8
1219	E	26	Very low	26.4	Very low	190 Å²	190	157.6 Å²	157.6	89%	0.888	83%	0.833	S	S	*	*				173.1	108.4	123	-95.8	173.7	-171	0	0	107.5
1220	L	28.4	Very low	26.2	Very low	182 Å²	182	155.4 Å²	155.4	95%	0.953	83%	0.83	S	S	*	*			trans	-168.9	70	165.8	-101.5	158.2	0	0	0	108.1
1221	E	23.6	Very low	25.9	Very low	191 Å²	191	152.7 Å²	152.7	89%	0.893	82%	0.824	S	S	*	*			trans	-126.1	149.3	154.9	-87.1	-171.3	158.3	0	0	107.2
1222	E	25	Very low	25.8	Very low	183 Å²	183	155.1 Å²	155.1	86%	0.855	83%	0.828	S	S	*	*			trans	92.9	103.4	179.5	-54.1	-168.4	162.7	0	0	116.2
1223	D	30	Very low	25.5	Very low	138 Å²	138	158 Å²	158	74%	0.738	83%	0.829	S	S	*	*				176	90.1	126.9	-86	-20.9	0	0	0	110.5
1224	F	24.3	Very low	25.6	Very low	208 Å²	208	158.9 Å²	158.9	91%	0.912	83%	0.826	S	S	*	*			trans	-111.6	83.9	165.4	-87.3	-84.4	0	0	0	108.4
1225	H	26.5	Very low	25.5	Very low	166 Å²	166	159.5 Å²	159.5	77%	0.769	82%	0.824	S	S	*	*			trans	-94.1	120.9	174.3	-97.3	-76.7	0	0	0	110.9
1226	F	23.7	Very low	25.6	Very low	196 Å²	196	154.7 Å²	154.7	86%	0.86	82%	0.82	S	S	*	*			trans	-85.4	112.1	169	-85	-95.9	0	0	0	109.1
1227	D	29.8	Very low	25.3	Very low	163 Å²	163	154.2 Å²	154.2	87%	0.872	82%	0.818	S	S	*	*			trans	-94.7	103.7	169.7	-89.2	-29.6	0	0	0	110.5
1228	D	26	Very low	25.3	Very low	170 Å²	170	150.6 Å²	150.6	91%	0.909	82%	0.815	S	S	*	*			trans	-82.2	125.6	158.3	-92.9	-28.8	0	0	0	108.6
1229	G	23.7	Very low	25.2	Very low	65 Å²	65	149.2 Å²	149.2	67%	0.67	82%	0.817	S	S	*	*			trans	159.8	88.8	164	0	0	0	0	0	119.3
1230	S	22.8	Very low	25.2	Very low	115 Å²	115	146.4 Å²	146.4	80%	0.804	81%	0.812	S	S	*	*			trans	78.6	134.2	133	79.2	0	0	0	0	121.7
1231	S	24.4	Very low	25.1	Very low	99 Å²	99	146.9 Å²	146.9	69%	0.692	81%	0.809	S	S	*	*			trans	100.7	122.3	143.8	77	0	0	0	0	119.8
1232	N	27.5	Very low	25.2	Very low	156 Å²	156	145 Å²	145	83%	0.834	81%	0.806	S	S	*	*			trans	90.2	100	151.8	-60.8	-16.4	0	0	0	119.9
1233	Q	23.7	Very low	25.2	Very low	183 Å²	183	144.1 Å²	144.1	86%	0.855	81%	0.807	S	S	*	*			trans	-35.6	145.1	143.3	-76.8	177.3	-21.2	0	0	112
1234	P	28.2	Very low	25.1	Very low	117 Å²	117	140.8 Å²	140.8	76%	0.76	81%	0.805	S	S	*	*				-147.3	144.6	66.6	34.8	-13.8	0	0	0	117.8
1235	N	23.2	Very low	25.1	Very low	140 Å²	140	138 Å²	138	75%	0.749	80%	0.799	S	S	*	*			trans	45	102.7	140.8	-68.5	-13	0	0	0	121.8
1236	V	24.8	Very low	25.1	Very low	126 Å²	126	137.9 Å²	137.9	76%	0.764	80%	0.803	S	S	*	*				46.1	94.6	118.3	-171.1	0	0	0	0	116.4
1237	N	22.2	Very low	25.2	Very low	168 Å²	168	135.9 Å²	135.9	90%	0.898	80%	0.8	S	S	*	*			trans	-175	101.5	139.4	-92.1	-20.4	0	0	0	109
1238	G	23.3	Very low	25.2	Very low	70 Å²	70	132 Å²	132	72%	0.722	79%	0.791	S	S	*	*			trans	167.8	85.7	177.9	0	0	0	0	0	115.2
1239	S	22.3	Very low	25.2	Very low	108 Å²	108	129.2 Å²	129.2	76%	0.755	79%	0.785	S	S	*	*			trans	25.6	128.2	133.1	62.7	0	0	0	0	120.7
1240	V	26.8	Very low	25.4	Very low	131 Å²	131	136 Å²	136	79%	0.794	80%	0.796	S	S	*	*			trans	70	86.1	138.7	-173.5	0	0	0	0	115.4
1241	Q	24.5	Very low	25.5	Very low	191 Å²	191	138.3 Å²	138.3	89%	0.893	79%	0.794	S	S	*	*			trans	-105	104.5	159	-82.7	-172	-19.4	0	0	110.3	N1243	Q1241-N1243 PolarHBondContact O-N 3.12Å
1242	N	26.2	Very low	25.5	Very low	152 Å²	152	145.4 Å²	145.4	81%	0.813	81%	0.806	S	S	*	*			trans	9.4	101.9	148	-69	-21.1	0	0	0	116.9	G1244	N1242-G1244 PolarHBondContact O-N 3.11Å
1243	N	26.1	Very low	25.4	Very low	164 Å²	164	145.4 Å²	145.4	88%	0.877	80%	0.801	S	S	*	*			trans	-65.3	88	156.5	-73.4	-13.8	0	0	0	108.8	Q1241 L1245	Q1241-N1243 PolarHBondContact O-N 3.12Å; N1243-L1245 VanDerWaalsContact C-N 3.3Å; N1243-L1245 PolarHBondContact O-N 3.06Å
1244	G	26.3	Very low	25.4	Very low	68 Å²	68	144.3 Å²	144.3	70%	0.701	80%	0.801	S	S	*	*			trans	-62.3	96.2	159.4	0	0	0	0	0	108.2	N1242 L1246	N1242-G1244 PolarHBondContact O-N 3.11Å; G1244-L1246 VanDerWaalsContact C-N 3.26Å; G1244-L1246 PolarHBondContact O-N 2.88Å
1245	L	25.4	Very low	25.3	Very low	149 Å²	149	146.6 Å²	146.6	78%	0.78	81%	0.806	S	S	*	*			trans	-64.2	86.3	175.1	-169.6	82.8	0	0	0	108.8	N1243 L1247	N1243-L1245 VanDerWaalsContact C-N 3.3Å; N1243-L1245 PolarHBondContact O-N 3.06Å; L1245-L1247 HydrophobicContact CD2-CD1 4.19Å; L1245-L1247 PolarHBondContact O-N 3.2Å; L1245-L1247 VanDerWaalsContact O-N 3.08Å
