A0A096N1P2_PAPAN Loading...

SH3 domain-binding protein 4

May function in transferrin receptor internalization at the plasma membrane through a cargo-specific control of clathrin-mediated endocytosis. Alternatively, may act as a negative regulator of the amino acid-induced TOR signaling by inhibiting the formation of active Rag GTPase complexes. Preferentially binds inactive Rag GTPase complexes and prevents their interaction with the mTORC1 complex inhibiting its relocalization to lysosomes and its activation. Thereby, may indirectly regulate cell growth, proliferation and autophagy.

AlphaFold DB , UniProt , Accession A0A096N1P2, Species PAPAN (Papio anubis, Olive baboon), Gene SH3BP4, Length 963 aa.

						>A0A096N1P2_PAPAN|A0A096N1P2|SH3BP4
MAAQRIRAANSSGLPRCKSEGTLIDLSEGFSETSFNDVKVPSPSALLVDNPTPFGNAKEVIAIKDYCPTNFTTLKFSKGDHLYVLDTSGGEWWYAHNTTEMGYIPSSYVQPLNYRNSTLSDSGMIDNLPDSPDEVAKELDLLGGWMDDKKVPGRTYSNNPFWNGVQTNPFLNGNVPVTPSLDELNPKSTVDLLLFDTGTSSFTESSSATTNSTGNIFDELPVTNGLHAEPPVRRDNPFFRSKRSYSLSELSVLQAKSDAPTSSSFFTGLKSPAPEQFQSREDFRTAWLNHRKLARSCHDLDLLGQSPGWGQTQAVETNIVCKLDSSGGAVQLPDTSISIHVPEGHVAPGETQQISMKALLDPPLELNSDRSCSISPVLEVKLSNLEVKTSIILEMKVSAEIKNDLFSKSTVGLQCLRSDSKEGPYVSVPLNCSCGDTVQAQLHNLEPCMYVAIVAHGPSILYPSTVWDFIHKKVTVGLYGPKHIHPSFKTVVTIFGHDCAPKTLLVSEVTRQAPNPAPVALQLWGKHQFVLSRPQDLKVCMFSNMTNYEVKASEQAKVVRGFQLKLGKVSRLIFPITSQNPNELSDFTLRVQVKDDQEAILTQFCVQTPQPPPKSAIKPSGQRRFLKKNEVGKIILSPFATTTKYPTFQDRPVSSLKFGKLLKTVVRQNKNHYLLEYKKGDGIALLSEERVRLRGQLWTKEWYIGYYQGRVGLVHTKNVLVVGRARPSLCSGPELSTSVLLEQILRPCKFLTYIYASVRTLLMENISSWRSFADALGYVNLPLTFFCRAELDSEPERVASVLEKLKEDCNNTESKDRKSFQKELVMALLKMDCQGLVVRLIQDFVLLTTAVEVAQRWRELAEKLAKVSKQQMDAYESPHRDRNGVVDSEAMWKPAYDFLLTWSHQIGDSYRDVIQELHLGLDKMKNPITKRWKHLTGTLILVNSLDILRAAAFSPADQDDFVI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.4	Very low	30.1	Very low	247 Å²	247	153.2 Å²	153.2	100%	1.217	85%	0.852	S	S	*	*				0	134.9	0	-58.7	179	-75.8	0	0	108.3
2	A	34.4	Very low	30	Very low	101 Å²	101	150.6 Å²	150.6	84%	0.835	85%	0.852	S	S	*	*			cis	-162.1	52.5	-18.9	0	0	0	0	0	111.9
3	A	29.1	Very low	29.6	Very low	96 Å²	96	145 Å²	145	79%	0.793	85%	0.849	S	S	*	*			trans	-162	114.5	173.9	0	0	0	0	0	114.1
4	Q	30.4	Very low	29.4	Very low	156 Å²	156	146.9 Å²	146.9	73%	0.729	85%	0.852	S	S	*	*			trans	-162	155.6	164.2	-71.5	-158.2	25.9	0	0	108.9
5	R	31.6	Very low	30.1	Very low	212 Å²	212	143.8 Å²	143.8	80%	0.8	84%	0.839	S	S	*	*			cis	-164.7	162.9	-18.4	-106	177.4	-173.4	156.6	-10.9	107.8
6	I	35.1	Very low	29.8	Very low	169 Å²	169	149 Å²	149	87%	0.867	84%	0.84	S	S	*	*			trans	-109.1	128.7	172	-61.4	170.6	0	0	0	110.5
7	R	30.1	Very low	29.4	Very low	239 Å²	239	146.8 Å²	146.8	90%	0.902	84%	0.835	S	S	*	*			trans	-172.1	160.4	145.7	-152.7	166.5	-76.1	-162.4	-3.7	113.7
8	A	26.3	Very low	29.3	Very low	100 Å²	100	149.7 Å²	149.7	83%	0.826	84%	0.836	S	S	*	*			trans	101.1	145.1	156.7	0	0	0	0	0	118
9	A	27.8	Very low	29.2	Very low	90 Å²	90	147 Å²	147	74%	0.744	83%	0.829	S	S	*	*			trans	-164.1	168.8	-171.4	0	0	0	0	0	113.2
10	N	28.7	Very low	29	Very low	158 Å²	158	148.9 Å²	148.9	85%	0.845	83%	0.83	S	S	*	*			trans	69.3	119.9	158.9	-66.3	-3.2	0	0	0	121.9
11	S	26.5	Very low	28.9	Very low	117 Å²	117	145 Å²	145	82%	0.818	82%	0.824	S	S	*	*				168.6	153.8	124.2	42.2	0	0	0	0	110.8
12	S	28.7	Very low	28.7	Very low	122 Å²	122	139.3 Å²	139.3	85%	0.853	80%	0.803	S	S	*	*			cis	-175.5	140.2	-32	50.7	0	0	0	0	109.6
13	G	24.6	Very low	28.2	Very low	78 Å²	78	141.5 Å²	141.5	80%	0.804	80%	0.8	S	S	*	*			trans	-179.5	130.7	168.9	0	0	0	0	0	115.3
14	L	26.2	Very low	28.1	Very low	172 Å²	172	143.6 Å²	143.6	90%	0.901	80%	0.797	S	S	*	*			trans	-146.3	178.2	-175.5	-82.2	173.3	0	0	0	108.8
15	P	40.1	Very low	27.9	Very low	100 Å²	100	143.1 Å²	143.1	65%	0.649	80%	0.799	S	S	*	*			cis	-123.6	-143.1	7.6	33	-7.8	0	0	0	111.4
16	R	25.2	Very low	27.7	Very low	227 Å²	227	139.7 Å²	139.7	86%	0.857	80%	0.796	S	S	*	*			cis	-156.9	-171.5	6	-146.9	174.8	-173.5	97.7	1.7	110.7
17	C	24.1	Very low	27.2	Very low	111 Å²	111	136.2 Å²	136.2	75%	0.75	79%	0.787	S	S	*	*			trans	-139.6	173.4	-174.2	-47.7	0	0	0	0	113.9
18	K	27.2	Very low	26.9	Very low	199 Å²	199	134 Å²	134	87%	0.865	79%	0.786	S	S	*	*			trans	85.9	153	168.4	-51.9	-168.2	176.1	-167	0	116.1
19	S	26.9	Very low	26.8	Very low	99 Å²	99	132.8 Å²	132.8	69%	0.692	78%	0.784	S	S	*	*			cis	-154.4	-172.2	9.1	2	0	0	0	0	113.2
20	E	26.4	Very low	26.7	Very low	184 Å²	184	138 Å²	138	86%	0.86	79%	0.791	S	S	*	*			trans	-42.7	165.3	172	-55.6	110.6	131.3	0	0	116.6
21	G	25.8	Very low	26.5	Very low	67 Å²	67	135.5 Å²	135.5	69%	0.691	79%	0.785	S	S	*	*			cis	155	-179.7	1.2	0	0	0	0	0	112.1
22	T	26.8	Very low	26.4	Very low	129 Å²	129	138.3 Å²	138.3	79%	0.791	79%	0.785	S	S	*	*			trans	88.9	110.3	154.3	-50.4	0	0	0	0	122.2
23	L	24.6	Very low	26.3	Very low	146 Å²	146	139.4 Å²	139.4	76%	0.764	79%	0.787	S	S	*	*			trans	68.4	130.6	142.5	-60.5	173.8	0	0	0	126.7
24	I	27.3	Very low	26.2	Very low	141 Å²	141	140.9 Å²	140.9	72%	0.723	79%	0.785	S	S	*	*			trans	70.2	101	132	-62.4	173	0	0	0	122.3
25	D	25	Very low	26.2	Very low	145 Å²	145	141.7 Å²	141.7	78%	0.775	78%	0.782	S	S	*	*				66.7	157.7	113.1	-145.9	12.6	0	0	0	125.1
26	L	27.9	Very low	25.4	Very low	141 Å²	141	143.5 Å²	143.5	74%	0.738	79%	0.786	S	S	*	*			trans	93.5	124.6	159.7	-64.2	175.5	0	0	0	123.8
27	S	24	Very low	25.3	Very low	96 Å²	96	139.9 Å²	139.9	67%	0.671	78%	0.783	S	S	*	*			trans	71.8	117.3	137.7	61	0	0	0	0	124.8
28	E	25.5	Very low	25.4	Very low	191 Å²	191	139.9 Å²	139.9	89%	0.893	78%	0.78	S	S	*	*				64.2	140.2	129.4	-59.3	-171.4	126.7	0	0	123.7
29	G	24.2	Very low	25.1	Very low	76 Å²	76	139.8 Å²	139.8	78%	0.784	78%	0.779	S	S	*	*			trans	169.4	109	169.3	0	0	0	0	0	114.8
30	F	24.4	Very low	25.4	Very low	200 Å²	200	141.2 Å²	141.2	88%	0.877	78%	0.784	S	S	*	*			trans	-87.1	179.6	174.3	-70	-106.1	0	0	0	111.2
31	S	24.2	Very low	25.4	Very low	104 Å²	104	138 Å²	138	73%	0.727	78%	0.779	S	S	*	*			cis	-158.7	154.1	9.9	45.5	0	0	0	0	113.4
32	E	25.1	Very low	25.3	Very low	177 Å²	177	140.2 Å²	140.2	83%	0.827	78%	0.784	S	S	*	*			trans	3.2	148.2	147.1	-52.1	-176.9	139.3	0	0	124.3
33	T	25.8	Very low	25.7	Very low	145 Å²	145	140.1 Å²	140.1	89%	0.89	79%	0.785	S	S	*	*				-175.6	148.2	125.6	18.2	0	0	0	0	108.9
34	S	22.8	Very low	25.8	Very low	109 Å²	109	139 Å²	139	76%	0.762	79%	0.79	S	S	*	*			cis	-151.6	164.9	-4.3	-173.2	0	0	0	0	109.9
35	F	26	Very low	25.8	Very low	189 Å²	189	137.4 Å²	137.4	83%	0.829	80%	0.797	S	S	*	*			trans	-143.4	158.4	-177.7	-111.9	-80.2	0	0	0	113.6
36	N	23.1	Very low	26.3	Very low	137 Å²	137	138.2 Å²	138.2	73%	0.733	80%	0.801	S	S	*	*			trans	80.9	132.5	173	-48.1	-48.1	0	0	0	115.4
37	D	23.7	Very low	26.4	Very low	151 Å²	151	139.4 Å²	139.4	81%	0.807	81%	0.807	S	S	*	*				-125	137	53.9	-89.9	-41.2	0	0	0	114.2
38	V	26.4	Very low	26.6	Very low	112 Å²	112	140.8 Å²	140.8	68%	0.679	81%	0.811	S	S	*	*				66.8	123.1	80.6	176	0	0	0	0	112.2
39	K	22	Very low	26.7	Very low	196 Å²	196	138 Å²	138	85%	0.852	80%	0.802	S	S	*	*			cis	-154	166.8	28.6	-151.7	165	-175.1	173.1	0	113.3
40	V	33.2	Very low	26.8	Very low	129 Å²	129	141.2 Å²	141.2	78%	0.782	80%	0.802	S	S	*	*			trans	-95.9	145.6	178.6	175	0	0	0	0	113
41	P	25	Very low	27.5	Very low	117 Å²	117	136.5 Å²	136.5	76%	0.76	79%	0.791	S	S	*	*			trans	-110.5	157.9	151	36.4	-28.4	0	0	0	113.6
42	S	24	Very low	27.6	Very low	113 Å²	113	138 Å²	138	79%	0.79	80%	0.796	S	S	*	*			trans	-89.2	166.7	-162.8	-56.3	0	0	0	0	115.2	S44	S42-S44 PolarHBondContact O-N 3.37Å
43	P	35	Very low	28.4	Very low	127 Å²	127	135 Å²	135	83%	0.825	79%	0.792	S	S	*	*	S	Bend	trans	-82.6	99.8	-168.4	32	-34.8	0	0	0	113.7
44	S	27.1	Very low	28.8	Very low	123 Å²	123	138.1 Å²	138.1	86%	0.86	79%	0.794	S	S	*	*			trans	-162	77.8	160.1	-80.7	0	0	0	0	111.1	S42	S42-S44 PolarHBondContact O-N 3.37Å
45	A	27.4	Very low	29.3	Very low	107 Å²	107	135.9 Å²	135.9	88%	0.884	79%	0.788	S	S	*	*			trans	-143.2	75.6	170.7	0	0	0	0	0	109.2
46	L	35.8	Very low	30.2	Very low	162 Å²	162	134.7 Å²	134.7	85%	0.848	79%	0.79	S	S	*	*			trans	-83.6	159.8	168.4	-72.7	170.9	0	0	0	110.1
47	L	29.3	Very low	31.6	Very low	167 Å²	167	130.3 Å²	130.3	87%	0.874	77%	0.773	S	S	*	*			trans	88.4	143.5	167.9	-48.1	175.2	0	0	0	117.7
48	V	27.9	Very low	33.9	Very low	124 Å²	124	129.7 Å²	129.7	75%	0.752	76%	0.763	S	S	*	*			trans	77.4	78.7	164.7	-159.2	0	0	0	0	118.5
49	D	27.4	Very low	36.7	Very low	132 Å²	132	126.8 Å²	126.8	71%	0.706	74%	0.742	S	S	*	*				61.3	121.6	116.2	-55	-8.6	0	0	0	123.5
50	N	27.2	Very low	39.7	Very low	145 Å²	145	117.6 Å²	117.6	78%	0.775	70%	0.702	S	S	*	*				90.8	152.1	125.9	-83.6	-27.1	0	0	0	121
51	P	40.3	Very low	42.4	Very low	101 Å²	101	114.1 Å²	114.1	66%	0.656	68%	0.679	S	S	*	*				-140.5	-171.7	-102.6	41.2	-21.3	0	0	0	114.7
52	T	25.8	Very low	45.4	Very low	136 Å²	136	108.6 Å²	108.6	83%	0.834	64%	0.643	S	S	*	*			trans	176.2	157.6	145.7	23.5	0	0	0	0	110.5
53	P	40.8	Very low	48.4	Very low	113 Å²	113	106.2 Å²	106.2	73%	0.734	62%	0.621	S	S	*	*			cis	-135.6	126.5	-49	31.3	-12.3	0	0	0	113.4	G55	P53-G55 PolarHBondContact O-N 3.14Å; P53-G55 VanDerWaalsContact O-N 3.12Å
54	F	35.6	Very low	50.8	Low	211 Å²	211	105 Å²	105	93%	0.925	60%	0.602	S	S	*	*			trans	-79.8	89.6	165	-81.6	-81.9	0	0	0	110.7
55	G	32.7	Very low	53.5	Low	62 Å²	62	103.9 Å²	103.9	64%	0.639	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	139.1	175.1	0	0	0	0	0	112.8	P53	P53-G55 PolarHBondContact O-N 3.14Å; P53-G55 VanDerWaalsContact O-N 3.12Å
56	N	44	Very low	56	Low	164 Å²	164	100.2 Å²	100.2	88%	0.877	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	84.7	8.4	171.5	-51	-26.2	0	0	0	119	K58	N56-K58 PolarHBondContact O-N 2.79Å
57	A	53	Low	58	Low	45 Å²	45	97.2 Å²	97.2	37%	0.372	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-65	131.1	161.8	0	0	0	0	0	110.1	V84 L85	A57-V84 WeakPolarHBondContact CA-O 3.39Å; A57-L85 HydrophobicContact CB-CD2 4.41Å
58	K	71.9	Confident	60	Low	138 Å²	138	91.7 Å²	91.7	60%	0.6	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	118.2	178.4	-73	-179.8	179.9	174.2	0	110.6	N56 V84	N56-K58 PolarHBondContact O-N 2.79Å; K58-V84 HydrophobicContact CB-CB 4.3Å; K58-V84 PolarHBondContact N-O 2.82Å; K58-V84 WeakPolarHBondContact O-CB 3.37Å; K58-V84 PolarHBondContact O-N 2.97Å
59	E	84.8	Confident	61.1	Low	51 Å²	51	92.4 Å²	92.4	24%	0.238	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	134.4	175.3	-167.5	172.4	-162.5	0	0	111.4	H81 L82 Y83 L112	E59-H81 IonicContact OE1-CE1 3.11Å; E59-H81 IonicContact OE1-CG 3.68Å; E59-H81 IonicContact OE1-ND1 2.84Å; E59-H81 PolarHBondContact OE1-ND1 3.06Å; E59-L82 WeakPolarHBondContact CA-O 3.43Å; E59-Y83 HydrophobicContact CB-CD1 3.97Å; E59-Y83 HydrophobicContact CB-CE1 3.8Å; E59-Y83 VanDerWaalsContact CD-CE1 3.41Å; E59-Y83 HydrophobicContact CG-CD1 3.99Å; E59-Y83 HydrophobicContact CG-CE1 3.48Å; E59-Y83 VanDerWaalsContact CG-CE1 3.48Å; E59-Y83 PolarHBondContact OE1-OH 2.94Å; E59-L112 HydrophobicContact CB-CB 4.32Å; E59-L112 HydrophobicContact CG-CB 4.28Å; E59-L112 HydrophobicContact CG-CD1 3.77Å; E59-L112 PolarHBondContact O-N 2.92Å
60	V	85.4	Confident	62.3	Low	3 Å²	3	88.2 Å²	88.2	2%	0.018	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	147.5	-179.7	-51.9	0	0	0	0	109.9	L82 V84 W93 I104 V109 Q110	V60-L82 HydrophobicContact CG2-CB 3.88Å; V60-L82 PolarHBondContact N-O 2.88Å; V60-L82 PolarHBondContact O-N 2.86Å; V60-V84 HydrophobicContact CB-CG2 4.48Å; V60-V84 HydrophobicContact CG1-CG2 3.78Å; V60-V84 HydrophobicContact CG2-CG2 3.76Å; V60-W93 HydrophobicContact CG1-CZ3 4.3Å; V60-I104 HydrophobicContact CG2-CD1 4.33Å; V60-V109 HydrophobicContact CB-CB 3.99Å; V60-V109 HydrophobicContact CB-CG2 4.42Å; V60-V109 HydrophobicContact CG2-CB 3.6Å; V60-V109 HydrophobicContact CG2-CG1 3.74Å; V60-V109 HydrophobicContact CG2-CG2 3.95Å; V60-Q110 CarbonylContact C-O 3.21Å; V60-Q110 VanDerWaalsContact CA-O 3.28Å; V60-Q110 WeakPolarHBondContact CA-O 3.43Å; V60-Q110 WeakPolarHBondContact CB-O 3.44Å
61	I	89.8	Confident	63.4	Low	55 Å²	55	88.9 Å²	88.9	28%	0.282	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	136.4	174.2	-63	173.5	0	0	0	109.6	I63 D80 V109 Q110 L112	I61-I63 PolarHBondContact O-N 3.4Å; I61-D80 WeakPolarHBondContact CA-O 3.49Å; I61-V109 CarbonylContact O-C 3.6Å; I61-V109 VanDerWaalsContact O-CA 3.25Å; I61-V109 WeakPolarHBondContact O-CA 3.27Å; I61-Q110 PolarHBondContact N-O 3.42Å; I61-Q110 PolarHBondContact O-N 3.2Å; I61-L112 HydrophobicContact CD1-CD1 3.78Å; I61-L112 HydrophobicContact CD1-CD2 4.34Å; I61-L112 HydrophobicContact CD1-CG 3.77Å; I61-L112 HydrophobicContact CG1-CD1 3.66Å; I61-L112 HydrophobicContact CG1-CG 3.88Å
62	A	88.2	Confident	64.8	Low	1 Å²	1	86.6 Å²	86.6	1%	0.008	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	117.1	169.9	0	0	0	0	0	112.3	F76 S77 K78 G79 D80 L82 Y108	A62-F76 HydrophobicContact CB-CD2 3.39Å; A62-F76 HydrophobicContact CB-CE2 3.7Å; A62-F76 HydrophobicContact CB-CG 4.41Å; A62-S77 WeakPolarHBondContact CB-O 3.46Å; A62-K78 CarbonylContact O-C 3.54Å; A62-K78 WeakPolarHBondContact O-CA 3.22Å; A62-G79 PolarHBondContact O-N 3.4Å; A62-D80 HydrophobicContact CB-CB 4.3Å; A62-D80 PolarHBondContact N-O 3.35Å; A62-L82 HydrophobicContact CB-CD1 4.38Å; A62-Y108 CarbonylContact C-O 3.51Å; A62-Y108 WeakPolarHBondContact CA-O 3.26Å
63	I	88.2	Confident	67.5	Low	64 Å²	64	81 Å²	81	33%	0.328	45%	0.445	S	S	.	.	S	Bend	trans	-89.6	-8.3	178.6	57.5	163.6	0	0	0	113.5	I61 K78 Y108 Q110	I61-I63 PolarHBondContact O-N 3.4Å; I63-K78 WeakPolarHBondContact O-CD 3.45Å; I63-K78 WeakPolarHBondContact O-CE 3.36Å; I63-Y108 VanDerWaalsContact CG1-C 3.49Å; I63-Y108 VanDerWaalsContact CG1-O 3.27Å; I63-Y108 WeakPolarHBondContact CG1-O 3.44Å; I63-Y108 PolarHBondContact N-O 3.33Å; I63-Q110 HydrophobicContact CG2-CB 3.76Å
64	K	84	Confident	69.6	Low	101 Å²	101	75.8 Å²	75.8	44%	0.439	41%	0.411	S	S	.	.	S	Bend	trans	-148	151	179.2	-68.7	171.8	-173.7	160.7	0	109.8	F76 Y108	K64-F76 WeakPolarHBondContact O-CE2 3.33Å; K64-Y108 HydrophobicContact CB-CD1 3.54Å; K64-Y108 HydrophobicContact CB-CE1 3.91Å; K64-Y108 HydrophobicContact CB-CG 4.29Å; K64-Y108 HydrophobicContact CD-CD1 4Å; K64-Y108 HydrophobicContact CD-CE1 3.94Å; K64-Y108 HydrophobicContact CD-CG 4.31Å; K64-Y108 HydrophobicContact CG-CD1 4.42Å
65	D	85.2	Confident	71.9	Confident	99 Å²	99	71.7 Å²	71.7	53%	0.529	39%	0.392	S	S	.	.			trans	-67.1	143.5	169.6	-50.8	-75.7	0	0	0	111.1	S77 K78	D65-S77 WeakPolarHBondContact OD1-CA 3.14Å; D65-K78 PolarHBondContact OD1-N 3.13Å
66	Y	80	Confident	74.5	Confident	30 Å²	30	69 Å²	69	12%	0.118	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-137.3	109.8	175.6	-178.8	-94.7	0	0	0	111	P68 T73 L74 F76 W92 P105 Y108	Y66-P68 HydrophobicContact CE1-CB 3.94Å; Y66-T73 PolarHBondContact OH-OG1 3.24Å; Y66-L74 VanDerWaalsContact CD1-O 3.24Å; Y66-L74 WeakPolarHBondContact CD1-O 3.38Å; Y66-F76 HydrophobicContact CD1-CD1 4.24Å; Y66-F76 AromaticContact CD1-CE1 3.76Å; Y66-F76 HydrophobicContact CD1-CE1 3.76Å; Y66-F76 HydrophobicContact CD1-CZ 4.31Å; Y66-F76 AromaticContact CG-CE1 3.89Å; Y66-F76 HydrophobicContact CG-CE1 3.89Å; Y66-F76 AromaticContact CG-CZ 3.96Å; Y66-F76 HydrophobicContact CG-CZ 3.96Å; Y66-F76 PolarHBondContact N-O 2.85Å; Y66-F76 PolarHBondContact O-N 2.59Å; Y66-W92 HydrophobicContact CE2-CH2 4.25Å; Y66-P105 HydrophobicContact CD2-CG 3.93Å; Y66-P105 HydrophobicContact CE2-CG 4.04Å; Y66-P105 HydrophobicContact CG-CG 4.46Å; Y66-Y108 HydrophobicContact CD2-CD1 4.34Å; Y66-Y108 HydrophobicContact CD2-CE1 4.28Å
67	C	76.8	Confident	76.5	Confident	99 Å²	99	63.9 Å²	63.9	67%	0.669	34%	0.34	S	S	*	.			trans	-92.8	118.8	170.2	-70.1	0	0	0	0	109.4
68	P	71.4	Confident	78.1	Confident	51 Å²	51	68.6 Å²	68.6	33%	0.331	35%	0.352	S	S	.	.			trans	-72.8	137.8	-175.4	29	-34.9	0	0	0	111.7	Y66 T73 K75	Y66-P68 HydrophobicContact CE1-CB 3.94Å; P68-T73 VanDerWaalsContact CB-O 3.31Å; P68-T73 WeakPolarHBondContact CB-O 3.37Å; P68-T73 VanDerWaalsContact CB-OG1 3.23Å; P68-T73 WeakPolarHBondContact CB-OG1 3.27Å; P68-K75 HydrophobicContact CG-CB 3.94Å
69	T	50.5	Low	78.5	Confident	139 Å²	139	64 Å²	64	85%	0.853	34%	0.344	S	S	*	.	S	Bend	trans	-99.1	2.2	172	52.9	0	0	0	0	112.9
70	N	52.9	Low	78.6	Confident	45 Å²	45	64.4 Å²	64.4	24%	0.241	35%	0.348	C	S	.	.	S	Bend	trans	-149.1	148.8	-177.5	-170.8	29.9	0	0	0	111.3	T72 T73	N70-T72 PolarHBondContact ND2-OG1 2.94Å; N70-T72 PolarHBondContact O-N 2.96Å; N70-T73 PolarHBondContact O-N 2.84Å; N70-T73 PolarHBondContact O-OG1 3.45Å
71	F	50.3	Low	78.7	Confident	158 Å²	158	68.7 Å²	68.7	69%	0.693	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-2.6	-176.2	70.9	-87.3	0	0	0	115.3
72	T	69.8	Low	78.5	Confident	53 Å²	53	66.1 Å²	66.1	33%	0.325	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-11	179.6	61.7	0	0	0	0	113.3	N70 Y103	N70-T72 PolarHBondContact ND2-OG1 2.94Å; N70-T72 PolarHBondContact O-N 2.96Å; T72-Y103 WeakPolarHBondContact O-CD2 3.43Å; T72-Y103 PolarHBondContact O-N 2.81Å
73	T	82.6	Confident	78.5	Confident	20 Å²	20	69.6 Å²	69.6	12%	0.123	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-109.1	138.1	-176.3	56	0	0	0	0	111.6	Y66 P68 N70 W92 Y103	Y66-T73 PolarHBondContact OH-OG1 3.24Å; P68-T73 VanDerWaalsContact CB-O 3.31Å; P68-T73 WeakPolarHBondContact CB-O 3.37Å; P68-T73 VanDerWaalsContact CB-OG1 3.23Å; P68-T73 WeakPolarHBondContact CB-OG1 3.27Å; N70-T73 PolarHBondContact O-N 2.84Å; N70-T73 PolarHBondContact O-OG1 3.45Å; T73-W92 HydrophobicContact CG2-CE3 4.02Å; T73-W92 HydrophobicContact CG2-CH2 4.16Å; T73-W92 HydrophobicContact CG2-CZ3 3.44Å; T73-W92 VanDerWaalsContact CG2-CZ3 3.44Å; T73-Y103 CarbonylContact C-O 3.53Å; T73-Y103 WeakPolarHBondContact CA-O 3.4Å; T73-Y103 VanDerWaalsContact CB-O 3.24Å; T73-Y103 WeakPolarHBondContact CB-O 3.49Å
74	L	84.1	Confident	78.4	Confident	3 Å²	3	66.8 Å²	66.8	2%	0.016	35%	0.354	C	S	.	.			trans	-73.7	142.3	-176	-169.2	74.9	0	0	0	110.1	Y66 L82 N97 E100 Y103 I104	Y66-L74 VanDerWaalsContact CD1-O 3.24Å; Y66-L74 WeakPolarHBondContact CD1-O 3.38Å; L74-L82 HydrophobicContact CD2-CD2 3.64Å; L74-N97 HydrophobicContact CD2-CB 4.19Å; L74-E100 HydrophobicContact CD1-CB 3.55Å; L74-E100 WeakPolarHBondContact CD1-O 3.29Å; L74-Y103 PolarHBondContact N-O 3.11Å; L74-I104 HydrophobicContact CB-CG2 3.77Å; L74-I104 HydrophobicContact CD2-CG2 4Å
75	K	84.6	Confident	78.2	Confident	124 Å²	124	66.1 Å²	66.1	54%	0.539	36%	0.355	S	S	.	.			trans	-84.6	133.3	167.6	-172.7	-177.3	174.9	-170.8	0	110.1	P68	P68-K75 HydrophobicContact CG-CB 3.94Å
76	F	86	Confident	77.8	Confident	5 Å²	5	64.6 Å²	64.6	2%	0.022	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-153.5	153.1	174.2	60	-94.2	0	0	0	111.8	A62 K64 Y66 D80 L82 I104	A62-F76 HydrophobicContact CB-CD2 3.39Å; A62-F76 HydrophobicContact CB-CE2 3.7Å; A62-F76 HydrophobicContact CB-CG 4.41Å; K64-F76 WeakPolarHBondContact O-CE2 3.33Å; Y66-F76 HydrophobicContact CD1-CD1 4.24Å; Y66-F76 AromaticContact CD1-CE1 3.76Å; Y66-F76 HydrophobicContact CD1-CE1 3.76Å; Y66-F76 HydrophobicContact CD1-CZ 4.31Å; Y66-F76 AromaticContact CG-CE1 3.89Å; Y66-F76 HydrophobicContact CG-CE1 3.89Å; Y66-F76 AromaticContact CG-CZ 3.96Å; Y66-F76 HydrophobicContact CG-CZ 3.96Å; Y66-F76 PolarHBondContact N-O 2.85Å; Y66-F76 PolarHBondContact O-N 2.59Å; F76-D80 VanDerWaalsContact CA-OD2 3.31Å; F76-D80 WeakPolarHBondContact CA-OD2 3.39Å; F76-D80 HydrophobicContact CB-CB 4.22Å; F76-D80 WeakPolarHBondContact CB-OD2 3.46Å; F76-L82 HydrophobicContact CB-CD1 4.14Å; F76-L82 HydrophobicContact CB-CD2 4.29Å; F76-L82 HydrophobicContact CD1-CD1 3.95Å; F76-L82 HydrophobicContact CD2-CD1 4.11Å; F76-L82 HydrophobicContact CE1-CD1 4.34Å; F76-L82 HydrophobicContact CE2-CD1 4.46Å; F76-L82 HydrophobicContact CG-CD1 3.81Å; F76-I104 HydrophobicContact CD1-CG2 3.91Å; F76-I104 HydrophobicContact CE1-CB 3.86Å; F76-I104 HydrophobicContact CE1-CG2 3.55Å; F76-I104 HydrophobicContact CZ-CB 4.44Å
77	S	87.8	Confident	77.5	Confident	58 Å²	58	66.1 Å²	66.1	41%	0.406	36%	0.359	S	S	.	.			trans	-102.2	160.7	174.7	-84.3	0	0	0	0	111.5	A62 D65 G79 D80	A62-S77 WeakPolarHBondContact CB-O 3.46Å; D65-S77 WeakPolarHBondContact OD1-CA 3.14Å; S77-G79 PolarHBondContact O-N 2.83Å; S77-D80 PolarHBondContact N-OD2 3.38Å; S77-D80 WeakPolarHBondContact O-CB 3.4Å; S77-D80 VanDerWaalsContact O-CG 3.29Å; S77-D80 PolarHBondContact O-N 2.75Å; S77-D80 VanDerWaalsContact O-N 3.12Å
78	K	85.4	Confident	77	Confident	143 Å²	143	66.1 Å²	66.1	62%	0.622	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	121.8	173.8	-179.7	178.7	179.5	-171.1	0	110.2	A62 I63 D65	A62-K78 CarbonylContact O-C 3.54Å; A62-K78 WeakPolarHBondContact O-CA 3.22Å; I63-K78 WeakPolarHBondContact O-CD 3.45Å; I63-K78 WeakPolarHBondContact O-CE 3.36Å; D65-K78 PolarHBondContact OD1-N 3.13Å
79	G	80.8	Confident	76.4	Confident	42 Å²	42	65.9 Å²	65.9	43%	0.433	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.3	-14	-174.8	0	0	0	0	0	114	A62 S77	A62-G79 PolarHBondContact O-N 3.4Å; S77-G79 PolarHBondContact O-N 2.83Å
80	D	86	Confident	77.5	Confident	60 Å²	60	61.4 Å²	61.4	32%	0.321	35%	0.348	S	S	.	.			trans	-64.6	136.7	179.4	-69.7	0.4	0	0	0	111.7	I61 A62 F76 S77	I61-D80 WeakPolarHBondContact CA-O 3.49Å; A62-D80 HydrophobicContact CB-CB 4.3Å; A62-D80 PolarHBondContact N-O 3.35Å; F76-D80 VanDerWaalsContact CA-OD2 3.31Å; F76-D80 WeakPolarHBondContact CA-OD2 3.39Å; F76-D80 HydrophobicContact CB-CB 4.22Å; F76-D80 WeakPolarHBondContact CB-OD2 3.46Å; S77-D80 PolarHBondContact N-OD2 3.38Å; S77-D80 WeakPolarHBondContact O-CB 3.4Å; S77-D80 VanDerWaalsContact O-CG 3.29Å; S77-D80 PolarHBondContact O-N 2.75Å; S77-D80 VanDerWaalsContact O-N 3.12Å
81	H	87.4	Confident	78.7	Confident	93 Å²	93	66.4 Å²	66.4	43%	0.431	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	129.2	170.9	-76.3	-129.5	0	0	0	110	E59 L112	E59-H81 IonicContact OE1-CE1 3.11Å; E59-H81 IonicContact OE1-CG 3.68Å; E59-H81 IonicContact OE1-ND1 2.84Å; E59-H81 PolarHBondContact OE1-ND1 3.06Å; H81-L112 VanDerWaalsContact CE1-CD1 3.47Å; H81-L112 WeakPolarHBondContact CE1-CD1 3.2Å
82	L	87.6	Confident	80.3	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	137.6	-175	-60.4	174.2	0	0	0	110.2	E59 V60 A62 L74 F76 N97 I104 V109	E59-L82 WeakPolarHBondContact CA-O 3.43Å; V60-L82 HydrophobicContact CG2-CB 3.88Å; V60-L82 PolarHBondContact N-O 2.88Å; V60-L82 PolarHBondContact O-N 2.86Å; A62-L82 HydrophobicContact CB-CD1 4.38Å; L74-L82 HydrophobicContact CD2-CD2 3.64Å; F76-L82 HydrophobicContact CB-CD1 4.14Å; F76-L82 HydrophobicContact CB-CD2 4.29Å; F76-L82 HydrophobicContact CD1-CD1 3.95Å; F76-L82 HydrophobicContact CD2-CD1 4.11Å; F76-L82 HydrophobicContact CE1-CD1 4.34Å; F76-L82 HydrophobicContact CE2-CD1 4.46Å; F76-L82 HydrophobicContact CG-CD1 3.81Å; L82-N97 HydrophobicContact CD2-CB 3.73Å; L82-I104 HydrophobicContact CD1-CD1 4.11Å; L82-I104 HydrophobicContact CD1-CG2 4.39Å; L82-V109 HydrophobicContact CD1-CG1 3.86Å
83	Y	88.1	Confident	81	Confident	75 Å²	75	62.7 Å²	62.7	29%	0.294	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	108.3	-178.4	-62.2	-75.1	0	0	0	109.9	E59 L85 A95 H96	E59-Y83 HydrophobicContact CB-CD1 3.97Å; E59-Y83 HydrophobicContact CB-CE1 3.8Å; E59-Y83 VanDerWaalsContact CD-CE1 3.41Å; E59-Y83 HydrophobicContact CG-CD1 3.99Å; E59-Y83 HydrophobicContact CG-CE1 3.48Å; E59-Y83 VanDerWaalsContact CG-CE1 3.48Å; E59-Y83 PolarHBondContact OE1-OH 2.94Å; Y83-L85 PolarHBondContact O-N 2.87Å; Y83-A95 CarbonylContact O-C 3.52Å; Y83-A95 WeakPolarHBondContact O-CA 3.37Å; Y83-A95 WeakPolarHBondContact O-CB 3.44Å; Y83-H96 WeakPolarHBondContact CB-NE2 3.33Å; Y83-H96 AromaticContact CD2-CE1 3.66Å; Y83-H96 AromaticContact CG-CE1 3.97Å; Y83-H96 PolarHBondContact N-O 2.98Å; Y83-H96 PolarHBondContact O-N 2.85Å
84	V	84.4	Confident	81	Confident	4 Å²	4	65.2 Å²	65.2	2%	0.024	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	120	-178.5	-179.4	0	0	0	0	110	A57 K58 V60 T87 W93 A95 I104	A57-V84 WeakPolarHBondContact CA-O 3.39Å; K58-V84 HydrophobicContact CB-CB 4.3Å; K58-V84 PolarHBondContact N-O 2.82Å; K58-V84 WeakPolarHBondContact O-CB 3.37Å; K58-V84 PolarHBondContact O-N 2.97Å; V60-V84 HydrophobicContact CB-CG2 4.48Å; V60-V84 HydrophobicContact CG1-CG2 3.78Å; V60-V84 HydrophobicContact CG2-CG2 3.76Å; V84-T87 HydrophobicContact CG1-CG2 3.65Å; V84-W93 HydrophobicContact CG1-CB 3.88Å; V84-W93 HydrophobicContact CG1-CD2 4.42Å; V84-W93 HydrophobicContact CG1-CE3 4.29Å; V84-W93 HydrophobicContact CG1-CG 4.31Å; V84-W93 HydrophobicContact CG2-CE3 3.89Å; V84-A95 HydrophobicContact CG2-CB 4.23Å; V84-I104 HydrophobicContact CG2-CD1 4.23Å
85	L	81.4	Confident	81.1	Confident	88 Å²	88	65 Å²	65	46%	0.461	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	-32.4	179.1	-61.5	175.6	0	0	0	112.3	A57 Y83 Y94 M101	A57-L85 HydrophobicContact CB-CD2 4.41Å; Y83-L85 PolarHBondContact O-N 2.87Å; L85-Y94 HydrophobicContact CB-CD1 4.26Å; L85-Y94 HydrophobicContact CD1-CD1 4.08Å; L85-Y94 HydrophobicContact CD1-CE1 4.11Å; L85-Y94 PolarHBondContact N-O 2.94Å; L85-M101 HydrophobicContact CD1-SD 4.5Å
86	D	74.9	Confident	81	Confident	66 Å²	66	61.8 Å²	61.8	35%	0.353	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	134.5	176.7	-178.1	24.1	0	0	0	112.3	S88 W93 Y94	D86-S88 VanDerWaalsContact OD1-CB 3.24Å; D86-S88 WeakPolarHBondContact OD1-CB 3.11Å; D86-S88 PolarHBondContact OD1-N 3.19Å; D86-S88 PolarHBondContact OD1-OG 3.29Å; D86-S88 WeakPolarHBondContact OD2-CB 3.26Å; D86-S88 PolarHBondContact OD2-OG 2.83Å; D86-W93 CarbonylContact O-C 3.59Å; D86-W93 VanDerWaalsContact O-CA 3.31Å; D86-W93 WeakPolarHBondContact O-CA 3.47Å; D86-W93 WeakPolarHBondContact O-CB 3.24Å; D86-Y94 PolarHBondContact N-O 2.77Å; D86-Y94 PolarHBondContact O-N 2.92Å
87	T	74.4	Confident	80.9	Confident	63 Å²	63	62.6 Å²	62.6	39%	0.387	34%	0.344	S	S	.	.			trans	-107.8	3.1	175.7	57.7	0	0	0	0	113.8	V84 G89 G90 W93	V84-T87 HydrophobicContact CG1-CG2 3.65Å; T87-G89 PolarHBondContact O-N 3.24Å; T87-G89 VanDerWaalsContact O-N 3.16Å; T87-G90 PolarHBondContact O-N 2.83Å; T87-G90 VanDerWaalsContact O-N 3.16Å; T87-W93 HydrophobicContact CG2-CD2 3.89Å; T87-W93 HydrophobicContact CG2-CE3 4.49Å; T87-W93 HydrophobicContact CG2-CG 3.99Å; T87-W93 HydrophobicContact CG2-CZ2 4.46Å
88	S	67.5	Low	80.2	Confident	99 Å²	99	66.4 Å²	66.4	69%	0.692	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.8	-174.9	74.3	0	0	0	0	114.2	D86 G90	D86-S88 VanDerWaalsContact OD1-CB 3.24Å; D86-S88 WeakPolarHBondContact OD1-CB 3.11Å; D86-S88 PolarHBondContact OD1-N 3.19Å; D86-S88 PolarHBondContact OD1-OG 3.29Å; D86-S88 WeakPolarHBondContact OD2-CB 3.26Å; D86-S88 PolarHBondContact OD2-OG 2.83Å; S88-G90 PolarHBondContact O-N 2.93Å
89	G	58.4	Low	79.4	Confident	45 Å²	45	65.2 Å²	65.2	46%	0.464	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	1	178.8	0	0	0	0	0	115.9	T87 E91 W92	T87-G89 PolarHBondContact O-N 3.24Å; T87-G89 VanDerWaalsContact O-N 3.16Å; G89-E91 PolarHBondContact O-N 3.47Å; G89-W92 CarbonylContact C-O 3.58Å; G89-W92 WeakPolarHBondContact CA-O 3.24Å; G89-W92 PolarHBondContact O-N 2.78Å
90	G	73.1	Confident	79.2	Confident	45 Å²	45	68.3 Å²	68.3	46%	0.464	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	-87.2	171.3	0	0	0	0	0	114.4	T87 S88 W92 W93 S106	T87-G90 PolarHBondContact O-N 2.83Å; T87-G90 VanDerWaalsContact O-N 3.16Å; S88-G90 PolarHBondContact O-N 2.93Å; G90-W92 VanDerWaalsContact C-N 3.27Å; G90-W93 PolarHBondContact O-NE1 3.12Å; G90-S106 PolarHBondContact O-OG 3.19Å
91	E	78.8	Confident	79.1	Confident	150 Å²	150	71.6 Å²	71.6	70%	0.701	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-19.6	174.4	-65.8	-173.4	155.9	0	0	112.8	G89 P105 S106	G89-E91 PolarHBondContact O-N 3.47Å; E91-P105 WeakPolarHBondContact O-CA 3.45Å; E91-S106 WeakPolarHBondContact CA-OG 3.25Å; E91-S106 PolarHBondContact O-N 2.71Å; E91-S106 PolarHBondContact O-OG 2.83Å
92	W	83.9	Confident	78.9	Confident	84 Å²	84	67.3 Å²	67.3	32%	0.318	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	126.5	177.7	-67.4	80.6	0	0	0	109.8	Y66 T73 G89 G90 I104 P105	Y66-W92 HydrophobicContact CE2-CH2 4.25Å; T73-W92 HydrophobicContact CG2-CE3 4.02Å; T73-W92 HydrophobicContact CG2-CH2 4.16Å; T73-W92 HydrophobicContact CG2-CZ3 3.44Å; T73-W92 VanDerWaalsContact CG2-CZ3 3.44Å; G89-W92 CarbonylContact C-O 3.58Å; G89-W92 WeakPolarHBondContact CA-O 3.24Å; G89-W92 PolarHBondContact O-N 2.78Å; G90-W92 VanDerWaalsContact C-N 3.27Å; W92-I104 WeakPolarHBondContact CA-O 3.17Å; W92-P105 HydrophobicContact CD2-CB 4.37Å; W92-P105 HydrophobicContact CE3-CB 4.17Å; W92-P105 HydrophobicContact CH2-CB 3.94Å; W92-P105 HydrophobicContact CH2-CG 3.99Å; W92-P105 HydrophobicContact CZ2-CB 4.13Å; W92-P105 HydrophobicContact CZ3-CB 3.96Å; W92-P105 HydrophobicContact CZ3-CG 3.93Å
93	W	83.9	Confident	78.8	Confident	50 Å²	50	72 Å²	72	19%	0.189	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	147.4	177.9	-62.4	-14.1	0	0	0	109.4	V60 V84 D86 T87 G90 Y103 I104 V109	V60-W93 HydrophobicContact CG1-CZ3 4.3Å; V84-W93 HydrophobicContact CG1-CB 3.88Å; V84-W93 HydrophobicContact CG1-CD2 4.42Å; V84-W93 HydrophobicContact CG1-CE3 4.29Å; V84-W93 HydrophobicContact CG1-CG 4.31Å; V84-W93 HydrophobicContact CG2-CE3 3.89Å; D86-W93 CarbonylContact O-C 3.59Å; D86-W93 VanDerWaalsContact O-CA 3.31Å; D86-W93 WeakPolarHBondContact O-CA 3.47Å; D86-W93 WeakPolarHBondContact O-CB 3.24Å; T87-W93 HydrophobicContact CG2-CD2 3.89Å; T87-W93 HydrophobicContact CG2-CE3 4.49Å; T87-W93 HydrophobicContact CG2-CG 3.99Å; T87-W93 HydrophobicContact CG2-CZ2 4.46Å; G90-W93 PolarHBondContact O-NE1 3.12Å; W93-Y103 CarbonylContact O-C 3.54Å; W93-Y103 VanDerWaalsContact O-CA 3.31Å; W93-Y103 WeakPolarHBondContact O-CA 2.84Å; W93-I104 HydrophobicContact CB-CG1 4.18Å; W93-I104 PolarHBondContact N-O 3.09Å; W93-I104 WeakPolarHBondContact O-CG1 3.37Å; W93-I104 PolarHBondContact O-N 3.41Å; W93-V109 HydrophobicContact CE3-CG2 3.97Å; W93-V109 HydrophobicContact CZ3-CG2 3.87Å
94	Y	81.8	Confident	78.7	Confident	72 Å²	72	68.5 Å²	68.5	28%	0.282	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	126.1	172.5	-165.9	-111.7	0	0	0	109.1	L85 D86 M101 Y103	L85-Y94 HydrophobicContact CB-CD1 4.26Å; L85-Y94 HydrophobicContact CD1-CD1 4.08Å; L85-Y94 HydrophobicContact CD1-CE1 4.11Å; L85-Y94 PolarHBondContact N-O 2.94Å; D86-Y94 PolarHBondContact N-O 2.77Å; D86-Y94 PolarHBondContact O-N 2.92Å; Y94-M101 HydrophobicContact CE1-CB 4.48Å; Y94-M101 WeakPolarHBondContact OH-CB 3.38Å; Y94-Y103 AromaticContact CD2-CD1 3.97Å; Y94-Y103 HydrophobicContact CD2-CD1 3.97Å; Y94-Y103 AromaticContact CD2-CD2 3.9Å; Y94-Y103 HydrophobicContact CD2-CD2 3.9Å; Y94-Y103 AromaticContact CD2-CE1 3.88Å; Y94-Y103 HydrophobicContact CD2-CE1 3.88Å; Y94-Y103 AromaticContact CD2-CE2 3.81Å; Y94-Y103 HydrophobicContact CD2-CE2 3.81Å; Y94-Y103 AromaticContact CD2-CG 3.98Å; Y94-Y103 HydrophobicContact CD2-CG 3.98Å; Y94-Y103 AromaticContact CD2-CZ 3.8Å; Y94-Y103 HydrophobicContact CE2-CD2 4.33Å; Y94-Y103 HydrophobicContact CE2-CE2 4.22Å; Y94-Y103 HydrophobicContact CG-CE1 4.28Å
95	A	86.6	Confident	78.9	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	167.3	-173.9	0	0	0	0	0	112.1	Y83 V84 M101 G102 I104	Y83-A95 CarbonylContact O-C 3.52Å; Y83-A95 WeakPolarHBondContact O-CA 3.37Å; Y83-A95 WeakPolarHBondContact O-CB 3.44Å; V84-A95 HydrophobicContact CG2-CB 4.23Å; A95-M101 WeakPolarHBondContact O-CA 3.46Å; A95-G102 PolarHBondContact N-O 2.79Å; A95-G102 PolarHBondContact O-N 3.2Å; A95-I104 HydrophobicContact CB-CD1 3.55Å; A95-I104 HydrophobicContact CB-CG1 3.83Å; A95-I104 HydrophobicContact CB-CG2 4.28Å
96	H	83.4	Confident	79	Confident	56 Å²	56	65.7 Å²	65.7	26%	0.259	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	151.8	169.6	72.8	92.7	0	0	0	112.1	Y83 E100 M101	Y83-H96 WeakPolarHBondContact CB-NE2 3.33Å; Y83-H96 AromaticContact CD2-CE1 3.66Å; Y83-H96 AromaticContact CG-CE1 3.97Å; Y83-H96 PolarHBondContact N-O 2.98Å; Y83-H96 PolarHBondContact O-N 2.85Å; H96-E100 VanDerWaalsContact CA-O 3.3Å; H96-E100 WeakPolarHBondContact CA-O 3.08Å; H96-E100 WeakPolarHBondContact CB-O 3.37Å; H96-M101 HydrophobicContact CB-CB 4.21Å; H96-M101 HydrophobicContact CB-CG 3.68Å; H96-M101 HydrophobicContact CB-SD 4.41Å
97	N	83.5	Confident	79.5	Confident	22 Å²	22	66.3 Å²	66.3	12%	0.118	37%	0.37	C	S	.	.			trans	-97.7	-157	160.7	63.9	25.6	0	0	0	108.5	L74 L82 T99 E100	L74-N97 HydrophobicContact CD2-CB 4.19Å; L82-N97 HydrophobicContact CD2-CB 3.73Å; N97-T99 VanDerWaalsContact C-N 3.32Å; N97-T99 PolarHBondContact O-N 3.35Å; N97-T99 PolarHBondContact OD1-N 3.25Å; N97-T99 PolarHBondContact OD1-OG1 2.92Å; N97-E100 PolarHBondContact N-O 2.84Å; N97-E100 PolarHBondContact OD1-N 3.03Å; N97-E100 PolarHBondContact OD1-O 2.85Å
98	T	73.3	Confident	80	Confident	137 Å²	137	66.9 Å²	66.9	84%	0.84	37%	0.366	S	S	*	.	S	Bend	trans	-78	-9.5	179.8	45.9	0	0	0	0	114.8
99	T	69.2	Low	80.9	Confident	118 Å²	118	62.7 Å²	62.7	72%	0.724	34%	0.336	S	S	*	.	S	Bend	trans	-134.7	-21.6	-172.9	54.7	0	0	0	0	115.2	N97	N97-T99 VanDerWaalsContact C-N 3.32Å; N97-T99 PolarHBondContact O-N 3.35Å; N97-T99 PolarHBondContact OD1-N 3.25Å; N97-T99 PolarHBondContact OD1-OG1 2.92Å
100	E	76.3	Confident	82.1	Confident	108 Å²	108	66.4 Å²	66.4	51%	0.505	34%	0.341	S	S	.	.			trans	-142	157.5	-169.4	-64.8	-177.9	171.6	0	0	111.9	L74 H96 N97	L74-E100 HydrophobicContact CD1-CB 3.55Å; L74-E100 WeakPolarHBondContact CD1-O 3.29Å; H96-E100 VanDerWaalsContact CA-O 3.3Å; H96-E100 WeakPolarHBondContact CA-O 3.08Å; H96-E100 WeakPolarHBondContact CB-O 3.37Å; N97-E100 PolarHBondContact N-O 2.84Å; N97-E100 PolarHBondContact OD1-N 3.03Å; N97-E100 PolarHBondContact OD1-O 2.85Å
101	M	82.7	Confident	82.4	Confident	128 Å²	128	67.9 Å²	67.9	63%	0.631	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	134.1	177.6	-50.3	-164.6	-77.4	0	0	110.9	L85 Y94 A95 H96	L85-M101 HydrophobicContact CD1-SD 4.5Å; Y94-M101 HydrophobicContact CE1-CB 4.48Å; Y94-M101 WeakPolarHBondContact OH-CB 3.38Å; A95-M101 WeakPolarHBondContact O-CA 3.46Å; H96-M101 HydrophobicContact CB-CB 4.21Å; H96-M101 HydrophobicContact CB-CG 3.68Å; H96-M101 HydrophobicContact CB-SD 4.41Å
102	G	84.1	Confident	82.1	Confident	3 Å²	3	63 Å²	63	3%	0.031	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.7	172	-175.2	0	0	0	0	0	114.1	A95	A95-G102 PolarHBondContact N-O 2.79Å; A95-G102 PolarHBondContact O-N 3.2Å
103	Y	85.4	Confident	80.3	Confident	100 Å²	100	65.9 Å²	65.9	39%	0.392	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	138.5	174.6	-71.3	-81	0	0	0	111.6	T72 T73 L74 W93 Y94	T72-Y103 WeakPolarHBondContact O-CD2 3.43Å; T72-Y103 PolarHBondContact O-N 2.81Å; T73-Y103 CarbonylContact C-O 3.53Å; T73-Y103 WeakPolarHBondContact CA-O 3.4Å; T73-Y103 VanDerWaalsContact CB-O 3.24Å; T73-Y103 WeakPolarHBondContact CB-O 3.49Å; L74-Y103 PolarHBondContact N-O 3.11Å; W93-Y103 CarbonylContact O-C 3.54Å; W93-Y103 VanDerWaalsContact O-CA 3.31Å; W93-Y103 WeakPolarHBondContact O-CA 2.84Å; Y94-Y103 AromaticContact CD2-CD1 3.97Å; Y94-Y103 HydrophobicContact CD2-CD1 3.97Å; Y94-Y103 AromaticContact CD2-CD2 3.9Å; Y94-Y103 HydrophobicContact CD2-CD2 3.9Å; Y94-Y103 AromaticContact CD2-CE1 3.88Å; Y94-Y103 HydrophobicContact CD2-CE1 3.88Å; Y94-Y103 AromaticContact CD2-CE2 3.81Å; Y94-Y103 HydrophobicContact CD2-CE2 3.81Å; Y94-Y103 AromaticContact CD2-CG 3.98Å; Y94-Y103 HydrophobicContact CD2-CG 3.98Å; Y94-Y103 AromaticContact CD2-CZ 3.8Å; Y94-Y103 HydrophobicContact CE2-CD2 4.33Å; Y94-Y103 HydrophobicContact CE2-CE2 4.22Å; Y94-Y103 HydrophobicContact CG-CE1 4.28Å
104	I	86.9	Confident	78	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	143.1	176.8	60.6	167.4	0	0	0	109.8	V60 L74 F76 L82 V84 W92 W93 A95 S106 V109	V60-I104 HydrophobicContact CG2-CD1 4.33Å; L74-I104 HydrophobicContact CB-CG2 3.77Å; L74-I104 HydrophobicContact CD2-CG2 4Å; F76-I104 HydrophobicContact CD1-CG2 3.91Å; F76-I104 HydrophobicContact CE1-CB 3.86Å; F76-I104 HydrophobicContact CE1-CG2 3.55Å; F76-I104 HydrophobicContact CZ-CB 4.44Å; L82-I104 HydrophobicContact CD1-CD1 4.11Å; L82-I104 HydrophobicContact CD1-CG2 4.39Å; V84-I104 HydrophobicContact CG2-CD1 4.23Å; W92-I104 WeakPolarHBondContact CA-O 3.17Å; W93-I104 HydrophobicContact CB-CG1 4.18Å; W93-I104 PolarHBondContact N-O 3.09Å; W93-I104 WeakPolarHBondContact O-CG1 3.37Å; W93-I104 PolarHBondContact O-N 3.41Å; A95-I104 HydrophobicContact CB-CD1 3.55Å; A95-I104 HydrophobicContact CB-CG1 3.83Å; A95-I104 HydrophobicContact CB-CG2 4.28Å; I104-S106 PolarHBondContact O-N 3.26Å; I104-V109 HydrophobicContact CD1-CG1 3.89Å; I104-V109 HydrophobicContact CD1-CG2 4.07Å
105	P	87.3	Confident	75.7	Confident	7 Å²	7	80 Å²	80	5%	0.045	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	125.4	174.3	23	-20.9	0	0	0	109.8	Y66 E91 W92 S107 Y108	Y66-P105 HydrophobicContact CD2-CG 3.93Å; Y66-P105 HydrophobicContact CE2-CG 4.04Å; Y66-P105 HydrophobicContact CG-CG 4.46Å; E91-P105 WeakPolarHBondContact O-CA 3.45Å; W92-P105 HydrophobicContact CD2-CB 4.37Å; W92-P105 HydrophobicContact CE3-CB 4.17Å; W92-P105 HydrophobicContact CH2-CB 3.94Å; W92-P105 HydrophobicContact CH2-CG 3.99Å; W92-P105 HydrophobicContact CZ2-CB 4.13Å; W92-P105 HydrophobicContact CZ3-CB 3.96Å; W92-P105 HydrophobicContact CZ3-CG 3.93Å; P105-S107 PolarHBondContact O-N 3.05Å; P105-S107 VanDerWaalsContact O-N 3.15Å; P105-Y108 HydrophobicContact CB-CD2 3.95Å; P105-Y108 HydrophobicContact CB-CG 4.48Å; P105-Y108 HydrophobicContact CG-CD1 4.49Å; P105-Y108 HydrophobicContact CG-CD2 3.68Å; P105-Y108 HydrophobicContact CG-CE2 4.32Å; P105-Y108 HydrophobicContact CG-CG 3.8Å; P105-Y108 WeakPolarHBondContact O-CB 3.37Å; P105-Y108 PolarHBondContact O-N 2.77Å
106	S	83.1	Confident	72.9	Confident	26 Å²	26	87 Å²	87	18%	0.182	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-64.6	-22.2	-174	59.3	0	0	0	0	113.5	G90 E91 I104 Y108	G90-S106 PolarHBondContact O-OG 3.19Å; E91-S106 WeakPolarHBondContact CA-OG 3.25Å; E91-S106 PolarHBondContact O-N 2.71Å; E91-S106 PolarHBondContact O-OG 2.83Å; I104-S106 PolarHBondContact O-N 3.26Å; S106-Y108 VanDerWaalsContact C-N 3.25Å; S106-Y108 PolarHBondContact O-N 2.77Å
107	S	85.8	Confident	70.3	Confident	79 Å²	79	89.9 Å²	89.9	55%	0.552	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-79	2.5	173.4	58.5	0	0	0	0	115.2	P105	P105-S107 PolarHBondContact O-N 3.05Å; P105-S107 VanDerWaalsContact O-N 3.15Å
108	Y	85.8	Confident	67.8	Low	76 Å²	76	95 Å²	95	30%	0.298	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-110.1	0.8	174.9	-77.9	-121.8	0	0	0	112.6	A62 I63 K64 Y66 P105 S106	A62-Y108 CarbonylContact C-O 3.51Å; A62-Y108 WeakPolarHBondContact CA-O 3.26Å; I63-Y108 VanDerWaalsContact CG1-C 3.49Å; I63-Y108 VanDerWaalsContact CG1-O 3.27Å; I63-Y108 WeakPolarHBondContact CG1-O 3.44Å; I63-Y108 PolarHBondContact N-O 3.33Å; K64-Y108 HydrophobicContact CB-CD1 3.54Å; K64-Y108 HydrophobicContact CB-CE1 3.91Å; K64-Y108 HydrophobicContact CB-CG 4.29Å; K64-Y108 HydrophobicContact CD-CD1 4Å; K64-Y108 HydrophobicContact CD-CE1 3.94Å; K64-Y108 HydrophobicContact CD-CG 4.31Å; K64-Y108 HydrophobicContact CG-CD1 4.42Å; Y66-Y108 HydrophobicContact CD2-CD1 4.34Å; Y66-Y108 HydrophobicContact CD2-CE1 4.28Å; P105-Y108 HydrophobicContact CB-CD2 3.95Å; P105-Y108 HydrophobicContact CB-CG 4.48Å; P105-Y108 HydrophobicContact CG-CD1 4.49Å; P105-Y108 HydrophobicContact CG-CD2 3.68Å; P105-Y108 HydrophobicContact CG-CE2 4.32Å; P105-Y108 HydrophobicContact CG-CG 3.8Å; P105-Y108 WeakPolarHBondContact O-CB 3.37Å; P105-Y108 PolarHBondContact O-N 2.77Å; S106-Y108 VanDerWaalsContact C-N 3.25Å; S106-Y108 PolarHBondContact O-N 2.77Å
109	V	85.6	Confident	65.9	Low	11 Å²	11	96.3 Å²	96.3	7%	0.067	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	155.5	-179.5	-71.6	0	0	0	0	112.5	V60 I61 L82 W93 I104	V60-V109 HydrophobicContact CB-CB 3.99Å; V60-V109 HydrophobicContact CB-CG2 4.42Å; V60-V109 HydrophobicContact CG2-CB 3.6Å; V60-V109 HydrophobicContact CG2-CG1 3.74Å; V60-V109 HydrophobicContact CG2-CG2 3.95Å; I61-V109 CarbonylContact O-C 3.6Å; I61-V109 VanDerWaalsContact O-CA 3.25Å; I61-V109 WeakPolarHBondContact O-CA 3.27Å; L82-V109 HydrophobicContact CD1-CG1 3.86Å; W93-V109 HydrophobicContact CE3-CG2 3.97Å; W93-V109 HydrophobicContact CZ3-CG2 3.87Å; I104-V109 HydrophobicContact CD1-CG1 3.89Å; I104-V109 HydrophobicContact CD1-CG2 4.07Å
110	Q	83.9	Confident	64	Low	122 Å²	122	96.2 Å²	96.2	57%	0.57	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.6	134	178.3	-174.8	170.4	-9.7	0	0	110.9	V60 I61 I63	V60-Q110 CarbonylContact C-O 3.21Å; V60-Q110 VanDerWaalsContact CA-O 3.28Å; V60-Q110 WeakPolarHBondContact CA-O 3.43Å; V60-Q110 WeakPolarHBondContact CB-O 3.44Å; I61-Q110 PolarHBondContact N-O 3.42Å; I61-Q110 PolarHBondContact O-N 3.2Å; I63-Q110 HydrophobicContact CG2-CB 3.76Å
111	P	80	Confident	61.8	Low	77 Å²	77	98.1 Å²	98.1	50%	0.5	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	137.1	-179.4	-25.6	35.2	0	0	0	114.4	N113	P111-N113 PolarHBondContact O-N 3.05Å; P111-N113 VanDerWaalsContact O-N 3.14Å
112	L	72.1	Confident	59.4	Low	47 Å²	47	97.3 Å²	97.3	25%	0.246	52%	0.519	C	S	.	.			trans	-83.7	85.7	178.8	-127.1	171.5	0	0	0	110.6	E59 I61 H81 Y114	E59-L112 HydrophobicContact CB-CB 4.32Å; E59-L112 HydrophobicContact CG-CB 4.28Å; E59-L112 HydrophobicContact CG-CD1 3.77Å; E59-L112 PolarHBondContact O-N 2.92Å; I61-L112 HydrophobicContact CD1-CD1 3.78Å; I61-L112 HydrophobicContact CD1-CD2 4.34Å; I61-L112 HydrophobicContact CD1-CG 3.77Å; I61-L112 HydrophobicContact CG1-CD1 3.66Å; I61-L112 HydrophobicContact CG1-CG 3.88Å; H81-L112 VanDerWaalsContact CE1-CD1 3.47Å; H81-L112 WeakPolarHBondContact CE1-CD1 3.2Å; L112-Y114 HydrophobicContact CD2-CD2 4.16Å; L112-Y114 HydrophobicContact CD2-CE2 4.24Å; L112-Y114 PolarHBondContact O-N 3.37Å
113	N	46.3	Very low	57.1	Low	144 Å²	144	100.9 Å²	100.9	77%	0.77	56%	0.556	S	S	*	*			trans	-71.2	92.9	177.1	-81.5	-10.4	0	0	0	111.3	P111 R115	P111-N113 PolarHBondContact O-N 3.05Å; P111-N113 VanDerWaalsContact O-N 3.14Å; N113-R115 VanDerWaalsContact C-N 3.29Å; N113-R115 PolarHBondContact O-N 3.16Å
114	Y	35.7	Very low	54.5	Low	194 Å²	194	104.7 Å²	104.7	76%	0.761	58%	0.579	S	S	*	*			trans	-72.5	76.4	176.1	-113.4	-79.6	0	0	0	112.6	L112	L112-Y114 HydrophobicContact CD2-CD2 4.16Å; L112-Y114 HydrophobicContact CD2-CE2 4.24Å; L112-Y114 PolarHBondContact O-N 3.37Å
115	R	32.7	Very low	51.8	Low	224 Å²	224	111.1 Å²	111.1	85%	0.845	61%	0.612	S	S	*	*			trans	176.7	123.9	159.2	-97.9	167.3	-168.1	-152.2	2	107.3	N113	N113-R115 VanDerWaalsContact C-N 3.29Å; N113-R115 PolarHBondContact O-N 3.16Å
116	N	27.5	Very low	49.1	Very low	148 Å²	148	116.4 Å²	116.4	79%	0.791	64%	0.64	S	S	*	*			cis	-134.8	158	9.7	-60	-50.9	0	0	0	111.4
117	S	29.3	Very low	46.3	Very low	116 Å²	116	122 Å²	122	81%	0.811	67%	0.668	S	S	*	*			trans	-97.6	127.1	165.9	-45.5	0	0	0	0	110.5
118	T	30.7	Very low	43.5	Very low	131 Å²	131	125.8 Å²	125.8	80%	0.804	68%	0.681	S	S	*	*			trans	-164.1	110.9	148.9	39.6	0	0	0	0	111.2
119	L	33.6	Very low	41.6	Very low	164 Å²	164	126.5 Å²	126.5	86%	0.859	70%	0.695	S	S	*	*			trans	34.5	151.8	131.2	-61.1	170.7	0	0	0	122.7
120	S	29	Very low	38.7	Very low	115 Å²	115	133.2 Å²	133.2	80%	0.804	73%	0.731	S	S	*	*			trans	72.8	121	175.5	-55.3	0	0	0	0	114.5
121	D	30.3	Very low	36.1	Very low	149 Å²	149	132.5 Å²	132.5	80%	0.797	74%	0.739	S	S	*	*			cis	91.4	140.4	42.1	-173.6	49.1	0	0	0	113.5
122	S	33.1	Very low	34.6	Very low	111 Å²	111	133.7 Å²	133.7	78%	0.776	75%	0.747	S	S	*	*			trans	61.7	134	-173.2	-65.5	0	0	0	0	115.5
123	G	34.9	Very low	32.5	Very low	78 Å²	78	137.9 Å²	137.9	80%	0.804	77%	0.77	S	S	*	*			trans	-123.1	160.7	178.8	0	0	0	0	0	112.2
124	M	30.7	Very low	31.8	Very low	179 Å²	179	138.9 Å²	138.9	88%	0.882	77%	0.77	S	S	*	*			trans	-152.6	-171.1	164.9	-127	-168.4	76.5	0	0	111.5
125	I	31.6	Very low	31.5	Very low	135 Å²	135	134.5 Å²	134.5	69%	0.692	76%	0.763	S	S	*	*			trans	-111.4	171	-162.4	-34	177.9	0	0	0	110.3
126	D	29.2	Very low	31.5	Very low	119 Å²	119	128.1 Å²	128.1	64%	0.636	76%	0.758	S	S	*	*			trans	91.9	111.5	149.6	-70.4	-49.1	0	0	0	121.1
127	N	24.4	Very low	31.7	Very low	144 Å²	144	128 Å²	128	77%	0.77	75%	0.75	S	S	*	*				78.4	145.2	126.8	-60.8	-40.8	0	0	0	124.4
128	L	26.8	Very low	31.7	Very low	157 Å²	157	129 Å²	129	82%	0.822	74%	0.742	S	S	*	*			trans	-46.3	175.9	154	-109.1	66.9	0	0	0	114.3
129	P	47	Very low	31.6	Very low	92 Å²	92	128.8 Å²	128.8	60%	0.597	74%	0.736	S	S	*	*			cis	-142.4	-163.3	2.6	26.3	1.1	0	0	0	115.9
130	D	23.5	Very low	31.2	Very low	152 Å²	152	127.7 Å²	127.7	81%	0.813	73%	0.731	S	S	*	*			trans	96.8	132.5	140.1	-70	-23.2	0	0	0	122.7
131	S	31	Very low	31.1	Very low	106 Å²	106	127.9 Å²	127.9	74%	0.741	72%	0.722	S	S	*	*			trans	-96.7	-174.7	161.5	59.7	0	0	0	0	109.4
132	P	47	Very low	30.9	Very low	103 Å²	103	128.7 Å²	128.7	67%	0.669	73%	0.725	S	S	*	*				-155.5	-168.8	77.8	38.8	-15.2	0	0	0	116.9
133	D	28.6	Very low	30.5	Very low	134 Å²	134	126.8 Å²	126.8	72%	0.717	72%	0.724	S	S	*	*			trans	109.6	112.9	154.2	-61.2	-12.2	0	0	0	116.6
134	E	32.4	Very low	29.9	Very low	166 Å²	166	126.4 Å²	126.4	78%	0.776	72%	0.719	S	S	*	*			cis	89.7	151.8	49.4	-84.9	-141.9	143.6	0	0	113.8
135	V	29.3	Very low	29.7	Very low	102 Å²	102	130 Å²	130	62%	0.618	72%	0.723	S	S	*	*			cis	-101.6	-137.1	-7.8	-144.4	0	0	0	0	108.2	K137	V135-K137 HydrophobicContact CG1-CG 4.11Å
136	A	31.8	Very low	29.3	Very low	89 Å²	89	132 Å²	132	74%	0.736	73%	0.731	S	S	*	*			cis	-158.3	174.4	-4.2	0	0	0	0	0	108.2
137	K	30.9	Very low	29.1	Very low	145 Å²	145	133.7 Å²	133.7	63%	0.63	74%	0.741	S	S	*	*			cis	-178.2	151.1	-37.3	-93.8	-175.1	168.8	-74.4	0	103.8	V135	V135-K137 HydrophobicContact CG1-CG 4.11Å
138	E	29.1	Very low	29.1	Very low	138 Å²	138	132.6 Å²	132.6	65%	0.645	74%	0.735	S	S	*	*			cis	-164.8	163.3	-14.1	-102	165.2	166	0	0	105.5
139	L	29.1	Very low	29	Very low	127 Å²	127	133 Å²	133	67%	0.665	73%	0.73	S	S	*	*			cis	-134.1	-136.8	5.8	-133	173.5	0	0	0	108.6	L141	L139-L141 HydrophobicContact CD2-CD2 4.11Å; L139-L141 HydrophobicContact CD2-CG 4.21Å
140	D	24.7	Very low	27.9	Very low	141 Å²	141	137.9 Å²	137.9	75%	0.754	74%	0.742	S	S	*	*			cis	-145.2	176.1	12.3	-158.1	5.1	0	0	0	112.4
141	L	26.7	Very low	27.9	Very low	118 Å²	118	137.2 Å²	137.2	62%	0.618	74%	0.743	S	S	*	*			trans	-87	131.5	-158.5	-60.4	165.4	0	0	0	114.2	L139	L139-L141 HydrophobicContact CD2-CD2 4.11Å; L139-L141 HydrophobicContact CD2-CG 4.21Å
142	L	27.4	Very low	28.2	Very low	166 Å²	166	138.2 Å²	138.2	87%	0.869	75%	0.747	S	S	*	*				63.8	146.8	95.9	-60.3	-179.5	0	0	0	117.5
143	G	24.8	Very low	27	Very low	72 Å²	72	136.9 Å²	136.9	74%	0.742	75%	0.752	S	S	*	*			cis	151.4	149.4	-8.2	0	0	0	0	0	114.8
144	G	22.8	Very low	26.9	Very low	69 Å²	69	141.6 Å²	141.6	71%	0.711	76%	0.76	S	S	*	*			trans	102.9	161.5	168.9	0	0	0	0	0	117.1
145	W	24.9	Very low	27	Very low	256 Å²	256	139.1 Å²	139.1	97%	0.97	76%	0.756	S	S	*	*			cis	-155.4	176.7	-15.1	-106	98.9	0	0	0	108.4
146	M	23	Very low	26.8	Very low	175 Å²	175	145.3 Å²	145.3	86%	0.862	77%	0.77	S	S	*	*			trans	-87.5	155.1	-174.7	-70.6	177.1	140.3	0	0	115.7
147	D	25	Very low	27.3	Very low	156 Å²	156	146 Å²	146	83%	0.834	77%	0.77	S	S	*	*				125.3	141.4	121.5	-146.6	18.4	0	0	0	120.6
148	D	25.1	Very low	27.1	Very low	121 Å²	121	145.8 Å²	145.8	65%	0.647	78%	0.775	S	S	*	*			trans	39.4	152	162.7	-154.4	23.6	0	0	0	124.9
149	K	25.6	Very low	27.1	Very low	166 Å²	166	146.1 Å²	146.1	72%	0.722	78%	0.782	S	S	*	*			trans	90.7	117.1	158.9	-56.2	-176.2	179	122.7	0	121.9
150	K	23.9	Very low	27.2	Very low	194 Å²	194	144.8 Å²	144.8	84%	0.843	78%	0.78	S	S	*	*			trans	52.1	106.5	139	-64	-175.4	177.5	-179	0	121
151	V	22.2	Very low	27.3	Very low	137 Å²	137	146.6 Å²	146.6	83%	0.83	78%	0.782	S	S	*	*				19.2	137.6	110.8	-176.7	0	0	0	0	117.7
152	P	37.3	Very low	27.8	Very low	127 Å²	127	149.1 Å²	149.1	83%	0.825	78%	0.783	S	S	*	*			cis	-128.3	-158.7	-3	41.4	-24.3	0	0	0	112.5
153	G	21.6	Very low	27.9	Very low	75 Å²	75	148.7 Å²	148.7	77%	0.773	78%	0.782	S	S	*	*			trans	139.7	118	145.3	0	0	0	0	0	116.2
154	R	26.4	Very low	28.3	Very low	234 Å²	234	147.9 Å²	147.9	88%	0.883	77%	0.774	S	S	*	*			trans	-92.2	151.6	170.2	-87.8	-175	169.2	-170.2	-1.7	111.2
155	T	34.9	Very low	28.6	Very low	114 Å²	114	149.7 Å²	149.7	70%	0.699	77%	0.771	S	S	*	*			trans	52.5	131.2	144.2	54.5	0	0	0	0	120.5
156	Y	24.6	Very low	28.9	Very low	231 Å²	231	144.8 Å²	144.8	91%	0.906	76%	0.759	S	S	*	*				-124.9	126	128.8	-98.7	-86.8	0	0	0	110.4
157	S	43.5	Very low	29.1	Very low	105 Å²	105	142 Å²	142	73%	0.734	75%	0.752	S	S	*	*			trans	-92.8	142.1	163.4	52.8	0	0	0	0	108.7
158	N	26.3	Very low	29.2	Very low	139 Å²	139	141.5 Å²	141.5	74%	0.743	75%	0.749	S	S	*	*			trans	-138.9	132	170.1	-109	-10.9	0	0	0	113.7
159	N	28.2	Very low	30.1	Very low	146 Å²	146	141.2 Å²	141.2	78%	0.781	75%	0.753	S	S	*	*			trans	81	145.5	153.7	-61.6	-16.8	0	0	0	121.9
160	P	32.4	Very low	30	Very low	98 Å²	98	142.6 Å²	142.6	64%	0.636	76%	0.76	S	S	*	*			trans	-137.6	-130.2	-157.2	40	-14.5	0	0	0	111.9
161	F	27	Very low	30.1	Very low	179 Å²	179	140.7 Å²	140.7	79%	0.785	76%	0.758	S	S	*	*			trans	75.6	111.5	-169.5	-56.6	-75.1	0	0	0	113.1
162	W	37.7	Very low	30.3	Very low	172 Å²	172	141.7 Å²	141.7	65%	0.652	76%	0.759	S	S	*	*				84	149.2	54.6	-78.7	57.5	0	0	0	112.9
163	N	28.5	Very low	29.8	Very low	156 Å²	156	139.4 Å²	139.4	83%	0.834	76%	0.758	S	S	*	*			cis	-102.1	160.3	8.8	-56.8	-51.8	0	0	0	112.1
164	G	32.4	Very low	29.9	Very low	56 Å²	56	143.4 Å²	143.4	58%	0.577	76%	0.762	S	S	*	*			cis	178	175.6	-1	0	0	0	0	0	107.3
165	V	30.4	Very low	29.8	Very low	107 Å²	107	138.3 Å²	138.3	65%	0.648	76%	0.757	S	S	*	*			cis	-159.7	128.1	20.6	161.8	0	0	0	0	109
166	Q	30.3	Very low	30.2	Very low	153 Å²	153	138.2 Å²	138.2	72%	0.715	76%	0.758	S	S	*	*			trans	54	153.4	148.9	-60.1	170.7	-3.5	0	0	121.3
167	T	28.6	Very low	30.3	Very low	117 Å²	117	133.2 Å²	133.2	72%	0.718	75%	0.751	S	S	*	*			cis	-162.2	142.1	-14.6	20	0	0	0	0	112.4
168	N	26	Very low	29.5	Very low	145 Å²	145	134.3 Å²	134.3	78%	0.775	75%	0.753	S	S	*	*				5.4	166.5	126.4	-69.4	-0.6	0	0	0	121.6
169	P	43.5	Very low	30	Very low	114 Å²	114	132.8 Å²	132.8	74%	0.74	75%	0.751	S	S	*	*			cis	-142.9	-156.9	-31.8	41.3	-21	0	0	0	114
170	F	23.6	Very low	29.8	Very low	195 Å²	195	130.4 Å²	130.4	86%	0.855	75%	0.746	S	S	*	*			trans	-64.8	143.5	-179.5	-52.3	-99.3	0	0	0	117
171	L	26.8	Very low	29.6	Very low	155 Å²	155	132.8 Å²	132.8	81%	0.812	75%	0.753	S	S	*	*				172.9	155.3	106.9	-94.5	171.6	0	0	0	114
172	N	25.9	Very low	29.8	Very low	158 Å²	158	129.9 Å²	129.9	85%	0.845	75%	0.745	S	S	*	*			trans	32.8	128.1	159.6	-66.7	-2	0	0	0	122.3
173	G	26.3	Very low	29.3	Very low	79 Å²	79	128.8 Å²	128.8	81%	0.814	75%	0.747	S	S	*	*			trans	-175.1	132.2	160.4	0	0	0	0	0	113.3
174	N	24.7	Very low	29.3	Very low	158 Å²	158	128.2 Å²	128.2	85%	0.845	74%	0.743	S	S	*	*			trans	-95.8	149.2	177.7	-78.1	-22.4	0	0	0	112
175	V	24.5	Very low	28.9	Very low	128 Å²	128	130.8 Å²	130.8	78%	0.776	74%	0.744	S	S	*	*				17.5	139	127.1	-173.3	0	0	0	0	117.3
176	P	43.8	Very low	29.3	Very low	111 Å²	111	130.4 Å²	130.4	72%	0.721	74%	0.744	S	S	*	*			cis	-135.2	-153.6	10.2	24.8	2.5	0	0	0	114.8
177	V	25.1	Very low	29	Very low	127 Å²	127	132.1 Å²	132.1	77%	0.77	75%	0.749	S	S	*	*			trans	102.2	104.6	149.8	-174	0	0	0	0	119.2
178	T	28.1	Very low	28.8	Very low	127 Å²	127	131.3 Å²	131.3	78%	0.779	75%	0.748	S	S	*	*			trans	-74.2	150.3	144.7	49	0	0	0	0	110.1
179	P	35.5	Very low	28.6	Very low	107 Å²	107	130.9 Å²	130.9	70%	0.695	75%	0.751	S	S	*	*				-159.6	-163.1	62.3	41.7	-18.3	0	0	0	117.4
180	S	24.7	Very low	27.7	Very low	96 Å²	96	131.2 Å²	131.2	67%	0.671	75%	0.75	S	S	*	*			trans	71.8	135.1	155.8	37.3	0	0	0	0	119.2
181	L	28.8	Very low	27.7	Very low	149 Å²	149	128.5 Å²	128.5	78%	0.78	75%	0.745	S	S	*	*				71.4	141.5	55.6	-99	63.9	0	0	0	112.7
182	D	29.7	Very low	27.6	Very low	117 Å²	117	127.4 Å²	127.4	63%	0.626	74%	0.739	S	S	*	*			cis	-132.9	-170.9	1.9	-125.9	-41.1	0	0	0	108.5
183	E	28.5	Very low	27.6	Very low	149 Å²	149	125.7 Å²	125.7	70%	0.696	73%	0.729	S	S	*	*			cis	-152.5	166.8	16.3	-131.7	162.7	-159.2	0	0	106.7
184	L	27.5	Very low	27.5	Very low	144 Å²	144	127.9 Å²	127.9	75%	0.754	72%	0.722	S	S	*	*			cis	-156.3	122.2	29.9	-157.8	144.3	0	0	0	113.1
185	N	25.2	Very low	27.4	Very low	111 Å²	111	128.7 Å²	128.7	59%	0.594	72%	0.718	S	S	*	*			trans	-9.6	170.3	155.3	-77.9	-56.6	0	0	0	122.5
186	P	37.1	Very low	27.3	Very low	99 Å²	99	129.2 Å²	129.2	64%	0.643	72%	0.717	S	S	*	*			cis	-146.1	177.1	-35.3	41.7	-23.6	0	0	0	116.6
187	K	24.6	Very low	26.5	Very low	189 Å²	189	130.4 Å²	130.4	82%	0.822	72%	0.722	S	S	*	*			trans	22.7	154.4	138.7	-61.2	168.4	-174	170.1	0	123
188	S	23.9	Very low	26.4	Very low	99 Å²	99	128 Å²	128	69%	0.692	72%	0.722	S	S	*	*			cis	176.2	119.5	-27.2	54.4	0	0	0	0	112.5
189	T	23.6	Very low	26.2	Very low	136 Å²	136	128.4 Å²	128.4	83%	0.834	73%	0.725	S	S	*	*			trans	-166.8	136.4	160.3	24.8	0	0	0	0	107
190	V	24.6	Very low	25.5	Very low	121 Å²	121	128.6 Å²	128.6	73%	0.733	73%	0.729	S	S	*	*				88.1	127.1	52	173.3	0	0	0	0	113
191	D	22.3	Very low	25.4	Very low	139 Å²	139	127.9 Å²	127.9	74%	0.743	72%	0.724	S	S	*	*			trans	69	157.9	164.6	-75.9	8.2	0	0	0	121.6
192	L	25.9	Very low	25.2	Very low	131 Å²	131	129.9 Å²	129.9	69%	0.686	73%	0.727	S	S	*	*			cis	-171.5	158.6	-41.9	-119.2	-174.3	0	0	0	110.8
193	L	24.9	Very low	24.8	Very low	123 Å²	123	129.8 Å²	129.8	64%	0.644	73%	0.731	S	S	*	*			trans	66.2	147.5	161.9	-56.2	175.4	0	0	0	117.8
194	L	24.1	Very low	24.5	Very low	124 Å²	124	131 Å²	131	65%	0.649	74%	0.737	S	S	*	*				49.3	146.3	88.4	-39.9	176.5	0	0	0	113.8
195	F	23	Very low	24.3	Very low	175 Å²	175	129.6 Å²	129.6	77%	0.768	74%	0.738	S	S	*	*			cis	-150.3	-175.5	20.2	-69.3	-90.1	0	0	0	109.5
196	D	22.7	Very low	24.2	Very low	140 Å²	140	129.9 Å²	129.9	75%	0.749	75%	0.749	S	S	*	*				-164.4	-131	-51.4	-158.8	-90.1	0	0	0	108.6
197	T	26	Very low	23.6	Very low	135 Å²	135	131 Å²	131	83%	0.828	76%	0.759	S	S	*	*			trans	-58.2	144.2	180	50.6	0	0	0	0	117
198	G	22.9	Very low	23.5	Very low	76 Å²	76	125.8 Å²	125.8	78%	0.784	75%	0.752	S	S	*	*			trans	-168.3	145.8	164.8	0	0	0	0	0	113
199	T	23.7	Very low	23.5	Very low	136 Å²	136	127.6 Å²	127.6	83%	0.834	76%	0.758	S	S	*	*			trans	-129.4	161.9	179.9	40	0	0	0	0	112.2
200	S	22.4	Very low	23.6	Very low	112 Å²	112	127.3 Å²	127.3	78%	0.783	76%	0.757	S	S	*	*			trans	73.6	157.9	173	92.4	0	0	0	0	114.7
201	S	22.6	Very low	23.6	Very low	81 Å²	81	129.2 Å²	129.2	57%	0.566	76%	0.763	S	S	*	*			cis	-152.1	152.6	0.1	-55.9	0	0	0	0	111.4
202	F	23.2	Very low	23.6	Very low	191 Å²	191	128 Å²	128	84%	0.838	77%	0.766	S	S	*	*			trans	57.5	162.6	156.4	-55.4	-56.9	0	0	0	118
203	T	22.8	Very low	23.7	Very low	115 Å²	115	128.2 Å²	128.2	71%	0.706	77%	0.772	S	S	*	*			cis	-146	174.9	-9.7	-6.4	0	0	0	0	110.1
204	E	21.9	Very low	23.6	Very low	175 Å²	175	125.7 Å²	125.7	82%	0.818	78%	0.776	S	S	*	*			trans	-30.6	152.2	167.5	-58.5	160	141.7	0	0	116.2
205	S	23.8	Very low	23.7	Very low	113 Å²	113	126.3 Å²	126.3	79%	0.79	78%	0.78	S	S	*	*				-169.6	169.9	55	37.8	0	0	0	0	116
206	S	22.2	Very low	23.8	Very low	117 Å²	117	124.2 Å²	124.2	82%	0.818	78%	0.775	S	S	*	*			trans	-30.8	170	166	-39.6	0	0	0	0	118.4
207	S	24.2	Very low	24	Very low	123 Å²	123	126.4 Å²	126.4	86%	0.86	78%	0.779	S	S	*	*			cis	-149.3	-168.1	14.9	59	0	0	0	0	112.2
208	A	22.3	Very low	24.1	Very low	80 Å²	80	126.6 Å²	126.6	66%	0.661	78%	0.775	S	S	*	*			trans	-136.4	170.8	-164.9	0	0	0	0	0	115.8
209	T	25	Very low	24.1	Very low	136 Å²	136	132 Å²	132	83%	0.834	78%	0.779	S	S	*	*			trans	71.5	158	169	67.6	0	0	0	0	115.9
210	T	24.6	Very low	24.2	Very low	130 Å²	130	133.1 Å²	133.1	80%	0.798	78%	0.779	S	S	*	*			cis	-138.2	178.9	26.1	51	0	0	0	0	115.7
211	N	25.3	Very low	24.6	Very low	162 Å²	162	133.3 Å²	133.3	87%	0.866	78%	0.778	S	S	*	*			trans	-96.5	175.7	-175.8	-50.5	-39	0	0	0	114.2
212	S	21.6	Very low	24.6	Very low	114 Å²	114	135.4 Å²	135.4	80%	0.797	79%	0.787	S	S	*	*			trans	-154.4	165.9	148.1	64.9	0	0	0	0	111.4
213	T	29.2	Very low	24.6	Very low	134 Å²	134	132 Å²	132	82%	0.822	78%	0.782	S	S	*	*				-172	149.4	-53.3	-57.3	0	0	0	0	105.2
214	G	23	Very low	24.6	Very low	71 Å²	71	134.2 Å²	134.2	73%	0.732	79%	0.79	S	S	*	*			trans	179.5	145.2	174.8	0	0	0	0	0	114.5
215	N	25.2	Very low	24.7	Very low	136 Å²	136	129.7 Å²	129.7	73%	0.727	79%	0.79	S	S	*	*			trans	-138.4	168.8	-155	-65.2	15.4	0	0	0	110.8
216	I	25.6	Very low	24.7	Very low	131 Å²	131	131.9 Å²	131.9	67%	0.672	79%	0.792	S	S	*	*			cis	-169.8	150.8	-12.6	-103.1	170.3	0	0	0	105.7
217	F	27	Very low	24.9	Very low	187 Å²	187	135.1 Å²	135.1	82%	0.82	79%	0.794	S	S	*	*				174.8	-159.5	86.2	-135.4	-30	0	0	0	113.1
218	D	26.9	Very low	24.8	Very low	138 Å²	138	133.9 Å²	133.9	74%	0.738	79%	0.791	S	S	*	*			trans	-77.6	-176.8	-178.6	-65.6	-55.3	0	0	0	114
219	E	22.7	Very low	25	Very low	190 Å²	190	138.9 Å²	138.9	89%	0.888	80%	0.801	S	S	*	*			cis	-157.8	-176.7	25.5	-155.5	173.3	-165.1	0	0	113
220	L	26.3	Very low	25	Very low	159 Å²	159	138 Å²	138	83%	0.832	80%	0.797	S	S	*	*			trans	-120.7	151	-175.3	-74.9	169.9	0	0	0	112.2
221	P	30.4	Very low	25.1	Very low	117 Å²	117	137.5 Å²	137.5	76%	0.76	80%	0.796	S	S	*	*				-162.8	149.6	87	40.8	-18.8	0	0	0	121.2
222	V	23.6	Very low	25.3	Very low	124 Å²	124	136 Å²	136	75%	0.752	79%	0.793	S	S	*	*			trans	57.8	131.5	130.3	-173.2	0	0	0	0	124.5
223	T	23.3	Very low	25.4	Very low	120 Å²	120	141.5 Å²	141.5	74%	0.736	80%	0.796	S	S	*	*			trans	84.8	137.1	155.1	40.6	0	0	0	0	125.7
224	N	23.3	Very low	25.4	Very low	162 Å²	162	146.5 Å²	146.5	87%	0.866	80%	0.8	S	S	*	*			trans	69.5	133.6	150	-66.6	-8.5	0	0	0	122.5
225	G	23	Very low	25.4	Very low	79 Å²	79	150.5 Å²	150.5	81%	0.814	81%	0.805	S	S	*	*			trans	134.9	83.2	146.5	0	0	0	0	0	119.9
226	L	24.4	Very low	25.8	Very low	160 Å²	160	148.2 Å²	148.2	84%	0.838	79%	0.792	S	S	*	*			trans	6.1	132.7	152.7	-61.4	163.7	0	0	0	122.3
227	H	25.8	Very low	26.1	Very low	185 Å²	185	147.1 Å²	147.1	86%	0.856	79%	0.793	S	S	*	*			trans	50.3	115.1	145.6	-76.7	-82	0	0	0	122.8
228	A	22.9	Very low	26.5	Very low	97 Å²	97	144 Å²	144	80%	0.802	78%	0.78	S	S	*	*				-165.5	139.8	120.2	0	0	0	0	0	111.8
229	E	25.6	Very low	26.9	Very low	184 Å²	184	146.3 Å²	146.3	86%	0.86	78%	0.784	S	S	*	*			trans	-87.5	149.6	160.7	-78.2	-161.8	135	0	0	110.4
230	P	26.1	Very low	27.3	Very low	117 Å²	117	148.9 Å²	148.9	76%	0.76	79%	0.785	S	S	*	*				-136.4	176.6	117.5	38.4	-26	0	0	0	112.5