1246	L	26.4	Very low	25.5	Very low	165 Å²	165	146.4 Å²	146.4	86%	0.864	80%	0.804	S	S	*	*			trans	-65.6	102.7	165.7	-108	150.2	0	0	0	107.2	G1244 A1248	G1244-L1246 VanDerWaalsContact C-N 3.26Å; G1244-L1246 PolarHBondContact O-N 2.88Å; L1246-A1248 VanDerWaalsContact C-N 3.3Å; L1246-A1248 PolarHBondContact O-N 2.66Å
1247	L	25.9	Very low	25.5	Very low	153 Å²	153	144.7 Å²	144.7	80%	0.801	80%	0.803	S	S	*	*			trans	-55.7	94.4	166.2	-103.7	79.3	0	0	0	108.3	L1245 S1249	L1245-L1247 HydrophobicContact CD2-CD1 4.19Å; L1245-L1247 PolarHBondContact O-N 3.2Å; L1245-L1247 VanDerWaalsContact O-N 3.08Å; L1247-S1249 PolarHBondContact O-N 3.23Å; L1247-S1249 VanDerWaalsContact O-N 3.11Å
1248	A	28.6	Very low	25.4	Very low	83 Å²	83	145 Å²	145	69%	0.686	80%	0.801	S	S	*	*			trans	-68.5	105.2	167.2	0	0	0	0	0	107.6	L1246 F1250	L1246-A1248 VanDerWaalsContact C-N 3.3Å; L1246-A1248 PolarHBondContact O-N 2.66Å; A1248-F1250 PolarHBondContact O-N 3.31Å
1249	S	27.2	Very low	25.5	Very low	111 Å²	111	147.6 Å²	147.6	78%	0.776	81%	0.805	S	S	*	*			trans	-56.7	125.5	172.5	49.6	0	0	0	0	110.1	L1247 E1251	L1247-S1249 PolarHBondContact O-N 3.23Å; L1247-S1249 VanDerWaalsContact O-N 3.11Å; S1249-E1251 VanDerWaalsContact C-N 3.32Å; S1249-E1251 PolarHBondContact O-N 3.49Å
1250	F	27.5	Very low	25.7	Very low	206 Å²	206	153.5 Å²	153.5	90%	0.904	81%	0.811	S	S	*	*			trans	-73	81.2	177.2	-71.5	-90.1	0	0	0	110.8	A1248	A1248-F1250 PolarHBondContact O-N 3.31Å
1251	E	24.7	Very low	25.7	Very low	164 Å²	164	153.3 Å²	153.3	77%	0.766	81%	0.812	S	S	*	*			trans	-124.1	78.6	157.3	-76.8	-170	163.2	0	0	108.7	S1249 Q1253	S1249-E1251 VanDerWaalsContact C-N 3.32Å; S1249-E1251 PolarHBondContact O-N 3.49Å; E1251-Q1253 PolarHBondContact O-N 3.42Å
1252	R	25.7	Very low	25.8	Very low	248 Å²	248	155.9 Å²	155.9	94%	0.936	81%	0.814	S	S	*	*			trans	-72.6	77.9	164.3	-83.9	-172.5	-178.8	-175.4	1	108.7
1253	Q	24.8	Very low	25.9	Very low	156 Å²	156	153.5 Å²	153.5	73%	0.729	81%	0.809	S	S	*	*			trans	-65.1	140.1	151.1	-74.5	-179.4	-7.5	0	0	107.9	E1251 L1255	E1251-Q1253 PolarHBondContact O-N 3.42Å; Q1253-L1255 PolarHBondContact O-N 3.23Å
1254	N	24.2	Very low	26	Very low	161 Å²	161	157.2 Å²	157.2	86%	0.861	81%	0.811	S	S	*	*			trans	-54.7	77.8	-179.5	-73.8	-38	0	0	0	112.4	I1256	N1254-I1256 VanDerWaalsContact C-N 3.33Å; N1254-I1256 PolarHBondContact O-N 3.47Å
1255	L	25.5	Very low	26.2	Very low	164 Å²	164	165.5 Å²	165.5	86%	0.859	82%	0.821	S	S	*	*			trans	-78.9	90.8	169.1	-79.3	162.4	0	0	0	107.2	Q1253 A1257	Q1253-L1255 PolarHBondContact O-N 3.23Å; L1255-A1257 PolarHBondContact O-N 2.68Å
1256	I	26.7	Very low	26.3	Very low	137 Å²	137	169.6 Å²	169.6	70%	0.703	83%	0.826	S	S	*	*			trans	-48.4	113.6	158.9	-63.6	169.1	0	0	0	106.2	N1254 M1258	N1254-I1256 VanDerWaalsContact C-N 3.33Å; N1254-I1256 PolarHBondContact O-N 3.47Å; I1256-M1258 PolarHBondContact O-N 2.96Å
1257	A	24.3	Very low	26.4	Very low	90 Å²	90	168 Å²	168	74%	0.744	83%	0.826	S	S	*	*			trans	-53.5	107.9	-178.2	0	0	0	0	0	109.8	L1255 P1259	L1255-A1257 PolarHBondContact O-N 2.68Å; A1257-P1259 WeakPolarHBondContact O-CD 3.38Å
1258	M	21.3	Very low	26.6	Very low	175 Å²	175	164.3 Å²	164.3	86%	0.862	82%	0.824	S	S	*	*			trans	-65.7	118.7	170.8	-70.8	-137.8	-75.9	0	0	108.3	I1256 R1260	I1256-M1258 PolarHBondContact O-N 2.96Å; M1258-R1260 PolarHBondContact O-N 2.75Å; M1258-R1260 VanDerWaalsContact O-N 3.09Å
1259	P	25.9	Very low	26.6	Very low	124 Å²	124	166 Å²	166	81%	0.805	83%	0.831	S	S	*	*			trans	-69.5	111.6	170	1.5	13.3	0	0	0	107.1	A1257	A1257-P1259 WeakPolarHBondContact O-CD 3.38Å
1260	R	25.3	Very low	26.6	Very low	232 Å²	232	171 Å²	171	88%	0.875	83%	0.833	S	S	*	*			trans	-53.3	127.6	173.6	-76.1	-179.7	176.4	158.5	-1.2	108.8	M1258 R1262	M1258-R1260 PolarHBondContact O-N 2.75Å; M1258-R1260 VanDerWaalsContact O-N 3.09Å; R1260-R1262 PolarHBondContact O-N 3.38Å
1261	P	26.4	Very low	26.8	Very low	126 Å²	126	166 Å²	166	82%	0.818	83%	0.829	S	S	*	*			trans	-63.7	114.6	-179.8	26.6	-33.7	0	0	0	108.6	S1263	P1261-S1263 PolarHBondContact O-N 3.14Å; P1261-S1263 VanDerWaalsContact O-N 3.15Å