231	P	26.8	Very low	27.6	Very low	120 Å²	120	143.9 Å²	143.9	78%	0.779	76%	0.764	S	S	*	*			trans	-98.5	142.8	-132.9	35.1	-36.2	0	0	0	116.5	R233	P231-R233 PolarHBondContact O-N 3.45Å
232	V	27.9	Very low	28.1	Very low	131 Å²	131	148.5 Å²	148.5	79%	0.794	77%	0.772	S	S	*	*			trans	-78	115.9	175.6	178.2	0	0	0	0	111.7	R234	V232-R234 PolarHBondContact O-N 3.31Å
233	R	24.5	Very low	29	Very low	230 Å²	230	150 Å²	150	87%	0.868	76%	0.764	S	S	*	*			trans	-64.8	110.7	158.5	-81.9	-174.2	173.1	-177.6	-0.1	109.3	P231 D235	P231-R233 PolarHBondContact O-N 3.45Å; R233-D235 PolarHBondContact O-N 3.44Å
234	R	28.4	Very low	29.7	Very low	238 Å²	238	146.5 Å²	146.5	90%	0.898	75%	0.745	S	S	*	*			trans	-74.3	89.5	168.1	-76.7	-174.3	174.3	179.7	-1.6	110.6	V232 N236	V232-R234 PolarHBondContact O-N 3.31Å; R234-N236 PolarHBondContact O-N 2.97Å
235	D	23.8	Very low	30.6	Very low	156 Å²	156	144.5 Å²	144.5	83%	0.834	73%	0.725	S	S	*	*			trans	-67.8	125	159.9	-94.2	-39.9	0	0	0	109.4	R233	R233-D235 PolarHBondContact O-N 3.44Å
236	N	33	Very low	31.7	Very low	88 Å²	88	140.8 Å²	140.8	47%	0.471	69%	0.687	S	S	.	*			trans	-97.8	117	-164.3	-160.6	-6.5	0	0	0	111.4	R234 F238	R234-N236 PolarHBondContact O-N 2.97Å; N236-F238 VanDerWaalsContact C-N 3.26Å; N236-F238 PolarHBondContact O-N 3.3Å; N236-F238 VanDerWaalsContact O-N 3.11Å; N236-F238 WeakPolarHBondContact OD1-CD2 3.32Å
237	P	32.4	Very low	33	Very low	107 Å²	107	134.2 Å²	134.2	70%	0.695	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-65.5	-19.7	-165.5	23	-35	0	0	0	115.7	F239 R240	P237-F239 PolarHBondContact O-N 3.39Å; P237-R240 PolarHBondContact O-N 3.11Å
238	F	35.3	Very low	33.7	Very low	122 Å²	122	127.8 Å²	127.8	54%	0.535	63%	0.628	S	S	.	*	G	3₁₀ helix	trans	-58	-18.5	-176.4	-69.2	-79.4	0	0	0	115.3	N236 E889	N236-F238 VanDerWaalsContact C-N 3.26Å; N236-F238 PolarHBondContact O-N 3.3Å; N236-F238 VanDerWaalsContact O-N 3.11Å; N236-F238 WeakPolarHBondContact OD1-CD2 3.32Å; F238-E889 WeakPolarHBondContact CE2-OE1 3.43Å; F238-E889 WeakPolarHBondContact CZ-OE2 3.47Å
239	F	36.1	Very low	34.8	Very low	186 Å²	186	126.3 Å²	126.3	82%	0.816	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-86.7	0.3	-174.2	-74.2	-74.6	0	0	0	116.2	P237	P237-F239 PolarHBondContact O-N 3.39Å
240	R	30.9	Very low	35.7	Very low	244 Å²	244	121.1 Å²	121.1	92%	0.921	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-107.5	8.5	-173.6	-74.4	-163.3	178.9	-162.1	3.5	117.7	P237	P237-R240 PolarHBondContact O-N 3.11Å
241	S	33.1	Very low	36.4	Very low	55 Å²	55	118.6 Å²	118.6	39%	0.385	57%	0.568	S	S	.	*			trans	-147	122.9	172	-175.3	0	0	0	0	113.5	R243 Y245	S241-R243 PolarHBondContact O-N 2.86Å; S241-Y245 PolarHBondContact OG-OH 3.06Å
242	K	40.8	Very low	36.9	Very low	213 Å²	213	117.9 Å²	117.9	93%	0.926	56%	0.561	S	S	*	*			trans	-93.2	72.5	171.3	-69	-178.1	-179.2	174.3	0	110.6
243	R	40.9	Very low	37.3	Very low	156 Å²	156	118.1 Å²	118.1	59%	0.589	56%	0.557	S	S	*	*			trans	-135.2	148.1	171.2	-65.9	-167.7	-174.5	-173	6.5	110.6	S241 Y245	S241-R243 PolarHBondContact O-N 2.86Å; R243-Y245 HydrophobicContact CB-CE2 4.48Å; R243-Y245 WeakPolarHBondContact O-CD2 3.46Å; R243-Y245 PolarHBondContact O-N 3.12Å
244	S	39.4	Very low	38	Very low	47 Å²	47	112.5 Å²	112.5	33%	0.329	54%	0.541	S	S	.	.			trans	-77.6	114.1	172.7	42.8	0	0	0	0	110.4	L751	S244-L751 WeakPolarHBondContact CB-O 3.34Å
245	Y	41.7	Very low	38.2	Very low	119 Å²	119	105.2 Å²	105.2	47%	0.467	53%	0.532	S	S	.	.			trans	-90	151.8	172.5	-66.8	-87	0	0	0	110.6	S241 R243	S241-Y245 PolarHBondContact OG-OH 3.06Å; R243-Y245 HydrophobicContact CB-CE2 4.48Å; R243-Y245 WeakPolarHBondContact O-CD2 3.46Å; R243-Y245 PolarHBondContact O-N 3.12Å
246	S	46.5	Very low	38.6	Very low	1 Å²	1	107.3 Å²	107.3	1%	0.007	53%	0.533	C	S	.	.			trans	-83.8	140.4	171.9	-164.2	0	0	0	0	110.2	S248 E249	S246-S248 PolarHBondContact O-N 2.63Å; S246-S248 PolarHBondContact OG-OG 2.93Å; S246-E249 PolarHBondContact N-OE2 2.84Å; S246-E249 WeakPolarHBondContact O-CB 2.83Å; S246-E249 PolarHBondContact O-N 2.91Å
247	L	50.6	Low	38.5	Very low	22 Å²	22	106.5 Å²	106.5	12%	0.115	53%	0.534	C	S	.	.	H	α-helix	trans	-60.8	-16.7	177.8	-67.9	-171.4	0	0	0	113.7	E249 L250 S251 I754 L847 W892	L247-E249 VanDerWaalsContact C-N 3.3Å; L247-E249 PolarHBondContact O-N 2.85Å; L247-L250 HydrophobicContact CD2-CD1 3.84Å; L247-S251 WeakPolarHBondContact O-CB 3.42Å; L247-S251 PolarHBondContact O-N 2.92Å; L247-S251 VanDerWaalsContact O-N 3.11Å; L247-S251 PolarHBondContact O-OG 2.87Å; L247-I754 HydrophobicContact CD1-CD1 4.28Å; L247-I754 HydrophobicContact CD1-CG1 3.85Å; L247-I754 HydrophobicContact CG-CG1 4.42Å; L247-L847 HydrophobicContact CD1-CD1 4.26Å; L247-L847 HydrophobicContact CD1-CD2 4.37Å; L247-W892 HydrophobicContact CD1-CH2 3.41Å; L247-W892 VanDerWaalsContact CD1-CH2 3.41Å; L247-W892 HydrophobicContact CD1-CZ2 3.89Å; L247-W892 HydrophobicContact CD1-CZ3 3.85Å; L247-W892 HydrophobicContact CD2-CZ2 4.33Å
248	S	41.1	Very low	38.4	Very low	50 Å²	50	109.2 Å²	109.2	35%	0.35	54%	0.543	S	S	.	.	H	α-helix	trans	-63.5	-33.3	169.1	56.9	0	0	0	0	113.3	S246 V252	S246-S248 PolarHBondContact O-N 2.63Å; S246-S248 PolarHBondContact OG-OG 2.93Å; S248-V252 WeakPolarHBondContact O-CG2 3.04Å; S248-V252 PolarHBondContact O-N 2.67Å
249	E	45.5	Very low	38.1	Very low	67 Å²	67	107.8 Å²	107.8	31%	0.313	55%	0.554	S	S	.	*	H	α-helix	trans	-76.5	-42.1	-177.8	-68.1	143.1	-166.3	0	0	110.7	S246 L247 S251 V252	S246-E249 PolarHBondContact N-OE2 2.84Å; S246-E249 WeakPolarHBondContact O-CB 2.83Å; S246-E249 PolarHBondContact O-N 2.91Å; L247-E249 VanDerWaalsContact C-N 3.3Å; L247-E249 PolarHBondContact O-N 2.85Å; E249-S251 VanDerWaalsContact C-N 3.32Å; E249-S251 PolarHBondContact O-N 2.83Å; E249-V252 PolarHBondContact O-N 3.31Å
250	L	45.6	Very low	38.2	Very low	74 Å²	74	103.4 Å²	103.4	39%	0.387	54%	0.544	S	S	.	.	H	α-helix	trans	-63.5	-38.2	173.4	-56	-174.4	0	0	0	111.8	L247 V252 L253 Q254	L247-L250 HydrophobicContact CD2-CD1 3.84Å; L250-V252 VanDerWaalsContact C-N 3.28Å; L250-V252 PolarHBondContact O-N 3.28Å; L250-L253 PolarHBondContact O-N 2.84Å; L250-Q254 PolarHBondContact O-N 3.02Å; L250-Q254 VanDerWaalsContact O-N 3.1Å
251	S	39.7	Very low	38.3	Very low	64 Å²	64	98.1 Å²	98.1	45%	0.448	54%	0.539	S	S	.	.	H	α-helix	trans	-61.6	-34.2	178	-59.9	0	0	0	0	113	L247 E249 Q254 A255	L247-S251 WeakPolarHBondContact O-CB 3.42Å; L247-S251 PolarHBondContact O-N 2.92Å; L247-S251 VanDerWaalsContact O-N 3.11Å; L247-S251 PolarHBondContact O-OG 2.87Å; E249-S251 VanDerWaalsContact C-N 3.32Å; E249-S251 PolarHBondContact O-N 2.83Å; S251-Q254 PolarHBondContact O-N 3.3Å; S251-A255 VanDerWaalsContact O-CB 3.24Å; S251-A255 WeakPolarHBondContact O-CB 3.39Å; S251-A255 PolarHBondContact O-N 2.85Å
252	V	37.9	Very low	37.9	Very low	105 Å²	105	101.7 Å²	101.7	64%	0.636	56%	0.564	S	S	*	*	H	α-helix	trans	-72.5	-29	179.2	169.7	0	0	0	0	112.1	S248 E249 L250	S248-V252 WeakPolarHBondContact O-CG2 3.04Å; S248-V252 PolarHBondContact O-N 2.67Å; E249-V252 PolarHBondContact O-N 3.31Å; L250-V252 VanDerWaalsContact C-N 3.28Å; L250-V252 PolarHBondContact O-N 3.28Å
253	L	35.8	Very low	37.4	Very low	137 Å²	137	97.2 Å²	97.2	72%	0.717	56%	0.56	S	S	*	*	H	α-helix	trans	-74.7	-40.2	173	-63.1	174.1	0	0	0	111.5	L250	L250-L253 PolarHBondContact O-N 2.84Å
254	Q	38.9	Very low	36.7	Very low	112 Å²	112	94.4 Å²	94.4	52%	0.523	56%	0.564	S	S	.	*	H	α-helix	trans	-75.1	-25.1	-179.5	-164.8	162.8	48.7	0	0	113.3	L250 S251 K256 S257	L250-Q254 PolarHBondContact O-N 3.02Å; L250-Q254 VanDerWaalsContact O-N 3.1Å; S251-Q254 PolarHBondContact O-N 3.3Å; Q254-K256 PolarHBondContact O-N 2.87Å; Q254-K256 VanDerWaalsContact O-N 3.09Å; Q254-S257 PolarHBondContact O-N 2.93Å; Q254-S257 PolarHBondContact O-OG 3.15Å
255	A	32.9	Very low	36.2	Very low	85 Å²	85	101.6 Å²	101.6	70%	0.702	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	7.1	-179.2	0	0	0	0	0	115.6	S251	S251-A255 VanDerWaalsContact O-CB 3.24Å; S251-A255 WeakPolarHBondContact O-CB 3.39Å; S251-A255 PolarHBondContact O-N 2.85Å
256	K	33.1	Very low	35.7	Very low	199 Å²	199	103.5 Å²	103.5	87%	0.865	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-2.6	173.6	-78.5	-168.3	172.8	-173.4	0	114.3	Q254	Q254-K256 PolarHBondContact O-N 2.87Å; Q254-K256 VanDerWaalsContact O-N 3.09Å
257	S	31.3	Very low	35.1	Very low	71 Å²	71	110.8 Å²	110.8	50%	0.497	65%	0.645	S	S	.	*	S	Bend	trans	-125.2	118.9	178.8	53	0	0	0	0	112.1	Q254	Q254-S257 PolarHBondContact O-N 2.93Å; Q254-S257 PolarHBondContact O-OG 3.15Å
258	D	28.8	Very low	34.5	Very low	165 Å²	165	111.8 Å²	111.8	88%	0.882	66%	0.66	S	S	*	*			trans	72.8	126.7	150.7	-50.4	-26.5	0	0	0	121.9
259	A	29.4	Very low	34.6	Very low	91 Å²	91	112 Å²	112	75%	0.752	66%	0.658	S	S	*	*			trans	-121.5	171.6	149.9	0	0	0	0	0	106.3
260	P	38.6	Very low	34.5	Very low	94 Å²	94	117.8 Å²	117.8	61%	0.61	68%	0.681	S	S	*	*			cis	-146.7	178.3	21.4	43.4	-22.7	0	0	0	118
261	T	32.4	Very low	34.4	Very low	134 Å²	134	118 Å²	118	82%	0.822	69%	0.69	S	S	*	*			trans	31.7	130	147.5	57.8	0	0	0	0	123
262	S	25	Very low	34.7	Very low	129 Å²	129	115.9 Å²	115.9	90%	0.902	67%	0.674	S	S	*	*			trans	-151.2	170.1	140.6	63.4	0	0	0	0	110.8
263	S	30.5	Very low	35.2	Very low	120 Å²	120	112.4 Å²	112.4	84%	0.839	66%	0.656	S	S	*	*			trans	-124.2	149.9	-167.1	52.1	0	0	0	0	113.9
264	S	25.1	Very low	35.6	Very low	96 Å²	96	109.8 Å²	109.8	67%	0.671	65%	0.648	S	S	*	*			trans	-157.9	124.1	172.5	-168.4	0	0	0	0	115.5	F266	S264-F266 PolarHBondContact O-N 2.92Å
265	F	30.6	Very low	36.1	Very low	199 Å²	199	113.4 Å²	113.4	87%	0.873	66%	0.664	S	S	*	*			trans	29.5	34	140.8	-66.2	-84.3	0	0	0	123.4
266	F	30.5	Very low	36.9	Very low	159 Å²	159	115.7 Å²	115.7	70%	0.697	66%	0.66	S	S	*	*			trans	-111.4	79	160.7	-83.7	-88.7	0	0	0	112.2	S264 G268 L269	S264-F266 PolarHBondContact O-N 2.92Å; F266-G268 PolarHBondContact O-N 2.88Å; F266-L269 WeakPolarHBondContact CB-O 3.39Å
267	T	33	Very low	37.9	Very low	154 Å²	154	109 Å²	109	95%	0.945	63%	0.632	S	S	*	*	S	Bend	trans	-80.6	58.4	176.4	44.2	0	0	0	0	112.7
268	G	39.5	Very low	38.5	Very low	42 Å²	42	115.6 Å²	115.6	43%	0.433	65%	0.654	S	S	.	*	S	Bend	trans	-176.9	-37.4	174.6	0	0	0	0	0	114.2	F266	F266-G268 PolarHBondContact O-N 2.88Å
269	L	43	Very low	39.1	Very low	56 Å²	56	109.6 Å²	109.6	29%	0.293	63%	0.626	S	S	.	*			trans	-123.7	96	171	-76.1	170.6	0	0	0	109.1	F266 S271 P486	F266-L269 WeakPolarHBondContact CB-O 3.39Å; L269-S271 PolarHBondContact O-N 2.86Å; L269-P486 HydrophobicContact CD1-CG 4.31Å; L269-P486 HydrophobicContact CD2-CG 4.37Å; L269-P486 HydrophobicContact CG-CG 4.48Å
270	K	43	Very low	39.6	Very low	187 Å²	187	115.7 Å²	115.7	81%	0.813	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-67.1	127.9	165.3	-70.7	-176.1	178.4	-179.9	0	107.8
271	S	44.1	Very low	39.7	Very low	80 Å²	80	115.1 Å²	115.1	56%	0.559	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-55.3	132.7	169.5	54.1	0	0	0	0	109.4	L269 A273	L269-S271 PolarHBondContact O-N 2.86Å; S271-A273 PolarHBondContact O-N 2.89Å
272	P	46.2	Very low	40.4	Very low	19 Å²	19	112 Å²	112	12%	0.123	60%	0.597	C	S	.	*	P	Polyproline II helix	trans	-54.5	131.7	176.3	20.5	-31.4	0	0	0	109.9	F277 F283 A286 W287	P272-F277 HydrophobicContact CB-CE2 3.49Å; P272-F277 VanDerWaalsContact CB-CE2 3.49Å; P272-F277 HydrophobicContact CB-CZ 3.82Å; P272-F283 WeakPolarHBondContact O-CE2 3.37Å; P272-A286 HydrophobicContact CB-CB 4.29Å; P272-A286 HydrophobicContact CG-CB 4.18Å; P272-W287 HydrophobicContact CG-CB 4.48Å
273	A	46.8	Very low	41.5	Very low	31 Å²	31	108.3 Å²	108.3	26%	0.256	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-92.6	145.6	178.9	0	0	0	0	0	110.4	S271 E275 Q276 F277	S271-A273 PolarHBondContact O-N 2.89Å; A273-E275 PolarHBondContact O-N 3.28Å; A273-Q276 HydrophobicContact CB-CG 4.16Å; A273-Q276 WeakPolarHBondContact O-CB 3.39Å; A273-Q276 PolarHBondContact O-N 3.28Å; A273-Q276 VanDerWaalsContact O-N 3.08Å; A273-F277 WeakPolarHBondContact O-CD2 3.19Å
274	P	44.7	Very low	42.3	Very low	83 Å²	83	107.6 Å²	107.6	54%	0.539	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-56.4	-37.5	-178.4	-24.9	34.1	0	0	0	113.5	Q276 F277 F283	P274-Q276 PolarHBondContact O-N 2.7Å; P274-Q276 VanDerWaalsContact O-N 3.14Å; P274-F277 PolarHBondContact O-N 2.66Å; P274-F283 HydrophobicContact CB-CD2 4.37Å; P274-F283 HydrophobicContact CB-CE2 4.24Å; P274-F283 HydrophobicContact CG-CD2 4.38Å; P274-F283 HydrophobicContact CG-CE2 3.76Å; P274-F283 HydrophobicContact CG-CZ 3.91Å
275	E	50.2	Low	43.3	Very low	187 Å²	187	106.7 Å²	106.7	87%	0.874	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-63.2	-15	180	-66.6	148.1	-145.7	0	0	114.2	A273	A273-E275 PolarHBondContact O-N 3.28Å
276	Q	48.5	Very low	44.1	Very low	133 Å²	133	98.5 Å²	98.5	62%	0.621	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-88.1	-6.2	-178.6	-64.7	172.5	-35.2	0	0	113.5	A273 P274	A273-Q276 HydrophobicContact CB-CG 4.16Å; A273-Q276 WeakPolarHBondContact O-CB 3.39Å; A273-Q276 PolarHBondContact O-N 3.28Å; A273-Q276 VanDerWaalsContact O-N 3.08Å; P274-Q276 PolarHBondContact O-N 2.7Å; P274-Q276 VanDerWaalsContact O-N 3.14Å
277	F	53.8	Low	45.1	Very low	60 Å²	60	96 Å²	96	26%	0.263	49%	0.489	S	S	.	.			trans	-130.4	125.7	-172.3	-60.3	-90.7	0	0	0	111.2	P272 A273 P274 S279 D282 F283 A286	P272-F277 HydrophobicContact CB-CE2 3.49Å; P272-F277 VanDerWaalsContact CB-CE2 3.49Å; P272-F277 HydrophobicContact CB-CZ 3.82Å; A273-F277 WeakPolarHBondContact O-CD2 3.19Å; P274-F277 PolarHBondContact O-N 2.66Å; F277-S279 VanDerWaalsContact C-N 3.33Å; F277-D282 HydrophobicContact CB-CB 4.32Å; F277-D282 HydrophobicContact CD1-CB 3.88Å; F277-D282 HydrophobicContact CG-CB 4.48Å; F277-F283 HydrophobicContact CB-CB 4.07Å; F277-F283 HydrophobicContact CD2-CB 4.26Å; F277-F283 HydrophobicContact CD2-CD2 4.11Å; F277-F283 HydrophobicContact CG-CB 4.22Å; F277-A286 HydrophobicContact CE1-CB 3.98Å; F277-A286 HydrophobicContact CZ-CB 3.9Å
278	Q	44.2	Very low	45.6	Very low	208 Å²	208	92 Å²	92	97%	0.972	46%	0.461	S	S	*	.	S	Bend	trans	-73.4	-25.2	179.7	-64.2	-178.9	0.3	0	0	112.6
279	S	42.8	Very low	45.9	Very low	40 Å²	40	93.3 Å²	93.3	28%	0.28	46%	0.459	S	S	.	.	S	Bend	trans	-106.3	138.5	170	-178	0	0	0	0	112.6	F277 E281 D282 F283	F277-S279 VanDerWaalsContact C-N 3.33Å; S279-E281 PolarHBondContact O-N 2.82Å; S279-E281 PolarHBondContact OG-N 3.43Å; S279-E281 VanDerWaalsContact OG-N 3.09Å; S279-D282 VanDerWaalsContact CB-OD2 3.31Å; S279-D282 WeakPolarHBondContact CB-OD2 3.5Å; S279-D282 PolarHBondContact O-N 2.85Å; S279-F283 PolarHBondContact O-N 3.12Å; S279-F283 VanDerWaalsContact O-N 3.13Å
280	R	39.6	Very low	46	Very low	218 Å²	218	92.7 Å²	92.7	82%	0.823	45%	0.454	S	S	*	.	H	α-helix	trans	-63.3	-21.6	170.2	-168.9	172	-174.4	155	3.3	112.5	R284	R280-R284 VanDerWaalsContact O-CB 3.31Å; R280-R284 WeakPolarHBondContact O-CB 3.29Å; R280-R284 PolarHBondContact O-N 3.49Å
281	E	40.4	Very low	46.2	Very low	82 Å²	82	89.4 Å²	89.4	38%	0.383	44%	0.436	S	S	.	.	H	α-helix	trans	-85	-33.8	179.4	-68	167.6	157.3	0	0	111.3	S279 R284 T285	S279-E281 PolarHBondContact O-N 2.82Å; S279-E281 PolarHBondContact OG-N 3.43Å; S279-E281 VanDerWaalsContact OG-N 3.09Å; E281-R284 PolarHBondContact O-N 2.84Å; E281-T285 WeakPolarHBondContact O-CB 3.48Å; E281-T285 WeakPolarHBondContact O-CG2 3.32Å; E281-T285 PolarHBondContact O-N 3.2Å; E281-T285 PolarHBondContact O-OG1 3.2Å
282	D	46.8	Very low	46.2	Very low	69 Å²	69	92.2 Å²	92.2	37%	0.369	44%	0.438	S	S	.	.	H	α-helix	trans	-64.6	-45.6	168.5	-62.5	-30.7	0	0	0	110.7	F277 S279 R284 T285 A286	F277-D282 HydrophobicContact CB-CB 4.32Å; F277-D282 HydrophobicContact CD1-CB 3.88Å; F277-D282 HydrophobicContact CG-CB 4.48Å; S279-D282 VanDerWaalsContact CB-OD2 3.31Å; S279-D282 WeakPolarHBondContact CB-OD2 3.5Å; S279-D282 PolarHBondContact O-N 2.85Å; D282-R284 PolarHBondContact O-N 2.85Å; D282-T285 WeakPolarHBondContact CA-OG1 3.32Å; D282-T285 PolarHBondContact O-N 3.49Å; D282-T285 PolarHBondContact O-OG1 3.16Å; D282-A286 WeakPolarHBondContact O-CB 3.42Å; D282-A286 PolarHBondContact O-N 3.26Å
283	F	48.4	Very low	46.1	Very low	52 Å²	52	93.2 Å²	93.2	23%	0.228	44%	0.443	C	S	.	.	H	α-helix	trans	-57.5	-46.3	171.7	173.9	-98.1	0	0	0	112	P272 P274 F277 S279 T285 A286 W287	P272-F283 WeakPolarHBondContact O-CE2 3.37Å; P274-F283 HydrophobicContact CB-CD2 4.37Å; P274-F283 HydrophobicContact CB-CE2 4.24Å; P274-F283 HydrophobicContact CG-CD2 4.38Å; P274-F283 HydrophobicContact CG-CE2 3.76Å; P274-F283 HydrophobicContact CG-CZ 3.91Å; F277-F283 HydrophobicContact CB-CB 4.07Å; F277-F283 HydrophobicContact CD2-CB 4.26Å; F277-F283 HydrophobicContact CD2-CD2 4.11Å; F277-F283 HydrophobicContact CG-CB 4.22Å; S279-F283 PolarHBondContact O-N 3.12Å; S279-F283 VanDerWaalsContact O-N 3.13Å; F283-T285 PolarHBondContact O-N 2.98Å; F283-A286 PolarHBondContact O-N 3.23Å; F283-W287 WeakPolarHBondContact O-CB 3.2Å; F283-W287 PolarHBondContact O-N 3.34Å
284	R	46.2	Very low	45.9	Very low	105 Å²	105	94.2 Å²	94.2	40%	0.396	45%	0.451	S	S	.	.	H	α-helix	trans	-65.7	-39.2	-179.1	-171.2	-179.5	-174.6	-171	1.9	112.1	R280 E281 D282 L288 S757	R280-R284 VanDerWaalsContact O-CB 3.31Å; R280-R284 WeakPolarHBondContact O-CB 3.29Å; R280-R284 PolarHBondContact O-N 3.49Å; E281-R284 PolarHBondContact O-N 2.84Å; D282-R284 PolarHBondContact O-N 2.85Å; R284-L288 HydrophobicContact CG-CD1 4.12Å; R284-L288 VanDerWaalsContact O-CB 3.3Å; R284-L288 WeakPolarHBondContact O-CB 3.32Å; R284-L288 VanDerWaalsContact O-CG 3.24Å; R284-L288 WeakPolarHBondContact O-CG 3.46Å; R284-L288 PolarHBondContact O-N 3.48Å; R284-S757 PolarHBondContact NH2-OG 2.9Å
285	T	47.1	Very low	45.8	Very low	76 Å²	76	99.2 Å²	99.2	47%	0.466	46%	0.459	S	S	.	.	H	α-helix	trans	-72.4	-42.5	177	52.6	0	0	0	0	111.6	E281 D282 F283 W287 L288 N289	E281-T285 WeakPolarHBondContact O-CB 3.48Å; E281-T285 WeakPolarHBondContact O-CG2 3.32Å; E281-T285 PolarHBondContact O-N 3.2Å; E281-T285 PolarHBondContact O-OG1 3.2Å; D282-T285 WeakPolarHBondContact CA-OG1 3.32Å; D282-T285 PolarHBondContact O-N 3.49Å; D282-T285 PolarHBondContact O-OG1 3.16Å; F283-T285 PolarHBondContact O-N 2.98Å; T285-W287 PolarHBondContact O-N 3.05Å; T285-L288 PolarHBondContact O-N 2.87Å; T285-N289 VanDerWaalsContact O-CB 3.24Å; T285-N289 WeakPolarHBondContact O-CB 3.18Å; T285-N289 PolarHBondContact O-N 3.3Å; T285-N289 PolarHBondContact O-ND2 3.21Å
286	A	47.6	Very low	45.2	Very low	27 Å²	27	92.5 Å²	92.5	22%	0.223	43%	0.433	C	S	.	.	H	α-helix	trans	-57.8	-45.5	172	0	0	0	0	0	111.8	P272 F277 D282 F283 N289 H290	P272-A286 HydrophobicContact CB-CB 4.29Å; P272-A286 HydrophobicContact CG-CB 4.18Å; F277-A286 HydrophobicContact CE1-CB 3.98Å; F277-A286 HydrophobicContact CZ-CB 3.9Å; D282-A286 WeakPolarHBondContact O-CB 3.42Å; D282-A286 PolarHBondContact O-N 3.26Å; F283-A286 PolarHBondContact O-N 3.23Å; A286-N289 PolarHBondContact O-N 2.68Å; A286-H290 VanDerWaalsContact O-CB 3.32Å; A286-H290 WeakPolarHBondContact O-CB 3.34Å; A286-H290 PolarHBondContact O-N 2.94Å
287	W	50.6	Low	44.8	Very low	107 Å²	107	87.9 Å²	87.9	41%	0.405	42%	0.415	S	S	.	.	H	α-helix	trans	-68.8	-40.3	178.9	-172.1	93.2	0	0	0	113.2	P272 F283 T285 H290 R291	P272-W287 HydrophobicContact CG-CB 4.48Å; F283-W287 WeakPolarHBondContact O-CB 3.2Å; F283-W287 PolarHBondContact O-N 3.34Å; T285-W287 PolarHBondContact O-N 3.05Å; W287-H290 WeakPolarHBondContact O-CB 3.36Å; W287-H290 PolarHBondContact O-N 3.46Å; W287-R291 VanDerWaalsContact CZ3-CD 3.4Å; W287-R291 PolarHBondContact O-N 2.89Å
288	L	44.8	Very low	44.3	Very low	69 Å²	69	90.9 Å²	90.9	36%	0.361	43%	0.43	S	S	.	.	H	α-helix	trans	-68.5	-36.2	174.1	-75.6	173.1	0	0	0	112.2	R284 T285 R291 K292	R284-L288 HydrophobicContact CG-CD1 4.12Å; R284-L288 VanDerWaalsContact O-CB 3.3Å; R284-L288 WeakPolarHBondContact O-CB 3.32Å; R284-L288 VanDerWaalsContact O-CG 3.24Å; R284-L288 WeakPolarHBondContact O-CG 3.46Å; R284-L288 PolarHBondContact O-N 3.48Å; T285-L288 PolarHBondContact O-N 2.87Å; L288-R291 PolarHBondContact O-N 3.29Å; L288-K292 WeakPolarHBondContact O-CG 3.32Å; L288-K292 PolarHBondContact O-N 3.41Å
289	N	44.8	Very low	44.1	Very low	71 Å²	71	86.6 Å²	86.6	38%	0.38	41%	0.413	S	S	.	.	H	α-helix	trans	-67.1	-44.4	172.5	-72	-17.9	0	0	0	110.3	T285 A286 R291 K292 L293	T285-N289 VanDerWaalsContact O-CB 3.24Å; T285-N289 WeakPolarHBondContact O-CB 3.18Å; T285-N289 PolarHBondContact O-N 3.3Å; T285-N289 PolarHBondContact O-ND2 3.21Å; A286-N289 PolarHBondContact O-N 2.68Å; N289-R291 VanDerWaalsContact C-N 3.31Å; N289-R291 PolarHBondContact O-N 3.33Å; N289-K292 CarbonylContact O-C 3.6Å; N289-K292 WeakPolarHBondContact O-CA 3.48Å; N289-K292 PolarHBondContact O-N 3.13Å; N289-L293 WeakPolarHBondContact O-CB 3.4Å; N289-L293 WeakPolarHBondContact O-CG 3.24Å; N289-L293 PolarHBondContact O-N 2.89Å
290	H	46.3	Very low	44.4	Very low	43 Å²	43	86.3 Å²	86.3	20%	0.199	41%	0.408	C	S	.	.	H	α-helix	trans	-54.4	-43.2	172.8	-171.6	-78.6	0	0	0	112.2	A286 W287 L293 A294	A286-H290 VanDerWaalsContact O-CB 3.32Å; A286-H290 WeakPolarHBondContact O-CB 3.34Å; A286-H290 PolarHBondContact O-N 2.94Å; W287-H290 WeakPolarHBondContact O-CB 3.36Å; W287-H290 PolarHBondContact O-N 3.46Å; H290-L293 PolarHBondContact O-N 2.55Å; H290-A294 WeakPolarHBondContact O-CB 3.33Å; H290-A294 PolarHBondContact O-N 3.16Å
291	R	46.4	Very low	44.4	Very low	117 Å²	117	79.4 Å²	79.4	44%	0.442	39%	0.388	S	S	.	.	H	α-helix	trans	-68.9	-27.8	174.1	-81.6	178.6	66.9	114.2	-11.3	114.6	W287 L288 N289 R295	W287-R291 VanDerWaalsContact CZ3-CD 3.4Å; W287-R291 PolarHBondContact O-N 2.89Å; L288-R291 PolarHBondContact O-N 3.29Å; N289-R291 VanDerWaalsContact C-N 3.31Å; N289-R291 PolarHBondContact O-N 3.33Å; R291-R295 WeakPolarHBondContact O-CG 3.48Å
292	K	45	Very low	44.3	Very low	139 Å²	139	81.8 Å²	81.8	60%	0.604	40%	0.402	S	S	*	.	H	α-helix	trans	-76.6	-41.8	173	-72.3	169.3	-176.8	172.4	0	111.4	L288 N289 R295 S296	L288-K292 WeakPolarHBondContact O-CG 3.32Å; L288-K292 PolarHBondContact O-N 3.41Å; N289-K292 CarbonylContact O-C 3.6Å; N289-K292 WeakPolarHBondContact O-CA 3.48Å; N289-K292 PolarHBondContact O-N 3.13Å; K292-R295 PolarHBondContact O-N 3.46Å; K292-S296 PolarHBondContact O-N 3.28Å; K292-S296 VanDerWaalsContact O-N 3.12Å
293	L	42.9	Very low	43.9	Very low	40 Å²	40	80.4 Å²	80.4	21%	0.209	40%	0.395	C	S	.	.	H	α-helix	trans	-61.2	-49.8	176.4	-70.3	165.9	0	0	0	110.6	N289 H290 R295 S296 C297 P612	N289-L293 WeakPolarHBondContact O-CB 3.4Å; N289-L293 WeakPolarHBondContact O-CG 3.24Å; N289-L293 PolarHBondContact O-N 2.89Å; H290-L293 PolarHBondContact O-N 2.55Å; L293-R295 PolarHBondContact O-N 2.99Å; L293-R295 VanDerWaalsContact O-N 3.12Å; L293-S296 WeakPolarHBondContact O-CB 3.39Å; L293-S296 PolarHBondContact O-N 2.78Å; L293-C297 PolarHBondContact O-SG 2.99Å; L293-P612 HydrophobicContact CD2-CG 4.26Å
294	A	42.8	Very low	43.4	Very low	53 Å²	53	81 Å²	81	44%	0.438	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-23.6	175.2	0	0	0	0	0	114.4	H290	H290-A294 WeakPolarHBondContact O-CB 3.33Å; H290-A294 PolarHBondContact O-N 3.16Å
295	R	41.9	Very low	42.8	Very low	188 Å²	188	84.3 Å²	84.3	71%	0.709	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-20.1	173.5	-77	-179.2	173.3	-165.5	-2.9	113.9	R291 K292 L293 C297	R291-R295 WeakPolarHBondContact O-CG 3.48Å; K292-R295 PolarHBondContact O-N 3.46Å; L293-R295 PolarHBondContact O-N 2.99Å; L293-R295 VanDerWaalsContact O-N 3.12Å; R295-C297 PolarHBondContact O-N 2.86Å
296	S	37.4	Very low	41.8	Very low	46 Å²	46	84.5 Å²	84.5	32%	0.322	44%	0.44	S	S	.	.	S	Bend	trans	-77.4	-8.7	175.3	-171.5	0	0	0	0	112.9	K292 L293	K292-S296 PolarHBondContact O-N 3.28Å; K292-S296 VanDerWaalsContact O-N 3.12Å; L293-S296 WeakPolarHBondContact O-CB 3.39Å; L293-S296 PolarHBondContact O-N 2.78Å
297	C	41.5	Very low	41	Very low	36 Å²	36	90.5 Å²	90.5	24%	0.243	48%	0.477	C	S	.	.			trans	-136.1	44.4	-159.3	-54	0	0	0	0	110.4	L293 R295 H485 S487	L293-C297 PolarHBondContact O-SG 2.99Å; R295-C297 PolarHBondContact O-N 2.86Å; C297-H485 VanDerWaalsContact SG-CD2 3.54Å; C297-H485 PolarHBondContact SG-CE1 2.92Å; C297-H485 PolarHBondContact SG-ND1 2.79Å; C297-S487 PolarHBondContact SG-O 3.08Å
298	H	43.3	Very low	40.1	Very low	123 Å²	123	87 Å²	87	57%	0.569	47%	0.474	S	S	*	.			trans	-66.7	156.5	171.3	-112.1	34.6	0	0	0	111.6	L300	H298-L300 VanDerWaalsContact C-N 3.34Å; H298-L300 PolarHBondContact O-N 2.93Å
299	D	38.9	Very low	39.3	Very low	118 Å²	118	91.2 Å²	91.2	63%	0.631	49%	0.486	S	S	*	.			trans	-77.2	83.4	-175.3	-168.2	-5.5	0	0	0	111.6	D301	D299-D301 PolarHBondContact O-N 3.39Å; D299-D301 WeakPolarHBondContact OD1-CB 3.47Å; D299-D301 PolarHBondContact OD1-N 3.4Å
300	L	48.8	Very low	38.5	Very low	33 Å²	33	89.4 Å²	89.4	17%	0.173	48%	0.484	C	S	.	.	G	3₁₀ helix	trans	-79.1	17.5	178.1	-64.8	165.2	0	0	0	112.5	H298 L302 L303 K489	H298-L300 VanDerWaalsContact C-N 3.34Å; H298-L300 PolarHBondContact O-N 2.93Å; L300-L302 VanDerWaalsContact C-N 3.33Å; L300-L303 HydrophobicContact CB-CD1 4.3Å; L300-L303 HydrophobicContact CD2-CD1 3.66Å; L300-L303 PolarHBondContact O-N 2.91Å; L300-K489 HydrophobicContact CB-CD 3.77Å; L300-K489 HydrophobicContact CD1-CB 4.2Å; L300-K489 HydrophobicContact CD1-CD 4.04Å; L300-K489 HydrophobicContact CD1-CG 4.08Å; L300-K489 PolarHBondContact O-NZ 3.45Å
301	D	40.9	Very low	38	Very low	74 Å²	74	91.5 Å²	91.5	40%	0.396	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-76.7	-19.1	179.8	-76.9	12	0	0	0	112.5	D299 L303 G304 K489 K551	D299-D301 PolarHBondContact O-N 3.39Å; D299-D301 WeakPolarHBondContact OD1-CB 3.47Å; D299-D301 PolarHBondContact OD1-N 3.4Å; D301-L303 PolarHBondContact O-N 2.86Å; D301-G304 PolarHBondContact O-N 2.91Å; D301-K489 WeakPolarHBondContact OD1-CE 3.36Å; D301-K489 IonicContact OD1-NZ 2.8Å; D301-K489 PolarHBondContact OD1-NZ 3.11Å; D301-K551 IonicContact OD2-NZ 2.66Å
302	L	38.1	Very low	37.4	Very low	131 Å²	131	86.9 Å²	86.9	69%	0.686	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-64.7	-22.4	170.3	-68.1	176.6	0	0	0	113.8	L300 G304	L300-L302 VanDerWaalsContact C-N 3.33Å; L302-G304 PolarHBondContact O-N 2.94Å
303	L	39.1	Very low	37.1	Very low	40 Å²	40	85.5 Å²	85.5	21%	0.209	47%	0.474	C	S	.	.	G	3₁₀ helix	trans	-74.7	-8.4	172.4	-73	164.8	0	0	0	113.3	L300 D301 I573	L300-L303 HydrophobicContact CB-CD1 4.3Å; L300-L303 HydrophobicContact CD2-CD1 3.66Å; L300-L303 PolarHBondContact O-N 2.91Å; D301-L303 PolarHBondContact O-N 2.86Å; L303-I573 HydrophobicContact CD1-CD1 4.43Å
304	G	36.2	Very low	37.1	Very low	66 Å²	66	84.1 Å²	84.1	68%	0.68	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-88.6	-13	-175.1	0	0	0	0	0	115.7	D301 L302	D301-G304 PolarHBondContact O-N 2.91Å; L302-G304 PolarHBondContact O-N 2.94Å
305	Q	34.6	Very low	37.3	Very low	173 Å²	173	84.5 Å²	84.5	81%	0.808	47%	0.465	S	S	*	.	S	Bend	trans	-110.4	16.2	-163.6	-62.4	-164.2	0.8	0	0	116
306	S	26.4	Very low	38.1	Very low	80 Å²	80	79.3 Å²	79.3	56%	0.559	45%	0.449	S	S	*	.	S	Bend	trans	-147.4	148.7	166.2	71.5	0	0	0	0	113.1	G308	S306-G308 PolarHBondContact O-N 2.8Å; S306-G308 PolarHBondContact OG-O 2.86Å
307	P	30.6	Very low	39.2	Very low	153 Å²	153	78.3 Å²	78.3	99%	0.994	44%	0.441	S	S	*	.	S	Bend	trans	-72	7.5	-174.5	-20.1	34.3	0	0	0	116.2
308	G	31.9	Very low	41	Very low	34 Å²	34	81.5 Å²	81.5	35%	0.351	46%	0.456	S	S	.	.	S	Bend	trans	-150.4	150.7	-178.9	0	0	0	0	0	112.7	S306	S306-G308 PolarHBondContact O-N 2.8Å; S306-G308 PolarHBondContact OG-O 2.86Å
309	W	26.5	Very low	43	Very low	157 Å²	157	77.8 Å²	77.8	60%	0.595	44%	0.44	S	S	*	.			trans	75.9	84.3	175.4	-57.4	90	0	0	0	117.4	V509	W309-V509 HydrophobicContact CE3-CG1 4.27Å
310	G	29.2	Very low	45.4	Very low	33 Å²	33	76.1 Å²	76.1	34%	0.34	43%	0.434	S	S	.	.			trans	-128.9	92.9	146.5	0	0	0	0	0	108.8	T312	G310-T312 VanDerWaalsContact C-N 3.28Å; G310-T312 PolarHBondContact O-N 2.82Å; G310-T312 PolarHBondContact O-OG1 2.77Å; G310-T312 VanDerWaalsContact O-OG1 3.11Å
311	Q	34.9	Very low	47.3	Very low	88 Å²	88	76.4 Å²	76.4	41%	0.411	44%	0.438	S	S	.	.			trans	-78.9	79.1	-166.5	-159.4	176.7	21.5	0	0	112.1	Q313 S507 V509	Q311-Q313 VanDerWaalsContact C-N 3.3Å; Q311-Q313 HydrophobicContact CG-CG 4.27Å; Q311-Q313 PolarHBondContact O-N 2.9Å; Q311-S507 PolarHBondContact O-N 3.16Å; Q311-S507 PolarHBondContact O-OG 3.37Å; Q311-V509 HydrophobicContact CB-CG2 3.53Å
312	T	35.3	Very low	49.6	Very low	20 Å²	20	79.4 Å²	79.4	12%	0.123	45%	0.447	C	S	.	.			trans	-79.5	71.6	178.7	33.2	0	0	0	0	110.7	G310 A314 L504 L505 V506 R571	G310-T312 VanDerWaalsContact C-N 3.28Å; G310-T312 PolarHBondContact O-N 2.82Å; G310-T312 PolarHBondContact O-OG1 2.77Å; G310-T312 VanDerWaalsContact O-OG1 3.11Å; T312-A314 PolarHBondContact O-N 2.79Å; T312-L504 HydrophobicContact CG2-CD2 4.15Å; T312-L505 CarbonylContact C-O 3.6Å; T312-L505 WeakPolarHBondContact CA-O 3.47Å; T312-V506 HydrophobicContact CG2-CB 4.22Å; T312-V506 HydrophobicContact CG2-CG1 3.94Å; T312-V506 HydrophobicContact CG2-CG2 4.07Å; T312-R571 PolarHBondContact O-NE 2.98Å; T312-R571 WeakPolarHBondContact OG1-CD 3.39Å
313	Q	38.3	Very low	52.1	Low	109 Å²	109	74.4 Å²	74.4	51%	0.509	42%	0.421	S	S	.	.			trans	-61.6	118.4	173.4	-68	-172.6	-6.5	0	0	109.5	Q311 L505	Q311-Q313 VanDerWaalsContact C-N 3.3Å; Q311-Q313 HydrophobicContact CG-CG 4.27Å; Q311-Q313 PolarHBondContact O-N 2.9Å; Q313-L505 PolarHBondContact N-O 3.12Å; Q313-L505 VanDerWaalsContact N-O 3.12Å; Q313-L505 CarbonylContact O-C 3.45Å; Q313-L505 WeakPolarHBondContact O-CA 3.43Å; Q313-L505 VanDerWaalsContact O-CB 3.3Å; Q313-L505 WeakPolarHBondContact O-CB 3.28Å; Q313-L505 PolarHBondContact O-N 2.95Å
314	A	42.1	Very low	54.5	Low	11 Å²	11	76.2 Å²	76.2	9%	0.091	43%	0.431	C	S	.	.	B	Isolated β-bridge	trans	-59.3	150.3	164.4	0	0	0	0	0	109.5	T312 E316 L360 P501	T312-A314 PolarHBondContact O-N 2.79Å; A314-E316 VanDerWaalsContact C-N 3.27Å; A314-E316 PolarHBondContact O-N 2.89Å; A314-L360 HydrophobicContact CB-CD1 3.41Å; A314-L360 VanDerWaalsContact CB-CD1 3.41Å; A314-P501 HydrophobicContact CB-CG 3.98Å
315	V	47.3	Very low	57	Low	61 Å²	61	74.7 Å²	74.7	37%	0.37	41%	0.41	S	S	.	.			trans	-70.1	98.2	159.9	-175.6	0	0	0	0	105.9	T317 T503 L505	V315-T317 PolarHBondContact O-N 2.82Å; V315-T317 VanDerWaalsContact O-N 3.09Å; V315-T503 HydrophobicContact CG2-CG2 3.82Å; V315-T503 PolarHBondContact N-O 2.66Å; V315-T503 VanDerWaalsContact N-O 3.16Å; V315-L505 HydrophobicContact CG2-CD1 3.92Å; V315-L505 HydrophobicContact CG2-CD2 4.44Å; V315-L505 HydrophobicContact CG2-CG 3.72Å
316	E	58.1	Low	59.5	Low	80 Å²	80	70.1 Å²	70.1	37%	0.374	40%	0.397	S	S	.	.			trans	-55.9	114.5	176.4	-61.1	172.9	105.1	0	0	107.8	A314 N318 K357 L359	A314-E316 VanDerWaalsContact C-N 3.27Å; A314-E316 PolarHBondContact O-N 2.89Å; E316-N318 PolarHBondContact O-N 2.8Å; E316-K357 HydrophobicContact CB-CG 4.27Å; E316-K357 WeakPolarHBondContact OE1-CE 3.1Å; E316-K357 IonicContact OE1-NZ 3.35Å; E316-K357 PolarHBondContact OE1-NZ 2.85Å; E316-K357 WeakPolarHBondContact OE2-CE 3.44Å; E316-K357 IonicContact OE2-NZ 3.76Å; E316-K357 PolarHBondContact OE2-NZ 3.41Å; E316-L359 VanDerWaalsContact OE1-CD2 3.26Å; E316-L359 WeakPolarHBondContact OE1-CD2 3.42Å
317	T	62	Low	62.4	Low	25 Å²	25	66.5 Å²	66.5	15%	0.153	37%	0.373	C	S	.	.			trans	-63.7	125.1	-177.8	41.8	0	0	0	0	108.3	V315 K357 A358 P501	V315-T317 PolarHBondContact O-N 2.82Å; V315-T317 VanDerWaalsContact O-N 3.09Å; T317-K357 WeakPolarHBondContact O-CA 3.47Å; T317-A358 PolarHBondContact O-N 3.16Å; T317-P501 HydrophobicContact CG2-CB 4.4Å
318	N	79.2	Confident	65.3	Low	103 Å²	103	61 Å²	61	55%	0.551	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	154.4	178.5	70.4	-20.8	0	0	0	111.9	E316 M356 K357	E316-N318 PolarHBondContact O-N 2.8Å; N318-M356 CarbonylContact C-O 3.54Å; N318-M356 VanDerWaalsContact CA-O 3.22Å; N318-M356 WeakPolarHBondContact CA-O 3.36Å; N318-K357 HydrophobicContact CB-CB 4.22Å; N318-K357 HydrophobicContact CB-CG 4.29Å
319	I	85.5	Confident	68.1	Low	45 Å²	45	62.4 Å²	62.4	23%	0.231	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	143.1	169.6	-172.7	168.5	0	0	0	109.1	V330 Q331 L332 P333 S355 M356	I319-V330 HydrophobicContact CD1-CG1 4.06Å; I319-V330 HydrophobicContact CG1-CG1 4.4Å; I319-V330 HydrophobicContact CG2-CG1 4.05Å; I319-Q331 WeakPolarHBondContact CD1-O 3.36Å; I319-L332 HydrophobicContact CB-CD1 4.48Å; I319-L332 HydrophobicContact CG2-CD1 3.87Å; I319-P333 HydrophobicContact CB-CG 4.43Å; I319-P333 HydrophobicContact CD1-CG 4.36Å; I319-S355 CarbonylContact O-C 3.54Å; I319-S355 WeakPolarHBondContact O-CA 3.35Å; I319-M356 HydrophobicContact CG2-CB 4Å; I319-M356 HydrophobicContact CG2-CE 3.61Å; I319-M356 PolarHBondContact N-O 2.87Å; I319-M356 PolarHBondContact O-N 3.08Å
320	V	88.4	Confident	71.3	Confident	83 Å²	83	55.1 Å²	55.1	50%	0.503	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123	170.4	-173.6	0	0	0	0	107.2	Q353 I354	V320-Q353 HydrophobicContact CG1-CG 3.86Å; V320-Q353 VanDerWaalsContact CG1-NE2 3.34Å; V320-I354 WeakPolarHBondContact CA-O 3.47Å
321	C	87.8	Confident	74.2	Confident	38 Å²	38	59.1 Å²	59.1	26%	0.257	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	157	178.7	-167	0	0	0	0	109.7	V330 Q353 I354	C321-V330 HydrophobicContact CB-CB 4.37Å; C321-V330 HydrophobicContact CB-CG1 3.58Å; C321-V330 HydrophobicContact CB-CG2 3.79Å; C321-Q353 CarbonylContact O-C 3.58Å; C321-Q353 WeakPolarHBondContact O-CA 3.48Å; C321-Q353 WeakPolarHBondContact O-CG 3.46Å; C321-I354 PolarHBondContact N-O 2.76Å; C321-I354 PolarHBondContact O-N 2.85Å
322	K	90.8	Very high	76.7	Confident	137 Å²	137	55 Å²	55	60%	0.596	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.5	118.7	176	-171.2	178.5	-179	-175.2	0	108.2	T351 Q352	K322-T351 WeakPolarHBondContact CE-OG1 3.08Å; K322-T351 PolarHBondContact NZ-OG1 2.86Å; K322-Q352 WeakPolarHBondContact CA-O 3.2Å
323	L	89.9	Confident	78.9	Confident	26 Å²	26	56.7 Å²	56.7	14%	0.136	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	156.4	-179	-57.2	175.4	0	0	0	109.3	V330 V341 T351 Q352	L323-V330 HydrophobicContact CD1-CG2 3.99Å; L323-V341 HydrophobicContact CD1-CB 3.95Å; L323-V341 HydrophobicContact CD1-CG1 4.49Å; L323-V341 HydrophobicContact CD1-CG2 3.68Å; L323-T351 CarbonylContact O-C 3.6Å; L323-T351 WeakPolarHBondContact O-CA 3.42Å; L323-T351 VanDerWaalsContact O-CB 3.24Å; L323-T351 WeakPolarHBondContact O-CB 3.37Å; L323-Q352 PolarHBondContact N-O 3.06Å; L323-Q352 PolarHBondContact O-N 3.32Å
324	D	88.5	Confident	80.6	Confident	79 Å²	79	56.3 Å²	56.3	42%	0.422	33%	0.328	S	S	.	.			trans	-106.9	-165.7	172.6	61	43	0	0	0	110.8	S326 G327 T351	D324-S326 PolarHBondContact O-N 3.42Å; D324-S326 VanDerWaalsContact O-N 3.13Å; D324-S326 VanDerWaalsContact OD1-CB 3.27Å; D324-S326 WeakPolarHBondContact OD1-CB 3.35Å; D324-S326 PolarHBondContact OD1-N 3.42Å; D324-S326 PolarHBondContact OD1-OG 2.81Å; D324-G327 PolarHBondContact O-N 2.9Å; D324-G327 VanDerWaalsContact O-N 3.11Å; D324-T351 HydrophobicContact CB-CG2 4.27Å
325	S	89.2	Confident	82.6	Confident	34 Å²	34	56.6 Å²	56.6	24%	0.238	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-11.9	180	55.4	0	0	0	0	114.9	G327 G344	S325-G327 PolarHBondContact O-N 3.09Å; S325-G344 PolarHBondContact O-N 2.9Å
326	S	87.9	Confident	84.4	Confident	76 Å²	76	55.8 Å²	55.8	53%	0.531	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-11.5	171.9	66	0	0	0	0	113.8	D324	D324-S326 PolarHBondContact O-N 3.42Å; D324-S326 VanDerWaalsContact O-N 3.13Å; D324-S326 VanDerWaalsContact OD1-CB 3.27Å; D324-S326 WeakPolarHBondContact OD1-CB 3.35Å; D324-S326 PolarHBondContact OD1-N 3.42Å; D324-S326 PolarHBondContact OD1-OG 2.81Å
327	G	87.3	Confident	86	Confident	5 Å²	5	52.1 Å²	52.1	5%	0.052	31%	0.309	C	S	.	.			trans	75.7	-143.1	-179.9	0	0	0	0	0	112.6	D324 S325 V341	D324-G327 PolarHBondContact O-N 2.9Å; D324-G327 VanDerWaalsContact O-N 3.11Å; S325-G327 PolarHBondContact O-N 3.09Å; G327-V341 WeakPolarHBondContact CA-O 3.41Å
328	G	91.4	Very high	87.4	Confident	36 Å²	36	51.5 Å²	51.5	37%	0.371	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	128.8	-173.2	175.5	0	0	0	0	0	114.3	V341	G328-V341 PolarHBondContact N-O 2.78Å; G328-V341 WeakPolarHBondContact O-CB 3.2Å; G328-V341 PolarHBondContact O-N 2.7Å
329	A	91.4	Very high	88.1	Confident	65 Å²	65	46.6 Å²	46.6	54%	0.537	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	135.7	-177.3	0	0	0	0	0	111.9	I339 H340	A329-I339 WeakPolarHBondContact CA-O 3.43Å; A329-H340 WeakPolarHBondContact CB-ND1 3.47Å
330	V	91.9	Very high	88.5	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.018	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	117.4	173.6	-163.3	0	0	0	0	108.5	I319 C321 L323 S338 I339 M356	I319-V330 HydrophobicContact CD1-CG1 4.06Å; I319-V330 HydrophobicContact CG1-CG1 4.4Å; I319-V330 HydrophobicContact CG2-CG1 4.05Å; C321-V330 HydrophobicContact CB-CB 4.37Å; C321-V330 HydrophobicContact CB-CG1 3.58Å; C321-V330 HydrophobicContact CB-CG2 3.79Å; L323-V330 HydrophobicContact CD1-CG2 3.99Å; V330-S338 CarbonylContact O-C 3.57Å; V330-S338 VanDerWaalsContact O-CA 3.25Å; V330-S338 WeakPolarHBondContact O-CA 3.44Å; V330-I339 PolarHBondContact N-O 2.96Å; V330-I339 PolarHBondContact O-N 2.78Å; V330-M356 HydrophobicContact CB-CE 4.08Å; V330-M356 HydrophobicContact CG1-CE 3.85Å; V330-M356 WeakPolarHBondContact O-CE 3.34Å
331	Q	91.1	Very high	88.7	Confident	118 Å²	118	43.9 Å²	43.9	55%	0.551	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	137	176	-170.9	-179.1	-1.8	0	0	110.8	I319 T335 I337	I319-Q331 WeakPolarHBondContact CD1-O 3.36Å; Q331-T335 PolarHBondContact NE2-O 2.89Å; Q331-I337 WeakPolarHBondContact CG-O 3.3Å
332	L	86.8	Confident	88.9	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-77	121.8	175.5	-175.4	70.7	0	0	0	109.8	I319 D334 T335 I337 M356 A358 L378	I319-L332 HydrophobicContact CB-CD1 4.48Å; I319-L332 HydrophobicContact CG2-CD1 3.87Å; L332-D334 PolarHBondContact O-N 2.84Å; L332-T335 WeakPolarHBondContact CB-OG1 3.43Å; L332-T335 HydrophobicContact CD2-CG2 4.27Å; L332-T335 PolarHBondContact O-N 2.8Å; L332-T335 PolarHBondContact O-OG1 2.87Å; L332-I337 HydrophobicContact CB-CB 4.28Å; L332-I337 HydrophobicContact CD2-CD1 4.43Å; L332-I337 PolarHBondContact N-O 2.85Å; L332-M356 HydrophobicContact CB-CE 3.93Å; L332-M356 HydrophobicContact CD1-CB 4.26Å; L332-A358 HydrophobicContact CD2-CB 3.65Å; L332-L378 HydrophobicContact CD2-CD1 4.19Å
333	P	81.4	Confident	88.9	Confident	57 Å²	57	45.2 Å²	45.2	37%	0.37	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	137.8	-170.9	-29.7	35.8	0	0	0	114.1	I319 T335	I319-P333 HydrophobicContact CB-CG 4.43Å; I319-P333 HydrophobicContact CD1-CG 4.36Å; P333-T335 PolarHBondContact O-N 3.47Å
334	D	74.9	Confident	88.8	Confident	100 Å²	100	45.5 Å²	45.5	54%	0.535	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	19.3	178.6	-56.4	-49.4	0	0	0	115.2	L332 K502	L332-D334 PolarHBondContact O-N 2.84Å; D334-K502 VanDerWaalsContact OD1-CE 3.31Å; D334-K502 WeakPolarHBondContact OD1-CE 3.34Å; D334-K502 IonicContact OD1-NZ 2.77Å; D334-K502 PolarHBondContact OD1-NZ 3.21Å; D334-K502 WeakPolarHBondContact OD2-CD 3.5Å; D334-K502 WeakPolarHBondContact OD2-CE 3.36Å; D334-K502 IonicContact OD2-NZ 3.67Å; D334-K502 PolarHBondContact OD2-NZ 3.2Å
335	T	84.1	Confident	88.8	Confident	17 Å²	17	41.8 Å²	41.8	10%	0.104	26%	0.259	C	S	.	.	S	Bend	trans	-131.4	163.4	174.1	73.3	0	0	0	0	111.6	Q331 L332 P333 I337 C499	Q331-T335 PolarHBondContact NE2-O 2.89Å; L332-T335 WeakPolarHBondContact CB-OG1 3.43Å; L332-T335 HydrophobicContact CD2-CG2 4.27Å; L332-T335 PolarHBondContact O-N 2.8Å; L332-T335 PolarHBondContact O-OG1 2.87Å; P333-T335 PolarHBondContact O-N 3.47Å; T335-I337 VanDerWaalsContact C-N 3.26Å; T335-I337 PolarHBondContact O-N 2.62Å; T335-I337 PolarHBondContact OG1-N 2.7Å; T335-C499 HydrophobicContact CG2-CB 4.3Å
336	S	85.1	Confident	88.9	Confident	44 Å²	44	40.3 Å²	40.3	31%	0.308	25%	0.248	S	C	.	.	S	Bend	trans	-91.6	37.9	171.4	46.4	0	0	0	0	112.1	M395 K396	S336-M395 WeakPolarHBondContact O-CA 3.4Å; S336-K396 PolarHBondContact O-N 3.44Å; S336-K396 WeakPolarHBondContact OG-CB 3.47Å
337	I	91.1	Very high	88.9	Confident	3 Å²	3	37.9 Å²	37.9	2%	0.015	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	125.8	177.5	-56.8	178.7	0	0	0	109	Q331 L332 T335 P376 L378 L393 E394 M395	Q331-I337 WeakPolarHBondContact CG-O 3.3Å; L332-I337 HydrophobicContact CB-CB 4.28Å; L332-I337 HydrophobicContact CD2-CD1 4.43Å; L332-I337 PolarHBondContact N-O 2.85Å; T335-I337 VanDerWaalsContact C-N 3.26Å; T335-I337 PolarHBondContact O-N 2.62Å; T335-I337 PolarHBondContact OG1-N 2.7Å; I337-P376 HydrophobicContact CD1-CG 3.62Å; I337-L378 HydrophobicContact CG2-CD1 4.18Å; I337-L378 HydrophobicContact CG2-CD2 3.87Å; I337-L393 HydrophobicContact CG2-CD1 4.1Å; I337-E394 WeakPolarHBondContact CA-O 3.2Å; I337-M395 HydrophobicContact CG1-CB 4.01Å
338	S	92.6	Very high	88.8	Confident	13 Å²	13	43.2 Å²	43.2	9%	0.091	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	144.2	178.3	34.2	0	0	0	0	112.5	V330 E394	V330-S338 CarbonylContact O-C 3.57Å; V330-S338 VanDerWaalsContact O-CA 3.25Å; V330-S338 WeakPolarHBondContact O-CA 3.44Å; S338-E394 PolarHBondContact N-O 3.17Å; S338-E394 PolarHBondContact O-N 3.03Å
339	I	93.9	Very high	88.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	124.9	168.3	-71.6	179.1	0	0	0	108.3	A329 V330 V341 I354 M356 L378 V380 I391 I392 L393	A329-I339 WeakPolarHBondContact CA-O 3.43Å; V330-I339 PolarHBondContact N-O 2.96Å; V330-I339 PolarHBondContact O-N 2.78Å; I339-V341 HydrophobicContact CG2-CG2 4.23Å; I339-I354 HydrophobicContact CG2-CD1 4.35Å; I339-M356 HydrophobicContact CB-SD 3.94Å; I339-M356 HydrophobicContact CD1-CG 3.91Å; I339-M356 HydrophobicContact CD1-SD 3.51Å; I339-M356 VanDerWaalsContact CD1-SD 3.51Å; I339-M356 HydrophobicContact CG1-SD 3.54Å; I339-M356 VanDerWaalsContact CG1-SD 3.54Å; I339-L378 HydrophobicContact CD1-CD2 4.45Å; I339-V380 HydrophobicContact CD1-CB 4.42Å; I339-V380 HydrophobicContact CD1-CG1 3.68Å; I339-V380 HydrophobicContact CD1-CG2 3.78Å; I339-I391 HydrophobicContact CD1-CD1 4.39Å; I339-I391 HydrophobicContact CG2-CB 4.03Å; I339-I391 HydrophobicContact CG2-CD1 3.94Å; I339-I391 HydrophobicContact CG2-CG1 4.24Å; I339-I392 CarbonylContact C-O 3.58Å; I339-I392 WeakPolarHBondContact CA-O 3.31Å; I339-L393 HydrophobicContact CD1-CD1 4.35Å; I339-L393 HydrophobicContact CG1-CB 4.49Å; I339-L393 HydrophobicContact CG1-CD1 3.68Å
340	H	92.5	Very high	88.2	Confident	61 Å²	61	45.9 Å²	45.9	28%	0.282	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	131.9	173.1	-54.6	-77.8	0	0	0	109.7	A329 I392 E394	A329-H340 WeakPolarHBondContact CB-ND1 3.47Å; H340-I392 HydrophobicContact CB-CB 4.37Å; H340-I392 PolarHBondContact N-O 3.02Å; H340-I392 PolarHBondContact O-N 3.14Å; H340-E394 IonicContact CD2-OE2 2.76Å; H340-E394 IonicContact CE1-OE2 2.75Å; H340-E394 IonicContact NE2-OE2 3.99Å; H340-E394 PolarHBondContact NE2-OE2 2.84Å
341	V	93.2	Very high	88.1	Confident	9 Å²	9	48.1 Å²	48.1	6%	0.055	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.8	-177.9	-175.4	0	0	0	0	108.2	L323 G327 G328 I339 H345 I354 I391	L323-V341 HydrophobicContact CD1-CB 3.95Å; L323-V341 HydrophobicContact CD1-CG1 4.49Å; L323-V341 HydrophobicContact CD1-CG2 3.68Å; G327-V341 WeakPolarHBondContact CA-O 3.41Å; G328-V341 PolarHBondContact N-O 2.78Å; G328-V341 WeakPolarHBondContact O-CB 3.2Å; G328-V341 PolarHBondContact O-N 2.7Å; I339-V341 HydrophobicContact CG2-CG2 4.23Å; V341-H345 HydrophobicContact CG1-CB 3.61Å; V341-H345 VanDerWaalsContact CG1-CD2 3.43Å; V341-H345 WeakPolarHBondContact CG1-CD2 3.32Å; V341-I354 HydrophobicContact CG2-CD1 3.43Å; V341-I354 VanDerWaalsContact CG2-CD1 3.43Å; V341-I391 HydrophobicContact CG1-CG2 4.45Å; V341-I391 HydrophobicContact CG2-CG2 4.12Å
342	P	91.6	Very high	88.1	Confident	42 Å²	42	42.5 Å²	42.5	27%	0.273	27%	0.267	S	S	.	.			trans	-61.7	152.8	178.8	-24	34.6	0	0	0	113	H345 T389 S390	P342-H345 VanDerWaalsContact O-CB 3.26Å; P342-H345 WeakPolarHBondContact O-CB 3.49Å; P342-H345 PolarHBondContact O-N 3.15Å; P342-T389 HydrophobicContact CB-CG2 4.37Å; P342-S390 WeakPolarHBondContact CD-O 3.35Å; P342-S390 WeakPolarHBondContact CG-O 3.39Å
343	E	91.4	Very high	88.3	Confident	161 Å²	161	46.9 Å²	46.9	75%	0.752	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	142.6	163.8	-175.3	172.1	-166.9	0	0	110	H345	E343-H345 VanDerWaalsContact C-N 3.29Å; E343-H345 PolarHBondContact O-N 3.23Å
344	G	86.9	Confident	88.8	Confident	33 Å²	33	44.1 Å²	44.1	34%	0.34	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	10	-177.2	0	0	0	0	0	115.7	S325 V346	S325-G344 PolarHBondContact O-N 2.9Å; G344-V346 VanDerWaalsContact C-N 3.34Å; G344-V346 PolarHBondContact O-N 2.78Å
345	H	89.2	Confident	89.7	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	25%	0.253	C	S	.	.	S	Bend	trans	-57	-42.4	177.3	-179.3	70.3	0	0	0	113.3	V341 P342 E343 V387 K388 T389 I391	V341-H345 HydrophobicContact CG1-CB 3.61Å; V341-H345 VanDerWaalsContact CG1-CD2 3.43Å; V341-H345 WeakPolarHBondContact CG1-CD2 3.32Å; P342-H345 VanDerWaalsContact O-CB 3.26Å; P342-H345 WeakPolarHBondContact O-CB 3.49Å; P342-H345 PolarHBondContact O-N 3.15Å; E343-H345 VanDerWaalsContact C-N 3.29Å; E343-H345 PolarHBondContact O-N 3.23Å; H345-V387 CarbonylContact O-C 3.58Å; H345-V387 VanDerWaalsContact O-CA 3.27Å; H345-V387 WeakPolarHBondContact O-CA 3.44Å; H345-K388 PolarHBondContact O-N 3.38Å; H345-T389 WeakPolarHBondContact CA-OG1 3.48Å; H345-T389 WeakPolarHBondContact CB-OG1 3.44Å; H345-T389 PolarHBondContact CE1-O 2.9Å; H345-T389 PolarHBondContact ND1-O 3.22Å; H345-T389 PolarHBondContact ND1-OG1 3.4Å; H345-I391 VanDerWaalsContact CE1-CG2 3.49Å; H345-I391 WeakPolarHBondContact CE1-CG2 3.46Å
346	V	90.9	Very high	90	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.018	25%	0.248	C	C	.	.	S	Bend	trans	-114	163.7	172.8	-67.1	0	0	0	0	110.9	G344 E350 Q352 V387	G344-V346 VanDerWaalsContact C-N 3.34Å; G344-V346 PolarHBondContact O-N 2.78Å; V346-E350 HydrophobicContact CB-CB 4.19Å; V346-E350 HydrophobicContact CG2-CB 4.47Å; V346-Q352 HydrophobicContact CG1-CB 4.01Å; V346-V387 HydrophobicContact CG1-CG1 4.12Å
347	A	87.8	Confident	90.3	Very high	24 Å²	24	39.8 Å²	39.8	20%	0.198	24%	0.242	C	C	.	.			trans	-68.2	153.1	178.6	0	0	0	0	0	112.6	G349 E350	A347-G349 PolarHBondContact O-N 2.8Å; A347-E350 HydrophobicContact CB-CB 4.49Å; A347-E350 HydrophobicContact CB-CG 4.14Å; A347-E350 WeakPolarHBondContact O-CB 3.31Å; A347-E350 PolarHBondContact O-N 3.28Å
348	P	85.8	Confident	90.1	Very high	117 Å²	117	39.6 Å²	39.6	76%	0.76	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	124	174.8	-24.9	35.3	0	0	0	112.1
349	G	83.2	Confident	89.9	Confident	82 Å²	82	39.5 Å²	39.5	85%	0.845	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	93.2	-13	-174.1	0	0	0	0	0	114.6	A347	A347-G349 PolarHBondContact O-N 2.8Å
350	E	87.5	Confident	89.3	Confident	75 Å²	75	40 Å²	40	35%	0.35	24%	0.242	S	C	.	.			trans	-89.5	170.2	167.7	-65.6	180	-172.4	0	0	111.8	V346 A347 N384	V346-E350 HydrophobicContact CB-CB 4.19Å; V346-E350 HydrophobicContact CG2-CB 4.47Å; A347-E350 HydrophobicContact CB-CB 4.49Å; A347-E350 HydrophobicContact CB-CG 4.14Å; A347-E350 WeakPolarHBondContact O-CB 3.31Å; A347-E350 PolarHBondContact O-N 3.28Å; E350-N384 PolarHBondContact OE2-ND2 3.21Å
351	T	89.6	Confident	88.7	Confident	50 Å²	50	39.6 Å²	39.6	31%	0.307	24%	0.242	S	C	.	.			trans	-148	132.2	-174.2	56.4	0	0	0	0	112.4	K322 L323 D324	K322-T351 WeakPolarHBondContact CE-OG1 3.08Å; K322-T351 PolarHBondContact NZ-OG1 2.86Å; L323-T351 CarbonylContact O-C 3.6Å; L323-T351 WeakPolarHBondContact O-CA 3.42Å; L323-T351 VanDerWaalsContact O-CB 3.24Å; L323-T351 WeakPolarHBondContact O-CB 3.37Å; D324-T351 HydrophobicContact CB-CG2 4.27Å
352	Q	89.9	Confident	88.3	Confident	1 Å²	1	40 Å²	40	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	117	172.4	-164.2	66.6	8.2	0	0	110.2	K322 L323 V346 I354 N384	K322-Q352 WeakPolarHBondContact CA-O 3.2Å; L323-Q352 PolarHBondContact N-O 3.06Å; L323-Q352 PolarHBondContact O-N 3.32Å; V346-Q352 HydrophobicContact CG1-CB 4.01Å; Q352-I354 HydrophobicContact CG-CD1 4.08Å; Q352-I354 HydrophobicContact CG-CG1 3.73Å; Q352-N384 PolarHBondContact NE2-O 2.85Å; Q352-N384 PolarHBondContact OE1-O 2.97Å
353	Q	92.3	Very high	87.9	Confident	91 Å²	91	38.2 Å²	38.2	43%	0.425	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	125.1	163.6	-175.3	-179.9	-32.9	0	0	108.9	V320 C321 S383	V320-Q353 HydrophobicContact CG1-CG 3.86Å; V320-Q353 VanDerWaalsContact CG1-NE2 3.34Å; C321-Q353 CarbonylContact O-C 3.58Å; C321-Q353 WeakPolarHBondContact O-CA 3.48Å; C321-Q353 WeakPolarHBondContact O-CG 3.46Å; Q353-S383 WeakPolarHBondContact CB-OG 3.46Å; Q353-S383 PolarHBondContact N-OG 2.89Å; Q353-S383 PolarHBondContact O-N 2.96Å; Q353-S383 VanDerWaalsContact O-N 3.15Å
354	I	92.5	Very high	87.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	125.3	178.3	-55.8	-169.2	0	0	0	108.5	V320 C321 I339 V341 Q352 M356 K381 L382	V320-I354 WeakPolarHBondContact CA-O 3.47Å; C321-I354 PolarHBondContact N-O 2.76Å; C321-I354 PolarHBondContact O-N 2.85Å; I339-I354 HydrophobicContact CG2-CD1 4.35Å; V341-I354 HydrophobicContact CG2-CD1 3.43Å; V341-I354 VanDerWaalsContact CG2-CD1 3.43Å; Q352-I354 HydrophobicContact CG-CD1 4.08Å; Q352-I354 HydrophobicContact CG-CG1 3.73Å; I354-M356 HydrophobicContact CG2-CG 4.14Å; I354-K381 WeakPolarHBondContact CA-O 3.48Å; I354-L382 HydrophobicContact CB-CD2 4.34Å; I354-L382 HydrophobicContact CD1-CD2 4.11Å; I354-L382 HydrophobicContact CG1-CD2 3.77Å; I354-L382 HydrophobicContact CG2-CD2 4.12Å
355	S	92.3	Very high	87.1	Confident	25 Å²	25	40.8 Å²	40.8	18%	0.175	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	121.7	172.3	168.6	0	0	0	0	109.1	I319 V380 K381	I319-S355 CarbonylContact O-C 3.54Å; I319-S355 WeakPolarHBondContact O-CA 3.35Å; S355-V380 CarbonylContact O-C 3.57Å; S355-V380 WeakPolarHBondContact O-CA 3.35Å; S355-K381 PolarHBondContact N-O 2.86Å; S355-K381 PolarHBondContact O-N 3.06Å
356	M	91.8	Very high	87	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	142.5	175.1	-60.8	-168.8	-61.3	0	0	110.5	N318 I319 V330 L332 I339 I354 L378 E379	N318-M356 CarbonylContact C-O 3.54Å; N318-M356 VanDerWaalsContact CA-O 3.22Å; N318-M356 WeakPolarHBondContact CA-O 3.36Å; I319-M356 HydrophobicContact CG2-CB 4Å; I319-M356 HydrophobicContact CG2-CE 3.61Å; I319-M356 PolarHBondContact N-O 2.87Å; I319-M356 PolarHBondContact O-N 3.08Å; V330-M356 HydrophobicContact CB-CE 4.08Å; V330-M356 HydrophobicContact CG1-CE 3.85Å; V330-M356 WeakPolarHBondContact O-CE 3.34Å; L332-M356 HydrophobicContact CB-CE 3.93Å; L332-M356 HydrophobicContact CD1-CB 4.26Å; I339-M356 HydrophobicContact CB-SD 3.94Å; I339-M356 HydrophobicContact CD1-CG 3.91Å; I339-M356 HydrophobicContact CD1-SD 3.51Å; I339-M356 VanDerWaalsContact CD1-SD 3.51Å; I339-M356 HydrophobicContact CG1-SD 3.54Å; I339-M356 VanDerWaalsContact CG1-SD 3.54Å; I354-M356 HydrophobicContact CG2-CG 4.14Å; M356-L378 HydrophobicContact CB-CD1 4.34Å; M356-L378 HydrophobicContact SD-CD2 4.43Å; M356-E379 CarbonylContact C-O 3.59Å; M356-E379 WeakPolarHBondContact CA-O 3.36Å
357	K	89.6	Confident	86.8	Confident	44 Å²	44	41.2 Å²	41.2	19%	0.191	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	124.9	179.3	178.6	-161.8	-175.8	-154.7	0	111	E316 T317 N318 L359 E379	E316-K357 HydrophobicContact CB-CG 4.27Å; E316-K357 WeakPolarHBondContact OE1-CE 3.1Å; E316-K357 IonicContact OE1-NZ 3.35Å; E316-K357 PolarHBondContact OE1-NZ 2.85Å; E316-K357 WeakPolarHBondContact OE2-CE 3.44Å; E316-K357 IonicContact OE2-NZ 3.76Å; E316-K357 PolarHBondContact OE2-NZ 3.41Å; T317-K357 WeakPolarHBondContact O-CA 3.47Å; N318-K357 HydrophobicContact CB-CB 4.22Å; N318-K357 HydrophobicContact CB-CG 4.29Å; K357-L359 HydrophobicContact CD-CD2 3.98Å; K357-L359 HydrophobicContact CG-CD2 4.4Å; K357-E379 HydrophobicContact CB-CB 4.22Å; K357-E379 WeakPolarHBondContact CD-OE1 3.46Å; K357-E379 PolarHBondContact N-O 3.12Å; K357-E379 PolarHBondContact O-N 3.31Å
358	A	88.8	Confident	86.8	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	121.1	176.3	0	0	0	0	0	111.9	T317 L332 L360 P376	T317-A358 PolarHBondContact O-N 3.16Å; L332-A358 HydrophobicContact CD2-CB 3.65Å; A358-L360 HydrophobicContact CB-CD2 4.42Å; A358-P376 HydrophobicContact CB-CB 4.37Å; A358-P376 HydrophobicContact CB-CG 4.5Å
359	L	86.6	Confident	86.9	Confident	11 Å²	11	40 Å²	40	6%	0.058	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	122.4	169.3	-46.8	-179.5	0	0	0	108.4	E316 K357 V377 K421 Y450	E316-L359 VanDerWaalsContact OE1-CD2 3.26Å; E316-L359 WeakPolarHBondContact OE1-CD2 3.42Å; K357-L359 HydrophobicContact CD-CD2 3.98Å; K357-L359 HydrophobicContact CG-CD2 4.4Å; L359-V377 HydrophobicContact CB-CB 4.33Å; L359-V377 WeakPolarHBondContact CB-O 3.24Å; L359-V377 PolarHBondContact N-O 3.14Å; L359-V377 PolarHBondContact O-N 3.47Å; L359-V377 VanDerWaalsContact O-N 3.15Å; L359-K421 HydrophobicContact CD1-CD 4.11Å; L359-K421 HydrophobicContact CD1-CG 4.13Å; L359-Y450 HydrophobicContact CD1-CD1 4.01Å; L359-Y450 HydrophobicContact CD1-CE1 3.99Å
360	L	81.5	Confident	87.2	Confident	9 Å²	9	41.5 Å²	41.5	5%	0.047	21%	0.21	C	C	.	.	S	Bend	trans	-87.5	-30	-170.7	-47.4	-176.9	0	0	0	113.3	A314 A358 P362 F495 H497 P501 V569	A314-L360 HydrophobicContact CB-CD1 3.41Å; A314-L360 VanDerWaalsContact CB-CD1 3.41Å; A358-L360 HydrophobicContact CB-CD2 4.42Å; L360-P362 WeakPolarHBondContact O-CD 3.22Å; L360-F495 HydrophobicContact CD1-CE1 4Å; L360-H497 PolarHBondContact O-NE2 3.17Å; L360-P501 HydrophobicContact CD1-CG 3.81Å; L360-V569 HydrophobicContact CB-CG2 4.08Å; L360-V569 WeakPolarHBondContact O-CG2 3.46Å
361	D	80.9	Confident	87.3	Confident	53 Å²	53	38.4 Å²	38.4	28%	0.283	20%	0.197	S	C	.	.	S	Bend	trans	-96.1	110.3	174.9	-73.6	-79.8	0	0	0	108.7	V569 R571	D361-V569 WeakPolarHBondContact OD1-CB 3.36Å; D361-V569 PolarHBondContact OD1-N 2.85Å; D361-R571 IonicContact OD1-NH1 2.76Å; D361-R571 PolarHBondContact OD1-NH1 3.4Å; D361-R571 IonicContact OD2-CZ 2.72Å; D361-R571 VanDerWaalsContact OD2-CZ 3.31Å; D361-R571 IonicContact OD2-NH1 2.73Å; D361-R571 PolarHBondContact OD2-NH1 2.94Å; D361-R571 IonicContact OD2-NH2 2.69Å; D361-R571 PolarHBondContact OD2-NH2 2.98Å
362	P	83.6	Confident	87.4	Confident	18 Å²	18	36.1 Å²	36.1	12%	0.117	18%	0.183	C	C	.	.			trans	-74.6	155.5	-177.1	30.5	-35.2	0	0	0	112.4	L360 L366 V377 G567	L360-P362 WeakPolarHBondContact O-CD 3.22Å; P362-L366 HydrophobicContact CB-CD1 4.32Å; P362-V377 HydrophobicContact CB-CG2 3.93Å; P362-G567 VanDerWaalsContact CD-O 3.29Å; P362-G567 WeakPolarHBondContact CD-O 3.5Å
363	P	84.1	Confident	87.4	Confident	5 Å²	5	36.4 Å²	36.4	3%	0.032	19%	0.185	C	C	.	.			trans	-57.3	149.9	166.1	-21.9	32.5	0	0	0	112.2	E365 L366 K421 Y425	P363-E365 VanDerWaalsContact C-N 3.29Å; P363-E365 PolarHBondContact O-N 2.99Å; P363-L366 HydrophobicContact CG-CD1 4.49Å; P363-L366 PolarHBondContact O-N 3.24Å; P363-K421 WeakPolarHBondContact CG-O 3.34Å; P363-Y425 HydrophobicContact CG-CE2 4.2Å
364	L	79.6	Confident	87.4	Confident	119 Å²	119	32 Å²	32	62%	0.623	17%	0.165	S	C	*	.	G	3₁₀ helix	trans	-64.4	-34	-178	-58.8	176.4	0	0	0	112.1	L366 N367 L566	L364-L366 PolarHBondContact O-N 3.28Å; L364-L366 VanDerWaalsContact O-N 3.12Å; L364-N367 PolarHBondContact O-N 3.07Å; L364-N367 VanDerWaalsContact O-N 3.12Å; L364-L566 HydrophobicContact CD2-CD1 4.28Å; L364-L566 HydrophobicContact CD2-CD2 4.19Å
365	E	82.4	Confident	87.3	Confident	129 Å²	129	32.2 Å²	32.2	60%	0.603	17%	0.166	S	C	*	.	G	3₁₀ helix	trans	-57.9	-26.8	-179.9	-57.7	-164.7	162.6	0	0	114	P363 N367 E422	P363-E365 VanDerWaalsContact C-N 3.29Å; P363-E365 PolarHBondContact O-N 2.99Å; E365-N367 VanDerWaalsContact C-N 3.26Å; E365-N367 PolarHBondContact O-N 3.36Å; E365-E422 VanDerWaalsContact CD-O 3.26Å
366	L	85.7	Confident	87.3	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.01	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-75.3	-12.1	-178.4	-58.1	-174.3	0	0	0	113.5	P362 P363 L364 S371 V377 L416 Y425 A452 V454	P362-L366 HydrophobicContact CB-CD1 4.32Å; P363-L366 HydrophobicContact CG-CD1 4.49Å; P363-L366 PolarHBondContact O-N 3.24Å; L364-L366 PolarHBondContact O-N 3.28Å; L364-L366 VanDerWaalsContact O-N 3.12Å; L366-S371 WeakPolarHBondContact O-CB 3.46Å; L366-S371 PolarHBondContact O-OG 2.75Å; L366-V377 HydrophobicContact CD1-CG2 3.68Å; L366-L416 HydrophobicContact CD2-CD1 3.86Å; L366-Y425 HydrophobicContact CD2-CD1 4Å; L366-Y425 HydrophobicContact CD2-CD2 3.73Å; L366-Y425 HydrophobicContact CD2-CE1 4.22Å; L366-Y425 HydrophobicContact CD2-CE2 3.98Å; L366-Y425 HydrophobicContact CD2-CG 3.75Å; L366-Y425 HydrophobicContact CG-CE2 4.44Å; L366-A452 HydrophobicContact CD1-CB 3.85Å; L366-V454 HydrophobicContact CB-CG1 4.39Å
367	N	88	Confident	87.3	Confident	10 Å²	10	31.4 Å²	31.4	5%	0.053	16%	0.16	C	C	.	.			trans	-129.8	118.4	-170.1	-64.2	-75.4	0	0	0	112.2	L364 E365 S371 S373 K565 L566	L364-N367 PolarHBondContact O-N 3.07Å; L364-N367 VanDerWaalsContact O-N 3.12Å; E365-N367 VanDerWaalsContact C-N 3.26Å; E365-N367 PolarHBondContact O-N 3.36Å; N367-S371 CarbonylContact C-O 3.57Å; N367-S371 WeakPolarHBondContact CA-O 3.46Å; N367-S373 PolarHBondContact ND2-OG 3.11Å; N367-S373 WeakPolarHBondContact OD1-CB 3.49Å; N367-S373 PolarHBondContact OD1-N 3.34Å; N367-S373 PolarHBondContact OD1-OG 3.45Å; N367-K565 WeakPolarHBondContact CB-O 3.41Å; N367-L566 PolarHBondContact ND2-O 2.91Å
368	S	87.6	Confident	87.4	Confident	54 Å²	54	29.3 Å²	29.3	38%	0.378	15%	0.151	S	C	.	.	S	Bend	trans	-151.4	-170.3	-179.2	69.7	0	0	0	0	110.5	R370 S371	S368-R370 PolarHBondContact O-N 2.9Å; S368-R370 PolarHBondContact OG-N 3.45Å; S368-R370 VanDerWaalsContact OG-N 3.16Å; S368-S371 PolarHBondContact N-O 3.45Å; S368-S371 PolarHBondContact OG-N 2.9Å; S368-S371 VanDerWaalsContact OG-N 3.11Å
369	D	87.1	Confident	87.6	Confident	63 Å²	63	30.2 Å²	30.2	34%	0.337	16%	0.155	S	C	.	.	S	Bend	trans	-66.6	-24.6	169.5	-67.2	-54.9	0	0	0	112.7	T465 V466 K565	D369-T465 HydrophobicContact CB-CG2 4.34Å; D369-T465 CarbonylContact O-C 3.57Å; D369-T465 WeakPolarHBondContact O-CA 3.36Å; D369-T465 VanDerWaalsContact OD1-CG2 3.31Å; D369-T465 WeakPolarHBondContact OD1-CG2 3.14Å; D369-V466 PolarHBondContact O-N 3.14Å; D369-K565 WeakPolarHBondContact OD1-CE 3.37Å; D369-K565 IonicContact OD1-NZ 2.65Å; D369-K565 PolarHBondContact OD1-NZ 3.14Å; D369-K565 IonicContact OD2-NZ 3.15Å