1262	R	26.6	Very low	27.1	Very low	245 Å²	245	164.8 Å²	164.8	93%	0.925	82%	0.824	S	S	*	*			trans	-53.1	120.4	176.5	-84.1	179.8	166.6	156.3	-3.9	109.3	R1260 R1264	R1260-R1262 PolarHBondContact O-N 3.38Å; R1262-R1264 PolarHBondContact O-N 3Å; R1262-R1264 VanDerWaalsContact O-N 3.12Å
1263	S	28.9	Very low	27.2	Very low	103 Å²	103	158.3 Å²	158.3	72%	0.72	82%	0.816	S	S	*	*			trans	-56.7	115.6	174.5	51.5	0	0	0	0	109.9	P1261 W1265	P1261-S1263 PolarHBondContact O-N 3.14Å; P1261-S1263 VanDerWaalsContact O-N 3.15Å; S1263-W1265 PolarHBondContact O-N 3.24Å
1264	R	29.3	Very low	27.4	Very low	242 Å²	242	156.6 Å²	156.6	91%	0.913	82%	0.822	S	S	*	*			trans	-27.9	99.5	172.6	-168.6	-176.1	-106.4	-152.5	-4.2	112.9	R1262 R1266	R1262-R1264 PolarHBondContact O-N 3Å; R1262-R1264 VanDerWaalsContact O-N 3.12Å; R1264-R1266 PolarHBondContact O-N 3.12Å
1265	W	28.9	Very low	27.7	Very low	242 Å²	242	156.3 Å²	156.3	92%	0.917	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-59.4	123.8	168.1	-92.3	52.2	0	0	0	109.2	S1263	S1263-W1265 PolarHBondContact O-N 3.24Å
1266	R	28	Very low	28	Very low	235 Å²	235	155.3 Å²	155.3	89%	0.887	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-75.9	123.7	171.2	-73.1	-176.3	178.7	-176.1	0	108.1	R1264 G1268	R1264-R1266 PolarHBondContact O-N 3.12Å; R1266-G1268 PolarHBondContact O-N 3.37Å
1267	P	29.5	Very low	28.1	Very low	132 Å²	132	151.3 Å²	151.3	86%	0.857	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-69.4	117.5	177.6	-12.3	26.9	0	0	0	109.7
1268	G	29.9	Very low	28.3	Very low	74 Å²	74	158 Å²	158	76%	0.763	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-68	155	168.2	0	0	0	0	0	111.6	R1266 R1270	R1266-G1268 PolarHBondContact O-N 3.37Å; G1268-R1270 PolarHBondContact O-N 3.28Å
1269	S	29	Very low	28.7	Very low	118 Å²	118	154.7 Å²	154.7	83%	0.825	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-60.7	120.8	-172.6	49	0	0	0	0	114.2	A1271	S1269-A1271 PolarHBondContact O-N 2.97Å
1270	R	26.5	Very low	29.1	Very low	216 Å²	216	154.6 Å²	154.6	82%	0.815	82%	0.816	S	S	*	*			trans	8	96	146.5	-165.8	174.3	178	147.6	-1	115.5	G1268 E1272	G1268-R1270 PolarHBondContact O-N 3.28Å; R1270-E1272 HydrophobicContact CG-CG 4.44Å; R1270-E1272 IonicContact CZ-OE1 3.27Å; R1270-E1272 IonicContact NE-OE1 2.63Å; R1270-E1272 PolarHBondContact NE-OE1 3.48Å; R1270-E1272 IonicContact NH2-OE1 3.33Å; R1270-E1272 PolarHBondContact NH2-OE1 2.84Å
1271	A	31.1	Very low	29.2	Very low	101 Å²	101	152.4 Å²	152.4	84%	0.835	82%	0.817	S	S	*	*			trans	-112.6	125.6	150.8	0	0	0	0	0	107.2	S1269	S1269-A1271 PolarHBondContact O-N 2.97Å
1272	E	30.5	Very low	29.4	Very low	140 Å²	140	152 Å²	152	65%	0.654	81%	0.813	S	S	*	*			trans	-76.5	143.3	-173.4	-71.3	167.9	163.3	0	0	111.3	R1270	R1270-E1272 HydrophobicContact CG-CG 4.44Å; R1270-E1272 IonicContact CZ-OE1 3.27Å; R1270-E1272 IonicContact NE-OE1 2.63Å; R1270-E1272 PolarHBondContact NE-OE1 3.48Å; R1270-E1272 IonicContact NH2-OE1 3.33Å; R1270-E1272 PolarHBondContact NH2-OE1 2.84Å
1273	S	27.8	Very low	29.7	Very low	111 Å²	111	144.6 Å²	144.6	78%	0.776	80%	0.804	S	S	*	*			trans	56.2	103.5	157.3	61.9	0	0	0	0	119.3
1274	S	30.7	Very low	29.8	Very low	121 Å²	121	146.4 Å²	146.4	85%	0.846	81%	0.806	S	S	*	*				177.2	126.3	124.2	33.3	0	0	0	0	111.2
1275	D	30.3	Very low	29.8	Very low	154 Å²	154	140.2 Å²	140.2	82%	0.824	80%	0.798	S	S	*	*			trans	27.6	109.2	163	-72.1	-33.6	0	0	0	121.1	G1277	D1275-G1277 VanDerWaalsContact C-N 3.33Å; D1275-G1277 PolarHBondContact O-N 2.64Å; D1275-G1277 VanDerWaalsContact O-N 3.1Å
1276	P	31.1	Very low	29.8	Very low	144 Å²	144	135.5 Å²	135.5	94%	0.935	79%	0.791	S	S	*	*			trans	-83.6	80.1	162.8	33.8	-27.4	0	0	0	109.5
1277	G	28.5	Very low	29.9	Very low	53 Å²	53	132.6 Å²	132.6	55%	0.546	79%	0.793	S	S	.	*			trans	-135.3	99.4	175.8	0	0	0	0	0	111.6	D1275	D1275-G1277 VanDerWaalsContact C-N 3.33Å; D1275-G1277 PolarHBondContact O-N 2.64Å; D1275-G1277 VanDerWaalsContact O-N 3.1Å
1278	Y	28.4	Very low	29.9	Very low	229 Å²	229	131 Å²	131	90%	0.898	78%	0.784	S	S	*	*			trans	76.1	135	157.7	-71.1	-88.5	0	0	0	120.9
1279	S	30.5	Very low	29.7	Very low	106 Å²	106	136.1 Å²	136.1	74%	0.741	79%	0.789	S	S	*	*			trans	74.9	123.4	156.6	-55.5	0	0	0	0	115
1280	T	33.3	Very low	29.6	Very low	123 Å²	123	136.4 Å²	136.4	76%	0.755	79%	0.788	S	S	*	*			cis	-166.8	134.7	45.6	37.3	0	0	0	0	107.1	T1282	T1280-T1282 PolarHBondContact O-N 2.8Å; T1280-T1282 VanDerWaalsContact O-N 3.16Å
1281	M	28.7	Very low	29.6	Very low	185 Å²	185	132.2 Å²	132.2	91%	0.911	79%	0.786	S	S	*	*			trans	-67.2	114.2	162.6	-89.3	177.6	56.8	0	0	107.6
1282	T	30.3	Very low	29.4	Very low	118 Å²	118	133.2 Å²	133.2	72%	0.724	78%	0.782	S	S	*	*			trans	-58	131.2	171.1	38.2	0	0	0	0	110	T1280 N1284	T1280-T1282 PolarHBondContact O-N 2.8Å; T1280-T1282 VanDerWaalsContact O-N 3.16Å; T1282-N1284 PolarHBondContact O-N 3.48Å
1283	A	33.2	Very low	29.1	Very low	89 Å²	89	132.7 Å²	132.7	74%	0.736	79%	0.789	S	S	*	*	S	Bend	trans	-73	48.3	-175.2	0	0	0	0	0	114.1
1284	N	31.4	Very low	29.1	Very low	142 Å²	142	133.5 Å²	133.5	76%	0.759	79%	0.789	S	S	*	*			trans	-121.6	72	172.2	-81.5	36.6	0	0	0	109.9	T1282	T1282-N1284 PolarHBondContact O-N 3.48Å
1285	C	29.3	Very low	28.9	Very low	112 Å²	112	134.4 Å²	134.4	76%	0.757	78%	0.784	S	S	*	*			trans	-140.3	62.7	158	-75.7	0	0	0	0	107	D1287	C1285-D1287 VanDerWaalsContact C-N 3.29Å; C1285-D1287 PolarHBondContact O-N 3.42Å; C1285-D1287 VanDerWaalsContact O-N 3.08Å
1286	D	27.9	Very low	28.6	Very low	142 Å²	142	131.7 Å²	131.7	76%	0.759	78%	0.783	S	S	*	*			trans	-72.8	85.5	166.3	-76.1	-31.9	0	0	0	108.7
1287	D	29.8	Very low	28.4	Very low	175 Å²	175	131.6 Å²	131.6	94%	0.936	78%	0.779	S	S	*	*			trans	-135.1	32.4	157.5	-88.4	-30.7	0	0	0	109.8	C1285	C1285-D1287 VanDerWaalsContact C-N 3.29Å; C1285-D1287 PolarHBondContact O-N 3.42Å; C1285-D1287 VanDerWaalsContact O-N 3.08Å
1288	S	29.3	Very low	28.2	Very low	97 Å²	97	133.5 Å²	133.5	68%	0.678	78%	0.784	S	S	*	*	S	Bend	trans	-134.1	124	167.1	40.1	0	0	0	0	108.4
1289	E	26.4	Very low	28	Very low	183 Å²	183	127.2 Å²	127.2	86%	0.855	77%	0.774	S	S	*	*			trans	-39.4	139.4	-165.9	-62.3	176	154	0	0	115.1	T1291	E1289-T1291 PolarHBondContact O-N 3.21Å; E1289-T1291 VanDerWaalsContact O-N 3.07Å
1290	P	27.7	Very low	27.7	Very low	123 Å²	123	129.2 Å²	129.2	80%	0.799	78%	0.776	S	S	*	*			trans	-68.7	110.6	-165.4	27.8	-33.5	0	0	0	111.1	T1292	P1290-T1292 PolarHBondContact O-N 3.19Å; P1290-T1292 VanDerWaalsContact O-N 3.09Å
1291	T	26.4	Very low	27.3	Very low	128 Å²	128	130.2 Å²	130.2	79%	0.785	78%	0.782	S	S	*	*			trans	-65	105.9	161.2	47.4	0	0	0	0	108.3	E1289 T1293	E1289-T1291 PolarHBondContact O-N 3.21Å; E1289-T1291 VanDerWaalsContact O-N 3.07Å; T1291-T1293 PolarHBondContact O-N 2.74Å
1292	T	25.8	Very low	27	Very low	122 Å²	122	125.9 Å²	125.9	75%	0.748	77%	0.77	S	S	*	*			trans	-56.5	108.8	169.7	48.5	0	0	0	0	109.2	P1290 V1294	P1290-T1292 PolarHBondContact O-N 3.19Å; P1290-T1292 VanDerWaalsContact O-N 3.09Å; T1292-V1294 PolarHBondContact O-N 3.5Å; T1292-V1294 VanDerWaalsContact O-N 3.07Å
1293	T	24.8	Very low	26.8	Very low	129 Å²	129	125.7 Å²	125.7	79%	0.791	77%	0.773	S	S	*	*			trans	-62.5	102.7	165.6	47.4	0	0	0	0	108.1	T1291	T1291-T1293 PolarHBondContact O-N 2.74Å
1294	V	27.6	Very low	26.4	Very low	128 Å²	128	125.4 Å²	125.4	78%	0.776	77%	0.771	S	S	*	*			trans	-90.9	106.4	167	-176.7	0	0	0	0	106.5	T1292 A1296	T1292-V1294 PolarHBondContact O-N 3.5Å; T1292-V1294 VanDerWaalsContact O-N 3.07Å; V1294-A1296 PolarHBondContact O-N 3.11Å
1295	D	26.4	Very low	26.1	Very low	141 Å²	141	129 Å²	129	75%	0.754	78%	0.78	S	S	*	*			trans	-51.4	130.4	172.7	-79.1	-40.4	0	0	0	110.4	V1297	D1295-V1297 PolarHBondContact O-N 3.46Å
1296	A	24.2	Very low	25.8	Very low	96 Å²	96	133.4 Å²	133.4	79%	0.793	79%	0.787	S	S	*	*			trans	-61.7	96.8	177	0	0	0	0	0	110	V1294 S1298	V1294-A1296 PolarHBondContact O-N 3.11Å; A1296-S1298 VanDerWaalsContact C-N 3.28Å; A1296-S1298 PolarHBondContact O-N 3.36Å
1297	V	26.1	Very low	25.5	Very low	142 Å²	142	137.6 Å²	137.6	86%	0.861	79%	0.792	S	S	*	*			trans	-71.4	94.4	161.7	-179.8	0	0	0	0	107.1	D1295 S1299	D1295-V1297 PolarHBondContact O-N 3.46Å; V1297-S1299 PolarHBondContact O-N 3.04Å
1298	S	23.9	Very low	25.3	Very low	94 Å²	94	134.1 Å²	134.1	66%	0.657	78%	0.781	S	S	*	*			trans	-54.5	120.9	168.2	54.5	0	0	0	0	110.8	A1296	A1296-S1298 VanDerWaalsContact C-N 3.28Å; A1296-S1298 PolarHBondContact O-N 3.36Å