370	R	89.2	Confident	88	Confident	112 Å²	112	29.7 Å²	29.7	42%	0.423	15%	0.152	S	C	.	.	S	Bend	trans	-103.3	-8.9	-177.8	-67	-174.2	174.5	162.4	-0.4	114.6	S368 H456 G457 P458 I460 V466	S368-R370 PolarHBondContact O-N 2.9Å; S368-R370 PolarHBondContact OG-N 3.45Å; S368-R370 VanDerWaalsContact OG-N 3.16Å; R370-H456 WeakPolarHBondContact O-CA 3.49Å; R370-H456 PolarHBondContact O-CD2 3.41Å; R370-G457 PolarHBondContact O-N 2.91Å; R370-P458 WeakPolarHBondContact CD-O 3.49Å; R370-P458 PolarHBondContact NE-O 2.97Å; R370-I460 HydrophobicContact CG-CB 4.34Å; R370-I460 PolarHBondContact NE-O 3.32Å; R370-I460 PolarHBondContact NH2-O 3.45Å; R370-V466 WeakPolarHBondContact O-CG2 3.45Å
371	S	90.3	Very high	88.5	Confident	11 Å²	11	32.9 Å²	32.9	8%	0.077	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	139.5	179.3	-177.6	0	0	0	0	111.3	L366 N367 S368 A455	L366-S371 WeakPolarHBondContact O-CB 3.46Å; L366-S371 PolarHBondContact O-OG 2.75Å; N367-S371 CarbonylContact C-O 3.57Å; N367-S371 WeakPolarHBondContact CA-O 3.46Å; S368-S371 PolarHBondContact N-O 3.45Å; S368-S371 PolarHBondContact OG-N 2.9Å; S368-S371 VanDerWaalsContact OG-N 3.11Å; S371-A455 CarbonylContact C-O 3.54Å; S371-A455 WeakPolarHBondContact CA-O 3.46Å
372	C	90.9	Very high	89	Confident	2 Å²	2	31 Å²	31	1%	0.014	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	129.3	168.5	-176.5	0	0	0	0	110.4	V454 A455 V466	C372-V454 CarbonylContact O-C 3.55Å; C372-V454 WeakPolarHBondContact O-CA 3.24Å; C372-V454 WeakPolarHBondContact O-CB 3.48Å; C372-A455 PolarHBondContact N-O 3.21Å; C372-A455 PolarHBondContact O-N 2.93Å; C372-V466 HydrophobicContact CB-CG1 3.98Å
373	S	91.4	Very high	89.3	Confident	6 Å²	6	33.6 Å²	33.6	4%	0.042	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	130.7	171.6	54.9	0	0	0	0	111.6	N367 K472	N367-S373 PolarHBondContact ND2-OG 3.11Å; N367-S373 WeakPolarHBondContact OD1-CB 3.49Å; N367-S373 PolarHBondContact OD1-N 3.34Å; N367-S373 PolarHBondContact OD1-OG 3.45Å; S373-K472 PolarHBondContact O-NZ 2.89Å
374	I	91.4	Very high	89.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.181	C	C	.	.			trans	-124.9	0.6	-178.1	68.2	173.9	0	0	0	114.1	V397 S398 A399 L413 I453 A455 K472	I374-V397 HydrophobicContact CD1-CB 3.77Å; I374-V397 HydrophobicContact CD1-CG1 3.84Å; I374-V397 HydrophobicContact CD1-CG2 4.25Å; I374-V397 HydrophobicContact CG1-CB 4.02Å; I374-V397 HydrophobicContact CG1-CG1 3.98Å; I374-S398 PolarHBondContact O-N 3.25Å; I374-A399 HydrophobicContact CB-CB 4.07Å; I374-A399 HydrophobicContact CD1-CB 4.35Å; I374-A399 HydrophobicContact CG2-CB 3.55Å; I374-L413 HydrophobicContact CD1-CD1 4.18Å; I374-L413 HydrophobicContact CD1-CD2 3.55Å; I374-L413 HydrophobicContact CD1-CG 4.4Å; I374-I453 HydrophobicContact CD1-CG2 3.96Å; I374-I453 HydrophobicContact CG1-CB 4.28Å; I374-I453 HydrophobicContact CG1-CG2 3.89Å; I374-I453 WeakPolarHBondContact CG1-O 3.38Å; I374-I453 PolarHBondContact N-O 3.49Å; I374-A455 HydrophobicContact CD1-CB 4.49Å; I374-A455 HydrophobicContact CG2-CB 4.16Å; I374-K472 HydrophobicContact CG2-CD 4.49Å
375	S	91.4	Very high	89.7	Confident	4 Å²	4	33 Å²	33	3%	0.028	17%	0.171	C	C	.	.	S	Bend	trans	-123.3	169	165.6	71	0	0	0	0	110.2	M395 I453	S375-M395 WeakPolarHBondContact CB-SD 3.49Å; S375-I453 PolarHBondContact N-O 2.96Å; S375-I453 PolarHBondContact OG-N 2.95Å
376	P	91.1	Very high	89.7	Confident	7 Å²	7	34.4 Å²	34.4	5%	0.045	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-61.9	167.1	153.5	31.7	-38	0	0	0	110.6	I337 A358 H497 C499	I337-P376 HydrophobicContact CD1-CG 3.62Å; A358-P376 HydrophobicContact CB-CB 4.37Å; A358-P376 HydrophobicContact CB-CG 4.5Å; P376-H497 VanDerWaalsContact CA-CD2 3.42Å; P376-H497 WeakPolarHBondContact CA-CD2 3.31Å; P376-C499 HydrophobicContact CG-CB 4.06Å
377	V	91.6	Very high	89.7	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	121.6	168.6	-174.7	0	0	0	0	108.4	L359 P362 L366 A452	L359-V377 HydrophobicContact CB-CB 4.33Å; L359-V377 WeakPolarHBondContact CB-O 3.24Å; L359-V377 PolarHBondContact N-O 3.14Å; L359-V377 PolarHBondContact O-N 3.47Å; L359-V377 VanDerWaalsContact O-N 3.15Å; P362-V377 HydrophobicContact CB-CG2 3.93Å; L366-V377 HydrophobicContact CD1-CG2 3.68Å; V377-A452 HydrophobicContact CG1-CB 4.47Å; V377-A452 HydrophobicContact CG2-CB 4.03Å
378	L	92.8	Very high	89.3	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	116.1	-179.5	-168.9	70.6	0	0	0	109.8	L332 I337 I339 M356 V380 L393 Y450 V451	L332-L378 HydrophobicContact CD2-CD1 4.19Å; I337-L378 HydrophobicContact CG2-CD1 4.18Å; I337-L378 HydrophobicContact CG2-CD2 3.87Å; I339-L378 HydrophobicContact CD1-CD2 4.45Å; M356-L378 HydrophobicContact CB-CD1 4.34Å; M356-L378 HydrophobicContact SD-CD2 4.43Å; L378-V380 HydrophobicContact CB-CG2 4.49Å; L378-V380 HydrophobicContact CD2-CG2 3.6Å; L378-V380 HydrophobicContact CG-CG2 3.75Å; L378-L393 HydrophobicContact CD2-CD1 3.56Å; L378-L393 HydrophobicContact CD2-CD2 4.19Å; L378-Y450 WeakPolarHBondContact O-CA 3.32Å; L378-V451 PolarHBondContact N-O 3.1Å; L378-V451 PolarHBondContact O-N 2.97Å
379	E	93.4	Very high	89.2	Confident	19 Å²	19	42.4 Å²	42.4	9%	0.089	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	121.4	162.8	179.2	-174.5	91	0	0	108.4	M356 K357 K381 M449 Y450	M356-E379 CarbonylContact C-O 3.59Å; M356-E379 WeakPolarHBondContact CA-O 3.36Å; K357-E379 HydrophobicContact CB-CB 4.22Å; K357-E379 WeakPolarHBondContact CD-OE1 3.46Å; K357-E379 PolarHBondContact N-O 3.12Å; K357-E379 PolarHBondContact O-N 3.31Å; E379-K381 HydrophobicContact CG-CD 4.37Å; E379-K381 HydrophobicContact CG-CG 4.46Å; E379-K381 WeakPolarHBondContact OE1-CE 3.5Å; E379-K381 IonicContact OE1-NZ 3.56Å; E379-K381 PolarHBondContact OE1-NZ 3.01Å; E379-K381 IonicContact OE2-NZ 3.99Å; E379-K381 PolarHBondContact OE2-NZ 2.76Å; E379-M449 CarbonylContact C-O 3.54Å; E379-M449 WeakPolarHBondContact CA-O 3.33Å; E379-Y450 HydrophobicContact CB-CD1 4.01Å; E379-Y450 HydrophobicContact CB-CE1 3.7Å; E379-Y450 HydrophobicContact CG-CD1 4.32Å; E379-Y450 HydrophobicContact CG-CE1 3.65Å; E379-Y450 PolarHBondContact OE2-OH 3.23Å
380	V	93.5	Very high	89.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	124.3	177.3	-176.5	0	0	0	0	108.2	I339 S355 L378 L382 C448 M449	I339-V380 HydrophobicContact CD1-CB 4.42Å; I339-V380 HydrophobicContact CD1-CG1 3.68Å; I339-V380 HydrophobicContact CD1-CG2 3.78Å; S355-V380 CarbonylContact O-C 3.57Å; S355-V380 WeakPolarHBondContact O-CA 3.35Å; L378-V380 HydrophobicContact CB-CG2 4.49Å; L378-V380 HydrophobicContact CD2-CG2 3.6Å; L378-V380 HydrophobicContact CG-CG2 3.75Å; V380-L382 HydrophobicContact CG1-CD2 4.22Å; V380-L382 HydrophobicContact CG1-CG 4.48Å; V380-C448 CarbonylContact O-C 3.58Å; V380-C448 WeakPolarHBondContact O-CA 3.41Å; V380-M449 HydrophobicContact CB-CE 4.22Å; V380-M449 HydrophobicContact CG1-CE 3.95Å; V380-M449 PolarHBondContact N-O 3.12Å; V380-M449 PolarHBondContact O-N 2.73Å
381	K	92.7	Very high	89.5	Confident	76 Å²	76	34.9 Å²	34.9	33%	0.33	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.7	178.1	-76	165.6	179.8	158.1	0	110.8	I354 S355 E379 P447 C448	I354-K381 WeakPolarHBondContact CA-O 3.48Å; S355-K381 PolarHBondContact N-O 2.86Å; S355-K381 PolarHBondContact O-N 3.06Å; E379-K381 HydrophobicContact CG-CD 4.37Å; E379-K381 HydrophobicContact CG-CG 4.46Å; E379-K381 WeakPolarHBondContact OE1-CE 3.5Å; E379-K381 IonicContact OE1-NZ 3.56Å; E379-K381 PolarHBondContact OE1-NZ 3.01Å; E379-K381 IonicContact OE2-NZ 3.99Å; E379-K381 PolarHBondContact OE2-NZ 2.76Å; K381-P447 WeakPolarHBondContact CA-O 3.47Å; K381-P447 WeakPolarHBondContact CB-O 3.4Å; K381-C448 WeakPolarHBondContact CE-SG 3.44Å; K381-C448 HydrophobicContact CG-CB 3.92Å
382	L	91.6	Very high	89.6	Confident	13 Å²	13	36.6 Å²	36.6	7%	0.068	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	140.2	-170.6	-61.9	-178.3	0	0	0	110.2	I354 V380 I391 L445 P447 M449	I354-L382 HydrophobicContact CB-CD2 4.34Å; I354-L382 HydrophobicContact CD1-CD2 4.11Å; I354-L382 HydrophobicContact CG1-CD2 3.77Å; I354-L382 HydrophobicContact CG2-CD2 4.12Å; V380-L382 HydrophobicContact CG1-CD2 4.22Å; V380-L382 HydrophobicContact CG1-CG 4.48Å; L382-I391 HydrophobicContact CD1-CD1 4.42Å; L382-I391 HydrophobicContact CD2-CD1 4.45Å; L382-L445 HydrophobicContact CD1-CB 3.9Å; L382-L445 HydrophobicContact CD1-CD1 4.46Å; L382-L445 HydrophobicContact CD1-CD2 4.06Å; L382-L445 HydrophobicContact CD1-CG 4.36Å; L382-P447 PolarHBondContact N-O 3.29Å; L382-M449 HydrophobicContact CD1-CE 3.61Å; L382-M449 HydrophobicContact CG-CE 4.2Å
383	S	90.3	Very high	89.7	Confident	73 Å²	73	36.6 Å²	36.6	51%	0.51	19%	0.189	S	C	.	.	S	Bend	trans	-96.3	-28.7	-176.3	66.7	0	0	0	0	115.8	Q353	Q353-S383 WeakPolarHBondContact CB-OG 3.46Å; Q353-S383 PolarHBondContact N-OG 2.89Å; Q353-S383 PolarHBondContact O-N 2.96Å; Q353-S383 VanDerWaalsContact O-N 3.15Å
384	N	85.3	Confident	89.7	Confident	32 Å²	32	38.4 Å²	38.4	17%	0.171	20%	0.197	C	C	.	.			trans	-121.2	143	175.4	-176	9.3	0	0	0	108.1	E350 Q352 E386	E350-N384 PolarHBondContact OE2-ND2 3.21Å; Q352-N384 PolarHBondContact NE2-O 2.85Å; Q352-N384 PolarHBondContact OE1-O 2.97Å; N384-E386 PolarHBondContact OD1-N 3.44Å
385	L	85.6	Confident	89.7	Confident	80 Å²	80	38.6 Å²	38.6	42%	0.419	20%	0.198	S	C	.	.			trans	-118.9	-7.6	-179	-54	-179.9	0	0	0	112.2	V387 P447	L385-V387 PolarHBondContact O-N 3.46Å; L385-P447 HydrophobicContact CD1-CG 3.95Å; L385-P447 HydrophobicContact CD2-CG 4.37Å
386	E	83.6	Confident	89.5	Confident	159 Å²	159	41.5 Å²	41.5	74%	0.743	21%	0.21	S	C	*	.			trans	-79.1	49.8	177.3	-60.8	-171.2	-157.1	0	0	110.7	N384	N384-E386 PolarHBondContact OD1-N 3.44Å
387	V	85.6	Confident	89.5	Confident	35 Å²	35	41.3 Å²	41.3	21%	0.212	21%	0.209	C	C	.	.			trans	-100	141.8	-167.9	-61.2	0	0	0	0	111.9	H345 V346 L385 L445	H345-V387 CarbonylContact O-C 3.58Å; H345-V387 VanDerWaalsContact O-CA 3.27Å; H345-V387 WeakPolarHBondContact O-CA 3.44Å; V346-V387 HydrophobicContact CG1-CG1 4.12Å; L385-V387 PolarHBondContact O-N 3.46Å; V387-L445 HydrophobicContact CG2-CD1 3.89Å
388	K	78.4	Confident	89.4	Confident	153 Å²	153	41.4 Å²	41.4	67%	0.665	21%	0.21	S	C	*	.	S	Bend	trans	-95.3	-10	-172.3	-64.1	175.9	-176.2	172.6	0	114	H345	H345-K388 PolarHBondContact O-N 3.38Å
389	T	87	Confident	89.2	Confident	46 Å²	46	41.6 Å²	41.6	28%	0.282	21%	0.211	S	C	.	.	S	Bend	trans	-140.6	151.7	-174.1	63.1	0	0	0	0	111.4	P342 H345	P342-T389 HydrophobicContact CB-CG2 4.37Å; H345-T389 WeakPolarHBondContact CA-OG1 3.48Å; H345-T389 WeakPolarHBondContact CB-OG1 3.44Å; H345-T389 PolarHBondContact CE1-O 2.9Å; H345-T389 PolarHBondContact ND1-O 3.22Å; H345-T389 PolarHBondContact ND1-OG1 3.4Å
390	S	88.9	Confident	88.9	Confident	17 Å²	17	44.7 Å²	44.7	12%	0.119	23%	0.225	C	C	.	.			trans	-68.6	146.2	166.9	53.7	0	0	0	0	111.8	P342 Q441 L442	P342-S390 WeakPolarHBondContact CD-O 3.35Å; P342-S390 WeakPolarHBondContact CG-O 3.39Å; S390-Q441 WeakPolarHBondContact OG-CG 3.47Å; S390-Q441 PolarHBondContact OG-NE2 2.77Å; S390-L442 WeakPolarHBondContact CA-O 3.22Å; S390-L442 WeakPolarHBondContact CB-O 3.08Å
391	I	92.1	Very high	88.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	153	166	67.3	-173.8	0	0	0	110.5	I339 V341 H345 L382 L442 L445 M449	I339-I391 HydrophobicContact CD1-CD1 4.39Å; I339-I391 HydrophobicContact CG2-CB 4.03Å; I339-I391 HydrophobicContact CG2-CD1 3.94Å; I339-I391 HydrophobicContact CG2-CG1 4.24Å; V341-I391 HydrophobicContact CG1-CG2 4.45Å; V341-I391 HydrophobicContact CG2-CG2 4.12Å; H345-I391 VanDerWaalsContact CE1-CG2 3.49Å; H345-I391 WeakPolarHBondContact CE1-CG2 3.46Å; L382-I391 HydrophobicContact CD1-CD1 4.42Å; L382-I391 HydrophobicContact CD2-CD1 4.45Å; I391-L442 HydrophobicContact CD1-CD1 4.18Å; I391-L442 HydrophobicContact CG1-CB 3.9Å; I391-L442 HydrophobicContact CG1-CD1 4.08Å; I391-L442 HydrophobicContact CG1-CG 4.47Å; I391-L442 PolarHBondContact N-O 3.28Å; I391-L442 PolarHBondContact O-N 3.24Å; I391-L445 HydrophobicContact CD1-CD2 3.84Å; I391-L445 HydrophobicContact CG1-CD1 4.46Å; I391-L445 HydrophobicContact CG1-CD2 3.84Å; I391-L445 HydrophobicContact CG2-CD1 4.27Å; I391-M449 HydrophobicContact CD1-CE 4.47Å
392	I	92.4	Very high	88.3	Confident	47 Å²	47	45.1 Å²	45.1	24%	0.241	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	121.4	178.9	-57.4	171.1	0	0	0	108.5	I339 H340 Q439	I339-I392 CarbonylContact C-O 3.58Å; I339-I392 WeakPolarHBondContact CA-O 3.31Å; H340-I392 HydrophobicContact CB-CB 4.37Å; H340-I392 PolarHBondContact N-O 3.02Å; H340-I392 PolarHBondContact O-N 3.14Å; I392-Q439 HydrophobicContact CG2-CB 4.3Å
393	L	92.7	Very high	87.7	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.6	174.1	175	60	0	0	0	109.6	I337 I339 L378 M395 Q439 A440 L442 V451	I337-L393 HydrophobicContact CG2-CD1 4.1Å; I339-L393 HydrophobicContact CD1-CD1 4.35Å; I339-L393 HydrophobicContact CG1-CB 4.49Å; I339-L393 HydrophobicContact CG1-CD1 3.68Å; L378-L393 HydrophobicContact CD2-CD1 3.56Å; L378-L393 HydrophobicContact CD2-CD2 4.19Å; L393-M395 HydrophobicContact CD1-CE 4.17Å; L393-M395 HydrophobicContact CD2-CE 3.43Å; L393-M395 VanDerWaalsContact CD2-CE 3.43Å; L393-M395 HydrophobicContact CG-CE 3.74Å; L393-Q439 CarbonylContact O-C 3.56Å; L393-Q439 WeakPolarHBondContact O-CA 3.4Å; L393-A440 PolarHBondContact N-O 3.36Å; L393-A440 PolarHBondContact O-N 2.73Å; L393-L442 HydrophobicContact CB-CD1 4.15Å; L393-L442 HydrophobicContact CD2-CD1 4.47Å; L393-V451 HydrophobicContact CD2-CB 3.96Å; L393-V451 HydrophobicContact CD2-CG1 3.52Å
394	E	92.1	Very high	87.5	Confident	44 Å²	44	51.4 Å²	51.4	21%	0.206	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	131.6	176.1	178.1	166.9	-132.9	0	0	110	I337 S338 H340 T437 Q439	I337-E394 WeakPolarHBondContact CA-O 3.2Å; S338-E394 PolarHBondContact N-O 3.17Å; S338-E394 PolarHBondContact O-N 3.03Å; H340-E394 IonicContact CD2-OE2 2.76Å; H340-E394 IonicContact CE1-OE2 2.75Å; H340-E394 IonicContact NE2-OE2 3.99Å; H340-E394 PolarHBondContact NE2-OE2 2.84Å; E394-T437 HydrophobicContact CG-CG2 3.67Å; E394-Q439 HydrophobicContact CB-CG 4.08Å; E394-Q439 HydrophobicContact CG-CG 4Å; E394-Q439 PolarHBondContact OE1-NE2 3.22Å
395	M	90.7	Very high	87.2	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.015	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	150.9	173.9	66.2	178	82.8	0	0	113.6	S336 I337 S375 L393 V438 I453	S336-M395 WeakPolarHBondContact O-CA 3.4Å; I337-M395 HydrophobicContact CG1-CB 4.01Å; S375-M395 WeakPolarHBondContact CB-SD 3.49Å; L393-M395 HydrophobicContact CD1-CE 4.17Å; L393-M395 HydrophobicContact CD2-CE 3.43Å; L393-M395 VanDerWaalsContact CD2-CE 3.43Å; L393-M395 HydrophobicContact CG-CE 3.74Å; M395-V438 PolarHBondContact N-O 2.87Å; M395-V438 PolarHBondContact O-N 3.04Å; M395-I453 HydrophobicContact CE-CD1 4.07Å; M395-I453 HydrophobicContact CE-CG1 4.05Å; M395-I453 HydrophobicContact CG-CD1 3.51Å; M395-I453 HydrophobicContact CG-CG1 4.33Å; M395-I453 HydrophobicContact SD-CB 4.34Å; M395-I453 HydrophobicContact SD-CD1 3.53Å; M395-I453 VanDerWaalsContact SD-CD1 3.53Å; M395-I453 HydrophobicContact SD-CG1 3.66Å
396	K	89.3	Confident	87	Confident	66 Å²	66	60 Å²	60	29%	0.287	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	122.8	168.4	-161	-172.4	-178.5	-170.2	0	111	S336 D436	S336-K396 PolarHBondContact O-N 3.44Å; S336-K396 WeakPolarHBondContact OG-CB 3.47Å; K396-D436 CarbonylContact C-O 3.59Å; K396-D436 WeakPolarHBondContact CA-O 3.46Å; K396-D436 HydrophobicContact CD-CB 4.2Å; K396-D436 WeakPolarHBondContact CE-OD2 3.32Å; K396-D436 HydrophobicContact CG-CB 3.78Å; K396-D436 WeakPolarHBondContact CG-O 3.41Å; K396-D436 IonicContact NZ-OD2 2.72Å; K396-D436 PolarHBondContact NZ-OD2 3.06Å
397	V	90.3	Very high	86.8	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.018	26%	0.263	C	S	.	.			trans	-84.1	155.8	174.4	-63.9	0	0	0	0	112.1	I374 L413 D436 V438 I453	I374-V397 HydrophobicContact CD1-CB 3.77Å; I374-V397 HydrophobicContact CD1-CG1 3.84Å; I374-V397 HydrophobicContact CD1-CG2 4.25Å; I374-V397 HydrophobicContact CG1-CB 4.02Å; I374-V397 HydrophobicContact CG1-CG1 3.98Å; V397-L413 HydrophobicContact CG2-CD1 4.35Å; V397-D436 WeakPolarHBondContact CG2-O 3.29Å; V397-D436 PolarHBondContact N-O 3.49Å; V397-V438 HydrophobicContact CG1-CB 4.23Å; V397-V438 HydrophobicContact CG1-CG2 3.74Å; V397-V438 HydrophobicContact CG2-CG2 4.07Å; V397-I453 HydrophobicContact CG1-CB 4.21Å; V397-I453 HydrophobicContact CG1-CD1 4.04Å; V397-I453 HydrophobicContact CG1-CG2 3.92Å
398	S	89.6	Confident	86.6	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.014	28%	0.276	C	S	.	.	S	Bend	trans	-110.4	38.7	179.9	-54.2	0	0	0	0	111.9	I374 K473 H497 D498	I374-S398 PolarHBondContact O-N 3.25Å; S398-K473 WeakPolarHBondContact O-CB 3.46Å; S398-K473 PolarHBondContact O-N 3.5Å; S398-H497 VanDerWaalsContact OG-CA 3.31Å; S398-H497 WeakPolarHBondContact OG-CA 3.31Å; S398-D498 PolarHBondContact OG-N 3.28Å
399	A	88.6	Confident	86.7	Confident	3 Å²	3	53.6 Å²	53.6	3%	0.025	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	147.3	165.5	0	0	0	0	0	110.4	I374 I470 H471 K472	I374-A399 HydrophobicContact CB-CB 4.07Å; I374-A399 HydrophobicContact CD1-CB 4.35Å; I374-A399 HydrophobicContact CG2-CB 3.55Å; A399-I470 HydrophobicContact CB-CB 4.46Å; A399-I470 HydrophobicContact CB-CD1 3.97Å; A399-H471 WeakPolarHBondContact CA-O 3.22Å; A399-K472 HydrophobicContact CB-CD 4.28Å
400	E	86.6	Confident	86.6	Confident	84 Å²	84	52.6 Å²	52.6	39%	0.393	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	144.3	166.2	-64.7	168.2	-142.1	0	0	108.8	I470 H471 K473	E400-I470 CarbonylContact O-C 3.55Å; E400-I470 VanDerWaalsContact O-CA 3.28Å; E400-I470 WeakPolarHBondContact O-CA 3.44Å; E400-I470 WeakPolarHBondContact O-CB 3.49Å; E400-H471 HydrophobicContact CB-CB 4.43Å; E400-H471 PolarHBondContact N-O 3.45Å; E400-H471 VanDerWaalsContact N-O 3.16Å; E400-H471 PolarHBondContact O-N 3.25Å; E400-K473 WeakPolarHBondContact OE1-CE 3.42Å; E400-K473 IonicContact OE1-NZ 3.48Å; E400-K473 PolarHBondContact OE1-NZ 2.91Å
401	I	86.4	Confident	86.5	Confident	40 Å²	40	51.9 Å²	51.9	21%	0.205	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	136.3	169.4	-61.4	161.8	0	0	0	108.1	K408 V411 L413 I470	I401-K408 HydrophobicContact CG2-CG 4.02Å; I401-V411 WeakPolarHBondContact CD1-O 3.2Å; I401-L413 HydrophobicContact CD1-CD2 3.91Å; I401-L413 HydrophobicContact CD1-CG 3.94Å; I401-L413 HydrophobicContact CG1-CD2 4.03Å; I401-I470 HydrophobicContact CG1-CG2 4.39Å
402	K	86.8	Confident	86.2	Confident	45 Å²	45	53.7 Å²	53.7	20%	0.196	28%	0.283	C	S	.	.			trans	-59.1	147.2	179.4	-67.4	179.4	-176.7	174.6	0	110.7	D404 S407 D468 F469 I470	K402-D404 VanDerWaalsContact CB-OD2 3.24Å; K402-D404 WeakPolarHBondContact CB-OD2 3.36Å; K402-D404 PolarHBondContact O-N 3.06Å; K402-D404 VanDerWaalsContact O-N 3.12Å; K402-S407 WeakPolarHBondContact O-CB 3.39Å; K402-D468 WeakPolarHBondContact CD-O 3.15Å; K402-D468 WeakPolarHBondContact CE-O 3.27Å; K402-D468 PolarHBondContact NZ-O 3.2Å; K402-F469 WeakPolarHBondContact CB-O 3.47Å; K402-F469 WeakPolarHBondContact CG-O 3.27Å; K402-F469 PolarHBondContact N-O 3.12Å; K402-I470 WeakPolarHBondContact CE-O 3.4Å
403	N	79.8	Confident	86.1	Confident	129 Å²	129	53.5 Å²	53.5	69%	0.69	28%	0.282	S	S	*	.	S	Bend	trans	-73.4	-9.4	-163.2	-103.2	-45.6	0	0	0	114.9	K408	N403-K408 WeakPolarHBondContact O-CE 3.44Å; N403-K408 PolarHBondContact O-NZ 3.13Å; N403-K408 PolarHBondContact OD1-NZ 3.27Å
404	D	85.5	Confident	86	Confident	90 Å²	90	55.5 Å²	55.5	48%	0.481	29%	0.291	S	S	.	.	S	Bend	trans	-67.4	147.9	-177.2	-23.4	-77.5	0	0	0	112.3	K402 F406 S407 K408	K402-D404 VanDerWaalsContact CB-OD2 3.24Å; K402-D404 WeakPolarHBondContact CB-OD2 3.36Å; K402-D404 PolarHBondContact O-N 3.06Å; K402-D404 VanDerWaalsContact O-N 3.12Å; D404-F406 VanDerWaalsContact C-N 3.26Å; D404-F406 PolarHBondContact O-N 3.01Å; D404-S407 PolarHBondContact O-N 2.76Å; D404-S407 PolarHBondContact OD2-OG 2.86Å; D404-K408 PolarHBondContact O-N 3.11Å; D404-K408 VanDerWaalsContact O-N 3.11Å
405	L	79.3	Confident	86	Confident	157 Å²	157	53.4 Å²	53.4	82%	0.822	28%	0.282	S	S	*	.	H	α-helix	trans	-56.5	-41.5	175.4	-95	76.6	0	0	0	112	K408 S409	L405-K408 PolarHBondContact O-N 3.14Å; L405-S409 WeakPolarHBondContact O-CB 3.22Å; L405-S409 PolarHBondContact O-N 3.18Å; L405-S409 PolarHBondContact O-OG 2.71Å
406	F	80.6	Confident	86	Confident	136 Å²	136	54.3 Å²	54.3	60%	0.596	29%	0.286	S	S	*	.	H	α-helix	trans	-62.9	-49.1	-178.2	-171.1	-119.4	0	0	0	111.6	D404 K408 S409 T410 F469	D404-F406 VanDerWaalsContact C-N 3.26Å; D404-F406 PolarHBondContact O-N 3.01Å; F406-K408 PolarHBondContact O-N 2.73Å; F406-S409 PolarHBondContact O-N 3.24Å; F406-S409 VanDerWaalsContact O-N 3.16Å; F406-S409 PolarHBondContact O-OG 2.73Å; F406-T410 WeakPolarHBondContact O-CB 3.47Å; F406-T410 PolarHBondContact O-N 2.89Å; F406-T410 PolarHBondContact O-OG1 3.39Å; F406-F469 AromaticContact CD1-CE1 3.86Å; F406-F469 HydrophobicContact CD1-CE1 3.86Å; F406-F469 AromaticContact CE1-CE1 3.68Å; F406-F469 HydrophobicContact CE1-CE1 3.68Å; F406-F469 HydrophobicContact CE1-CZ 4.24Å
407	S	81.1	Confident	86.2	Confident	6 Å²	6	52.3 Å²	52.3	4%	0.042	28%	0.277	C	S	.	.	H	α-helix	trans	-56.1	-48.6	176.3	-54	0	0	0	0	112	K402 D404 S409 T410 V411	K402-S407 WeakPolarHBondContact O-CB 3.39Å; D404-S407 PolarHBondContact O-N 2.76Å; D404-S407 PolarHBondContact OD2-OG 2.86Å; S407-S409 VanDerWaalsContact C-N 3.31Å; S407-S409 PolarHBondContact O-N 3.49Å; S407-T410 PolarHBondContact O-N 2.89Å; S407-V411 PolarHBondContact O-N 2.64Å
408	K	81.4	Confident	86.3	Confident	112 Å²	112	52.4 Å²	52.4	49%	0.487	28%	0.277	S	S	.	.	H	α-helix	trans	-68.8	-22.9	177.9	-72.2	169.6	177.2	161.4	0	114.8	I401 N403 D404 L405 F406	I401-K408 HydrophobicContact CG2-CG 4.02Å; N403-K408 WeakPolarHBondContact O-CE 3.44Å; N403-K408 PolarHBondContact O-NZ 3.13Å; N403-K408 PolarHBondContact OD1-NZ 3.27Å; D404-K408 PolarHBondContact O-N 3.11Å; D404-K408 VanDerWaalsContact O-N 3.11Å; L405-K408 PolarHBondContact O-N 3.14Å; F406-K408 PolarHBondContact O-N 2.73Å
409	S	80.4	Confident	86.3	Confident	93 Å²	93	56.6 Å²	56.6	65%	0.65	30%	0.3	S	S	*	.	H	α-helix	trans	-86.2	-21.8	175.4	67.9	0	0	0	0	113.7	L405 F406 S407	L405-S409 WeakPolarHBondContact O-CB 3.22Å; L405-S409 PolarHBondContact O-N 3.18Å; L405-S409 PolarHBondContact O-OG 2.71Å; F406-S409 PolarHBondContact O-N 3.24Å; F406-S409 VanDerWaalsContact O-N 3.16Å; F406-S409 PolarHBondContact O-OG 2.73Å; S407-S409 VanDerWaalsContact C-N 3.31Å; S407-S409 PolarHBondContact O-N 3.49Å
410	T	83.6	Confident	86.3	Confident	25 Å²	25	59.1 Å²	59.1	15%	0.153	32%	0.318	C	S	.	.	H	α-helix	trans	-104.4	-30.1	-170	-62.1	0	0	0	0	113.1	F406 S407 G457 I460 F469	F406-T410 WeakPolarHBondContact O-CB 3.47Å; F406-T410 PolarHBondContact O-N 2.89Å; F406-T410 PolarHBondContact O-OG1 3.39Å; S407-T410 PolarHBondContact O-N 2.89Å; T410-G457 VanDerWaalsContact O-CA 3.32Å; T410-G457 WeakPolarHBondContact O-CA 3.44Å; T410-I460 HydrophobicContact CG2-CG1 3.91Å; T410-F469 HydrophobicContact CG2-CE1 4.36Å; T410-F469 HydrophobicContact CG2-CE2 4.43Å; T410-F469 HydrophobicContact CG2-CZ 4.24Å
411	V	86.8	Confident	86.2	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.018	31%	0.314	C	S	.	.			trans	-124.7	127.8	178.3	175.7	0	0	0	0	110.5	I401 S407 A455 I460 V466 F469 I470	I401-V411 WeakPolarHBondContact CD1-O 3.2Å; S407-V411 PolarHBondContact O-N 2.64Å; V411-A455 HydrophobicContact CG1-CB 4.02Å; V411-I460 HydrophobicContact CG2-CD1 3.79Å; V411-V466 HydrophobicContact CG1-CG1 4.39Å; V411-F469 HydrophobicContact CB-CB 4.2Å; V411-F469 HydrophobicContact CG2-CB 3.6Å; V411-F469 HydrophobicContact CG2-CD2 3.9Å; V411-F469 HydrophobicContact CG2-CG 3.89Å; V411-I470 HydrophobicContact CG1-CG2 4.11Å
412	G	86.8	Confident	86.2	Confident	38 Å²	38	61.4 Å²	61.4	39%	0.392	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	162.4	171.2	0	0	0	0	0	112	A455 H456	G412-A455 WeakPolarHBondContact O-CA 3.39Å; G412-H456 PolarHBondContact N-O 3.25Å; G412-H456 PolarHBondContact O-N 2.88Å
413	L	89.9	Confident	86.1	Confident	42 Å²	42	59.8 Å²	59.8	22%	0.22	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	140.3	163.2	-56.5	-165.6	0	0	0	109.2	I374 V397 I401 L430 V438 A455	I374-L413 HydrophobicContact CD1-CD1 4.18Å; I374-L413 HydrophobicContact CD1-CD2 3.55Å; I374-L413 HydrophobicContact CD1-CG 4.4Å; V397-L413 HydrophobicContact CG2-CD1 4.35Å; I401-L413 HydrophobicContact CD1-CD2 3.91Å; I401-L413 HydrophobicContact CD1-CG 3.94Å; I401-L413 HydrophobicContact CG1-CD2 4.03Å; L413-L430 HydrophobicContact CB-CD1 3.85Å; L413-L430 WeakPolarHBondContact O-CD1 3.44Å; L413-V438 HydrophobicContact CD1-CG2 3.99Å; L413-A455 HydrophobicContact CD2-CB 4.05Å
414	Q	89.9	Confident	86.5	Confident	45 Å²	45	58.5 Å²	58.5	21%	0.21	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	128.5	-175.3	-170.6	170.8	15.4	0	0	110	L416 S427 I453 V454 H456	Q414-L416 HydrophobicContact CG-CD2 4.06Å; Q414-S427 VanDerWaalsContact NE2-CB 3.29Å; Q414-S427 PolarHBondContact NE2-OG 3.02Å; Q414-I453 WeakPolarHBondContact O-CA 3.33Å; Q414-V454 HydrophobicContact CB-CG2 4.01Å; Q414-V454 PolarHBondContact N-O 3.36Å; Q414-V454 PolarHBondContact O-N 2.87Å; Q414-H456 PolarHBondContact OE1-ND1 3.01Å
415	C	91.9	Very high	86.7	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	133.2	166.4	-177.2	0	0	0	0	108.7	V428 L430 A440 V451	C415-V428 HydrophobicContact CB-CB 4.04Å; C415-V428 PolarHBondContact O-N 3.45Å; C415-L430 HydrophobicContact CB-CD2 3.56Å; C415-L430 HydrophobicContact CB-CG 4.5Å; C415-A440 HydrophobicContact CB-CB 3.87Å; C415-V451 WeakPolarHBondContact SG-CG1 3.36Å
416	L	92.4	Very high	87.3	Confident	21 Å²	21	53.1 Å²	53.1	11%	0.11	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	134.3	176.1	-65.7	-178.5	0	0	0	109.4	L366 Q414 Y425 V426 V451 A452 V454	L366-L416 HydrophobicContact CD2-CD1 3.86Å; Q414-L416 HydrophobicContact CG-CD2 4.06Å; L416-Y425 HydrophobicContact CB-CD1 3.95Å; L416-Y425 HydrophobicContact CB-CG 4.48Å; L416-V426 CarbonylContact C-O 3.55Å; L416-V426 WeakPolarHBondContact CA-O 3.44Å; L416-V451 WeakPolarHBondContact O-CA 3.41Å; L416-A452 PolarHBondContact N-O 2.9Å; L416-A452 PolarHBondContact O-N 2.9Å; L416-V454 HydrophobicContact CD1-CB 4.43Å; L416-V454 HydrophobicContact CD1-CG1 3.79Å; L416-V454 HydrophobicContact CD1-CG2 3.7Å; L416-V454 HydrophobicContact CG-CG2 4.02Å
417	R	92.6	Very high	87.7	Confident	25 Å²	25	49.9 Å²	49.9	9%	0.094	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139.4	177.7	166.6	171.4	158.6	19.3	9.7	109.9	D419 V426 V428 N444 Y450	R417-D419 IonicContact CZ-OD1 3.41Å; R417-D419 IonicContact NH1-OD1 3.17Å; R417-D419 PolarHBondContact NH1-OD1 3.16Å; R417-D419 IonicContact NH1-OD2 2.68Å; R417-D419 IonicContact NH2-OD1 2.75Å; R417-D419 PolarHBondContact NH2-OD1 3Å; R417-D419 IonicContact NH2-OD2 3.49Å; R417-V426 PolarHBondContact N-O 3.48Å; R417-V426 PolarHBondContact O-N 2.8Å; R417-V428 HydrophobicContact CB-CG2 3.54Å; R417-N444 VanDerWaalsContact CZ-O 3.3Å; R417-N444 PolarHBondContact NE-O 3.01Å; R417-N444 PolarHBondContact NH2-O 2.88Å; R417-Y450 CarbonylContact C-O 3.55Å; R417-Y450 WeakPolarHBondContact CA-O 3.42Å
418	S	92.4	Very high	88	Confident	4 Å²	4	50.4 Å²	50.4	3%	0.028	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	164	166.7	-167.3	0	0	0	0	110.5	S420 P424 M449 Y450	S418-S420 WeakPolarHBondContact CB-O 3.4Å; S418-S420 PolarHBondContact OG-N 2.83Å; S418-S420 PolarHBondContact OG-O 2.89Å; S418-S420 VanDerWaalsContact OG-O 3.13Å; S418-P424 WeakPolarHBondContact CB-O 3.42Å; S418-P424 PolarHBondContact OG-O 2.84Å; S418-M449 CarbonylContact O-C 3.52Å; S418-M449 WeakPolarHBondContact O-CA 3.24Å; S418-Y450 PolarHBondContact N-O 2.87Å; S418-Y450 PolarHBondContact O-N 2.84Å
419	D	89.7	Confident	87.9	Confident	90 Å²	90	49 Å²	49	48%	0.481	29%	0.293	S	S	.	.	S	Bend	trans	-95.2	-12.2	169.9	-56.7	-64.3	0	0	0	111.8	R417 E446	R417-D419 IonicContact CZ-OD1 3.41Å; R417-D419 IonicContact NH1-OD1 3.17Å; R417-D419 PolarHBondContact NH1-OD1 3.16Å; R417-D419 IonicContact NH1-OD2 2.68Å; R417-D419 IonicContact NH2-OD1 2.75Å; R417-D419 PolarHBondContact NH2-OD1 3Å; R417-D419 IonicContact NH2-OD2 3.49Å; D419-E446 WeakPolarHBondContact OD1-CB 3.44Å; D419-E446 WeakPolarHBondContact OD1-CG 3.5Å
420	S	88	Confident	88	Confident	57 Å²	57	47 Å²	47	40%	0.399	28%	0.275	S	S	.	.	S	Bend	trans	-118.9	142.2	178.7	154.3	0	0	0	0	109.9	S418 E422 G423	S418-S420 WeakPolarHBondContact CB-O 3.4Å; S418-S420 PolarHBondContact OG-N 2.83Å; S418-S420 PolarHBondContact OG-O 2.89Å; S418-S420 VanDerWaalsContact OG-O 3.13Å; S420-E422 VanDerWaalsContact C-N 3.28Å; S420-E422 PolarHBondContact O-N 2.81Å; S420-G423 WeakPolarHBondContact CB-O 3.31Å; S420-G423 PolarHBondContact O-N 2.81Å; S420-G423 PolarHBondContact OG-O 3.15Å
421	K	85.7	Confident	87.2	Confident	71 Å²	71	49.7 Å²	49.7	31%	0.309	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-43.8	-177.4	178.5	-175.4	165.8	-69.5	0	111.7	L359 P363 Y425 Y450	L359-K421 HydrophobicContact CD1-CD 4.11Å; L359-K421 HydrophobicContact CD1-CG 4.13Å; P363-K421 WeakPolarHBondContact CG-O 3.34Å; K421-Y425 PolarHBondContact O-OH 2.82Å; K421-Y450 HydrophobicContact CB-CD1 4.18Å; K421-Y450 HydrophobicContact CB-CD2 4.41Å; K421-Y450 HydrophobicContact CB-CE1 3.92Å; K421-Y450 HydrophobicContact CB-CE2 4.15Å; K421-Y450 HydrophobicContact CB-CG 4.42Å; K421-Y450 HydrophobicContact CG-CD1 4.39Å; K421-Y450 HydrophobicContact CG-CE1 4.29Å; K421-Y450 VanDerWaalsContact N-CD2 3.32Å; K421-Y450 VanDerWaalsContact N-CE2 3.34Å
422	E	86	Confident	86	Confident	100 Å²	100	52.1 Å²	52.1	47%	0.467	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-0.5	-172.1	-43.7	-55	170.9	0	0	113.5	E365 S420	E365-E422 VanDerWaalsContact CD-O 3.26Å; S420-E422 VanDerWaalsContact C-N 3.28Å; S420-E422 PolarHBondContact O-N 2.81Å
423	G	84.9	Confident	84.8	Confident	11 Å²	11	54.3 Å²	54.3	11%	0.113	32%	0.315	C	S	.	.			trans	113.2	179.5	-175.5	0	0	0	0	0	113.6	S420	S420-G423 WeakPolarHBondContact CB-O 3.31Å; S420-G423 PolarHBondContact O-N 2.81Å; S420-G423 PolarHBondContact OG-O 3.15Å
424	P	88.5	Confident	83.1	Confident	103 Å²	103	57.1 Å²	57.1	67%	0.669	34%	0.337	S	S	*	.			cis	-76.7	146	5.1	31.3	-35.8	0	0	0	112.8	S418	S418-P424 WeakPolarHBondContact CB-O 3.42Å; S418-P424 PolarHBondContact OG-O 2.84Å
425	Y	89.9	Confident	82.1	Confident	36 Å²	36	58.3 Å²	58.3	14%	0.141	36%	0.361	C	S	.	.			trans	-98	135.3	-179.6	-80	-89.3	0	0	0	112.7	P363 L366 L416 K421	P363-Y425 HydrophobicContact CG-CE2 4.2Å; L366-Y425 HydrophobicContact CD2-CD1 4Å; L366-Y425 HydrophobicContact CD2-CD2 3.73Å; L366-Y425 HydrophobicContact CD2-CE1 4.22Å; L366-Y425 HydrophobicContact CD2-CE2 3.98Å; L366-Y425 HydrophobicContact CD2-CG 3.75Å; L366-Y425 HydrophobicContact CG-CE2 4.44Å; L416-Y425 HydrophobicContact CB-CD1 3.95Å; L416-Y425 HydrophobicContact CB-CG 4.48Å; K421-Y425 PolarHBondContact O-OH 2.82Å
426	V	90.4	Very high	81.4	Confident	98 Å²	98	60 Å²	60	59%	0.594	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	144	-176.8	-176.3	0	0	0	0	110.5	L416 R417	L416-V426 CarbonylContact C-O 3.55Å; L416-V426 WeakPolarHBondContact CA-O 3.44Å; R417-V426 PolarHBondContact N-O 3.48Å; R417-V426 PolarHBondContact O-N 2.8Å
427	S	88.8	Confident	81.1	Confident	67 Å²	67	61.1 Å²	61.1	47%	0.469	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	136.1	179.2	-167.9	0	0	0	0	113.1	Q414	Q414-S427 VanDerWaalsContact NE2-CB 3.29Å; Q414-S427 PolarHBondContact NE2-OG 3.02Å
428	V	87.6	Confident	80.9	Confident	17 Å²	17	60 Å²	60	10%	0.103	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	135.8	167.8	-178.9	0	0	0	0	108.3	C415 R417 Q441 L442	C415-V428 HydrophobicContact CB-CB 4.04Å; C415-V428 PolarHBondContact O-N 3.45Å; R417-V428 HydrophobicContact CB-CG2 3.54Å; V428-Q441 VanDerWaalsContact CG1-O 3.29Å; V428-Q441 WeakPolarHBondContact CG1-O 3.39Å; V428-L442 HydrophobicContact CG1-CD2 4.22Å; V428-L442 HydrophobicContact CG2-CD2 4.46Å
429	P	80.1	Confident	80.8	Confident	83 Å²	83	62.4 Å²	62.4	54%	0.539	38%	0.384	S	S	.	.			trans	-62.5	148.9	175.8	26.7	-34.9	0	0	0	112.1
430	L	82.1	Confident	80.9	Confident	52 Å²	52	58.2 Å²	58.2	27%	0.272	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	134.2	171.2	-65.2	-177.6	0	0	0	109.5	L413 C415 V438 A440	L413-L430 HydrophobicContact CB-CD1 3.85Å; L413-L430 WeakPolarHBondContact O-CD1 3.44Å; C415-L430 HydrophobicContact CB-CD2 3.56Å; C415-L430 HydrophobicContact CB-CG 4.5Å; L430-V438 HydrophobicContact CD1-CG1 3.75Å; L430-V438 HydrophobicContact CD2-CG1 3.51Å; L430-V438 HydrophobicContact CG-CG1 4.15Å; L430-A440 HydrophobicContact CD2-CB 3.82Å
431	N	67.2	Low	81	Confident	80 Å²	80	57.9 Å²	57.9	43%	0.428	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-41.4	-178.3	-73.9	35.3	0	0	0	111.4	Q439 Q441	N431-Q439 PolarHBondContact N-O 2.95Å; N431-Q441 PolarHBondContact ND2-OE1 3.09Å; N431-Q441 WeakPolarHBondContact OD1-CB 3.26Å
432	C	62.1	Low	81.2	Confident	55 Å²	55	54.5 Å²	54.5	37%	0.372	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	154.6	174.8	64.5	0	0	0	0	111.7	Q439	C432-Q439 PolarHBondContact O-N 2.84Å
433	S	61.8	Low	81	Confident	84 Å²	84	54.7 Å²	54.7	59%	0.587	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124	105.8	166.1	49.1	0	0	0	0	108.1	T437	S433-T437 CarbonylContact C-O 3.59Å; S433-T437 WeakPolarHBondContact CA-O 3.38Å
434	C	53.5	Low	80.8	Confident	101 Å²	101	60.3 Å²	60.3	68%	0.682	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	87.4	-178.4	-171	0	0	0	0	108.8	D436 T437	C434-D436 PolarHBondContact O-N 3.34Å; C434-T437 PolarHBondContact N-O 2.69Å; C434-T437 PolarHBondContact O-N 3.33Å
435	G	69.6	Low	80.8	Confident	70 Å²	70	56.3 Å²	56.3	72%	0.722	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	-130	-171.1	0	0	0	0	0	111.3	T437	G435-T437 PolarHBondContact O-N 2.72Å
436	D	76.1	Confident	80.7	Confident	35 Å²	35	58.7 Å²	58.7	19%	0.187	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-9.5	177.2	-84.8	-12.1	0	0	0	114.1	K396 V397 C434 K473	K396-D436 CarbonylContact C-O 3.59Å; K396-D436 WeakPolarHBondContact CA-O 3.46Å; K396-D436 HydrophobicContact CD-CB 4.2Å; K396-D436 WeakPolarHBondContact CE-OD2 3.32Å; K396-D436 HydrophobicContact CG-CB 3.78Å; K396-D436 WeakPolarHBondContact CG-O 3.41Å; K396-D436 IonicContact NZ-OD2 2.72Å; K396-D436 PolarHBondContact NZ-OD2 3.06Å; V397-D436 WeakPolarHBondContact CG2-O 3.29Å; V397-D436 PolarHBondContact N-O 3.49Å; C434-D436 PolarHBondContact O-N 3.34Å; D436-K473 IonicContact OD1-NZ 3.31Å; D436-K473 PolarHBondContact OD1-NZ 2.87Å; D436-K473 IonicContact OD2-NZ 2.71Å; D436-K473 PolarHBondContact OD2-NZ 3.37Å
437	T	86	Confident	80.6	Confident	44 Å²	44	57.2 Å²	57.2	27%	0.27	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	131.7	-175.6	-57.3	0	0	0	0	111.4	E394 S433 C434 G435	E394-T437 HydrophobicContact CG-CG2 3.67Å; S433-T437 CarbonylContact C-O 3.59Å; S433-T437 WeakPolarHBondContact CA-O 3.38Å; C434-T437 PolarHBondContact N-O 2.69Å; C434-T437 PolarHBondContact O-N 3.33Å; G435-T437 PolarHBondContact O-N 2.72Å
438	V	88.7	Confident	80.7	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.006	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	137.1	-179.2	-179.6	0	0	0	0	109.9	M395 V397 L413 L430 I453	M395-V438 PolarHBondContact N-O 2.87Å; M395-V438 PolarHBondContact O-N 3.04Å; V397-V438 HydrophobicContact CG1-CB 4.23Å; V397-V438 HydrophobicContact CG1-CG2 3.74Å; V397-V438 HydrophobicContact CG2-CG2 4.07Å; L413-V438 HydrophobicContact CD1-CG2 3.99Å; L430-V438 HydrophobicContact CD1-CG1 3.75Å; L430-V438 HydrophobicContact CD2-CG1 3.51Å; L430-V438 HydrophobicContact CG-CG1 4.15Å; V438-I453 HydrophobicContact CB-CD1 3.79Å; V438-I453 HydrophobicContact CG1-CD1 3.69Å
439	Q	90.8	Very high	81	Confident	56 Å²	56	54.7 Å²	54.7	26%	0.262	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.2	175.8	-61.4	-176	-3.4	0	0	111.2	I392 L393 E394 N431 C432	I392-Q439 HydrophobicContact CG2-CB 4.3Å; L393-Q439 CarbonylContact O-C 3.56Å; L393-Q439 WeakPolarHBondContact O-CA 3.4Å; E394-Q439 HydrophobicContact CB-CG 4.08Å; E394-Q439 HydrophobicContact CG-CG 4Å; E394-Q439 PolarHBondContact OE1-NE2 3.22Å; N431-Q439 PolarHBondContact N-O 2.95Å; C432-Q439 PolarHBondContact O-N 2.84Å
440	A	90.6	Very high	81.6	Confident	1 Å²	1	52 Å²	52	1%	0.008	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	137.8	-179.6	0	0	0	0	0	111	L393 C415 L430	L393-A440 PolarHBondContact N-O 3.36Å; L393-A440 PolarHBondContact O-N 2.73Å; C415-A440 HydrophobicContact CB-CB 3.87Å; L430-A440 HydrophobicContact CD2-CB 3.82Å
441	Q	90	Very high	82.2	Confident	50 Å²	50	49.6 Å²	49.6	23%	0.234	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	118.9	-177.3	-167.9	172.7	-7.6	0	0	110.9	S390 V428 N431 H443	S390-Q441 WeakPolarHBondContact OG-CG 3.47Å; S390-Q441 PolarHBondContact OG-NE2 2.77Å; V428-Q441 VanDerWaalsContact CG1-O 3.29Å; V428-Q441 WeakPolarHBondContact CG1-O 3.39Å; N431-Q441 PolarHBondContact ND2-OE1 3.09Å; N431-Q441 WeakPolarHBondContact OD1-CB 3.26Å; Q441-H443 WeakPolarHBondContact CG-NE2 3.49Å; Q441-H443 PolarHBondContact NE2-CE1 2.94Å; Q441-H443 PolarHBondContact O-CD2 3.31Å
442	L	90	Very high	83.4	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	105.1	-175.6	-60	176.7	0	0	0	109.6	S390 I391 L393 V428 L445 V451	S390-L442 WeakPolarHBondContact CA-O 3.22Å; S390-L442 WeakPolarHBondContact CB-O 3.08Å; I391-L442 HydrophobicContact CD1-CD1 4.18Å; I391-L442 HydrophobicContact CG1-CB 3.9Å; I391-L442 HydrophobicContact CG1-CD1 4.08Å; I391-L442 HydrophobicContact CG1-CG 4.47Å; I391-L442 PolarHBondContact N-O 3.28Å; I391-L442 PolarHBondContact O-N 3.24Å; L393-L442 HydrophobicContact CB-CD1 4.15Å; L393-L442 HydrophobicContact CD2-CD1 4.47Å; V428-L442 HydrophobicContact CG1-CD2 4.22Å; V428-L442 HydrophobicContact CG2-CD2 4.46Å; L442-L445 HydrophobicContact CB-CD2 3.71Å; L442-L445 WeakPolarHBondContact O-CD2 3.2Å; L442-V451 HydrophobicContact CD1-CG2 4.31Å; L442-V451 HydrophobicContact CD2-CG1 4.43Å; L442-V451 HydrophobicContact CD2-CG2 4.39Å
443	H	82.3	Confident	84.8	Confident	104 Å²	104	43.2 Å²	43.2	48%	0.481	26%	0.257	S	S	.	.			trans	-92.3	-51.4	-176.5	-64.4	-91.6	0	0	0	113.5	Q441 L445	Q441-H443 WeakPolarHBondContact CG-NE2 3.49Å; Q441-H443 PolarHBondContact NE2-CE1 2.94Å; Q441-H443 PolarHBondContact O-CD2 3.31Å; H443-L445 PolarHBondContact O-N 3Å
444	N	81.8	Confident	86.3	Confident	128 Å²	128	39.2 Å²	39.2	68%	0.684	23%	0.229	S	C	*	.	S	Bend	trans	-87.1	90.2	-178.7	-62.9	6.1	0	0	0	108.8	R417	R417-N444 VanDerWaalsContact CZ-O 3.3Å; R417-N444 PolarHBondContact NE-O 3.01Å; R417-N444 PolarHBondContact NH2-O 2.88Å
445	L	87.4	Confident	88.1	Confident	19 Å²	19	34.4 Å²	34.4	10%	0.099	20%	0.196	C	C	.	.			trans	-93.2	129.7	-171.6	-62.8	174.9	0	0	0	111.5	L382 V387 I391 L442 H443 M449	L382-L445 HydrophobicContact CD1-CB 3.9Å; L382-L445 HydrophobicContact CD1-CD1 4.46Å; L382-L445 HydrophobicContact CD1-CD2 4.06Å; L382-L445 HydrophobicContact CD1-CG 4.36Å; V387-L445 HydrophobicContact CG2-CD1 3.89Å; I391-L445 HydrophobicContact CD1-CD2 3.84Å; I391-L445 HydrophobicContact CG1-CD1 4.46Å; I391-L445 HydrophobicContact CG1-CD2 3.84Å; I391-L445 HydrophobicContact CG2-CD1 4.27Å; L442-L445 HydrophobicContact CB-CD2 3.71Å; L442-L445 WeakPolarHBondContact O-CD2 3.2Å; H443-L445 PolarHBondContact O-N 3Å; L445-M449 HydrophobicContact CD2-CE 3.72Å; L445-M449 HydrophobicContact CD2-SD 3.99Å
446	E	87.6	Confident	89.1	Confident	87 Å²	87	33.8 Å²	33.8	41%	0.407	17%	0.174	S	C	.	.			trans	-125.6	161.6	-175.7	-74.2	-70.5	168.7	0	0	110.8	D419 C448 M449	D419-E446 WeakPolarHBondContact OD1-CB 3.44Å; D419-E446 WeakPolarHBondContact OD1-CG 3.5Å; E446-C448 PolarHBondContact O-N 2.8Å; E446-C448 VanDerWaalsContact O-N 3.09Å; E446-M449 HydrophobicContact CB-CG 4.02Å
447	P	88	Confident	89.7	Confident	67 Å²	67	32.1 Å²	32.1	44%	0.435	17%	0.166	S	C	.	.	S	Bend	trans	-56.3	-28.6	-178.1	-27.1	34.3	0	0	0	114.6	K381 L382 L385	K381-P447 WeakPolarHBondContact CA-O 3.47Å; K381-P447 WeakPolarHBondContact CB-O 3.4Å; L382-P447 PolarHBondContact N-O 3.29Å; L385-P447 HydrophobicContact CD1-CG 3.95Å; L385-P447 HydrophobicContact CD2-CG 4.37Å
448	C	91.7	Very high	89.6	Confident	31 Å²	31	33.4 Å²	33.4	21%	0.209	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	126.4	177.5	-175.3	0	0	0	0	109.2	V380 K381 E446 Y450	V380-C448 CarbonylContact O-C 3.58Å; V380-C448 WeakPolarHBondContact O-CA 3.41Å; K381-C448 WeakPolarHBondContact CE-SG 3.44Å; K381-C448 HydrophobicContact CG-CB 3.92Å; E446-C448 PolarHBondContact O-N 2.8Å; E446-C448 VanDerWaalsContact O-N 3.09Å; C448-Y450 PolarHBondContact SG-OH 3.33Å
449	M	93.4	Very high	89.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	144.9	-178.7	-55.1	-178.5	-71.6	0	0	109.7	E379 V380 L382 I391 S418 L445 E446 V451	E379-M449 CarbonylContact C-O 3.54Å; E379-M449 WeakPolarHBondContact CA-O 3.33Å; V380-M449 HydrophobicContact CB-CE 4.22Å; V380-M449 HydrophobicContact CG1-CE 3.95Å; V380-M449 PolarHBondContact N-O 3.12Å; V380-M449 PolarHBondContact O-N 2.73Å; L382-M449 HydrophobicContact CD1-CE 3.61Å; L382-M449 HydrophobicContact CG-CE 4.2Å; I391-M449 HydrophobicContact CD1-CE 4.47Å; S418-M449 CarbonylContact O-C 3.52Å; S418-M449 WeakPolarHBondContact O-CA 3.24Å; L445-M449 HydrophobicContact CD2-CE 3.72Å; L445-M449 HydrophobicContact CD2-SD 3.99Å; E446-M449 HydrophobicContact CB-CG 4.02Å; M449-V451 HydrophobicContact CB-CG2 4.41Å
450	Y	93.5	Very high	89.2	Confident	27 Å²	27	35.5 Å²	35.5	11%	0.106	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	119.2	173.2	-62.1	-84.2	0	0	0	108.4	L359 L378 E379 R417 S418 K421 C448	L359-Y450 HydrophobicContact CD1-CD1 4.01Å; L359-Y450 HydrophobicContact CD1-CE1 3.99Å; L378-Y450 WeakPolarHBondContact O-CA 3.32Å; E379-Y450 HydrophobicContact CB-CD1 4.01Å; E379-Y450 HydrophobicContact CB-CE1 3.7Å; E379-Y450 HydrophobicContact CG-CD1 4.32Å; E379-Y450 HydrophobicContact CG-CE1 3.65Å; E379-Y450 PolarHBondContact OE2-OH 3.23Å; R417-Y450 CarbonylContact C-O 3.55Å; R417-Y450 WeakPolarHBondContact CA-O 3.42Å; S418-Y450 PolarHBondContact N-O 2.87Å; S418-Y450 PolarHBondContact O-N 2.84Å; K421-Y450 HydrophobicContact CB-CD1 4.18Å; K421-Y450 HydrophobicContact CB-CD2 4.41Å; K421-Y450 HydrophobicContact CB-CE1 3.92Å; K421-Y450 HydrophobicContact CB-CE2 4.15Å; K421-Y450 HydrophobicContact CB-CG 4.42Å; K421-Y450 HydrophobicContact CG-CD1 4.39Å; K421-Y450 HydrophobicContact CG-CE1 4.29Å; K421-Y450 VanDerWaalsContact N-CD2 3.32Å; K421-Y450 VanDerWaalsContact N-CE2 3.34Å; C448-Y450 PolarHBondContact SG-OH 3.33Å
451	V	93.7	Very high	88.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	132.3	-173.2	-169.2	0	0	0	0	110.6	L378 L393 C415 L416 L442 M449	L378-V451 PolarHBondContact N-O 3.1Å; L378-V451 PolarHBondContact O-N 2.97Å; L393-V451 HydrophobicContact CD2-CB 3.96Å; L393-V451 HydrophobicContact CD2-CG1 3.52Å; C415-V451 WeakPolarHBondContact SG-CG1 3.36Å; L416-V451 WeakPolarHBondContact O-CA 3.41Å; L442-V451 HydrophobicContact CD1-CG2 4.31Å; L442-V451 HydrophobicContact CD2-CG1 4.43Å; L442-V451 HydrophobicContact CD2-CG2 4.39Å; M449-V451 HydrophobicContact CB-CG2 4.41Å
452	A	92.9	Very high	88.2	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	153.5	179.6	0	0	0	0	0	110.8	L366 V377 L416	L366-A452 HydrophobicContact CD1-CB 3.85Å; V377-A452 HydrophobicContact CG1-CB 4.47Å; V377-A452 HydrophobicContact CG2-CB 4.03Å; L416-A452 PolarHBondContact N-O 2.9Å; L416-A452 PolarHBondContact O-N 2.9Å
453	I	91.8	Very high	87.8	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	131.8	170.3	-56.8	-177.2	0	0	0	109	I374 S375 M395 V397 Q414 V438	I374-I453 HydrophobicContact CD1-CG2 3.96Å; I374-I453 HydrophobicContact CG1-CB 4.28Å; I374-I453 HydrophobicContact CG1-CG2 3.89Å; I374-I453 WeakPolarHBondContact CG1-O 3.38Å; I374-I453 PolarHBondContact N-O 3.49Å; S375-I453 PolarHBondContact N-O 2.96Å; S375-I453 PolarHBondContact OG-N 2.95Å; M395-I453 HydrophobicContact CE-CD1 4.07Å; M395-I453 HydrophobicContact CE-CG1 4.05Å; M395-I453 HydrophobicContact CG-CD1 3.51Å; M395-I453 HydrophobicContact CG-CG1 4.33Å; M395-I453 HydrophobicContact SD-CB 4.34Å; M395-I453 HydrophobicContact SD-CD1 3.53Å; M395-I453 VanDerWaalsContact SD-CD1 3.53Å; M395-I453 HydrophobicContact SD-CG1 3.66Å; V397-I453 HydrophobicContact CG1-CB 4.21Å; V397-I453 HydrophobicContact CG1-CD1 4.04Å; V397-I453 HydrophobicContact CG1-CG2 3.92Å; Q414-I453 WeakPolarHBondContact O-CA 3.33Å; V438-I453 HydrophobicContact CB-CD1 3.79Å; V438-I453 HydrophobicContact CG1-CD1 3.69Å
454	V	92.6	Very high	87.9	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	153.8	174.5	-58.6	0	0	0	0	110.5	L366 C372 Q414 L416 H456	L366-V454 HydrophobicContact CB-CG1 4.39Å; C372-V454 CarbonylContact O-C 3.55Å; C372-V454 WeakPolarHBondContact O-CA 3.24Å; C372-V454 WeakPolarHBondContact O-CB 3.48Å; Q414-V454 HydrophobicContact CB-CG2 4.01Å; Q414-V454 PolarHBondContact N-O 3.36Å; Q414-V454 PolarHBondContact O-N 2.87Å; L416-V454 HydrophobicContact CD1-CB 4.43Å; L416-V454 HydrophobicContact CD1-CG1 3.79Å; L416-V454 HydrophobicContact CD1-CG2 3.7Å; L416-V454 HydrophobicContact CG-CG2 4.02Å; V454-H456 HydrophobicContact CG2-CB 4.05Å
455	A	91.3	Very high	88.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	122.6	155.1	0	0	0	0	0	107.6	S371 C372 I374 V411 G412 L413 V466 I470	S371-A455 CarbonylContact C-O 3.54Å; S371-A455 WeakPolarHBondContact CA-O 3.46Å; C372-A455 PolarHBondContact N-O 3.21Å; C372-A455 PolarHBondContact O-N 2.93Å; I374-A455 HydrophobicContact CD1-CB 4.49Å; I374-A455 HydrophobicContact CG2-CB 4.16Å; V411-A455 HydrophobicContact CG1-CB 4.02Å; G412-A455 WeakPolarHBondContact O-CA 3.39Å; L413-A455 HydrophobicContact CD2-CB 4.05Å; A455-V466 HydrophobicContact CB-CG1 3.84Å; A455-I470 HydrophobicContact CB-CD1 4.26Å; A455-I470 HydrophobicContact CB-CG2 4.08Å
456	H	91.3	Very high	88.3	Confident	57 Å²	57	44.9 Å²	44.9	26%	0.264	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	133.3	-174.1	174.1	-124.6	0	0	0	111.1	R370 G412 Q414 V454	R370-H456 WeakPolarHBondContact O-CA 3.49Å; R370-H456 PolarHBondContact O-CD2 3.41Å; G412-H456 PolarHBondContact N-O 3.25Å; G412-H456 PolarHBondContact O-N 2.88Å; Q414-H456 PolarHBondContact OE1-ND1 3.01Å; V454-H456 HydrophobicContact CG2-CB 4.05Å
457	G	89.3	Confident	88.4	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.228	C	C	.	.			trans	-133.7	87.2	-179.9	0	0	0	0	0	110.9	R370 T410 S459 I460	R370-G457 PolarHBondContact O-N 2.91Å; T410-G457 VanDerWaalsContact O-CA 3.32Å; T410-G457 WeakPolarHBondContact O-CA 3.44Å; G457-S459 PolarHBondContact O-N 3.28Å; G457-I460 WeakPolarHBondContact O-CB 3.36Å; G457-I460 WeakPolarHBondContact O-CG1 3.46Å; G457-I460 PolarHBondContact O-N 2.89Å
458	P	83.8	Confident	88.4	Confident	72 Å²	72	41.1 Å²	41.1	47%	0.468	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-29.3	-173.4	25.1	-33.7	0	0	0	112.8	R370 I460	R370-P458 WeakPolarHBondContact CD-O 3.49Å; R370-P458 PolarHBondContact NE-O 2.97Å; P458-I460 VanDerWaalsContact C-N 3.3Å; P458-I460 PolarHBondContact O-N 3.1Å
459	S	84.5	Confident	88.3	Confident	94 Å²	94	40.5 Å²	40.5	66%	0.657	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.6	1.4	-178.5	-50.3	0	0	0	0	114.3	G457	G457-S459 PolarHBondContact O-N 3.28Å
460	I	86.7	Confident	88.1	Confident	6 Å²	6	40.6 Å²	40.6	3%	0.031	22%	0.219	C	C	.	.			trans	-71.8	133.4	-179.2	-63.4	173.4	0	0	0	110.2	R370 T410 V411 G457 P458 S464 V466 F469	R370-I460 HydrophobicContact CG-CB 4.34Å; R370-I460 PolarHBondContact NE-O 3.32Å; R370-I460 PolarHBondContact NH2-O 3.45Å; T410-I460 HydrophobicContact CG2-CG1 3.91Å; V411-I460 HydrophobicContact CG2-CD1 3.79Å; G457-I460 WeakPolarHBondContact O-CB 3.36Å; G457-I460 WeakPolarHBondContact O-CG1 3.46Å; G457-I460 PolarHBondContact O-N 2.89Å; P458-I460 VanDerWaalsContact C-N 3.3Å; P458-I460 PolarHBondContact O-N 3.1Å; I460-S464 WeakPolarHBondContact CG2-O 3.37Å; I460-V466 HydrophobicContact CD1-CB 4.34Å; I460-V466 HydrophobicContact CD1-CG2 3.64Å; I460-F469 HydrophobicContact CD1-CD2 3.65Å; I460-F469 HydrophobicContact CD1-CE2 3.67Å; I460-F469 HydrophobicContact CG1-CD2 4.25Å; I460-F469 HydrophobicContact CG1-CE2 3.81Å; I460-F469 HydrophobicContact CG2-CE2 4.38Å
461	L	83.9	Confident	87.9	Confident	124 Å²	124	43 Å²	43	65%	0.649	23%	0.231	S	C	*	.			trans	-114.2	142.9	177.6	-60.9	178.1	0	0	0	110.1	S464	L461-S464 WeakPolarHBondContact O-CB 3.46Å; L461-S464 PolarHBondContact O-N 2.89Å
462	Y	74.9	Confident	87.7	Confident	206 Å²	206	43.2 Å²	43.2	81%	0.808	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	138.8	172.3	-178.3	-88.1	0	0	0	110.3
463	P	80.6	Confident	87.7	Confident	103 Å²	103	44.1 Å²	44.1	67%	0.669	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	cis	-87.1	0.3	11.3	35.3	-37.4	0	0	0	116
464	S	84.9	Confident	87.7	Confident	51 Å²	51	44.3 Å²	44.3	36%	0.357	24%	0.237	S	C	.	.			trans	-73.6	156.8	179.9	-59.1	0	0	0	0	112.8	I460 L461	I460-S464 WeakPolarHBondContact CG2-O 3.37Å; L461-S464 WeakPolarHBondContact O-CB 3.46Å; L461-S464 PolarHBondContact O-N 2.89Å
465	T	88.8	Confident	87.7	Confident	17 Å²	17	44.3 Å²	44.3	10%	0.104	24%	0.237	C	C	.	.			trans	-137.7	165.3	-177.4	69.4	0	0	0	0	111.1	D369 W467 D468 F469	D369-T465 HydrophobicContact CB-CG2 4.34Å; D369-T465 CarbonylContact O-C 3.57Å; D369-T465 WeakPolarHBondContact O-CA 3.36Å; D369-T465 VanDerWaalsContact OD1-CG2 3.31Å; D369-T465 WeakPolarHBondContact OD1-CG2 3.14Å; T465-W467 PolarHBondContact O-N 3.3Å; T465-W467 VanDerWaalsContact O-N 3.12Å; T465-W467 PolarHBondContact OG1-N 3.43Å; T465-D468 PolarHBondContact N-OD2 2.99Å; T465-D468 WeakPolarHBondContact O-CB 3.48Å; T465-D468 PolarHBondContact O-N 3.45Å; T465-D468 PolarHBondContact OG1-OD2 3.45Å; T465-F469 VanDerWaalsContact O-CD2 3.27Å; T465-F469 WeakPolarHBondContact O-CD2 3.32Å; T465-F469 WeakPolarHBondContact O-CE2 3.28Å
466	V	89.6	Confident	87.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-52.6	-34.1	173.8	165.8	0	0	0	0	113	D369 R370 C372 V411 A455 I460 D468 F469 I470	D369-V466 PolarHBondContact O-N 3.14Å; R370-V466 WeakPolarHBondContact O-CG2 3.45Å; C372-V466 HydrophobicContact CB-CG1 3.98Å; V411-V466 HydrophobicContact CG1-CG1 4.39Å; A455-V466 HydrophobicContact CB-CG1 3.84Å; I460-V466 HydrophobicContact CD1-CB 4.34Å; I460-V466 HydrophobicContact CD1-CG2 3.64Å; V466-D468 PolarHBondContact O-N 2.99Å; V466-F469 PolarHBondContact O-N 3.38Å; V466-I470 HydrophobicContact CG1-CD1 3.93Å; V466-I470 HydrophobicContact CG1-CG1 4.33Å; V466-I470 HydrophobicContact CG1-CG2 4.28Å; V466-I470 PolarHBondContact O-N 3.37Å
467	W	89.3	Confident	87.9	Confident	6 Å²	6	41.6 Å²	41.6	2%	0.023	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-60.8	-30.1	-179.1	-69.7	71.5	0	0	0	112.4	T465 F469 I470 K472 L531 P534	T465-W467 PolarHBondContact O-N 3.3Å; T465-W467 VanDerWaalsContact O-N 3.12Å; T465-W467 PolarHBondContact OG1-N 3.43Å; W467-F469 PolarHBondContact O-N 3.4Å; W467-I470 PolarHBondContact O-N 3.04Å; W467-I470 VanDerWaalsContact O-O 3.12Å; W467-K472 HydrophobicContact CE3-CB 3.86Å; W467-K472 HydrophobicContact CE3-CG 4.03Å; W467-K472 HydrophobicContact CH2-CB 4.45Å; W467-K472 HydrophobicContact CH2-CG 3.73Å; W467-K472 HydrophobicContact CZ2-CG 4.32Å; W467-K472 HydrophobicContact CZ3-CB 3.8Å; W467-K472 HydrophobicContact CZ3-CG 3.55Å; W467-L531 HydrophobicContact CH2-CD2 4.34Å; W467-L531 HydrophobicContact CZ3-CB 4.32Å; W467-L531 HydrophobicContact CZ3-CD2 3.89Å; W467-L531 HydrophobicContact CZ3-CG 4.09Å; W467-P534 HydrophobicContact CD2-CB 4.25Å; W467-P534 HydrophobicContact CD2-CG 4.1Å; W467-P534 HydrophobicContact CE3-CB 4.49Å; W467-P534 HydrophobicContact CG-CG 4.14Å; W467-P534 HydrophobicContact CH2-CB 4.34Å; W467-P534 HydrophobicContact CZ2-CB 4.12Å
468	D	88.5	Confident	88	Confident	68 Å²	68	41.6 Å²	41.6	36%	0.364	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-67.3	-16.5	177.5	-57.8	-63.1	0	0	0	112.8	K402 T465 V466	K402-D468 WeakPolarHBondContact CD-O 3.15Å; K402-D468 WeakPolarHBondContact CE-O 3.27Å; K402-D468 PolarHBondContact NZ-O 3.2Å; T465-D468 PolarHBondContact N-OD2 2.99Å; T465-D468 WeakPolarHBondContact O-CB 3.48Å; T465-D468 PolarHBondContact O-N 3.45Å; T465-D468 PolarHBondContact OG1-OD2 3.45Å; V466-D468 PolarHBondContact O-N 2.99Å
469	F	88.8	Confident	88.3	Confident	19 Å²	19	38.1 Å²	38.1	8%	0.083	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-111.3	-4.2	-177.5	-55.5	-76.2	0	0	0	114.4	K402 F406 T410 V411 I460 T465 V466 W467	K402-F469 WeakPolarHBondContact CB-O 3.47Å; K402-F469 WeakPolarHBondContact CG-O 3.27Å; K402-F469 PolarHBondContact N-O 3.12Å; F406-F469 AromaticContact CD1-CE1 3.86Å; F406-F469 HydrophobicContact CD1-CE1 3.86Å; F406-F469 AromaticContact CE1-CE1 3.68Å; F406-F469 HydrophobicContact CE1-CE1 3.68Å; F406-F469 HydrophobicContact CE1-CZ 4.24Å; T410-F469 HydrophobicContact CG2-CE1 4.36Å; T410-F469 HydrophobicContact CG2-CE2 4.43Å; T410-F469 HydrophobicContact CG2-CZ 4.24Å; V411-F469 HydrophobicContact CB-CB 4.2Å; V411-F469 HydrophobicContact CG2-CB 3.6Å; V411-F469 HydrophobicContact CG2-CD2 3.9Å; V411-F469 HydrophobicContact CG2-CG 3.89Å; I460-F469 HydrophobicContact CD1-CD2 3.65Å; I460-F469 HydrophobicContact CD1-CE2 3.67Å; I460-F469 HydrophobicContact CG1-CD2 4.25Å; I460-F469 HydrophobicContact CG1-CE2 3.81Å; I460-F469 HydrophobicContact CG2-CE2 4.38Å; T465-F469 VanDerWaalsContact O-CD2 3.27Å; T465-F469 WeakPolarHBondContact O-CD2 3.32Å; T465-F469 WeakPolarHBondContact O-CE2 3.28Å; V466-F469 PolarHBondContact O-N 3.38Å; W467-F469 PolarHBondContact O-N 3.4Å
470	I	89.5	Confident	88.5	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	152.2	-179.1	66.8	172.3	0	0	0	112.6	A399 E400 I401 K402 V411 A455 V466 W467 K472	A399-I470 HydrophobicContact CB-CB 4.46Å; A399-I470 HydrophobicContact CB-CD1 3.97Å; E400-I470 CarbonylContact O-C 3.55Å; E400-I470 VanDerWaalsContact O-CA 3.28Å; E400-I470 WeakPolarHBondContact O-CA 3.44Å; E400-I470 WeakPolarHBondContact O-CB 3.49Å; I401-I470 HydrophobicContact CG1-CG2 4.39Å; K402-I470 WeakPolarHBondContact CE-O 3.4Å; V411-I470 HydrophobicContact CG1-CG2 4.11Å; A455-I470 HydrophobicContact CB-CD1 4.26Å; A455-I470 HydrophobicContact CB-CG2 4.08Å; V466-I470 HydrophobicContact CG1-CD1 3.93Å; V466-I470 HydrophobicContact CG1-CG1 4.33Å; V466-I470 HydrophobicContact CG1-CG2 4.28Å; V466-I470 PolarHBondContact O-N 3.37Å; W467-I470 PolarHBondContact O-N 3.04Å; W467-I470 VanDerWaalsContact O-O 3.12Å; I470-K472 HydrophobicContact CD1-CB 4.11Å; I470-K472 HydrophobicContact CD1-CD 4.28Å; I470-K472 HydrophobicContact CG1-CB 4.32Å; I470-K472 PolarHBondContact O-N 3Å
471	H	89.1	Confident	88.3	Confident	79 Å²	79	33.7 Å²	33.7	37%	0.366	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	88.5	162	-66.9	141.8	0	0	0	108.5	A399 E400 K473 V530	A399-H471 WeakPolarHBondContact CA-O 3.22Å; E400-H471 HydrophobicContact CB-CB 4.43Å; E400-H471 PolarHBondContact N-O 3.45Å; E400-H471 VanDerWaalsContact N-O 3.16Å; E400-H471 PolarHBondContact O-N 3.25Å; H471-K473 PolarHBondContact O-N 3.24Å; H471-V530 HydrophobicContact CB-CG1 3.9Å
472	K	90.7	Very high	87.9	Confident	4 Å²	4	32.8 Å²	32.8	2%	0.017	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	119	-179.2	-179.8	66.2	-172.4	174.6	0	110.3	S373 I374 A399 W467 I470 V474 G496 V530 L531	S373-K472 PolarHBondContact O-NZ 2.89Å; I374-K472 HydrophobicContact CG2-CD 4.49Å; A399-K472 HydrophobicContact CB-CD 4.28Å; W467-K472 HydrophobicContact CE3-CB 3.86Å; W467-K472 HydrophobicContact CE3-CG 4.03Å; W467-K472 HydrophobicContact CH2-CB 4.45Å; W467-K472 HydrophobicContact CH2-CG 3.73Å; W467-K472 HydrophobicContact CZ2-CG 4.32Å; W467-K472 HydrophobicContact CZ3-CB 3.8Å; W467-K472 HydrophobicContact CZ3-CG 3.55Å; I470-K472 HydrophobicContact CD1-CB 4.11Å; I470-K472 HydrophobicContact CD1-CD 4.28Å; I470-K472 HydrophobicContact CG1-CB 4.32Å; I470-K472 PolarHBondContact O-N 3Å; K472-V474 HydrophobicContact CG-CG2 4.32Å; K472-G496 WeakPolarHBondContact CE-O 3.5Å; K472-G496 PolarHBondContact NZ-O 3.08Å; K472-V530 WeakPolarHBondContact O-CA 3.38Å; K472-L531 PolarHBondContact O-N 2.91Å
473	K	91.8	Very high	87.9	Confident	19 Å²	19	27 Å²	27	8%	0.083	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	128.8	174.3	-64	170.3	-179.3	168.4	0	109.1	S398 E400 D436 H471 Q528 F529 V530	S398-K473 WeakPolarHBondContact O-CB 3.46Å; S398-K473 PolarHBondContact O-N 3.5Å; E400-K473 WeakPolarHBondContact OE1-CE 3.42Å; E400-K473 IonicContact OE1-NZ 3.48Å; E400-K473 PolarHBondContact OE1-NZ 2.91Å; D436-K473 IonicContact OD1-NZ 3.31Å; D436-K473 PolarHBondContact OD1-NZ 2.87Å; D436-K473 IonicContact OD2-NZ 2.71Å; D436-K473 PolarHBondContact OD2-NZ 3.37Å; H471-K473 PolarHBondContact O-N 3.24Å; K473-Q528 HydrophobicContact CB-CG 4.01Å; K473-F529 WeakPolarHBondContact CA-O 3.31Å; K473-V530 HydrophobicContact CG-CG2 4.29Å
474	V	92.3	Very high	87.8	Confident	4 Å²	4	22.1 Å²	22.1	2%	0.024	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	134.2	179.8	177.9	0	0	0	0	108.8	K472 I494 Q528 F529 L531	K472-V474 HydrophobicContact CG-CG2 4.32Å; V474-I494 HydrophobicContact CG1-CG2 3.39Å; V474-Q528 WeakPolarHBondContact O-CA 2.98Å; V474-F529 HydrophobicContact CB-CD1 4.37Å; V474-F529 HydrophobicContact CB-CE1 3.91Å; V474-F529 HydrophobicContact CB-CZ 4.19Å; V474-F529 HydrophobicContact CG1-CE1 3.86Å; V474-F529 HydrophobicContact CG1-CZ 4.2Å; V474-F529 PolarHBondContact N-O 2.73Å; V474-F529 WeakPolarHBondContact O-CD1 3.29Å; V474-F529 PolarHBondContact O-N 2.8Å; V474-L531 HydrophobicContact CG2-CB 3.8Å; V474-L531 HydrophobicContact CG2-CD2 4.13Å
475	T	92.3	Very high	87	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	127.7	-173.5	-46	0	0	0	0	110.3	I494 F495 H497 D498 K526 H527 Q528	T475-I494 WeakPolarHBondContact O-CA 3.14Å; T475-F495 PolarHBondContact N-O 3.44Å; T475-F495 PolarHBondContact O-N 2.94Å; T475-H497 VanDerWaalsContact CB-O 3.29Å; T475-H497 WeakPolarHBondContact CB-O 3.34Å; T475-H497 VanDerWaalsContact OG1-C 3.32Å; T475-H497 PolarHBondContact OG1-O 2.76Å; T475-D498 WeakPolarHBondContact OG1-CA 3.43Å; T475-K526 HydrophobicContact CG2-CB 4.37Å; T475-K526 HydrophobicContact CG2-CD 4.15Å; T475-H527 CarbonylContact C-O 3.51Å; T475-H527 WeakPolarHBondContact CA-O 3.38Å; T475-Q528 PolarHBondContact OG1-NE2 3.02Å; T475-Q528 VanDerWaalsContact OG1-NE2 3.09Å