1299	S	24.2	Very low	25.1	Very low	97 Å²	97	137 Å²	137	68%	0.678	79%	0.787	S	S	*	*	S	Bend	trans	25.4	104.3	143.2	59.2	0	0	0	0	117.5	V1297	V1297-S1299 PolarHBondContact O-N 3.04Å
1300	N	24.4	Very low	25	Very low	148 Å²	148	134 Å²	134	79%	0.791	79%	0.787	S	S	*	*				173.6	80.2	129.9	-87.2	-18.5	0	0	0	110.7
1301	V	25.5	Very low	24.9	Very low	144 Å²	144	132.6 Å²	132.6	87%	0.873	78%	0.78	S	S	*	*			trans	-130.1	67.3	152	-170.8	0	0	0	0	107.7
1302	S	22.3	Very low	24.7	Very low	94 Å²	94	137.7 Å²	137.7	66%	0.657	79%	0.785	S	S	*	*			trans	-69.4	133.3	155.1	52.1	0	0	0	0	108.8
1303	S	25.3	Very low	24.7	Very low	113 Å²	113	137.8 Å²	137.8	79%	0.79	79%	0.788	S	S	*	*	S	Bend	trans	65	83.3	160.6	67.5	0	0	0	0	118.6
1304	A	25.8	Very low	24.6	Very low	84 Å²	84	139.4 Å²	139.4	69%	0.694	79%	0.791	S	S	*	*			trans	-173.2	85.5	136.8	0	0	0	0	0	110
1305	F	25.5	Very low	24.4	Very low	216 Å²	216	137.1 Å²	137.1	95%	0.947	79%	0.793	S	S	*	*			trans	-168	61.1	146.1	-109.3	-76.5	0	0	0	109.3
1306	K	21.7	Very low	24.3	Very low	206 Å²	206	133.2 Å²	133.2	90%	0.896	79%	0.786	S	S	*	*			trans	-92.5	105.6	153.5	-90.9	-177.1	176.4	177.6	0	106.5
1307	R	23.3	Very low	24.2	Very low	229 Å²	229	135 Å²	135	86%	0.864	79%	0.787	S	S	*	*			trans	-174.7	108.3	142.8	-104.3	168.2	-166.3	-162.1	4	111
1308	S	25	Very low	24	Very low	102 Å²	102	139.4 Å²	139.4	71%	0.713	79%	0.79	S	S	*	*			trans	49.2	102.7	136.9	60.9	0	0	0	0	118.9
1309	I	25.9	Very low	24.1	Very low	157 Å²	157	140.8 Å²	140.8	81%	0.805	80%	0.795	S	S	*	*			trans	-134.3	89.4	133.6	-58.6	-178.1	0	0	0	107.5	S1311	I1309-S1311 PolarHBondContact O-N 3.34Å
1310	S	23.3	Very low	24.1	Very low	121 Å²	121	139.2 Å²	139.2	85%	0.846	79%	0.794	S	S	*	*			trans	-80.3	101.7	156.7	61.2	0	0	0	0	107.3
1311	S	25.6	Very low	24	Very low	94 Å²	94	140.7 Å²	140.7	66%	0.657	80%	0.796	S	S	*	*			trans	-145.2	96.3	156	52.6	0	0	0	0	108.1	I1309 P1313	I1309-S1311 PolarHBondContact O-N 3.34Å; S1311-P1313 WeakPolarHBondContact O-CD 3.47Å
1312	R	21.8	Very low	24	Very low	234 Å²	234	140.3 Å²	140.3	88%	0.883	79%	0.794	S	S	*	*			trans	-68.2	120.6	162.6	-80.8	177.7	170.8	174.2	-3.7	107	N1314	R1312-N1314 PolarHBondContact O-N 2.93Å
1313	P	25.4	Very low	24.2	Very low	125 Å²	125	142.8 Å²	142.8	81%	0.812	80%	0.8	S	S	*	*			trans	-79.2	97.2	161.7	20.1	-7.1	0	0	0	107.5	S1311	S1311-P1313 WeakPolarHBondContact O-CD 3.47Å
1314	N	24.3	Very low	24.1	Very low	163 Å²	163	148.7 Å²	148.7	87%	0.872	81%	0.805	S	S	*	*			trans	-71.8	116.6	151.8	-91.4	-7.8	0	0	0	107	R1312	R1312-N1314 PolarHBondContact O-N 2.93Å
1315	G	22.8	Very low	24.1	Very low	79 Å²	79	152.5 Å²	152.5	81%	0.814	81%	0.812	S	S	*	*			trans	158.5	127.3	170.7	0	0	0	0	0	109.6
1316	G	23.6	Very low	24	Very low	59 Å²	59	153 Å²	153	61%	0.608	81%	0.808	S	S	*	*			cis	-170.3	137.8	-1.7	0	0	0	0	0	104.9	Y1318	G1316-Y1318 PolarHBondContact O-N 3.47Å
1317	T	22.4	Very low	24.1	Very low	133 Å²	133	148.2 Å²	148.2	82%	0.816	80%	0.8	S	S	*	*			trans	-56.8	100.4	172.1	32.9	0	0	0	0	110	T1319	T1317-T1319 VanDerWaalsContact C-N 3.29Å; T1317-T1319 PolarHBondContact O-N 3.25Å
1318	Y	23.1	Very low	24.3	Very low	235 Å²	235	143.9 Å²	143.9	92%	0.922	80%	0.799	S	S	*	*			trans	-71.4	88.6	165.1	-101	-91.6	0	0	0	108.5	G1316 G1320	G1316-Y1318 PolarHBondContact O-N 3.47Å; Y1318-G1320 VanDerWaalsContact C-N 3.27Å; Y1318-G1320 PolarHBondContact O-N 2.92Å
1319	T	25	Very low	24.3	Very low	124 Å²	124	146.6 Å²	146.6	76%	0.761	81%	0.805	S	S	*	*			trans	-84.9	77.1	162.9	43.7	0	0	0	0	107.6	T1317 Q1321	T1317-T1319 VanDerWaalsContact C-N 3.29Å; T1317-T1319 PolarHBondContact O-N 3.25Å; T1319-Q1321 PolarHBondContact O-N 2.79Å
1320	G	24.1	Very low	24.4	Very low	63 Å²	63	143.9 Å²	143.9	65%	0.649	81%	0.806	S	S	*	*			trans	-68	102.4	172.4	0	0	0	0	0	109.7	Y1318 V1322	Y1318-G1320 VanDerWaalsContact C-N 3.27Å; Y1318-G1320 PolarHBondContact O-N 2.92Å; G1320-V1322 PolarHBondContact O-N 2.99Å
1321	Q	23.3	Very low	24.4	Very low	179 Å²	179	141.6 Å²	141.6	84%	0.836	80%	0.802	S	S	*	*			trans	-53	126	171.3	-79.6	179.6	-42.7	0	0	110.4	T1319 N1323	T1319-Q1321 PolarHBondContact O-N 2.79Å; Q1321-N1323 PolarHBondContact O-N 3.18Å