476	V	93.8	Very high	86.2	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	118.2	176.4	-170.4	0	0	0	0	108.9	V492 T493 K526 H527 F529 V593 F604	V476-V492 HydrophobicContact CG1-CG1 3.4Å; V476-V492 VanDerWaalsContact CG1-CG1 3.4Å; V476-T493 CarbonylContact C-O 3.53Å; V476-T493 WeakPolarHBondContact CA-O 3.26Å; V476-K526 CarbonylContact O-C 3.51Å; V476-K526 VanDerWaalsContact O-CA 3.29Å; V476-K526 WeakPolarHBondContact O-CA 3.18Å; V476-H527 PolarHBondContact N-O 3.3Å; V476-H527 PolarHBondContact O-N 2.82Å; V476-F529 HydrophobicContact CG2-CD1 4.26Å; V476-F529 HydrophobicContact CG2-CE1 3.78Å; V476-V593 HydrophobicContact CG2-CG2 4.3Å; V476-F604 HydrophobicContact CB-CE1 3.94Å; V476-F604 HydrophobicContact CB-CZ 3.97Å; V476-F604 HydrophobicContact CG1-CE1 3.93Å; V476-F604 HydrophobicContact CG1-CZ 3.75Å
477	G	92.1	Very high	85.7	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	125.5	174.5	0	0	0	0	0	111.6	Y479 T493	G477-Y479 WeakPolarHBondContact O-CD2 3.48Å; G477-T493 PolarHBondContact N-O 2.84Å; G477-T493 PolarHBondContact O-N 3.02Å
478	L	92.6	Very high	85.2	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	121.9	170.9	177.8	66.1	0	0	0	109.6	V492 W524 G525 M541 L589 V591 V606	L478-V492 HydrophobicContact CD1-CG2 3.71Å; L478-W524 HydrophobicContact CD2-CE3 4.07Å; L478-W524 HydrophobicContact CG-CE3 4.32Å; L478-W524 PolarHBondContact O-N 3.42Å; L478-G525 PolarHBondContact N-O 2.81Å; L478-M541 HydrophobicContact CD1-SD 4.24Å; L478-L589 HydrophobicContact CD2-CB 4.13Å; L478-L589 HydrophobicContact CD2-CD1 4Å; L478-V591 HydrophobicContact CD1-CG2 4.46Å; L478-V591 HydrophobicContact CD2-CG2 4.34Å; L478-V606 HydrophobicContact CB-CG2 4.42Å; L478-V606 HydrophobicContact CD2-CB 3.8Å; L478-V606 HydrophobicContact CD2-CG1 4.06Å; L478-V606 HydrophobicContact CD2-CG2 3.96Å
479	Y	90.1	Very high	84.9	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	144	177.5	-65.8	-98.7	0	0	0	111.1	G477 T490 V491 F495 P501 L504 Q522 L523	G477-Y479 WeakPolarHBondContact O-CD2 3.48Å; Y479-T490 CarbonylContact O-C 3.59Å; Y479-T490 VanDerWaalsContact O-CA 3.26Å; Y479-T490 WeakPolarHBondContact O-CA 3.31Å; Y479-T490 VanDerWaalsContact O-CB 3.3Å; Y479-T490 WeakPolarHBondContact O-CB 3.34Å; Y479-V491 WeakPolarHBondContact CB-O 3.45Å; Y479-V491 PolarHBondContact N-O 3Å; Y479-V491 PolarHBondContact O-N 3.13Å; Y479-F495 HydrophobicContact CE2-CE2 4.2Å; Y479-F495 HydrophobicContact CE2-CZ 4.06Å; Y479-P501 WeakPolarHBondContact CE1-O 3.14Å; Y479-P501 WeakPolarHBondContact OH-CD 3.35Å; Y479-P501 PolarHBondContact OH-O 2.66Å; Y479-L504 HydrophobicContact CD1-CB 3.68Å; Y479-L504 HydrophobicContact CD1-CD1 4.36Å; Y479-L504 HydrophobicContact CD2-CD1 4.12Å; Y479-L504 HydrophobicContact CE1-CB 3.86Å; Y479-L504 HydrophobicContact CE1-CD1 4.47Å; Y479-L504 HydrophobicContact CE2-CD1 4.25Å; Y479-L504 HydrophobicContact CG-CB 4.24Å; Y479-L504 HydrophobicContact CG-CD1 4.2Å; Y479-Q522 VanDerWaalsContact CA-O 3.3Å; Y479-Q522 WeakPolarHBondContact CA-O 3.38Å; Y479-L523 HydrophobicContact CD1-CB 4.11Å; Y479-L523 HydrophobicContact CD2-CD1 4.32Å; Y479-L523 HydrophobicContact CE1-CB 3.73Å; Y479-L523 HydrophobicContact CE1-CD1 4.08Å; Y479-L523 HydrophobicContact CE1-CG 4.47Å; Y479-L523 HydrophobicContact CE2-CD1 3.85Å
480	G	87.7	Confident	84.8	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	-178.6	175.1	0	0	0	0	0	113.2	L521 Q522 W524	G480-L521 CarbonylContact O-C 3.59Å; G480-L521 WeakPolarHBondContact O-CA 3.26Å; G480-Q522 PolarHBondContact N-O 3.3Å; G480-Q522 PolarHBondContact O-N 3.11Å; G480-W524 VanDerWaalsContact CA-CE2 3.44Å; G480-W524 PolarHBondContact O-NE1 2.84Å
481	P	82.8	Confident	84.8	Confident	6 Å²	6	20.6 Å²	20.6	4%	0.039	10%	0.102	C	C	.	.			trans	-62.2	162.1	177.5	27.2	-36	0	0	0	111.9	H483 F488 W524	P481-H483 WeakPolarHBondContact CG-O 3.12Å; P481-H483 PolarHBondContact O-N 3.5Å; P481-F488 HydrophobicContact CG-CB 4.07Å; P481-F488 HydrophobicContact CG-CD2 3.58Å; P481-F488 HydrophobicContact CG-CE2 4.21Å; P481-F488 HydrophobicContact CG-CG 3.93Å; P481-W524 HydrophobicContact CG-CH2 4.46Å; P481-W524 HydrophobicContact CG-CZ2 3.98Å; P481-W524 VanDerWaalsContact O-CE2 3.32Å; P481-W524 WeakPolarHBondContact O-CZ2 3.46Å; P481-W524 PolarHBondContact O-NE1 3.28Å
482	K	76.1	Confident	84.9	Confident	105 Å²	105	16.9 Å²	16.9	46%	0.457	8%	0.084	S	C	.	.	S	Bend	trans	-68.6	-19.7	178.7	179.9	164.2	-177.7	174.1	0	114.1
483	H	75.9	Confident	84.8	Confident	86 Å²	86	16.7 Å²	16.7	40%	0.398	8%	0.084	S	C	.	.	S	Bend	trans	-143.9	147.5	-179.3	-61.4	-66.2	0	0	0	108.8	P481	P481-H483 WeakPolarHBondContact CG-O 3.12Å; P481-H483 PolarHBondContact O-N 3.5Å
484	I	77	Confident	84.8	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.08	C	C	.	.			trans	-69.5	148.2	176	-60.6	163.5	0	0	0	110.9	F488 Y548 S585 D586 F587 T608 P609	I484-F488 HydrophobicContact CG2-CE1 3.92Å; I484-F488 HydrophobicContact CG2-CZ 4.45Å; I484-Y548 HydrophobicContact CG2-CE1 3.79Å; I484-Y548 VanDerWaalsContact CG2-OH 3.25Å; I484-Y548 WeakPolarHBondContact CG2-OH 3.22Å; I484-S585 WeakPolarHBondContact CD1-O 3.22Å; I484-D586 HydrophobicContact CD1-CB 4.12Å; I484-F587 HydrophobicContact CD1-CD1 4.21Å; I484-F587 HydrophobicContact CD1-CE1 4.25Å; I484-F587 HydrophobicContact CG2-CE1 4.35Å; I484-T608 WeakPolarHBondContact CD1-OG1 3.43Å; I484-P609 WeakPolarHBondContact CD1-O 3.48Å; I484-P609 WeakPolarHBondContact CG1-O 3.49Å
485	H	68.8	Low	84.7	Confident	12 Å²	12	15.9 Å²	15.9	6%	0.056	8%	0.08	C	C	.	.			trans	-130.9	160.1	173.6	-168.4	-102.7	0	0	0	109.7	C297 S487 F488	C297-H485 VanDerWaalsContact SG-CD2 3.54Å; C297-H485 PolarHBondContact SG-CE1 2.92Å; C297-H485 PolarHBondContact SG-ND1 2.79Å; H485-S487 PolarHBondContact ND1-N 3.47Å; H485-S487 VanDerWaalsContact ND1-N 3.12Å; H485-S487 PolarHBondContact ND1-O 3.35Å; H485-S487 PolarHBondContact O-N 3.11Å; H485-S487 VanDerWaalsContact O-N 3.15Å; H485-F488 HydrophobicContact CB-CB 4.42Å; H485-F488 HydrophobicContact CB-CD1 4.19Å; H485-F488 WeakPolarHBondContact O-CD1 3.37Å; H485-F488 WeakPolarHBondContact O-CE1 3.41Å
486	P	72.1	Confident	84.4	Confident	15 Å²	15	16.6 Å²	16.6	10%	0.097	9%	0.088	C	C	.	.	S	Bend	trans	-63	-9.5	168.9	22.8	-35.8	0	0	0	115.5	L269 S578 P581 L584	L269-P486 HydrophobicContact CD1-CG 4.31Å; L269-P486 HydrophobicContact CD2-CG 4.37Å; L269-P486 HydrophobicContact CG-CG 4.48Å; P486-S578 PolarHBondContact O-N 3.01Å; P486-P581 HydrophobicContact CB-CB 3.64Å; P486-P581 HydrophobicContact CG-CB 4.15Å; P486-L584 HydrophobicContact CB-CD2 4.07Å
487	S	77.9	Confident	84.1	Confident	56 Å²	56	16.9 Å²	16.9	39%	0.392	9%	0.089	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	125.2	171.3	178	0	0	0	0	109.3	C297 H485 I576	C297-S487 PolarHBondContact SG-O 3.08Å; H485-S487 PolarHBondContact ND1-N 3.47Å; H485-S487 VanDerWaalsContact ND1-N 3.12Å; H485-S487 PolarHBondContact ND1-O 3.35Å; H485-S487 PolarHBondContact O-N 3.11Å; H485-S487 VanDerWaalsContact O-N 3.15Å; S487-I576 WeakPolarHBondContact CA-O 3.31Å
488	F	80.3	Confident	83.8	Confident	7 Å²	7	18.5 Å²	18.5	3%	0.031	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	168.1	179.1	60	-80.6	0	0	0	110.6	P481 I484 H485 T490 W524 I576 F587	P481-F488 HydrophobicContact CG-CB 4.07Å; P481-F488 HydrophobicContact CG-CD2 3.58Å; P481-F488 HydrophobicContact CG-CE2 4.21Å; P481-F488 HydrophobicContact CG-CG 3.93Å; I484-F488 HydrophobicContact CG2-CE1 3.92Å; I484-F488 HydrophobicContact CG2-CZ 4.45Å; H485-F488 HydrophobicContact CB-CB 4.42Å; H485-F488 HydrophobicContact CB-CD1 4.19Å; H485-F488 WeakPolarHBondContact O-CD1 3.37Å; H485-F488 WeakPolarHBondContact O-CE1 3.41Å; F488-T490 HydrophobicContact CD2-CG2 4Å; F488-T490 HydrophobicContact CE2-CG2 3.62Å; F488-W524 HydrophobicContact CD2-CH2 4.38Å; F488-W524 AromaticContact CE2-CH2 3.49Å; F488-W524 HydrophobicContact CE2-CH2 3.49Å; F488-W524 VanDerWaalsContact CE2-CH2 3.49Å; F488-W524 HydrophobicContact CE2-CZ2 4.42Å; F488-W524 HydrophobicContact CE2-CZ3 4.15Å; F488-W524 HydrophobicContact CZ-CH2 4.03Å; F488-I576 HydrophobicContact CE1-CB 4.21Å; F488-I576 HydrophobicContact CE1-CG2 4.3Å; F488-I576 HydrophobicContact CE2-CB 4.27Å; F488-I576 HydrophobicContact CE2-CD1 3.73Å; F488-I576 HydrophobicContact CE2-CG1 4.31Å; F488-I576 HydrophobicContact CZ-CB 4.04Å; F488-I576 HydrophobicContact CZ-CD1 3.88Å; F488-I576 HydrophobicContact CZ-CG1 4.45Å; F488-I576 HydrophobicContact CZ-CG2 4.2Å; F488-I576 PolarHBondContact N-O 3.23Å; F488-I576 PolarHBondContact O-N 3Å; F488-F587 HydrophobicContact CZ-CE1 4.34Å; F488-F587 HydrophobicContact CZ-CZ 4.11Å
489	K	81	Confident	83.4	Confident	37 Å²	37	19 Å²	19	16%	0.161	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	141.9	172	-53.5	-157.3	-178	-177	0	110.9	L300 D301 I573 F574 P575	L300-K489 HydrophobicContact CB-CD 3.77Å; L300-K489 HydrophobicContact CD1-CB 4.2Å; L300-K489 HydrophobicContact CD1-CD 4.04Å; L300-K489 HydrophobicContact CD1-CG 4.08Å; L300-K489 PolarHBondContact O-NZ 3.45Å; D301-K489 WeakPolarHBondContact OD1-CE 3.36Å; D301-K489 IonicContact OD1-NZ 2.8Å; D301-K489 PolarHBondContact OD1-NZ 3.11Å; K489-I573 HydrophobicContact CB-CG2 3.88Å; K489-I573 HydrophobicContact CD-CG2 3.76Å; K489-I573 HydrophobicContact CG-CG2 4.41Å; K489-F574 WeakPolarHBondContact CA-O 3.41Å; K489-P575 HydrophobicContact CD-CB 4.21Å; K489-P575 HydrophobicContact CG-CB 4.13Å
490	T	87.3	Confident	83.2	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	162.9	171.4	56.2	0	0	0	0	109.5	Y479 F488 W524 I573 F574 I576 L589	Y479-T490 CarbonylContact O-C 3.59Å; Y479-T490 VanDerWaalsContact O-CA 3.26Å; Y479-T490 WeakPolarHBondContact O-CA 3.31Å; Y479-T490 VanDerWaalsContact O-CB 3.3Å; Y479-T490 WeakPolarHBondContact O-CB 3.34Å; F488-T490 HydrophobicContact CD2-CG2 4Å; F488-T490 HydrophobicContact CE2-CG2 3.62Å; T490-W524 HydrophobicContact CG2-CE3 4.48Å; T490-W524 HydrophobicContact CG2-CH2 4.14Å; T490-W524 HydrophobicContact CG2-CZ3 3.82Å; T490-I573 CarbonylContact O-C 3.6Å; T490-I573 WeakPolarHBondContact O-CA 3.41Å; T490-F574 PolarHBondContact N-O 3.26Å; T490-F574 PolarHBondContact O-N 3.09Å; T490-F574 PolarHBondContact OG1-O 2.94Å; T490-F574 VanDerWaalsContact OG1-O 3.1Å; T490-I576 HydrophobicContact CG2-CD1 3.61Å; T490-I576 HydrophobicContact CG2-CG1 4.39Å; T490-L589 HydrophobicContact CG2-CD1 4.38Å
491	V	88.6	Confident	83	Confident	3 Å²	3	19.8 Å²	19.8	2%	0.018	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	114	175.8	-177.9	0	0	0	0	109.4	Y479 L521 R571 L572 I573	Y479-V491 WeakPolarHBondContact CB-O 3.45Å; Y479-V491 PolarHBondContact N-O 3Å; Y479-V491 PolarHBondContact O-N 3.13Å; V491-L521 HydrophobicContact CB-CD1 4.14Å; V491-L521 HydrophobicContact CG2-CD1 3.5Å; V491-R571 HydrophobicContact CG1-CB 4.23Å; V491-L572 CarbonylContact C-O 3.58Å; V491-L572 VanDerWaalsContact CA-O 3.29Å; V491-L572 WeakPolarHBondContact CA-O 3.25Å; V491-I573 HydrophobicContact CG2-CG1 4.2Å
492	V	91.3	Very high	82.9	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	121.9	167.3	-178	0	0	0	0	107.8	V476 L478 V539 L572 F574 V591	V476-V492 HydrophobicContact CG1-CG1 3.4Å; V476-V492 VanDerWaalsContact CG1-CG1 3.4Å; L478-V492 HydrophobicContact CD1-CG2 3.71Å; V492-V539 HydrophobicContact CB-CG1 4.45Å; V492-V539 HydrophobicContact CG1-CG1 4.01Å; V492-L572 HydrophobicContact CB-CB 4.43Å; V492-L572 PolarHBondContact N-O 2.98Å; V492-L572 WeakPolarHBondContact O-CB 3.38Å; V492-L572 PolarHBondContact O-N 3.25Å; V492-F574 HydrophobicContact CB-CD2 4.38Å; V492-F574 HydrophobicContact CB-CE2 4.01Å; V492-F574 HydrophobicContact CG2-CD2 3.86Å; V492-F574 HydrophobicContact CG2-CE2 3.74Å; V492-V591 HydrophobicContact CG1-CG1 4.31Å; V492-V591 HydrophobicContact CG2-CG1 4.5Å; V492-V591 HydrophobicContact CG2-CG2 4.28Å
493	T	90.1	Very high	83	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	129.2	179.1	-54.6	0	0	0	0	110.4	V476 G477 F495 V569 S570 R571	V476-T493 CarbonylContact C-O 3.53Å; V476-T493 WeakPolarHBondContact CA-O 3.26Å; G477-T493 PolarHBondContact N-O 2.84Å; G477-T493 PolarHBondContact O-N 3.02Å; T493-F495 HydrophobicContact CG2-CD1 4.11Å; T493-F495 HydrophobicContact CG2-CD2 4.19Å; T493-F495 HydrophobicContact CG2-CE1 3.55Å; T493-F495 HydrophobicContact CG2-CE2 3.66Å; T493-F495 HydrophobicContact CG2-CG 4.4Å; T493-F495 HydrophobicContact CG2-CZ 3.3Å; T493-V569 HydrophobicContact CG2-CG1 3.28Å; T493-S570 CarbonylContact C-O 3.4Å; T493-S570 WeakPolarHBondContact CA-O 3.36Å; T493-R571 HydrophobicContact CG2-CG 3.79Å
494	I	90.8	Very high	82.9	Confident	2 Å²	2	18.1 Å²	18.1	1%	0.01	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	125.2	172.5	-48.7	-173.8	0	0	0	108.8	V474 T475 L537 V539 V559 L564 V569 S570	V474-I494 HydrophobicContact CG1-CG2 3.39Å; T475-I494 WeakPolarHBondContact O-CA 3.14Å; I494-L537 HydrophobicContact CD1-CD1 4.41Å; I494-V539 HydrophobicContact CD1-CG2 3.89Å; I494-V559 HydrophobicContact CD1-CB 4.24Å; I494-V559 HydrophobicContact CD1-CG1 4.47Å; I494-V559 HydrophobicContact CD1-CG2 3.84Å; I494-L564 HydrophobicContact CG2-CD2 3.99Å; I494-V569 WeakPolarHBondContact O-CA 3.28Å; I494-S570 PolarHBondContact N-O 2.99Å; I494-S570 PolarHBondContact O-N 3.06Å; I494-S570 VanDerWaalsContact O-N 3.14Å
495	F	89.8	Confident	82.3	Confident	4 Å²	4	20.6 Å²	20.6	2%	0.018	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	140.4	177	-52	-88.1	0	0	0	110.6	L360 T475 Y479 T493 H497 A500 V569	L360-F495 HydrophobicContact CD1-CE1 4Å; T475-F495 PolarHBondContact N-O 3.44Å; T475-F495 PolarHBondContact O-N 2.94Å; Y479-F495 HydrophobicContact CE2-CE2 4.2Å; Y479-F495 HydrophobicContact CE2-CZ 4.06Å; T493-F495 HydrophobicContact CG2-CD1 4.11Å; T493-F495 HydrophobicContact CG2-CD2 4.19Å; T493-F495 HydrophobicContact CG2-CE1 3.55Å; T493-F495 HydrophobicContact CG2-CE2 3.66Å; T493-F495 HydrophobicContact CG2-CG 4.4Å; T493-F495 HydrophobicContact CG2-CZ 3.3Å; F495-H497 WeakPolarHBondContact CB-O 3.47Å; F495-H497 AromaticContact CD1-CE1 3.87Å; F495-H497 PolarHBondContact O-N 2.91Å; F495-H497 VanDerWaalsContact O-N 3.16Å; F495-A500 HydrophobicContact CD2-CB 4.04Å; F495-A500 HydrophobicContact CE2-CB 3.64Å; F495-A500 HydrophobicContact CZ-CB 4.16Å; F495-V569 HydrophobicContact CD1-CB 4.4Å; F495-V569 HydrophobicContact CD1-CG1 3.57Å; F495-V569 HydrophobicContact CD1-CG2 3.85Å; F495-V569 HydrophobicContact CE1-CG1 3.65Å; F495-V569 HydrophobicContact CG-CG1 4.43Å
496	G	86.2	Confident	81.8	Confident	16 Å²	16	20.6 Å²	20.6	17%	0.165	12%	0.116	C	C	.	.	S	Bend	trans	-73.2	7.8	170	0	0	0	0	0	114.6	K472	K472-G496 WeakPolarHBondContact CE-O 3.5Å; K472-G496 PolarHBondContact NZ-O 3.08Å
497	H	87.4	Confident	80.4	Confident	5 Å²	5	20.9 Å²	20.9	2%	0.023	12%	0.118	C	C	.	.	S	Bend	trans	-153.4	165.8	-174	56.9	46.6	0	0	0	112.2	L360 P376 S398 T475 F495 C499	L360-H497 PolarHBondContact O-NE2 3.17Å; P376-H497 VanDerWaalsContact CA-CD2 3.42Å; P376-H497 WeakPolarHBondContact CA-CD2 3.31Å; S398-H497 VanDerWaalsContact OG-CA 3.31Å; S398-H497 WeakPolarHBondContact OG-CA 3.31Å; T475-H497 VanDerWaalsContact CB-O 3.29Å; T475-H497 WeakPolarHBondContact CB-O 3.34Å; T475-H497 VanDerWaalsContact OG1-C 3.32Å; T475-H497 PolarHBondContact OG1-O 2.76Å; F495-H497 WeakPolarHBondContact CB-O 3.47Å; F495-H497 AromaticContact CD1-CE1 3.87Å; F495-H497 PolarHBondContact O-N 2.91Å; F495-H497 VanDerWaalsContact O-N 3.16Å; H497-C499 VanDerWaalsContact C-N 3.3Å; H497-C499 PolarHBondContact CE1-O 3.12Å; H497-C499 PolarHBondContact ND1-N 2.82Å; H497-C499 PolarHBondContact ND1-O 3.41Å; H497-C499 PolarHBondContact O-N 3.46Å
498	D	85.6	Confident	78.5	Confident	34 Å²	34	19.9 Å²	19.9	18%	0.182	11%	0.107	C	C	.	.	S	Bend	trans	-72.9	-13.1	-179.8	-165.7	48.1	0	0	0	115.7	S398 T475 A500 K526 Q528	S398-D498 PolarHBondContact OG-N 3.28Å; T475-D498 WeakPolarHBondContact OG1-CA 3.43Å; D498-A500 VanDerWaalsContact C-N 3.32Å; D498-A500 PolarHBondContact O-N 3.16Å; D498-K526 PolarHBondContact O-NZ 3.3Å; D498-K526 IonicContact OD1-NZ 2.79Å; D498-K526 PolarHBondContact OD1-NZ 2.79Å; D498-K526 IonicContact OD2-NZ 3.19Å; D498-K526 PolarHBondContact OD2-NZ 3.4Å; D498-Q528 PolarHBondContact OD1-NE2 3.19Å
499	C	85.2	Confident	76.1	Confident	10 Å²	10	22 Å²	22	7%	0.068	12%	0.121	C	C	.	.			trans	-74.8	76.2	-178.4	-70.1	0	0	0	0	113.1	T335 P376 H497	T335-C499 HydrophobicContact CG2-CB 4.3Å; P376-C499 HydrophobicContact CG-CB 4.06Å; H497-C499 VanDerWaalsContact C-N 3.3Å; H497-C499 PolarHBondContact CE1-O 3.12Å; H497-C499 PolarHBondContact ND1-N 2.82Å; H497-C499 PolarHBondContact ND1-O 3.41Å; H497-C499 PolarHBondContact O-N 3.46Å
500	A	86.1	Confident	73.7	Confident	12 Å²	12	22.7 Å²	22.7	10%	0.099	13%	0.128	C	C	.	.			trans	-90.4	115.5	170.1	0	0	0	0	0	110.4	F495 D498 L523 K526	F495-A500 HydrophobicContact CD2-CB 4.04Å; F495-A500 HydrophobicContact CE2-CB 3.64Å; F495-A500 HydrophobicContact CZ-CB 4.16Å; D498-A500 VanDerWaalsContact C-N 3.32Å; D498-A500 PolarHBondContact O-N 3.16Å; A500-L523 HydrophobicContact CB-CD2 4.41Å; A500-K526 HydrophobicContact CB-CD 4.16Å
501	P	82.1	Confident	71.3	Confident	5 Å²	5	33.7 Å²	33.7	3%	0.032	17%	0.17	C	C	.	.			trans	-67.9	151.2	-178.8	29.7	-38.1	0	0	0	111.7	A314 T317 L360 Y479 T503	A314-P501 HydrophobicContact CB-CG 3.98Å; T317-P501 HydrophobicContact CG2-CB 4.4Å; L360-P501 HydrophobicContact CD1-CG 3.81Å; Y479-P501 WeakPolarHBondContact CE1-O 3.14Å; Y479-P501 WeakPolarHBondContact OH-CD 3.35Å; Y479-P501 PolarHBondContact OH-O 2.66Å; P501-T503 VanDerWaalsContact C-N 3.3Å; P501-T503 PolarHBondContact O-N 3.36Å
502	K	81.6	Confident	68.8	Low	115 Å²	115	43.4 Å²	43.4	50%	0.5	22%	0.215	S	C	.	.	S	Bend	trans	-68.6	-24.1	176.1	-79.2	-173.3	-178.9	150.5	0	114.7	D334 Q522 L523	D334-K502 VanDerWaalsContact OD1-CE 3.31Å; D334-K502 WeakPolarHBondContact OD1-CE 3.34Å; D334-K502 IonicContact OD1-NZ 2.77Å; D334-K502 PolarHBondContact OD1-NZ 3.21Å; D334-K502 WeakPolarHBondContact OD2-CD 3.5Å; D334-K502 WeakPolarHBondContact OD2-CE 3.36Å; D334-K502 IonicContact OD2-NZ 3.67Å; D334-K502 PolarHBondContact OD2-NZ 3.2Å; K502-Q522 WeakPolarHBondContact O-CA 3.04Å; K502-L523 PolarHBondContact O-N 3.3Å
503	T	78.4	Confident	66	Low	45 Å²	45	45.9 Å²	45.9	28%	0.276	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	134.4	-175.8	-51.9	0	0	0	0	110.5	V315 P501 A520 L521	V315-T503 HydrophobicContact CG2-CG2 3.82Å; V315-T503 PolarHBondContact N-O 2.66Å; V315-T503 VanDerWaalsContact N-O 3.16Å; P501-T503 VanDerWaalsContact C-N 3.3Å; P501-T503 PolarHBondContact O-N 3.36Å; T503-A520 HydrophobicContact CG2-CB 3.97Å; T503-L521 WeakPolarHBondContact CA-O 3.29Å
504	L	73.7	Confident	63.5	Low	2 Å²	2	51.5 Å²	51.5	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	124.9	177.5	-176.2	157	0	0	0	108.3	T312 Y479 V506 L521	T312-L504 HydrophobicContact CG2-CD2 4.15Å; Y479-L504 HydrophobicContact CD1-CB 3.68Å; Y479-L504 HydrophobicContact CD1-CD1 4.36Å; Y479-L504 HydrophobicContact CD2-CD1 4.12Å; Y479-L504 HydrophobicContact CE1-CB 3.86Å; Y479-L504 HydrophobicContact CE1-CD1 4.47Å; Y479-L504 HydrophobicContact CE2-CD1 4.25Å; Y479-L504 HydrophobicContact CG-CB 4.24Å; Y479-L504 HydrophobicContact CG-CD1 4.2Å; L504-V506 HydrophobicContact CD2-CG2 3.91Å; L504-L521 PolarHBondContact N-O 2.75Å; L504-L521 PolarHBondContact O-N 3.35Å
505	L	64	Low	60.8	Low	53 Å²	53	56 Å²	56	28%	0.277	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	118.2	177.7	-66.4	173.6	0	0	0	109.8	T312 Q313 V315 S507 P518 A520	T312-L505 CarbonylContact C-O 3.6Å; T312-L505 WeakPolarHBondContact CA-O 3.47Å; Q313-L505 PolarHBondContact N-O 3.12Å; Q313-L505 VanDerWaalsContact N-O 3.12Å; Q313-L505 CarbonylContact O-C 3.45Å; Q313-L505 WeakPolarHBondContact O-CA 3.43Å; Q313-L505 VanDerWaalsContact O-CB 3.3Å; Q313-L505 WeakPolarHBondContact O-CB 3.28Å; Q313-L505 PolarHBondContact O-N 2.95Å; V315-L505 HydrophobicContact CG2-CD1 3.92Å; V315-L505 HydrophobicContact CG2-CD2 4.44Å; V315-L505 HydrophobicContact CG2-CG 3.72Å; L505-S507 PolarHBondContact O-N 3.37Å; L505-P518 HydrophobicContact CB-CB 4.18Å; L505-P518 HydrophobicContact CD2-CB 4.43Å; L505-P518 HydrophobicContact CD2-CG 4.37Å; L505-A520 HydrophobicContact CD2-CB 3.82Å
506	V	58.9	Low	58.6	Low	12 Å²	12	58.7 Å²	58.7	7%	0.073	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	104	170.8	-173.3	0	0	0	0	107.5	T312 L504 P518 V519 L521	T312-V506 HydrophobicContact CG2-CB 4.22Å; T312-V506 HydrophobicContact CG2-CG1 3.94Å; T312-V506 HydrophobicContact CG2-CG2 4.07Å; L504-V506 HydrophobicContact CD2-CG2 3.91Å; V506-P518 CarbonylContact O-C 3.55Å; V506-P518 VanDerWaalsContact O-CA 3.23Å; V506-P518 WeakPolarHBondContact O-CA 3.43Å; V506-P518 WeakPolarHBondContact O-CB 3.5Å; V506-V519 HydrophobicContact CB-CB 4.28Å; V506-V519 PolarHBondContact N-O 2.75Å; V506-V519 PolarHBondContact O-N 3.3Å; V506-L521 HydrophobicContact CG2-CD1 3.54Å; V506-L521 HydrophobicContact CG2-CG 3.89Å
507	S	42.3	Very low	56.6	Low	20 Å²	20	62.3 Å²	62.3	14%	0.14	34%	0.342	C	S	.	.			trans	-93.5	135.6	167	82.4	0	0	0	0	110.2	Q311 L505	Q311-S507 PolarHBondContact O-N 3.16Å; Q311-S507 PolarHBondContact O-OG 3.37Å; L505-S507 PolarHBondContact O-N 3.37Å
508	E	37	Very low	54.9	Low	35 Å²	35	65.1 Å²	65.1	16%	0.164	36%	0.36	C	S	.	.			trans	-90.4	119	177.3	-176.2	169.1	-123.9	0	0	108.7	T510 P516	E508-T510 HydrophobicContact CG-CG2 4.26Å; E508-P516 HydrophobicContact CB-CG 4.34Å; E508-P516 WeakPolarHBondContact OE2-CG 3.11Å
509	V	31.5	Very low	53.8	Low	53 Å²	53	65.9 Å²	65.9	32%	0.321	37%	0.366	S	S	.	.			trans	-103.3	74.9	-177.5	-174.4	0	0	0	0	109.2	W309 Q311	W309-V509 HydrophobicContact CE3-CG1 4.27Å; Q311-V509 HydrophobicContact CB-CG2 3.53Å
510	T	30	Very low	53.2	Low	51 Å²	51	68 Å²	68	31%	0.313	39%	0.385	S	S	.	.			trans	-77	136.1	167.8	41	0	0	0	0	109.9	E508 Q512	E508-T510 HydrophobicContact CG-CG2 4.26Å; T510-Q512 PolarHBondContact O-N 2.85Å
511	R	37.9	Very low	52.9	Low	231 Å²	231	68 Å²	68	87%	0.872	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	121.6	169.8	-82.2	-178.1	167.5	-172.9	-4.7	108.7
512	Q	35.2	Very low	53.1	Low	206 Å²	206	71.3 Å²	71.3	96%	0.963	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	37.2	165.8	-56.2	-179.4	-9.7	0	0	117.3	T510	T510-Q512 PolarHBondContact O-N 2.85Å
513	A	32.1	Very low	53.5	Low	52 Å²	52	68 Å²	68	43%	0.43	39%	0.385	S	S	.	.	S	Bend	trans	-128.7	151.7	163	0	0	0	0	0	111.3	N515	A513-N515 PolarHBondContact O-N 3.03Å
514	P	37.4	Very low	54	Low	118 Å²	118	67.5 Å²	67.5	77%	0.766	38%	0.378	S	S	*	.			trans	-73.1	115.6	174.5	28.8	-32.5	0	0	0	110.6
515	N	33.8	Very low	54.7	Low	98 Å²	98	68.3 Å²	68.3	52%	0.524	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-49	140.6	-168.6	-67.9	12.2	0	0	0	115.2	A513	A513-N515 PolarHBondContact O-N 3.03Å
516	P	43.7	Very low	56	Low	59 Å²	59	70.1 Å²	70.1	38%	0.383	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-65.9	159.7	158	30.4	-32.7	0	0	0	111	E508	E508-P516 HydrophobicContact CB-CG 4.34Å; E508-P516 WeakPolarHBondContact OE2-CG 3.11Å
517	A	43.7	Very low	57.7	Low	92 Å²	92	72.3 Å²	72.3	76%	0.76	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-65.5	135.9	177.9	0	0	0	0	0	111
518	P	53.5	Low	60.1	Low	64 Å²	64	74.2 Å²	74.2	42%	0.416	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-66.6	139.6	-172.5	26.6	-35.2	0	0	0	112.5	L505 V506 A520	L505-P518 HydrophobicContact CB-CB 4.18Å; L505-P518 HydrophobicContact CD2-CB 4.43Å; L505-P518 HydrophobicContact CD2-CG 4.37Å; V506-P518 CarbonylContact O-C 3.55Å; V506-P518 VanDerWaalsContact O-CA 3.23Å; V506-P518 WeakPolarHBondContact O-CA 3.43Å; V506-P518 WeakPolarHBondContact O-CB 3.5Å; P518-A520 PolarHBondContact O-N 3.21Å
519	V	61.3	Low	62.7	Low	51 Å²	51	73.4 Å²	73.4	31%	0.309	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	118.1	-177.8	-178.4	0	0	0	0	109.7	V506 L521	V506-V519 HydrophobicContact CB-CB 4.28Å; V506-V519 PolarHBondContact N-O 2.75Å; V506-V519 PolarHBondContact O-N 3.3Å; V519-L521 HydrophobicContact CG1-CD2 4.24Å; V519-L521 PolarHBondContact O-N 3.19Å
520	A	72.4	Confident	65.6	Low	55 Å²	55	74.6 Å²	74.6	46%	0.455	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	105.9	177.5	0	0	0	0	0	111.4	T503 L505 P518	T503-A520 HydrophobicContact CG2-CB 3.97Å; L505-A520 HydrophobicContact CD2-CB 3.82Å; P518-A520 PolarHBondContact O-N 3.21Å
521	L	81.3	Confident	68.4	Low	10 Å²	10	72.2 Å²	72.2	5%	0.052	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	144.2	170.5	-57	177.4	0	0	0	110.2	G480 V491 T503 L504 V506 V519	G480-L521 CarbonylContact O-C 3.59Å; G480-L521 WeakPolarHBondContact O-CA 3.26Å; V491-L521 HydrophobicContact CB-CD1 4.14Å; V491-L521 HydrophobicContact CG2-CD1 3.5Å; T503-L521 WeakPolarHBondContact CA-O 3.29Å; L504-L521 PolarHBondContact N-O 2.75Å; L504-L521 PolarHBondContact O-N 3.35Å; V506-L521 HydrophobicContact CG2-CD1 3.54Å; V506-L521 HydrophobicContact CG2-CG 3.89Å; V519-L521 HydrophobicContact CG1-CD2 4.24Å; V519-L521 PolarHBondContact O-N 3.19Å
522	Q	85.8	Confident	70.6	Confident	76 Å²	76	64.6 Å²	64.6	36%	0.355	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	144	177.7	-53.3	-155.9	-86.4	0	0	110.6	Y479 G480 K502 W524	Y479-Q522 VanDerWaalsContact CA-O 3.3Å; Y479-Q522 WeakPolarHBondContact CA-O 3.38Å; G480-Q522 PolarHBondContact N-O 3.3Å; G480-Q522 PolarHBondContact O-N 3.11Å; K502-Q522 WeakPolarHBondContact O-CA 3.04Å; Q522-W524 VanDerWaalsContact O-CD1 3.25Å; Q522-W524 PolarHBondContact O-N 2.88Å
523	L	89.2	Confident	73.1	Confident	45 Å²	45	59.7 Å²	59.7	24%	0.236	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	116.2	170.1	-178.4	67.1	0	0	0	109.3	Y479 A500 K502 G525 K526	Y479-L523 HydrophobicContact CD1-CB 4.11Å; Y479-L523 HydrophobicContact CD2-CD1 4.32Å; Y479-L523 HydrophobicContact CE1-CB 3.73Å; Y479-L523 HydrophobicContact CE1-CD1 4.08Å; Y479-L523 HydrophobicContact CE1-CG 4.47Å; Y479-L523 HydrophobicContact CE2-CD1 3.85Å; A500-L523 HydrophobicContact CB-CD2 4.41Å; K502-L523 PolarHBondContact O-N 3.3Å; L523-G525 WeakPolarHBondContact CD1-O 3.26Å; L523-K526 HydrophobicContact CD1-CB 4.47Å
524	W	89.5	Confident	75.7	Confident	34 Å²	34	58.8 Å²	58.8	13%	0.129	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-33	176.4	-67.7	-3.8	0	0	0	111.8	L478 G480 P481 F488 T490 Q522 L589 V606 T608 P609	L478-W524 HydrophobicContact CD2-CE3 4.07Å; L478-W524 HydrophobicContact CG-CE3 4.32Å; L478-W524 PolarHBondContact O-N 3.42Å; G480-W524 VanDerWaalsContact CA-CE2 3.44Å; G480-W524 PolarHBondContact O-NE1 2.84Å; P481-W524 HydrophobicContact CG-CH2 4.46Å; P481-W524 HydrophobicContact CG-CZ2 3.98Å; P481-W524 VanDerWaalsContact O-CE2 3.32Å; P481-W524 WeakPolarHBondContact O-CZ2 3.46Å; P481-W524 PolarHBondContact O-NE1 3.28Å; F488-W524 HydrophobicContact CD2-CH2 4.38Å; F488-W524 AromaticContact CE2-CH2 3.49Å; F488-W524 HydrophobicContact CE2-CH2 3.49Å; F488-W524 VanDerWaalsContact CE2-CH2 3.49Å; F488-W524 HydrophobicContact CE2-CZ2 4.42Å; F488-W524 HydrophobicContact CE2-CZ3 4.15Å; F488-W524 HydrophobicContact CZ-CH2 4.03Å; T490-W524 HydrophobicContact CG2-CE3 4.48Å; T490-W524 HydrophobicContact CG2-CH2 4.14Å; T490-W524 HydrophobicContact CG2-CZ3 3.82Å; Q522-W524 VanDerWaalsContact O-CD1 3.25Å; Q522-W524 PolarHBondContact O-N 2.88Å; W524-L589 HydrophobicContact CE3-CD1 4.23Å; W524-L589 HydrophobicContact CZ3-CD1 3.74Å; W524-V606 HydrophobicContact CB-CG1 3.72Å; W524-T608 HydrophobicContact CE3-CG2 4.16Å; W524-T608 HydrophobicContact CH2-CG2 4.06Å; W524-T608 HydrophobicContact CZ3-CG2 3.56Å; W524-P609 HydrophobicContact CD2-CG 4.23Å; W524-P609 HydrophobicContact CG-CG 4.23Å; W524-P609 VanDerWaalsContact CZ2-CD 3.48Å; W524-P609 HydrophobicContact CZ2-CG 4Å; W524-P609 VanDerWaalsContact NE1-CG 3.32Å
525	G	88.6	Confident	78.2	Confident	19 Å²	19	53.8 Å²	53.8	20%	0.196	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171	152.2	173.8	0	0	0	0	0	111.7	L478 L523	L478-G525 PolarHBondContact N-O 2.81Å; L523-G525 WeakPolarHBondContact CD1-O 3.26Å
526	K	91.8	Very high	81	Confident	92 Å²	92	51.4 Å²	51.4	40%	0.4	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	147.2	168.9	71.5	168.4	-176.3	165	0	111.1	T475 V476 D498 A500 L523	T475-K526 HydrophobicContact CG2-CB 4.37Å; T475-K526 HydrophobicContact CG2-CD 4.15Å; V476-K526 CarbonylContact O-C 3.51Å; V476-K526 VanDerWaalsContact O-CA 3.29Å; V476-K526 WeakPolarHBondContact O-CA 3.18Å; D498-K526 PolarHBondContact O-NZ 3.3Å; D498-K526 IonicContact OD1-NZ 2.79Å; D498-K526 PolarHBondContact OD1-NZ 2.79Å; D498-K526 IonicContact OD2-NZ 3.19Å; D498-K526 PolarHBondContact OD2-NZ 3.4Å; A500-K526 HydrophobicContact CB-CD 4.16Å; L523-K526 HydrophobicContact CD1-CB 4.47Å
527	H	93.1	Very high	83.3	Confident	58 Å²	58	48.6 Å²	48.6	27%	0.269	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	146.5	173.4	178.4	79.1	0	0	0	109.2	T475 V476 T602 F604	T475-H527 CarbonylContact C-O 3.51Å; T475-H527 WeakPolarHBondContact CA-O 3.38Å; V476-H527 PolarHBondContact N-O 3.3Å; V476-H527 PolarHBondContact O-N 2.82Å; H527-T602 PolarHBondContact CD2-OG1 2.62Å; H527-T602 VanDerWaalsContact CD2-OG1 3.28Å; H527-T602 PolarHBondContact NE2-OG1 2.75Å; H527-F604 HydrophobicContact CB-CB 4.07Å; H527-F604 HydrophobicContact CB-CD1 3.53Å; H527-F604 HydrophobicContact CB-CD2 3.78Å; H527-F604 HydrophobicContact CB-CE1 3.8Å; H527-F604 HydrophobicContact CB-CE2 4.02Å; H527-F604 HydrophobicContact CB-CG 3.52Å; H527-F604 HydrophobicContact CB-CZ 4.03Å; H527-F604 AromaticContact CD2-CD1 3.81Å; H527-F604 AromaticContact CG-CD1 3.69Å; H527-F604 AromaticContact CG-CG 3.81Å
528	Q	92.4	Very high	85.6	Confident	59 Å²	59	46.9 Å²	46.9	28%	0.276	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	132.8	-179.8	-177.8	171.7	81.5	0	0	109.6	K473 V474 T475 D498	K473-Q528 HydrophobicContact CB-CG 4.01Å; V474-Q528 WeakPolarHBondContact O-CA 2.98Å; T475-Q528 PolarHBondContact OG1-NE2 3.02Å; T475-Q528 VanDerWaalsContact OG1-NE2 3.09Å; D498-Q528 PolarHBondContact OD1-NE2 3.19Å
529	F	93	Very high	87.4	Confident	18 Å²	18	43.9 Å²	43.9	8%	0.079	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	162.8	-179.9	74.2	-73.9	0	0	0	110.4	K473 V474 V476 L531 L537 V593 L601 T602	K473-F529 WeakPolarHBondContact CA-O 3.31Å; V474-F529 HydrophobicContact CB-CD1 4.37Å; V474-F529 HydrophobicContact CB-CE1 3.91Å; V474-F529 HydrophobicContact CB-CZ 4.19Å; V474-F529 HydrophobicContact CG1-CE1 3.86Å; V474-F529 HydrophobicContact CG1-CZ 4.2Å; V474-F529 PolarHBondContact N-O 2.73Å; V474-F529 WeakPolarHBondContact O-CD1 3.29Å; V474-F529 PolarHBondContact O-N 2.8Å; V476-F529 HydrophobicContact CG2-CD1 4.26Å; V476-F529 HydrophobicContact CG2-CE1 3.78Å; F529-L531 HydrophobicContact CE2-CB 4.27Å; F529-L531 HydrophobicContact CE2-CD1 4.4Å; F529-L537 HydrophobicContact CZ-CD1 4.27Å; F529-V593 HydrophobicContact CZ-CG1 4.18Å; F529-L601 HydrophobicContact CD2-CB 4.37Å; F529-L601 HydrophobicContact CE2-CB 4.09Å; F529-L601 HydrophobicContact CE2-CD1 4.22Å; F529-T602 HydrophobicContact CB-CG2 4.05Å; F529-T602 HydrophobicContact CD1-CG2 3.64Å; F529-T602 HydrophobicContact CD2-CG2 4Å; F529-T602 HydrophobicContact CE1-CG2 4.03Å; F529-T602 HydrophobicContact CE2-CG2 4.36Å; F529-T602 HydrophobicContact CG-CG2 3.63Å; F529-T602 HydrophobicContact CZ-CG2 4.38Å
530	V	91.5	Very high	88.8	Confident	78 Å²	78	41.7 Å²	41.7	47%	0.473	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	132.7	175.6	178.6	0	0	0	0	109.4	H471 K472 K473	H471-V530 HydrophobicContact CB-CG1 3.9Å; K472-V530 WeakPolarHBondContact O-CA 3.38Å; K473-V530 HydrophobicContact CG-CG2 4.29Å
531	L	89.6	Confident	89.6	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	124.8	173.3	-177	63.1	0	0	0	109.1	W467 K472 V474 F529 R533 Q535 L537 L564 L601	W467-L531 HydrophobicContact CH2-CD2 4.34Å; W467-L531 HydrophobicContact CZ3-CB 4.32Å; W467-L531 HydrophobicContact CZ3-CD2 3.89Å; W467-L531 HydrophobicContact CZ3-CG 4.09Å; K472-L531 PolarHBondContact O-N 2.91Å; V474-L531 HydrophobicContact CG2-CB 3.8Å; V474-L531 HydrophobicContact CG2-CD2 4.13Å; F529-L531 HydrophobicContact CE2-CB 4.27Å; F529-L531 HydrophobicContact CE2-CD1 4.4Å; L531-R533 WeakPolarHBondContact CG-O 3.32Å; L531-Q535 HydrophobicContact CD1-CG 4.33Å; L531-L537 HydrophobicContact CD1-CD2 4.15Å; L531-L537 HydrophobicContact CD2-CD1 4.2Å; L531-L564 HydrophobicContact CD2-CD1 4.16Å; L531-L601 HydrophobicContact CD1-CD1 3.98Å
532	S	83.6	Confident	89.9	Confident	71 Å²	71	41.8 Å²	41.8	50%	0.497	21%	0.21	S	C	.	.	S	Bend	trans	-79.1	-32.6	-172.7	50.6	0	0	0	0	114.3
533	R	87.7	Confident	89.8	Confident	102 Å²	102	39.6 Å²	39.6	39%	0.385	20%	0.203	S	C	.	.	S	Bend	trans	-147.4	154.6	-179.9	62.7	171.3	-177	134.1	11	111	L531 Q535 D596	L531-R533 WeakPolarHBondContact CG-O 3.32Å; R533-Q535 HydrophobicContact CG-CB 4.28Å; R533-Q535 PolarHBondContact O-N 2.89Å; R533-D596 IonicContact CZ-OD1 2.73Å; R533-D596 IonicContact CZ-OD2 3.67Å; R533-D596 IonicContact NH1-OD2 3.72Å; R533-D596 IonicContact NH2-OD1 3.82Å; R533-D596 PolarHBondContact NH2-OD1 2.84Å; R533-D596 IonicContact NH2-OD2 3.91Å; R533-D596 PolarHBondContact NH2-OD2 2.67Å
534	P	87	Confident	89.2	Confident	34 Å²	34	41.6 Å²	41.6	22%	0.221	21%	0.214	C	C	.	.			trans	-76.2	94.1	175.7	30.3	-30.7	0	0	0	110.1	W467 K565	W467-P534 HydrophobicContact CD2-CB 4.25Å; W467-P534 HydrophobicContact CD2-CG 4.1Å; W467-P534 HydrophobicContact CE3-CB 4.49Å; W467-P534 HydrophobicContact CG-CG 4.14Å; W467-P534 HydrophobicContact CH2-CB 4.34Å; W467-P534 HydrophobicContact CZ2-CB 4.12Å; P534-K565 HydrophobicContact CB-CB 3.87Å; P534-K565 HydrophobicContact CB-CG 4.34Å; P534-K565 HydrophobicContact CG-CB 4.33Å; P534-K565 HydrophobicContact CG-CD 4.46Å; P534-K565 HydrophobicContact CG-CG 4.27Å
535	Q	90.1	Very high	88.2	Confident	12 Å²	12	44.2 Å²	44.2	6%	0.056	23%	0.229	C	C	.	.			trans	-119.7	165	-178.2	67.5	-165.5	18.9	0	0	111.1	L531 R533 L537 G561	L531-Q535 HydrophobicContact CD1-CG 4.33Å; R533-Q535 HydrophobicContact CG-CB 4.28Å; R533-Q535 PolarHBondContact O-N 2.89Å; Q535-L537 HydrophobicContact CG-CD2 4.04Å; Q535-L537 PolarHBondContact O-N 3.09Å; Q535-G561 VanDerWaalsContact C-CA 3.41Å; Q535-G561 VanDerWaalsContact O-CA 3.23Å; Q535-G561 WeakPolarHBondContact O-CA 3.39Å
536	D	91.7	Very high	87	Confident	49 Å²	49	48.8 Å²	48.8	26%	0.262	25%	0.254	S	S	.	.			trans	-62.9	133.8	171.4	-86.6	25.6	0	0	0	110.4	V558 V559 R560 G561 D596	D536-V558 HydrophobicContact CB-CG1 4.38Å; D536-V559 WeakPolarHBondContact CA-O 3.37Å; D536-R560 VanDerWaalsContact OD1-CA 3.25Å; D536-R560 WeakPolarHBondContact OD1-CA 3.38Å; D536-R560 WeakPolarHBondContact OD2-CD 3.35Å; D536-R560 IonicContact OD2-CZ 2.71Å; D536-R560 IonicContact OD2-NE 2.99Å; D536-R560 IonicContact OD2-NH1 3.5Å; D536-R560 PolarHBondContact OD2-NH1 3.45Å; D536-G561 PolarHBondContact OD1-N 3.43Å; D536-D596 PolarHBondContact O-N 3.45Å
537	L	92.1	Very high	85.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	122.2	179.7	-64.2	-173	0	0	0	110.5	I494 F529 L531 Q535 V558 V559 L564 V593 K594 L601	I494-L537 HydrophobicContact CD1-CD1 4.41Å; F529-L537 HydrophobicContact CZ-CD1 4.27Å; L531-L537 HydrophobicContact CD1-CD2 4.15Å; L531-L537 HydrophobicContact CD2-CD1 4.2Å; Q535-L537 HydrophobicContact CG-CD2 4.04Å; Q535-L537 PolarHBondContact O-N 3.09Å; L537-V558 WeakPolarHBondContact O-CA 3.46Å; L537-V559 PolarHBondContact N-O 2.93Å; L537-V559 PolarHBondContact O-N 2.88Å; L537-L564 HydrophobicContact CB-CD1 4.47Å; L537-L564 HydrophobicContact CD1-CD1 3.48Å; L537-L564 VanDerWaalsContact CD1-CD1 3.48Å; L537-L564 HydrophobicContact CG-CD1 3.63Å; L537-V593 HydrophobicContact CB-CG1 4.18Å; L537-V593 HydrophobicContact CD1-CG1 4.06Å; L537-V593 HydrophobicContact CD2-CG1 4.31Å; L537-V593 HydrophobicContact CG-CG1 4.43Å; L537-K594 WeakPolarHBondContact CA-O 3.26Å; L537-L601 HydrophobicContact CD2-CD1 3.39Å
538	K	91.8	Very high	85.2	Confident	56 Å²	56	43.8 Å²	43.8	24%	0.243	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	106.4	174.2	-177.6	-176.4	-179.5	-173.8	0	109.1	A556 V558 K594 E598	K538-A556 HydrophobicContact CD-CB 4.46Å; K538-A556 HydrophobicContact CG-CB 4.14Å; K538-V558 HydrophobicContact CB-CG2 4.46Å; K538-V558 HydrophobicContact CG-CG2 4.44Å; K538-K594 HydrophobicContact CB-CB 4.19Å; K538-K594 HydrophobicContact CD-CD 4.35Å; K538-K594 PolarHBondContact N-O 3.14Å; K538-K594 PolarHBondContact O-N 2.81Å; K538-E598 WeakPolarHBondContact CD-OE1 3.13Å; K538-E598 WeakPolarHBondContact CE-OE1 3.48Å; K538-E598 IonicContact NZ-OE1 3.61Å; K538-E598 PolarHBondContact NZ-OE1 3.39Å; K538-E598 IonicContact NZ-OE2 3.78Å; K538-E598 PolarHBondContact NZ-OE2 2.96Å
539	V	92.5	Very high	84.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	114.9	176.3	-178.4	0	0	0	0	108.8	V492 I494 A556 K557 L572 F574 V591 V593	V492-V539 HydrophobicContact CB-CG1 4.45Å; V492-V539 HydrophobicContact CG1-CG1 4.01Å; I494-V539 HydrophobicContact CD1-CG2 3.89Å; V539-A556 CarbonylContact O-C 3.57Å; V539-A556 WeakPolarHBondContact O-CA 3.18Å; V539-K557 PolarHBondContact N-O 3.47Å; V539-K557 PolarHBondContact O-N 2.92Å; V539-L572 HydrophobicContact CB-CD1 3.59Å; V539-L572 HydrophobicContact CG1-CD1 4.05Å; V539-L572 HydrophobicContact CG2-CD1 3.6Å; V539-F574 HydrophobicContact CG1-CE2 4.33Å; V539-F574 HydrophobicContact CG1-CZ 4.16Å; V539-V591 HydrophobicContact CG1-CG1 4.06Å; V539-V593 HydrophobicContact CG2-CG2 4.42Å
540	C	89.8	Confident	83.7	Confident	6 Å²	6	44.1 Å²	44.1	4%	0.041	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	143	172.7	-59.3	0	0	0	0	110.7	F542 Q555 Q592	C540-F542 HydrophobicContact CB-CD2 4.4Å; C540-F542 HydrophobicContact CB-CE2 3.49Å; C540-F542 VanDerWaalsContact CB-CE2 3.49Å; C540-F542 HydrophobicContact CB-CZ 3.6Å; C540-Q555 CarbonylContact C-O 3.55Å; C540-Q555 WeakPolarHBondContact CA-O 3.1Å; C540-Q592 HydrophobicContact CB-CB 4.36Å; C540-Q592 PolarHBondContact N-O 3.43Å; C540-Q592 PolarHBondContact O-N 3.08Å
541	M	89.8	Confident	82.6	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	126.3	174.8	-167.4	-176	78.5	0	0	111.3	L478 V550 Q555 F574 I576 L589 V591	L478-M541 HydrophobicContact CD1-SD 4.24Å; M541-V550 HydrophobicContact CE-CG1 4.15Å; M541-V550 HydrophobicContact CE-CG2 3.54Å; M541-Q555 PolarHBondContact N-O 3.4Å; M541-F574 HydrophobicContact CB-CD1 4.01Å; M541-F574 HydrophobicContact CB-CE1 4.11Å; M541-F574 HydrophobicContact CB-CG 4.23Å; M541-F574 HydrophobicContact CB-CZ 4.42Å; M541-F574 HydrophobicContact CE-CB 3.41Å; M541-F574 VanDerWaalsContact CE-CB 3.41Å; M541-F574 HydrophobicContact CE-CG 4.04Å; M541-F574 HydrophobicContact SD-CB 4.01Å; M541-F574 HydrophobicContact SD-CD2 4.36Å; M541-F574 HydrophobicContact SD-CG 4.18Å; M541-I576 HydrophobicContact CE-CD1 3.59Å; M541-I576 HydrophobicContact CE-CG1 3.71Å; M541-L589 HydrophobicContact CE-CD2 4.04Å; M541-L589 HydrophobicContact CG-CD2 4.15Å; M541-L589 HydrophobicContact SD-CD1 4.27Å; M541-L589 HydrophobicContact SD-CD2 4.14Å; M541-V591 HydrophobicContact CG-CG2 4.35Å
542	F	86.8	Confident	81	Confident	66 Å²	66	47.5 Å²	47.5	29%	0.289	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	140.6	-176.8	-52.2	-77.3	0	0	0	111.1	C540 R590 Q592	C540-F542 HydrophobicContact CB-CD2 4.4Å; C540-F542 HydrophobicContact CB-CE2 3.49Å; C540-F542 VanDerWaalsContact CB-CE2 3.49Å; C540-F542 HydrophobicContact CB-CZ 3.6Å; F542-R590 HydrophobicContact CB-CB 4.47Å; F542-R590 PolarHBondContact N-O 3.25Å; F542-R590 PolarHBondContact O-N 2.81Å; F542-Q592 HydrophobicContact CE2-CB 4.25Å
543	S	84.2	Confident	79.7	Confident	30 Å²	30	49.4 Å²	49.4	21%	0.21	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	138.8	164	176	0	0	0	0	109.8	M545 Y548	S543-M545 VanDerWaalsContact C-N 3.29Å; S543-M545 PolarHBondContact OG-N 2.78Å; S543-M545 VanDerWaalsContact OG-N 3.13Å; S543-M545 PolarHBondContact OG-O 2.83Å; S543-Y548 WeakPolarHBondContact CB-O 2.95Å; S543-Y548 PolarHBondContact OG-O 3.45Å
544	N	75.7	Confident	78.6	Confident	87 Å²	87	46.7 Å²	46.7	47%	0.465	26%	0.262	S	S	.	.	S	Bend	trans	-90.5	12.9	171.8	-151.5	98.8	0	0	0	112.7	T588 R590	N544-T588 WeakPolarHBondContact CB-O 3.27Å; N544-T588 PolarHBondContact N-O 3.21Å; N544-R590 PolarHBondContact OD1-NH2 2.94Å
545	M	70.4	Confident	77.9	Confident	90 Å²	90	47.8 Å²	47.8	44%	0.443	26%	0.264	S	S	.	.	S	Bend	trans	-137.6	136.9	175.3	-71.7	-169.3	176.5	0	0	111.4	S543 N547 Y548 F587	S543-M545 VanDerWaalsContact C-N 3.29Å; S543-M545 PolarHBondContact OG-N 2.78Å; S543-M545 VanDerWaalsContact OG-N 3.13Å; S543-M545 PolarHBondContact OG-O 2.83Å; M545-N547 VanDerWaalsContact C-N 3.28Å; M545-N547 PolarHBondContact O-N 3.5Å; M545-Y548 PolarHBondContact O-N 3.2Å; M545-F587 HydrophobicContact CB-CB 4.23Å; M545-F587 HydrophobicContact CG-CB 4.02Å; M545-F587 HydrophobicContact SD-CB 3.69Å
546	T	62.9	Low	77.5	Confident	115 Å²	115	49.2 Å²	49.2	71%	0.706	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-34.9	179.3	48	0	0	0	0	113.6	Y548 Q579	T546-Y548 PolarHBondContact O-N 2.84Å; T546-Q579 PolarHBondContact O-OE1 2.6Å
547	N	69.3	Low	77.2	Confident	42 Å²	42	49.3 Å²	49.3	23%	0.225	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-11.1	-179.3	-78.7	1.4	0	0	0	114.7	M545 S578 Q579	M545-N547 VanDerWaalsContact C-N 3.28Å; M545-N547 PolarHBondContact O-N 3.5Å; N547-S578 CarbonylContact O-C 3.57Å; N547-S578 WeakPolarHBondContact O-CA 3.28Å; N547-S578 WeakPolarHBondContact O-CB 3.13Å; N547-S578 PolarHBondContact O-OG 3.35Å; N547-Q579 PolarHBondContact O-N 3.22Å
548	Y	77.4	Confident	77	Confident	3 Å²	3	52.8 Å²	52.8	1%	0.012	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	125.3	174.7	-64.8	-84.8	0	0	0	110.7	I484 S543 M545 T546 I576 L584 S585 F587	I484-Y548 HydrophobicContact CG2-CE1 3.79Å; I484-Y548 VanDerWaalsContact CG2-OH 3.25Å; I484-Y548 WeakPolarHBondContact CG2-OH 3.22Å; S543-Y548 WeakPolarHBondContact CB-O 2.95Å; S543-Y548 PolarHBondContact OG-O 3.45Å; M545-Y548 PolarHBondContact O-N 3.2Å; T546-Y548 PolarHBondContact O-N 2.84Å; Y548-I576 HydrophobicContact CD1-CG2 4.48Å; Y548-L584 HydrophobicContact CE1-CD2 4.34Å; Y548-L584 WeakPolarHBondContact OH-CA 3.49Å; Y548-S585 WeakPolarHBondContact CE2-O 3.19Å; Y548-S585 PolarHBondContact OH-N 2.93Å; Y548-S585 PolarHBondContact OH-O 3.46Å; Y548-F587 HydrophobicContact CD1-CD1 4.43Å; Y548-F587 AromaticContact CD1-CE1 3.82Å; Y548-F587 HydrophobicContact CD1-CE1 3.82Å; Y548-F587 HydrophobicContact CD1-CZ 4.06Å; Y548-F587 HydrophobicContact CD2-CB 4.23Å; Y548-F587 AromaticContact CD2-CD1 3.37Å; Y548-F587 HydrophobicContact CD2-CD1 3.37Å; Y548-F587 HydrophobicContact CD2-CD2 4.17Å; Y548-F587 AromaticContact CD2-CE1 3.61Å; Y548-F587 HydrophobicContact CD2-CE1 3.61Å; Y548-F587 HydrophobicContact CD2-CE2 4.35Å; Y548-F587 AromaticContact CD2-CG 3.69Å; Y548-F587 HydrophobicContact CD2-CG 3.69Å; Y548-F587 HydrophobicContact CD2-CZ 4.1Å; Y548-F587 HydrophobicContact CE1-CD1 4.42Å; Y548-F587 AromaticContact CE1-CE1 3.92Å; Y548-F587 HydrophobicContact CE1-CE1 3.92Å; Y548-F587 HydrophobicContact CE2-CB 4.45Å; Y548-F587 AromaticContact CE2-CD1 3.35Å; Y548-F587 HydrophobicContact CE2-CD1 3.35Å; Y548-F587 AromaticContact CE2-CE1 3.7Å; Y548-F587 HydrophobicContact CE2-CE1 3.7Å; Y548-F587 HydrophobicContact CE2-CG 4.04Å; Y548-F587 AromaticContact CG-CD1 3.92Å; Y548-F587 HydrophobicContact CG-CD1 3.92Å; Y548-F587 HydrophobicContact CG-CD2 4.41Å; Y548-F587 AromaticContact CG-CE1 3.65Å; Y548-F587 HydrophobicContact CG-CE1 3.65Å; Y548-F587 HydrophobicContact CG-CE2 4.16Å; Y548-F587 HydrophobicContact CG-CG 4.3Å; Y548-F587 AromaticContact CG-CZ 3.78Å; Y548-F587 HydrophobicContact CG-CZ 3.78Å; Y548-F587 AromaticContact CZ-CD1 3.9Å; Y548-F587 AromaticContact CZ-CE1 3.84Å
549	E	76.9	Confident	76.9	Confident	80 Å²	80	50.2 Å²	50.2	37%	0.374	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.7	-177.5	-166.9	177.1	150.7	0	0	111.2	T577 Q579	E549-T577 PolarHBondContact N-O 2.91Å; E549-T577 PolarHBondContact O-N 2.91Å; E549-T577 PolarHBondContact O-OG1 3.49Å; E549-Q579 PolarHBondContact OE2-NE2 3.12Å
550	V	77.4	Confident	76.7	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.018	31%	0.309	C	S	.	.			trans	-96.5	119	163.5	-176.3	0	0	0	0	105.7	M541 A552 Q555 F574 I576	M541-V550 HydrophobicContact CE-CG1 4.15Å; M541-V550 HydrophobicContact CE-CG2 3.54Å; V550-A552 PolarHBondContact O-N 2.93Å; V550-Q555 HydrophobicContact CB-CG 3.93Å; V550-Q555 HydrophobicContact CG1-CG 3.82Å; V550-Q555 WeakPolarHBondContact O-CG 3.43Å; V550-Q555 PolarHBondContact O-NE2 2.78Å; V550-F574 HydrophobicContact CG1-CD1 4.5Å; V550-I576 HydrophobicContact CG2-CG1 4.34Å
551	K	67.6	Low	76.4	Confident	76 Å²	76	56.3 Å²	56.3	33%	0.33	31%	0.31	S	S	.	.			trans	-46.6	124.5	-176.3	-67.9	-179.6	-176.1	171.4	0	110.2	D301 S553 E554 Q555 P575	D301-K551 IonicContact OD2-NZ 2.66Å; K551-S553 PolarHBondContact O-N 2.78Å; K551-S553 VanDerWaalsContact O-N 3.1Å; K551-E554 HydrophobicContact CB-CB 4.47Å; K551-E554 IonicContact NZ-OE1 2.8Å; K551-E554 CarbonylContact O-C 3.57Å; K551-E554 WeakPolarHBondContact O-CA 3.1Å; K551-E554 PolarHBondContact O-N 2.96Å; K551-Q555 PolarHBondContact O-N 3.44Å; K551-P575 HydrophobicContact CD-CG 4.45Å
552	A	56.7	Low	76.2	Confident	75 Å²	75	62.5 Å²	62.5	62%	0.62	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-53.8	-36.4	-172.1	0	0	0	0	0	114.2	V550 E554	V550-A552 PolarHBondContact O-N 2.93Å; A552-E554 PolarHBondContact O-N 2.89Å
553	S	57.1	Low	76.1	Confident	111 Å²	111	61.8 Å²	61.8	78%	0.776	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-68.1	-14	175.6	52.1	0	0	0	0	115.1	K551	K551-S553 PolarHBondContact O-N 2.78Å; K551-S553 VanDerWaalsContact O-N 3.1Å
554	E	64.6	Low	76.1	Confident	45 Å²	45	61 Å²	61	21%	0.21	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-118.6	1	-178.9	-68	-166.6	-112.2	0	0	113.6	K551 A552 A556 K557 F574 P575	K551-E554 HydrophobicContact CB-CB 4.47Å; K551-E554 IonicContact NZ-OE1 2.8Å; K551-E554 CarbonylContact O-C 3.57Å; K551-E554 WeakPolarHBondContact O-CA 3.1Å; K551-E554 PolarHBondContact O-N 2.96Å; A552-E554 PolarHBondContact O-N 2.89Å; E554-A556 PolarHBondContact O-N 3.3Å; E554-A556 VanDerWaalsContact O-N 3.16Å; E554-K557 WeakPolarHBondContact O-CE 3.44Å; E554-K557 IonicContact OE2-NZ 2.88Å; E554-K557 PolarHBondContact OE2-NZ 3.13Å; E554-F574 VanDerWaalsContact O-CD1 3.29Å; E554-F574 WeakPolarHBondContact O-CD1 3.4Å; E554-F574 WeakPolarHBondContact O-CE1 3.29Å; E554-P575 WeakPolarHBondContact OE1-CG 3.17Å; E554-P575 VanDerWaalsContact OE2-CD 3.3Å; E554-P575 WeakPolarHBondContact OE2-CD 3.24Å
555	Q	71.9	Confident	76.6	Confident	57 Å²	57	59.9 Å²	59.9	27%	0.266	32%	0.319	S	S	.	.	S	Bend	trans	-60.9	-24.1	-176.9	-81.7	179.5	15.8	0	0	114	C540 M541 V550 K551	C540-Q555 CarbonylContact C-O 3.55Å; C540-Q555 WeakPolarHBondContact CA-O 3.1Å; M541-Q555 PolarHBondContact N-O 3.4Å; V550-Q555 HydrophobicContact CB-CG 3.93Å; V550-Q555 HydrophobicContact CG1-CG 3.82Å; V550-Q555 WeakPolarHBondContact O-CG 3.43Å; V550-Q555 PolarHBondContact O-NE2 2.78Å; K551-Q555 PolarHBondContact O-N 3.44Å
556	A	81.3	Confident	77.3	Confident	42 Å²	42	58.4 Å²	58.4	35%	0.347	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	132.5	179.4	0	0	0	0	0	111.4	K538 V539 E554	K538-A556 HydrophobicContact CD-CB 4.46Å; K538-A556 HydrophobicContact CG-CB 4.14Å; V539-A556 CarbonylContact O-C 3.57Å; V539-A556 WeakPolarHBondContact O-CA 3.18Å; E554-A556 PolarHBondContact O-N 3.3Å; E554-A556 VanDerWaalsContact O-N 3.16Å
557	K	86.3	Confident	78	Confident	52 Å²	52	53.3 Å²	53.3	23%	0.226	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	137.2	176.3	-60	-169.4	179.6	-168.8	0	110.3	V539 E554 L572 I573 F574	V539-K557 PolarHBondContact N-O 3.47Å; V539-K557 PolarHBondContact O-N 2.92Å; E554-K557 WeakPolarHBondContact O-CE 3.44Å; E554-K557 IonicContact OE2-NZ 2.88Å; E554-K557 PolarHBondContact OE2-NZ 3.13Å; K557-L572 HydrophobicContact CB-CD1 4.34Å; K557-L572 HydrophobicContact CB-CD2 4.17Å; K557-I573 WeakPolarHBondContact CD-O 3.3Å; K557-I573 WeakPolarHBondContact CE-O 3.45Å; K557-I573 PolarHBondContact NZ-O 3.35Å; K557-F574 HydrophobicContact CB-CE1 4.3Å; K557-F574 HydrophobicContact CB-CZ 3.96Å; K557-F574 HydrophobicContact CD-CD1 4.39Å; K557-F574 HydrophobicContact CD-CE1 4.09Å; K557-F574 HydrophobicContact CD-CZ 4.25Å; K557-F574 HydrophobicContact CG-CE1 3.81Å; K557-F574 HydrophobicContact CG-CZ 3.96Å
558	V	87.8	Confident	78.7	Confident	73 Å²	73	55.4 Å²	55.4	44%	0.442	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	131.6	-172.2	-179	0	0	0	0	110.9	D536 L537 K538	D536-V558 HydrophobicContact CB-CG1 4.38Å; L537-V558 WeakPolarHBondContact O-CA 3.46Å; K538-V558 HydrophobicContact CB-CG2 4.46Å; K538-V558 HydrophobicContact CG-CG2 4.44Å
559	V	88.1	Confident	79.1	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	130.8	165.2	172.9	0	0	0	0	107.9	I494 D536 L537 Q563 L564 S570 L572	I494-V559 HydrophobicContact CD1-CB 4.24Å; I494-V559 HydrophobicContact CD1-CG1 4.47Å; I494-V559 HydrophobicContact CD1-CG2 3.84Å; D536-V559 WeakPolarHBondContact CA-O 3.37Å; L537-V559 PolarHBondContact N-O 2.93Å; L537-V559 PolarHBondContact O-N 2.88Å; V559-Q563 HydrophobicContact CG1-CB 4.45Å; V559-L564 HydrophobicContact CG1-CD1 4.27Å; V559-L564 HydrophobicContact CG1-CD2 3.91Å; V559-L564 HydrophobicContact CG1-CG 3.9Å; V559-S570 WeakPolarHBondContact CG1-OG 3.47Å; V559-L572 HydrophobicContact CG2-CD1 3.87Å; V559-L572 HydrophobicContact CG2-CD2 3.87Å; V559-L572 HydrophobicContact CG2-CG 4.13Å
560	R	88.5	Confident	79.4	Confident	129 Å²	129	52.2 Å²	52.2	49%	0.487	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-82.7	141.7	-175.1	-60.4	-61.7	-168.9	171.4	3.9	111.3	D536 F562 Q563 L564	D536-R560 VanDerWaalsContact OD1-CA 3.25Å; D536-R560 WeakPolarHBondContact OD1-CA 3.38Å; D536-R560 WeakPolarHBondContact OD2-CD 3.35Å; D536-R560 IonicContact OD2-CZ 2.71Å; D536-R560 IonicContact OD2-NE 2.99Å; D536-R560 IonicContact OD2-NH1 3.5Å; D536-R560 PolarHBondContact OD2-NH1 3.45Å; R560-F562 HydrophobicContact CB-CD1 3.52Å; R560-F562 HydrophobicContact CB-CE1 3.41Å; R560-F562 VanDerWaalsContact CB-CE1 3.41Å; R560-F562 HydrophobicContact CB-CG 4.47Å; R560-F562 HydrophobicContact CB-CZ 4.28Å; R560-F562 HydrophobicContact CG-CD1 4.38Å; R560-F562 HydrophobicContact CG-CE1 3.84Å; R560-F562 PolarHBondContact O-N 3.14Å; R560-F562 VanDerWaalsContact O-N 3.15Å; R560-Q563 HydrophobicContact CB-CG 4.2Å; R560-Q563 VanDerWaalsContact O-CB 3.3Å; R560-Q563 WeakPolarHBondContact O-CB 3.2Å; R560-Q563 PolarHBondContact O-N 2.92Å; R560-L564 PolarHBondContact O-N 2.89Å
561	G	85	Confident	79.8	Confident	6 Å²	6	55 Å²	55	6%	0.062	29%	0.287	C	S	.	.	H	α-helix	trans	-56.8	-33.5	-177.4	0	0	0	0	0	113.5	Q535 D536 Q563 L564 K565	Q535-G561 VanDerWaalsContact C-CA 3.41Å; Q535-G561 VanDerWaalsContact O-CA 3.23Å; Q535-G561 WeakPolarHBondContact O-CA 3.39Å; D536-G561 PolarHBondContact OD1-N 3.43Å; G561-Q563 VanDerWaalsContact C-N 3.3Å; G561-Q563 PolarHBondContact O-N 3.25Å; G561-L564 PolarHBondContact O-N 3.43Å; G561-K565 WeakPolarHBondContact O-CB 3.29Å; G561-K565 PolarHBondContact O-N 2.65Å
562	F	83.7	Confident	80.6	Confident	129 Å²	129	52.4 Å²	52.4	57%	0.566	28%	0.277	S	S	*	.	H	α-helix	trans	-64.7	-31.1	174.5	78.5	-97.9	0	0	0	113.3	R560 K565 L566	R560-F562 HydrophobicContact CB-CD1 3.52Å; R560-F562 HydrophobicContact CB-CE1 3.41Å; R560-F562 VanDerWaalsContact CB-CE1 3.41Å; R560-F562 HydrophobicContact CB-CG 4.47Å; R560-F562 HydrophobicContact CB-CZ 4.28Å; R560-F562 HydrophobicContact CG-CD1 4.38Å; R560-F562 HydrophobicContact CG-CE1 3.84Å; R560-F562 PolarHBondContact O-N 3.14Å; R560-F562 VanDerWaalsContact O-N 3.15Å; F562-K565 PolarHBondContact O-N 2.92Å; F562-L566 HydrophobicContact CD2-CD1 4.32Å; F562-L566 WeakPolarHBondContact O-CB 3.31Å; F562-L566 VanDerWaalsContact O-CG 3.28Å; F562-L566 WeakPolarHBondContact O-CG 3.23Å; F562-L566 PolarHBondContact O-N 2.81Å
563	Q	84.8	Confident	81.9	Confident	51 Å²	51	50.9 Å²	50.9	24%	0.238	26%	0.258	C	S	.	.	H	α-helix	trans	-68.7	-39.6	177.5	-60.5	171.9	-32.8	0	0	110.4	V559 R560 G561 G567 K568	V559-Q563 HydrophobicContact CG1-CB 4.45Å; R560-Q563 HydrophobicContact CB-CG 4.2Å; R560-Q563 VanDerWaalsContact O-CB 3.3Å; R560-Q563 WeakPolarHBondContact O-CB 3.2Å; R560-Q563 PolarHBondContact O-N 2.92Å; G561-Q563 VanDerWaalsContact C-N 3.3Å; G561-Q563 PolarHBondContact O-N 3.25Å; Q563-G567 PolarHBondContact O-N 3.32Å; Q563-K568 WeakPolarHBondContact O-CB 3.49Å; Q563-K568 PolarHBondContact O-N 3.24Å
564	L	85.9	Confident	83.2	Confident	15 Å²	15	45.6 Å²	45.6	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-69.9	-40.7	174.6	-59.4	170.8	0	0	0	111.8	I494 L531 L537 V559 R560 G561 L566 G567	I494-L564 HydrophobicContact CG2-CD2 3.99Å; L531-L564 HydrophobicContact CD2-CD1 4.16Å; L537-L564 HydrophobicContact CB-CD1 4.47Å; L537-L564 HydrophobicContact CD1-CD1 3.48Å; L537-L564 VanDerWaalsContact CD1-CD1 3.48Å; L537-L564 HydrophobicContact CG-CD1 3.63Å; V559-L564 HydrophobicContact CG1-CD1 4.27Å; V559-L564 HydrophobicContact CG1-CD2 3.91Å; V559-L564 HydrophobicContact CG1-CG 3.9Å; R560-L564 PolarHBondContact O-N 2.89Å; G561-L564 PolarHBondContact O-N 3.43Å; L564-L566 VanDerWaalsContact C-N 3.28Å; L564-L566 PolarHBondContact O-N 2.8Å; L564-G567 PolarHBondContact O-N 3.47Å
565	K	85.8	Confident	84.1	Confident	62 Å²	62	43.9 Å²	43.9	27%	0.27	21%	0.213	S	C	.	.	H	α-helix	trans	-57.4	-41.1	174.5	-168	178.6	179.6	-177.8	0	111.7	N367 D369 P534 G561 F562 G567	N367-K565 WeakPolarHBondContact CB-O 3.41Å; D369-K565 WeakPolarHBondContact OD1-CE 3.37Å; D369-K565 IonicContact OD1-NZ 2.65Å; D369-K565 PolarHBondContact OD1-NZ 3.14Å; D369-K565 IonicContact OD2-NZ 3.15Å; P534-K565 HydrophobicContact CB-CB 3.87Å; P534-K565 HydrophobicContact CB-CG 4.34Å; P534-K565 HydrophobicContact CG-CB 4.33Å; P534-K565 HydrophobicContact CG-CD 4.46Å; P534-K565 HydrophobicContact CG-CG 4.27Å; G561-K565 WeakPolarHBondContact O-CB 3.29Å; G561-K565 PolarHBondContact O-N 2.65Å; F562-K565 PolarHBondContact O-N 2.92Å; K565-G567 PolarHBondContact O-N 3.13Å
566	L	84	Confident	84.7	Confident	60 Å²	60	41.1 Å²	41.1	31%	0.314	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	1.2	175.5	-66.7	173.1	0	0	0	114.1	L364 N367 F562 L564 K568	L364-L566 HydrophobicContact CD2-CD1 4.28Å; L364-L566 HydrophobicContact CD2-CD2 4.19Å; N367-L566 PolarHBondContact ND2-O 2.91Å; F562-L566 HydrophobicContact CD2-CD1 4.32Å; F562-L566 WeakPolarHBondContact O-CB 3.31Å; F562-L566 VanDerWaalsContact O-CG 3.28Å; F562-L566 WeakPolarHBondContact O-CG 3.23Å; F562-L566 PolarHBondContact O-N 2.81Å; L564-L566 VanDerWaalsContact C-N 3.28Å; L564-L566 PolarHBondContact O-N 2.8Å; L566-K568 PolarHBondContact O-N 3.41Å
567	G	77.8	Confident	84.7	Confident	8 Å²	8	41.4 Å²	41.4	8%	0.082	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	9.2	-178.7	0	0	0	0	0	115.3	P362 Q563 L564 K565	P362-G567 VanDerWaalsContact CD-O 3.29Å; P362-G567 WeakPolarHBondContact CD-O 3.5Å; Q563-G567 PolarHBondContact O-N 3.32Å; L564-G567 PolarHBondContact O-N 3.47Å; K565-G567 PolarHBondContact O-N 3.13Å
568	K	83.5	Confident	84.4	Confident	86 Å²	86	39.8 Å²	39.8	37%	0.374	19%	0.193	S	C	.	.			trans	-70.6	135.4	-172.5	-172.5	173.6	-176.8	170.1	0	112.1	Q563 L566 S570	Q563-K568 WeakPolarHBondContact O-CB 3.49Å; Q563-K568 PolarHBondContact O-N 3.24Å; L566-K568 PolarHBondContact O-N 3.41Å; K568-S570 PolarHBondContact O-N 3.27Å; K568-S570 VanDerWaalsContact O-N 3.15Å
569	V	85.6	Confident	83.7	Confident	4 Å²	4	41.5 Å²	41.5	2%	0.024	20%	0.197	C	C	.	.			trans	-78	104.9	-177.1	176.3	0	0	0	0	110	L360 D361 T493 I494 F495 R571	L360-V569 HydrophobicContact CB-CG2 4.08Å; L360-V569 WeakPolarHBondContact O-CG2 3.46Å; D361-V569 WeakPolarHBondContact OD1-CB 3.36Å; D361-V569 PolarHBondContact OD1-N 2.85Å; T493-V569 HydrophobicContact CG2-CG1 3.28Å; I494-V569 WeakPolarHBondContact O-CA 3.28Å; F495-V569 HydrophobicContact CD1-CB 4.4Å; F495-V569 HydrophobicContact CD1-CG1 3.57Å; F495-V569 HydrophobicContact CD1-CG2 3.85Å; F495-V569 HydrophobicContact CE1-CG1 3.65Å; F495-V569 HydrophobicContact CG-CG1 4.43Å; V569-R571 HydrophobicContact CG1-CG 4.2Å; V569-R571 PolarHBondContact O-NH1 3.3Å
570	S	84.6	Confident	83	Confident	11 Å²	11	45.1 Å²	45.1	8%	0.077	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	125.9	-175.7	-63.8	0	0	0	0	110.6	T493 I494 V559 K568	T493-S570 CarbonylContact C-O 3.4Å; T493-S570 WeakPolarHBondContact CA-O 3.36Å; I494-S570 PolarHBondContact N-O 2.99Å; I494-S570 PolarHBondContact O-N 3.06Å; I494-S570 VanDerWaalsContact O-N 3.14Å; V559-S570 WeakPolarHBondContact CG1-OG 3.47Å; K568-S570 PolarHBondContact O-N 3.27Å; K568-S570 VanDerWaalsContact O-N 3.15Å
571	R	84.6	Confident	81.8	Confident	62 Å²	62	40.9 Å²	40.9	23%	0.234	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	112.7	-168.9	-61.8	165.1	178.1	94.3	-15.3	109.2	T312 D361 V491 T493 V569	T312-R571 PolarHBondContact O-NE 2.98Å; T312-R571 WeakPolarHBondContact OG1-CD 3.39Å; D361-R571 IonicContact OD1-NH1 2.76Å; D361-R571 PolarHBondContact OD1-NH1 3.4Å; D361-R571 IonicContact OD2-CZ 2.72Å; D361-R571 VanDerWaalsContact OD2-CZ 3.31Å; D361-R571 IonicContact OD2-NH1 2.73Å; D361-R571 PolarHBondContact OD2-NH1 2.94Å; D361-R571 IonicContact OD2-NH2 2.69Å; D361-R571 PolarHBondContact OD2-NH2 2.98Å; V491-R571 HydrophobicContact CG1-CB 4.23Å; T493-R571 HydrophobicContact CG2-CG 3.79Å; V569-R571 HydrophobicContact CG1-CG 4.2Å; V569-R571 PolarHBondContact O-NH1 3.3Å
572	L	86.1	Confident	80.6	Confident	21 Å²	21	46.8 Å²	46.8	11%	0.11	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	112.7	-169.3	-56.4	176.5	0	0	0	110.8	V491 V492 V539 K557 V559 F574	V491-L572 CarbonylContact C-O 3.58Å; V491-L572 VanDerWaalsContact CA-O 3.29Å; V491-L572 WeakPolarHBondContact CA-O 3.25Å; V492-L572 HydrophobicContact CB-CB 4.43Å; V492-L572 PolarHBondContact N-O 2.98Å; V492-L572 WeakPolarHBondContact O-CB 3.38Å; V492-L572 PolarHBondContact O-N 3.25Å; V539-L572 HydrophobicContact CB-CD1 3.59Å; V539-L572 HydrophobicContact CG1-CD1 4.05Å; V539-L572 HydrophobicContact CG2-CD1 3.6Å; K557-L572 HydrophobicContact CB-CD1 4.34Å; K557-L572 HydrophobicContact CB-CD2 4.17Å; V559-L572 HydrophobicContact CG2-CD1 3.87Å; V559-L572 HydrophobicContact CG2-CD2 3.87Å; V559-L572 HydrophobicContact CG2-CG 4.13Å; L572-F574 HydrophobicContact CB-CD2 4.35Å; L572-F574 HydrophobicContact CB-CE2 3.67Å; L572-F574 HydrophobicContact CB-CZ 4.38Å; L572-F574 HydrophobicContact CD1-CE2 4.35Å; L572-F574 WeakPolarHBondContact O-CD2 3.24Å
573	I	83.9	Confident	79.8	Confident	44 Å²	44	46.1 Å²	46.1	23%	0.226	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	128.2	179.8	-49.6	177.2	0	0	0	109.8	L303 K489 T490 V491 K557	L303-I573 HydrophobicContact CD1-CD1 4.43Å; K489-I573 HydrophobicContact CB-CG2 3.88Å; K489-I573 HydrophobicContact CD-CG2 3.76Å; K489-I573 HydrophobicContact CG-CG2 4.41Å; T490-I573 CarbonylContact O-C 3.6Å; T490-I573 WeakPolarHBondContact O-CA 3.41Å; V491-I573 HydrophobicContact CG2-CG1 4.2Å; K557-I573 WeakPolarHBondContact CD-O 3.3Å; K557-I573 WeakPolarHBondContact CE-O 3.45Å; K557-I573 PolarHBondContact NZ-O 3.35Å
574	F	83.6	Confident	79.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	118.8	173.4	-66.8	-92.2	0	0	0	110.9	K489 T490 V492 V539 M541 V550 E554 K557 L572	K489-F574 WeakPolarHBondContact CA-O 3.41Å; T490-F574 PolarHBondContact N-O 3.26Å; T490-F574 PolarHBondContact O-N 3.09Å; T490-F574 PolarHBondContact OG1-O 2.94Å; T490-F574 VanDerWaalsContact OG1-O 3.1Å; V492-F574 HydrophobicContact CB-CD2 4.38Å; V492-F574 HydrophobicContact CB-CE2 4.01Å; V492-F574 HydrophobicContact CG2-CD2 3.86Å; V492-F574 HydrophobicContact CG2-CE2 3.74Å; V539-F574 HydrophobicContact CG1-CE2 4.33Å; V539-F574 HydrophobicContact CG1-CZ 4.16Å; M541-F574 HydrophobicContact CB-CD1 4.01Å; M541-F574 HydrophobicContact CB-CE1 4.11Å; M541-F574 HydrophobicContact CB-CG 4.23Å; M541-F574 HydrophobicContact CB-CZ 4.42Å; M541-F574 HydrophobicContact CE-CB 3.41Å; M541-F574 VanDerWaalsContact CE-CB 3.41Å; M541-F574 HydrophobicContact CE-CG 4.04Å; M541-F574 HydrophobicContact SD-CB 4.01Å; M541-F574 HydrophobicContact SD-CD2 4.36Å; M541-F574 HydrophobicContact SD-CG 4.18Å; V550-F574 HydrophobicContact CG1-CD1 4.5Å; E554-F574 VanDerWaalsContact O-CD1 3.29Å; E554-F574 WeakPolarHBondContact O-CD1 3.4Å; E554-F574 WeakPolarHBondContact O-CE1 3.29Å; K557-F574 HydrophobicContact CB-CE1 4.3Å; K557-F574 HydrophobicContact CB-CZ 3.96Å; K557-F574 HydrophobicContact CD-CD1 4.39Å; K557-F574 HydrophobicContact CD-CE1 4.09Å; K557-F574 HydrophobicContact CD-CZ 4.25Å; K557-F574 HydrophobicContact CG-CE1 3.81Å; K557-F574 HydrophobicContact CG-CZ 3.96Å; L572-F574 HydrophobicContact CB-CD2 4.35Å; L572-F574 HydrophobicContact CB-CE2 3.67Å; L572-F574 HydrophobicContact CB-CZ 4.38Å; L572-F574 HydrophobicContact CD1-CE2 4.35Å; L572-F574 WeakPolarHBondContact O-CD2 3.24Å
575	P	82.9	Confident	78.6	Confident	8 Å²	8	46.6 Å²	46.6	5%	0.052	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	143.1	172.6	31.3	-31.9	0	0	0	111.6	K489 K551 E554	K489-P575 HydrophobicContact CD-CB 4.21Å; K489-P575 HydrophobicContact CG-CB 4.13Å; K551-P575 HydrophobicContact CD-CG 4.45Å; E554-P575 WeakPolarHBondContact OE1-CG 3.17Å; E554-P575 VanDerWaalsContact OE2-CD 3.3Å; E554-P575 WeakPolarHBondContact OE2-CD 3.24Å
576	I	84.3	Confident	78.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.2	177.1	-48.1	-176.2	0	0	0	108.3	S487 F488 T490 M541 Y548 V550 F587 L589	S487-I576 WeakPolarHBondContact CA-O 3.31Å; F488-I576 HydrophobicContact CE1-CB 4.21Å; F488-I576 HydrophobicContact CE1-CG2 4.3Å; F488-I576 HydrophobicContact CE2-CB 4.27Å; F488-I576 HydrophobicContact CE2-CD1 3.73Å; F488-I576 HydrophobicContact CE2-CG1 4.31Å; F488-I576 HydrophobicContact CZ-CB 4.04Å; F488-I576 HydrophobicContact CZ-CD1 3.88Å; F488-I576 HydrophobicContact CZ-CG1 4.45Å; F488-I576 HydrophobicContact CZ-CG2 4.2Å; F488-I576 PolarHBondContact N-O 3.23Å; F488-I576 PolarHBondContact O-N 3Å; T490-I576 HydrophobicContact CG2-CD1 3.61Å; T490-I576 HydrophobicContact CG2-CG1 4.39Å; M541-I576 HydrophobicContact CE-CD1 3.59Å; M541-I576 HydrophobicContact CE-CG1 3.71Å; Y548-I576 HydrophobicContact CD1-CG2 4.48Å; V550-I576 HydrophobicContact CG2-CG1 4.34Å; I576-F587 HydrophobicContact CD1-CZ 4.49Å; I576-F587 HydrophobicContact CG2-CZ 4.14Å; I576-L589 HydrophobicContact CD1-CD1 3.65Å; I576-L589 HydrophobicContact CD1-CD2 3.91Å; I576-L589 HydrophobicContact CD1-CG 4.37Å
577	T	81.6	Confident	78.2	Confident	48 Å²	48	43 Å²	43	29%	0.294	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	134.6	179.2	41.3	0	0	0	0	110.6	E549	E549-T577 PolarHBondContact N-O 2.91Å; E549-T577 PolarHBondContact O-N 2.91Å; E549-T577 PolarHBondContact O-OG1 3.49Å
578	S	80.5	Confident	78.6	Confident	17 Å²	17	44.9 Å²	44.9	12%	0.119	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	137.2	171.9	-173.8	0	0	0	0	110.8	P486 N547 N580	P486-S578 PolarHBondContact O-N 3.01Å; N547-S578 CarbonylContact O-C 3.57Å; N547-S578 WeakPolarHBondContact O-CA 3.28Å; N547-S578 WeakPolarHBondContact O-CB 3.13Å; N547-S578 PolarHBondContact O-OG 3.35Å; S578-N580 VanDerWaalsContact C-N 3.31Å; S578-N580 PolarHBondContact OG-N 3.47Å; S578-N580 PolarHBondContact OG-O 2.55Å
579	Q	74.1	Confident	78.9	Confident	110 Å²	110	40.8 Å²	40.8	51%	0.514	22%	0.217	S	C	.	.	S	Bend	trans	-73	-26.5	172	-62.3	-175.5	-9.4	0	0	111.6	T546 N547 E549	T546-Q579 PolarHBondContact O-OE1 2.6Å; N547-Q579 PolarHBondContact O-N 3.22Å; E549-Q579 PolarHBondContact OE2-NE2 3.12Å
580	N	71.6	Confident	79.1	Confident	76 Å²	76	44.9 Å²	44.9	41%	0.406	23%	0.232	S	C	.	.			trans	-128.5	88.5	-175.6	-78.9	-44.2	0	0	0	111.6	S578 N582 E583	S578-N580 VanDerWaalsContact C-N 3.31Å; S578-N580 PolarHBondContact OG-N 3.47Å; S578-N580 PolarHBondContact OG-O 2.55Å; N580-N582 PolarHBondContact O-N 3.32Å; N580-E583 HydrophobicContact CB-CB 4.42Å; N580-E583 PolarHBondContact O-N 3.22Å
581	P	64.9	Low	79.5	Confident	41 Å²	41	44.4 Å²	44.4	27%	0.266	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-14.6	-171.3	25.9	-35.5	0	0	0	115.3	P486	P486-P581 HydrophobicContact CB-CB 3.64Å; P486-P581 HydrophobicContact CG-CB 4.15Å
582	N	59.6	Low	79.9	Confident	129 Å²	129	42.5 Å²	42.5	69%	0.69	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-14.9	177	-63	-26.9	0	0	0	113.2	N580 K614	N580-N582 PolarHBondContact O-N 3.32Å; N582-K614 WeakPolarHBondContact O-CE 3.2Å; N582-K614 PolarHBondContact O-NZ 3.37Å
583	E	66.9	Low	80.3	Confident	115 Å²	115	41.5 Å²	41.5	54%	0.537	22%	0.217	S	C	.	.			trans	-120.6	54.3	-171.7	-63.4	-161.7	151.1	0	0	112.3	N580 S585	N580-E583 HydrophobicContact CB-CB 4.42Å; N580-E583 PolarHBondContact O-N 3.22Å; E583-S585 PolarHBondContact O-N 3.39Å
584	L	70.9	Confident	80.7	Confident	37 Å²	37	41 Å²	41	19%	0.194	21%	0.213	C	C	.	.			trans	-68.8	110.5	173.2	-50.8	177.1	0	0	0	110.7	P486 Y548 P611	P486-L584 HydrophobicContact CB-CD2 4.07Å; Y548-L584 HydrophobicContact CE1-CD2 4.34Å; Y548-L584 WeakPolarHBondContact OH-CA 3.49Å; L584-P611 HydrophobicContact CB-CB 4Å; L584-P611 WeakPolarHBondContact O-CG 3.43Å
585	S	72.9	Confident	81	Confident	39 Å²	39	42 Å²	42	27%	0.273	22%	0.219	S	C	.	.			trans	-106.1	166	163.4	65.6	0	0	0	0	110.6	I484 Y548 E583	I484-S585 WeakPolarHBondContact CD1-O 3.22Å; Y548-S585 WeakPolarHBondContact CE2-O 3.19Å; Y548-S585 PolarHBondContact OH-N 2.93Å; Y548-S585 PolarHBondContact OH-O 3.46Å; E583-S585 PolarHBondContact O-N 3.39Å
586	D	77.6	Confident	81.1	Confident	45 Å²	45	45.7 Å²	45.7	24%	0.241	24%	0.238	C	C	.	.			trans	-72.8	151.6	154.9	57	-51.5	0	0	0	110.8	I484 Q607	I484-D586 HydrophobicContact CD1-CB 4.12Å; D586-Q607 PolarHBondContact OD2-NE2 2.87Å
587	F	84.6	Confident	81.2	Confident	2 Å²	2	53 Å²	53	1%	0.009	27%	0.272	C	S	.	.			trans	-145.2	174	-177.4	65.3	-75.8	0	0	0	110.1	I484 F488 M545 Y548 I576 L589 T608	I484-F587 HydrophobicContact CD1-CD1 4.21Å; I484-F587 HydrophobicContact CD1-CE1 4.25Å; I484-F587 HydrophobicContact CG2-CE1 4.35Å; F488-F587 HydrophobicContact CZ-CE1 4.34Å; F488-F587 HydrophobicContact CZ-CZ 4.11Å; M545-F587 HydrophobicContact CB-CB 4.23Å; M545-F587 HydrophobicContact CG-CB 4.02Å; M545-F587 HydrophobicContact SD-CB 3.69Å; Y548-F587 HydrophobicContact CD1-CD1 4.43Å; Y548-F587 AromaticContact CD1-CE1 3.82Å; Y548-F587 HydrophobicContact CD1-CE1 3.82Å; Y548-F587 HydrophobicContact CD1-CZ 4.06Å; Y548-F587 HydrophobicContact CD2-CB 4.23Å; Y548-F587 AromaticContact CD2-CD1 3.37Å; Y548-F587 HydrophobicContact CD2-CD1 3.37Å; Y548-F587 HydrophobicContact CD2-CD2 4.17Å; Y548-F587 AromaticContact CD2-CE1 3.61Å; Y548-F587 HydrophobicContact CD2-CE1 3.61Å; Y548-F587 HydrophobicContact CD2-CE2 4.35Å; Y548-F587 AromaticContact CD2-CG 3.69Å; Y548-F587 HydrophobicContact CD2-CG 3.69Å; Y548-F587 HydrophobicContact CD2-CZ 4.1Å; Y548-F587 HydrophobicContact CE1-CD1 4.42Å; Y548-F587 AromaticContact CE1-CE1 3.92Å; Y548-F587 HydrophobicContact CE1-CE1 3.92Å; Y548-F587 HydrophobicContact CE2-CB 4.45Å; Y548-F587 AromaticContact CE2-CD1 3.35Å; Y548-F587 HydrophobicContact CE2-CD1 3.35Å; Y548-F587 AromaticContact CE2-CE1 3.7Å; Y548-F587 HydrophobicContact CE2-CE1 3.7Å; Y548-F587 HydrophobicContact CE2-CG 4.04Å; Y548-F587 AromaticContact CG-CD1 3.92Å; Y548-F587 HydrophobicContact CG-CD1 3.92Å; Y548-F587 HydrophobicContact CG-CD2 4.41Å; Y548-F587 AromaticContact CG-CE1 3.65Å; Y548-F587 HydrophobicContact CG-CE1 3.65Å; Y548-F587 HydrophobicContact CG-CE2 4.16Å; Y548-F587 HydrophobicContact CG-CG 4.3Å; Y548-F587 AromaticContact CG-CZ 3.78Å; Y548-F587 HydrophobicContact CG-CZ 3.78Å; Y548-F587 AromaticContact CZ-CD1 3.9Å; Y548-F587 AromaticContact CZ-CE1 3.84Å; I576-F587 HydrophobicContact CD1-CZ 4.49Å; I576-F587 HydrophobicContact CG2-CZ 4.14Å; F587-L589 HydrophobicContact CD2-CG 4.39Å; F587-L589 HydrophobicContact CE2-CD1 4.44Å; F587-L589 HydrophobicContact CE2-CD2 3.74Å; F587-L589 HydrophobicContact CE2-CG 3.75Å; F587-L589 HydrophobicContact CZ-CG 4.4Å; F587-T608 HydrophobicContact CD1-CG2 3.93Å; F587-T608 HydrophobicContact CD2-CG2 4.33Å; F587-T608 HydrophobicContact CE1-CG2 3.72Å; F587-T608 HydrophobicContact CE2-CG2 4.15Å; F587-T608 HydrophobicContact CG-CG2 4.23Å; F587-T608 HydrophobicContact CZ-CG2 3.83Å; F587-T608 PolarHBondContact N-OG1 3.04Å; F587-T608 PolarHBondContact O-N 2.9Å; F587-T608 PolarHBondContact O-OG1 3.39Å
588	T	86.7	Confident	81.4	Confident	47 Å²	47	54.8 Å²	54.8	29%	0.288	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125.8	176.5	-59.7	0	0	0	0	109.7	N544 C605 V606	N544-T588 WeakPolarHBondContact CB-O 3.27Å; N544-T588 PolarHBondContact N-O 3.21Å; T588-C605 HydrophobicContact CG2-CB 3.49Å; T588-C605 VanDerWaalsContact CG2-CB 3.49Å; T588-V606 WeakPolarHBondContact CA-O 3.38Å
589	L	89.5	Confident	81.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	126.5	165.6	-78.7	169.9	0	0	0	109.5	L478 T490 W524 M541 I576 F587 C605 V606 T608	L478-L589 HydrophobicContact CD2-CB 4.13Å; L478-L589 HydrophobicContact CD2-CD1 4Å; T490-L589 HydrophobicContact CG2-CD1 4.38Å; W524-L589 HydrophobicContact CE3-CD1 4.23Å; W524-L589 HydrophobicContact CZ3-CD1 3.74Å; M541-L589 HydrophobicContact CE-CD2 4.04Å; M541-L589 HydrophobicContact CG-CD2 4.15Å; M541-L589 HydrophobicContact SD-CD1 4.27Å; M541-L589 HydrophobicContact SD-CD2 4.14Å; I576-L589 HydrophobicContact CD1-CD1 3.65Å; I576-L589 HydrophobicContact CD1-CD2 3.91Å; I576-L589 HydrophobicContact CD1-CG 4.37Å; F587-L589 HydrophobicContact CD2-CG 4.39Å; F587-L589 HydrophobicContact CE2-CD1 4.44Å; F587-L589 HydrophobicContact CE2-CD2 3.74Å; F587-L589 HydrophobicContact CE2-CG 3.75Å; F587-L589 HydrophobicContact CZ-CG 4.4Å; L589-C605 CarbonylContact O-C 3.35Å; L589-C605 WeakPolarHBondContact O-CA 3.47Å; L589-V606 PolarHBondContact N-O 3.38Å; L589-V606 PolarHBondContact O-N 3.42Å; L589-T608 HydrophobicContact CD1-CG2 4.05Å; L589-T608 HydrophobicContact CG-CG2 4.21Å
590	R	90.4	Very high	82.6	Confident	91 Å²	91	55.4 Å²	55.4	34%	0.343	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	114.6	171.3	-169.1	-173.3	-52.9	-170.3	6.9	108.3	F542 N544 F604	F542-R590 HydrophobicContact CB-CB 4.47Å; F542-R590 PolarHBondContact N-O 3.25Å; F542-R590 PolarHBondContact O-N 2.81Å; N544-R590 PolarHBondContact OD1-NH2 2.94Å; R590-F604 WeakPolarHBondContact CA-O 3.47Å
591	V	93	Very high	83.5	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	129	168.5	-178.9	0	0	0	0	107.5	L478 V492 V539 M541 Q603 F604	L478-V591 HydrophobicContact CD1-CG2 4.46Å; L478-V591 HydrophobicContact CD2-CG2 4.34Å; V492-V591 HydrophobicContact CG1-CG1 4.31Å; V492-V591 HydrophobicContact CG2-CG1 4.5Å; V492-V591 HydrophobicContact CG2-CG2 4.28Å; V539-V591 HydrophobicContact CG1-CG1 4.06Å; M541-V591 HydrophobicContact CG-CG2 4.35Å; V591-Q603 CarbonylContact O-C 3.58Å; V591-Q603 VanDerWaalsContact O-CA 3.31Å; V591-Q603 WeakPolarHBondContact O-CA 3.36Å; V591-F604 HydrophobicContact CB-CD1 4.21Å; V591-F604 HydrophobicContact CB-CE1 3.71Å; V591-F604 HydrophobicContact CB-CE2 4.11Å; V591-F604 HydrophobicContact CB-CZ 3.65Å; V591-F604 HydrophobicContact CG1-CE1 3.71Å; V591-F604 HydrophobicContact CG1-CZ 3.83Å; V591-F604 HydrophobicContact CG2-CE2 4.24Å; V591-F604 HydrophobicContact CG2-CZ 4.05Å; V591-F604 PolarHBondContact N-O 3.47Å; V591-F604 PolarHBondContact O-N 2.76Å
592	Q	93.3	Very high	84.8	Confident	22 Å²	22	53.3 Å²	53.3	10%	0.103	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	127.6	178.8	-180	-178.5	83.7	0	0	108.3	C540 F542 K594 I600 Q603	C540-Q592 HydrophobicContact CB-CB 4.36Å; C540-Q592 PolarHBondContact N-O 3.43Å; C540-Q592 PolarHBondContact O-N 3.08Å; F542-Q592 HydrophobicContact CE2-CB 4.25Å; Q592-K594 HydrophobicContact CG-CG 4.43Å; Q592-I600 HydrophobicContact CG-CG1 4.22Å; Q592-I600 HydrophobicContact CG-CG2 3.91Å; Q592-Q603 HydrophobicContact CB-CB 4.37Å; Q592-Q603 HydrophobicContact CG-CB 4.38Å
593	V	93.7	Very high	86.3	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	121.1	175.1	-173.1	0	0	0	0	108.1	V476 F529 L537 V539 L601 T602	V476-V593 HydrophobicContact CG2-CG2 4.3Å; F529-V593 HydrophobicContact CZ-CG1 4.18Å; L537-V593 HydrophobicContact CB-CG1 4.18Å; L537-V593 HydrophobicContact CD1-CG1 4.06Å; L537-V593 HydrophobicContact CD2-CG1 4.31Å; L537-V593 HydrophobicContact CG-CG1 4.43Å; V539-V593 HydrophobicContact CG2-CG2 4.42Å; V593-L601 PolarHBondContact O-N 2.74Å; V593-T602 HydrophobicContact CB-CG2 3.82Å; V593-T602 HydrophobicContact CG2-CG2 3.89Å; V593-T602 PolarHBondContact N-O 3.38Å; V593-T602 PolarHBondContact O-N 3.43Å
594	K	92.3	Very high	87.6	Confident	33 Å²	33	47.5 Å²	47.5	14%	0.143	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	158.6	176.1	-71.8	160.6	157.5	-99.8	0	111.5	L537 K538 Q592 E598 A599 I600	L537-K594 WeakPolarHBondContact CA-O 3.26Å; K538-K594 HydrophobicContact CB-CB 4.19Å; K538-K594 HydrophobicContact CD-CD 4.35Å; K538-K594 PolarHBondContact N-O 3.14Å; K538-K594 PolarHBondContact O-N 2.81Å; Q592-K594 HydrophobicContact CG-CG 4.43Å; K594-E598 WeakPolarHBondContact CD-OE2 3.47Å; K594-E598 PolarHBondContact NZ-O 2.61Å; K594-E598 IonicContact NZ-OE2 3.63Å; K594-E598 PolarHBondContact NZ-OE2 3.04Å; K594-A599 CarbonylContact C-O 3.57Å; K594-A599 WeakPolarHBondContact CA-O 3.24Å; K594-A599 WeakPolarHBondContact CB-O 3.41Å; K594-I600 HydrophobicContact CG-CG1 4.35Å
595	D	90	Very high	88.5	Confident	23 Å²	23	49.6 Å²	49.6	12%	0.123	26%	0.261	C	S	.	.			trans	-86.7	-172.1	168.3	61.2	22	0	0	0	113.2	Q597 E598 A599 L601	D595-Q597 PolarHBondContact O-N 3.46Å; D595-Q597 VanDerWaalsContact OD1-C 3.27Å; D595-Q597 VanDerWaalsContact OD1-CA 3.31Å; D595-Q597 WeakPolarHBondContact OD1-CA 3.46Å; D595-Q597 WeakPolarHBondContact OD1-CB 3.5Å; D595-Q597 PolarHBondContact OD1-N 2.98Å; D595-E598 PolarHBondContact O-N 2.9Å; D595-E598 PolarHBondContact OD1-N 3.39Å; D595-E598 VanDerWaalsContact OD1-N 3.13Å; D595-A599 PolarHBondContact N-O 2.79Å; D595-A599 PolarHBondContact OD1-N 3.39Å; D595-L601 HydrophobicContact CB-CD1 4.03Å; D595-L601 HydrophobicContact CB-CD2 4.09Å; D595-L601 HydrophobicContact CB-CG 4.06Å
596	D	84.4	Confident	89.3	Confident	84 Å²	84	48.3 Å²	48.3	45%	0.449	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-9.8	174	54.5	-27.6	0	0	0	113.9	R533 D536	R533-D596 IonicContact CZ-OD1 2.73Å; R533-D596 IonicContact CZ-OD2 3.67Å; R533-D596 IonicContact NH1-OD2 3.72Å; R533-D596 IonicContact NH2-OD1 3.82Å; R533-D596 PolarHBondContact NH2-OD1 2.84Å; R533-D596 IonicContact NH2-OD2 3.91Å; R533-D596 PolarHBondContact NH2-OD2 2.67Å; D536-D596 PolarHBondContact O-N 3.45Å
597	Q	86.6	Confident	89.7	Confident	153 Å²	153	52.2 Å²	52.2	72%	0.715	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	12.8	175.3	-54.7	-173.3	10.9	0	0	112.2	D595 A599	D595-Q597 PolarHBondContact O-N 3.46Å; D595-Q597 VanDerWaalsContact OD1-C 3.27Å; D595-Q597 VanDerWaalsContact OD1-CA 3.31Å; D595-Q597 WeakPolarHBondContact OD1-CA 3.46Å; D595-Q597 WeakPolarHBondContact OD1-CB 3.5Å; D595-Q597 PolarHBondContact OD1-N 2.98Å; Q597-A599 PolarHBondContact O-N 3.24Å; Q597-A599 VanDerWaalsContact O-N 3.13Å
598	E	85	Confident	89.6	Confident	86 Å²	86	52.3 Å²	52.3	40%	0.402	27%	0.268	S	S	.	.	S	Bend	trans	61.3	7.1	-173.6	-66.6	-75.8	153.2	0	0	115.1	K538 K594 D595	K538-E598 WeakPolarHBondContact CD-OE1 3.13Å; K538-E598 WeakPolarHBondContact CE-OE1 3.48Å; K538-E598 IonicContact NZ-OE1 3.61Å; K538-E598 PolarHBondContact NZ-OE1 3.39Å; K538-E598 IonicContact NZ-OE2 3.78Å; K538-E598 PolarHBondContact NZ-OE2 2.96Å; K594-E598 WeakPolarHBondContact CD-OE2 3.47Å; K594-E598 PolarHBondContact NZ-O 2.61Å; K594-E598 IonicContact NZ-OE2 3.63Å; K594-E598 PolarHBondContact NZ-OE2 3.04Å; D595-E598 PolarHBondContact O-N 2.9Å; D595-E598 PolarHBondContact OD1-N 3.39Å; D595-E598 VanDerWaalsContact OD1-N 3.13Å
599	A	89.3	Confident	89.3	Confident	48 Å²	48	51.9 Å²	51.9	40%	0.397	27%	0.267	S	S	.	.			trans	-77.3	149.5	177.7	0	0	0	0	0	111	K594 D595 Q597 L601	K594-A599 CarbonylContact C-O 3.57Å; K594-A599 WeakPolarHBondContact CA-O 3.24Å; K594-A599 WeakPolarHBondContact CB-O 3.41Å; D595-A599 PolarHBondContact N-O 2.79Å; D595-A599 PolarHBondContact OD1-N 3.39Å; Q597-A599 PolarHBondContact O-N 3.24Å; Q597-A599 VanDerWaalsContact O-N 3.13Å; A599-L601 PolarHBondContact O-N 2.87Å
600	I	90.8	Very high	88.3	Confident	92 Å²	92	58.6 Å²	58.6	47%	0.472	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	107.8	-169.8	-57.9	162.8	0	0	0	109.8	Q592 K594 Q603	Q592-I600 HydrophobicContact CG-CG1 4.22Å; Q592-I600 HydrophobicContact CG-CG2 3.91Å; K594-I600 HydrophobicContact CG-CG1 4.35Å; I600-Q603 HydrophobicContact CG2-CB 4.35Å
601	L	90.3	Very high	86.9	Confident	59 Å²	59	55.4 Å²	55.4	31%	0.309	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	-38.7	176.1	-59.7	175.7	0	0	0	112.1	F529 L531 L537 V593 D595 A599	F529-L601 HydrophobicContact CD2-CB 4.37Å; F529-L601 HydrophobicContact CE2-CB 4.09Å; F529-L601 HydrophobicContact CE2-CD1 4.22Å; L531-L601 HydrophobicContact CD1-CD1 3.98Å; L537-L601 HydrophobicContact CD2-CD1 3.39Å; V593-L601 PolarHBondContact O-N 2.74Å; D595-L601 HydrophobicContact CB-CD1 4.03Å; D595-L601 HydrophobicContact CB-CD2 4.09Å; D595-L601 HydrophobicContact CB-CG 4.06Å; A599-L601 PolarHBondContact O-N 2.87Å
602	T	92.6	Very high	85.1	Confident	15 Å²	15	57 Å²	57	9%	0.092	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	153.1	171.3	177.8	0	0	0	0	111	H527 F529 V593	H527-T602 PolarHBondContact CD2-OG1 2.62Å; H527-T602 VanDerWaalsContact CD2-OG1 3.28Å; H527-T602 PolarHBondContact NE2-OG1 2.75Å; F529-T602 HydrophobicContact CB-CG2 4.05Å; F529-T602 HydrophobicContact CD1-CG2 3.64Å; F529-T602 HydrophobicContact CD2-CG2 4Å; F529-T602 HydrophobicContact CE1-CG2 4.03Å; F529-T602 HydrophobicContact CE2-CG2 4.36Å; F529-T602 HydrophobicContact CG-CG2 3.63Å; F529-T602 HydrophobicContact CZ-CG2 4.38Å; V593-T602 HydrophobicContact CB-CG2 3.82Å; V593-T602 HydrophobicContact CG2-CG2 3.89Å; V593-T602 PolarHBondContact N-O 3.38Å; V593-T602 PolarHBondContact O-N 3.43Å
603	Q	92.6	Very high	82.9	Confident	101 Å²	101	61.8 Å²	61.8	47%	0.472	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	139.4	163.5	60.2	179.8	-3.7	0	0	109.6	V591 Q592 I600	V591-Q603 CarbonylContact O-C 3.58Å; V591-Q603 VanDerWaalsContact O-CA 3.31Å; V591-Q603 WeakPolarHBondContact O-CA 3.36Å; Q592-Q603 HydrophobicContact CB-CB 4.37Å; Q592-Q603 HydrophobicContact CG-CB 4.38Å; I600-Q603 HydrophobicContact CG2-CB 4.35Å
604	F	92.9	Very high	80.7	Confident	20 Å²	20	68.6 Å²	68.6	9%	0.088	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	151.4	175.9	65.1	-83.2	0	0	0	111.4	V476 H527 R590 V591 V606	V476-F604 HydrophobicContact CB-CE1 3.94Å; V476-F604 HydrophobicContact CB-CZ 3.97Å; V476-F604 HydrophobicContact CG1-CE1 3.93Å; V476-F604 HydrophobicContact CG1-CZ 3.75Å; H527-F604 HydrophobicContact CB-CB 4.07Å; H527-F604 HydrophobicContact CB-CD1 3.53Å; H527-F604 HydrophobicContact CB-CD2 3.78Å; H527-F604 HydrophobicContact CB-CE1 3.8Å; H527-F604 HydrophobicContact CB-CE2 4.02Å; H527-F604 HydrophobicContact CB-CG 3.52Å; H527-F604 HydrophobicContact CB-CZ 4.03Å; H527-F604 AromaticContact CD2-CD1 3.81Å; H527-F604 AromaticContact CG-CD1 3.69Å; H527-F604 AromaticContact CG-CG 3.81Å; R590-F604 WeakPolarHBondContact CA-O 3.47Å; V591-F604 HydrophobicContact CB-CD1 4.21Å; V591-F604 HydrophobicContact CB-CE1 3.71Å; V591-F604 HydrophobicContact CB-CE2 4.11Å; V591-F604 HydrophobicContact CB-CZ 3.65Å; V591-F604 HydrophobicContact CG1-CE1 3.71Å; V591-F604 HydrophobicContact CG1-CZ 3.83Å; V591-F604 HydrophobicContact CG2-CE2 4.24Å; V591-F604 HydrophobicContact CG2-CZ 4.05Å; V591-F604 PolarHBondContact N-O 3.47Å; V591-F604 PolarHBondContact O-N 2.76Å; F604-V606 HydrophobicContact CD2-CG2 3.67Å; F604-V606 HydrophobicContact CE2-CG2 3.66Å
605	C	90.3	Very high	78.1	Confident	82 Å²	82	72.3 Å²	72.3	55%	0.554	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.8	-179.4	-77.7	0	0	0	0	109.8	T588 L589	T588-C605 HydrophobicContact CG2-CB 3.49Å; T588-C605 VanDerWaalsContact CG2-CB 3.49Å; L589-C605 CarbonylContact O-C 3.35Å; L589-C605 WeakPolarHBondContact O-CA 3.47Å
606	V	88.8	Confident	75.1	Confident	11 Å²	11	75.5 Å²	75.5	7%	0.067	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	123.2	175.9	-175.2	0	0	0	0	108.6	L478 W524 T588 L589 F604	L478-V606 HydrophobicContact CB-CG2 4.42Å; L478-V606 HydrophobicContact CD2-CB 3.8Å; L478-V606 HydrophobicContact CD2-CG1 4.06Å; L478-V606 HydrophobicContact CD2-CG2 3.96Å; W524-V606 HydrophobicContact CB-CG1 3.72Å; T588-V606 WeakPolarHBondContact CA-O 3.38Å; L589-V606 PolarHBondContact N-O 3.38Å; L589-V606 PolarHBondContact O-N 3.42Å; F604-V606 HydrophobicContact CD2-CG2 3.67Å; F604-V606 HydrophobicContact CE2-CG2 3.66Å
607	Q	86.3	Confident	72.7	Confident	128 Å²	128	78.9 Å²	78.9	60%	0.598	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	126.9	170.8	-173.3	175.7	3	0	0	109	D586	D586-Q607 PolarHBondContact OD2-NE2 2.87Å
608	T	83.6	Confident	70	Confident	3 Å²	3	80 Å²	80	2%	0.018	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-68.8	147	176.4	56.1	0	0	0	0	110.9	I484 W524 F587 L589	I484-T608 WeakPolarHBondContact CD1-OG1 3.43Å; W524-T608 HydrophobicContact CE3-CG2 4.16Å; W524-T608 HydrophobicContact CH2-CG2 4.06Å; W524-T608 HydrophobicContact CZ3-CG2 3.56Å; F587-T608 HydrophobicContact CD1-CG2 3.93Å; F587-T608 HydrophobicContact CD2-CG2 4.33Å; F587-T608 HydrophobicContact CE1-CG2 3.72Å; F587-T608 HydrophobicContact CE2-CG2 4.15Å; F587-T608 HydrophobicContact CG-CG2 4.23Å; F587-T608 HydrophobicContact CZ-CG2 3.83Å; F587-T608 PolarHBondContact N-OG1 3.04Å; F587-T608 PolarHBondContact O-N 2.9Å; F587-T608 PolarHBondContact O-OG1 3.39Å; L589-T608 HydrophobicContact CD1-CG2 4.05Å; L589-T608 HydrophobicContact CG-CG2 4.21Å
609	P	78.9	Confident	67.1	Low	39 Å²	39	82 Å²	82	25%	0.253	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-56.4	142.5	175.4	-20.4	30.5	0	0	0	111.3	I484 W524	I484-P609 WeakPolarHBondContact CD1-O 3.48Å; I484-P609 WeakPolarHBondContact CG1-O 3.49Å; W524-P609 HydrophobicContact CD2-CG 4.23Å; W524-P609 HydrophobicContact CG-CG 4.23Å; W524-P609 VanDerWaalsContact CZ2-CD 3.48Å; W524-P609 HydrophobicContact CZ2-CG 4Å; W524-P609 VanDerWaalsContact NE1-CG 3.32Å
610	Q	68.8	Low	64.5	Low	140 Å²	140	85.9 Å²	85.9	65%	0.654	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-53	142.7	-177.1	-76.9	-176	-23	0	0	113.1
611	P	62.7	Low	61.3	Low	25 Å²	25	84.9 Å²	84.9	16%	0.162	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-58.1	155.7	174.4	27.8	-36	0	0	0	109.9	L584	L584-P611 HydrophobicContact CB-CB 4Å; L584-P611 WeakPolarHBondContact O-CG 3.43Å
612	P	54.8	Low	58.5	Low	32 Å²	32	90 Å²	90	21%	0.208	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-56.4	126.8	174.5	26.2	-33.8	0	0	0	108.7	L293 K614	L293-P612 HydrophobicContact CD2-CG 4.26Å; P612-K614 PolarHBondContact O-N 3.27Å
613	P	47.3	Very low	55.3	Low	124 Å²	124	99.6 Å²	99.6	81%	0.805	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-61.1	124.1	-168.5	21.7	-32.9	0	0	0	110.8
614	K	46.3	Very low	52.3	Low	143 Å²	143	100.6 Å²	100.6	62%	0.622	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-56.2	140.7	160.6	-67.5	-178	176.5	-178.1	0	107.4	N582 P612 A616	N582-K614 WeakPolarHBondContact O-CE 3.2Å; N582-K614 PolarHBondContact O-NZ 3.37Å; P612-K614 PolarHBondContact O-N 3.27Å; K614-A616 PolarHBondContact O-N 2.98Å
615	S	37.2	Very low	49.3	Very low	111 Å²	111	107.6 Å²	107.6	78%	0.776	58%	0.584	S	S	*	*	S	Bend	trans	-63	91	-169.1	50.3	0	0	0	0	112.6
616	A	27.5	Very low	46.4	Very low	89 Å²	89	108.1 Å²	108.1	74%	0.736	58%	0.581	S	S	*	*			trans	-121	154.7	174.1	0	0	0	0	0	109.7	K614	K614-A616 PolarHBondContact O-N 2.98Å
617	I	33.6	Very low	43.6	Very low	156 Å²	156	112.4 Å²	112.4	80%	0.8	60%	0.599	S	S	*	*			trans	-88.6	118	-153.6	-62.1	168.2	0	0	0	112.5
618	K	29.8	Very low	41.2	Very low	177 Å²	177	114.8 Å²	114.8	77%	0.77	61%	0.607	S	S	*	*			trans	66.4	167	164.3	-72	173.4	-178.1	175.7	0	114.5
619	P	25.6	Very low	38.7	Very low	128 Å²	128	121.5 Å²	121.5	83%	0.831	64%	0.643	S	S	*	*			cis	-107.2	173.7	3.4	41.1	-32.1	0	0	0	115.4	G621	P619-G621 PolarHBondContact O-N 3.39Å
620	S	33.3	Very low	36.3	Very low	129 Å²	129	128.9 Å²	128.9	90%	0.902	67%	0.674	S	S	*	*			trans	-80.7	110.2	-175.3	52.2	0	0	0	0	114.3
621	G	25.2	Very low	34.6	Very low	70 Å²	70	128.2 Å²	128.2	72%	0.722	68%	0.679	S	S	*	*			trans	-110.4	125.6	165.8	0	0	0	0	0	111.9	P619	P619-G621 PolarHBondContact O-N 3.39Å
622	Q	30.1	Very low	33	Very low	166 Å²	166	131 Å²	131	78%	0.776	71%	0.712	S	S	*	*			trans	-65.9	138.5	-171	-66.2	179.2	-5.4	0	0	113.9
623	R	25.5	Very low	31.9	Very low	217 Å²	217	138.4 Å²	138.4	82%	0.819	74%	0.741	S	S	*	*			trans	-134.7	65.2	157	-79.2	-167.5	172.2	149.4	3.9	112.3
624	R	30.9	Very low	31.1	Very low	123 Å²	123	139.2 Å²	139.2	46%	0.464	74%	0.737	S	S	.	*			trans	-63.9	135.1	151.8	-71.9	179.8	173.5	176.2	-0.5	108.2	N765	R624-N765 PolarHBondContact NH2-O 3.04Å
625	F	28	Very low	30.4	Very low	166 Å²	166	140.5 Å²	140.5	73%	0.728	75%	0.749	S	S	*	*			trans	-133.5	122.7	146.7	-98.5	-77.3	0	0	0	110.3	R839	F625-R839 PolarHBondContact O-NH2 3.15Å
626	L	31.4	Very low	30	Very low	94 Å²	94	141.4 Å²	141.4	49%	0.492	75%	0.745	S	S	.	*			trans	-98	173.5	163.2	-157.9	68.3	0	0	0	107.5	K628 G835	L626-K628 PolarHBondContact O-N 3.46Å; L626-G835 WeakPolarHBondContact CD1-O 3.41Å
627	K	29.6	Very low	30	Very low	100 Å²	100	140.9 Å²	140.9	44%	0.435	74%	0.735	S	S	.	*			trans	-48.3	130	179.9	-65.6	-173.9	73	-176.7	0	111	N629 D908 S909 Y910	K627-N629 PolarHBondContact O-N 2.98Å; K627-D908 HydrophobicContact CD-CB 4.46Å; K627-D908 WeakPolarHBondContact CD-O 3.33Å; K627-D908 WeakPolarHBondContact CE-O 3.49Å; K627-D908 HydrophobicContact CG-CB 4.32Å; K627-D908 WeakPolarHBondContact CG-O 3.49Å; K627-S909 PolarHBondContact NZ-OG 3.45Å; K627-Y910 HydrophobicContact CD-CD1 4.1Å; K627-Y910 HydrophobicContact CD-CE1 4.15Å
628	K	34.8	Very low	29.7	Very low	179 Å²	179	139.5 Å²	139.5	78%	0.778	74%	0.737	S	S	*	*	S	Bend	trans	-87.4	89.1	-178.8	-176	-167.3	174.2	-168.8	0	110.3	L626	L626-K628 PolarHBondContact O-N 3.46Å
629	N	32.1	Very low	29.7	Very low	144 Å²	144	139.8 Å²	139.8	77%	0.77	74%	0.738	S	S	*	*	S	Bend	trans	-167.2	160.4	147.8	-89.2	-20	0	0	0	107.4	K627	K627-N629 PolarHBondContact O-N 2.98Å
630	E	28.7	Very low	30	Very low	194 Å²	194	136 Å²	136	91%	0.907	72%	0.717	S	S	*	*	S	Bend	trans	65.9	39.2	179.2	-54.6	-171.2	160.1	0	0	118.1
631	V	31.4	Very low	30.3	Very low	126 Å²	126	136 Å²	136	76%	0.764	71%	0.712	S	S	*	*			trans	-133.3	69.4	152	-168.7	0	0	0	0	109.8	K633	V631-K633 VanDerWaalsContact C-N 3.27Å; V631-K633 PolarHBondContact O-N 3.24Å
632	G	29.9	Very low	30.9	Very low	82 Å²	82	138.5 Å²	138.5	85%	0.845	71%	0.714	S	S	*	*			trans	-83.3	23.4	-176.2	0	0	0	0	0	115.7
633	K	31.8	Very low	31.8	Very low	188 Å²	188	134.7 Å²	134.7	82%	0.817	70%	0.702	S	S	*	*	S	Bend	trans	-166.9	149.2	173.3	-105.6	155.3	-173.4	176.6	0	109.2	V631	V631-K633 VanDerWaalsContact C-N 3.27Å; V631-K633 PolarHBondContact O-N 3.24Å
634	I	31.1	Very low	33.7	Very low	142 Å²	142	133.7 Å²	133.7	73%	0.728	70%	0.703	S	S	*	*			trans	101.8	93.7	-172.2	-60.4	165.9	0	0	0	112.4	L636	I634-L636 HydrophobicContact CG2-CD1 3.85Å; I634-L636 HydrophobicContact CG2-CD2 4.38Å; I634-L636 HydrophobicContact CG2-CG 3.65Å
635	I	31	Very low	36	Very low	170 Å²	170	129.4 Å²	129.4	87%	0.872	69%	0.688	S	S	*	*			trans	-85.8	127	160.4	-61.2	171.2	0	0	0	106.5
636	L	29.1	Very low	38.5	Very low	130 Å²	130	124.4 Å²	124.4	68%	0.681	67%	0.672	S	S	*	*			trans	-121.5	114.9	170.3	-75.1	171.6	0	0	0	110.4	I634 A640	I634-L636 HydrophobicContact CG2-CD1 3.85Å; I634-L636 HydrophobicContact CG2-CD2 4.38Å; I634-L636 HydrophobicContact CG2-CG 3.65Å; L636-A640 HydrophobicContact CD2-CB 3.82Å
637	S	26.4	Very low	40.8	Very low	77 Å²	77	124.9 Å²	124.9	54%	0.538	68%	0.679	S	S	.	*			trans	-74.2	165.9	167.3	54.5	0	0	0	0	110.8	F639	S637-F639 PolarHBondContact O-N 3.03Å
638	P	28.7	Very low	43.5	Very low	128 Å²	128	122.2 Å²	122.2	83%	0.831	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	11.1	-172.1	-23.1	35.7	0	0	0	117.5
639	F	30	Very low	46	Very low	182 Å²	182	117.6 Å²	117.6	80%	0.798	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	2.8	-170.9	-78	-81.6	0	0	0	115.1	S637 T641	S637-F639 PolarHBondContact O-N 3.03Å; F639-T641 VanDerWaalsContact C-N 3.33Å; F639-T641 PolarHBondContact O-N 3.41Å
640	A	30.8	Very low	48.6	Very low	48 Å²	48	115.1 Å²	115.1	40%	0.397	64%	0.635	S	S	.	*			trans	-84.2	59.8	-175.4	0	0	0	0	0	114.2	L636 T642	L636-A640 HydrophobicContact CD2-CB 3.82Å; A640-T642 PolarHBondContact O-N 2.84Å
641	T	38.7	Very low	51.4	Low	130 Å²	130	108.4 Å²	108.4	80%	0.798	60%	0.601	S	S	*	*			trans	-78.4	43.8	-175.8	-39.4	0	0	0	0	114	F639	F639-T641 VanDerWaalsContact C-N 3.33Å; F639-T641 PolarHBondContact O-N 3.41Å
642	T	38.1	Very low	53.9	Low	122 Å²	122	106.1 Å²	106.1	75%	0.748	59%	0.589	S	S	*	*			trans	-144.5	48	177.5	57.4	0	0	0	0	113	A640 K644	A640-T642 PolarHBondContact O-N 2.84Å; T642-K644 VanDerWaalsContact C-N 3.32Å; T642-K644 PolarHBondContact O-N 3.13Å
643	T	49.5	Very low	56.4	Low	86 Å²	86	102.7 Å²	102.7	53%	0.528	55%	0.552	S	S	.	*			trans	-67.8	84	175.7	-41.6	0	0	0	0	111.5	Y645	T643-Y645 PolarHBondContact O-N 2.96Å
644	K	65.2	Low	58.1	Low	196 Å²	196	96.8 Å²	96.8	85%	0.852	53%	0.534	S	S	*	.			trans	-67.8	115.2	169.2	-69.1	-174.2	178.5	-178.4	0	108.9	T642	T642-K644 VanDerWaalsContact C-N 3.32Å; T642-K644 PolarHBondContact O-N 3.13Å
645	Y	79.1	Confident	59.9	Low	34 Å²	34	93.7 Å²	93.7	13%	0.133	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-65.8	139.6	170.1	-71.9	-82.3	0	0	0	110	T643 S767 M831	T643-Y645 PolarHBondContact O-N 2.96Å; Y645-S767 PolarHBondContact OH-N 2.81Å; Y645-S767 PolarHBondContact OH-OG 3.38Å; Y645-M831 HydrophobicContact CD1-CB 4.01Å; Y645-M831 HydrophobicContact CD1-CE 3.87Å; Y645-M831 WeakPolarHBondContact CD1-O 3.23Å; Y645-M831 HydrophobicContact CD2-CE 3.79Å; Y645-M831 HydrophobicContact CE1-CE 3.74Å; Y645-M831 HydrophobicContact CE2-CE 3.65Å; Y645-M831 HydrophobicContact CG-CB 4.49Å; Y645-M831 HydrophobicContact CG-CE 3.89Å
646	P	81.6	Confident	62.2	Low	60 Å²	60	86.5 Å²	86.5	39%	0.39	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-68.4	143.7	173.2	31.8	-35.7	0	0	0	109.8	D832 F953	P646-D832 HydrophobicContact CG-CB 3.56Å; P646-F953 HydrophobicContact CB-CD1 3.87Å; P646-F953 HydrophobicContact CB-CE1 4.22Å; P646-F953 HydrophobicContact CG-CD1 4.04Å; P646-F953 HydrophobicContact CG-CE1 4.11Å
647	T	78.9	Confident	64.9	Low	105 Å²	105	83.1 Å²	83.1	64%	0.644	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-87.1	128.8	177.9	45.1	0	0	0	0	110.6	Q649	T647-Q649 PolarHBondContact O-N 2.84Å
648	F	87.5	Confident	67.7	Low	43 Å²	43	80.8 Å²	80.8	19%	0.189	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-61.3	124.5	171.5	-178.6	-85.5	0	0	0	110.3	L741 K830 L948 A952 F953	F648-L741 HydrophobicContact CE2-CD2 4.02Å; F648-L741 HydrophobicContact CZ-CD2 3.91Å; F648-K830 HydrophobicContact CB-CB 3.94Å; F648-K830 HydrophobicContact CB-CG 3.96Å; F648-K830 HydrophobicContact CD1-CG 4.43Å; F648-K830 HydrophobicContact CD2-CG 4.16Å; F648-K830 HydrophobicContact CG-CB 4.41Å; F648-K830 HydrophobicContact CG-CG 3.94Å; F648-K830 PolarHBondContact N-O 3.15Å; F648-L948 HydrophobicContact CE2-CD1 4.18Å; F648-A952 HydrophobicContact CD2-CB 3.68Å; F648-A952 HydrophobicContact CE2-CB 3.56Å; F648-A952 HydrophobicContact CG-CB 4.48Å; F648-A952 HydrophobicContact CZ-CB 4.27Å; F648-F953 HydrophobicContact CB-CE1 4.14Å; F648-F953 HydrophobicContact CB-CZ 4.18Å; F648-F953 HydrophobicContact CD2-CE2 4.5Å; F648-F953 HydrophobicContact CD2-CZ 4.14Å
649	Q	86.3	Confident	70.5	Confident	83 Å²	83	74.7 Å²	74.7	39%	0.388	41%	0.409	S	S	.	.			trans	-109.2	133.2	176.1	-54.7	-171.5	23.1	0	0	109.3	T647 R651 T737 A952	T647-Q649 PolarHBondContact O-N 2.84Å; Q649-R651 HydrophobicContact CB-CG 4.32Å; Q649-R651 PolarHBondContact O-N 3.48Å; Q649-T737 PolarHBondContact O-OG1 2.96Å; Q649-A952 PolarHBondContact N-O 2.97Å
650	D	87.1	Confident	73.3	Confident	91 Å²	91	71 Å²	71	49%	0.487	39%	0.393	S	S	.	.			trans	-83.9	116	174.6	-161.3	25.3	0	0	0	111	T737 S738	D650-T737 VanDerWaalsContact CA-OG1 3.32Å; D650-T737 WeakPolarHBondContact CA-OG1 3.49Å; D650-T737 PolarHBondContact OD1-N 3.22Å; D650-T737 PolarHBondContact OD1-OG1 3.1Å; D650-S738 VanDerWaalsContact CG-CB 3.44Å; D650-S738 WeakPolarHBondContact OD1-CB 3.12Å; D650-S738 PolarHBondContact OD1-N 2.9Å; D650-S738 PolarHBondContact OD1-OG 2.84Å; D650-S738 WeakPolarHBondContact OD2-CB 3.45Å; D650-S738 PolarHBondContact OD2-OG 2.9Å
651	R	86.7	Confident	76.1	Confident	53 Å²	53	68.8 Å²	68.8	20%	0.2	37%	0.374	C	S	.	.			trans	-138.4	158	-174.5	-66.1	-176.4	-178.5	173.1	2.5	110.5	Q649 S736 T737 S954	Q649-R651 HydrophobicContact CB-CG 4.32Å; Q649-R651 PolarHBondContact O-N 3.48Å; R651-S736 CarbonylContact O-C 3.54Å; R651-S736 VanDerWaalsContact O-CA 3.32Å; R651-S736 WeakPolarHBondContact O-CA 3.3Å; R651-T737 PolarHBondContact N-OG1 3.14Å; R651-T737 PolarHBondContact O-N 3.3Å; R651-T737 PolarHBondContact O-OG1 2.98Å; R651-S954 PolarHBondContact NH1-O 3.12Å; R651-S954 PolarHBondContact NH1-OG 3.48Å; R651-S954 VanDerWaalsContact NH1-OG 3.09Å; R651-S954 PolarHBondContact NH2-O 2.79Å
652	P	83.6	Confident	78.5	Confident	79 Å²	79	66.3 Å²	66.3	51%	0.513	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-61.2	140.3	164	28.4	-34.7	0	0	0	110.1	S654 E734	P652-S654 PolarHBondContact O-N 2.83Å; P652-E734 HydrophobicContact CB-CG 4.21Å
653	V	83.4	Confident	81	Confident	9 Å²	9	66.4 Å²	66.4	6%	0.055	35%	0.345	C	S	.	.			trans	-76.4	96.1	178.2	179.2	0	0	0	0	109.3	L656 L735 T737 L740 I947 A951	V653-L656 HydrophobicContact CB-CD1 4.23Å; V653-L656 HydrophobicContact CG1-CD1 4.25Å; V653-L656 HydrophobicContact CG1-CD2 4.06Å; V653-L656 HydrophobicContact CG1-CG 4.02Å; V653-L656 WeakPolarHBondContact O-CD1 3.45Å; V653-L656 WeakPolarHBondContact O-CG 3.23Å; V653-L735 HydrophobicContact CB-CD2 4.22Å; V653-L735 HydrophobicContact CB-CG 4.23Å; V653-L735 HydrophobicContact CG2-CD2 4.18Å; V653-L735 HydrophobicContact CG2-CG 3.92Å; V653-L735 WeakPolarHBondContact CG2-O 3.28Å; V653-L735 PolarHBondContact N-O 2.87Å; V653-T737 HydrophobicContact CG2-CG2 3.93Å; V653-L740 HydrophobicContact CG2-CD2 4.08Å; V653-I947 HydrophobicContact CG1-CD1 3.76Å; V653-I947 HydrophobicContact CG1-CG1 3.71Å; V653-A951 HydrophobicContact CB-CB 4.31Å; V653-A951 HydrophobicContact CG1-CB 4.13Å; V653-A951 HydrophobicContact CG2-CB 4.09Å
654	S	66.3	Low	82.9	Confident	64 Å²	64	66.2 Å²	66.2	45%	0.448	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	172.3	174.8	64	0	0	0	0	112	P652 L656	P652-S654 PolarHBondContact O-N 2.83Å; S654-L656 PolarHBondContact O-N 3.14Å; S654-L656 VanDerWaalsContact O-N 3.12Å
655	S	69.4	Low	84	Confident	78 Å²	78	58.3 Å²	58.3	55%	0.545	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	-1.9	178.6	80.4	0	0	0	0	118.7	K657	S655-K657 PolarHBondContact O-N 2.72Å
656	L	80.6	Confident	84.3	Confident	18 Å²	18	62.5 Å²	62.5	9%	0.094	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-50.8	135.9	176.5	-69.7	167.4	0	0	0	113.1	V653 S654 F658 A684 L685 L686 L735 I947	V653-L656 HydrophobicContact CB-CD1 4.23Å; V653-L656 HydrophobicContact CG1-CD1 4.25Å; V653-L656 HydrophobicContact CG1-CD2 4.06Å; V653-L656 HydrophobicContact CG1-CG 4.02Å; V653-L656 WeakPolarHBondContact O-CD1 3.45Å; V653-L656 WeakPolarHBondContact O-CG 3.23Å; S654-L656 PolarHBondContact O-N 3.14Å; S654-L656 VanDerWaalsContact O-N 3.12Å; L656-F658 HydrophobicContact CB-CZ 4.47Å; L656-A684 HydrophobicContact CD1-CB 4.15Å; L656-L685 WeakPolarHBondContact CD2-O 3.49Å; L656-L686 HydrophobicContact CD2-CD2 3.63Å; L656-L735 HydrophobicContact CD1-CD2 4.28Å; L656-I947 HydrophobicContact CD2-CD1 3.64Å; L656-I947 HydrophobicContact CG-CD1 4.49Å
657	K	84.1	Confident	84	Confident	60 Å²	60	62.5 Å²	62.5	26%	0.261	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	139.1	166.5	-69.1	-167.9	-176.9	-176.2	0	109.9	S655 L685 E688 G723	S655-K657 PolarHBondContact O-N 2.72Å; K657-L685 WeakPolarHBondContact O-CB 3.22Å; K657-L685 PolarHBondContact O-N 2.98Å; K657-E688 HydrophobicContact CD-CG 4.42Å; K657-E688 VanDerWaalsContact CE-CD 3.47Å; K657-E688 WeakPolarHBondContact CE-OE1 3.45Å; K657-E688 IonicContact NZ-OE1 2.92Å; K657-E688 PolarHBondContact NZ-OE1 2.99Å; K657-E688 IonicContact NZ-OE2 3.2Å; K657-E688 PolarHBondContact NZ-OE2 2.78Å; K657-G723 CarbonylContact C-O 3.36Å; K657-G723 WeakPolarHBondContact CA-O 3.47Å
658	F	87.1	Confident	83.2	Confident	27 Å²	27	67.6 Å²	67.6	12%	0.118	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	148.4	176.9	-64.3	-86	0	0	0	111.7	L656 I683 A684 V722 G723 R726 P727	L656-F658 HydrophobicContact CB-CZ 4.47Å; F658-I683 CarbonylContact C-O 3.49Å; F658-I683 WeakPolarHBondContact CA-O 3.46Å; F658-A684 HydrophobicContact CD1-CB 4.19Å; F658-A684 HydrophobicContact CE1-CB 3.98Å; F658-V722 PolarHBondContact O-N 2.92Å; F658-G723 PolarHBondContact N-O 3.09Å; F658-G723 PolarHBondContact O-N 3.03Å; F658-R726 HydrophobicContact CD2-CB 4.34Å; F658-R726 HydrophobicContact CE1-CG 4.12Å; F658-R726 HydrophobicContact CE2-CB 3.88Å; F658-R726 HydrophobicContact CE2-CG 4.33Å; F658-R726 HydrophobicContact CZ-CB 3.99Å; F658-R726 HydrophobicContact CZ-CG 3.93Å; F658-P727 VanDerWaalsContact CB-CD 3.44Å; F658-P727 HydrophobicContact CB-CG 3.95Å
659	G	87.1	Confident	82.1	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	160.6	172.4	0	0	0	0	0	112.3	G682 I683 L720	G659-G682 CarbonylContact O-C 3.52Å; G659-G682 WeakPolarHBondContact O-CA 3.41Å; G659-I683 PolarHBondContact N-O 3.27Å; G659-I683 WeakPolarHBondContact O-CG2 3.1Å; G659-I683 PolarHBondContact O-N 2.9Å; G659-L720 CarbonylContact C-O 3.58Å; G659-L720 WeakPolarHBondContact CA-O 3.38Å
660	K	88.9	Confident	81	Confident	105 Å²	105	74.7 Å²	74.7	46%	0.457	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	132.6	174.4	-168.9	169.6	-172.4	170	0	110.2	G680 L720 V722	K660-G680 WeakPolarHBondContact CE-O 3.38Å; K660-G680 WeakPolarHBondContact CG-O 3.12Å; K660-L720 PolarHBondContact N-O 3.02Å; K660-L720 PolarHBondContact O-N 3.03Å; K660-V722 HydrophobicContact CB-CG2 4.03Å
661	L	90	Very high	80.4	Confident	1 Å²	1	71.7 Å²	71.7	1%	0.005	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	118.4	-173.6	-68.3	158.2	0	0	0	111	Y677 K678 K679 G680 D681 I683 Y707 V714 V719	L661-Y677 HydrophobicContact CB-CD2 4.42Å; L661-Y677 HydrophobicContact CD1-CD2 4.42Å; L661-Y677 HydrophobicContact CD1-CG 4.3Å; L661-Y677 HydrophobicContact CD2-CD2 3.71Å; L661-Y677 HydrophobicContact CD2-CE2 4.07Å; L661-Y677 HydrophobicContact CD2-CG 3.95Å; L661-Y677 HydrophobicContact CG-CD2 4.39Å; L661-K678 VanDerWaalsContact CB-O 3.24Å; L661-K678 WeakPolarHBondContact CB-O 3.3Å; L661-K679 WeakPolarHBondContact O-CA 3.39Å; L661-G680 PolarHBondContact O-N 2.8Å; L661-D681 WeakPolarHBondContact CB-O 3.5Å; L661-D681 HydrophobicContact CD1-CB 3.97Å; L661-D681 PolarHBondContact N-O 2.93Å; L661-I683 HydrophobicContact CD1-CB 4.07Å; L661-I683 HydrophobicContact CD1-CG2 4.35Å; L661-I683 HydrophobicContact CD2-CB 4.3Å; L661-I683 HydrophobicContact CD2-CD1 4.35Å; L661-I683 HydrophobicContact CD2-CG2 3.87Å; L661-I683 HydrophobicContact CG-CB 4.18Å; L661-I683 HydrophobicContact CG-CG2 3.89Å; L661-Y707 HydrophobicContact CD1-CD2 3.87Å; L661-Y707 HydrophobicContact CD1-CE2 3.63Å; L661-V714 HydrophobicContact CD2-CG1 4.14Å; L661-V719 HydrophobicContact CD2-CG2 4.33Å
662	L	89	Confident	79.9	Confident	79 Å²	79	75.3 Å²	75.3	41%	0.414	39%	0.388	S	S	.	.			trans	-84.4	-18.3	-170.9	-63.1	177.8	0	0	0	114	K679 N718 L720	L662-K679 WeakPolarHBondContact O-CG 3.38Å; L662-N718 PolarHBondContact N-O 3.37Å; L662-L720 HydrophobicContact CD1-CB 4.25Å; L662-L720 HydrophobicContact CD2-CB 3.96Å; L662-L720 HydrophobicContact CG-CB 4.22Å
663	K	89.8	Confident	80	Confident	123 Å²	123	72.1 Å²	72.1	54%	0.535	37%	0.366	S	S	.	.	S	Bend	trans	-144.5	143	-176.4	-62	-172.1	-179.1	-175.8	0	110.8	Y677	K663-Y677 VanDerWaalsContact O-CD2 3.28Å; K663-Y677 WeakPolarHBondContact O-CD2 3.35Å; K663-Y677 VanDerWaalsContact O-CE2 3.23Å; K663-Y677 WeakPolarHBondContact O-CE2 3.43Å
664	T	89.6	Confident	80.3	Confident	83 Å²	83	73.2 Å²	73.2	51%	0.509	37%	0.371	S	S	.	.			trans	-74.4	132.3	168.4	-59.5	0	0	0	0	109.1	V666 Y677 K679	T664-V666 HydrophobicContact CG2-CG2 4.25Å; T664-Y677 CarbonylContact C-O 3.59Å; T664-Y677 WeakPolarHBondContact CA-O 3.39Å; T664-K679 PolarHBondContact OG1-N 2.83Å
665	V	88.1	Confident	81.3	Confident	30 Å²	30	70.6 Å²	70.6	18%	0.182	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-133.4	106.6	175.9	176.5	0	0	0	0	109	R667 E676 Y677	V665-R667 HydrophobicContact CG1-CG 4.33Å; V665-E676 CarbonylContact O-C 3.57Å; V665-E676 VanDerWaalsContact O-CA 3.24Å; V665-E676 WeakPolarHBondContact O-CA 3.3Å; V665-Y677 HydrophobicContact CB-CD2 4.17Å; V665-Y677 HydrophobicContact CB-CE1 4.15Å; V665-Y677 HydrophobicContact CB-CE2 3.7Å; V665-Y677 HydrophobicContact CG2-CD2 4.37Å; V665-Y677 HydrophobicContact CG2-CE2 3.52Å; V665-Y677 PolarHBondContact N-O 2.79Å; V665-Y677 PolarHBondContact O-N 2.85Å
666	V	84.7	Confident	82.3	Confident	122 Å²	122	69.6 Å²	69.6	74%	0.739	34%	0.339	S	S	*	.			trans	-106.4	145.6	168.5	-177.8	0	0	0	0	107.8	T664	T664-V666 HydrophobicContact CG2-CG2 4.25Å
667	R	76.9	Confident	82.7	Confident	59 Å²	59	69.1 Å²	69.1	22%	0.223	34%	0.336	C	S	.	.			trans	-122.8	127.8	-174.5	-60	173.6	-172.3	-82	1.4	110.8	V665 N669 L675 E676	V665-R667 HydrophobicContact CG1-CG 4.33Å; R667-N669 VanDerWaalsContact C-N 3.33Å; R667-N669 PolarHBondContact O-N 2.88Å; R667-L675 PolarHBondContact NE-O 2.84Å; R667-L675 PolarHBondContact NH2-O 2.82Å; R667-E676 HydrophobicContact CB-CG 4Å; R667-E676 HydrophobicContact CG-CG 3.77Å
668	Q	61.2	Low	82.9	Confident	212 Å²	212	72.2 Å²	72.2	99%	0.991	35%	0.349	S	S	*	.	S	Bend	trans	-65.4	-36	175	-67.9	173.4	-19.7	0	0	112.4
669	N	64.4	Low	83	Confident	114 Å²	114	78 Å²	78	61%	0.61	37%	0.374	S	S	*	.	S	Bend	trans	-104.3	106.5	178.2	-169.2	-57.1	0	0	0	109.9	R667 N671 K933	R667-N669 VanDerWaalsContact C-N 3.33Å; R667-N669 PolarHBondContact O-N 2.88Å; N669-N671 PolarHBondContact O-N 3.16Å; N669-K933 PolarHBondContact OD1-NZ 3.5Å
670	K	63.5	Low	82.8	Confident	161 Å²	161	79 Å²	79	70%	0.7	38%	0.384	S	S	*	.			trans	-57.1	118.5	179.4	-66.4	178.1	-179.7	175.5	0	110.2	K933	K670-K933 PolarHBondContact O-NZ 3.38Å
671	N	74.4	Confident	82.7	Confident	28 Å²	28	75.2 Å²	75.2	15%	0.15	37%	0.369	C	S	.	.			trans	-124.7	110.4	173.4	-175	-8.9	0	0	0	108.6	N669 Y673 L674 K933	N669-N671 PolarHBondContact O-N 3.16Å; N671-Y673 PolarHBondContact O-N 3.2Å; N671-Y673 PolarHBondContact OD1-N 2.87Å; N671-L674 HydrophobicContact CB-CB 4.27Å; N671-L674 HydrophobicContact CB-CD1 4.25Å; N671-L674 HydrophobicContact CB-CG 4.25Å; N671-L674 WeakPolarHBondContact ND2-CD1 3.45Å; N671-L674 PolarHBondContact O-N 2.91Å; N671-K933 HydrophobicContact CB-CD 4.34Å
672	H	75.1	Confident	82.5	Confident	130 Å²	130	75.6 Å²	75.6	60%	0.602	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-12.3	-173	-54.9	-75.1	0	0	0	114.8
673	Y	87.1	Confident	82.5	Confident	11 Å²	11	71.9 Å²	71.9	4%	0.043	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-0.3	-179.8	-54.6	-65.4	0	0	0	114.2	N671 L713 R746 P747 K933 H934 I940	N671-Y673 PolarHBondContact O-N 3.2Å; N671-Y673 PolarHBondContact OD1-N 2.87Å; Y673-L713 PolarHBondContact O-N 2.89Å; Y673-R746 HydrophobicContact CE1-CB 4.47Å; Y673-P747 WeakPolarHBondContact OH-CA 3.31Å; Y673-P747 WeakPolarHBondContact OH-CD 3.45Å; Y673-K933 HydrophobicContact CD2-CB 4.28Å; Y673-K933 WeakPolarHBondContact CD2-O 3.32Å; Y673-K933 HydrophobicContact CE2-CB 4.46Å; Y673-K933 WeakPolarHBondContact CE2-O 3.29Å; Y673-H934 AromaticContact CE2-ND1 3.58Å; Y673-H934 AromaticContact CZ-ND1 3.73Å; Y673-H934 PolarHBondContact OH-ND1 2.85Å; Y673-I940 HydrophobicContact CD1-CD1 3.89Å; Y673-I940 HydrophobicContact CG-CD1 4.23Å
674	L	88.3	Confident	82.5	Confident	33 Å²	33	66.4 Å²	66.4	17%	0.173	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-116	118.1	173.4	-60.5	-179.1	0	0	0	108.6	N671 W702 L713	N671-L674 HydrophobicContact CB-CB 4.27Å; N671-L674 HydrophobicContact CB-CD1 4.25Å; N671-L674 HydrophobicContact CB-CG 4.25Å; N671-L674 WeakPolarHBondContact ND2-CD1 3.45Å; N671-L674 PolarHBondContact O-N 2.91Å; L674-W702 HydrophobicContact CD2-CZ3 4.42Å; L674-L713 HydrophobicContact CD2-CB 3.97Å; L674-L713 HydrophobicContact CD2-CD1 4.15Å
675	L	88.3	Confident	82.5	Confident	8 Å²	8	63 Å²	63	4%	0.042	31%	0.311	C	S	.	.			trans	-70	152.7	-177.1	-67.6	172.5	0	0	0	112	R667 Y677 I683 G705 R710 L713 V714	R667-L675 PolarHBondContact NE-O 2.84Å; R667-L675 PolarHBondContact NH2-O 2.82Å; L675-Y677 HydrophobicContact CB-CD1 4.04Å; L675-Y677 HydrophobicContact CB-CE1 4.47Å; L675-Y677 WeakPolarHBondContact O-CE1 3.45Å; L675-I683 HydrophobicContact CD1-CD1 4.09Å; L675-G705 WeakPolarHBondContact CD1-O 3.45Å; L675-R710 HydrophobicContact CD2-CB 3.78Å; L675-L713 PolarHBondContact N-O 3.02Å; L675-L713 VanDerWaalsContact N-O 3.13Å; L675-V714 HydrophobicContact CB-CG2 3.87Å; L675-V714 HydrophobicContact CD1-CG2 3.79Å; L675-V714 HydrophobicContact CG-CG2 4.34Å
676	E	89.6	Confident	82.3	Confident	58 Å²	58	61.9 Å²	61.9	27%	0.271	30%	0.303	S	S	.	.			trans	-115.5	134	171	-72.6	160.5	-152.8	0	0	106.3	V665 R667 Y707	V665-E676 CarbonylContact O-C 3.57Å; V665-E676 VanDerWaalsContact O-CA 3.24Å; V665-E676 WeakPolarHBondContact O-CA 3.3Å; R667-E676 HydrophobicContact CB-CG 4Å; R667-E676 HydrophobicContact CG-CG 3.77Å; E676-Y707 WeakPolarHBondContact O-CD1 3.46Å; E676-Y707 WeakPolarHBondContact O-CE1 2.97Å
677	Y	89.4	Confident	82.2	Confident	8 Å²	8	57.4 Å²	57.4	3%	0.031	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-159.9	158.8	-165.7	47.5	-97.8	0	0	0	112.9	L661 K663 T664 V665 L675 V714 N718	L661-Y677 HydrophobicContact CB-CD2 4.42Å; L661-Y677 HydrophobicContact CD1-CD2 4.42Å; L661-Y677 HydrophobicContact CD1-CG 4.3Å; L661-Y677 HydrophobicContact CD2-CD2 3.71Å; L661-Y677 HydrophobicContact CD2-CE2 4.07Å; L661-Y677 HydrophobicContact CD2-CG 3.95Å; L661-Y677 HydrophobicContact CG-CD2 4.39Å; K663-Y677 VanDerWaalsContact O-CD2 3.28Å; K663-Y677 WeakPolarHBondContact O-CD2 3.35Å; K663-Y677 VanDerWaalsContact O-CE2 3.23Å; K663-Y677 WeakPolarHBondContact O-CE2 3.43Å; T664-Y677 CarbonylContact C-O 3.59Å; T664-Y677 WeakPolarHBondContact CA-O 3.39Å; V665-Y677 HydrophobicContact CB-CD2 4.17Å; V665-Y677 HydrophobicContact CB-CE1 4.15Å; V665-Y677 HydrophobicContact CB-CE2 3.7Å; V665-Y677 HydrophobicContact CG2-CD2 4.37Å; V665-Y677 HydrophobicContact CG2-CE2 3.52Å; V665-Y677 PolarHBondContact N-O 2.79Å; V665-Y677 PolarHBondContact O-N 2.85Å; L675-Y677 HydrophobicContact CB-CD1 4.04Å; L675-Y677 HydrophobicContact CB-CE1 4.47Å; L675-Y677 WeakPolarHBondContact O-CE1 3.45Å; Y677-V714 HydrophobicContact CD1-CG1 4.5Å; Y677-V714 HydrophobicContact CD1-CG2 4.09Å; Y677-V714 HydrophobicContact CE1-CB 4.32Å; Y677-V714 HydrophobicContact CE1-CG1 3.77Å; Y677-V714 HydrophobicContact CE1-CG2 3.82Å; Y677-V714 HydrophobicContact CE2-CG1 4.49Å; Y677-N718 HydrophobicContact CE2-CB 4.31Å; Y677-N718 PolarHBondContact OH-ND2 3.39Å
678	K	88.6	Confident	82	Confident	125 Å²	125	60.9 Å²	60.9	54%	0.543	30%	0.297	S	S	.	.			trans	-100.2	154.8	178.7	-63.6	176	-178.1	179	0	111.8	L661 D681 Y707	L661-K678 VanDerWaalsContact CB-O 3.24Å; L661-K678 WeakPolarHBondContact CB-O 3.3Å; K678-D681 WeakPolarHBondContact CB-OD1 3.2Å; K678-Y707 PolarHBondContact N-OH 2.8Å
679	K	88.8	Confident	83	Confident	147 Å²	147	55.1 Å²	55.1	64%	0.639	27%	0.269	S	S	*	.	S	Bend	trans	-71.7	128.9	170.8	177.7	-178.5	178.9	-166.2	0	109.7	L661 L662 T664	L661-K679 WeakPolarHBondContact O-CA 3.39Å; L662-K679 WeakPolarHBondContact O-CG 3.38Å; T664-K679 PolarHBondContact OG1-N 2.83Å
680	G	82.9	Confident	84	Confident	21 Å²	21	55.5 Å²	55.5	22%	0.216	26%	0.262	C	S	.	.	S	Bend	trans	110.6	-34.9	176.7	0	0	0	0	0	113.2	K660 L661	K660-G680 WeakPolarHBondContact CE-O 3.38Å; K660-G680 WeakPolarHBondContact CG-O 3.12Å; L661-G680 PolarHBondContact O-N 2.8Å
681	D	87.9	Confident	85.2	Confident	26 Å²	26	48 Å²	48	14%	0.139	23%	0.23	C	C	.	.			trans	-62	151.2	-177	-57.4	30.5	0	0	0	112.6	L661 K678 Y707	L661-D681 WeakPolarHBondContact CB-O 3.5Å; L661-D681 HydrophobicContact CD1-CB 3.97Å; L661-D681 PolarHBondContact N-O 2.93Å; K678-D681 WeakPolarHBondContact CB-OD1 3.2Å; D681-Y707 HydrophobicContact CB-CE2 3.98Å; D681-Y707 PolarHBondContact OD2-OH 2.88Å
682	G	85.5	Confident	85.9	Confident	9 Å²	9	51 Å²	51	9%	0.093	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	144.8	171.2	0	0	0	0	0	113	G659 L729	G659-G682 CarbonylContact O-C 3.52Å; G659-G682 WeakPolarHBondContact O-CA 3.41Å; G682-L729 PolarHBondContact N-O 2.97Å
683	I	88.8	Confident	86.3	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	139.5	173.7	-176.9	163.4	0	0	0	110.4	F658 G659 L661 L675 L685 V714 V719	F658-I683 CarbonylContact C-O 3.49Å; F658-I683 WeakPolarHBondContact CA-O 3.46Å; G659-I683 PolarHBondContact N-O 3.27Å; G659-I683 WeakPolarHBondContact O-CG2 3.1Å; G659-I683 PolarHBondContact O-N 2.9Å; L661-I683 HydrophobicContact CD1-CB 4.07Å; L661-I683 HydrophobicContact CD1-CG2 4.35Å; L661-I683 HydrophobicContact CD2-CB 4.3Å; L661-I683 HydrophobicContact CD2-CD1 4.35Å; L661-I683 HydrophobicContact CD2-CG2 3.87Å; L661-I683 HydrophobicContact CG-CB 4.18Å; L661-I683 HydrophobicContact CG-CG2 3.89Å; L675-I683 HydrophobicContact CD1-CD1 4.09Å; I683-L685 HydrophobicContact CG1-CD2 4.37Å; I683-L685 HydrophobicContact CG2-CD2 4.33Å; I683-V714 HydrophobicContact CD1-CB 4.33Å; I683-V714 HydrophobicContact CD1-CG2 3.51Å; I683-V719 HydrophobicContact CG2-CG1 4.09Å
684	A	88.8	Confident	85.8	Confident	8 Å²	8	50.8 Å²	50.8	7%	0.066	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	140.6	168.9	0	0	0	0	0	110.2	L656 F658 G705 Y706	L656-A684 HydrophobicContact CD1-CB 4.15Å; F658-A684 HydrophobicContact CD1-CB 4.19Å; F658-A684 HydrophobicContact CE1-CB 3.98Å; A684-G705 CarbonylContact O-C 3.58Å; A684-G705 WeakPolarHBondContact O-CA 3.21Å; A684-Y706 PolarHBondContact N-O 3.43Å; A684-Y706 PolarHBondContact O-N 2.88Å
685	L	89.7	Confident	84.8	Confident	11 Å²	11	50.4 Å²	50.4	6%	0.058	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	129.8	179.6	-55.7	-178.4	0	0	0	109.6	L656 K657 I683 Y703 V719 V721	L656-L685 WeakPolarHBondContact CD2-O 3.49Å; K657-L685 WeakPolarHBondContact O-CB 3.22Å; K657-L685 PolarHBondContact O-N 2.98Å; I683-L685 HydrophobicContact CG1-CD2 4.37Å; I683-L685 HydrophobicContact CG2-CD2 4.33Å; L685-Y703 HydrophobicContact CD1-CD2 4.37Å; L685-Y703 HydrophobicContact CD1-CG 4.39Å; L685-V719 HydrophobicContact CD1-CG1 4.4Å; L685-V721 HydrophobicContact CD1-CG2 4.03Å
686	L	85.4	Confident	83.5	Confident	6 Å²	6	59.5 Å²	59.5	3%	0.031	28%	0.281	C	S	.	.	S	Bend	trans	-86.9	-21.1	-174.6	-57.5	-166.2	0	0	0	113.6	L656 I704 V711 L735 L740 I947	L656-L686 HydrophobicContact CD2-CD2 3.63Å; L686-I704 HydrophobicContact CB-CB 4.49Å; L686-I704 HydrophobicContact CB-CG2 4.05Å; L686-I704 HydrophobicContact CD1-CG2 3.88Å; L686-I704 HydrophobicContact CG-CG2 4.11Å; L686-I704 PolarHBondContact N-O 2.83Å; L686-V711 HydrophobicContact CD1-CB 4.46Å; L686-V711 HydrophobicContact CD1-CG1 3.51Å; L686-V711 HydrophobicContact CD1-CG2 4.04Å; L686-L735 HydrophobicContact CD2-CD2 3.51Å; L686-L740 HydrophobicContact CD1-CD1 3.63Å; L686-I947 HydrophobicContact CB-CG2 4.41Å; L686-I947 WeakPolarHBondContact O-CD1 3.4Å
687	S	80.8	Confident	82.1	Confident	29 Å²	29	63.6 Å²	63.6	20%	0.203	30%	0.303	C	S	.	.			trans	-153	152.7	178.4	-176.7	0	0	0	0	110.3	E689	S687-E689 WeakPolarHBondContact OG-CB 3.46Å; S687-E689 PolarHBondContact OG-N 2.94Å; S687-E689 VanDerWaalsContact OG-N 3.12Å
688	E	74	Confident	81.4	Confident	132 Å²	132	72.9 Å²	72.9	62%	0.617	34%	0.339	S	S	*	.	S	Bend	trans	-81.3	-22.1	170.6	-50.8	-154.4	-139.8	0	0	111.8	K657	K657-E688 HydrophobicContact CD-CG 4.42Å; K657-E688 VanDerWaalsContact CE-CD 3.47Å; K657-E688 WeakPolarHBondContact CE-OE1 3.45Å; K657-E688 IonicContact NZ-OE1 2.92Å; K657-E688 PolarHBondContact NZ-OE1 2.99Å; K657-E688 IonicContact NZ-OE2 3.2Å; K657-E688 PolarHBondContact NZ-OE2 2.78Å
689	E	81.7	Confident	81.1	Confident	90 Å²	90	70.8 Å²	70.8	42%	0.421	34%	0.336	S	S	.	.	S	Bend	trans	-64	133	177.4	-64.3	-178.1	168.9	0	0	110.7	S687 R911 N943	S687-E689 WeakPolarHBondContact OG-CB 3.46Å; S687-E689 PolarHBondContact OG-N 2.94Å; S687-E689 VanDerWaalsContact OG-N 3.12Å; E689-R911 IonicContact OE1-NH1 2.58Å; E689-R911 PolarHBondContact OE1-NH1 2.99Å; E689-R911 IonicContact OE2-CZ 3.55Å; E689-R911 IonicContact OE2-NE 3.69Å; E689-R911 IonicContact OE2-NH1 3.5Å; E689-R911 PolarHBondContact OE2-NH1 3.26Å; E689-N943 PolarHBondContact OE2-OD1 3.31Å
690	R	86.1	Confident	81	Confident	123 Å²	123	68.3 Å²	68.3	46%	0.464	33%	0.325	S	S	.	.			trans	-99.1	115	-175.6	-64	-178.6	-176.5	166.2	15.3	110.7	R692 E701 Y703 T716	R690-R692 PolarHBondContact O-N 2.75Å; R690-E701 HydrophobicContact CB-CB 4.34Å; R690-E701 WeakPolarHBondContact CD-OE2 3.45Å; R690-E701 IonicContact CZ-OE2 2.84Å; R690-E701 IonicContact NE-OE2 2.62Å; R690-E701 IonicContact NH1-OE1 2.66Å; R690-E701 IonicContact NH1-OE2 2.89Å; R690-E701 PolarHBondContact NH1-OE2 2.96Å; R690-Y703 HydrophobicContact CG-CD1 4.1Å; R690-Y703 HydrophobicContact CG-CE1 3.7Å; R690-Y703 PolarHBondContact NE-OH 3.17Å; R690-Y703 PolarHBondContact NH2-OH 3.34Å; R690-T716 HydrophobicContact CG-CG2 4.29Å
691	V	87.8	Confident	81.4	Confident	2 Å²	2	70.9 Å²	70.9	1%	0.012	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	129.5	174.5	-166.8	0	0	0	0	109.2	L693 W702 I704 L713 L939	V691-L693 HydrophobicContact CB-CD1 4.06Å; V691-L693 HydrophobicContact CG1-CD1 3.61Å; V691-W702 PolarHBondContact N-O 2.98Å; V691-W702 PolarHBondContact O-N 2.78Å; V691-I704 HydrophobicContact CG2-CD1 3.86Å; V691-I704 HydrophobicContact CG2-CG1 3.9Å; V691-L713 HydrophobicContact CB-CD2 4.18Å; V691-L713 HydrophobicContact CG2-CD2 4.09Å; V691-L939 HydrophobicContact CG1-CB 4.33Å; V691-L939 HydrophobicContact CG1-CD1 3.89Å
692	R	88.8	Confident	81.6	Confident	91 Å²	91	71.2 Å²	71.2	34%	0.343	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122	179.1	-64.2	179.9	-71.3	134.6	8.4	109.1	R690 T699 Q915 E916 L919	R690-R692 PolarHBondContact O-N 2.75Å; R692-T699 HydrophobicContact CB-CG2 4.02Å; R692-Q915 PolarHBondContact O-NE2 3.45Å; R692-Q915 PolarHBondContact O-OE1 3.33Å; R692-E916 IonicContact CZ-OE1 3.92Å; R692-E916 IonicContact NH1-OE1 3Å; R692-E916 PolarHBondContact NH1-OE1 2.83Å; R692-E916 IonicContact NH2-OE1 2.77Å; R692-E916 PolarHBondContact NH2-OE1 3.19Å; R692-L919 HydrophobicContact CB-CD1 4.31Å
693	L	84.2	Confident	81.9	Confident	18 Å²	18	72.1 Å²	72.1	9%	0.094	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	144.7	174.9	-69	88.8	0	0	0	110.3	V691 G695 K700 W702 L713 T936	V691-L693 HydrophobicContact CB-CD1 4.06Å; V691-L693 HydrophobicContact CG1-CD1 3.61Å; L693-G695 PolarHBondContact O-N 3.34Å; L693-K700 PolarHBondContact N-O 2.83Å; L693-K700 PolarHBondContact O-N 2.86Å; L693-W702 HydrophobicContact CD1-CB 4.4Å; L693-W702 VanDerWaalsContact CD1-CD1 3.49Å; L693-W702 HydrophobicContact CD1-CG 4.03Å; L693-L713 HydrophobicContact CD1-CD1 3.59Å; L693-L713 HydrophobicContact CD2-CD1 3.84Å; L693-L713 HydrophobicContact CG-CD1 4.41Å; L693-T936 HydrophobicContact CD2-CG2 3.86Å
694	R	76.8	Confident	82	Confident	119 Å²	119	72 Å²	72	45%	0.449	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	120.7	-176.8	-149.8	-176.2	-179.6	-153.8	-1.3	111.2	D922	R694-D922 HydrophobicContact CB-CB 3.57Å; R694-D922 WeakPolarHBondContact CB-OD2 3.32Å; R694-D922 VanDerWaalsContact CD-O 3.25Å; R694-D922 WeakPolarHBondContact CD-O 3.29Å; R694-D922 HydrophobicContact CG-CB 4.5Å; R694-D922 PolarHBondContact N-OD2 3.07Å; R694-D922 PolarHBondContact NH1-O 2.93Å