1322	V	25.6	Very low	24.5	Very low	137 Å²	137	144 Å²	144	83%	0.83	81%	0.812	S	S	*	*			trans	-61.6	97.1	171	177.8	0	0	0	0	108.4	G1320 R1324	G1320-V1322 PolarHBondContact O-N 2.99Å; V1322-R1324 PolarHBondContact O-N 3.06Å
1323	N	25.2	Very low	24.7	Very low	146 Å²	146	140.8 Å²	140.8	78%	0.781	81%	0.813	S	S	*	*			trans	-66.5	102.6	167.7	-90.9	-20.8	0	0	0	108.5	Q1321 I1325	Q1321-N1323 PolarHBondContact O-N 3.18Å; N1323-I1325 PolarHBondContact O-N 3.36Å
1324	R	23.9	Very low	24.8	Very low	236 Å²	236	138.1 Å²	138.1	89%	0.891	81%	0.808	S	S	*	*			trans	-53.2	100.3	164.2	-83.5	178.4	171.5	171.2	-2.8	109.2	V1322 R1326	V1322-R1324 PolarHBondContact O-N 3.06Å; R1324-R1326 PolarHBondContact O-N 3.46Å
1325	I	25.6	Very low	25.5	Very low	164 Å²	164	136.3 Å²	136.3	84%	0.841	81%	0.805	S	S	*	*			trans	-75	111.7	161.6	-63.4	176.6	0	0	0	106.5	N1323	N1323-I1325 PolarHBondContact O-N 3.36Å
1326	R	23.4	Very low	25.6	Very low	228 Å²	228	137.6 Å²	137.6	86%	0.86	80%	0.801	S	S	*	*			trans	-55.6	132.3	175.6	-90.3	174.4	167.7	165.2	-4.2	110.5	R1324 T1328	R1324-R1326 PolarHBondContact O-N 3.46Å; R1326-T1328 PolarHBondContact O-N 3.39Å
1327	S	24.2	Very low	25.7	Very low	104 Å²	104	142.3 Å²	142.3	73%	0.727	81%	0.813	S	S	*	*			trans	-54.2	111.7	163.9	52.5	0	0	0	0	111.5
1328	T	26.7	Very low	25.6	Very low	139 Å²	139	142 Å²	142	85%	0.853	82%	0.815	S	S	*	*			trans	-88.9	102.9	156.5	44	0	0	0	0	108.1	R1326 A1330	R1326-T1328 PolarHBondContact O-N 3.39Å; T1328-A1330 PolarHBondContact O-N 3.41Å
1329	N	24.5	Very low	25.6	Very low	158 Å²	158	138 Å²	138	85%	0.845	81%	0.809	S	S	*	*			trans	-59.5	116	163.1	-79.4	-19.9	0	0	0	109.2
1330	A	28.1	Very low	25.6	Very low	100 Å²	100	139.7 Å²	139.7	83%	0.826	81%	0.809	S	S	*	*			trans	-126.7	97.1	155.9	0	0	0	0	0	106.3	T1328	T1328-A1330 PolarHBondContact O-N 3.41Å
1331	G	23.7	Very low	25.6	Very low	73 Å²	73	145.8 Å²	145.8	75%	0.753	83%	0.825	S	S	*	*			trans	-75.8	137.1	172.2	0	0	0	0	0	110.2
1332	V	28.4	Very low	25.6	Very low	145 Å²	145	143.2 Å²	143.2	88%	0.879	82%	0.817	S	S	*	*			trans	-141.7	115.1	149.2	179.6	0	0	0	0	106.8
1333	N	25	Very low	25.6	Very low	166 Å²	166	143.7 Å²	143.7	89%	0.888	81%	0.813	S	S	*	*			trans	-68.7	144.3	168.8	-68.4	-39.9	0	0	0	110.2
1334	G	28.9	Very low	25.6	Very low	69 Å²	69	140.4 Å²	140.4	71%	0.711	81%	0.813	S	S	*	*			trans	174.1	120.9	164.2	0	0	0	0	0	111.6
1335	P	38	Very low	25.5	Very low	126 Å²	126	140 Å²	140	82%	0.818	81%	0.812	S	S	*	*			trans	-92.1	164	-152.6	36.5	-36	0	0	0	115.4
1336	S	24.5	Very low	25.5	Very low	105 Å²	105	139.4 Å²	139.4	73%	0.734	81%	0.811	S	S	*	*			trans	-38.7	127.4	159.2	50.2	0	0	0	0	114.6
1337	D	25.9	Very low	25.6	Very low	158 Å²	158	134 Å²	134	85%	0.845	80%	0.802	S	S	*	*			trans	-149.6	94.2	144.7	-98.6	-23	0	0	0	107.5
1338	C	20.9	Very low	25.6	Very low	128 Å²	128	135 Å²	135	87%	0.865	81%	0.808	S	S	*	*			trans	-108.4	89.6	163	-79.2	0	0	0	0	105.8
1339	D	22.8	Very low	25.4	Very low	150 Å²	150	136 Å²	136	80%	0.802	80%	0.803	S	S	*	*			trans	-144.7	130.8	162.9	-95.3	-29.3	0	0	0	110.6
1340	E	24.5	Very low	25.5	Very low	160 Å²	160	136.5 Å²	136.5	75%	0.748	80%	0.8	S	S	*	*			trans	47.8	103.1	155.8	-61.4	-166.8	147.4	0	0	120.7
1341	L	25.1	Very low	25.6	Very low	190 Å²	190	138.2 Å²	138.2	100%	0.995	80%	0.801	S	S	*	*			trans	-109.5	78.1	153	-96.7	155.7	0	0	0	109.6
1342	L	23.8	Very low	25.6	Very low	126 Å²	126	138 Å²	138	66%	0.66	80%	0.799	S	S	*	*			trans	-94.5	124.5	163.3	-88.4	163.9	0	0	0	109.6
1343	I	24.2	Very low	25.5	Very low	146 Å²	146	141 Å²	141	75%	0.749	80%	0.8	S	S	*	*			trans	61.8	79.3	148.1	-45.4	172.9	0	0	0	116.3
1344	G	25	Very low	25.3	Very low	77 Å²	77	139.2 Å²	139.2	79%	0.794	80%	0.799	S	S	*	*			trans	-92	93.1	160.7	0	0	0	0	0	111.4	N1346	G1344-N1346 PolarHBondContact O-N 2.81Å
1345	R	23.1	Very low	25.3	Very low	227 Å²	227	141.4 Å²	141.4	86%	0.857	80%	0.801	S	S	*	*			trans	-81.9	85.6	176.9	-150.3	-176.9	-164.2	177.6	2.6	108.7	V1347	R1345-V1347 PolarHBondContact O-N 3.31Å
1346	N	25.1	Very low	24.7	Very low	152 Å²	152	142.3 Å²	142.3	81%	0.813	80%	0.797	S	S	*	*			trans	-82.6	99.1	175.2	-81.1	-8.6	0	0	0	110.5	G1344 C1348	G1344-N1346 PolarHBondContact O-N 2.81Å; N1346-C1348 PolarHBondContact O-N 3.33Å