695	G	68	Low	82.1	Confident	25 Å²	25	71.6 Å²	71.6	26%	0.258	33%	0.328	S	S	.	.			trans	-75.3	178.9	164.9	0	0	0	0	0	111.7	L693 L697 W698	L693-G695 PolarHBondContact O-N 3.34Å; G695-L697 PolarHBondContact O-N 3.01Å; G695-L697 VanDerWaalsContact O-N 3.08Å; G695-W698 VanDerWaalsContact CA-O 3.23Å; G695-W698 WeakPolarHBondContact CA-O 3.17Å; G695-W698 PolarHBondContact N-O 3.35Å
696	Q	60.9	Low	82.1	Confident	200 Å²	200	71.8 Å²	71.8	94%	0.935	33%	0.328	S	S	*	.	S	Bend	trans	-60.1	-19.7	-179.6	-175.3	171.1	-8.9	0	0	114.7
697	L	59.5	Low	82.3	Confident	143 Å²	143	72 Å²	72	75%	0.749	33%	0.329	S	S	*	.	S	Bend	trans	-134.8	-40.8	178.1	-68	171.1	0	0	0	112.2	G695	G695-L697 PolarHBondContact O-N 3.01Å; G695-L697 VanDerWaalsContact O-N 3.08Å
698	W	74	Confident	82.4	Confident	204 Å²	204	75.2 Å²	75.2	77%	0.773	34%	0.341	S	S	*	.	S	Bend	trans	-127.3	146.2	-172.9	-61.5	96.5	0	0	0	112	G695	G695-W698 VanDerWaalsContact CA-O 3.23Å; G695-W698 WeakPolarHBondContact CA-O 3.17Å; G695-W698 PolarHBondContact N-O 3.35Å
699	T	82.6	Confident	82.8	Confident	80 Å²	80	69.9 Å²	69.9	49%	0.491	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	138.9	166.9	-52.2	0	0	0	0	110.1	R692 L919	R692-T699 HydrophobicContact CB-CG2 4.02Å; T699-L919 HydrophobicContact CG2-CD2 4.16Å
700	K	87.2	Confident	83.1	Confident	95 Å²	95	72.4 Å²	72.4	41%	0.413	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	144.4	-177.9	-72.8	177.5	168.8	-167.3	0	110.1	L693 W702 H715	L693-K700 PolarHBondContact N-O 2.83Å; L693-K700 PolarHBondContact O-N 2.86Å; K700-W702 HydrophobicContact CB-CZ2 4.45Å; K700-W702 HydrophobicContact CD-CZ2 4.49Å; K700-W702 PolarHBondContact O-NE1 3.45Å; K700-H715 WeakPolarHBondContact CD-NE2 3.29Å
701	E	90.6	Very high	83.3	Confident	76 Å²	76	66.8 Å²	66.8	36%	0.355	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	142.9	175.8	-62.4	-179.4	163.6	0	0	111.1	R690 T716	R690-E701 HydrophobicContact CB-CB 4.34Å; R690-E701 WeakPolarHBondContact CD-OE2 3.45Å; R690-E701 IonicContact CZ-OE2 2.84Å; R690-E701 IonicContact NE-OE2 2.62Å; R690-E701 IonicContact NH1-OE1 2.66Å; R690-E701 IonicContact NH1-OE2 2.89Å; R690-E701 PolarHBondContact NH1-OE2 2.96Å; E701-T716 HydrophobicContact CB-CG2 3.61Å; E701-T716 PolarHBondContact O-N 2.89Å; E701-T716 VanDerWaalsContact O-N 3.12Å
702	W	91.7	Very high	83.4	Confident	32 Å²	32	66.7 Å²	66.7	12%	0.121	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	135	-179	-53.9	75.5	0	0	0	110.1	L674 V691 L693 K700 L713 V714 H715	L674-W702 HydrophobicContact CD2-CZ3 4.42Å; V691-W702 PolarHBondContact N-O 2.98Å; V691-W702 PolarHBondContact O-N 2.78Å; L693-W702 HydrophobicContact CD1-CB 4.4Å; L693-W702 VanDerWaalsContact CD1-CD1 3.49Å; L693-W702 HydrophobicContact CD1-CG 4.03Å; K700-W702 HydrophobicContact CB-CZ2 4.45Å; K700-W702 HydrophobicContact CD-CZ2 4.49Å; K700-W702 PolarHBondContact O-NE1 3.45Å; W702-L713 HydrophobicContact CB-CB 4.04Å; W702-L713 HydrophobicContact CB-CD1 4.5Å; W702-L713 HydrophobicContact CB-CD2 4Å; W702-L713 HydrophobicContact CB-CG 4.41Å; W702-L713 HydrophobicContact CD2-CB 4.39Å; W702-L713 HydrophobicContact CE3-CB 4Å; W702-L713 HydrophobicContact CG-CB 4.42Å; W702-V714 CarbonylContact C-O 3.51Å; W702-V714 VanDerWaalsContact CA-O 3.24Å; W702-V714 WeakPolarHBondContact CA-O 3.48Å; W702-H715 HydrophobicContact CD2-CB 4.32Å; W702-H715 HydrophobicContact CE3-CB 3.88Å; W702-H715 VanDerWaalsContact CE3-N 3.26Å; W702-H715 HydrophobicContact CH2-CB 4.13Å; W702-H715 AromaticContact CZ2-CD2 3.91Å; W702-H715 HydrophobicContact CZ3-CB 3.77Å
703	Y	91.9	Very high	83.6	Confident	28 Å²	28	62.4 Å²	62.4	11%	0.11	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	148.2	164.3	-64.4	-59.7	0	0	0	109.6	L685 R690 L713 V714 T716 V719 V721	L685-Y703 HydrophobicContact CD1-CD2 4.37Å; L685-Y703 HydrophobicContact CD1-CG 4.39Å; R690-Y703 HydrophobicContact CG-CD1 4.1Å; R690-Y703 HydrophobicContact CG-CE1 3.7Å; R690-Y703 PolarHBondContact NE-OH 3.17Å; R690-Y703 PolarHBondContact NH2-OH 3.34Å; Y703-L713 WeakPolarHBondContact O-CA 3.45Å; Y703-V714 PolarHBondContact N-O 3.47Å; Y703-V714 PolarHBondContact O-N 3.04Å; Y703-T716 HydrophobicContact CD1-CG2 4.46Å; Y703-T716 HydrophobicContact CD2-CG2 3.89Å; Y703-T716 HydrophobicContact CE1-CG2 4.28Å; Y703-T716 HydrophobicContact CE2-CG2 3.7Å; Y703-T716 HydrophobicContact CG-CG2 4.27Å; Y703-V719 HydrophobicContact CD2-CB 4.39Å; Y703-V719 HydrophobicContact CD2-CG2 4.44Å; Y703-V721 HydrophobicContact CE2-CG2 4.4Å
704	I	92.4	Very high	83.9	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	122.3	164.7	-59.9	166.7	0	0	0	107.2	L686 V691 V711 L713 I940 N943	L686-I704 HydrophobicContact CB-CB 4.49Å; L686-I704 HydrophobicContact CB-CG2 4.05Å; L686-I704 HydrophobicContact CD1-CG2 3.88Å; L686-I704 HydrophobicContact CG-CG2 4.11Å; L686-I704 PolarHBondContact N-O 2.83Å; V691-I704 HydrophobicContact CG2-CD1 3.86Å; V691-I704 HydrophobicContact CG2-CG1 3.9Å; I704-V711 HydrophobicContact CG2-CG1 3.88Å; I704-L713 HydrophobicContact CG1-CD2 3.74Å; I704-I940 HydrophobicContact CG1-CG1 4.4Å; I704-I940 HydrophobicContact CG2-CG2 4.07Å; I704-N943 HydrophobicContact CD1-CB 3.43Å; I704-N943 VanDerWaalsContact CD1-CB 3.43Å
705	G	90.4	Very high	84.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	165.5	179.8	0	0	0	0	0	113.2	L675 A684 V711 G712	L675-G705 WeakPolarHBondContact CD1-O 3.45Å; A684-G705 CarbonylContact O-C 3.58Å; A684-G705 WeakPolarHBondContact O-CA 3.21Å; G705-V711 CarbonylContact O-C 3.49Å; G705-V711 WeakPolarHBondContact O-CA 3.37Å; G705-G712 PolarHBondContact N-O 3.42Å; G705-G712 PolarHBondContact O-N 3.06Å; G705-G712 VanDerWaalsContact O-O 3.13Å
706	Y	90.5	Very high	85.6	Confident	14 Å²	14	56.8 Å²	56.8	6%	0.055	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	126.3	174.1	174.4	-97.5	0	0	0	109.9	A684 G709 R710 V711 P733 L735 V739	A684-Y706 PolarHBondContact N-O 3.43Å; A684-Y706 PolarHBondContact O-N 2.88Å; Y706-G709 WeakPolarHBondContact OH-CA 3.12Å; Y706-R710 WeakPolarHBondContact CA-O 3.28Å; Y706-V711 HydrophobicContact CD2-CG2 3.83Å; Y706-P733 WeakPolarHBondContact CE1-O 3.28Å; Y706-P733 PolarHBondContact OH-O 2.87Å; Y706-L735 HydrophobicContact CD1-CB 3.99Å; Y706-L735 HydrophobicContact CD1-CD1 4.49Å; Y706-L735 HydrophobicContact CD1-CD2 4.46Å; Y706-L735 HydrophobicContact CD2-CD1 3.77Å; Y706-L735 HydrophobicContact CD2-CD2 4.49Å; Y706-L735 HydrophobicContact CE1-CB 3.91Å; Y706-L735 HydrophobicContact CE1-CD1 4.44Å; Y706-L735 HydrophobicContact CE2-CD1 3.68Å; Y706-L735 HydrophobicContact CG-CB 4.38Å; Y706-L735 HydrophobicContact CG-CD1 4.14Å; Y706-L735 HydrophobicContact CG-CD2 4.14Å; Y706-L735 HydrophobicContact CG-CG 4.46Å; Y706-V739 HydrophobicContact CE2-CG1 4.24Å
707	Y	88.1	Confident	86.9	Confident	11 Å²	11	55.3 Å²	55.3	4%	0.043	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	131.2	-175.9	175.8	-90.3	0	0	0	109.4	L661 E676 K678 D681 G709 R710	L661-Y707 HydrophobicContact CD1-CD2 3.87Å; L661-Y707 HydrophobicContact CD1-CE2 3.63Å; E676-Y707 WeakPolarHBondContact O-CD1 3.46Å; E676-Y707 WeakPolarHBondContact O-CE1 2.97Å; K678-Y707 PolarHBondContact N-OH 2.8Å; D681-Y707 HydrophobicContact CB-CE2 3.98Å; D681-Y707 PolarHBondContact OD2-OH 2.88Å; Y707-G709 PolarHBondContact O-N 3.45Å; Y707-R710 PolarHBondContact N-O 3.38Å; Y707-R710 PolarHBondContact O-N 2.89Å
708	Q	83.8	Confident	88.4	Confident	96 Å²	96	49.4 Å²	49.4	45%	0.449	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.5	53.4	176.8	-63.3	-177.2	-6.1	0	0	113.9	R710	Q708-R710 VanDerWaalsContact C-N 3.31Å; Q708-R710 PolarHBondContact O-N 3.19Å
709	G	82.4	Confident	89.2	Confident	21 Å²	21	40.3 Å²	40.3	22%	0.216	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	10.7	176.5	0	0	0	0	0	115.7	Y706 Y707 Q743	Y706-G709 WeakPolarHBondContact OH-CA 3.12Å; Y707-G709 PolarHBondContact O-N 3.45Å; G709-Q743 VanDerWaalsContact O-CD 3.32Å; G709-Q743 PolarHBondContact O-NE2 2.92Å; G709-Q743 PolarHBondContact O-OE1 2.76Å
710	R	87.1	Confident	89.4	Confident	142 Å²	142	41.2 Å²	41.2	54%	0.536	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135.7	-177.3	-59.2	-177.9	-172.2	170.1	7	112.2	L675 Y706 Y707 Q708	L675-R710 HydrophobicContact CD2-CB 3.78Å; Y706-R710 WeakPolarHBondContact CA-O 3.28Å; Y707-R710 PolarHBondContact N-O 3.38Å; Y707-R710 PolarHBondContact O-N 2.89Å; Q708-R710 VanDerWaalsContact C-N 3.31Å; Q708-R710 PolarHBondContact O-N 3.19Å
711	V	90.3	Very high	89.4	Confident	6 Å²	6	39.7 Å²	39.7	4%	0.036	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	136.4	166.5	-178.4	0	0	0	0	109.4	L686 I704 G705 Y706 L740 Q743 I940	L686-V711 HydrophobicContact CD1-CB 4.46Å; L686-V711 HydrophobicContact CD1-CG1 3.51Å; L686-V711 HydrophobicContact CD1-CG2 4.04Å; I704-V711 HydrophobicContact CG2-CG1 3.88Å; G705-V711 CarbonylContact O-C 3.49Å; G705-V711 WeakPolarHBondContact O-CA 3.37Å; Y706-V711 HydrophobicContact CD2-CG2 3.83Å; V711-L740 HydrophobicContact CG2-CD1 4.09Å; V711-Q743 HydrophobicContact CB-CB 4.03Å; V711-Q743 HydrophobicContact CG2-CB 3.73Å; V711-Q743 HydrophobicContact CG2-CG 4.13Å; V711-I940 HydrophobicContact CG1-CG2 3.66Å
712	G	90.7	Very high	88.9	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179	-176.2	175	0	0	0	0	0	113.7	G705	G705-G712 PolarHBondContact N-O 3.42Å; G705-G712 PolarHBondContact O-N 3.06Å; G705-G712 VanDerWaalsContact O-O 3.13Å
713	L	91.6	Very high	88.1	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	136.9	-174.5	-63.9	173.2	0	0	0	113.1	Y673 L674 L675 V691 L693 W702 Y703 I704 T936 I940	Y673-L713 PolarHBondContact O-N 2.89Å; L674-L713 HydrophobicContact CD2-CB 3.97Å; L674-L713 HydrophobicContact CD2-CD1 4.15Å; L675-L713 PolarHBondContact N-O 3.02Å; L675-L713 VanDerWaalsContact N-O 3.13Å; V691-L713 HydrophobicContact CB-CD2 4.18Å; V691-L713 HydrophobicContact CG2-CD2 4.09Å; L693-L713 HydrophobicContact CD1-CD1 3.59Å; L693-L713 HydrophobicContact CD2-CD1 3.84Å; L693-L713 HydrophobicContact CG-CD1 4.41Å; W702-L713 HydrophobicContact CB-CB 4.04Å; W702-L713 HydrophobicContact CB-CD1 4.5Å; W702-L713 HydrophobicContact CB-CD2 4Å; W702-L713 HydrophobicContact CB-CG 4.41Å; W702-L713 HydrophobicContact CD2-CB 4.39Å; W702-L713 HydrophobicContact CE3-CB 4Å; W702-L713 HydrophobicContact CG-CB 4.42Å; Y703-L713 WeakPolarHBondContact O-CA 3.45Å; I704-L713 HydrophobicContact CG1-CD2 3.74Å; L713-T936 HydrophobicContact CD1-CG2 3.47Å; L713-T936 VanDerWaalsContact CD1-CG2 3.47Å; L713-I940 HydrophobicContact CD2-CG1 4.23Å; L713-I940 HydrophobicContact CG-CD1 4.2Å; L713-I940 HydrophobicContact CG-CG1 4.25Å
714	V	91	Very high	86.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	133.6	170.7	-178.2	0	0	0	0	110.4	L661 L675 Y677 I683 W702 Y703 T716 V719	L661-V714 HydrophobicContact CD2-CG1 4.14Å; L675-V714 HydrophobicContact CB-CG2 3.87Å; L675-V714 HydrophobicContact CD1-CG2 3.79Å; L675-V714 HydrophobicContact CG-CG2 4.34Å; Y677-V714 HydrophobicContact CD1-CG1 4.5Å; Y677-V714 HydrophobicContact CD1-CG2 4.09Å; Y677-V714 HydrophobicContact CE1-CB 4.32Å; Y677-V714 HydrophobicContact CE1-CG1 3.77Å; Y677-V714 HydrophobicContact CE1-CG2 3.82Å; Y677-V714 HydrophobicContact CE2-CG1 4.49Å; I683-V714 HydrophobicContact CD1-CB 4.33Å; I683-V714 HydrophobicContact CD1-CG2 3.51Å; W702-V714 CarbonylContact C-O 3.51Å; W702-V714 VanDerWaalsContact CA-O 3.24Å; W702-V714 WeakPolarHBondContact CA-O 3.48Å; Y703-V714 PolarHBondContact N-O 3.47Å; Y703-V714 PolarHBondContact O-N 3.04Å; V714-T716 PolarHBondContact O-N 3.07Å; V714-V719 HydrophobicContact CB-CG2 4.19Å; V714-V719 HydrophobicContact CG1-CG2 3.36Å
715	H	90.8	Very high	85.2	Confident	25 Å²	25	51 Å²	51	12%	0.116	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	130.6	-176.4	-173.3	-84	0	0	0	110.7	K700 W702 K717 N718	K700-H715 WeakPolarHBondContact CD-NE2 3.29Å; W702-H715 HydrophobicContact CD2-CB 4.32Å; W702-H715 HydrophobicContact CE3-CB 3.88Å; W702-H715 VanDerWaalsContact CE3-N 3.26Å; W702-H715 HydrophobicContact CH2-CB 4.13Å; W702-H715 AromaticContact CZ2-CD2 3.91Å; W702-H715 HydrophobicContact CZ3-CB 3.77Å; H715-K717 VanDerWaalsContact C-N 3.34Å; H715-K717 PolarHBondContact ND1-N 2.93Å; H715-K717 PolarHBondContact O-N 3.32Å; H715-N718 WeakPolarHBondContact O-CB 3.49Å; H715-N718 PolarHBondContact O-N 3.04Å
716	T	90.4	Very high	83.9	Confident	19 Å²	19	57.3 Å²	57.3	12%	0.117	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-53.5	-47.1	-172.4	54	0	0	0	0	112.9	R690 E701 Y703 V714 N718 V719	R690-T716 HydrophobicContact CG-CG2 4.29Å; E701-T716 HydrophobicContact CB-CG2 3.61Å; E701-T716 PolarHBondContact O-N 2.89Å; E701-T716 VanDerWaalsContact O-N 3.12Å; Y703-T716 HydrophobicContact CD1-CG2 4.46Å; Y703-T716 HydrophobicContact CD2-CG2 3.89Å; Y703-T716 HydrophobicContact CE1-CG2 4.28Å; Y703-T716 HydrophobicContact CE2-CG2 3.7Å; Y703-T716 HydrophobicContact CG-CG2 4.27Å; V714-T716 PolarHBondContact O-N 3.07Å; T716-N718 PolarHBondContact O-N 3.47Å; T716-V719 PolarHBondContact O-N 3.38Å
717	K	89.1	Confident	82.4	Confident	168 Å²	168	58.3 Å²	58.3	73%	0.73	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-63.8	-1.1	177.6	-53.2	-169.1	179.8	-169.1	0	115.8	H715	H715-K717 VanDerWaalsContact C-N 3.34Å; H715-K717 PolarHBondContact ND1-N 2.93Å; H715-K717 PolarHBondContact O-N 3.32Å
718	N	90.6	Very high	80.8	Confident	20 Å²	20	64.2 Å²	64.2	11%	0.107	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-107	-0.3	174.8	-68.8	3.1	0	0	0	112.9	L662 Y677 H715 T716	L662-N718 PolarHBondContact N-O 3.37Å; Y677-N718 HydrophobicContact CE2-CB 4.31Å; Y677-N718 PolarHBondContact OH-ND2 3.39Å; H715-N718 WeakPolarHBondContact O-CB 3.49Å; H715-N718 PolarHBondContact O-N 3.04Å; T716-N718 PolarHBondContact O-N 3.47Å
719	V	89.5	Confident	79.2	Confident	13 Å²	13	64.5 Å²	64.5	8%	0.079	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.1	179.3	-170.6	0	0	0	0	109.7	L661 I683 L685 Y703 V714 T716	L661-V719 HydrophobicContact CD2-CG2 4.33Å; I683-V719 HydrophobicContact CG2-CG1 4.09Å; L685-V719 HydrophobicContact CD1-CG1 4.4Å; Y703-V719 HydrophobicContact CD2-CB 4.39Å; Y703-V719 HydrophobicContact CD2-CG2 4.44Å; V714-V719 HydrophobicContact CB-CG2 4.19Å; V714-V719 HydrophobicContact CG1-CG2 3.36Å; T716-V719 PolarHBondContact O-N 3.38Å
720	L	88.5	Confident	77.8	Confident	99 Å²	99	65 Å²	65	52%	0.518	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	116.7	160.9	176.5	64.8	0	0	0	107.6	G659 K660 L662	G659-L720 CarbonylContact C-O 3.58Å; G659-L720 WeakPolarHBondContact CA-O 3.38Å; K660-L720 PolarHBondContact N-O 3.02Å; K660-L720 PolarHBondContact O-N 3.03Å; L662-L720 HydrophobicContact CD1-CB 4.25Å; L662-L720 HydrophobicContact CD2-CB 3.96Å; L662-L720 HydrophobicContact CG-CB 4.22Å
721	V	86.5	Confident	76.2	Confident	63 Å²	63	61.9 Å²	61.9	38%	0.382	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	129.7	175.8	-175.7	0	0	0	0	108.6	L685 Y703	L685-V721 HydrophobicContact CD1-CG2 4.03Å; Y703-V721 HydrophobicContact CE2-CG2 4.4Å
722	V	79	Confident	74.8	Confident	81 Å²	81	63.6 Å²	63.6	49%	0.491	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	-26.5	-172.7	-178.2	0	0	0	0	112	F658 K660	F658-V722 PolarHBondContact O-N 2.92Å; K660-V722 HydrophobicContact CB-CG2 4.03Å
723	G	74.9	Confident	73.6	Confident	25 Å²	25	67.4 Å²	67.4	26%	0.258	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	133.3	-155.6	175.5	0	0	0	0	0	112.7	K657 F658	K657-G723 CarbonylContact C-O 3.36Å; K657-G723 WeakPolarHBondContact CA-O 3.47Å; F658-G723 PolarHBondContact N-O 3.09Å; F658-G723 PolarHBondContact O-N 3.03Å
724	R	66.3	Low	72.8	Confident	189 Å²	189	72.2 Å²	72.2	71%	0.713	41%	0.406	S	S	*	.	S	Bend	trans	-85.9	-20.7	172.5	-73.1	-175.5	175.5	178.3	0.9	113.5	R726	R724-R726 PolarHBondContact O-N 3.3Å
725	A	57.2	Low	72.5	Confident	77 Å²	77	72.6 Å²	72.6	64%	0.636	41%	0.408	S	S	*	.	S	Bend	trans	-66.4	124.4	177	0	0	0	0	0	110.7	P727	A725-P727 VanDerWaalsContact O-CD 3.26Å; A725-P727 WeakPolarHBondContact O-CD 3.14Å
726	R	63.9	Low	72.4	Confident	134 Å²	134	72.7 Å²	72.7	51%	0.506	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-66.5	117.2	177.5	-175.7	177.7	-176.3	155.5	0.5	109.7	F658 R724 E734	F658-R726 HydrophobicContact CD2-CB 4.34Å; F658-R726 HydrophobicContact CE1-CG 4.12Å; F658-R726 HydrophobicContact CE2-CB 3.88Å; F658-R726 HydrophobicContact CE2-CG 4.33Å; F658-R726 HydrophobicContact CZ-CB 3.99Å; F658-R726 HydrophobicContact CZ-CG 3.93Å; R724-R726 PolarHBondContact O-N 3.3Å; R726-E734 IonicContact CZ-OE2 2.77Å; R726-E734 VanDerWaalsContact NH1-CD 3.31Å; R726-E734 IonicContact NH1-OE1 3.78Å; R726-E734 PolarHBondContact NH1-OE1 3.3Å; R726-E734 IonicContact NH1-OE2 3.7Å; R726-E734 PolarHBondContact NH1-OE2 2.93Å; R726-E734 IonicContact NH2-OE2 3.69Å; R726-E734 PolarHBondContact NH2-OE2 3.03Å
727	P	59.6	Low	72.3	Confident	34 Å²	34	71.8 Å²	71.8	22%	0.221	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-62.6	141	175.9	-22.6	33.9	0	0	0	111.1	F658 A725 L729 C730	F658-P727 VanDerWaalsContact CB-CD 3.44Å; F658-P727 HydrophobicContact CB-CG 3.95Å; A725-P727 VanDerWaalsContact O-CD 3.26Å; A725-P727 WeakPolarHBondContact O-CD 3.14Å; P727-L729 PolarHBondContact O-N 3.03Å; P727-C730 PolarHBondContact O-N 3.46Å
728	S	53.8	Low	72.3	Confident	135 Å²	135	65.7 Å²	65.7	94%	0.944	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-1.2	177.1	50.8	0	0	0	0	115
729	L	51.1	Low	72.3	Confident	102 Å²	102	67.1 Å²	67.1	53%	0.534	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	31.3	180	-148.7	78.4	0	0	0	112.9	G682 P727 S731	G682-L729 PolarHBondContact N-O 2.97Å; P727-L729 PolarHBondContact O-N 3.03Å; L729-S731 PolarHBondContact O-N 3.49Å
730	C	52.8	Low	72.3	Confident	33 Å²	33	66.5 Å²	66.5	22%	0.223	39%	0.39	C	S	.	.			trans	-83.1	80.5	174.7	-93.1	0	0	0	0	111.9	P727 G732	P727-C730 PolarHBondContact O-N 3.46Å; C730-G732 PolarHBondContact O-N 2.98Å; C730-G732 VanDerWaalsContact O-N 3.16Å
731	S	53.3	Low	72.4	Confident	75 Å²	75	62 Å²	62	52%	0.524	37%	0.367	S	S	.	.			trans	-75.5	95.6	178.5	-55.6	0	0	0	0	113.1	L729	L729-S731 PolarHBondContact O-N 3.49Å
732	G	60.2	Low	72.6	Confident	42 Å²	42	62.9 Å²	62.9	43%	0.433	37%	0.367	S	S	.	.	S	Bend	trans	174.5	167.3	170.6	0	0	0	0	0	113.1	C730	C730-G732 PolarHBondContact O-N 2.98Å; C730-G732 VanDerWaalsContact O-N 3.16Å
733	P	65.3	Low	73	Confident	81 Å²	81	60.3 Å²	60.3	53%	0.526	35%	0.349	S	S	.	.			trans	-63.7	154.3	171.6	27.7	-33.9	0	0	0	111.3	Y706	Y706-P733 WeakPolarHBondContact CE1-O 3.28Å; Y706-P733 PolarHBondContact OH-O 2.87Å
734	E	75.8	Confident	73.8	Confident	102 Å²	102	59.2 Å²	59.2	48%	0.477	34%	0.337	S	S	.	.			trans	-63.8	146.3	175.7	-160.2	98.9	173	0	0	111	P652 R726 S736	P652-E734 HydrophobicContact CB-CG 4.21Å; R726-E734 IonicContact CZ-OE2 2.77Å; R726-E734 VanDerWaalsContact NH1-CD 3.31Å; R726-E734 IonicContact NH1-OE1 3.78Å; R726-E734 PolarHBondContact NH1-OE1 3.3Å; R726-E734 IonicContact NH1-OE2 3.7Å; R726-E734 PolarHBondContact NH1-OE2 2.93Å; R726-E734 IonicContact NH2-OE2 3.69Å; R726-E734 PolarHBondContact NH2-OE2 3.03Å; E734-S736 PolarHBondContact O-N 3.38Å
735	L	83.5	Confident	75	Confident	8 Å²	8	50.2 Å²	50.2	4%	0.042	30%	0.303	C	S	.	.			trans	-85.4	100.2	174.2	-178.9	60	0	0	0	110.2	V653 L656 L686 Y706 V739 L740	V653-L735 HydrophobicContact CB-CD2 4.22Å; V653-L735 HydrophobicContact CB-CG 4.23Å; V653-L735 HydrophobicContact CG2-CD2 4.18Å; V653-L735 HydrophobicContact CG2-CG 3.92Å; V653-L735 WeakPolarHBondContact CG2-O 3.28Å; V653-L735 PolarHBondContact N-O 2.87Å; L656-L735 HydrophobicContact CD1-CD2 4.28Å; L686-L735 HydrophobicContact CD2-CD2 3.51Å; Y706-L735 HydrophobicContact CD1-CB 3.99Å; Y706-L735 HydrophobicContact CD1-CD1 4.49Å; Y706-L735 HydrophobicContact CD1-CD2 4.46Å; Y706-L735 HydrophobicContact CD2-CD1 3.77Å; Y706-L735 HydrophobicContact CD2-CD2 4.49Å; Y706-L735 HydrophobicContact CE1-CB 3.91Å; Y706-L735 HydrophobicContact CE1-CD1 4.44Å; Y706-L735 HydrophobicContact CE2-CD1 3.68Å; Y706-L735 HydrophobicContact CG-CB 4.38Å; Y706-L735 HydrophobicContact CG-CD1 4.14Å; Y706-L735 HydrophobicContact CG-CD2 4.14Å; Y706-L735 HydrophobicContact CG-CG 4.46Å; L735-V739 HydrophobicContact CD1-CB 4.44Å; L735-V739 HydrophobicContact CD1-CG1 4.1Å; L735-L740 HydrophobicContact CD1-CB 3.93Å; L735-L740 HydrophobicContact CG-CB 4.43Å
736	S	89.3	Confident	76.4	Confident	26 Å²	26	51.1 Å²	51.1	18%	0.182	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-78.5	158.1	164.3	72.6	0	0	0	0	111.8	R651 E734 S738 V739 L740	R651-S736 CarbonylContact O-C 3.54Å; R651-S736 VanDerWaalsContact O-CA 3.32Å; R651-S736 WeakPolarHBondContact O-CA 3.3Å; E734-S736 PolarHBondContact O-N 3.38Å; S736-S738 VanDerWaalsContact C-N 3.31Å; S736-S738 PolarHBondContact O-N 2.96Å; S736-S738 PolarHBondContact OG-OG 2.77Å; S736-V739 PolarHBondContact O-N 3.49Å; S736-V739 WeakPolarHBondContact OG-CB 3.48Å; S736-V739 VanDerWaalsContact OG-CG2 3.32Å; S736-V739 WeakPolarHBondContact OG-CG2 3.48Å; S736-V739 PolarHBondContact OG-N 2.68Å; S736-V739 VanDerWaalsContact OG-N 3.13Å; S736-L740 WeakPolarHBondContact O-CB 3.37Å; S736-L740 PolarHBondContact O-N 2.92Å
737	T	89.2	Confident	77.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61	-34.4	172.3	39	0	0	0	0	113.4	Q649 D650 R651 V653 L740 L741 L948 A951 A952	Q649-T737 PolarHBondContact O-OG1 2.96Å; D650-T737 VanDerWaalsContact CA-OG1 3.32Å; D650-T737 WeakPolarHBondContact CA-OG1 3.49Å; D650-T737 PolarHBondContact OD1-N 3.22Å; D650-T737 PolarHBondContact OD1-OG1 3.1Å; R651-T737 PolarHBondContact N-OG1 3.14Å; R651-T737 PolarHBondContact O-N 3.3Å; R651-T737 PolarHBondContact O-OG1 2.98Å; V653-T737 HydrophobicContact CG2-CG2 3.93Å; T737-L740 PolarHBondContact O-N 3.31Å; T737-L741 VanDerWaalsContact O-CB 3.24Å; T737-L741 WeakPolarHBondContact O-CB 3.41Å; T737-L741 PolarHBondContact O-N 3.23Å; T737-L948 HydrophobicContact CG2-CD1 4.47Å; T737-A951 HydrophobicContact CG2-CB 3.54Å; T737-A952 HydrophobicContact CG2-CB 3.97Å
738	S	88.6	Confident	78.7	Confident	41 Å²	41	43.2 Å²	43.2	29%	0.287	26%	0.256	S	S	.	.	H	α-helix	trans	-67.5	-43	174.9	60	0	0	0	0	112.2	D650 S736 L741 E742	D650-S738 VanDerWaalsContact CG-CB 3.44Å; D650-S738 WeakPolarHBondContact OD1-CB 3.12Å; D650-S738 PolarHBondContact OD1-N 2.9Å; D650-S738 PolarHBondContact OD1-OG 2.84Å; D650-S738 WeakPolarHBondContact OD2-CB 3.45Å; D650-S738 PolarHBondContact OD2-OG 2.9Å; S736-S738 VanDerWaalsContact C-N 3.31Å; S736-S738 PolarHBondContact O-N 2.96Å; S736-S738 PolarHBondContact OG-OG 2.77Å; S738-L741 PolarHBondContact O-N 2.83Å; S738-E742 PolarHBondContact O-N 3.36Å
739	V	89.5	Confident	80.2	Confident	49 Å²	49	40.8 Å²	40.8	30%	0.297	23%	0.229	S	C	.	.	H	α-helix	trans	-64.1	-45	173.4	170.2	0	0	0	0	109.8	Y706 L735 S736 L741 E742 Q743	Y706-V739 HydrophobicContact CE2-CG1 4.24Å; L735-V739 HydrophobicContact CD1-CB 4.44Å; L735-V739 HydrophobicContact CD1-CG1 4.1Å; S736-V739 PolarHBondContact O-N 3.49Å; S736-V739 WeakPolarHBondContact OG-CB 3.48Å; S736-V739 VanDerWaalsContact OG-CG2 3.32Å; S736-V739 WeakPolarHBondContact OG-CG2 3.48Å; S736-V739 PolarHBondContact OG-N 2.68Å; S736-V739 VanDerWaalsContact OG-N 3.13Å; V739-L741 PolarHBondContact O-N 3.45Å; V739-E742 PolarHBondContact O-N 3.06Å; V739-Q743 HydrophobicContact CG1-CG 4.2Å; V739-Q743 WeakPolarHBondContact O-CG 3.47Å; V739-Q743 PolarHBondContact O-N 3.5Å
740	L	90.2	Very high	81.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-55.5	-51.4	175.3	179	57.3	0	0	0	111.3	V653 L686 V711 L735 S736 T737 E742 Q743 I744 I947 L948	V653-L740 HydrophobicContact CG2-CD2 4.08Å; L686-L740 HydrophobicContact CD1-CD1 3.63Å; V711-L740 HydrophobicContact CG2-CD1 4.09Å; L735-L740 HydrophobicContact CD1-CB 3.93Å; L735-L740 HydrophobicContact CG-CB 4.43Å; S736-L740 WeakPolarHBondContact O-CB 3.37Å; S736-L740 PolarHBondContact O-N 2.92Å; T737-L740 PolarHBondContact O-N 3.31Å; L740-E742 PolarHBondContact O-N 3.48Å; L740-Q743 PolarHBondContact O-N 3.15Å; L740-I744 HydrophobicContact CD1-CG2 3.84Å; L740-I744 WeakPolarHBondContact O-CG1 3.36Å; L740-I744 WeakPolarHBondContact O-CG2 3.45Å; L740-I744 PolarHBondContact O-N 2.87Å; L740-I947 HydrophobicContact CD2-CG2 4.43Å; L740-L948 HydrophobicContact CD2-CB 3.98Å; L740-L948 HydrophobicContact CD2-CD1 4.06Å; L740-L948 HydrophobicContact CG-CD1 4.28Å
741	L	91.4	Very high	83.3	Confident	5 Å²	5	39.1 Å²	39.1	3%	0.026	21%	0.214	C	C	.	.	H	α-helix	trans	-55.4	-48.8	178.9	-178	62.2	0	0	0	112.2	F648 T737 S738 V739 I744 L745 M826 L829 K830 L948	F648-L741 HydrophobicContact CE2-CD2 4.02Å; F648-L741 HydrophobicContact CZ-CD2 3.91Å; T737-L741 VanDerWaalsContact O-CB 3.24Å; T737-L741 WeakPolarHBondContact O-CB 3.41Å; T737-L741 PolarHBondContact O-N 3.23Å; S738-L741 PolarHBondContact O-N 2.83Å; V739-L741 PolarHBondContact O-N 3.45Å; L741-I744 WeakPolarHBondContact O-CG1 3.2Å; L741-L745 HydrophobicContact CD1-CD1 3.6Å; L741-L745 HydrophobicContact CD1-CG 4.18Å; L741-L745 HydrophobicContact CG-CD1 3.9Å; L741-L745 WeakPolarHBondContact O-CB 3.4Å; L741-L745 WeakPolarHBondContact O-CD1 3.33Å; L741-L745 WeakPolarHBondContact O-CG 3.35Å; L741-L745 PolarHBondContact O-N 3.19Å; L741-L745 VanDerWaalsContact O-N 3.14Å; L741-M826 HydrophobicContact CD1-CG 4.43Å; L741-M826 HydrophobicContact CD2-CG 3.75Å; L741-M826 HydrophobicContact CG-CG 4.12Å; L741-L829 HydrophobicContact CD1-CB 3.98Å; L741-L829 HydrophobicContact CD1-CD1 3.46Å; L741-L829 VanDerWaalsContact CD1-CD1 3.46Å; L741-L829 HydrophobicContact CD1-CG 4.37Å; L741-K830 HydrophobicContact CD2-CG 4.35Å; L741-L948 HydrophobicContact CB-CD1 4.39Å; L741-L948 HydrophobicContact CD1-CD2 3.93Å
742	E	89	Confident	84.9	Confident	82 Å²	82	36.5 Å²	36.5	38%	0.383	20%	0.195	S	C	.	.	H	α-helix	trans	-64.4	-39.2	176.6	-85.4	-61.7	146.5	0	0	113.3	S738 V739 L740 K822 M826	S738-E742 PolarHBondContact O-N 3.36Å; V739-E742 PolarHBondContact O-N 3.06Å; L740-E742 PolarHBondContact O-N 3.48Å; E742-K822 VanDerWaalsContact CD-NZ 3.29Å; E742-K822 VanDerWaalsContact OE1-CE 3.22Å; E742-K822 WeakPolarHBondContact OE1-CE 3.27Å; E742-K822 IonicContact OE1-NZ 2.85Å; E742-K822 PolarHBondContact OE1-NZ 3.37Å; E742-K822 WeakPolarHBondContact OE2-CE 3.39Å; E742-K822 IonicContact OE2-NZ 2.73Å; E742-K822 PolarHBondContact OE2-NZ 2.88Å; E742-K822 VanDerWaalsContact OE2-NZ 3.11Å; E742-M826 WeakPolarHBondContact OE1-CE 3.34Å
743	Q	89.1	Confident	86.1	Confident	26 Å²	26	35.1 Å²	35.1	12%	0.121	18%	0.176	C	C	.	.	H	α-helix	trans	-67.5	-43.7	179.6	-61.6	-74.2	-39.6	0	0	111.2	G709 V711 V739 L740 R746	G709-Q743 VanDerWaalsContact O-CD 3.32Å; G709-Q743 PolarHBondContact O-NE2 2.92Å; G709-Q743 PolarHBondContact O-OE1 2.76Å; V711-Q743 HydrophobicContact CB-CB 4.03Å; V711-Q743 HydrophobicContact CG2-CB 3.73Å; V711-Q743 HydrophobicContact CG2-CG 4.13Å; V739-Q743 HydrophobicContact CG1-CG 4.2Å; V739-Q743 WeakPolarHBondContact O-CG 3.47Å; V739-Q743 PolarHBondContact O-N 3.5Å; L740-Q743 PolarHBondContact O-N 3.15Å; Q743-R746 VanDerWaalsContact NE2-NH2 3.14Å; Q743-R746 WeakPolarHBondContact O-CG 3.29Å
744	I	91	Very high	87	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-75.3	-26.1	-176.5	70.4	173.8	0	0	0	113.4	L740 L741 R746 P747 I940 L941 L945 L948	L740-I744 HydrophobicContact CD1-CG2 3.84Å; L740-I744 WeakPolarHBondContact O-CG1 3.36Å; L740-I744 WeakPolarHBondContact O-CG2 3.45Å; L740-I744 PolarHBondContact O-N 2.87Å; L741-I744 WeakPolarHBondContact O-CG1 3.2Å; I744-R746 VanDerWaalsContact C-N 3.34Å; I744-R746 PolarHBondContact O-N 2.75Å; I744-P747 WeakPolarHBondContact O-CD 3.3Å; I744-P747 VanDerWaalsContact O-CG 3.27Å; I744-P747 WeakPolarHBondContact O-CG 3.42Å; I744-I940 HydrophobicContact CG2-CG2 4.37Å; I744-L941 HydrophobicContact CB-CB 4.2Å; I744-L941 HydrophobicContact CB-CG 4.46Å; I744-L941 HydrophobicContact CD1-CG 4.37Å; I744-L941 HydrophobicContact CG1-CD1 4.41Å; I744-L941 HydrophobicContact CG1-CG 4.47Å; I744-L941 VanDerWaalsContact O-CD1 3.3Å; I744-L941 WeakPolarHBondContact O-CD1 3.5Å; I744-L945 HydrophobicContact CD1-CD2 4.3Å; I744-L948 HydrophobicContact CD1-CD2 3.9Å
745	L	91.1	Very high	87.4	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-80.2	-8.4	-178.9	-73	174.1	0	0	0	115	L741 C748 K822 V825 M826 L829 L941	L741-L745 HydrophobicContact CD1-CD1 3.6Å; L741-L745 HydrophobicContact CD1-CG 4.18Å; L741-L745 HydrophobicContact CG-CD1 3.9Å; L741-L745 WeakPolarHBondContact O-CB 3.4Å; L741-L745 WeakPolarHBondContact O-CD1 3.33Å; L741-L745 WeakPolarHBondContact O-CG 3.35Å; L741-L745 PolarHBondContact O-N 3.19Å; L741-L745 VanDerWaalsContact O-N 3.14Å; L745-C748 VanDerWaalsContact O-CB 3.28Å; L745-C748 WeakPolarHBondContact O-CB 3.31Å; L745-C748 PolarHBondContact O-N 3.13Å; L745-K822 HydrophobicContact CB-CG 3.87Å; L745-K822 HydrophobicContact CD1-CG 4.48Å; L745-V825 HydrophobicContact CD2-CB 4.01Å; L745-V825 HydrophobicContact CD2-CG1 3.49Å; L745-V825 VanDerWaalsContact CD2-CG1 3.49Å; L745-M826 HydrophobicContact CD1-CB 3.64Å; L745-M826 HydrophobicContact CD1-CE 4.47Å; L745-M826 HydrophobicContact CD1-CG 3.86Å; L745-L829 HydrophobicContact CD1-CD1 4.49Å; L745-L829 HydrophobicContact CD2-CD1 3.9Å; L745-L829 HydrophobicContact CG-CD1 4.39Å; L745-L941 HydrophobicContact CD2-CD1 3.86Å
746	R	86.6	Confident	87.4	Confident	96 Å²	96	31.7 Å²	31.7	36%	0.362	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-46.4	-47.5	174.5	-71.2	178	172.4	161.8	4.9	116.2	Y673 Q743 I744 C748 K749 F750	Y673-R746 HydrophobicContact CE1-CB 4.47Å; Q743-R746 VanDerWaalsContact NE2-NH2 3.14Å; Q743-R746 WeakPolarHBondContact O-CG 3.29Å; I744-R746 VanDerWaalsContact C-N 3.34Å; I744-R746 PolarHBondContact O-N 2.75Å; R746-C748 PolarHBondContact O-N 2.77Å; R746-K749 PolarHBondContact O-N 3.3Å; R746-F750 WeakPolarHBondContact O-CD2 3.47Å
747	P	86.7	Confident	87.2	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.006	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-55.1	-33.1	174.3	23.7	-39.6	0	0	0	114.5	Y673 I744 K749 F750 H934 T938	Y673-P747 WeakPolarHBondContact OH-CA 3.31Å; Y673-P747 WeakPolarHBondContact OH-CD 3.45Å; I744-P747 WeakPolarHBondContact O-CD 3.3Å; I744-P747 VanDerWaalsContact O-CG 3.27Å; I744-P747 WeakPolarHBondContact O-CG 3.42Å; P747-K749 PolarHBondContact O-N 2.85Å; P747-F750 PolarHBondContact O-N 2.87Å; P747-H934 HydrophobicContact CB-CB 4.41Å; P747-T938 WeakPolarHBondContact CB-OG1 3.48Å
748	C	86.2	Confident	87.1	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.007	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-62.4	-18.3	-174	-56.1	0	0	0	0	113.4	L745 R746 F750 Q821	L745-C748 VanDerWaalsContact O-CB 3.28Å; L745-C748 WeakPolarHBondContact O-CB 3.31Å; L745-C748 PolarHBondContact O-N 3.13Å; R746-C748 PolarHBondContact O-N 2.77Å; C748-F750 PolarHBondContact O-N 2.87Å; C748-Q821 WeakPolarHBondContact O-CB 3.41Å; C748-Q821 PolarHBondContact O-OE1 2.87Å
749	K	84.6	Confident	87	Confident	85 Å²	85	32.8 Å²	32.8	37%	0.37	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-72.9	-8.3	173.1	-56.1	-151.9	175.8	-159.7	0	114.4	R746 P747 S819 K822	R746-K749 PolarHBondContact O-N 3.3Å; P747-K749 PolarHBondContact O-N 2.85Å; K749-S819 WeakPolarHBondContact CD-OG 3.41Å; K749-S819 WeakPolarHBondContact CE-OG 2.98Å; K749-S819 WeakPolarHBondContact CG-OG 3.25Å; K749-K822 HydrophobicContact CG-CB 4.33Å
750	F	83.7	Confident	86.8	Confident	99 Å²	99	32.4 Å²	32.4	43%	0.434	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-130.9	24.7	-169	-55.8	-85.2	0	0	0	113	R746 P747 C748 W932 H934	R746-F750 WeakPolarHBondContact O-CD2 3.47Å; P747-F750 PolarHBondContact O-N 2.87Å; C748-F750 PolarHBondContact O-N 2.87Å; F750-W932 PolarHBondContact O-NE1 2.81Å; F750-H934 HydrophobicContact CB-CB 4.04Å; F750-H934 AromaticContact CD1-NE2 3.71Å; F750-H934 AromaticContact CD2-CD2 3.96Å; F750-H934 AromaticContact CD2-CE1 3.3Å; F750-H934 WeakPolarHBondContact CD2-CE1 3.42Å; F750-H934 AromaticContact CD2-CG 3.71Å; F750-H934 AromaticContact CD2-ND1 3.29Å; F750-H934 VanDerWaalsContact CD2-ND1 3.29Å; F750-H934 WeakPolarHBondContact CD2-ND1 3.48Å; F750-H934 AromaticContact CD2-NE2 3.76Å; F750-H934 AromaticContact CE1-NE2 3.96Å; F750-H934 AromaticContact CE2-CE1 3.37Å; F750-H934 WeakPolarHBondContact CE2-CE1 3.45Å; F750-H934 AromaticContact CE2-ND1 3.74Å; F750-H934 AromaticContact CG-CD2 3.59Å; F750-H934 AromaticContact CG-CE1 3.66Å; F750-H934 AromaticContact CG-CG 3.72Å; F750-H934 AromaticContact CG-ND1 3.76Å; F750-H934 AromaticContact CG-NE2 3.6Å; F750-H934 AromaticContact CZ-CE1 3.78Å
751	L	86.2	Confident	86.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.166	C	C	.	.			trans	-109.2	151.9	175.7	-52	178.9	0	0	0	110.2	S244 Q821 I841 F844 V845 T848 W932	S244-L751 WeakPolarHBondContact CB-O 3.34Å; L751-Q821 PolarHBondContact O-NE2 2.98Å; L751-Q821 PolarHBondContact O-OE1 2.89Å; L751-I841 HydrophobicContact CD1-CD1 4.23Å; L751-F844 HydrophobicContact CB-CB 3.96Å; L751-F844 HydrophobicContact CD1-CB 3.83Å; L751-F844 HydrophobicContact CD1-CD2 4.25Å; L751-V845 HydrophobicContact CD2-CG2 4.45Å; L751-T848 VanDerWaalsContact CA-OG1 3.31Å; L751-T848 WeakPolarHBondContact CA-OG1 3.23Å; L751-W932 HydrophobicContact CD2-CZ2 3.79Å
752	T	85.9	Confident	86.3	Confident	21 Å²	21	33.7 Å²	33.7	13%	0.129	17%	0.165	C	C	.	.			trans	-89.6	145.5	171.7	-51.9	0	0	0	0	110	F844 L847 T848	T752-F844 WeakPolarHBondContact O-CA 3.39Å; T752-L847 HydrophobicContact CG2-CD2 3.95Å; T752-L847 HydrophobicContact CG2-CG 4.07Å; T752-T848 PolarHBondContact N-OG1 2.95Å
753	Y	85.7	Confident	86.1	Confident	12 Å²	12	32 Å²	32	5%	0.047	16%	0.158	C	C	.	.			trans	-144	156.1	-179	72.2	-75.2	0	0	0	112.9	Y755 V758 F820 Q821 F844	Y753-Y755 HydrophobicContact CE2-CD2 4.28Å; Y753-V758 HydrophobicContact CD2-CG2 4.15Å; Y753-F820 HydrophobicContact CD2-CD1 4.39Å; Y753-F820 HydrophobicContact CD2-CE1 4.15Å; Y753-F820 HydrophobicContact CE1-CD1 4.39Å; Y753-F820 AromaticContact CE2-CD1 3.64Å; Y753-F820 HydrophobicContact CE2-CD1 3.64Å; Y753-F820 AromaticContact CE2-CE1 3.53Å; Y753-F820 HydrophobicContact CE2-CE1 3.53Å; Y753-F820 AromaticContact CZ-CD1 3.65Å; Y753-Q821 HydrophobicContact CD1-CG 3.74Å; Y753-Q821 HydrophobicContact CE1-CG 4.08Å; Y753-Q821 HydrophobicContact CG-CG 4.11Å; Y753-F844 VanDerWaalsContact CB-CE1 3.47Å
754	I	84.3	Confident	85.8	Confident	47 Å²	47	37.3 Å²	37.3	24%	0.241	18%	0.183	C	C	.	.			trans	-104.3	106.6	171	-65.2	159.8	0	0	0	108.1	L247 A756 S757 V758 L847	L247-I754 HydrophobicContact CD1-CD1 4.28Å; L247-I754 HydrophobicContact CD1-CG1 3.85Å; L247-I754 HydrophobicContact CG-CG1 4.42Å; I754-A756 HydrophobicContact CG2-CB 4.22Å; I754-A756 PolarHBondContact O-N 2.87Å; I754-S757 PolarHBondContact O-N 3.12Å; I754-S757 VanDerWaalsContact O-N 3.08Å; I754-V758 WeakPolarHBondContact O-CG2 3.36Å; I754-V758 PolarHBondContact O-N 3.46Å; I754-V758 VanDerWaalsContact O-N 3.09Å; I754-L847 HydrophobicContact CD1-CD2 3.99Å; I754-L847 HydrophobicContact CG1-CD2 3.75Å
755	Y	84.7	Confident	85.5	Confident	26 Å²	26	37.9 Å²	37.9	10%	0.102	19%	0.186	C	C	.	.	H	α-helix	trans	-54.1	-39.3	-177.8	179.2	-102.9	0	0	0	113	Y753 V758 R759 L802 E803 K806 F820	Y753-Y755 HydrophobicContact CE2-CD2 4.28Å; Y755-V758 PolarHBondContact O-N 3.04Å; Y755-R759 WeakPolarHBondContact O-CB 3.14Å; Y755-R759 PolarHBondContact O-N 3.42Å; Y755-L802 HydrophobicContact CE2-CD2 4.29Å; Y755-L802 HydrophobicContact CE2-CG 4.1Å; Y755-E803 WeakPolarHBondContact OH-CA 3.47Å; Y755-E803 VanDerWaalsContact OH-CG 3.27Å; Y755-E803 WeakPolarHBondContact OH-CG 3.3Å; Y755-E803 PolarHBondContact OH-N 3.09Å; Y755-K806 HydrophobicContact CD2-CD 3.89Å; Y755-K806 HydrophobicContact CE1-CD 4.39Å; Y755-K806 HydrophobicContact CE2-CB 4.17Å; Y755-K806 HydrophobicContact CE2-CD 3.75Å; Y755-K806 HydrophobicContact CE2-CG 4.27Å; Y755-K806 HydrophobicContact CG-CD 4.29Å; Y755-F820 HydrophobicContact CD2-CE1 4.18Å; Y755-F820 AromaticContact CD2-CZ 3.81Å; Y755-F820 HydrophobicContact CD2-CZ 3.81Å; Y755-F820 HydrophobicContact CE2-CE2 4.18Å; Y755-F820 AromaticContact CE2-CZ 3.71Å; Y755-F820 HydrophobicContact CE2-CZ 3.71Å
756	A	81.9	Confident	85.4	Confident	47 Å²	47	38.4 Å²	38.4	39%	0.388	19%	0.188	S	C	.	.	H	α-helix	trans	-62.1	-43.6	177.3	0	0	0	0	0	113.1	I754 V758 R759 T760	I754-A756 HydrophobicContact CG2-CB 4.22Å; I754-A756 PolarHBondContact O-N 2.87Å; A756-V758 VanDerWaalsContact C-N 3.35Å; A756-R759 WeakPolarHBondContact O-CB 3.45Å; A756-R759 PolarHBondContact O-N 2.79Å; A756-T760 PolarHBondContact O-N 2.67Å; A756-T760 PolarHBondContact O-OG1 3.1Å
757	S	85.8	Confident	85.3	Confident	34 Å²	34	36.2 Å²	36.2	24%	0.238	19%	0.188	C	C	.	.	H	α-helix	trans	-67.3	-36.7	176.6	-60.6	0	0	0	0	111.8	R284 I754 L761	R284-S757 PolarHBondContact NH2-OG 2.9Å; I754-S757 PolarHBondContact O-N 3.12Å; I754-S757 VanDerWaalsContact O-N 3.08Å; S757-L761 VanDerWaalsContact O-CB 3.3Å; S757-L761 WeakPolarHBondContact O-CB 3.43Å; S757-L761 PolarHBondContact O-N 2.83Å
758	V	87.1	Confident	85.4	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.012	20%	0.198	C	C	.	.	H	α-helix	trans	-61.9	-47.4	173	177.8	0	0	0	0	110.8	Y753 I754 Y755 A756 L761 L762 L802 L824 L840 F844	Y753-V758 HydrophobicContact CD2-CG2 4.15Å; I754-V758 WeakPolarHBondContact O-CG2 3.36Å; I754-V758 PolarHBondContact O-N 3.46Å; I754-V758 VanDerWaalsContact O-N 3.09Å; Y755-V758 PolarHBondContact O-N 3.04Å; A756-V758 VanDerWaalsContact C-N 3.35Å; V758-L761 PolarHBondContact O-N 2.87Å; V758-L762 HydrophobicContact CG1-CD1 3.96Å; V758-L762 VanDerWaalsContact O-CD1 3.29Å; V758-L762 WeakPolarHBondContact O-CD1 3.48Å; V758-L762 PolarHBondContact O-N 2.85Å; V758-L802 HydrophobicContact CG1-CD2 4.27Å; V758-L824 HydrophobicContact CG1-CD2 3.52Å; V758-L840 HydrophobicContact CG1-CD2 4.37Å; V758-L840 HydrophobicContact CG2-CD2 4.07Å; V758-F844 HydrophobicContact CG2-CE1 3.59Å; V758-F844 HydrophobicContact CG2-CZ 3.74Å
759	R	85.6	Confident	85.5	Confident	54 Å²	54	38.4 Å²	38.4	20%	0.204	20%	0.201	C	C	.	.	H	α-helix	trans	-54.9	-57.3	176.7	-170.9	-152.9	-168.8	89	-7.4	111.2	Y755 A756 L761 L762 M763 A799 L802 E803	Y755-R759 WeakPolarHBondContact O-CB 3.14Å; Y755-R759 PolarHBondContact O-N 3.42Å; A756-R759 WeakPolarHBondContact O-CB 3.45Å; A756-R759 PolarHBondContact O-N 2.79Å; R759-L761 VanDerWaalsContact C-N 3.34Å; R759-L761 PolarHBondContact O-N 2.86Å; R759-L762 PolarHBondContact O-N 3.41Å; R759-M763 HydrophobicContact CG-SD 3.79Å; R759-M763 VanDerWaalsContact O-CG 3.28Å; R759-M763 WeakPolarHBondContact O-CG 3.21Å; R759-M763 PolarHBondContact O-N 2.97Å; R759-A799 HydrophobicContact CG-CB 4.31Å; R759-L802 HydrophobicContact CB-CD2 4.12Å; R759-L802 HydrophobicContact CG-CD2 4.42Å; R759-E803 IonicContact CZ-OE1 3.91Å; R759-E803 IonicContact NH1-OE1 3.73Å; R759-E803 PolarHBondContact NH1-OE1 3.19Å; R759-E803 IonicContact NH2-OE1 3.51Å; R759-E803 PolarHBondContact NH2-OE1 2.81Å
760	T	85.4	Confident	85.8	Confident	40 Å²	40	39.4 Å²	39.4	25%	0.245	20%	0.202	C	C	.	.	H	α-helix	trans	-56.2	-47.8	-180	-48.2	0	0	0	0	111.4	A756 L762 M763 E764	A756-T760 PolarHBondContact O-N 2.67Å; A756-T760 PolarHBondContact O-OG1 3.1Å; T760-L762 VanDerWaalsContact C-N 3.32Å; T760-L762 PolarHBondContact O-N 2.91Å; T760-M763 PolarHBondContact O-N 2.83Å; T760-E764 HydrophobicContact CG2-CG 4.47Å; T760-E764 WeakPolarHBondContact O-CG 3.29Å; T760-E764 PolarHBondContact O-N 3.13Å
761	L	85.3	Confident	86	Confident	31 Å²	31	36.5 Å²	36.5	16%	0.162	19%	0.194	C	C	.	.	H	α-helix	trans	-66.2	-32.7	-176.7	-163.5	72.4	0	0	0	112.5	S757 V758 R759 N765 L836 R839 L840	S757-L761 VanDerWaalsContact O-CB 3.3Å; S757-L761 WeakPolarHBondContact O-CB 3.43Å; S757-L761 PolarHBondContact O-N 2.83Å; V758-L761 PolarHBondContact O-N 2.87Å; R759-L761 VanDerWaalsContact C-N 3.34Å; R759-L761 PolarHBondContact O-N 2.86Å; L761-N765 WeakPolarHBondContact O-CB 3.34Å; L761-N765 PolarHBondContact O-N 3.43Å; L761-N765 PolarHBondContact O-ND2 2.94Å; L761-L836 HydrophobicContact CD2-CD1 3.52Å; L761-L836 HydrophobicContact CG-CD1 3.57Å; L761-R839 HydrophobicContact CD2-CB 4.23Å; L761-L840 HydrophobicContact CD2-CD2 3.8Å; L761-L840 HydrophobicContact CD2-CG 4.01Å
762	L	86.3	Confident	86.3	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-70.6	-46.5	172.6	-95.8	74.8	0	0	0	112.1	V758 R759 T760 E764 N765 I766 F772 V798 L802 L824 L828 L836 L840	V758-L762 HydrophobicContact CG1-CD1 3.96Å; V758-L762 VanDerWaalsContact O-CD1 3.29Å; V758-L762 WeakPolarHBondContact O-CD1 3.48Å; V758-L762 PolarHBondContact O-N 2.85Å; R759-L762 PolarHBondContact O-N 3.41Å; T760-L762 VanDerWaalsContact C-N 3.32Å; T760-L762 PolarHBondContact O-N 2.91Å; L762-E764 PolarHBondContact O-N 3.44Å; L762-N765 PolarHBondContact O-N 3.48Å; L762-N765 VanDerWaalsContact O-N 3.1Å; L762-I766 HydrophobicContact CB-CD1 4.12Å; L762-I766 HydrophobicContact CD2-CD1 3.71Å; L762-I766 HydrophobicContact CG-CD1 3.69Å; L762-I766 HydrophobicContact CG-CG1 4.42Å; L762-I766 WeakPolarHBondContact O-CB 3.3Å; L762-I766 PolarHBondContact O-N 2.84Å; L762-F772 HydrophobicContact CD2-CE1 3.88Å; L762-F772 HydrophobicContact CD2-CE2 3.86Å; L762-F772 HydrophobicContact CD2-CZ 3.33Å; L762-V798 HydrophobicContact CB-CG1 4.21Å; L762-L802 HydrophobicContact CD2-CD1 3.93Å; L762-L802 HydrophobicContact CD2-CD2 4.17Å; L762-L824 HydrophobicContact CD1-CD1 4.29Å; L762-L824 HydrophobicContact CD2-CD1 3.64Å; L762-L828 HydrophobicContact CD1-CD1 4.38Å; L762-L836 HydrophobicContact CD1-CD2 4.44Å; L762-L840 HydrophobicContact CD1-CD1 4.16Å
763	M	84.9	Confident	86.5	Confident	47 Å²	47	35.6 Å²	35.6	23%	0.232	19%	0.189	C	C	.	.	H	α-helix	trans	-57.1	-37.1	176.9	-68.4	173.2	73.3	0	0	112.3	R759 T760 P795 A799	R759-M763 HydrophobicContact CG-SD 3.79Å; R759-M763 VanDerWaalsContact O-CG 3.28Å; R759-M763 WeakPolarHBondContact O-CG 3.21Å; R759-M763 PolarHBondContact O-N 2.97Å; T760-M763 PolarHBondContact O-N 2.83Å; M763-P795 HydrophobicContact CB-CB 3.89Å; M763-P795 HydrophobicContact CE-CB 4.15Å; M763-P795 HydrophobicContact CG-CB 4.26Å; M763-P795 WeakPolarHBondContact CG-O 3.41Å; M763-A799 HydrophobicContact CE-CB 4.4Å; M763-A799 HydrophobicContact CG-CB 4.12Å; M763-A799 HydrophobicContact SD-CB 3.89Å
764	E	84.1	Confident	86.7	Confident	137 Å²	137	37.7 Å²	37.7	64%	0.64	20%	0.201	S	C	*	.	H	α-helix	trans	-76.4	-22.6	177.5	-73.1	177.6	176.7	0	0	114.6	T760 L762	T760-E764 HydrophobicContact CG2-CG 4.47Å; T760-E764 WeakPolarHBondContact O-CG 3.29Å; T760-E764 PolarHBondContact O-N 3.13Å; L762-E764 PolarHBondContact O-N 3.44Å
765	N	84.4	Confident	86.9	Confident	15 Å²	15	36.3 Å²	36.3	8%	0.08	20%	0.196	C	C	.	.	H	α-helix	trans	-119.3	-17.4	-167.3	-69.4	-101.3	0	0	0	114.8	R624 L761 L762 L836 R839	R624-N765 PolarHBondContact NH2-O 3.04Å; L761-N765 WeakPolarHBondContact O-CB 3.34Å; L761-N765 PolarHBondContact O-N 3.43Å; L761-N765 PolarHBondContact O-ND2 2.94Å; L762-N765 PolarHBondContact O-N 3.48Å; L762-N765 VanDerWaalsContact O-N 3.1Å; N765-L836 HydrophobicContact CB-CD1 4.16Å; N765-L836 HydrophobicContact CB-CD2 4.06Å; N765-R839 PolarHBondContact OD1-NH1 3.23Å
766	I	88.1	Confident	87.1	Confident	10 Å²	10	36 Å²	36	5%	0.051	20%	0.197	C	C	.	.			trans	-95.9	131	176.3	-61.6	-179.6	0	0	0	110	L762 S768 F772 V798 L828 L836	L762-I766 HydrophobicContact CB-CD1 4.12Å; L762-I766 HydrophobicContact CD2-CD1 3.71Å; L762-I766 HydrophobicContact CG-CD1 3.69Å; L762-I766 HydrophobicContact CG-CG1 4.42Å; L762-I766 WeakPolarHBondContact O-CB 3.3Å; L762-I766 PolarHBondContact O-N 2.84Å; I766-S768 VanDerWaalsContact CG2-O 3.31Å; I766-S768 WeakPolarHBondContact CG2-O 3.26Å; I766-F772 HydrophobicContact CD1-CB 4.29Å; I766-F772 HydrophobicContact CD1-CD1 4.15Å; I766-F772 HydrophobicContact CD1-CD2 3.67Å; I766-F772 HydrophobicContact CD1-CE1 4.41Å; I766-F772 HydrophobicContact CD1-CE2 3.97Å; I766-F772 HydrophobicContact CD1-CG 3.77Å; I766-F772 HydrophobicContact CD1-CZ 4.33Å; I766-F772 HydrophobicContact CG2-CB 4.18Å; I766-V798 HydrophobicContact CB-CG1 4.18Å; I766-V798 HydrophobicContact CB-CG2 4.09Å; I766-V798 HydrophobicContact CD1-CG1 4.01Å; I766-V798 HydrophobicContact CG2-CG1 4.4Å; I766-V798 HydrophobicContact CG2-CG2 3.67Å; I766-L828 HydrophobicContact CD1-CD2 3.97Å; I766-L836 HydrophobicContact CG1-CD2 4.42Å
767	S	84.3	Confident	87.3	Confident	51 Å²	51	36.4 Å²	36.4	36%	0.357	21%	0.205	S	C	.	.	S	Bend	trans	-108.8	5.9	-177.3	60.9	0	0	0	0	114.7	Y645	Y645-S767 PolarHBondContact OH-N 2.81Å; Y645-S767 PolarHBondContact OH-OG 3.38Å
768	S	88.8	Confident	87.4	Confident	30 Å²	30	36.2 Å²	36.2	21%	0.21	20%	0.199	C	C	.	.			trans	-151.7	123.9	168	-175.6	0	0	0	0	110.5	I766 R770 E794	I766-S768 VanDerWaalsContact CG2-O 3.31Å; I766-S768 WeakPolarHBondContact CG2-O 3.26Å; S768-R770 VanDerWaalsContact C-N 3.27Å; S768-R770 PolarHBondContact O-N 3.18Å; S768-R770 PolarHBondContact OG-N 2.8Å; S768-E794 WeakPolarHBondContact CA-OE2 3.2Å
769	W	89.4	Confident	87.3	Confident	18 Å²	18	40.1 Å²	40.1	7%	0.068	22%	0.223	C	C	.	.	H	α-helix	trans	-65.8	-32.7	173.8	73.2	-91.7	0	0	0	112.2	F772 A773 L783 F786 E794 R797 V798 V801	W769-F772 PolarHBondContact O-N 3.29Å; W769-A773 HydrophobicContact CE3-CB 4.23Å; W769-A773 HydrophobicContact CZ3-CB 4.4Å; W769-A773 WeakPolarHBondContact O-CB 3.39Å; W769-A773 PolarHBondContact O-N 3.47Å; W769-L783 HydrophobicContact CD2-CD1 4.22Å; W769-L783 HydrophobicContact CE3-CD1 4.33Å; W769-L783 HydrophobicContact CH2-CB 3.98Å; W769-L783 HydrophobicContact CH2-CD1 4.21Å; W769-L783 HydrophobicContact CZ2-CB 3.98Å; W769-L783 HydrophobicContact CZ2-CD1 4.11Å; W769-L783 HydrophobicContact CZ2-CG 4.48Å; W769-L783 HydrophobicContact CZ3-CD1 4.33Å; W769-F786 HydrophobicContact CZ3-CD2 4.15Å; W769-F786 AromaticContact CZ3-CE2 3.86Å; W769-F786 HydrophobicContact CZ3-CE2 3.86Å; W769-E794 VanDerWaalsContact CD1-OE1 3.24Å; W769-E794 VanDerWaalsContact CD1-OE2 3.23Å; W769-E794 PolarHBondContact N-OE2 3.49Å; W769-E794 VanDerWaalsContact N-OE2 3.11Å; W769-R797 HydrophobicContact CB-CB 3.67Å; W769-R797 VanDerWaalsContact CD1-CD 3.4Å; W769-R797 HydrophobicContact CD2-CB 4.37Å; W769-R797 HydrophobicContact CG-CB 3.59Å; W769-V798 HydrophobicContact CB-CG2 3.9Å; W769-V801 HydrophobicContact CB-CG2 4.47Å; W769-V801 HydrophobicContact CE3-CG2 3.98Å
770	R	89.6	Confident	87	Confident	105 Å²	105	44.5 Å²	44.5	40%	0.396	25%	0.25	S	S	.	.	H	α-helix	trans	-66.7	-52.5	-174.8	-178.5	169	-65	-73.4	5.1	111.3	S768 F772 A773 D774 L781	S768-R770 VanDerWaalsContact C-N 3.27Å; S768-R770 PolarHBondContact O-N 3.18Å; S768-R770 PolarHBondContact OG-N 2.8Å; R770-F772 PolarHBondContact O-N 2.89Å; R770-F772 VanDerWaalsContact O-N 3.14Å; R770-A773 WeakPolarHBondContact O-CB 2.96Å; R770-A773 PolarHBondContact O-N 2.97Å; R770-D774 WeakPolarHBondContact CG-OD2 3.33Å; R770-D774 VanDerWaalsContact O-CG 3.26Å; R770-D774 PolarHBondContact O-N 3.42Å; R770-D774 VanDerWaalsContact O-OD2 3.08Å; R770-L781 PolarHBondContact NH1-O 2.77Å
771	S	88.6	Confident	87.1	Confident	39 Å²	39	45.1 Å²	45.1	27%	0.273	25%	0.252	S	S	.	.	H	α-helix	trans	-59.5	-28.5	176.4	-55.1	0	0	0	0	113.2	A775	S771-A775 VanDerWaalsContact O-CB 3.24Å; S771-A775 WeakPolarHBondContact O-CB 3.23Å; S771-A775 PolarHBondContact O-N 3.33Å; S771-A775 VanDerWaalsContact O-N 3.12Å
772	F	91.2	Very high	87.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-74.5	-42.8	173.9	179.7	-123.3	0	0	0	112.6	L762 I766 W769 R770 A775 L776 V798 V801 L802 L824 L828 M831	L762-F772 HydrophobicContact CD2-CE1 3.88Å; L762-F772 HydrophobicContact CD2-CE2 3.86Å; L762-F772 HydrophobicContact CD2-CZ 3.33Å; I766-F772 HydrophobicContact CD1-CB 4.29Å; I766-F772 HydrophobicContact CD1-CD1 4.15Å; I766-F772 HydrophobicContact CD1-CD2 3.67Å; I766-F772 HydrophobicContact CD1-CE1 4.41Å; I766-F772 HydrophobicContact CD1-CE2 3.97Å; I766-F772 HydrophobicContact CD1-CG 3.77Å; I766-F772 HydrophobicContact CD1-CZ 4.33Å; I766-F772 HydrophobicContact CG2-CB 4.18Å; W769-F772 PolarHBondContact O-N 3.29Å; R770-F772 PolarHBondContact O-N 2.89Å; R770-F772 VanDerWaalsContact O-N 3.14Å; F772-A775 PolarHBondContact O-N 3.18Å; F772-L776 HydrophobicContact CD1-CD1 4.21Å; F772-L776 HydrophobicContact CD2-CD1 4.3Å; F772-L776 HydrophobicContact CE1-CD1 3.83Å; F772-L776 HydrophobicContact CE2-CD1 3.92Å; F772-L776 HydrophobicContact CE2-CG 4.27Å; F772-L776 HydrophobicContact CG-CD1 4.43Å; F772-L776 HydrophobicContact CZ-CD1 3.66Å; F772-L776 HydrophobicContact CZ-CG 4.46Å; F772-L776 WeakPolarHBondContact O-CG 3.35Å; F772-L776 PolarHBondContact O-N 3.44Å; F772-L776 VanDerWaalsContact O-N 3.11Å; F772-V798 HydrophobicContact CD1-CG1 4.25Å; F772-V798 HydrophobicContact CE1-CG1 4.42Å; F772-V801 HydrophobicContact CD1-CB 4.1Å; F772-V801 HydrophobicContact CD1-CG1 3.63Å; F772-V801 HydrophobicContact CE1-CB 4.27Å; F772-V801 HydrophobicContact CE1-CG1 3.8Å; F772-L802 HydrophobicContact CE1-CB 4.42Å; F772-L802 HydrophobicContact CZ-CD1 4.24Å; F772-L824 HydrophobicContact CE2-CD1 4.11Å; F772-L824 HydrophobicContact CZ-CD1 3.95Å; F772-L828 HydrophobicContact CD2-CD2 4.31Å; F772-L828 HydrophobicContact CE2-CD2 4.11Å; F772-M831 HydrophobicContact CB-CE 4.12Å; F772-M831 HydrophobicContact CB-SD 4.1Å; F772-M831 HydrophobicContact CD2-SD 3.97Å
773	A	90.7	Very high	86.8	Confident	2 Å²	2	48.9 Å²	48.9	2%	0.017	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-46.5	173.2	0	0	0	0	0	111.8	W769 R770 A775 L776 G777 Y778 F786 V801	W769-A773 HydrophobicContact CE3-CB 4.23Å; W769-A773 HydrophobicContact CZ3-CB 4.4Å; W769-A773 WeakPolarHBondContact O-CB 3.39Å; W769-A773 PolarHBondContact O-N 3.47Å; R770-A773 WeakPolarHBondContact O-CB 2.96Å; R770-A773 PolarHBondContact O-N 2.97Å; A773-A775 PolarHBondContact O-N 2.79Å; A773-L776 PolarHBondContact O-N 3.01Å; A773-G777 PolarHBondContact O-N 3.05Å; A773-Y778 WeakPolarHBondContact O-CB 3.46Å; A773-Y778 PolarHBondContact O-N 3.46Å; A773-F786 HydrophobicContact CB-CZ 3.95Å; A773-V801 HydrophobicContact CB-CG1 4.05Å; A773-V801 HydrophobicContact CB-CG2 4.18Å
774	D	89.3	Confident	86.7	Confident	56 Å²	56	52 Å²	52	30%	0.299	30%	0.297	S	S	.	.	H	α-helix	trans	-60.7	-43.4	177	-63.3	-40.6	0	0	0	111.3	R770 L776 G777	R770-D774 WeakPolarHBondContact CG-OD2 3.33Å; R770-D774 VanDerWaalsContact O-CG 3.26Å; R770-D774 PolarHBondContact O-N 3.42Å; R770-D774 VanDerWaalsContact O-OD2 3.08Å; D774-L776 VanDerWaalsContact C-N 3.3Å; D774-L776 PolarHBondContact O-N 2.96Å; D774-G777 WeakPolarHBondContact O-CA 3.45Å; D774-G777 PolarHBondContact O-N 2.93Å
775	A	89.1	Confident	86.7	Confident	17 Å²	17	50.1 Å²	50.1	14%	0.14	29%	0.287	C	S	.	.	H	α-helix	trans	-67.1	-26.7	178.2	0	0	0	0	0	114.1	S771 F772 A773 G777 A827 K830 M831	S771-A775 VanDerWaalsContact O-CB 3.24Å; S771-A775 WeakPolarHBondContact O-CB 3.23Å; S771-A775 PolarHBondContact O-N 3.33Å; S771-A775 VanDerWaalsContact O-N 3.12Å; F772-A775 PolarHBondContact O-N 3.18Å; A773-A775 PolarHBondContact O-N 2.79Å; A775-G777 VanDerWaalsContact C-N 3.29Å; A775-A827 HydrophobicContact CB-CB 3.89Å; A775-K830 HydrophobicContact CB-CB 4.5Å; A775-M831 HydrophobicContact CB-CG 3.61Å; A775-M831 HydrophobicContact CB-SD 3.89Å
776	L	88.8	Confident	86.6	Confident	21 Å²	21	50.4 Å²	50.4	11%	0.11	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-9.4	170	-73	168.2	0	0	0	113.4	F772 A773 D774 Y778 V801 L805 A827	F772-L776 HydrophobicContact CD1-CD1 4.21Å; F772-L776 HydrophobicContact CD2-CD1 4.3Å; F772-L776 HydrophobicContact CE1-CD1 3.83Å; F772-L776 HydrophobicContact CE2-CD1 3.92Å; F772-L776 HydrophobicContact CE2-CG 4.27Å; F772-L776 HydrophobicContact CG-CD1 4.43Å; F772-L776 HydrophobicContact CZ-CD1 3.66Å; F772-L776 HydrophobicContact CZ-CG 4.46Å; F772-L776 WeakPolarHBondContact O-CG 3.35Å; F772-L776 PolarHBondContact O-N 3.44Å; F772-L776 VanDerWaalsContact O-N 3.11Å; A773-L776 PolarHBondContact O-N 3.01Å; D774-L776 VanDerWaalsContact C-N 3.3Å; D774-L776 PolarHBondContact O-N 2.96Å; L776-Y778 HydrophobicContact CB-CD2 3.71Å; L776-Y778 HydrophobicContact CB-CE2 3.93Å; L776-Y778 HydrophobicContact CD1-CD2 4.38Å; L776-Y778 HydrophobicContact CD1-CE2 4.21Å; L776-V801 HydrophobicContact CD1-CG1 3.79Å; L776-L805 HydrophobicContact CD1-CB 4.45Å; L776-L805 HydrophobicContact CD1-CD2 3.96Å; L776-L805 HydrophobicContact CD2-CD1 3.86Å; L776-L805 HydrophobicContact CD2-CD2 3.51Å; L776-L805 HydrophobicContact CD2-CG 4.28Å; L776-L805 HydrophobicContact CG-CD2 4.41Å; L776-A827 HydrophobicContact CB-CB 4.42Å; L776-A827 HydrophobicContact CD2-CB 3.46Å; L776-A827 VanDerWaalsContact CD2-CB 3.46Å; L776-A827 HydrophobicContact CG-CB 3.63Å
777	G	86.3	Confident	86.2	Confident	55 Å²	55	51.4 Å²	51.4	57%	0.567	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.5	7	-179.4	0	0	0	0	0	115	A773 D774 A775 V779	A773-G777 PolarHBondContact O-N 3.05Å; D774-G777 WeakPolarHBondContact O-CA 3.45Å; D774-G777 PolarHBondContact O-N 2.93Å; A775-G777 VanDerWaalsContact C-N 3.29Å; G777-V779 PolarHBondContact O-N 3.22Å
778	Y	88.3	Confident	85.3	Confident	30 Å²	30	61.1 Å²	61.1	12%	0.118	32%	0.324	C	S	.	.			trans	-82	44.3	174.6	-60.9	-73	0	0	0	112.4	A773 L776 L781 F785 F786 L805 D808	A773-Y778 WeakPolarHBondContact O-CB 3.46Å; A773-Y778 PolarHBondContact O-N 3.46Å; L776-Y778 HydrophobicContact CB-CD2 3.71Å; L776-Y778 HydrophobicContact CB-CE2 3.93Å; L776-Y778 HydrophobicContact CD1-CD2 4.38Å; L776-Y778 HydrophobicContact CD1-CE2 4.21Å; Y778-L781 HydrophobicContact CD1-CD1 3.89Å; Y778-L781 HydrophobicContact CG-CD1 4.43Å; Y778-L781 PolarHBondContact O-N 3.29Å; Y778-F785 HydrophobicContact CD1-CE1 4.19Å; Y778-F785 HydrophobicContact CE1-CE1 4.22Å; Y778-F786 HydrophobicContact CD1-CE1 4.21Å; Y778-F786 HydrophobicContact CD1-CZ 4.46Å; Y778-F786 AromaticContact CD2-CE1 3.97Å; Y778-F786 HydrophobicContact CD2-CE1 3.97Å; Y778-F786 HydrophobicContact CD2-CZ 4.38Å; Y778-F786 HydrophobicContact CE2-CE1 4.39Å; Y778-F786 AromaticContact CG-CE1 3.87Å; Y778-F786 HydrophobicContact CG-CE1 3.87Å; Y778-F786 AromaticContact CG-CZ 3.98Å; Y778-F786 HydrophobicContact CG-CZ 3.98Å; Y778-L805 HydrophobicContact CE2-CD1 4.48Å; Y778-L805 WeakPolarHBondContact OH-CA 3.31Å; Y778-D808 VanDerWaalsContact CE1-OD2 3.31Å; Y778-D808 WeakPolarHBondContact CE1-OD2 3.25Å; Y778-D808 PolarHBondContact OH-OD2 2.85Å
779	V	84.9	Confident	84.4	Confident	83 Å²	83	62.4 Å²	62.4	50%	0.503	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	137.5	-171.6	-174.8	0	0	0	0	110.9	G777 L781	G777-V779 PolarHBondContact O-N 3.22Å; V779-L781 PolarHBondContact O-N 2.91Å; V779-L781 VanDerWaalsContact O-N 3.14Å
780	N	80.2	Confident	83.1	Confident	146 Å²	146	70.8 Å²	70.8	78%	0.781	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	8.5	179.2	-62.5	-30.7	0	0	0	116.6
781	L	87.1	Confident	82.4	Confident	53 Å²	53	67.3 Å²	67.3	28%	0.277	37%	0.366	S	S	.	.			trans	-74.2	143.3	177.1	-59.7	-170.3	0	0	0	112.3	R770 Y778 V779 F785 F786	R770-L781 PolarHBondContact NH1-O 2.77Å; Y778-L781 HydrophobicContact CD1-CD1 3.89Å; Y778-L781 HydrophobicContact CG-CD1 4.43Å; Y778-L781 PolarHBondContact O-N 3.29Å; V779-L781 PolarHBondContact O-N 2.91Å; V779-L781 VanDerWaalsContact O-N 3.14Å; L781-F785 HydrophobicContact CB-CB 4.41Å; L781-F785 HydrophobicContact CB-CG 4.5Å; L781-F785 HydrophobicContact CD1-CD1 3.54Å; L781-F785 HydrophobicContact CD1-CD2 4.24Å; L781-F785 HydrophobicContact CD1-CE1 3.57Å; L781-F785 HydrophobicContact CD1-CE2 4.26Å; L781-F785 HydrophobicContact CD1-CG 3.9Å; L781-F785 HydrophobicContact CD1-CZ 3.94Å; L781-F786 HydrophobicContact CB-CE2 4.05Å; L781-F786 HydrophobicContact CB-CZ 4.23Å
782	P	84.1	Confident	81.3	Confident	69 Å²	69	72.5 Å²	72.5	45%	0.448	39%	0.39	S	S	.	.			trans	-77	158.2	174.9	33.3	-35.9	0	0	0	111.3	T784 F785	P782-T784 WeakPolarHBondContact CG-OG1 3.44Å; P782-T784 PolarHBondContact O-N 3.49Å; P782-F785 VanDerWaalsContact O-CB 3.31Å; P782-F785 WeakPolarHBondContact O-CB 3.43Å; P782-F785 PolarHBondContact O-N 3.42Å
783	L	81.9	Confident	81	Confident	42 Å²	42	73.6 Å²	73.6	22%	0.22	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-59.9	-30	179.3	-175.2	60	0	0	0	112.4	W769 F785 F786 C787 R797	W769-L783 HydrophobicContact CD2-CD1 4.22Å; W769-L783 HydrophobicContact CE3-CD1 4.33Å; W769-L783 HydrophobicContact CH2-CB 3.98Å; W769-L783 HydrophobicContact CH2-CD1 4.21Å; W769-L783 HydrophobicContact CZ2-CB 3.98Å; W769-L783 HydrophobicContact CZ2-CD1 4.11Å; W769-L783 HydrophobicContact CZ2-CG 4.48Å; W769-L783 HydrophobicContact CZ3-CD1 4.33Å; L783-F785 PolarHBondContact O-N 2.78Å; L783-F785 VanDerWaalsContact O-N 3.13Å; L783-F786 PolarHBondContact O-N 3.18Å; L783-C787 PolarHBondContact O-N 3.35Å; L783-C787 VanDerWaalsContact O-N 3.09Å; L783-R797 HydrophobicContact CD1-CB 4.2Å; L783-R797 HydrophobicContact CD1-CG 4.06Å; L783-R797 HydrophobicContact CD2-CG 4.02Å
784	T	81.9	Confident	80.6	Confident	112 Å²	112	76.2 Å²	76.2	69%	0.687	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-61.1	-15.5	175.4	51	0	0	0	0	114.6	P782 C787	P782-T784 WeakPolarHBondContact CG-OG1 3.44Å; P782-T784 PolarHBondContact O-N 3.49Å; T784-C787 WeakPolarHBondContact CA-O 3.36Å
785	F	83.8	Confident	80.4	Confident	98 Å²	98	75.7 Å²	75.7	43%	0.43	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-75.5	-28.2	171.1	-176.9	-94.7	0	0	0	112.6	Y778 L781 P782 L783 K804	Y778-F785 HydrophobicContact CD1-CE1 4.19Å; Y778-F785 HydrophobicContact CE1-CE1 4.22Å; L781-F785 HydrophobicContact CB-CB 4.41Å; L781-F785 HydrophobicContact CB-CG 4.5Å; L781-F785 HydrophobicContact CD1-CD1 3.54Å; L781-F785 HydrophobicContact CD1-CD2 4.24Å; L781-F785 HydrophobicContact CD1-CE1 3.57Å; L781-F785 HydrophobicContact CD1-CE2 4.26Å; L781-F785 HydrophobicContact CD1-CG 3.9Å; L781-F785 HydrophobicContact CD1-CZ 3.94Å; P782-F785 VanDerWaalsContact O-CB 3.31Å; P782-F785 WeakPolarHBondContact O-CB 3.43Å; P782-F785 PolarHBondContact O-N 3.42Å; L783-F785 PolarHBondContact O-N 2.78Å; L783-F785 VanDerWaalsContact O-N 3.13Å; F785-K804 HydrophobicContact CE1-CG 4.1Å
786	F	83.5	Confident	80.2	Confident	21 Å²	21	79.1 Å²	79.1	9%	0.092	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-32.2	-175	-55.1	-85.3	0	0	0	113	W769 A773 Y778 L781 L783 V801 K804	W769-F786 HydrophobicContact CZ3-CD2 4.15Å; W769-F786 AromaticContact CZ3-CE2 3.86Å; W769-F786 HydrophobicContact CZ3-CE2 3.86Å; A773-F786 HydrophobicContact CB-CZ 3.95Å; Y778-F786 HydrophobicContact CD1-CE1 4.21Å; Y778-F786 HydrophobicContact CD1-CZ 4.46Å; Y778-F786 AromaticContact CD2-CE1 3.97Å; Y778-F786 HydrophobicContact CD2-CE1 3.97Å; Y778-F786 HydrophobicContact CD2-CZ 4.38Å; Y778-F786 HydrophobicContact CE2-CE1 4.39Å; Y778-F786 AromaticContact CG-CE1 3.87Å; Y778-F786 HydrophobicContact CG-CE1 3.87Å; Y778-F786 AromaticContact CG-CZ 3.98Å; Y778-F786 HydrophobicContact CG-CZ 3.98Å; L781-F786 HydrophobicContact CB-CE2 4.05Å; L781-F786 HydrophobicContact CB-CZ 4.23Å; L783-F786 PolarHBondContact O-N 3.18Å; F786-V801 HydrophobicContact CD1-CB 4.28Å; F786-V801 HydrophobicContact CD1-CG2 3.82Å; F786-V801 HydrophobicContact CD2-CG2 4.41Å; F786-V801 HydrophobicContact CE1-CB 4.46Å; F786-V801 HydrophobicContact CE1-CG1 4.27Å; F786-V801 HydrophobicContact CE1-CG2 4.01Å; F786-V801 HydrophobicContact CG-CG2 4.01Å; F786-V801 HydrophobicContact CZ-CG2 4.37Å; F786-K804 HydrophobicContact CD1-CB 3.84Å; F786-K804 HydrophobicContact CD1-CG 3.95Å; F786-K804 HydrophobicContact CE1-CG 4.39Å
787	C	78.7	Confident	80.1	Confident	31 Å²	31	81 Å²	81	21%	0.209	43%	0.428	C	S	.	.			trans	-143.1	145.7	175.3	-162.5	0	0	0	0	111	L783 T784 L791	L783-C787 PolarHBondContact O-N 3.35Å; L783-C787 VanDerWaalsContact O-N 3.09Å; T784-C787 WeakPolarHBondContact CA-O 3.36Å; C787-L791 HydrophobicContact CB-CD1 3.91Å; C787-L791 HydrophobicContact CB-CG 4.48Å
788	R	66.1	Low	80.2	Confident	255 Å²	255	78.3 Å²	78.3	96%	0.962	40%	0.401	S	S	*	.	S	Bend	trans	-88.9	-8.1	173.6	-65.4	-173.6	-179	-172.9	0.6	113.7
789	A	69.4	Low	80.2	Confident	57 Å²	57	77 Å²	77	47%	0.471	40%	0.397	S	S	.	.	S	Bend	trans	-100.9	149.9	177	0	0	0	0	0	110.7	L791	A789-L791 PolarHBondContact O-N 2.93Å
790	E	61.5	Low	80.4	Confident	195 Å²	195	73.4 Å²	73.4	91%	0.911	38%	0.375	S	S	*	.			trans	-73.6	110	168.5	-62.9	-172.1	147.3	0	0	108.5
791	L	75.4	Confident	80.8	Confident	32 Å²	32	66.5 Å²	66.5	17%	0.168	34%	0.338	C	S	.	.			trans	-98.2	118.1	179.3	-64.9	175.5	0	0	0	109.3	C787 A789 E796 R797	C787-L791 HydrophobicContact CB-CD1 3.91Å; C787-L791 HydrophobicContact CB-CG 4.48Å; A789-L791 PolarHBondContact O-N 2.93Å; L791-E796 HydrophobicContact CB-CB 4.44Å; L791-E796 HydrophobicContact CD1-CB 4.21Å; L791-E796 HydrophobicContact CD2-CB 4.3Å; L791-R797 HydrophobicContact CB-CG 3.95Å; L791-R797 HydrophobicContact CD1-CG 4.41Å; L791-R797 PolarHBondContact O-NE 3.25Å; L791-R797 PolarHBondContact O-NH2 2.59Å
792	D	65.7	Low	81	Confident	147 Å²	147	64 Å²	64	79%	0.786	33%	0.325	S	S	*	.			trans	-73	-28.7	-179	-78.6	-31.5	0	0	0	113.6
793	S	83.7	Confident	81.2	Confident	24 Å²	24	64 Å²	64	17%	0.168	32%	0.319	C	S	.	.			trans	-103.6	135.5	-173.1	88.4	0	0	0	0	114.2	P795 E796 R797	S793-P795 WeakPolarHBondContact OG-CG 3.39Å; S793-E796 VanDerWaalsContact CB-OE2 3.26Å; S793-E796 WeakPolarHBondContact CB-OE2 3.23Å; S793-E796 PolarHBondContact N-OE2 3.4Å; S793-E796 PolarHBondContact O-N 3.35Å; S793-E796 WeakPolarHBondContact OG-CB 3.33Å; S793-E796 VanDerWaalsContact OG-CG 3.26Å; S793-E796 WeakPolarHBondContact OG-CG 3.36Å; S793-E796 PolarHBondContact OG-N 3.02Å; S793-E796 PolarHBondContact OG-OE2 3.03Å; S793-R797 WeakPolarHBondContact O-CG 3.24Å; S793-R797 PolarHBondContact O-N 3.49Å; S793-R797 VanDerWaalsContact O-N 3.11Å
794	E	83.7	Confident	81.5	Confident	56 Å²	56	63.9 Å²	63.9	26%	0.262	32%	0.317	S	S	.	.	H	α-helix	trans	-50.7	-43.8	169.9	-73.5	-63.5	111.9	0	0	114.5	S768 W769 E796 R797 V798	S768-E794 WeakPolarHBondContact CA-OE2 3.2Å; W769-E794 VanDerWaalsContact CD1-OE1 3.24Å; W769-E794 VanDerWaalsContact CD1-OE2 3.23Å; W769-E794 PolarHBondContact N-OE2 3.49Å; W769-E794 VanDerWaalsContact N-OE2 3.11Å; E794-E796 PolarHBondContact O-N 2.92Å; E794-R797 PolarHBondContact O-N 3.45Å; E794-R797 WeakPolarHBondContact OE1-CD 3.48Å; E794-R797 IonicContact OE1-CZ 2.66Å; E794-R797 IonicContact OE1-NE 3.59Å; E794-R797 IonicContact OE1-NH1 3.2Å; E794-R797 PolarHBondContact OE1-NH1 2.85Å; E794-V798 WeakPolarHBondContact O-CG2 3.3Å; E794-V798 PolarHBondContact O-N 3.41Å
795	P	85.4	Confident	81.8	Confident	46 Å²	46	58.9 Å²	58.9	30%	0.299	29%	0.286	S	S	.	.	H	α-helix	trans	-64.3	-35.7	177.8	22.4	-32.8	0	0	0	113.5	M763 S793 V798 A799	M763-P795 HydrophobicContact CB-CB 3.89Å; M763-P795 HydrophobicContact CE-CB 4.15Å; M763-P795 HydrophobicContact CG-CB 4.26Å; M763-P795 WeakPolarHBondContact CG-O 3.41Å; S793-P795 WeakPolarHBondContact OG-CG 3.39Å; P795-V798 PolarHBondContact O-N 3.38Å; P795-A799 WeakPolarHBondContact O-CB 3.47Å; P795-A799 PolarHBondContact O-N 2.85Å
796	E	84.8	Confident	82	Confident	88 Å²	88	56 Å²	56	41%	0.411	27%	0.273	S	S	.	.	H	α-helix	trans	-66.8	-40.2	174	-71	155.3	161.4	0	0	111.1	L791 S793 E794 V798 A799 S800	L791-E796 HydrophobicContact CB-CB 4.44Å; L791-E796 HydrophobicContact CD1-CB 4.21Å; L791-E796 HydrophobicContact CD2-CB 4.3Å; S793-E796 VanDerWaalsContact CB-OE2 3.26Å; S793-E796 WeakPolarHBondContact CB-OE2 3.23Å; S793-E796 PolarHBondContact N-OE2 3.4Å; S793-E796 PolarHBondContact O-N 3.35Å; S793-E796 WeakPolarHBondContact OG-CB 3.33Å; S793-E796 VanDerWaalsContact OG-CG 3.26Å; S793-E796 WeakPolarHBondContact OG-CG 3.36Å; S793-E796 PolarHBondContact OG-N 3.02Å; S793-E796 PolarHBondContact OG-OE2 3.03Å; E794-E796 PolarHBondContact O-N 2.92Å; E796-V798 PolarHBondContact O-N 3.49Å; E796-A799 WeakPolarHBondContact O-CA 3.44Å; E796-A799 WeakPolarHBondContact O-CB 3.17Å; E796-A799 PolarHBondContact O-N 2.97Å; E796-A799 VanDerWaalsContact O-N 3.08Å; E796-S800 PolarHBondContact O-N 3.49Å
797	R	86.9	Confident	82.1	Confident	60 Å²	60	60.4 Å²	60.4	23%	0.226	29%	0.294	C	S	.	.	H	α-helix	trans	-61.8	-42	173.9	-61.3	169.8	-172.7	169.9	-2.4	111.8	W769 L783 L791 S793 E794 A799 S800 V801	W769-R797 HydrophobicContact CB-CB 3.67Å; W769-R797 VanDerWaalsContact CD1-CD 3.4Å; W769-R797 HydrophobicContact CD2-CB 4.37Å; W769-R797 HydrophobicContact CG-CB 3.59Å; L783-R797 HydrophobicContact CD1-CB 4.2Å; L783-R797 HydrophobicContact CD1-CG 4.06Å; L783-R797 HydrophobicContact CD2-CG 4.02Å; L791-R797 HydrophobicContact CB-CG 3.95Å; L791-R797 HydrophobicContact CD1-CG 4.41Å; L791-R797 PolarHBondContact O-NE 3.25Å; L791-R797 PolarHBondContact O-NH2 2.59Å; S793-R797 WeakPolarHBondContact O-CG 3.24Å; S793-R797 PolarHBondContact O-N 3.49Å; S793-R797 VanDerWaalsContact O-N 3.11Å; E794-R797 PolarHBondContact O-N 3.45Å; E794-R797 WeakPolarHBondContact OE1-CD 3.48Å; E794-R797 IonicContact OE1-CZ 2.66Å; E794-R797 IonicContact OE1-NE 3.59Å; E794-R797 IonicContact OE1-NH1 3.2Å; E794-R797 PolarHBondContact OE1-NH1 2.85Å; R797-A799 VanDerWaalsContact C-N 3.29Å; R797-A799 PolarHBondContact O-N 3.5Å; R797-S800 PolarHBondContact O-N 2.91Å; R797-V801 WeakPolarHBondContact O-CG2 3.44Å; R797-V801 PolarHBondContact O-N 3.46Å; R797-V801 VanDerWaalsContact O-N 3.08Å
798	V	88	Confident	82.3	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.7	-40.3	171.5	169	0	0	0	0	111.1	L762 I766 W769 F772 E794 P795 E796 V801 L802	L762-V798 HydrophobicContact CB-CG1 4.21Å; I766-V798 HydrophobicContact CB-CG1 4.18Å; I766-V798 HydrophobicContact CB-CG2 4.09Å; I766-V798 HydrophobicContact CD1-CG1 4.01Å; I766-V798 HydrophobicContact CG2-CG1 4.4Å; I766-V798 HydrophobicContact CG2-CG2 3.67Å; W769-V798 HydrophobicContact CB-CG2 3.9Å; F772-V798 HydrophobicContact CD1-CG1 4.25Å; F772-V798 HydrophobicContact CE1-CG1 4.42Å; E794-V798 WeakPolarHBondContact O-CG2 3.3Å; E794-V798 PolarHBondContact O-N 3.41Å; P795-V798 PolarHBondContact O-N 3.38Å; E796-V798 PolarHBondContact O-N 3.49Å; V798-V801 PolarHBondContact O-N 3.18Å; V798-L802 WeakPolarHBondContact O-CB 3.3Å; V798-L802 PolarHBondContact O-N 3.47Å
799	A	87.9	Confident	83.2	Confident	2 Å²	2	50 Å²	50	2%	0.017	26%	0.257	C	S	.	.	H	α-helix	trans	-65.2	-41.9	177.8	0	0	0	0	0	112.3	R759 M763 P795 E796 R797 L802 E803	R759-A799 HydrophobicContact CG-CB 4.31Å; M763-A799 HydrophobicContact CE-CB 4.4Å; M763-A799 HydrophobicContact CG-CB 4.12Å; M763-A799 HydrophobicContact SD-CB 3.89Å; P795-A799 WeakPolarHBondContact O-CB 3.47Å; P795-A799 PolarHBondContact O-N 2.85Å; E796-A799 WeakPolarHBondContact O-CA 3.44Å; E796-A799 WeakPolarHBondContact O-CB 3.17Å; E796-A799 PolarHBondContact O-N 2.97Å; E796-A799 VanDerWaalsContact O-N 3.08Å; R797-A799 VanDerWaalsContact C-N 3.29Å; R797-A799 PolarHBondContact O-N 3.5Å; A799-L802 CarbonylContact O-C 3.57Å; A799-L802 WeakPolarHBondContact O-CB 3.29Å; A799-L802 PolarHBondContact O-N 3.02Å; A799-L802 VanDerWaalsContact O-N 3.14Å; A799-E803 WeakPolarHBondContact O-CG 3.46Å; A799-E803 PolarHBondContact O-N 3.03Å
800	S	88	Confident	83.6	Confident	8 Å²	8	51.7 Å²	51.7	6%	0.056	26%	0.258	C	S	.	.	H	α-helix	trans	-67.1	-35.2	175.6	-63.7	0	0	0	0	113.3	E796 R797 L802 E803 K804	E796-S800 PolarHBondContact O-N 3.49Å; R797-S800 PolarHBondContact O-N 2.91Å; S800-L802 VanDerWaalsContact C-N 3.29Å; S800-L802 PolarHBondContact O-N 3.32Å; S800-E803 PolarHBondContact O-N 3.35Å; S800-K804 WeakPolarHBondContact O-CB 3.38Å; S800-K804 PolarHBondContact O-N 2.81Å
801	V	89.9	Confident	84.4	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.3	-38.4	169.9	175.5	0	0	0	0	111.1	W769 F772 A773 L776 F786 R797 V798 K804 L805	W769-V801 HydrophobicContact CB-CG2 4.47Å; W769-V801 HydrophobicContact CE3-CG2 3.98Å; F772-V801 HydrophobicContact CD1-CB 4.1Å; F772-V801 HydrophobicContact CD1-CG1 3.63Å; F772-V801 HydrophobicContact CE1-CB 4.27Å; F772-V801 HydrophobicContact CE1-CG1 3.8Å; A773-V801 HydrophobicContact CB-CG1 4.05Å; A773-V801 HydrophobicContact CB-CG2 4.18Å; L776-V801 HydrophobicContact CD1-CG1 3.79Å; F786-V801 HydrophobicContact CD1-CB 4.28Å; F786-V801 HydrophobicContact CD1-CG2 3.82Å; F786-V801 HydrophobicContact CD2-CG2 4.41Å; F786-V801 HydrophobicContact CE1-CB 4.46Å; F786-V801 HydrophobicContact CE1-CG1 4.27Å; F786-V801 HydrophobicContact CE1-CG2 4.01Å; F786-V801 HydrophobicContact CG-CG2 4.01Å; F786-V801 HydrophobicContact CZ-CG2 4.37Å; R797-V801 WeakPolarHBondContact O-CG2 3.44Å; R797-V801 PolarHBondContact O-N 3.46Å; R797-V801 VanDerWaalsContact O-N 3.08Å; V798-V801 PolarHBondContact O-N 3.18Å; V801-K804 PolarHBondContact O-N 3.43Å; V801-L805 WeakPolarHBondContact O-CB 3.36Å; V801-L805 PolarHBondContact O-N 3.29Å
802	L	90.1	Very high	83.6	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-73.4	-33.4	177.5	-172.4	67.1	0	0	0	113.4	Y755 V758 R759 L762 F772 V798 A799 S800 L805 K806 F820 L824	Y755-L802 HydrophobicContact CE2-CD2 4.29Å; Y755-L802 HydrophobicContact CE2-CG 4.1Å; V758-L802 HydrophobicContact CG1-CD2 4.27Å; R759-L802 HydrophobicContact CB-CD2 4.12Å; R759-L802 HydrophobicContact CG-CD2 4.42Å; L762-L802 HydrophobicContact CD2-CD1 3.93Å; L762-L802 HydrophobicContact CD2-CD2 4.17Å; F772-L802 HydrophobicContact CE1-CB 4.42Å; F772-L802 HydrophobicContact CZ-CD1 4.24Å; V798-L802 WeakPolarHBondContact O-CB 3.3Å; V798-L802 PolarHBondContact O-N 3.47Å; A799-L802 CarbonylContact O-C 3.57Å; A799-L802 WeakPolarHBondContact O-CB 3.29Å; A799-L802 PolarHBondContact O-N 3.02Å; A799-L802 VanDerWaalsContact O-N 3.14Å; S800-L802 VanDerWaalsContact C-N 3.29Å; S800-L802 PolarHBondContact O-N 3.32Å; L802-L805 HydrophobicContact CD1-CD2 4.36Å; L802-K806 PolarHBondContact O-N 3.25Å; L802-F820 HydrophobicContact CD1-CE2 3.85Å; L802-F820 HydrophobicContact CD1-CZ 3.61Å; L802-F820 HydrophobicContact CG-CE2 4.45Å; L802-F820 HydrophobicContact CG-CZ 4.18Å; L802-L824 HydrophobicContact CD1-CD1 3.96Å
803	E	88.6	Confident	83.1	Confident	70 Å²	70	49.8 Å²	49.8	33%	0.327	25%	0.253	S	S	.	.	H	α-helix	trans	-62.5	-49	169	-74.2	168.1	160.3	0	0	109.9	Y755 R759 A799 S800 L805 K806 E807	Y755-E803 WeakPolarHBondContact OH-CA 3.47Å; Y755-E803 VanDerWaalsContact OH-CG 3.27Å; Y755-E803 WeakPolarHBondContact OH-CG 3.3Å; Y755-E803 PolarHBondContact OH-N 3.09Å; R759-E803 IonicContact CZ-OE1 3.91Å; R759-E803 IonicContact NH1-OE1 3.73Å; R759-E803 PolarHBondContact NH1-OE1 3.19Å; R759-E803 IonicContact NH2-OE1 3.51Å; R759-E803 PolarHBondContact NH2-OE1 2.81Å; A799-E803 WeakPolarHBondContact O-CG 3.46Å; A799-E803 PolarHBondContact O-N 3.03Å; S800-E803 PolarHBondContact O-N 3.35Å; E803-L805 PolarHBondContact O-N 3.33Å; E803-K806 WeakPolarHBondContact O-CA 3.3Å; E803-K806 VanDerWaalsContact O-CB 3.29Å; E803-K806 WeakPolarHBondContact O-CB 3.37Å; E803-K806 PolarHBondContact O-N 3.2Å; E803-E807 PolarHBondContact O-N 3.08Å
804	K	88.4	Confident	81.8	Confident	38 Å²	38	50.7 Å²	50.7	17%	0.165	26%	0.259	C	S	.	.	H	α-helix	trans	-62	-41.4	179.8	-170.5	48.1	178	154.6	0	112.9	F785 F786 S800 V801 K806 E807 D808	F785-K804 HydrophobicContact CE1-CG 4.1Å; F786-K804 HydrophobicContact CD1-CB 3.84Å; F786-K804 HydrophobicContact CD1-CG 3.95Å; F786-K804 HydrophobicContact CE1-CG 4.39Å; S800-K804 WeakPolarHBondContact O-CB 3.38Å; S800-K804 PolarHBondContact O-N 2.81Å; V801-K804 PolarHBondContact O-N 3.43Å; K804-K806 PolarHBondContact O-N 2.95Å; K804-E807 HydrophobicContact CD-CB 4.48Å; K804-E807 WeakPolarHBondContact CD-OE2 3.38Å; K804-E807 IonicContact NZ-OE2 2.7Å; K804-E807 PolarHBondContact NZ-OE2 2.85Å; K804-E807 WeakPolarHBondContact O-CB 3.48Å; K804-E807 PolarHBondContact O-N 3.15Å; K804-D808 VanDerWaalsContact CE-OD1 3.23Å; K804-D808 WeakPolarHBondContact CE-OD1 3.5Å; K804-D808 IonicContact NZ-OD1 2.78Å; K804-D808 PolarHBondContact NZ-OD1 2.85Å; K804-D808 VanDerWaalsContact O-CG 3.31Å; K804-D808 PolarHBondContact O-N 3.43Å
805	L	88.9	Confident	80.2	Confident	7 Å²	7	58 Å²	58	4%	0.037	29%	0.29	C	S	.	.	H	α-helix	trans	-58	-36.5	171.8	-178.2	64.6	0	0	0	112.7	L776 Y778 V801 L802 E803 C809 F820 E823 L824	L776-L805 HydrophobicContact CD1-CB 4.45Å; L776-L805 HydrophobicContact CD1-CD2 3.96Å; L776-L805 HydrophobicContact CD2-CD1 3.86Å; L776-L805 HydrophobicContact CD2-CD2 3.51Å; L776-L805 HydrophobicContact CD2-CG 4.28Å; L776-L805 HydrophobicContact CG-CD2 4.41Å; Y778-L805 HydrophobicContact CE2-CD1 4.48Å; Y778-L805 WeakPolarHBondContact OH-CA 3.31Å; V801-L805 WeakPolarHBondContact O-CB 3.36Å; V801-L805 PolarHBondContact O-N 3.29Å; L802-L805 HydrophobicContact CD1-CD2 4.36Å; E803-L805 PolarHBondContact O-N 3.33Å; L805-C809 WeakPolarHBondContact O-CB 3.34Å; L805-C809 PolarHBondContact O-N 3.14Å; L805-C809 VanDerWaalsContact O-N 3.1Å; L805-C809 PolarHBondContact O-SG 3.26Å; L805-F820 HydrophobicContact CB-CE2 4.38Å; L805-F820 HydrophobicContact CD2-CD2 4.1Å; L805-F820 HydrophobicContact CD2-CE2 4Å; L805-F820 HydrophobicContact CG-CD2 3.96Å; L805-F820 HydrophobicContact CG-CE2 4.11Å; L805-E823 HydrophobicContact CD1-CB 4.31Å; L805-L824 HydrophobicContact CD2-CB 4.18Å
806	K	87.3	Confident	78.9	Confident	37 Å²	37	62 Å²	62	16%	0.161	31%	0.309	C	S	.	.	H	α-helix	trans	-70.9	-42.9	178	-166.4	-164.9	-179.4	-174.9	0	111.4	Y755 L802 E803 K804 N810 F820	Y755-K806 HydrophobicContact CD2-CD 3.89Å; Y755-K806 HydrophobicContact CE1-CD 4.39Å; Y755-K806 HydrophobicContact CE2-CB 4.17Å; Y755-K806 HydrophobicContact CE2-CD 3.75Å; Y755-K806 HydrophobicContact CE2-CG 4.27Å; Y755-K806 HydrophobicContact CG-CD 4.29Å; L802-K806 PolarHBondContact O-N 3.25Å; E803-K806 WeakPolarHBondContact O-CA 3.3Å; E803-K806 VanDerWaalsContact O-CB 3.29Å; E803-K806 WeakPolarHBondContact O-CB 3.37Å; E803-K806 PolarHBondContact O-N 3.2Å; K804-K806 PolarHBondContact O-N 2.95Å; K806-N810 VanDerWaalsContact O-CB 3.31Å; K806-N810 WeakPolarHBondContact O-CB 3.29Å; K806-N810 PolarHBondContact O-N 3.36Å; K806-F820 HydrophobicContact CB-CD2 4.08Å; K806-F820 HydrophobicContact CB-CE2 3.88Å; K806-F820 HydrophobicContact CG-CD2 4.38Å; K806-F820 HydrophobicContact CG-CE2 4.38Å
807	E	85.5	Confident	77.8	Confident	114 Å²	114	65.5 Å²	65.5	53%	0.533	32%	0.318	S	S	.	.	H	α-helix	trans	-57.2	-52.4	173.1	-66.3	179.6	172.9	0	0	111.3	E803 K804 C809 N810 N811	E803-E807 PolarHBondContact O-N 3.08Å; K804-E807 HydrophobicContact CD-CB 4.48Å; K804-E807 WeakPolarHBondContact CD-OE2 3.38Å; K804-E807 IonicContact NZ-OE2 2.7Å; K804-E807 PolarHBondContact NZ-OE2 2.85Å; K804-E807 WeakPolarHBondContact O-CB 3.48Å; K804-E807 PolarHBondContact O-N 3.15Å; E807-C809 VanDerWaalsContact C-N 3.31Å; E807-C809 PolarHBondContact O-N 2.68Å; E807-N810 CarbonylContact O-C 3.52Å; E807-N810 WeakPolarHBondContact O-CA 3.31Å; E807-N810 PolarHBondContact O-N 3.02Å; E807-N811 PolarHBondContact O-N 2.58Å
808	D	83.6	Confident	77.2	Confident	50 Å²	50	67.9 Å²	67.9	27%	0.267	33%	0.33	S	S	.	.	H	α-helix	trans	-68.6	-30.2	-173.5	-64.7	-15.4	0	0	0	112.1	Y778 K804	Y778-D808 VanDerWaalsContact CE1-OD2 3.31Å; Y778-D808 WeakPolarHBondContact CE1-OD2 3.25Å; Y778-D808 PolarHBondContact OH-OD2 2.85Å; K804-D808 VanDerWaalsContact CE-OD1 3.23Å; K804-D808 WeakPolarHBondContact CE-OD1 3.5Å; K804-D808 IonicContact NZ-OD1 2.78Å; K804-D808 PolarHBondContact NZ-OD1 2.85Å; K804-D808 VanDerWaalsContact O-CG 3.31Å; K804-D808 PolarHBondContact O-N 3.43Å
809	C	83.5	Confident	77	Confident	19 Å²	19	69 Å²	69	13%	0.128	34%	0.338	C	S	.	.	H	α-helix	trans	-75.9	-22	170.4	-67.6	0	0	0	0	113.6	L805 E807 F820	L805-C809 WeakPolarHBondContact O-CB 3.34Å; L805-C809 PolarHBondContact O-N 3.14Å; L805-C809 VanDerWaalsContact O-N 3.1Å; L805-C809 PolarHBondContact O-SG 3.26Å; E807-C809 VanDerWaalsContact C-N 3.31Å; E807-C809 PolarHBondContact O-N 2.68Å; C809-F820 HydrophobicContact CB-CB 4.07Å
810	N	78.9	Confident	77.1	Confident	91 Å²	91	69.4 Å²	69.4	49%	0.487	34%	0.339	S	S	.	.	H	α-helix	trans	-89.1	-20.4	176.7	-80.5	5.3	0	0	0	112.6	K806 E807 T812	K806-N810 VanDerWaalsContact O-CB 3.31Å; K806-N810 WeakPolarHBondContact O-CB 3.29Å; K806-N810 PolarHBondContact O-N 3.36Å; E807-N810 CarbonylContact O-C 3.52Å; E807-N810 WeakPolarHBondContact O-CA 3.31Å; E807-N810 PolarHBondContact O-N 3.02Å; N810-T812 PolarHBondContact O-N 3.11Å; N810-T812 VanDerWaalsContact O-N 3.14Å
811	N	77.3	Confident	77.1	Confident	69 Å²	69	69.2 Å²	69.2	37%	0.369	34%	0.338	S	S	.	.			trans	-65.8	113.4	179	-172.1	-7.9	0	0	0	111.6	E807 E813 S814	E807-N811 PolarHBondContact O-N 2.58Å; N811-E813 PolarHBondContact ND2-OE2 3.18Å; N811-E813 PolarHBondContact O-N 2.73Å; N811-E813 WeakPolarHBondContact OD1-CB 3.23Å; N811-E813 WeakPolarHBondContact OD1-CG 3.31Å; N811-E813 PolarHBondContact OD1-N 2.87Å; N811-E813 PolarHBondContact OD1-OE2 2.76Å; N811-S814 PolarHBondContact O-N 2.81Å; N811-S814 PolarHBondContact O-OG 3.16Å
812	T	58.6	Low	77	Confident	105 Å²	105	70 Å²	70	64%	0.644	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-13.9	-179.9	42.6	0	0	0	0	115.4	N810 S814	N810-T812 PolarHBondContact O-N 3.11Å; N810-T812 VanDerWaalsContact O-N 3.14Å; T812-S814 VanDerWaalsContact C-N 3.33Å
813	E	56.5	Low	77.1	Confident	161 Å²	161	71.4 Å²	71.4	75%	0.752	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-15.4	180	-59.3	172.6	149	0	0	113	N811 K815	N811-E813 PolarHBondContact ND2-OE2 3.18Å; N811-E813 PolarHBondContact O-N 2.73Å; N811-E813 WeakPolarHBondContact OD1-CB 3.23Å; N811-E813 WeakPolarHBondContact OD1-CG 3.31Å; N811-E813 PolarHBondContact OD1-N 2.87Å; N811-E813 PolarHBondContact OD1-OE2 2.76Å; E813-K815 PolarHBondContact O-N 2.91Å
814	S	55.2	Low	77.3	Confident	42 Å²	42	68 Å²	68	29%	0.294	33%	0.332	S	S	.	.			trans	-66.3	124.7	176.9	59.1	0	0	0	0	111.6	N811 T812 D816	N811-S814 PolarHBondContact O-N 2.81Å; N811-S814 PolarHBondContact O-OG 3.16Å; T812-S814 VanDerWaalsContact C-N 3.33Å; S814-D816 VanDerWaalsContact C-N 3.3Å; S814-D816 PolarHBondContact O-N 3.43Å
815	K	51.3	Low	77.5	Confident	211 Å²	211	66.2 Å²	66.2	92%	0.917	32%	0.324	S	S	*	.	S	Bend	trans	-61.3	-39.7	177.4	-70	-175.5	178	179.3	0	111.6	E813	E813-K815 PolarHBondContact O-N 2.91Å
816	D	58.1	Low	77.7	Confident	130 Å²	130	66.7 Å²	66.7	70%	0.695	33%	0.326	S	S	*	.	S	Bend	trans	-95.3	105.9	171.2	-73.4	-54.9	0	0	0	111	S814 K818	S814-D816 VanDerWaalsContact C-N 3.3Å; S814-D816 PolarHBondContact O-N 3.43Å; D816-K818 VanDerWaalsContact C-N 3.26Å; D816-K818 PolarHBondContact O-N 2.95Å
817	R	61.3	Low	77.9	Confident	161 Å²	161	65 Å²	65	61%	0.608	32%	0.319	S	S	*	.			trans	-68.7	83.2	173.7	-72.7	-178.4	175.7	149.3	1.7	111.3
818	K	74.1	Confident	78.2	Confident	109 Å²	109	59.5 Å²	59.5	47%	0.474	29%	0.294	S	S	.	.			trans	-58.5	143.6	168.7	-72.3	-174.2	179.2	-175.3	0	110	D816 E823	D816-K818 VanDerWaalsContact C-N 3.26Å; D816-K818 PolarHBondContact O-N 2.95Å; K818-E823 HydrophobicContact CB-CG 3.98Å; K818-E823 HydrophobicContact CD-CG 4.33Å; K818-E823 HydrophobicContact CG-CG 4.29Å
819	S	84.3	Confident	78.6	Confident	23 Å²	23	57.2 Å²	57.2	16%	0.161	28%	0.281	C	S	.	.			trans	-117.8	108	-176.8	48.9	0	0	0	0	108.6	K749 Q821 K822 E823	K749-S819 WeakPolarHBondContact CD-OG 3.41Å; K749-S819 WeakPolarHBondContact CE-OG 2.98Å; K749-S819 WeakPolarHBondContact CG-OG 3.25Å; S819-Q821 VanDerWaalsContact C-N 3.28Å; S819-Q821 PolarHBondContact O-N 2.81Å; S819-K822 WeakPolarHBondContact O-CA 3.11Å; S819-K822 WeakPolarHBondContact O-CB 3.35Å; S819-K822 PolarHBondContact O-N 2.84Å; S819-K822 VanDerWaalsContact OG-CB 3.24Å; S819-K822 WeakPolarHBondContact OG-CB 3.29Å; S819-E823 PolarHBondContact O-N 3.27Å
820	F	88.6	Confident	78.9	Confident	11 Å²	11	59.5 Å²	59.5	5%	0.048	29%	0.289	C	S	.	.	H	α-helix	trans	-35.5	-53.6	-171.7	177.3	-100.4	0	0	0	114.3	Y753 Y755 L802 L805 K806 C809 K822 E823 L824	Y753-F820 HydrophobicContact CD2-CD1 4.39Å; Y753-F820 HydrophobicContact CD2-CE1 4.15Å; Y753-F820 HydrophobicContact CE1-CD1 4.39Å; Y753-F820 AromaticContact CE2-CD1 3.64Å; Y753-F820 HydrophobicContact CE2-CD1 3.64Å; Y753-F820 AromaticContact CE2-CE1 3.53Å; Y753-F820 HydrophobicContact CE2-CE1 3.53Å; Y753-F820 AromaticContact CZ-CD1 3.65Å; Y755-F820 HydrophobicContact CD2-CE1 4.18Å; Y755-F820 AromaticContact CD2-CZ 3.81Å; Y755-F820 HydrophobicContact CD2-CZ 3.81Å; Y755-F820 HydrophobicContact CE2-CE2 4.18Å; Y755-F820 AromaticContact CE2-CZ 3.71Å; Y755-F820 HydrophobicContact CE2-CZ 3.71Å; L802-F820 HydrophobicContact CD1-CE2 3.85Å; L802-F820 HydrophobicContact CD1-CZ 3.61Å; L802-F820 HydrophobicContact CG-CE2 4.45Å; L802-F820 HydrophobicContact CG-CZ 4.18Å; L805-F820 HydrophobicContact CB-CE2 4.38Å; L805-F820 HydrophobicContact CD2-CD2 4.1Å; L805-F820 HydrophobicContact CD2-CE2 4Å; L805-F820 HydrophobicContact CG-CD2 3.96Å; L805-F820 HydrophobicContact CG-CE2 4.11Å; K806-F820 HydrophobicContact CB-CD2 4.08Å; K806-F820 HydrophobicContact CB-CE2 3.88Å; K806-F820 HydrophobicContact CG-CD2 4.38Å; K806-F820 HydrophobicContact CG-CE2 4.38Å; C809-F820 HydrophobicContact CB-CB 4.07Å; F820-K822 PolarHBondContact O-N 3.05Å; F820-E823 PolarHBondContact O-N 3.31Å; F820-L824 HydrophobicContact CE1-CD2 4.02Å; F820-L824 HydrophobicContact CZ-CD2 4.3Å; F820-L824 WeakPolarHBondContact O-CB 3.39Å; F820-L824 PolarHBondContact O-N 3.32Å
821	Q	88.2	Confident	79.4	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.019	27%	0.268	C	S	.	.	H	α-helix	trans	-63.9	-36.5	-178.8	-65.2	160.4	-74.8	0	0	113.9	C748 L751 Y753 S819 V825 F844	C748-Q821 WeakPolarHBondContact O-CB 3.41Å; C748-Q821 PolarHBondContact O-OE1 2.87Å; L751-Q821 PolarHBondContact O-NE2 2.98Å; L751-Q821 PolarHBondContact O-OE1 2.89Å; Y753-Q821 HydrophobicContact CD1-CG 3.74Å; Y753-Q821 HydrophobicContact CE1-CG 4.08Å; Y753-Q821 HydrophobicContact CG-CG 4.11Å; S819-Q821 VanDerWaalsContact C-N 3.28Å; S819-Q821 PolarHBondContact O-N 2.81Å; Q821-V825 VanDerWaalsContact O-CB 3.31Å; Q821-V825 WeakPolarHBondContact O-CB 3.4Å; Q821-V825 WeakPolarHBondContact O-CG2 3.5Å; Q821-V825 PolarHBondContact O-N 2.82Å; Q821-F844 HydrophobicContact CB-CE2 4.4Å; Q821-F844 HydrophobicContact CG-CE2 4.12Å
822	K	89.6	Confident	79.9	Confident	17 Å²	17	53.9 Å²	53.9	7%	0.074	26%	0.259	C	S	.	.	H	α-helix	trans	-68.6	-47.9	177.5	-169.8	-150.9	149.4	-141.3	0	110.3	E742 L745 K749 S819 F820 V825 M826	E742-K822 VanDerWaalsContact CD-NZ 3.29Å; E742-K822 VanDerWaalsContact OE1-CE 3.22Å; E742-K822 WeakPolarHBondContact OE1-CE 3.27Å; E742-K822 IonicContact OE1-NZ 2.85Å; E742-K822 PolarHBondContact OE1-NZ 3.37Å; E742-K822 WeakPolarHBondContact OE2-CE 3.39Å; E742-K822 IonicContact OE2-NZ 2.73Å; E742-K822 PolarHBondContact OE2-NZ 2.88Å; E742-K822 VanDerWaalsContact OE2-NZ 3.11Å; L745-K822 HydrophobicContact CB-CG 3.87Å; L745-K822 HydrophobicContact CD1-CG 4.48Å; K749-K822 HydrophobicContact CG-CB 4.33Å; S819-K822 WeakPolarHBondContact O-CA 3.11Å; S819-K822 WeakPolarHBondContact O-CB 3.35Å; S819-K822 PolarHBondContact O-N 2.84Å; S819-K822 VanDerWaalsContact OG-CB 3.24Å; S819-K822 WeakPolarHBondContact OG-CB 3.29Å; F820-K822 PolarHBondContact O-N 3.05Å; K822-V825 PolarHBondContact O-N 3.15Å; K822-M826 VanDerWaalsContact NZ-CE 3.25Å; K822-M826 VanDerWaalsContact O-CB 3.26Å; K822-M826 WeakPolarHBondContact O-CB 3.37Å; K822-M826 PolarHBondContact O-N 2.78Å
823	E	90.8	Very high	81.3	Confident	30 Å²	30	49.6 Å²	49.6	14%	0.14	23%	0.233	C	C	.	.	H	α-helix	trans	-68.1	-42.9	-177.4	-51	-51.3	117.5	0	0	111.1	L805 K818 S819 F820 M826 A827	L805-E823 HydrophobicContact CD1-CB 4.31Å; K818-E823 HydrophobicContact CB-CG 3.98Å; K818-E823 HydrophobicContact CD-CG 4.33Å; K818-E823 HydrophobicContact CG-CG 4.29Å; S819-E823 PolarHBondContact O-N 3.27Å; F820-E823 PolarHBondContact O-N 3.31Å; E823-M826 PolarHBondContact O-N 3.2Å; E823-A827 PolarHBondContact O-N 3.45Å
824	L	92.7	Very high	82.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-54.5	-55	171.5	171.6	62.7	0	0	0	111.8	V758 L762 F772 L802 L805 F820 M826 A827 L828	V758-L824 HydrophobicContact CG1-CD2 3.52Å; L762-L824 HydrophobicContact CD1-CD1 4.29Å; L762-L824 HydrophobicContact CD2-CD1 3.64Å; F772-L824 HydrophobicContact CE2-CD1 4.11Å; F772-L824 HydrophobicContact CZ-CD1 3.95Å; L802-L824 HydrophobicContact CD1-CD1 3.96Å; L805-L824 HydrophobicContact CD2-CB 4.18Å; F820-L824 HydrophobicContact CE1-CD2 4.02Å; F820-L824 HydrophobicContact CZ-CD2 4.3Å; F820-L824 WeakPolarHBondContact O-CB 3.39Å; F820-L824 PolarHBondContact O-N 3.32Å; L824-M826 VanDerWaalsContact C-N 3.31Å; L824-M826 PolarHBondContact O-N 2.78Å; L824-A827 PolarHBondContact O-N 2.97Å; L824-L828 HydrophobicContact CD1-CD1 4.02Å; L824-L828 HydrophobicContact CD1-CG 4.33Å; L824-L828 HydrophobicContact CG-CD1 4.3Å; L824-L828 WeakPolarHBondContact O-CG 3.36Å; L824-L828 PolarHBondContact O-N 3.26Å; L824-L828 VanDerWaalsContact O-N 3.08Å
825	V	92.4	Very high	84.1	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-67	-34.6	-178.6	176.5	0	0	0	0	110.8	L745 Q821 K822 L828 L829 V837 I841	L745-V825 HydrophobicContact CD2-CB 4.01Å; L745-V825 HydrophobicContact CD2-CG1 3.49Å; L745-V825 VanDerWaalsContact CD2-CG1 3.49Å; Q821-V825 VanDerWaalsContact O-CB 3.31Å; Q821-V825 WeakPolarHBondContact O-CB 3.4Å; Q821-V825 WeakPolarHBondContact O-CG2 3.5Å; Q821-V825 PolarHBondContact O-N 2.82Å; K822-V825 PolarHBondContact O-N 3.15Å; V825-L828 PolarHBondContact O-N 3.12Å; V825-L829 HydrophobicContact CG1-CD1 4.1Å; V825-L829 HydrophobicContact CG1-CG 4.25Å; V825-L829 WeakPolarHBondContact O-CB 3.48Å; V825-L829 VanDerWaalsContact O-CG 3.28Å; V825-L829 WeakPolarHBondContact O-CG 3.18Å; V825-L829 PolarHBondContact O-N 2.95Å; V825-V837 HydrophobicContact CG1-CB 4.39Å; V825-V837 HydrophobicContact CG1-CG1 3.53Å; V825-V837 HydrophobicContact CG1-CG2 4.02Å; V825-I841 HydrophobicContact CG2-CD1 4.41Å
826	M	92.9	Very high	85.8	Confident	16 Å²	16	31.9 Å²	31.9	8%	0.079	15%	0.153	C	C	.	.	H	α-helix	trans	-60.7	-48.6	174.3	-166.5	-162.2	-60.7	0	0	112.1	L741 E742 L745 K822 E823 L824 L828 L829 K830	L741-M826 HydrophobicContact CD1-CG 4.43Å; L741-M826 HydrophobicContact CD2-CG 3.75Å; L741-M826 HydrophobicContact CG-CG 4.12Å; E742-M826 WeakPolarHBondContact OE1-CE 3.34Å; L745-M826 HydrophobicContact CD1-CB 3.64Å; L745-M826 HydrophobicContact CD1-CE 4.47Å; L745-M826 HydrophobicContact CD1-CG 3.86Å; K822-M826 VanDerWaalsContact NZ-CE 3.25Å; K822-M826 VanDerWaalsContact O-CB 3.26Å; K822-M826 WeakPolarHBondContact O-CB 3.37Å; K822-M826 PolarHBondContact O-N 2.78Å; E823-M826 PolarHBondContact O-N 3.2Å; L824-M826 VanDerWaalsContact C-N 3.31Å; L824-M826 PolarHBondContact O-N 2.78Å; M826-L828 PolarHBondContact O-N 3.44Å; M826-L829 PolarHBondContact O-N 3.12Å; M826-K830 HydrophobicContact CG-CD 4.38Å; M826-K830 WeakPolarHBondContact O-CG 3.19Å; M826-K830 PolarHBondContact O-N 3.2Å; M826-K830 PolarHBondContact SD-NZ 3.09Å; M826-K830 VanDerWaalsContact SD-NZ 3.42Å
827	A	92.1	Very high	87.3	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.008	12%	0.12	C	C	.	.	H	α-helix	trans	-62.3	-43.4	178.4	0	0	0	0	0	111.6	A775 L776 E823 L824 L829 K830 M831	A775-A827 HydrophobicContact CB-CB 3.89Å; L776-A827 HydrophobicContact CB-CB 4.42Å; L776-A827 HydrophobicContact CD2-CB 3.46Å; L776-A827 VanDerWaalsContact CD2-CB 3.46Å; L776-A827 HydrophobicContact CG-CB 3.63Å; E823-A827 PolarHBondContact O-N 3.45Å; L824-A827 PolarHBondContact O-N 2.97Å; A827-L829 PolarHBondContact O-N 3.12Å; A827-K830 WeakPolarHBondContact O-CB 3.49Å; A827-K830 PolarHBondContact O-N 3.34Å; A827-K830 VanDerWaalsContact O-N 3.14Å; A827-M831 WeakPolarHBondContact O-CG 3.43Å; A827-M831 PolarHBondContact O-N 2.99Å
828	L	92.3	Very high	88.7	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.1	-39.7	176	-66.6	178.7	0	0	0	112.5	L762 I766 F772 L824 V825 M826 K830 M831 C833 L836 V837 L840	L762-L828 HydrophobicContact CD1-CD1 4.38Å; I766-L828 HydrophobicContact CD1-CD2 3.97Å; F772-L828 HydrophobicContact CD2-CD2 4.31Å; F772-L828 HydrophobicContact CE2-CD2 4.11Å; L824-L828 HydrophobicContact CD1-CD1 4.02Å; L824-L828 HydrophobicContact CD1-CG 4.33Å; L824-L828 HydrophobicContact CG-CD1 4.3Å; L824-L828 WeakPolarHBondContact O-CG 3.36Å; L824-L828 PolarHBondContact O-N 3.26Å; L824-L828 VanDerWaalsContact O-N 3.08Å; V825-L828 PolarHBondContact O-N 3.12Å; M826-L828 PolarHBondContact O-N 3.44Å; L828-K830 VanDerWaalsContact C-N 3.34Å; L828-M831 PolarHBondContact O-N 2.85Å; L828-C833 HydrophobicContact CB-CB 4.1Å; L828-C833 HydrophobicContact CD2-CB 4.16Å; L828-C833 WeakPolarHBondContact O-CA 3.34Å; L828-C833 VanDerWaalsContact O-CB 3.27Å; L828-C833 WeakPolarHBondContact O-CB 3.4Å; L828-C833 PolarHBondContact O-N 3.39Å; L828-L836 HydrophobicContact CD1-CD2 3.99Å; L828-L836 HydrophobicContact CD1-CG 4.14Å; L828-L836 HydrophobicContact CD2-CD2 3.87Å; L828-V837 HydrophobicContact CB-CG2 3.47Å; L828-V837 VanDerWaalsContact CB-CG2 3.47Å; L828-V837 HydrophobicContact CD1-CG2 4.28Å; L828-L840 HydrophobicContact CD1-CD1 3.54Å
829	L	91.5	Very high	89.3	Confident	1 Å²	1	16.2 Å²	16.2	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-64.3	-37.6	172.5	-71.7	176.8	0	0	0	112.1	L741 L745 V825 M826 A827 M831 D832 V837 L945 L948 F953	L741-L829 HydrophobicContact CD1-CB 3.98Å; L741-L829 HydrophobicContact CD1-CD1 3.46Å; L741-L829 VanDerWaalsContact CD1-CD1 3.46Å; L741-L829 HydrophobicContact CD1-CG 4.37Å; L745-L829 HydrophobicContact CD1-CD1 4.49Å; L745-L829 HydrophobicContact CD2-CD1 3.9Å; L745-L829 HydrophobicContact CG-CD1 4.39Å; V825-L829 HydrophobicContact CG1-CD1 4.1Å; V825-L829 HydrophobicContact CG1-CG 4.25Å; V825-L829 WeakPolarHBondContact O-CB 3.48Å; V825-L829 VanDerWaalsContact O-CG 3.28Å; V825-L829 WeakPolarHBondContact O-CG 3.18Å; V825-L829 PolarHBondContact O-N 2.95Å; M826-L829 PolarHBondContact O-N 3.12Å; A827-L829 PolarHBondContact O-N 3.12Å; L829-M831 PolarHBondContact O-N 3.5Å; L829-D832 PolarHBondContact O-N 2.92Å; L829-V837 HydrophobicContact CD2-CB 4.19Å; L829-V837 HydrophobicContact CD2-CG1 3.98Å; L829-V837 HydrophobicContact CD2-CG2 3.98Å; L829-V837 HydrophobicContact CG-CG1 4.33Å; L829-V837 HydrophobicContact CG-CG2 4.04Å; L829-L945 HydrophobicContact CD2-CD2 3.97Å; L829-L948 HydrophobicContact CD1-CD2 4.18Å; L829-F953 WeakPolarHBondContact O-CE2 3.43Å; L829-F953 VanDerWaalsContact O-CZ 3.29Å; L829-F953 WeakPolarHBondContact O-CZ 3.33Å
830	K	90.5	Very high	89.6	Confident	68 Å²	68	15.2 Å²	15.2	30%	0.296	8%	0.076	S	C	.	.	H	α-helix	trans	-67.5	-20.3	175.4	-73.9	173.3	176.9	176	0	114.2	F648 L741 A775 M826 A827 L828	F648-K830 HydrophobicContact CB-CB 3.94Å; F648-K830 HydrophobicContact CB-CG 3.96Å; F648-K830 HydrophobicContact CD1-CG 4.43Å; F648-K830 HydrophobicContact CD2-CG 4.16Å; F648-K830 HydrophobicContact CG-CB 4.41Å; F648-K830 HydrophobicContact CG-CG 3.94Å; F648-K830 PolarHBondContact N-O 3.15Å; L741-K830 HydrophobicContact CD2-CG 4.35Å; A775-K830 HydrophobicContact CB-CB 4.5Å; M826-K830 HydrophobicContact CG-CD 4.38Å; M826-K830 WeakPolarHBondContact O-CG 3.19Å; M826-K830 PolarHBondContact O-N 3.2Å; M826-K830 PolarHBondContact SD-NZ 3.09Å; M826-K830 VanDerWaalsContact SD-NZ 3.42Å; A827-K830 WeakPolarHBondContact O-CB 3.49Å; A827-K830 PolarHBondContact O-N 3.34Å; A827-K830 VanDerWaalsContact O-N 3.14Å; L828-K830 VanDerWaalsContact C-N 3.34Å
831	M	88.9	Confident	89.7	Confident	7 Å²	7	14.8 Å²	14.8	3%	0.034	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	13.1	175.7	-63.2	171	72.5	0	0	113.2	Y645 F772 A775 A827 L828 L829 C833	Y645-M831 HydrophobicContact CD1-CB 4.01Å; Y645-M831 HydrophobicContact CD1-CE 3.87Å; Y645-M831 WeakPolarHBondContact CD1-O 3.23Å; Y645-M831 HydrophobicContact CD2-CE 3.79Å; Y645-M831 HydrophobicContact CE1-CE 3.74Å; Y645-M831 HydrophobicContact CE2-CE 3.65Å; Y645-M831 HydrophobicContact CG-CB 4.49Å; Y645-M831 HydrophobicContact CG-CE 3.89Å; F772-M831 HydrophobicContact CB-CE 4.12Å; F772-M831 HydrophobicContact CB-SD 4.1Å; F772-M831 HydrophobicContact CD2-SD 3.97Å; A775-M831 HydrophobicContact CB-CG 3.61Å; A775-M831 HydrophobicContact CB-SD 3.89Å; A827-M831 WeakPolarHBondContact O-CG 3.43Å; A827-M831 PolarHBondContact O-N 2.99Å; L828-M831 PolarHBondContact O-N 2.85Å; L829-M831 PolarHBondContact O-N 3.5Å; M831-C833 PolarHBondContact O-N 3.01Å; M831-C833 VanDerWaalsContact O-N 3.08Å
832	D	87.4	Confident	89.8	Confident	34 Å²	34	16.5 Å²	16.5	18%	0.182	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	26	-169.8	-165.7	36.9	0	0	0	114.6	P646 L829 Q834 R949 F953	P646-D832 HydrophobicContact CG-CB 3.56Å; L829-D832 PolarHBondContact O-N 2.92Å; D832-Q834 PolarHBondContact O-N 3.08Å; D832-Q834 VanDerWaalsContact OD1-CG 3.22Å; D832-Q834 WeakPolarHBondContact OD1-CG 3.42Å; D832-R949 WeakPolarHBondContact OD1-CD 3.25Å; D832-R949 WeakPolarHBondContact OD1-CG 3.43Å; D832-R949 IonicContact OD1-CZ 3.19Å; D832-R949 IonicContact OD1-NE 2.87Å; D832-R949 PolarHBondContact OD1-NE 2.98Å; D832-R949 IonicContact OD1-NH2 2.63Å; D832-R949 IonicContact OD2-CZ 2.77Å; D832-R949 IonicContact OD2-NE 2.7Å; D832-R949 PolarHBondContact OD2-NE 3.04Å; D832-R949 VanDerWaalsContact OD2-NE 3.15Å; D832-R949 IonicContact OD2-NH2 2.67Å; D832-R949 PolarHBondContact OD2-NH2 2.99Å; D832-F953 HydrophobicContact CB-CD1 4.49Å; D832-F953 HydrophobicContact CB-CD2 4.14Å; D832-F953 HydrophobicContact CB-CE1 4.19Å; D832-F953 HydrophobicContact CB-CE2 3.85Å; D832-F953 HydrophobicContact CB-CG 4.46Å; D832-F953 HydrophobicContact CB-CZ 3.87Å
833	C	89.1	Confident	89.7	Confident	16 Å²	16	18.2 Å²	18.2	11%	0.108	9%	0.092	C	C	.	.			trans	-78.7	38.3	176.3	-63.7	0	0	0	0	112	L828 M831 G835 L836 V837	L828-C833 HydrophobicContact CB-CB 4.1Å; L828-C833 HydrophobicContact CD2-CB 4.16Å; L828-C833 WeakPolarHBondContact O-CA 3.34Å; L828-C833 VanDerWaalsContact O-CB 3.27Å; L828-C833 WeakPolarHBondContact O-CB 3.4Å; L828-C833 PolarHBondContact O-N 3.39Å; M831-C833 PolarHBondContact O-N 3.01Å; M831-C833 VanDerWaalsContact O-N 3.08Å; C833-G835 VanDerWaalsContact C-N 3.28Å; C833-G835 PolarHBondContact O-N 3.47Å; C833-L836 HydrophobicContact CB-CB 4.23Å; C833-L836 WeakPolarHBondContact O-CA 3.26Å; C833-L836 WeakPolarHBondContact O-CB 3.37Å; C833-L836 PolarHBondContact O-N 2.79Å; C833-V837 PolarHBondContact O-N 3.02Å
834	Q	85.1	Confident	89.7	Confident	16 Å²	16	17.1 Å²	17.1	8%	0.075	9%	0.087	C	C	.	.	H	α-helix	trans	-49.7	-46	-176.6	-62.8	-73.9	-5	0	0	112.2	D832 L836 V837 V838 R949	D832-Q834 PolarHBondContact O-N 3.08Å; D832-Q834 VanDerWaalsContact OD1-CG 3.22Å; D832-Q834 WeakPolarHBondContact OD1-CG 3.42Å; Q834-L836 VanDerWaalsContact C-N 3.31Å; Q834-L836 PolarHBondContact O-N 3.06Å; Q834-V837 WeakPolarHBondContact O-CB 3.12Å; Q834-V837 PolarHBondContact O-N 3.26Å; Q834-V838 WeakPolarHBondContact O-CG2 3.33Å; Q834-V838 PolarHBondContact O-N 2.93Å; Q834-R949 HydrophobicContact CG-CG 4.29Å
835	G	84.3	Confident	89.7	Confident	16 Å²	16	17.1 Å²	17.1	17%	0.165	9%	0.087	C	C	.	.	H	α-helix	trans	-65.9	-28.4	178.7	0	0	0	0	0	114.8	L626 C833	L626-G835 WeakPolarHBondContact CD1-O 3.41Å; C833-G835 VanDerWaalsContact C-N 3.28Å; C833-G835 PolarHBondContact O-N 3.47Å
836	L	88	Confident	89.6	Confident	10 Å²	10	17.2 Å²	17.2	5%	0.052	9%	0.087	C	C	.	.	H	α-helix	trans	-76.6	-41.9	173.4	176.5	59.2	0	0	0	110.5	L761 L762 N765 I766 L828 C833 Q834 V838 R839 L840	L761-L836 HydrophobicContact CD2-CD1 3.52Å; L761-L836 HydrophobicContact CG-CD1 3.57Å; L762-L836 HydrophobicContact CD1-CD2 4.44Å; N765-L836 HydrophobicContact CB-CD1 4.16Å; N765-L836 HydrophobicContact CB-CD2 4.06Å; I766-L836 HydrophobicContact CG1-CD2 4.42Å; L828-L836 HydrophobicContact CD1-CD2 3.99Å; L828-L836 HydrophobicContact CD1-CG 4.14Å; L828-L836 HydrophobicContact CD2-CD2 3.87Å; C833-L836 HydrophobicContact CB-CB 4.23Å; C833-L836 WeakPolarHBondContact O-CA 3.26Å; C833-L836 WeakPolarHBondContact O-CB 3.37Å; C833-L836 PolarHBondContact O-N 2.79Å; Q834-L836 VanDerWaalsContact C-N 3.31Å; Q834-L836 PolarHBondContact O-N 3.06Å; L836-V838 VanDerWaalsContact C-N 3.35Å; L836-V838 PolarHBondContact O-N 2.8Å; L836-R839 PolarHBondContact O-N 3.29Å; L836-L840 HydrophobicContact CD1-CD1 4.38Å; L836-L840 HydrophobicContact CD1-CG 4.47Å; L836-L840 HydrophobicContact CG-CD1 4.17Å; L836-L840 WeakPolarHBondContact O-CG 3.48Å; L836-L840 PolarHBondContact O-N 2.99Å
837	V	90	Very high	89.5	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-57.6	-46.3	173.7	167.9	0	0	0	0	111.4	V825 L828 L829 C833 Q834 R839 L840 I841	V825-V837 HydrophobicContact CG1-CB 4.39Å; V825-V837 HydrophobicContact CG1-CG1 3.53Å; V825-V837 HydrophobicContact CG1-CG2 4.02Å; L828-V837 HydrophobicContact CB-CG2 3.47Å; L828-V837 VanDerWaalsContact CB-CG2 3.47Å; L828-V837 HydrophobicContact CD1-CG2 4.28Å; L829-V837 HydrophobicContact CD2-CB 4.19Å; L829-V837 HydrophobicContact CD2-CG1 3.98Å; L829-V837 HydrophobicContact CD2-CG2 3.98Å; L829-V837 HydrophobicContact CG-CG1 4.33Å; L829-V837 HydrophobicContact CG-CG2 4.04Å; C833-V837 PolarHBondContact O-N 3.02Å; Q834-V837 WeakPolarHBondContact O-CB 3.12Å; Q834-V837 PolarHBondContact O-N 3.26Å; V837-R839 PolarHBondContact O-N 3.37Å; V837-L840 PolarHBondContact O-N 2.74Å; V837-I841 HydrophobicContact CG1-CG1 4.01Å; V837-I841 WeakPolarHBondContact O-CB 3.25Å; V837-I841 VanDerWaalsContact O-CG1 3.25Å; V837-I841 WeakPolarHBondContact O-CG1 3.2Å; V837-I841 PolarHBondContact O-N 3.09Å
838	V	88.9	Confident	89.3	Confident	14 Å²	14	16.7 Å²	16.7	9%	0.085	9%	0.085	C	C	.	.	H	α-helix	trans	-55.4	-47.8	177.5	160.8	0	0	0	0	112	Q834 L836 I841 Q842 Y910 L945	Q834-V838 WeakPolarHBondContact O-CG2 3.33Å; Q834-V838 PolarHBondContact O-N 2.93Å; L836-V838 VanDerWaalsContact C-N 3.35Å; L836-V838 PolarHBondContact O-N 2.8Å; V838-I841 PolarHBondContact O-N 3.15Å; V838-Q842 WeakPolarHBondContact O-CB 3.36Å; V838-Q842 PolarHBondContact O-N 2.93Å; V838-Y910 HydrophobicContact CB-CD2 4.46Å; V838-Y910 HydrophobicContact CG1-CD1 3.44Å; V838-Y910 VanDerWaalsContact CG1-CD1 3.44Å; V838-Y910 HydrophobicContact CG1-CD2 3.6Å; V838-Y910 HydrophobicContact CG1-CE1 3.88Å; V838-Y910 HydrophobicContact CG1-CE2 4.03Å; V838-Y910 HydrophobicContact CG1-CG 3.28Å; V838-Y910 HydrophobicContact CG2-CD2 4.04Å; V838-Y910 HydrophobicContact CG2-CE1 4.34Å; V838-Y910 HydrophobicContact CG2-CE2 3.7Å; V838-Y910 HydrophobicContact CG2-CG 4.49Å; V838-L945 HydrophobicContact CG2-CD1 3.57Å
839	R	87.7	Confident	89.2	Confident	57 Å²	57	16.7 Å²	16.7	22%	0.215	9%	0.085	C	C	.	.	H	α-helix	trans	-61.9	-49.5	177.1	-66.1	-174.7	-161.4	129	-3.3	111.6	F625 L761 N765 L836 V837 I841 Q842 D843	F625-R839 PolarHBondContact O-NH2 3.15Å; L761-R839 HydrophobicContact CD2-CB 4.23Å; N765-R839 PolarHBondContact OD1-NH1 3.23Å; L836-R839 PolarHBondContact O-N 3.29Å; V837-R839 PolarHBondContact O-N 3.37Å; R839-I841 VanDerWaalsContact C-N 3.32Å; R839-I841 PolarHBondContact O-N 3.45Å; R839-Q842 PolarHBondContact O-N 2.97Å; R839-D843 PolarHBondContact O-N 2.98Å
840	L	90.3	Very high	89.1	Confident	2 Å²	2	16.7 Å²	16.7	1%	0.01	9%	0.085	C	C	.	.	H	α-helix	trans	-57.5	-45	178.8	-71.9	169.6	0	0	0	111.6	V758 L761 L762 L828 L836 V837 D843 F844	V758-L840 HydrophobicContact CG1-CD2 4.37Å; V758-L840 HydrophobicContact CG2-CD2 4.07Å; L761-L840 HydrophobicContact CD2-CD2 3.8Å; L761-L840 HydrophobicContact CD2-CG 4.01Å; L762-L840 HydrophobicContact CD1-CD1 4.16Å; L828-L840 HydrophobicContact CD1-CD1 3.54Å; L836-L840 HydrophobicContact CD1-CD1 4.38Å; L836-L840 HydrophobicContact CD1-CG 4.47Å; L836-L840 HydrophobicContact CG-CD1 4.17Å; L836-L840 WeakPolarHBondContact O-CG 3.48Å; L836-L840 PolarHBondContact O-N 2.99Å; V837-L840 PolarHBondContact O-N 2.74Å; L840-D843 PolarHBondContact O-N 2.82Å; L840-F844 HydrophobicContact CB-CE1 4.48Å; L840-F844 HydrophobicContact CB-CE2 4.31Å; L840-F844 HydrophobicContact CB-CZ 4.13Å; L840-F844 HydrophobicContact CD2-CE1 4.18Å; L840-F844 HydrophobicContact CD2-CZ 4.06Å; L840-F844 VanDerWaalsContact O-CB 3.28Å; L840-F844 WeakPolarHBondContact O-CB 3.5Å; L840-F844 WeakPolarHBondContact O-CD1 3.26Å; L840-F844 WeakPolarHBondContact O-CD2 3.43Å; L840-F844 WeakPolarHBondContact O-CG 3.38Å; L840-F844 PolarHBondContact O-N 3.43Å
841	I	90.9	Very high	88.9	Confident	1 Å²	1	16 Å²	16	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-65.5	-39.9	178.4	-69.2	-68.4	0	0	0	111.5	L751 V825 V837 V838 R839 V845 I914 T938 L941 V942	L751-I841 HydrophobicContact CD1-CD1 4.23Å; V825-I841 HydrophobicContact CG2-CD1 4.41Å; V837-I841 HydrophobicContact CG1-CG1 4.01Å; V837-I841 WeakPolarHBondContact O-CB 3.25Å; V837-I841 VanDerWaalsContact O-CG1 3.25Å; V837-I841 WeakPolarHBondContact O-CG1 3.2Å; V837-I841 PolarHBondContact O-N 3.09Å; V838-I841 PolarHBondContact O-N 3.15Å; R839-I841 VanDerWaalsContact C-N 3.32Å; R839-I841 PolarHBondContact O-N 3.45Å; I841-V845 HydrophobicContact CG2-CG2 4.46Å; I841-V845 WeakPolarHBondContact O-CB 3.32Å; I841-V845 VanDerWaalsContact O-CG2 3.29Å; I841-V845 WeakPolarHBondContact O-CG2 3.22Å; I841-V845 PolarHBondContact O-N 3.43Å; I841-I914 HydrophobicContact CG2-CD1 4.46Å; I841-T938 HydrophobicContact CG2-CG2 3.37Å; I841-L941 HydrophobicContact CD1-CD2 4.43Å; I841-L941 HydrophobicContact CG1-CD2 4.16Å; I841-L941 HydrophobicContact CG2-CD2 4.33Å; I841-V942 HydrophobicContact CG2-CG2 3.82Å
842	Q	89.8	Confident	88.8	Confident	40 Å²	40	20.5 Å²	20.5	19%	0.187	11%	0.107	C	C	.	.	H	α-helix	trans	-63	-50.2	174.5	179.1	170.1	-20.6	0	0	111.4	V838 R839 F844 V845 L846	V838-Q842 WeakPolarHBondContact O-CB 3.36Å; V838-Q842 PolarHBondContact O-N 2.93Å; R839-Q842 PolarHBondContact O-N 2.97Å; Q842-F844 VanDerWaalsContact C-N 3.33Å; Q842-F844 PolarHBondContact O-N 2.56Å; Q842-V845 PolarHBondContact O-N 3.31Å; Q842-L846 HydrophobicContact CG-CD1 3.87Å; Q842-L846 HydrophobicContact CG-CG 4.44Å; Q842-L846 VanDerWaalsContact O-CG 3.29Å; Q842-L846 WeakPolarHBondContact O-CG 3.32Å; Q842-L846 PolarHBondContact O-N 3.46Å
843	D	88.8	Confident	88.7	Confident	54 Å²	54	19.1 Å²	19.1	29%	0.289	10%	0.1	S	C	.	.	H	α-helix	trans	-57.8	-45.2	176.7	-76.1	-17.4	0	0	0	111.7	R839 L840 L846 L847	R839-D843 PolarHBondContact O-N 2.98Å; L840-D843 PolarHBondContact O-N 2.82Å; D843-L846 PolarHBondContact O-N 3.4Å; D843-L847 VanDerWaalsContact O-CB 3.3Å; D843-L847 WeakPolarHBondContact O-CB 3.34Å; D843-L847 PolarHBondContact O-N 3.43Å
844	F	91	Very high	88.5	Confident	6 Å²	6	19.7 Å²	19.7	3%	0.026	11%	0.106	C	C	.	.	H	α-helix	trans	-64.2	-43.3	178.4	-65.1	-3.4	0	0	0	111.3	L751 T752 Y753 V758 Q821 L840 Q842 L847 T848	L751-F844 HydrophobicContact CB-CB 3.96Å; L751-F844 HydrophobicContact CD1-CB 3.83Å; L751-F844 HydrophobicContact CD1-CD2 4.25Å; T752-F844 WeakPolarHBondContact O-CA 3.39Å; Y753-F844 VanDerWaalsContact CB-CE1 3.47Å; V758-F844 HydrophobicContact CG2-CE1 3.59Å; V758-F844 HydrophobicContact CG2-CZ 3.74Å; Q821-F844 HydrophobicContact CB-CE2 4.4Å; Q821-F844 HydrophobicContact CG-CE2 4.12Å; L840-F844 HydrophobicContact CB-CE1 4.48Å; L840-F844 HydrophobicContact CB-CE2 4.31Å; L840-F844 HydrophobicContact CB-CZ 4.13Å; L840-F844 HydrophobicContact CD2-CE1 4.18Å; L840-F844 HydrophobicContact CD2-CZ 4.06Å; L840-F844 VanDerWaalsContact O-CB 3.28Å; L840-F844 WeakPolarHBondContact O-CB 3.5Å; L840-F844 WeakPolarHBondContact O-CD1 3.26Å; L840-F844 WeakPolarHBondContact O-CD2 3.43Å; L840-F844 WeakPolarHBondContact O-CG 3.38Å; L840-F844 PolarHBondContact O-N 3.43Å; Q842-F844 VanDerWaalsContact C-N 3.33Å; Q842-F844 PolarHBondContact O-N 2.56Å; F844-L847 PolarHBondContact O-N 3.37Å; F844-T848 WeakPolarHBondContact O-CB 3.21Å; F844-T848 PolarHBondContact O-N 2.83Å; F844-T848 PolarHBondContact O-OG1 2.81Å
845	V	91.4	Very high	88.3	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.2	-46	177.3	163.7	0	0	0	0	111.6	L751 I841 Q842 L847 T848 T849 I914 L917 L935 T938	L751-V845 HydrophobicContact CD2-CG2 4.45Å; I841-V845 HydrophobicContact CG2-CG2 4.46Å; I841-V845 WeakPolarHBondContact O-CB 3.32Å; I841-V845 VanDerWaalsContact O-CG2 3.29Å; I841-V845 WeakPolarHBondContact O-CG2 3.22Å; I841-V845 PolarHBondContact O-N 3.43Å; Q842-V845 PolarHBondContact O-N 3.31Å; V845-L847 PolarHBondContact O-N 3.07Å; V845-T848 PolarHBondContact O-N 2.69Å; V845-T849 VanDerWaalsContact O-CB 3.29Å; V845-T849 WeakPolarHBondContact O-CB 3.28Å; V845-T849 PolarHBondContact O-N 3.4Å; V845-T849 PolarHBondContact O-OG1 2.94Å; V845-I914 HydrophobicContact CG1-CG1 4.43Å; V845-L917 HydrophobicContact CG1-CD2 3.67Å; V845-L935 HydrophobicContact CG1-CD1 3.61Å; V845-L935 HydrophobicContact CG2-CD1 4.3Å; V845-T938 HydrophobicContact CG2-CG2 3.59Å
846	L	91.3	Very high	88.5	Confident	2 Å²	2	27.9 Å²	27.9	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-62.7	-43.1	179	-66.5	169	0	0	0	110.9	Q842 D843 T849 A850 Y896 L899 W902 L917	Q842-L846 HydrophobicContact CG-CD1 3.87Å; Q842-L846 HydrophobicContact CG-CG 4.44Å; Q842-L846 VanDerWaalsContact O-CG 3.29Å; Q842-L846 WeakPolarHBondContact O-CG 3.32Å; Q842-L846 PolarHBondContact O-N 3.46Å; D843-L846 PolarHBondContact O-N 3.4Å; L846-T849 PolarHBondContact O-N 3.28Å; L846-A850 WeakPolarHBondContact O-CB 3.42Å; L846-A850 PolarHBondContact O-N 3.45Å; L846-Y896 HydrophobicContact CB-CD2 4.48Å; L846-Y896 HydrophobicContact CB-CE2 4.1Å; L846-L899 HydrophobicContact CD2-CB 4.11Å; L846-W902 HydrophobicContact CD2-CZ3 4.34Å; L846-L917 HydrophobicContact CD2-CD2 4.1Å
847	L	89.9	Confident	88.5	Confident	4 Å²	4	27.5 Å²	27.5	2%	0.021	13%	0.134	C	C	.	.	H	α-helix	trans	-68	-44.6	177.6	-176.3	62.5	0	0	0	112.8	L247 T752 I754 D843 F844 V845 T849 A850 V851 W892 Y896	L247-L847 HydrophobicContact CD1-CD1 4.26Å; L247-L847 HydrophobicContact CD1-CD2 4.37Å; T752-L847 HydrophobicContact CG2-CD2 3.95Å; T752-L847 HydrophobicContact CG2-CG 4.07Å; I754-L847 HydrophobicContact CD1-CD2 3.99Å; I754-L847 HydrophobicContact CG1-CD2 3.75Å; D843-L847 VanDerWaalsContact O-CB 3.3Å; D843-L847 WeakPolarHBondContact O-CB 3.34Å; D843-L847 PolarHBondContact O-N 3.43Å; F844-L847 PolarHBondContact O-N 3.37Å; V845-L847 PolarHBondContact O-N 3.07Å; L847-T849 VanDerWaalsContact C-N 3.27Å; L847-T849 PolarHBondContact O-N 2.94Å; L847-A850 PolarHBondContact O-N 3.36Å; L847-V851 WeakPolarHBondContact O-CG2 3.5Å; L847-V851 PolarHBondContact O-N 2.87Å; L847-W892 HydrophobicContact CD1-CE3 4.08Å; L847-W892 HydrophobicContact CD1-CZ3 4.01Å; L847-Y896 HydrophobicContact CB-CD2 4.1Å; L847-Y896 HydrophobicContact CB-CE2 3.78Å; L847-Y896 HydrophobicContact CD1-CD2 3.94Å; L847-Y896 HydrophobicContact CD1-CE2 4.15Å; L847-Y896 HydrophobicContact CD1-CG 4.27Å
848	T	89.2	Confident	88.4	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.018	15%	0.149	C	C	.	.	H	α-helix	trans	-61.6	-41.3	176.5	-43	0	0	0	0	110.5	L751 T752 F844 V845 V851 E852 W932	L751-T848 VanDerWaalsContact CA-OG1 3.31Å; L751-T848 WeakPolarHBondContact CA-OG1 3.23Å; T752-T848 PolarHBondContact N-OG1 2.95Å; F844-T848 WeakPolarHBondContact O-CB 3.21Å; F844-T848 PolarHBondContact O-N 2.83Å; F844-T848 PolarHBondContact O-OG1 2.81Å; V845-T848 PolarHBondContact O-N 2.69Å; T848-V851 PolarHBondContact O-N 3.47Å; T848-E852 HydrophobicContact CG2-CG 4.27Å; T848-E852 WeakPolarHBondContact O-CB 3.22Å; T848-E852 WeakPolarHBondContact O-CG 3.21Å; T848-E852 PolarHBondContact O-N 2.84Å; T848-W932 HydrophobicContact CG2-CH2 3.99Å; T848-W932 HydrophobicContact CG2-CZ2 3.32Å
849	T	90	Very high	88.5	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63.8	-44.4	177.4	-55.3	0	0	0	0	111.1	V845 L846 L847 V851 E852 V853 L860 L899 L917 L921 W932	V845-T849 VanDerWaalsContact O-CB 3.29Å; V845-T849 WeakPolarHBondContact O-CB 3.28Å; V845-T849 PolarHBondContact O-N 3.4Å; V845-T849 PolarHBondContact O-OG1 2.94Å; L846-T849 PolarHBondContact O-N 3.28Å; L847-T849 VanDerWaalsContact C-N 3.27Å; L847-T849 PolarHBondContact O-N 2.94Å; T849-V851 VanDerWaalsContact C-N 3.29Å; T849-V851 PolarHBondContact O-N 3.41Å; T849-E852 PolarHBondContact O-N 3.45Å; T849-V853 HydrophobicContact CG2-CG2 3.82Å; T849-V853 WeakPolarHBondContact O-CB 3.24Å; T849-V853 WeakPolarHBondContact O-CG2 3.3Å; T849-V853 PolarHBondContact O-N 3.06Å; T849-L860 HydrophobicContact CG2-CD2 4.04Å; T849-L899 HydrophobicContact CG2-CD1 3.85Å; T849-L917 HydrophobicContact CG2-CD1 4.13Å; T849-L917 HydrophobicContact CG2-CD2 4.42Å; T849-L917 HydrophobicContact CG2-CG 4.49Å; T849-L921 HydrophobicContact CG2-CD1 3.87Å; T849-L921 HydrophobicContact CG2-CD2 3.91Å; T849-L921 HydrophobicContact CG2-CG 4.34Å; T849-W932 WeakPolarHBondContact OG1-CZ3 3.29Å
850	A	89.1	Confident	88.5	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-58.1	-40.8	176.1	0	0	0	0	0	112.7	L846 L847 A854 W892 A895 Y896 L899	L846-A850 WeakPolarHBondContact O-CB 3.42Å; L846-A850 PolarHBondContact O-N 3.45Å; L847-A850 PolarHBondContact O-N 3.36Å; A850-A854 PolarHBondContact O-N 3.31Å; A850-W892 WeakPolarHBondContact O-CB 3.02Å; A850-A895 HydrophobicContact CB-CB 3.98Å; A850-Y896 HydrophobicContact CB-CD2 4.25Å; A850-Y896 HydrophobicContact CB-CG 4.48Å; A850-L899 HydrophobicContact CB-CD1 4.21Å
851	V	86.7	Confident	88.5	Confident	55 Å²	55	29.6 Å²	29.6	33%	0.333	14%	0.142	S	C	.	.	H	α-helix	trans	-73.2	-45.2	178.7	174.2	0	0	0	0	112.6	L847 T848 T849 V853 W892	L847-V851 WeakPolarHBondContact O-CG2 3.5Å; L847-V851 PolarHBondContact O-N 2.87Å; T848-V851 PolarHBondContact O-N 3.47Å; T849-V851 VanDerWaalsContact C-N 3.29Å; T849-V851 PolarHBondContact O-N 3.41Å; V851-V853 VanDerWaalsContact C-N 3.29Å; V851-V853 PolarHBondContact O-N 2.87Å; V851-W892 HydrophobicContact CG2-CB 3.95Å; V851-W892 HydrophobicContact CG2-CD2 4.33Å; V851-W892 HydrophobicContact CG2-CG 4.04Å
852	E	85.3	Confident	88.4	Confident	101 Å²	101	34 Å²	34	47%	0.472	16%	0.163	S	C	.	.	H	α-helix	trans	-67.9	-27.3	177.9	-77.2	-80.1	153.1	0	0	113.1	T848 T849 I928	T848-E852 HydrophobicContact CG2-CG 4.27Å; T848-E852 WeakPolarHBondContact O-CB 3.22Å; T848-E852 WeakPolarHBondContact O-CG 3.21Å; T848-E852 PolarHBondContact O-N 2.84Å; T849-E852 PolarHBondContact O-N 3.45Å; E852-I928 HydrophobicContact CB-CG2 4.28Å
853	V	85.6	Confident	88.3	Confident	5 Å²	5	35.2 Å²	35.2	3%	0.03	17%	0.168	C	C	.	.	H	α-helix	trans	-87.9	-41.6	-179.6	174.6	0	0	0	0	111.5	T849 V851 Q855 R856 W857 L860 L921 M924 I928	T849-V853 HydrophobicContact CG2-CG2 3.82Å; T849-V853 WeakPolarHBondContact O-CB 3.24Å; T849-V853 WeakPolarHBondContact O-CG2 3.3Å; T849-V853 PolarHBondContact O-N 3.06Å; V851-V853 VanDerWaalsContact C-N 3.29Å; V851-V853 PolarHBondContact O-N 2.87Å; V853-Q855 PolarHBondContact O-N 3.45Å; V853-R856 VanDerWaalsContact CG1-C 3.49Å; V853-R856 HydrophobicContact CG1-CB 4.19Å; V853-R856 WeakPolarHBondContact O-CB 3.44Å; V853-R856 PolarHBondContact O-N 3.13Å; V853-W857 HydrophobicContact CG1-CB 3.94Å; V853-W857 VanDerWaalsContact CG1-N 3.35Å; V853-L860 HydrophobicContact CG1-CB 4.22Å; V853-L860 HydrophobicContact CG1-CD2 4.23Å; V853-L860 HydrophobicContact CG2-CD2 3.89Å; V853-L921 HydrophobicContact CG2-CD2 3.67Å; V853-M924 HydrophobicContact CG1-CE 4.29Å; V853-I928 HydrophobicContact CB-CD1 4.21Å; V853-I928 HydrophobicContact CG2-CD1 3.51Å
854	A	85.3	Confident	88.2	Confident	28 Å²	28	34 Å²	34	23%	0.231	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	40.1	-118.2	177.9	0	0	0	0	0	113.3	A850 R856 W857	A850-A854 PolarHBondContact O-N 3.31Å; A854-R856 PolarHBondContact O-N 2.84Å; A854-W857 VanDerWaalsContact O-CB 3.32Å; A854-W857 WeakPolarHBondContact O-CB 3.41Å; A854-W857 PolarHBondContact O-N 2.85Å
855	Q	82.1	Confident	87.9	Confident	128 Å²	128	35.9 Å²	35.9	60%	0.598	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	-54.3	-24.7	-179.3	-63.2	175.1	7.5	0	0	114.4	V853 W857 M891	V853-Q855 PolarHBondContact O-N 3.45Å; Q855-W857 VanDerWaalsContact C-N 3.28Å; Q855-W857 PolarHBondContact O-N 3.06Å; Q855-M891 HydrophobicContact CG-CB 4.41Å; Q855-M891 HydrophobicContact CG-CG 4.18Å
856	R	86.8	Confident	87.6	Confident	75 Å²	75	44.9 Å²	44.9	28%	0.283	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-85.4	7.6	179.7	-62.8	178.9	59.8	-149.3	-1.6	113.7	V853 A854 R858 E859 L860 M924 N926	V853-R856 VanDerWaalsContact CG1-C 3.49Å; V853-R856 HydrophobicContact CG1-CB 4.19Å; V853-R856 WeakPolarHBondContact O-CB 3.44Å; V853-R856 PolarHBondContact O-N 3.13Å; A854-R856 PolarHBondContact O-N 2.84Å; R856-R858 PolarHBondContact O-N 2.83Å; R856-E859 IonicContact CZ-OE2 3.52Å; R856-E859 VanDerWaalsContact CZ-OE2 3.26Å; R856-E859 IonicContact NE-OE2 3.26Å; R856-E859 PolarHBondContact NE-OE2 2.78Å; R856-E859 IonicContact NH2-OE1 3.6Å; R856-E859 IonicContact NH2-OE2 2.67Å; R856-E859 PolarHBondContact NH2-OE2 3.5Å; R856-E859 WeakPolarHBondContact O-CB 3.47Å; R856-E859 PolarHBondContact O-N 3.41Å; R856-L860 PolarHBondContact O-N 2.91Å; R856-M924 HydrophobicContact CB-CE 3.95Å; R856-M924 WeakPolarHBondContact O-CE 3.39Å; R856-N926 PolarHBondContact NH1-O 3.44Å; R856-N926 PolarHBondContact NH2-O 2.81Å
857	W	89.1	Confident	87.3	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.008	22%	0.221	C	C	.	.	H	α-helix	trans	-62.5	-32.3	-175.9	83.8	-87.2	0	0	0	112.7	V853 A854 Q855 E859 L860 A861 M872 Y875 E876 P894 A895 F898	V853-W857 HydrophobicContact CG1-CB 3.94Å; V853-W857 VanDerWaalsContact CG1-N 3.35Å; A854-W857 VanDerWaalsContact O-CB 3.32Å; A854-W857 WeakPolarHBondContact O-CB 3.41Å; A854-W857 PolarHBondContact O-N 2.85Å; Q855-W857 VanDerWaalsContact C-N 3.28Å; Q855-W857 PolarHBondContact O-N 3.06Å; W857-E859 VanDerWaalsContact C-N 3.31Å; W857-E859 PolarHBondContact O-N 3.29Å; W857-L860 WeakPolarHBondContact O-CB 3.45Å; W857-L860 PolarHBondContact O-N 3Å; W857-L860 VanDerWaalsContact O-N 3.07Å; W857-A861 HydrophobicContact CE3-CB 4.13Å; W857-A861 HydrophobicContact CZ3-CB 4Å; W857-A861 WeakPolarHBondContact O-CB 3.36Å; W857-A861 PolarHBondContact O-N 3.05Å; W857-M872 HydrophobicContact CH2-CB 3.83Å; W857-M872 HydrophobicContact CH2-CG 4.12Å; W857-M872 HydrophobicContact CZ2-CB 4.06Å; W857-Y875 HydrophobicContact CH2-CD2 4.2Å; W857-Y875 HydrophobicContact CH2-CG 4.32Å; W857-Y875 HydrophobicContact CZ3-CD2 4.47Å; W857-E876 HydrophobicContact CZ2-CG 3.87Å; W857-E876 WeakPolarHBondContact CZ2-OE1 3.4Å; W857-E876 PolarHBondContact NE1-OE1 2.86Å; W857-P894 HydrophobicContact CZ2-CB 4.16Å; W857-A895 HydrophobicContact CB-CB 3.39Å; W857-A895 HydrophobicContact CD2-CB 4.37Å; W857-A895 HydrophobicContact CG-CB 3.78Å; W857-F898 HydrophobicContact CE3-CB 3.98Å; W857-F898 HydrophobicContact CE3-CD1 4.03Å; W857-F898 HydrophobicContact CE3-CG 4.1Å; W857-F898 HydrophobicContact CZ3-CB 3.6Å; W857-F898 HydrophobicContact CZ3-CD1 4.13Å; W857-F898 HydrophobicContact CZ3-CD2 4.41Å; W857-F898 AromaticContact CZ3-CG 3.75Å; W857-F898 HydrophobicContact CZ3-CG 3.75Å
858	R	88.4	Confident	87	Confident	80 Å²	80	47.6 Å²	47.6	30%	0.302	24%	0.236	S	C	.	.	H	α-helix	trans	-55.4	-42.7	171.1	-66.9	-176.5	172.5	-132.4	3.6	112.3	R856 E862 M872 D873 E876	R856-R858 PolarHBondContact O-N 2.83Å; R858-E862 PolarHBondContact O-N 2.77Å; R858-E862 VanDerWaalsContact O-N 3.14Å; R858-M872 HydrophobicContact CB-SD 3.55Å; R858-M872 VanDerWaalsContact CB-SD 3.55Å; R858-M872 HydrophobicContact CG-CB 4.44Å; R858-M872 HydrophobicContact CG-SD 3.7Å; R858-M872 WeakPolarHBondContact O-CE 3.14Å; R858-D873 IonicContact CZ-OD1 3.74Å; R858-D873 IonicContact NH1-OD1 2.8Å; R858-D873 IonicContact NH2-OD1 3.43Å; R858-D873 PolarHBondContact NH2-OD1 3.18Å; R858-E876 IonicContact CZ-OE1 2.62Å; R858-E876 IonicContact CZ-OE2 2.74Å; R858-E876 IonicContact NE-OE1 3.65Å; R858-E876 PolarHBondContact NE-OE1 3.47Å; R858-E876 IonicContact NE-OE2 3.61Å; R858-E876 IonicContact NH2-OE1 2.87Å; R858-E876 PolarHBondContact NH2-OE1 3.41Å; R858-E876 IonicContact NH2-OE2 2.73Å; R858-E876 PolarHBondContact NH2-OE2 3.37Å
859	E	89.6	Confident	86.6	Confident	35 Å²	35	55.4 Å²	55.4	16%	0.164	27%	0.269	C	S	.	.	H	α-helix	trans	-64.8	-41.5	174.6	-179	-174.7	-170.8	0	0	111	R856 W857 E862 K863 M924 K925	R856-E859 IonicContact CZ-OE2 3.52Å; R856-E859 VanDerWaalsContact CZ-OE2 3.26Å; R856-E859 IonicContact NE-OE2 3.26Å; R856-E859 PolarHBondContact NE-OE2 2.78Å; R856-E859 IonicContact NH2-OE1 3.6Å; R856-E859 IonicContact NH2-OE2 2.67Å; R856-E859 PolarHBondContact NH2-OE2 3.5Å; R856-E859 WeakPolarHBondContact O-CB 3.47Å; R856-E859 PolarHBondContact O-N 3.41Å; W857-E859 VanDerWaalsContact C-N 3.31Å; W857-E859 PolarHBondContact O-N 3.29Å; E859-E862 PolarHBondContact O-N 2.82Å; E859-K863 WeakPolarHBondContact O-CG 3.45Å; E859-K863 PolarHBondContact O-N 3.3Å; E859-K863 VanDerWaalsContact O-N 3.16Å; E859-M924 HydrophobicContact CB-CE 3.9Å; E859-M924 HydrophobicContact CG-CB 4.45Å; E859-M924 HydrophobicContact CG-CE 3.94Å; E859-M924 HydrophobicContact CG-CG 4.38Å; E859-M924 WeakPolarHBondContact OE2-CE 3.41Å; E859-K925 WeakPolarHBondContact OE1-CB 3.35Å; E859-K925 WeakPolarHBondContact OE1-CG 3.31Å; E859-K925 PolarHBondContact OE1-N 3.11Å