1347	V	24.5	Very low	24.9	Very low	114 Å²	114	143.7 Å²	143.7	69%	0.691	80%	0.801	S	S	*	*			trans	-64.9	107.4	160.3	175.2	0	0	0	0	107.2	R1345 E1349	R1345-V1347 PolarHBondContact O-N 3.31Å; V1347-E1349 HydrophobicContact CG1-CG 4.09Å
1348	C	25.1	Very low	24.9	Very low	125 Å²	125	142.8 Å²	142.8	85%	0.845	80%	0.797	S	S	*	*			trans	-100.2	92.5	163.3	-73.9	0	0	0	0	107.6	N1346	N1346-C1348 PolarHBondContact O-N 3.33Å
1349	E	23.2	Very low	25.1	Very low	161 Å²	161	142.5 Å²	142.5	75%	0.752	79%	0.786	S	S	*	*			trans	-75.8	147.2	161.4	-92.2	176.9	155.3	0	0	110.6	V1347	V1347-E1349 HydrophobicContact CG1-CG 4.09Å
1350	E	25.8	Very low	25.2	Very low	168 Å²	168	145.9 Å²	145.9	79%	0.785	79%	0.788	S	S	*	*			trans	88.8	131.3	146.9	-79.8	-171.2	165.2	0	0	123.3
1351	T	29.2	Very low	25.4	Very low	137 Å²	137	143.7 Å²	143.7	84%	0.84	79%	0.79	S	S	*	*			trans	77.6	118.3	162.6	73.8	0	0	0	0	116.2
1352	G	24.7	Very low	25.3	Very low	68 Å²	68	139.5 Å²	139.5	70%	0.701	78%	0.783	S	S	*	*			cis	108	91.4	26.6	0	0	0	0	0	109.3
1353	K	26.3	Very low	25.5	Very low	207 Å²	207	139.7 Å²	139.7	90%	0.9	79%	0.789	S	S	*	*			trans	163.8	94.8	149.9	-91.7	162.3	-173.8	-178.1	0	110.2	P1355	K1353-P1355 WeakPolarHBondContact O-CD 3.43Å
1354	C	21.3	Very low	25.5	Very low	130 Å²	130	138 Å²	138	88%	0.878	79%	0.791	S	S	*	*			trans	-81.2	115.3	158.2	-69.2	0	0	0	0	108	I1356	C1354-I1356 PolarHBondContact O-N 3.31Å
1355	P	28.4	Very low	25.5	Very low	114 Å²	114	142.2 Å²	142.2	74%	0.74	79%	0.794	S	S	*	*			trans	-80.3	120.7	168.3	31.3	-26.7	0	0	0	108.7	K1353 T1357	K1353-P1355 WeakPolarHBondContact O-CD 3.43Å; P1355-T1357 PolarHBondContact O-N 3.45Å
1356	I	24.6	Very low	25.6	Very low	146 Å²	146	140.6 Å²	140.6	75%	0.749	79%	0.793	S	S	*	*			trans	-64.5	121.1	162.6	-63.8	163.7	0	0	0	106.9	C1354	C1354-I1356 PolarHBondContact O-N 3.31Å
1357	T	28.4	Very low	25.7	Very low	133 Å²	133	140.7 Å²	140.7	82%	0.816	79%	0.794	S	S	*	*			trans	-129.9	110.5	158.6	48.6	0	0	0	0	108.3	P1355	P1355-T1357 PolarHBondContact O-N 3.45Å
1358	D	27.2	Very low	25.8	Very low	140 Å²	140	144.8 Å²	144.8	75%	0.749	80%	0.802	S	S	*	*			trans	-67.1	150.9	174.2	-84.5	-41.1	0	0	0	113.1
1359	D	25.3	Very low	25.9	Very low	121 Å²	121	145.1 Å²	145.1	65%	0.647	80%	0.803	S	S	*	*			trans	68.8	118.8	141.9	-92.5	5.4	0	0	0	123.1
1360	R	24.7	Very low	26.1	Very low	221 Å²	221	143 Å²	143	83%	0.834	81%	0.806	S	S	*	*			trans	72.2	103.1	135.5	-62.8	172.9	-168.7	-150.6	-3.3	118.7
1361	S	28.7	Very low	26.2	Very low	114 Å²	114	139.6 Å²	139.6	80%	0.797	81%	0.807	S	S	*	*				-166.7	104.4	124.3	53.5	0	0	0	0	110.7
1362	A	23.3	Very low	26.1	Very low	102 Å²	102	139.6 Å²	139.6	84%	0.843	81%	0.806	S	S	*	*			trans	-79.9	114.4	163	0	0	0	0	0	108.8
1363	T	27	Very low	26.1	Very low	130 Å²	130	141 Å²	141	80%	0.798	81%	0.805	S	S	*	*			trans	-151.7	104.3	157.6	38.9	0	0	0	0	110.5
1364	S	25.5	Very low	26.1	Very low	112 Å²	112	136.9 Å²	136.9	78%	0.783	80%	0.797	S	S	*	*			trans	35.1	110.4	141.4	-158.7	0	0	0	0	119.2
1365	L	23.2	Very low	26.3	Very low	165 Å²	165	139.3 Å²	139.3	86%	0.864	80%	0.796	S	S	*	*			trans	-28.6	129	143.2	-73.5	123.7	0	0	0	112.8
1366	K	27	Very low	26.2	Very low	192 Å²	192	142.7 Å²	142.7	84%	0.835	80%	0.799	S	S	*	*			trans	-153.6	109.5	146.4	-105.2	-177.5	-175.6	-175.2	0	109.5
1367	D	27.5	Very low	26.3	Very low	155 Å²	155	141.8 Å²	141.8	83%	0.829	80%	0.801	S	S	*	*			trans	4.1	115.3	156.2	-55.5	-43.7	0	0	0	118
1368	K	25	Very low	26.2	Very low	199 Å²	199	142.7 Å²	142.7	87%	0.865	80%	0.799	S	S	*	*			trans	-128	120.7	152.7	-92.9	-176	176	178.7	0	108.9	S1370	K1368-S1370 PolarHBondContact O-N 3.36Å
1369	P	28.7	Very low	26.1	Very low	132 Å²	132	142 Å²	142	86%	0.857	80%	0.8	S	S	*	*			trans	-79.1	118.8	178.7	31.4	-29.3	0	0	0	108.9
1370	S	27.2	Very low	26.2	Very low	118 Å²	118	139.9 Å²	139.9	83%	0.825	80%	0.799	S	S	*	*			trans	-83.8	126.8	176.5	50.9	0	0	0	0	110.8	K1368	K1368-S1370 PolarHBondContact O-N 3.36Å
1371	A	27.1	Very low	26.3	Very low	96 Å²	96	137.4 Å²	137.4	79%	0.793	80%	0.797	S	S	*	*			trans	-39.7	136.2	178	0	0	0	0	0	115.3	S1373	A1371-S1373 PolarHBondContact O-N 3.22Å; A1371-S1373 VanDerWaalsContact O-N 3.15Å
1372	V	26.7	Very low	26.3	Very low	137 Å²	137	137.8 Å²	137.8	83%	0.83	79%	0.794	S	S	*	*			trans	-65.7	102.7	170.9	177.7	0	0	0	0	108.9	T1374	V1372-T1374 PolarHBondContact O-N 3.21Å
1373	S	26.3	Very low	26.5	Very low	96 Å²	96	141 Å²	141	67%	0.671	79%	0.791	S	S	*	*			trans	-78.1	107.7	164.9	61.4	0	0	0	0	109	A1371	A1371-S1373 PolarHBondContact O-N 3.22Å; A1371-S1373 VanDerWaalsContact O-N 3.15Å
1374	T	25.6	Very low	26.6	Very low	121 Å²	121	139.5 Å²	139.5	74%	0.742	79%	0.792	S	S	*	*			trans	-58.2	150.7	162.9	44.1	0	0	0	0	111.4	V1372	V1372-T1374 PolarHBondContact O-N 3.21Å
1375	E	25.3	Very low	26.8	Very low	181 Å²	181	138.4 Å²	138.4	85%	0.846	79%	0.79	S	S	*	*			trans	99.6	69.6	177.5	-57.4	-171.4	163.9	0	0	115.6
1376	F	26	Very low	26.9	Very low	185 Å²	185	135.2 Å²	135.2	81%	0.811	79%	0.787	S	S	*	*			trans	-109.1	105.8	149.3	-84.8	-84.8	0	0	0	108.6	I1378	F1376-I1378 PolarHBondContact O-N 3.31Å
1377	V	26.2	Very low	27.1	Very low	128 Å²	128	134.9 Å²	134.9	78%	0.776	81%	0.809	S	S	*	*			trans	-71.8	102.9	170.9	176.5	0	0	0	0	107.6	T1379	V1377-T1379 PolarHBondContact O-N 3.24Å; V1377-T1379 VanDerWaalsContact O-N 3.16Å
1378	I	26.8	Very low	27.1	Very low	152 Å²	152	133.9 Å²	133.9	78%	0.779	81%	0.808	S	S	*	*			trans	-79.6	93.7	176.3	-58.1	173.8	0	0	0	108.3	F1376 A1380	F1376-I1378 PolarHBondContact O-N 3.31Å; I1378-A1380 VanDerWaalsContact C-N 3.35Å; I1378-A1380 HydrophobicContact CG2-CB 4.38Å; I1378-A1380 PolarHBondContact O-N 3.37Å; I1378-A1380 VanDerWaalsContact O-N 3.16Å
1379	T	24.4	Very low	27.2	Very low	126 Å²	126	130.4 Å²	130.4	77%	0.773	80%	0.804	S	S	*	*			trans	-77.9	88.3	160.6	38.4	0	0	0	0	108.9	V1377 Q1381	V1377-T1379 PolarHBondContact O-N 3.24Å; V1377-T1379 VanDerWaalsContact O-N 3.16Å; T1379-Q1381 PolarHBondContact O-N 3.3Å; T1379-Q1381 VanDerWaalsContact O-N 3.11Å
1380	A	27.7	Very low	27.1	Very low	75 Å²	75	130.3 Å²	130.3	62%	0.62	80%	0.802	S	S	*	*			trans	-71.3	97.4	168.7	0	0	0	0	0	109.4	I1378 V1382	I1378-A1380 VanDerWaalsContact C-N 3.35Å; I1378-A1380 HydrophobicContact CG2-CB 4.38Å; I1378-A1380 PolarHBondContact O-N 3.37Å; I1378-A1380 VanDerWaalsContact O-N 3.16Å; A1380-V1382 VanDerWaalsContact C-N 3.29Å; A1380-V1382 HydrophobicContact CB-CG2 4.44Å; A1380-V1382 PolarHBondContact O-N 3.26Å
1381	Q	26.2	Very low	27.1	Very low	170 Å²	170	131.1 Å²	131.1	79%	0.794	80%	0.8	S	S	*	*			trans	-71.9	90.5	161.4	-85.2	-178.5	-28.9	0	0	108.3	T1379 H1383	T1379-Q1381 PolarHBondContact O-N 3.3Å; T1379-Q1381 VanDerWaalsContact O-N 3.11Å; Q1381-H1383 PolarHBondContact O-N 3.2Å; Q1381-H1383 VanDerWaalsContact O-N 3.11Å
1382	V	29.1	Very low	27.1	Very low	121 Å²	121	133.3 Å²	133.3	73%	0.733	80%	0.801	S	S	*	*			trans	-71.4	100.9	169.8	179.7	0	0	0	0	107.4	A1380 A1384	A1380-V1382 VanDerWaalsContact C-N 3.29Å; A1380-V1382 HydrophobicContact CB-CG2 4.44Å; A1380-V1382 PolarHBondContact O-N 3.26Å; V1382-A1384 VanDerWaalsContact C-N 3.31Å; V1382-A1384 PolarHBondContact O-N 2.95Å
1383	H	28.6	Very low	27.2	Very low	171 Å²	171	133 Å²	133	79%	0.792	80%	0.799	S	S	*	*			trans	-65.4	95.8	162.5	-85	-87.8	0	0	0	108	Q1381 A1385	Q1381-H1383 PolarHBondContact O-N 3.2Å; Q1381-H1383 VanDerWaalsContact O-N 3.11Å; H1383-A1385 PolarHBondContact O-N 3.18Å
1384	A	29.3	Very low	27.2	Very low	97 Å²	97	135.6 Å²	135.6	80%	0.802	81%	0.808	S	S	*	*			trans	-71.4	81	167.1	0	0	0	0	0	108.9	V1382	V1382-A1384 VanDerWaalsContact C-N 3.31Å; V1382-A1384 PolarHBondContact O-N 2.95Å
1385	A	28.6	Very low	27.3	Very low	90 Å²	90	136.8 Å²	136.8	74%	0.744	81%	0.813	S	S	*	*			trans	-93.9	83.6	159.1	0	0	0	0	0	107.2	H1383 S1387	H1383-A1385 PolarHBondContact O-N 3.18Å; A1385-S1387 PolarHBondContact O-N 2.94Å
1386	A	26.4	Very low	27.5	Very low	97 Å²	97	133.1 Å²	133.1	80%	0.802	81%	0.81	S	S	*	*			trans	-77.5	101.6	164.7	0	0	0	0	0	107.9
1387	S	30.7	Very low	27.6	Very low	185 Å²	185	128.4 Å²	128.4	100%	1.294	81%	0.81	S	S	*	*			trans	-164.4	0	155.1	65.2	0	0	0	0	109.7	A1385	A1385-S1387 PolarHBondContact O-N 2.94Å

Retrieved 1,387 of 1,387 residues in 689.7 ms (Link to these results)

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