860	L	88.9	Confident	86.1	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-67.3	-42.9	179.2	-177.4	60.7	0	0	0	111.9	T849 V853 R856 W857 E862 K863 L864 L899 L921 M924	T849-L860 HydrophobicContact CG2-CD2 4.04Å; V853-L860 HydrophobicContact CG1-CB 4.22Å; V853-L860 HydrophobicContact CG1-CD2 4.23Å; V853-L860 HydrophobicContact CG2-CD2 3.89Å; R856-L860 PolarHBondContact O-N 2.91Å; W857-L860 WeakPolarHBondContact O-CB 3.45Å; W857-L860 PolarHBondContact O-N 3Å; W857-L860 VanDerWaalsContact O-N 3.07Å; L860-E862 VanDerWaalsContact C-N 3.32Å; L860-E862 PolarHBondContact O-N 2.88Å; L860-K863 PolarHBondContact O-N 2.87Å; L860-K863 VanDerWaalsContact O-N 3.12Å; L860-L864 HydrophobicContact CD1-CD1 3.81Å; L860-L864 HydrophobicContact CD1-CG 3.84Å; L860-L864 HydrophobicContact CD2-CD1 4.23Å; L860-L864 HydrophobicContact CG-CD1 3.7Å; L860-L864 HydrophobicContact CG-CG 4.13Å; L860-L864 WeakPolarHBondContact O-CB 3.49Å; L860-L864 WeakPolarHBondContact O-CG 3.31Å; L860-L864 PolarHBondContact O-N 2.87Å; L860-L899 HydrophobicContact CD2-CD1 4.49Å; L860-L899 HydrophobicContact CD2-CD2 4.15Å; L860-L921 HydrophobicContact CD1-CD2 3.9Å; L860-L921 HydrophobicContact CD1-CG 4.08Å; L860-L921 HydrophobicContact CD2-CD2 3.87Å; L860-M924 HydrophobicContact CB-CE 3.93Å; L860-M924 HydrophobicContact CB-SD 4.25Å; L860-M924 HydrophobicContact CD1-CG 4.37Å; L860-M924 HydrophobicContact CD1-SD 4.14Å
861	A	88.9	Confident	85.6	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-61	-40.4	177.2	0	0	0	0	0	112.1	W857 K863 L864 A865 K866 V867 M872 F898	W857-A861 HydrophobicContact CE3-CB 4.13Å; W857-A861 HydrophobicContact CZ3-CB 4Å; W857-A861 WeakPolarHBondContact O-CB 3.36Å; W857-A861 PolarHBondContact O-N 3.05Å; A861-K863 PolarHBondContact O-N 3.29Å; A861-L864 PolarHBondContact O-N 3.03Å; A861-A865 PolarHBondContact O-N 3.03Å; A861-K866 PolarHBondContact O-N 3.23Å; A861-V867 HydrophobicContact CB-CB 4.14Å; A861-V867 HydrophobicContact CB-CG2 3.99Å; A861-M872 HydrophobicContact CB-CE 4.3Å; A861-F898 HydrophobicContact CB-CD1 4.01Å; A861-F898 HydrophobicContact CB-CD2 4.38Å; A861-F898 HydrophobicContact CB-CE1 3.64Å; A861-F898 HydrophobicContact CB-CE2 4.06Å; A861-F898 HydrophobicContact CB-CG 4.38Å; A861-F898 HydrophobicContact CB-CZ 3.68Å
862	E	88.5	Confident	85.3	Confident	93 Å²	93	65.6 Å²	65.6	44%	0.435	31%	0.314	S	S	.	.	H	α-helix	trans	-59.6	-44.3	171.9	-161.9	-143.5	119.8	0	0	111.7	R858 E859 L860 K866 M872	R858-E862 PolarHBondContact O-N 2.77Å; R858-E862 VanDerWaalsContact O-N 3.14Å; E859-E862 PolarHBondContact O-N 2.82Å; L860-E862 VanDerWaalsContact C-N 3.32Å; L860-E862 PolarHBondContact O-N 2.88Å; E862-K866 VanDerWaalsContact O-CA 3.29Å; E862-K866 WeakPolarHBondContact O-CA 3.34Å; E862-K866 PolarHBondContact O-N 3.3Å; E862-K866 VanDerWaalsContact O-N 3.08Å; E862-M872 HydrophobicContact CB-CE 4.16Å
863	K	88.2	Confident	85.1	Confident	66 Å²	66	63.4 Å²	63.4	29%	0.287	31%	0.305	S	S	.	.	H	α-helix	trans	-80.1	-20.3	-178.2	-59.4	-39.5	176.7	-165.4	0	115.1	E859 L860 A861 K923	E859-K863 WeakPolarHBondContact O-CG 3.45Å; E859-K863 PolarHBondContact O-N 3.3Å; E859-K863 VanDerWaalsContact O-N 3.16Å; L860-K863 PolarHBondContact O-N 2.87Å; L860-K863 VanDerWaalsContact O-N 3.12Å; A861-K863 PolarHBondContact O-N 3.29Å; K863-K923 HydrophobicContact CB-CB 3.77Å; K863-K923 HydrophobicContact CG-CB 4Å
864	L	86.4	Confident	85.1	Confident	28 Å²	28	65.8 Å²	65.8	15%	0.147	33%	0.326	C	S	.	.	H	α-helix	trans	-89.4	-45.3	178	-78.8	-178.3	0	0	0	113.1	L860 A861 F898 L899 W902 E916 L917	L860-L864 HydrophobicContact CD1-CD1 3.81Å; L860-L864 HydrophobicContact CD1-CG 3.84Å; L860-L864 HydrophobicContact CD2-CD1 4.23Å; L860-L864 HydrophobicContact CG-CD1 3.7Å; L860-L864 HydrophobicContact CG-CG 4.13Å; L860-L864 WeakPolarHBondContact O-CB 3.49Å; L860-L864 WeakPolarHBondContact O-CG 3.31Å; L860-L864 PolarHBondContact O-N 2.87Å; A861-L864 PolarHBondContact O-N 3.03Å; L864-F898 HydrophobicContact CB-CZ 4.4Å; L864-F898 HydrophobicContact CD1-CE1 4.23Å; L864-L899 HydrophobicContact CD1-CD2 3.87Å; L864-W902 HydrophobicContact CD1-CD2 4.02Å; L864-W902 HydrophobicContact CD1-CE3 4.32Å; L864-W902 HydrophobicContact CD1-CH2 4.28Å; L864-W902 HydrophobicContact CD1-CZ2 3.91Å; L864-W902 HydrophobicContact CD1-CZ3 4.46Å; L864-W902 HydrophobicContact CD2-CH2 4.23Å; L864-W902 HydrophobicContact CD2-CZ2 3.52Å; L864-W902 HydrophobicContact CG-CZ2 4.19Å; L864-E916 WeakPolarHBondContact CD2-O 3.45Å; L864-L917 HydrophobicContact CD1-CD1 3.92Å
865	A	85.3	Confident	84.9	Confident	47 Å²	47	67.2 Å²	67.2	39%	0.388	33%	0.325	S	S	.	.	H	α-helix	trans	-138.9	10.2	-170.7	0	0	0	0	0	114.5	A861 V867	A861-A865 PolarHBondContact O-N 3.03Å; A865-V867 HydrophobicContact CB-CG2 3.88Å; A865-V867 PolarHBondContact O-N 3.02Å; A865-V867 VanDerWaalsContact O-N 3.16Å
866	K	85.4	Confident	85	Confident	189 Å²	189	61.7 Å²	61.7	82%	0.822	30%	0.3	S	S	*	.			trans	53	32.7	-178	-57.1	-179.4	-179.1	176.8	0	113.6	A861 E862	A861-K866 PolarHBondContact O-N 3.23Å; E862-K866 VanDerWaalsContact O-CA 3.29Å; E862-K866 WeakPolarHBondContact O-CA 3.34Å; E862-K866 PolarHBondContact O-N 3.3Å; E862-K866 VanDerWaalsContact O-N 3.08Å
867	V	84.7	Confident	84.7	Confident	16 Å²	16	61.5 Å²	61.5	10%	0.097	31%	0.31	C	S	.	.			trans	-54.1	137	-176.9	-176.8	0	0	0	0	110.8	A861 A865 Q871 M872 F898	A861-V867 HydrophobicContact CB-CB 4.14Å; A861-V867 HydrophobicContact CB-CG2 3.99Å; A865-V867 HydrophobicContact CB-CG2 3.88Å; A865-V867 PolarHBondContact O-N 3.02Å; A865-V867 VanDerWaalsContact O-N 3.16Å; V867-Q871 HydrophobicContact CG1-CB 3.44Å; V867-Q871 VanDerWaalsContact CG1-CB 3.44Å; V867-M872 HydrophobicContact CB-CE 4.26Å; V867-M872 HydrophobicContact CB-CG 4.45Å; V867-M872 HydrophobicContact CG1-CG 3.87Å; V867-M872 WeakPolarHBondContact O-CE 3.43Å; V867-F898 HydrophobicContact CG2-CD2 4.46Å; V867-F898 HydrophobicContact CG2-CE2 3.69Å; V867-F898 HydrophobicContact CG2-CZ 4.24Å
868	S	82.7	Confident	84.4	Confident	47 Å²	47	65.5 Å²	65.5	33%	0.329	34%	0.336	S	S	.	.			trans	-76	158.7	178.3	83.4	0	0	0	0	111.8	Q870 Q871 M872	S868-Q870 VanDerWaalsContact C-N 3.3Å; S868-Q870 PolarHBondContact O-N 2.82Å; S868-Q871 WeakPolarHBondContact O-CB 3.3Å; S868-Q871 PolarHBondContact O-N 3.3Å; S868-Q871 VanDerWaalsContact O-N 3.12Å; S868-Q871 WeakPolarHBondContact OG-CG 3.24Å; S868-Q871 PolarHBondContact OG-N 3.1Å; S868-M872 WeakPolarHBondContact O-CG 3.43Å; S868-M872 PolarHBondContact O-N 2.65Å
869	K	81.4	Confident	83.9	Confident	166 Å²	166	64 Å²	64	72%	0.722	33%	0.332	S	S	*	.	H	α-helix	trans	-55.1	-46	176.4	-69.8	-176.4	179.4	178.7	0	112	Q871 M872 D873	K869-Q871 VanDerWaalsContact C-N 3.31Å; K869-Q871 PolarHBondContact O-N 3.24Å; K869-M872 WeakPolarHBondContact O-CA 3.49Å; K869-M872 WeakPolarHBondContact O-CB 3.37Å; K869-M872 PolarHBondContact O-N 2.84Å; K869-D873 PolarHBondContact O-N 3.03Å; K869-D873 VanDerWaalsContact O-OD2 3.05Å
870	Q	79.7	Confident	83.5	Confident	164 Å²	164	67.1 Å²	67.1	77%	0.766	34%	0.342	S	S	*	.	H	α-helix	trans	-57.8	-41.2	177.2	-68.7	169.4	-27.7	0	0	112.4	S868 D873 A874	S868-Q870 VanDerWaalsContact C-N 3.3Å; S868-Q870 PolarHBondContact O-N 2.82Å; Q870-D873 PolarHBondContact O-N 3.39Å; Q870-A874 WeakPolarHBondContact O-CB 3.24Å; Q870-A874 PolarHBondContact O-N 3.49Å
871	Q	77.6	Confident	82.8	Confident	92 Å²	92	70.5 Å²	70.5	43%	0.43	36%	0.36	S	S	.	.	H	α-helix	trans	-67.4	-37	174.6	-71.5	169.4	-26.1	0	0	111.8	V867 S868 K869 A874 Y875	V867-Q871 HydrophobicContact CG1-CB 3.44Å; V867-Q871 VanDerWaalsContact CG1-CB 3.44Å; S868-Q871 WeakPolarHBondContact O-CB 3.3Å; S868-Q871 PolarHBondContact O-N 3.3Å; S868-Q871 VanDerWaalsContact O-N 3.12Å; S868-Q871 WeakPolarHBondContact OG-CG 3.24Å; S868-Q871 PolarHBondContact OG-N 3.1Å; K869-Q871 VanDerWaalsContact C-N 3.31Å; K869-Q871 PolarHBondContact O-N 3.24Å; Q871-A874 WeakPolarHBondContact O-CB 3.48Å; Q871-A874 PolarHBondContact O-N 3.32Å; Q871-Y875 WeakPolarHBondContact O-CD2 3.45Å; Q871-Y875 PolarHBondContact O-N 3.19Å
872	M	81.6	Confident	81.8	Confident	13 Å²	13	81.6 Å²	81.6	6%	0.064	40%	0.402	C	S	.	.	H	α-helix	trans	-64.3	-46.2	174.4	-63	178.1	-167.8	0	0	111.8	W857 R858 A861 E862 V867 S868 K869 A874 Y875 E876	W857-M872 HydrophobicContact CH2-CB 3.83Å; W857-M872 HydrophobicContact CH2-CG 4.12Å; W857-M872 HydrophobicContact CZ2-CB 4.06Å; R858-M872 HydrophobicContact CB-SD 3.55Å; R858-M872 VanDerWaalsContact CB-SD 3.55Å; R858-M872 HydrophobicContact CG-CB 4.44Å; R858-M872 HydrophobicContact CG-SD 3.7Å; R858-M872 WeakPolarHBondContact O-CE 3.14Å; A861-M872 HydrophobicContact CB-CE 4.3Å; E862-M872 HydrophobicContact CB-CE 4.16Å; V867-M872 HydrophobicContact CB-CE 4.26Å; V867-M872 HydrophobicContact CB-CG 4.45Å; V867-M872 HydrophobicContact CG1-CG 3.87Å; V867-M872 WeakPolarHBondContact O-CE 3.43Å; S868-M872 WeakPolarHBondContact O-CG 3.43Å; S868-M872 PolarHBondContact O-N 2.65Å; K869-M872 WeakPolarHBondContact O-CA 3.49Å; K869-M872 WeakPolarHBondContact O-CB 3.37Å; K869-M872 PolarHBondContact O-N 2.84Å; M872-A874 PolarHBondContact O-N 3.23Å; M872-Y875 PolarHBondContact O-N 2.88Å; M872-Y875 VanDerWaalsContact O-N 3.15Å; M872-E876 PolarHBondContact O-N 3.33Å; M872-E876 VanDerWaalsContact O-N 3.16Å
873	D	81.9	Confident	80.8	Confident	55 Å²	55	83.4 Å²	83.4	29%	0.294	42%	0.415	S	S	.	.	H	α-helix	trans	-62.5	-30.8	177.1	-69.5	-53.4	0	0	0	111.8	R858 K869 Q870 E876 S877 R880	R858-D873 IonicContact CZ-OD1 3.74Å; R858-D873 IonicContact NH1-OD1 2.8Å; R858-D873 IonicContact NH2-OD1 3.43Å; R858-D873 PolarHBondContact NH2-OD1 3.18Å; K869-D873 PolarHBondContact O-N 3.03Å; K869-D873 VanDerWaalsContact O-OD2 3.05Å; Q870-D873 PolarHBondContact O-N 3.39Å; D873-E876 PolarHBondContact O-N 3.08Å; D873-S877 PolarHBondContact O-N 3.16Å; D873-R880 IonicContact OD1-NH2 2.8Å; D873-R880 PolarHBondContact OD1-NH2 3.5Å; D873-R880 VanDerWaalsContact OD1-NH2 3.16Å
874	A	83.6	Confident	79.7	Confident	56 Å²	56	82.1 Å²	82.1	46%	0.463	42%	0.421	S	S	.	.	H	α-helix	trans	-66.5	-39	172.8	0	0	0	0	0	113.2	Q870 Q871 M872 E876 S877	Q870-A874 WeakPolarHBondContact O-CB 3.24Å; Q870-A874 PolarHBondContact O-N 3.49Å; Q871-A874 WeakPolarHBondContact O-CB 3.48Å; Q871-A874 PolarHBondContact O-N 3.32Å; M872-A874 PolarHBondContact O-N 3.23Å; A874-E876 VanDerWaalsContact C-N 3.33Å; A874-S877 PolarHBondContact O-N 2.93Å; A874-S877 PolarHBondContact O-OG 3.5Å
875	Y	82.4	Confident	78.9	Confident	58 Å²	58	85.2 Å²	85.2	23%	0.227	44%	0.44	C	S	.	.	H	α-helix	trans	-69	-29.5	172.8	-75.6	-75.4	0	0	0	112.9	W857 Q871 M872 P878 H879 D897 F898 T901	W857-Y875 HydrophobicContact CH2-CD2 4.2Å; W857-Y875 HydrophobicContact CH2-CG 4.32Å; W857-Y875 HydrophobicContact CZ3-CD2 4.47Å; Q871-Y875 WeakPolarHBondContact O-CD2 3.45Å; Q871-Y875 PolarHBondContact O-N 3.19Å; M872-Y875 PolarHBondContact O-N 2.88Å; M872-Y875 VanDerWaalsContact O-N 3.15Å; Y875-P878 VanDerWaalsContact O-CD 3.29Å; Y875-P878 WeakPolarHBondContact O-CD 3.3Å; Y875-H879 PolarHBondContact O-CD2 3.14Å; Y875-D897 HydrophobicContact CD1-CB 4.27Å; Y875-F898 HydrophobicContact CD1-CB 4.19Å; Y875-F898 HydrophobicContact CD2-CB 4.34Å; Y875-F898 HydrophobicContact CD2-CD2 4.46Å; Y875-F898 HydrophobicContact CE1-CB 4.25Å; Y875-F898 HydrophobicContact CE2-CB 4.41Å; Y875-F898 AromaticContact CE2-CD2 3.93Å; Y875-F898 HydrophobicContact CE2-CD2 3.93Å; Y875-F898 HydrophobicContact CG-CB 4.25Å; Y875-T901 WeakPolarHBondContact OH-CG2 3.46Å
876	E	83.9	Confident	78.3	Confident	12 Å²	12	83.6 Å²	83.6	6%	0.056	43%	0.425	C	S	.	.	H	α-helix	trans	-79.2	-28.1	175.3	-81.9	174.8	-154.8	0	0	113.3	W857 R858 M872 D873 A874 P878 H879 R880 V886 P894	W857-E876 HydrophobicContact CZ2-CG 3.87Å; W857-E876 WeakPolarHBondContact CZ2-OE1 3.4Å; W857-E876 PolarHBondContact NE1-OE1 2.86Å; R858-E876 IonicContact CZ-OE1 2.62Å; R858-E876 IonicContact CZ-OE2 2.74Å; R858-E876 IonicContact NE-OE1 3.65Å; R858-E876 PolarHBondContact NE-OE1 3.47Å; R858-E876 IonicContact NE-OE2 3.61Å; R858-E876 IonicContact NH2-OE1 2.87Å; R858-E876 PolarHBondContact NH2-OE1 3.41Å; R858-E876 IonicContact NH2-OE2 2.73Å; R858-E876 PolarHBondContact NH2-OE2 3.37Å; M872-E876 PolarHBondContact O-N 3.33Å; M872-E876 VanDerWaalsContact O-N 3.16Å; D873-E876 PolarHBondContact O-N 3.08Å; A874-E876 VanDerWaalsContact C-N 3.33Å; E876-P878 VanDerWaalsContact C-N 3.34Å; E876-P878 VanDerWaalsContact O-N 3.15Å; E876-H879 PolarHBondContact O-N 3.12Å; E876-R880 PolarHBondContact O-N 3.44Å; E876-V886 HydrophobicContact CB-CG2 3.76Å; E876-V886 HydrophobicContact CG-CG2 3.95Å; E876-P894 HydrophobicContact CB-CG 4.47Å; E876-P894 HydrophobicContact CG-CB 3.76Å; E876-P894 HydrophobicContact CG-CG 3.76Å
877	S	81.1	Confident	77.9	Confident	71 Å²	71	77.7 Å²	77.7	50%	0.497	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-50.2	-36.3	-176.3	72.5	0	0	0	0	116.4	D873 A874 H879	D873-S877 PolarHBondContact O-N 3.16Å; A874-S877 PolarHBondContact O-N 2.93Å; A874-S877 PolarHBondContact O-OG 3.5Å; S877-H879 VanDerWaalsContact C-N 3.28Å; S877-H879 PolarHBondContact O-N 3.16Å
878	P	81.4	Confident	77.2	Confident	85 Å²	85	80 Å²	80	55%	0.552	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-80.6	-7.8	179.1	-9.2	29	0	0	0	113.7	Y875 E876	Y875-P878 VanDerWaalsContact O-CD 3.29Å; Y875-P878 WeakPolarHBondContact O-CD 3.3Å; E876-P878 VanDerWaalsContact C-N 3.34Å; E876-P878 VanDerWaalsContact O-N 3.15Å
879	H	78.8	Confident	76.5	Confident	48 Å²	48	82.8 Å²	82.8	22%	0.222	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-116	4.9	-175.1	-57.7	-76.6	0	0	0	112.7	Y875 E876 S877 V886 K893 P894 D897	Y875-H879 PolarHBondContact O-CD2 3.14Å; E876-H879 PolarHBondContact O-N 3.12Å; S877-H879 VanDerWaalsContact C-N 3.28Å; S877-H879 PolarHBondContact O-N 3.16Å; H879-V886 HydrophobicContact CB-CG1 4.21Å; H879-V886 HydrophobicContact CB-CG2 4.4Å; H879-K893 VanDerWaalsContact CE1-CB 3.44Å; H879-K893 WeakPolarHBondContact CE1-CB 3.34Å; H879-K893 WeakPolarHBondContact ND1-CB 3.12Å; H879-P894 HydrophobicContact CB-CG 4.06Å; H879-D897 IonicContact CD2-OD2 2.73Å; H879-D897 IonicContact CE1-OD2 3.55Å; H879-D897 IonicContact NE2-OD2 3.16Å; H879-D897 PolarHBondContact NE2-OD2 3.34Å
880	R	80.8	Confident	76.4	Confident	102 Å²	102	75.3 Å²	75.3	39%	0.385	40%	0.397	S	S	.	.			trans	-72.3	141.7	174.1	-73.6	173	-176.9	-158.1	-0.6	110.3	D873 E876 G884 V886	D873-R880 IonicContact OD1-NH2 2.8Å; D873-R880 PolarHBondContact OD1-NH2 3.5Å; D873-R880 VanDerWaalsContact OD1-NH2 3.16Å; E876-R880 PolarHBondContact O-N 3.44Å; R880-G884 VanDerWaalsContact CD-O 3.25Å; R880-G884 WeakPolarHBondContact CD-O 3.37Å; R880-G884 WeakPolarHBondContact CG-O 3.35Å; R880-V886 HydrophobicContact CB-CG2 4.47Å; R880-V886 HydrophobicContact CG-CG2 3.63Å
881	D	73.6	Confident	76.5	Confident	72 Å²	72	68.5 Å²	68.5	39%	0.385	37%	0.365	S	S	.	.			trans	-74.4	-176.9	174.3	78.7	-13.6	0	0	0	111.9	N883 G884 V885	D881-N883 PolarHBondContact O-N 2.83Å; D881-N883 VanDerWaalsContact O-N 3.12Å; D881-N883 VanDerWaalsContact OD1-C 3.29Å; D881-N883 VanDerWaalsContact OD1-CA 3.27Å; D881-N883 WeakPolarHBondContact OD1-CA 3.36Å; D881-N883 WeakPolarHBondContact OD1-CB 3.29Å; D881-N883 PolarHBondContact OD1-N 3.39Å; D881-N883 PolarHBondContact OD2-ND2 3.43Å; D881-G884 PolarHBondContact O-N 3.07Å; D881-G884 PolarHBondContact OD1-N 3.25Å; D881-V885 WeakPolarHBondContact CB-O 3.39Å; D881-V885 VanDerWaalsContact CG-O 3.23Å; D881-V885 PolarHBondContact N-O 2.94Å; D881-V885 PolarHBondContact OD1-N 2.74Å; D881-V885 VanDerWaalsContact OD1-O 3.05Å
882	R	68.1	Low	76.7	Confident	233 Å²	233	66.8 Å²	66.8	88%	0.879	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-16.2	176.5	-173.6	172.4	174.9	179	-2.2	113.7
883	N	67.2	Low	76.9	Confident	132 Å²	132	69.1 Å²	69.1	71%	0.706	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-0.8	178.1	-48.9	-57.1	0	0	0	112.4	D881	D881-N883 PolarHBondContact O-N 2.83Å; D881-N883 VanDerWaalsContact O-N 3.12Å; D881-N883 VanDerWaalsContact OD1-C 3.29Å; D881-N883 VanDerWaalsContact OD1-CA 3.27Å; D881-N883 WeakPolarHBondContact OD1-CA 3.36Å; D881-N883 WeakPolarHBondContact OD1-CB 3.29Å; D881-N883 PolarHBondContact OD1-N 3.39Å; D881-N883 PolarHBondContact OD2-ND2 3.43Å
884	G	66	Low	77	Confident	39 Å²	39	66.5 Å²	66.5	40%	0.402	35%	0.351	S	S	.	.	S	Bend	trans	83.7	12.3	-179.1	0	0	0	0	0	114.8	R880 D881	R880-G884 VanDerWaalsContact CD-O 3.25Å; R880-G884 WeakPolarHBondContact CD-O 3.37Å; R880-G884 WeakPolarHBondContact CG-O 3.35Å; D881-G884 PolarHBondContact O-N 3.07Å; D881-G884 PolarHBondContact OD1-N 3.25Å
885	V	69.3	Low	77.2	Confident	92 Å²	92	63.9 Å²	63.9	56%	0.558	33%	0.329	S	S	*	.			trans	-113	138.1	-177.1	-177.4	0	0	0	0	109.7	D881	D881-V885 WeakPolarHBondContact CB-O 3.39Å; D881-V885 VanDerWaalsContact CG-O 3.23Å; D881-V885 PolarHBondContact N-O 2.94Å; D881-V885 PolarHBondContact OD1-N 2.74Å; D881-V885 VanDerWaalsContact OD1-O 3.05Å
886	V	73.9	Confident	77.4	Confident	13 Å²	13	63 Å²	63	8%	0.079	33%	0.326	C	S	.	.			trans	-81.9	125	169.6	-175.1	0	0	0	0	108.3	E876 H879 R880 S888 A890 M891 P894	E876-V886 HydrophobicContact CB-CG2 3.76Å; E876-V886 HydrophobicContact CG-CG2 3.95Å; H879-V886 HydrophobicContact CB-CG1 4.21Å; H879-V886 HydrophobicContact CB-CG2 4.4Å; R880-V886 HydrophobicContact CB-CG2 4.47Å; R880-V886 HydrophobicContact CG-CG2 3.63Å; V886-S888 PolarHBondContact O-N 3.31Å; V886-A890 HydrophobicContact CG1-CB 4.38Å; V886-M891 HydrophobicContact CB-SD 3.68Å; V886-M891 HydrophobicContact CG1-CG 4.22Å; V886-M891 HydrophobicContact CG1-SD 3.54Å; V886-M891 VanDerWaalsContact CG1-SD 3.54Å; V886-P894 HydrophobicContact CG1-CG 4.25Å
887	D	75.6	Confident	77.5	Confident	66 Å²	66	65 Å²	65	35%	0.353	34%	0.337	S	S	.	.			trans	-56.7	133.7	174.5	163.3	36.7	0	0	0	111	E889 A890 M891	D887-E889 PolarHBondContact O-N 2.76Å; D887-E889 VanDerWaalsContact O-N 3.14Å; D887-E889 PolarHBondContact OD1-N 2.96Å; D887-E889 WeakPolarHBondContact OD2-CB 3.39Å; D887-E889 PolarHBondContact OD2-N 3.44Å; D887-A890 HydrophobicContact CB-CB 4.07Å; D887-A890 CarbonylContact O-C 3.52Å; D887-A890 WeakPolarHBondContact O-CA 3.5Å; D887-A890 WeakPolarHBondContact O-CB 3.32Å; D887-A890 PolarHBondContact O-N 3.43Å; D887-A890 PolarHBondContact OD2-N 3.19Å; D887-M891 WeakPolarHBondContact O-CG 3.49Å; D887-M891 PolarHBondContact O-N 2.86Å; D887-M891 VanDerWaalsContact O-N 3.07Å
888	S	69.5	Low	77.9	Confident	63 Å²	63	61.9 Å²	61.9	44%	0.441	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.4	-39.1	171.6	58.9	0	0	0	0	115.3	V886	V886-S888 PolarHBondContact O-N 3.31Å
889	E	69.7	Low	78.2	Confident	107 Å²	107	57.9 Å²	57.9	50%	0.5	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-19.4	178.5	-56.5	-171	-174.2	0	0	112.6	F238 D887 W892	F238-E889 WeakPolarHBondContact CE2-OE1 3.43Å; F238-E889 WeakPolarHBondContact CZ-OE2 3.47Å; D887-E889 PolarHBondContact O-N 2.76Å; D887-E889 VanDerWaalsContact O-N 3.14Å; D887-E889 PolarHBondContact OD1-N 2.96Å; D887-E889 WeakPolarHBondContact OD2-CB 3.39Å; D887-E889 PolarHBondContact OD2-N 3.44Å; E889-W892 PolarHBondContact O-NE1 3.49Å
890	A	79.6	Confident	78.7	Confident	9 Å²	9	58.2 Å²	58.2	7%	0.074	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-9.5	173.9	0	0	0	0	0	114.3	V886 D887 W892 K893 P894	V886-A890 HydrophobicContact CG1-CB 4.38Å; D887-A890 HydrophobicContact CB-CB 4.07Å; D887-A890 CarbonylContact O-C 3.52Å; D887-A890 WeakPolarHBondContact O-CA 3.5Å; D887-A890 WeakPolarHBondContact O-CB 3.32Å; D887-A890 PolarHBondContact O-N 3.43Å; D887-A890 PolarHBondContact OD2-N 3.19Å; A890-W892 PolarHBondContact O-N 3.36Å; A890-K893 HydrophobicContact CB-CD 4.29Å; A890-K893 WeakPolarHBondContact O-CG 3.41Å; A890-K893 PolarHBondContact O-N 3.41Å; A890-P894 WeakPolarHBondContact O-CD 3.44Å
891	M	80.9	Confident	78.9	Confident	20 Å²	20	56.1 Å²	56.1	10%	0.099	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-14.1	-176.8	-75.9	-66.4	-82.4	0	0	115.6	Q855 V886 D887 K893	Q855-M891 HydrophobicContact CG-CB 4.41Å; Q855-M891 HydrophobicContact CG-CG 4.18Å; V886-M891 HydrophobicContact CB-SD 3.68Å; V886-M891 HydrophobicContact CG1-CG 4.22Å; V886-M891 HydrophobicContact CG1-SD 3.54Å; V886-M891 VanDerWaalsContact CG1-SD 3.54Å; D887-M891 WeakPolarHBondContact O-CG 3.49Å; D887-M891 PolarHBondContact O-N 2.86Å; D887-M891 VanDerWaalsContact O-N 3.07Å; M891-K893 VanDerWaalsContact C-N 3.3Å
892	W	82.6	Confident	79.7	Confident	56 Å²	56	52.9 Å²	52.9	21%	0.212	27%	0.272	C	S	.	.	H	α-helix	trans	-71.1	-21.3	170.3	67.8	-95.8	0	0	0	113.2	L247 L847 A850 V851 E889 A890 A895 Y896	L247-W892 HydrophobicContact CD1-CH2 3.41Å; L247-W892 VanDerWaalsContact CD1-CH2 3.41Å; L247-W892 HydrophobicContact CD1-CZ2 3.89Å; L247-W892 HydrophobicContact CD1-CZ3 3.85Å; L247-W892 HydrophobicContact CD2-CZ2 4.33Å; L847-W892 HydrophobicContact CD1-CE3 4.08Å; L847-W892 HydrophobicContact CD1-CZ3 4.01Å; A850-W892 WeakPolarHBondContact O-CB 3.02Å; V851-W892 HydrophobicContact CG2-CB 3.95Å; V851-W892 HydrophobicContact CG2-CD2 4.33Å; V851-W892 HydrophobicContact CG2-CG 4.04Å; E889-W892 PolarHBondContact O-NE1 3.49Å; A890-W892 PolarHBondContact O-N 3.36Å; W892-A895 PolarHBondContact O-N 2.89Å; W892-Y896 VanDerWaalsContact O-CB 3.3Å; W892-Y896 WeakPolarHBondContact O-CB 3.44Å; W892-Y896 PolarHBondContact O-N 3.3Å
893	K	84.4	Confident	80.5	Confident	63 Å²	63	42 Å²	42	27%	0.274	23%	0.231	S	C	.	.	H	α-helix	trans	-71.3	-51	-178.7	-51.5	167	-173.7	168.9	0	112	H879 A890 M891 A895 Y896 D897	H879-K893 VanDerWaalsContact CE1-CB 3.44Å; H879-K893 WeakPolarHBondContact CE1-CB 3.34Å; H879-K893 WeakPolarHBondContact ND1-CB 3.12Å; A890-K893 HydrophobicContact CB-CD 4.29Å; A890-K893 WeakPolarHBondContact O-CG 3.41Å; A890-K893 PolarHBondContact O-N 3.41Å; M891-K893 VanDerWaalsContact C-N 3.3Å; K893-A895 VanDerWaalsContact C-N 3.27Å; K893-A895 PolarHBondContact O-N 2.84Å; K893-Y896 PolarHBondContact O-N 2.89Å; K893-D897 PolarHBondContact O-N 3.42Å
894	P	85.3	Confident	81.2	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-57.1	-40.3	169.6	-21.8	31.4	0	0	0	112.5	W857 E876 H879 V886 A890 Y896 D897 F898	W857-P894 HydrophobicContact CZ2-CB 4.16Å; E876-P894 HydrophobicContact CB-CG 4.47Å; E876-P894 HydrophobicContact CG-CB 3.76Å; E876-P894 HydrophobicContact CG-CG 3.76Å; H879-P894 HydrophobicContact CB-CG 4.06Å; V886-P894 HydrophobicContact CG1-CG 4.25Å; A890-P894 WeakPolarHBondContact O-CD 3.44Å; P894-Y896 VanDerWaalsContact C-N 3.34Å; P894-Y896 PolarHBondContact O-N 2.97Å; P894-D897 PolarHBondContact O-N 3.21Å; P894-F898 WeakPolarHBondContact O-CB 3.46Å; P894-F898 PolarHBondContact O-N 3.14Å
895	A	86.4	Confident	81.8	Confident	1 Å²	1	47 Å²	47	1%	0.008	24%	0.24	C	C	.	.	H	α-helix	trans	-61.6	-40.4	177.9	0	0	0	0	0	112.4	A850 W857 W892 K893 L899	A850-A895 HydrophobicContact CB-CB 3.98Å; W857-A895 HydrophobicContact CB-CB 3.39Å; W857-A895 HydrophobicContact CD2-CB 4.37Å; W857-A895 HydrophobicContact CG-CB 3.78Å; W892-A895 PolarHBondContact O-N 2.89Å; K893-A895 VanDerWaalsContact C-N 3.27Å; K893-A895 PolarHBondContact O-N 2.84Å; A895-L899 VanDerWaalsContact O-CB 3.28Å; A895-L899 WeakPolarHBondContact O-CB 3.43Å; A895-L899 VanDerWaalsContact O-CG 3.23Å; A895-L899 WeakPolarHBondContact O-CG 3.42Å; A895-L899 PolarHBondContact O-N 3.46Å
896	Y	87.5	Confident	81.6	Confident	40 Å²	40	45.6 Å²	45.6	16%	0.157	23%	0.229	C	C	.	.	H	α-helix	trans	-72.6	-42.9	177.6	-174.1	-110.1	0	0	0	112.1	L846 L847 A850 W892 K893 P894 F898 L899 L900	L846-Y896 HydrophobicContact CB-CD2 4.48Å; L846-Y896 HydrophobicContact CB-CE2 4.1Å; L847-Y896 HydrophobicContact CB-CD2 4.1Å; L847-Y896 HydrophobicContact CB-CE2 3.78Å; L847-Y896 HydrophobicContact CD1-CD2 3.94Å; L847-Y896 HydrophobicContact CD1-CE2 4.15Å; L847-Y896 HydrophobicContact CD1-CG 4.27Å; A850-Y896 HydrophobicContact CB-CD2 4.25Å; A850-Y896 HydrophobicContact CB-CG 4.48Å; W892-Y896 VanDerWaalsContact O-CB 3.3Å; W892-Y896 WeakPolarHBondContact O-CB 3.44Å; W892-Y896 PolarHBondContact O-N 3.3Å; K893-Y896 PolarHBondContact O-N 2.89Å; P894-Y896 VanDerWaalsContact C-N 3.34Å; P894-Y896 PolarHBondContact O-N 2.97Å; Y896-F898 VanDerWaalsContact C-N 3.31Å; Y896-F898 PolarHBondContact O-N 2.7Å; Y896-L899 PolarHBondContact O-N 3.5Å; Y896-L900 WeakPolarHBondContact O-CB 3.24Å; Y896-L900 PolarHBondContact O-N 3.1Å
897	D	85.8	Confident	80.7	Confident	54 Å²	54	46.7 Å²	46.7	29%	0.289	24%	0.242	S	C	.	.	H	α-helix	trans	-60.9	-40.7	175.1	-78.1	-27.4	0	0	0	111.7	Y875 H879 K893 P894 T901	Y875-D897 HydrophobicContact CD1-CB 4.27Å; H879-D897 IonicContact CD2-OD2 2.73Å; H879-D897 IonicContact CE1-OD2 3.55Å; H879-D897 IonicContact NE2-OD2 3.16Å; H879-D897 PolarHBondContact NE2-OD2 3.34Å; K893-D897 PolarHBondContact O-N 3.42Å; P894-D897 PolarHBondContact O-N 3.21Å; D897-T901 WeakPolarHBondContact O-CB 3.38Å; D897-T901 PolarHBondContact O-N 3.08Å; D897-T901 VanDerWaalsContact O-N 3.09Å; D897-T901 PolarHBondContact O-OG1 2.99Å
898	F	90.1	Very high	79.9	Confident	4 Å²	4	50 Å²	50	2%	0.018	26%	0.26	C	S	.	.	H	α-helix	trans	-63.5	-53.6	171.8	165.3	-106.2	0	0	0	111.8	W857 A861 L864 V867 Y875 P894 Y896 L900 T901 W902	W857-F898 HydrophobicContact CE3-CB 3.98Å; W857-F898 HydrophobicContact CE3-CD1 4.03Å; W857-F898 HydrophobicContact CE3-CG 4.1Å; W857-F898 HydrophobicContact CZ3-CB 3.6Å; W857-F898 HydrophobicContact CZ3-CD1 4.13Å; W857-F898 HydrophobicContact CZ3-CD2 4.41Å; W857-F898 AromaticContact CZ3-CG 3.75Å; W857-F898 HydrophobicContact CZ3-CG 3.75Å; A861-F898 HydrophobicContact CB-CD1 4.01Å; A861-F898 HydrophobicContact CB-CD2 4.38Å; A861-F898 HydrophobicContact CB-CE1 3.64Å; A861-F898 HydrophobicContact CB-CE2 4.06Å; A861-F898 HydrophobicContact CB-CG 4.38Å; A861-F898 HydrophobicContact CB-CZ 3.68Å; L864-F898 HydrophobicContact CB-CZ 4.4Å; L864-F898 HydrophobicContact CD1-CE1 4.23Å; V867-F898 HydrophobicContact CG2-CD2 4.46Å; V867-F898 HydrophobicContact CG2-CE2 3.69Å; V867-F898 HydrophobicContact CG2-CZ 4.24Å; Y875-F898 HydrophobicContact CD1-CB 4.19Å; Y875-F898 HydrophobicContact CD2-CB 4.34Å; Y875-F898 HydrophobicContact CD2-CD2 4.46Å; Y875-F898 HydrophobicContact CE1-CB 4.25Å; Y875-F898 HydrophobicContact CE2-CB 4.41Å; Y875-F898 AromaticContact CE2-CD2 3.93Å; Y875-F898 HydrophobicContact CE2-CD2 3.93Å; Y875-F898 HydrophobicContact CG-CB 4.25Å; P894-F898 WeakPolarHBondContact O-CB 3.46Å; P894-F898 PolarHBondContact O-N 3.14Å; Y896-F898 VanDerWaalsContact C-N 3.31Å; Y896-F898 PolarHBondContact O-N 2.7Å; F898-L900 VanDerWaalsContact C-N 3.31Å; F898-L900 PolarHBondContact O-N 3.11Å; F898-T901 PolarHBondContact O-N 3.34Å; F898-T901 VanDerWaalsContact O-N 3.15Å; F898-W902 HydrophobicContact CD2-CB 4.49Å; F898-W902 HydrophobicContact CE1-CB 4.46Å; F898-W902 HydrophobicContact CE2-CB 3.95Å; F898-W902 HydrophobicContact CE2-CG 4.5Å; F898-W902 HydrophobicContact CZ-CB 3.92Å; F898-W902 HydrophobicContact CZ-CG 4.07Å; F898-W902 VanDerWaalsContact O-CB 3.26Å; F898-W902 WeakPolarHBondContact O-CB 3.36Å; F898-W902 PolarHBondContact O-N 3.46Å
899	L	87.8	Confident	80.2	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-62.6	-37	-177.1	-78.3	173	0	0	0	112.4	L846 T849 A850 L860 L864 A895 Y896 W902 S903 L917	L846-L899 HydrophobicContact CD2-CB 4.11Å; T849-L899 HydrophobicContact CG2-CD1 3.85Å; A850-L899 HydrophobicContact CB-CD1 4.21Å; L860-L899 HydrophobicContact CD2-CD1 4.49Å; L860-L899 HydrophobicContact CD2-CD2 4.15Å; L864-L899 HydrophobicContact CD1-CD2 3.87Å; A895-L899 VanDerWaalsContact O-CB 3.28Å; A895-L899 WeakPolarHBondContact O-CB 3.43Å; A895-L899 VanDerWaalsContact O-CG 3.23Å; A895-L899 WeakPolarHBondContact O-CG 3.42Å; A895-L899 PolarHBondContact O-N 3.46Å; Y896-L899 PolarHBondContact O-N 3.5Å; L899-W902 HydrophobicContact CD2-CE3 3.98Å; L899-W902 HydrophobicContact CD2-CZ3 4.37Å; L899-S903 VanDerWaalsContact O-CB 3.3Å; L899-S903 WeakPolarHBondContact O-CB 3.17Å; L899-S903 PolarHBondContact O-N 3.26Å; L899-S903 PolarHBondContact O-OG 2.92Å; L899-L917 HydrophobicContact CD2-CD1 3.68Å
900	L	87.8	Confident	80.6	Confident	54 Å²	54	45.1 Å²	45.1	28%	0.283	23%	0.231	S	C	.	.	H	α-helix	trans	-62.3	-50.8	172.6	-174.4	65.9	0	0	0	110.4	Y896 F898 W902 S903 H904	Y896-L900 WeakPolarHBondContact O-CB 3.24Å; Y896-L900 PolarHBondContact O-N 3.1Å; F898-L900 VanDerWaalsContact C-N 3.31Å; F898-L900 PolarHBondContact O-N 3.11Å; L900-W902 PolarHBondContact O-N 3.21Å; L900-S903 PolarHBondContact O-N 2.82Å; L900-S903 PolarHBondContact O-OG 2.87Å; L900-H904 PolarHBondContact O-N 2.91Å; L900-H904 PolarHBondContact O-ND1 2.95Å
901	T	86.5	Confident	80.9	Confident	59 Å²	59	46.1 Å²	46.1	36%	0.362	23%	0.233	S	C	.	.	H	α-helix	trans	-61.7	-44.5	179.6	-54.6	0	0	0	0	111.9	Y875 D897 F898 H904	Y875-T901 WeakPolarHBondContact OH-CG2 3.46Å; D897-T901 WeakPolarHBondContact O-CB 3.38Å; D897-T901 PolarHBondContact O-N 3.08Å; D897-T901 VanDerWaalsContact O-N 3.09Å; D897-T901 PolarHBondContact O-OG1 2.99Å; F898-T901 PolarHBondContact O-N 3.34Å; F898-T901 VanDerWaalsContact O-N 3.15Å; T901-H904 PolarHBondContact O-N 3.32Å
902	W	88.9	Confident	81.1	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.015	25%	0.247	C	C	.	.	H	α-helix	trans	-62.4	-40.9	176.1	166.6	80.5	0	0	0	112.7	L846 L864 F898 L899 L900 H904 Q905 I906 V913 E916 L917	L846-W902 HydrophobicContact CD2-CZ3 4.34Å; L864-W902 HydrophobicContact CD1-CD2 4.02Å; L864-W902 HydrophobicContact CD1-CE3 4.32Å; L864-W902 HydrophobicContact CD1-CH2 4.28Å; L864-W902 HydrophobicContact CD1-CZ2 3.91Å; L864-W902 HydrophobicContact CD1-CZ3 4.46Å; L864-W902 HydrophobicContact CD2-CH2 4.23Å; L864-W902 HydrophobicContact CD2-CZ2 3.52Å; L864-W902 HydrophobicContact CG-CZ2 4.19Å; F898-W902 HydrophobicContact CD2-CB 4.49Å; F898-W902 HydrophobicContact CE1-CB 4.46Å; F898-W902 HydrophobicContact CE2-CB 3.95Å; F898-W902 HydrophobicContact CE2-CG 4.5Å; F898-W902 HydrophobicContact CZ-CB 3.92Å; F898-W902 HydrophobicContact CZ-CG 4.07Å; F898-W902 VanDerWaalsContact O-CB 3.26Å; F898-W902 WeakPolarHBondContact O-CB 3.36Å; F898-W902 PolarHBondContact O-N 3.46Å; L899-W902 HydrophobicContact CD2-CE3 3.98Å; L899-W902 HydrophobicContact CD2-CZ3 4.37Å; L900-W902 PolarHBondContact O-N 3.21Å; W902-H904 PolarHBondContact O-N 3.12Å; W902-Q905 WeakPolarHBondContact O-CB 3.47Å; W902-Q905 PolarHBondContact O-N 2.95Å; W902-I906 HydrophobicContact CH2-CD1 3.97Å; W902-I906 HydrophobicContact CZ2-CD1 3.18Å; W902-I906 HydrophobicContact CZ2-CG1 4.31Å; W902-I906 PolarHBondContact O-N 3.47Å; W902-V913 WeakPolarHBondContact CH2-O 3.46Å; W902-V913 HydrophobicContact CZ3-CG1 4.2Å; W902-E916 HydrophobicContact CZ2-CB 4.44Å; W902-L917 HydrophobicContact CH2-CB 3.66Å; W902-L917 HydrophobicContact CH2-CD1 4.02Å; W902-L917 HydrophobicContact CH2-CG 4.4Å; W902-L917 HydrophobicContact CZ3-CB 4.02Å; W902-L917 HydrophobicContact CZ3-CD1 3.88Å; W902-L917 HydrophobicContact CZ3-CG 4.38Å
903	S	86.2	Confident	81.4	Confident	3 Å²	3	46 Å²	46	2%	0.021	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-25.9	179.2	70.2	0	0	0	0	113.5	L899 L900 Q905	L899-S903 VanDerWaalsContact O-CB 3.3Å; L899-S903 WeakPolarHBondContact O-CB 3.17Å; L899-S903 PolarHBondContact O-N 3.26Å; L899-S903 PolarHBondContact O-OG 2.92Å; L900-S903 PolarHBondContact O-N 2.82Å; L900-S903 PolarHBondContact O-OG 2.87Å; S903-Q905 VanDerWaalsContact C-N 3.31Å
904	H	81.6	Confident	81.6	Confident	143 Å²	143	43.1 Å²	43.1	66%	0.662	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-12.7	173.2	-69.4	76.9	0	0	0	113.3	L900 T901 W902	L900-H904 PolarHBondContact O-N 2.91Å; L900-H904 PolarHBondContact O-ND1 2.95Å; T901-H904 PolarHBondContact O-N 3.32Å; W902-H904 PolarHBondContact O-N 3.12Å
905	Q	78.1	Confident	81.8	Confident	133 Å²	133	43.9 Å²	43.9	62%	0.621	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-22.9	-177.5	-68	175	-21.2	0	0	113.7	W902 S903 G907	W902-Q905 WeakPolarHBondContact O-CB 3.47Å; W902-Q905 PolarHBondContact O-N 2.95Å; S903-Q905 VanDerWaalsContact C-N 3.31Å; Q905-G907 PolarHBondContact O-N 2.81Å
906	I	66.2	Low	81.9	Confident	64 Å²	64	46 Å²	46	33%	0.328	24%	0.238	S	C	.	.	S	Bend	trans	-77.5	-9.5	178.3	-76.8	-168	0	0	0	113	W902 D912 V913 E916	W902-I906 HydrophobicContact CH2-CD1 3.97Å; W902-I906 HydrophobicContact CZ2-CD1 3.18Å; W902-I906 HydrophobicContact CZ2-CG1 4.31Å; W902-I906 PolarHBondContact O-N 3.47Å; I906-D912 HydrophobicContact CG2-CB 4.38Å; I906-V913 HydrophobicContact CB-CG2 4.35Å; I906-V913 HydrophobicContact CG2-CG2 4.12Å; I906-E916 HydrophobicContact CD1-CB 3.84Å; I906-E916 HydrophobicContact CD1-CG 4.42Å
907	G	55	Low	82	Confident	35 Å²	35	44.1 Å²	44.1	36%	0.361	23%	0.231	S	C	.	.			trans	104.6	172.6	179.1	0	0	0	0	0	112.6	Q905 S909	Q905-G907 PolarHBondContact O-N 2.81Å; G907-S909 PolarHBondContact O-N 2.9Å
908	D	57.9	Low	82.2	Confident	136 Å²	136	41.6 Å²	41.6	73%	0.727	22%	0.218	S	C	*	.	S	Bend	trans	-63.2	-1.6	-168.5	-61.7	-32.5	0	0	0	115.5	K627	K627-D908 HydrophobicContact CD-CB 4.46Å; K627-D908 WeakPolarHBondContact CD-O 3.33Å; K627-D908 WeakPolarHBondContact CE-O 3.49Å; K627-D908 HydrophobicContact CG-CB 4.32Å; K627-D908 WeakPolarHBondContact CG-O 3.49Å
909	S	75.9	Confident	82.1	Confident	25 Å²	25	41.9 Å²	41.9	18%	0.175	22%	0.219	C	C	.	.			trans	-98.4	102.7	-165	-163	0	0	0	0	113	K627 G907 R911 D912 V913	K627-S909 PolarHBondContact NZ-OG 3.45Å; G907-S909 PolarHBondContact O-N 2.9Å; S909-R911 PolarHBondContact O-N 2.95Å; S909-D912 WeakPolarHBondContact CB-OD2 3.17Å; S909-D912 PolarHBondContact O-N 3.25Å; S909-D912 PolarHBondContact OG-OD2 3.35Å; S909-V913 WeakPolarHBondContact O-CG2 3.39Å; S909-V913 PolarHBondContact O-N 3.33Å
910	Y	78.9	Confident	82.1	Confident	42 Å²	42	41.8 Å²	41.8	17%	0.165	22%	0.218	C	C	.	.	H	α-helix	trans	-55.1	-30.6	175.6	60.9	-88.9	0	0	0	114.1	K627 V838 I914 V942	K627-Y910 HydrophobicContact CD-CD1 4.1Å; K627-Y910 HydrophobicContact CD-CE1 4.15Å; V838-Y910 HydrophobicContact CB-CD2 4.46Å; V838-Y910 HydrophobicContact CG1-CD1 3.44Å; V838-Y910 VanDerWaalsContact CG1-CD1 3.44Å; V838-Y910 HydrophobicContact CG1-CD2 3.6Å; V838-Y910 HydrophobicContact CG1-CE1 3.88Å; V838-Y910 HydrophobicContact CG1-CE2 4.03Å; V838-Y910 HydrophobicContact CG1-CG 3.28Å; V838-Y910 HydrophobicContact CG2-CD2 4.04Å; V838-Y910 HydrophobicContact CG2-CE1 4.34Å; V838-Y910 HydrophobicContact CG2-CE2 3.7Å; V838-Y910 HydrophobicContact CG2-CG 4.49Å; Y910-I914 VanDerWaalsContact O-CG1 3.29Å; Y910-I914 WeakPolarHBondContact O-CG1 3.37Å; Y910-I914 PolarHBondContact O-N 2.74Å; Y910-V942 HydrophobicContact CD2-CG1 3.45Å; Y910-V942 VanDerWaalsContact CD2-CG1 3.45Å; Y910-V942 HydrophobicContact CE2-CG1 3.63Å
911	R	85.3	Confident	82.1	Confident	30 Å²	30	39.2 Å²	39.2	11%	0.113	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-52.3	171	-82.1	-178.2	-170.3	156.3	19.9	111	E689 S909 I914 Q915 V942 N943 D946	E689-R911 IonicContact OE1-NH1 2.58Å; E689-R911 PolarHBondContact OE1-NH1 2.99Å; E689-R911 IonicContact OE2-CZ 3.55Å; E689-R911 IonicContact OE2-NE 3.69Å; E689-R911 IonicContact OE2-NH1 3.5Å; E689-R911 PolarHBondContact OE2-NH1 3.26Å; S909-R911 PolarHBondContact O-N 2.95Å; R911-I914 PolarHBondContact O-N 3.34Å; R911-Q915 WeakPolarHBondContact O-CB 3.31Å; R911-Q915 PolarHBondContact O-N 3.16Å; R911-V942 HydrophobicContact CG-CG1 3.82Å; R911-V942 PolarHBondContact NE-O 3.02Å; R911-N943 WeakPolarHBondContact CD-OD1 3.27Å; R911-D946 IonicContact CZ-OD2 2.68Å; R911-D946 IonicContact NH1-OD2 3.77Å; R911-D946 IonicContact NH2-OD1 2.7Å; R911-D946 PolarHBondContact NH2-OD1 3.36Å; R911-D946 IonicContact NH2-OD2 2.77Å; R911-D946 PolarHBondContact NH2-OD2 3.27Å
912	D	85.8	Confident	82.1	Confident	73 Å²	73	37.2 Å²	37.2	39%	0.39	19%	0.192	S	C	.	.	H	α-helix	trans	-69.5	-37.9	-175.7	-58.3	-65.5	0	0	0	112.1	I906 S909 Q915 E916	I906-D912 HydrophobicContact CG2-CB 4.38Å; S909-D912 WeakPolarHBondContact CB-OD2 3.17Å; S909-D912 PolarHBondContact O-N 3.25Å; S909-D912 PolarHBondContact OG-OD2 3.35Å; D912-Q915 PolarHBondContact O-N 3.15Å; D912-E916 PolarHBondContact O-N 3.12Å
913	V	88	Confident	82	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.012	21%	0.208	C	C	.	.	H	α-helix	trans	-56.7	-51.2	171.2	170.4	0	0	0	0	111.1	W902 I906 S909 L917	W902-V913 WeakPolarHBondContact CH2-O 3.46Å; W902-V913 HydrophobicContact CZ3-CG1 4.2Å; I906-V913 HydrophobicContact CB-CG2 4.35Å; I906-V913 HydrophobicContact CG2-CG2 4.12Å; S909-V913 WeakPolarHBondContact O-CG2 3.39Å; S909-V913 PolarHBondContact O-N 3.33Å; V913-L917 WeakPolarHBondContact O-CB 3.41Å; V913-L917 PolarHBondContact O-N 2.98Å
914	I	88.6	Confident	82	Confident	2 Å²	2	41 Å²	41	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-72.3	-32.2	-178.2	-61.9	170.9	0	0	0	110.9	I841 V845 Y910 R911 H918 L935 L939 V942	I841-I914 HydrophobicContact CG2-CD1 4.46Å; V845-I914 HydrophobicContact CG1-CG1 4.43Å; Y910-I914 VanDerWaalsContact O-CG1 3.29Å; Y910-I914 WeakPolarHBondContact O-CG1 3.37Å; Y910-I914 PolarHBondContact O-N 2.74Å; R911-I914 PolarHBondContact O-N 3.34Å; I914-H918 WeakPolarHBondContact O-CB 3.49Å; I914-H918 PolarHBondContact O-N 3.43Å; I914-L935 HydrophobicContact CG2-CD1 4.27Å; I914-L939 HydrophobicContact CB-CD2 4.25Å; I914-L939 HydrophobicContact CG2-CD2 3.7Å; I914-L939 HydrophobicContact CG2-CG 4.01Å; I914-V942 HydrophobicContact CD1-CG1 4.43Å; I914-V942 HydrophobicContact CD1-CG2 3.94Å
915	Q	89.3	Confident	81.9	Confident	15 Å²	15	42.9 Å²	42.9	7%	0.07	22%	0.215	C	C	.	.	H	α-helix	trans	-68.8	-47.1	177.1	175.2	60.5	103.3	0	0	112.5	R692 R911 D912 H918 L919 L939	R692-Q915 PolarHBondContact O-NE2 3.45Å; R692-Q915 PolarHBondContact O-OE1 3.33Å; R911-Q915 WeakPolarHBondContact O-CB 3.31Å; R911-Q915 PolarHBondContact O-N 3.16Å; D912-Q915 PolarHBondContact O-N 3.15Å; Q915-H918 PolarHBondContact O-N 3.46Å; Q915-L919 HydrophobicContact CG-CD1 4.41Å; Q915-L919 WeakPolarHBondContact O-CG 3.48Å; Q915-L919 PolarHBondContact O-N 3Å; Q915-L939 HydrophobicContact CB-CD2 4.22Å
916	E	89.3	Confident	81.9	Confident	46 Å²	46	42.1 Å²	42.1	22%	0.215	22%	0.215	C	C	.	.	H	α-helix	trans	-74.8	-26.5	176.3	-70.2	-58.5	145.8	0	0	112.1	R692 L864 W902 I906 D912 L919 G920 K923	R692-E916 IonicContact CZ-OE1 3.92Å; R692-E916 IonicContact NH1-OE1 3Å; R692-E916 PolarHBondContact NH1-OE1 2.83Å; R692-E916 IonicContact NH2-OE1 2.77Å; R692-E916 PolarHBondContact NH2-OE1 3.19Å; L864-E916 WeakPolarHBondContact CD2-O 3.45Å; W902-E916 HydrophobicContact CZ2-CB 4.44Å; I906-E916 HydrophobicContact CD1-CB 3.84Å; I906-E916 HydrophobicContact CD1-CG 4.42Å; D912-E916 PolarHBondContact O-N 3.12Å; E916-L919 PolarHBondContact O-N 3.25Å; E916-L919 WeakPolarHBondContact OE1-CD1 3.36Å; E916-G920 PolarHBondContact O-N 3.01Å; E916-K923 IonicContact OE2-NZ 3.76Å
917	L	90.1	Very high	82.3	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.7	-46.2	169.5	-173.6	57.1	0	0	0	111.4	V845 L846 T849 L864 L899 W902 V913 G920 L921	V845-L917 HydrophobicContact CG1-CD2 3.67Å; L846-L917 HydrophobicContact CD2-CD2 4.1Å; T849-L917 HydrophobicContact CG2-CD1 4.13Å; T849-L917 HydrophobicContact CG2-CD2 4.42Å; T849-L917 HydrophobicContact CG2-CG 4.49Å; L864-L917 HydrophobicContact CD1-CD1 3.92Å; L899-L917 HydrophobicContact CD2-CD1 3.68Å; W902-L917 HydrophobicContact CH2-CB 3.66Å; W902-L917 HydrophobicContact CH2-CD1 4.02Å; W902-L917 HydrophobicContact CH2-CG 4.4Å; W902-L917 HydrophobicContact CZ3-CB 4.02Å; W902-L917 HydrophobicContact CZ3-CD1 3.88Å; W902-L917 HydrophobicContact CZ3-CG 4.38Å; V913-L917 WeakPolarHBondContact O-CB 3.41Å; V913-L917 PolarHBondContact O-N 2.98Å; L917-G920 PolarHBondContact O-N 2.71Å; L917-L921 HydrophobicContact CG-CD1 4.21Å; L917-L921 WeakPolarHBondContact O-CG 3.36Å; L917-L921 PolarHBondContact O-N 2.99Å
918	H	89.8	Confident	83.3	Confident	2 Å²	2	39 Å²	39	1%	0.009	19%	0.192	C	C	.	.	H	α-helix	trans	-59.5	-49	175.1	-173.1	-64.6	0	0	0	111	I914 Q915 G920 L921 D922 L935 T936 L939	I914-H918 WeakPolarHBondContact O-CB 3.49Å; I914-H918 PolarHBondContact O-N 3.43Å; Q915-H918 PolarHBondContact O-N 3.46Å; H918-G920 PolarHBondContact O-N 2.93Å; H918-L921 PolarHBondContact O-N 3.43Å; H918-D922 IonicContact CE1-OD2 3.26Å; H918-D922 PolarHBondContact CE1-OD2 3.23Å; H918-D922 IonicContact ND1-OD2 3.74Å; H918-D922 WeakPolarHBondContact O-CB 3.43Å; H918-D922 PolarHBondContact O-N 2.93Å; H918-L935 HydrophobicContact CB-CD2 4.03Å; H918-T936 PolarHBondContact NE2-OG1 3.01Å; H918-L939 HydrophobicContact CB-CD1 3.86Å; H918-L939 VanDerWaalsContact CD2-CD1 3.45Å; H918-L939 WeakPolarHBondContact CD2-CD1 3.38Å
919	L	88.4	Confident	84	Confident	9 Å²	9	33 Å²	33	5%	0.047	16%	0.16	C	C	.	.	H	α-helix	trans	-63	-29.1	175.5	-68.6	169.4	0	0	0	112.8	R692 T699 Q915 E916 K923	R692-L919 HydrophobicContact CB-CD1 4.31Å; T699-L919 HydrophobicContact CG2-CD2 4.16Å; Q915-L919 HydrophobicContact CG-CD1 4.41Å; Q915-L919 WeakPolarHBondContact O-CG 3.48Å; Q915-L919 PolarHBondContact O-N 3Å; E916-L919 PolarHBondContact O-N 3.25Å; E916-L919 WeakPolarHBondContact OE1-CD1 3.36Å; L919-K923 VanDerWaalsContact O-CD 3.26Å; L919-K923 WeakPolarHBondContact O-CD 3.47Å; L919-K923 WeakPolarHBondContact O-CE 3.44Å; L919-K923 WeakPolarHBondContact O-CG 3.34Å; L919-K923 PolarHBondContact O-N 3.41Å; L919-K923 VanDerWaalsContact O-N 3.15Å
920	G	87.7	Confident	83.7	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.2	-49.1	171.7	0	0	0	0	0	113.5	E916 L917 H918 D922 K923	E916-G920 PolarHBondContact O-N 3.01Å; L917-G920 PolarHBondContact O-N 2.71Å; H918-G920 PolarHBondContact O-N 2.93Å; G920-D922 VanDerWaalsContact C-N 3.28Å; G920-D922 PolarHBondContact O-N 2.91Å; G920-K923 WeakPolarHBondContact O-CA 3.21Å; G920-K923 WeakPolarHBondContact O-CB 3.42Å; G920-K923 PolarHBondContact O-N 3Å
921	L	87.9	Confident	83.2	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-65.1	-33.9	176.4	-67.3	160.9	0	0	0	111.5	T849 V853 L860 L917 H918 K923 M924 P927 I928 T929 W932 L935	T849-L921 HydrophobicContact CG2-CD1 3.87Å; T849-L921 HydrophobicContact CG2-CD2 3.91Å; T849-L921 HydrophobicContact CG2-CG 4.34Å; V853-L921 HydrophobicContact CG2-CD2 3.67Å; L860-L921 HydrophobicContact CD1-CD2 3.9Å; L860-L921 HydrophobicContact CD1-CG 4.08Å; L860-L921 HydrophobicContact CD2-CD2 3.87Å; L917-L921 HydrophobicContact CG-CD1 4.21Å; L917-L921 WeakPolarHBondContact O-CG 3.36Å; L917-L921 PolarHBondContact O-N 2.99Å; H918-L921 PolarHBondContact O-N 3.43Å; L921-K923 VanDerWaalsContact C-N 3.28Å; L921-K923 PolarHBondContact O-N 3.09Å; L921-M924 HydrophobicContact CD2-SD 3.93Å; L921-M924 PolarHBondContact O-N 3.43Å; L921-P927 VanDerWaalsContact O-CA 3.32Å; L921-P927 WeakPolarHBondContact O-CA 3.48Å; L921-P927 WeakPolarHBondContact O-CB 3.18Å; L921-I928 HydrophobicContact CD2-CB 4.49Å; L921-I928 HydrophobicContact CD2-CD1 4.28Å; L921-T929 HydrophobicContact CB-CG2 3.8Å; L921-W932 HydrophobicContact CD1-CZ3 4.5Å; L921-L935 HydrophobicContact CD1-CD2 3.4Å; L921-L935 VanDerWaalsContact CD1-CD2 3.4Å
922	D	86.1	Confident	82.6	Confident	17 Å²	17	47.3 Å²	47.3	9%	0.091	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-13.7	169.7	-90.8	1	0	0	0	114	R694 H918 G920 T929	R694-D922 HydrophobicContact CB-CB 3.57Å; R694-D922 WeakPolarHBondContact CB-OD2 3.32Å; R694-D922 VanDerWaalsContact CD-O 3.25Å; R694-D922 WeakPolarHBondContact CD-O 3.29Å; R694-D922 HydrophobicContact CG-CB 4.5Å; R694-D922 PolarHBondContact N-OD2 3.07Å; R694-D922 PolarHBondContact NH1-O 2.93Å; H918-D922 IonicContact CE1-OD2 3.26Å; H918-D922 PolarHBondContact CE1-OD2 3.23Å; H918-D922 IonicContact ND1-OD2 3.74Å; H918-D922 WeakPolarHBondContact O-CB 3.43Å; H918-D922 PolarHBondContact O-N 2.93Å; G920-D922 VanDerWaalsContact C-N 3.28Å; G920-D922 PolarHBondContact O-N 2.91Å; D922-T929 WeakPolarHBondContact OD1-CB 3.49Å; D922-T929 WeakPolarHBondContact OD1-CG2 3.45Å; D922-T929 PolarHBondContact OD1-OG1 2.97Å
923	K	85.8	Confident	82.4	Confident	80 Å²	80	46.1 Å²	46.1	35%	0.348	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-12.9	174.1	-74	157.5	-162.9	163.7	0	113.4	K863 E916 L919 G920 L921	K863-K923 HydrophobicContact CB-CB 3.77Å; K863-K923 HydrophobicContact CG-CB 4Å; E916-K923 IonicContact OE2-NZ 3.76Å; L919-K923 VanDerWaalsContact O-CD 3.26Å; L919-K923 WeakPolarHBondContact O-CD 3.47Å; L919-K923 WeakPolarHBondContact O-CE 3.44Å; L919-K923 WeakPolarHBondContact O-CG 3.34Å; L919-K923 PolarHBondContact O-N 3.41Å; L919-K923 VanDerWaalsContact O-N 3.15Å; G920-K923 WeakPolarHBondContact O-CA 3.21Å; G920-K923 WeakPolarHBondContact O-CB 3.42Å; G920-K923 PolarHBondContact O-N 3Å; L921-K923 VanDerWaalsContact C-N 3.28Å; L921-K923 PolarHBondContact O-N 3.09Å
924	M	86.1	Confident	82.1	Confident	6 Å²	6	47.7 Å²	47.7	3%	0.03	21%	0.213	C	C	.	.	S	Bend	trans	-70.5	150.6	177.6	-56.1	-179.6	89	0	0	112	V853 R856 E859 L860 L921 N926 I928	V853-M924 HydrophobicContact CG1-CE 4.29Å; R856-M924 HydrophobicContact CB-CE 3.95Å; R856-M924 WeakPolarHBondContact O-CE 3.39Å; E859-M924 HydrophobicContact CB-CE 3.9Å; E859-M924 HydrophobicContact CG-CB 4.45Å; E859-M924 HydrophobicContact CG-CE 3.94Å; E859-M924 HydrophobicContact CG-CG 4.38Å; E859-M924 WeakPolarHBondContact OE2-CE 3.41Å; L860-M924 HydrophobicContact CB-CE 3.93Å; L860-M924 HydrophobicContact CB-SD 4.25Å; L860-M924 HydrophobicContact CD1-CG 4.37Å; L860-M924 HydrophobicContact CD1-SD 4.14Å; L921-M924 HydrophobicContact CD2-SD 3.93Å; L921-M924 PolarHBondContact O-N 3.43Å; M924-N926 VanDerWaalsContact C-N 3.28Å; M924-N926 PolarHBondContact O-N 3.42Å; M924-I928 HydrophobicContact SD-CD1 4.13Å
925	K	79.8	Confident	82	Confident	182 Å²	182	47.6 Å²	47.6	79%	0.791	21%	0.212	S	C	*	.	S	Bend	trans	-55.7	-42.8	179.2	-66.4	176.5	179.5	179.1	0	112	E859	E859-K925 WeakPolarHBondContact OE1-CB 3.35Å; E859-K925 WeakPolarHBondContact OE1-CG 3.31Å; E859-K925 PolarHBondContact OE1-N 3.11Å
926	N	77.7	Confident	81.9	Confident	118 Å²	118	47.3 Å²	47.3	63%	0.631	21%	0.212	S	C	*	.	S	Bend	trans	-115	93.3	169.5	-80.4	-50.8	0	0	0	109	R856 M924 I928	R856-N926 PolarHBondContact NH1-O 3.44Å; R856-N926 PolarHBondContact NH2-O 2.81Å; M924-N926 VanDerWaalsContact C-N 3.28Å; M924-N926 PolarHBondContact O-N 3.42Å; N926-I928 PolarHBondContact O-N 2.8Å
927	P	75.3	Confident	81.9	Confident	20 Å²	20	45.1 Å²	45.1	13%	0.13	20%	0.201	C	C	.	.			trans	-73.5	124.1	-172.2	28.5	-35	0	0	0	111.6	L921 T929 K930	L921-P927 VanDerWaalsContact O-CA 3.32Å; L921-P927 WeakPolarHBondContact O-CA 3.48Å; L921-P927 WeakPolarHBondContact O-CB 3.18Å; P927-T929 VanDerWaalsContact C-N 3.28Å; P927-T929 PolarHBondContact O-N 2.82Å; P927-K930 HydrophobicContact CG-CD 3.85Å; P927-K930 HydrophobicContact CG-CG 4.12Å; P927-K930 PolarHBondContact O-N 2.88Å
928	I	76.1	Confident	81.9	Confident	13 Å²	13	45.1 Å²	45.1	7%	0.067	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-68.8	-29.1	-173.3	-69.1	162.6	0	0	0	111.4	E852 V853 L921 M924 N926 K930 R931 W932	E852-I928 HydrophobicContact CB-CG2 4.28Å; V853-I928 HydrophobicContact CB-CD1 4.21Å; V853-I928 HydrophobicContact CG2-CD1 3.51Å; L921-I928 HydrophobicContact CD2-CB 4.49Å; L921-I928 HydrophobicContact CD2-CD1 4.28Å; M924-I928 HydrophobicContact SD-CD1 4.13Å; N926-I928 PolarHBondContact O-N 2.8Å; I928-K930 PolarHBondContact O-N 3.37Å; I928-R931 WeakPolarHBondContact O-CA 3.46Å; I928-R931 PolarHBondContact O-N 2.87Å; I928-W932 HydrophobicContact CG2-CB 4.06Å; I928-W932 PolarHBondContact O-N 2.86Å
929	T	71.8	Confident	81.9	Confident	11 Å²	11	45.1 Å²	45.1	7%	0.067	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-49.2	-31	173.5	54.3	0	0	0	0	114.4	L921 D922 P927 R931 L935	L921-T929 HydrophobicContact CB-CG2 3.8Å; D922-T929 WeakPolarHBondContact OD1-CB 3.49Å; D922-T929 WeakPolarHBondContact OD1-CG2 3.45Å; D922-T929 PolarHBondContact OD1-OG1 2.97Å; P927-T929 VanDerWaalsContact C-N 3.28Å; P927-T929 PolarHBondContact O-N 2.82Å; T929-R931 VanDerWaalsContact C-N 3.29Å; T929-R931 PolarHBondContact O-N 2.89Å; T929-L935 HydrophobicContact CG2-CD2 4.42Å
930	K	70.3	Confident	82	Confident	158 Å²	158	44.9 Å²	44.9	69%	0.687	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-67	-28.9	175.6	-68.8	-177.8	-178.2	172.9	0	113	P927 I928	P927-K930 HydrophobicContact CG-CD 3.85Å; P927-K930 HydrophobicContact CG-CG 4.12Å; P927-K930 PolarHBondContact O-N 2.88Å; I928-K930 PolarHBondContact O-N 3.37Å
931	R	67.9	Low	82.2	Confident	225 Å²	225	44.9 Å²	44.9	85%	0.849	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95	-54.9	177.2	-62.3	-179.3	178.1	-176.1	-1.5	110.1	I928 T929 K933	I928-R931 WeakPolarHBondContact O-CA 3.46Å; I928-R931 PolarHBondContact O-N 2.87Å; T929-R931 VanDerWaalsContact C-N 3.29Å; T929-R931 PolarHBondContact O-N 2.89Å; R931-K933 VanDerWaalsContact C-N 3.31Å; R931-K933 PolarHBondContact O-N 3.18Å
932	W	72.9	Confident	82.3	Confident	13 Å²	13	44.9 Å²	44.9	5%	0.049	20%	0.2	C	C	.	.			trans	-83.8	70.8	179	-172.2	52.6	0	0	0	111.2	F750 L751 T848 T849 L921 I928 H934 L935	F750-W932 PolarHBondContact O-NE1 2.81Å; L751-W932 HydrophobicContact CD2-CZ2 3.79Å; T848-W932 HydrophobicContact CG2-CH2 3.99Å; T848-W932 HydrophobicContact CG2-CZ2 3.32Å; T849-W932 WeakPolarHBondContact OG1-CZ3 3.29Å; L921-W932 HydrophobicContact CD1-CZ3 4.5Å; I928-W932 HydrophobicContact CG2-CB 4.06Å; I928-W932 PolarHBondContact O-N 2.86Å; W932-H934 PolarHBondContact O-N 2.98Å; W932-L935 HydrophobicContact CD2-CB 4.24Å; W932-L935 HydrophobicContact CE3-CB 3.8Å; W932-L935 HydrophobicContact CE3-CD2 4.31Å; W932-L935 HydrophobicContact CH2-CB 4.16Å; W932-L935 HydrophobicContact CH2-CD1 3.89Å; W932-L935 HydrophobicContact CH2-CG 4.47Å; W932-L935 HydrophobicContact CZ3-CB 3.77Å; W932-L935 HydrophobicContact CZ3-CD1 3.9Å; W932-L935 HydrophobicContact CZ3-CD2 3.92Å; W932-L935 HydrophobicContact CZ3-CG 4.07Å; W932-L935 PolarHBondContact O-N 2.86Å
933	K	80.8	Confident	82.4	Confident	48 Å²	48	44.9 Å²	44.9	21%	0.209	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-19.2	179.2	-70	172.7	172.3	174.5	0	113.3	N669 K670 N671 Y673 R931 L935 T936	N669-K933 PolarHBondContact OD1-NZ 3.5Å; K670-K933 PolarHBondContact O-NZ 3.38Å; N671-K933 HydrophobicContact CB-CD 4.34Å; Y673-K933 HydrophobicContact CD2-CB 4.28Å; Y673-K933 WeakPolarHBondContact CD2-O 3.32Å; Y673-K933 HydrophobicContact CE2-CB 4.46Å; Y673-K933 WeakPolarHBondContact CE2-O 3.29Å; R931-K933 VanDerWaalsContact C-N 3.31Å; R931-K933 PolarHBondContact O-N 3.18Å; K933-L935 PolarHBondContact O-N 2.83Å; K933-T936 WeakPolarHBondContact O-CB 3.47Å; K933-T936 PolarHBondContact O-N 3.16Å
934	H	82.8	Confident	82.6	Confident	35 Å²	35	41 Å²	41	16%	0.162	18%	0.184	C	C	.	.	H	α-helix	trans	-74.6	-20.5	-172.6	-56.2	-69.7	0	0	0	114.6	Y673 P747 F750 W932 T936 G937 T938	Y673-H934 AromaticContact CE2-ND1 3.58Å; Y673-H934 AromaticContact CZ-ND1 3.73Å; Y673-H934 PolarHBondContact OH-ND1 2.85Å; P747-H934 HydrophobicContact CB-CB 4.41Å; F750-H934 HydrophobicContact CB-CB 4.04Å; F750-H934 AromaticContact CD1-NE2 3.71Å; F750-H934 AromaticContact CD2-CD2 3.96Å; F750-H934 AromaticContact CD2-CE1 3.3Å; F750-H934 WeakPolarHBondContact CD2-CE1 3.42Å; F750-H934 AromaticContact CD2-CG 3.71Å; F750-H934 AromaticContact CD2-ND1 3.29Å; F750-H934 VanDerWaalsContact CD2-ND1 3.29Å; F750-H934 WeakPolarHBondContact CD2-ND1 3.48Å; F750-H934 AromaticContact CD2-NE2 3.76Å; F750-H934 AromaticContact CE1-NE2 3.96Å; F750-H934 AromaticContact CE2-CE1 3.37Å; F750-H934 WeakPolarHBondContact CE2-CE1 3.45Å; F750-H934 AromaticContact CE2-ND1 3.74Å; F750-H934 AromaticContact CG-CD2 3.59Å; F750-H934 AromaticContact CG-CE1 3.66Å; F750-H934 AromaticContact CG-CG 3.72Å; F750-H934 AromaticContact CG-ND1 3.76Å; F750-H934 AromaticContact CG-NE2 3.6Å; F750-H934 AromaticContact CZ-CE1 3.78Å; W932-H934 PolarHBondContact O-N 2.98Å; H934-T936 VanDerWaalsContact C-N 3.31Å; H934-T936 PolarHBondContact O-N 2.86Å; H934-G937 CarbonylContact O-C 3.5Å; H934-G937 WeakPolarHBondContact O-CA 3.49Å; H934-G937 PolarHBondContact O-N 3.15Å; H934-G937 VanDerWaalsContact O-N 3.07Å; H934-T938 PolarHBondContact O-N 2.58Å; H934-T938 PolarHBondContact O-OG1 3.16Å
935	L	85.6	Confident	82.7	Confident	0 Å²	0	41 Å²	41	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.4	-40.9	171.1	-173.8	63.6	0	0	0	111.4	V845 I914 H918 L921 T929 W932 K933 G937 T938 L939	V845-L935 HydrophobicContact CG1-CD1 3.61Å; V845-L935 HydrophobicContact CG2-CD1 4.3Å; I914-L935 HydrophobicContact CG2-CD1 4.27Å; H918-L935 HydrophobicContact CB-CD2 4.03Å; L921-L935 HydrophobicContact CD1-CD2 3.4Å; L921-L935 VanDerWaalsContact CD1-CD2 3.4Å; T929-L935 HydrophobicContact CG2-CD2 4.42Å; W932-L935 HydrophobicContact CD2-CB 4.24Å; W932-L935 HydrophobicContact CE3-CB 3.8Å; W932-L935 HydrophobicContact CE3-CD2 4.31Å; W932-L935 HydrophobicContact CH2-CB 4.16Å; W932-L935 HydrophobicContact CH2-CD1 3.89Å; W932-L935 HydrophobicContact CH2-CG 4.47Å; W932-L935 HydrophobicContact CZ3-CB 3.77Å; W932-L935 HydrophobicContact CZ3-CD1 3.9Å; W932-L935 HydrophobicContact CZ3-CD2 3.92Å; W932-L935 HydrophobicContact CZ3-CG 4.07Å; W932-L935 PolarHBondContact O-N 2.86Å; K933-L935 PolarHBondContact O-N 2.83Å; L935-G937 VanDerWaalsContact C-N 3.27Å; L935-G937 PolarHBondContact O-N 3.35Å; L935-T938 WeakPolarHBondContact O-CB 3.38Å; L935-T938 PolarHBondContact O-N 3Å; L935-L939 PolarHBondContact O-N 3Å
936	T	88.1	Confident	83.1	Confident	9 Å²	9	36.2 Å²	36.2	6%	0.055	17%	0.167	C	C	.	.	H	α-helix	trans	-62.2	-35.5	171.5	-55.3	0	0	0	0	111.9	L693 L713 H918 K933 H934 T938 L939 I940	L693-T936 HydrophobicContact CD2-CG2 3.86Å; L713-T936 HydrophobicContact CD1-CG2 3.47Å; L713-T936 VanDerWaalsContact CD1-CG2 3.47Å; H918-T936 PolarHBondContact NE2-OG1 3.01Å; K933-T936 WeakPolarHBondContact O-CB 3.47Å; K933-T936 PolarHBondContact O-N 3.16Å; H934-T936 VanDerWaalsContact C-N 3.31Å; H934-T936 PolarHBondContact O-N 2.86Å; T936-T938 VanDerWaalsContact C-N 3.32Å; T936-L939 PolarHBondContact O-N 3.48Å; T936-I940 WeakPolarHBondContact O-CG1 3.48Å; T936-I940 PolarHBondContact O-N 2.88Å; T936-I940 VanDerWaalsContact O-N 3.14Å
937	G	89.1	Confident	83.5	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.8	-37.6	170.2	0	0	0	0	0	113.1	H934 L935 I940 L941	H934-G937 CarbonylContact O-C 3.5Å; H934-G937 WeakPolarHBondContact O-CA 3.49Å; H934-G937 PolarHBondContact O-N 3.15Å; H934-G937 VanDerWaalsContact O-N 3.07Å; L935-G937 VanDerWaalsContact C-N 3.27Å; L935-G937 PolarHBondContact O-N 3.35Å; G937-I940 WeakPolarHBondContact O-CB 3.33Å; G937-I940 PolarHBondContact O-N 2.86Å; G937-L941 PolarHBondContact O-N 3.16Å
938	T	90.4	Very high	84.1	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.006	14%	0.136	C	C	.	.	H	α-helix	trans	-71.6	-37.2	178.9	-47.5	0	0	0	0	111.5	P747 I841 V845 H934 L935 T936 I940 L941 V942	P747-T938 WeakPolarHBondContact CB-OG1 3.48Å; I841-T938 HydrophobicContact CG2-CG2 3.37Å; V845-T938 HydrophobicContact CG2-CG2 3.59Å; H934-T938 PolarHBondContact O-N 2.58Å; H934-T938 PolarHBondContact O-OG1 3.16Å; L935-T938 WeakPolarHBondContact O-CB 3.38Å; L935-T938 PolarHBondContact O-N 3Å; T936-T938 VanDerWaalsContact C-N 3.32Å; T938-I940 VanDerWaalsContact C-N 3.3Å; T938-I940 PolarHBondContact O-N 3.29Å; T938-L941 PolarHBondContact O-N 2.89Å; T938-V942 HydrophobicContact CG2-CG2 4.1Å; T938-V942 VanDerWaalsContact O-CB 3.31Å; T938-V942 WeakPolarHBondContact O-CB 3.28Å; T938-V942 WeakPolarHBondContact O-CG2 3.39Å; T938-V942 PolarHBondContact O-N 2.73Å
939	L	89.2	Confident	84.6	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-56.3	-44.5	167.5	-78.7	172.3	0	0	0	111.7	V691 I914 Q915 H918 L935 T936 V942 N943	V691-L939 HydrophobicContact CG1-CB 4.33Å; V691-L939 HydrophobicContact CG1-CD1 3.89Å; I914-L939 HydrophobicContact CB-CD2 4.25Å; I914-L939 HydrophobicContact CG2-CD2 3.7Å; I914-L939 HydrophobicContact CG2-CG 4.01Å; Q915-L939 HydrophobicContact CB-CD2 4.22Å; H918-L939 HydrophobicContact CB-CD1 3.86Å; H918-L939 VanDerWaalsContact CD2-CD1 3.45Å; H918-L939 WeakPolarHBondContact CD2-CD1 3.38Å; L935-L939 PolarHBondContact O-N 3Å; T936-L939 PolarHBondContact O-N 3.48Å; L939-V942 PolarHBondContact O-N 2.67Å; L939-N943 WeakPolarHBondContact O-CB 3.25Å; L939-N943 PolarHBondContact O-N 2.8Å; L939-N943 VanDerWaalsContact O-N 3.13Å; L939-N943 PolarHBondContact O-ND2 2.87Å
940	I	91.1	Very high	85.3	Confident	5 Å²	5	38.6 Å²	38.6	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-59.3	-49.6	175.6	-69.5	158.9	0	0	0	110.9	Y673 I704 V711 L713 I744 T936 G937 T938 V942 N943 S944	Y673-I940 HydrophobicContact CD1-CD1 3.89Å; Y673-I940 HydrophobicContact CG-CD1 4.23Å; I704-I940 HydrophobicContact CG1-CG1 4.4Å; I704-I940 HydrophobicContact CG2-CG2 4.07Å; V711-I940 HydrophobicContact CG1-CG2 3.66Å; L713-I940 HydrophobicContact CD2-CG1 4.23Å; L713-I940 HydrophobicContact CG-CD1 4.2Å; L713-I940 HydrophobicContact CG-CG1 4.25Å; I744-I940 HydrophobicContact CG2-CG2 4.37Å; T936-I940 WeakPolarHBondContact O-CG1 3.48Å; T936-I940 PolarHBondContact O-N 2.88Å; T936-I940 VanDerWaalsContact O-N 3.14Å; G937-I940 WeakPolarHBondContact O-CB 3.33Å; G937-I940 PolarHBondContact O-N 2.86Å; T938-I940 VanDerWaalsContact C-N 3.3Å; T938-I940 PolarHBondContact O-N 3.29Å; I940-V942 PolarHBondContact O-N 3.26Å; I940-N943 PolarHBondContact O-N 3.29Å; I940-S944 VanDerWaalsContact O-CB 3.29Å; I940-S944 WeakPolarHBondContact O-CB 3.47Å; I940-S944 PolarHBondContact O-N 3.14Å; I940-S944 VanDerWaalsContact O-N 3.1Å; I940-S944 PolarHBondContact O-OG 2.9Å
941	L	91.1	Very high	86	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-55.3	-52.3	177.6	175.1	145.8	0	0	0	111.7	I744 L745 I841 G937 T938 N943 S944 L945	I744-L941 HydrophobicContact CB-CB 4.2Å; I744-L941 HydrophobicContact CB-CG 4.46Å; I744-L941 HydrophobicContact CD1-CG 4.37Å; I744-L941 HydrophobicContact CG1-CD1 4.41Å; I744-L941 HydrophobicContact CG1-CG 4.47Å; I744-L941 VanDerWaalsContact O-CD1 3.3Å; I744-L941 WeakPolarHBondContact O-CD1 3.5Å; L745-L941 HydrophobicContact CD2-CD1 3.86Å; I841-L941 HydrophobicContact CD1-CD2 4.43Å; I841-L941 HydrophobicContact CG1-CD2 4.16Å; I841-L941 HydrophobicContact CG2-CD2 4.33Å; G937-L941 PolarHBondContact O-N 3.16Å; T938-L941 PolarHBondContact O-N 2.89Å; L941-N943 VanDerWaalsContact C-N 3.28Å; L941-N943 PolarHBondContact O-N 2.81Å; L941-S944 PolarHBondContact O-N 3.37Å; L941-L945 HydrophobicContact CD2-CD2 4.02Å; L941-L945 HydrophobicContact CD2-CG 4.46Å; L941-L945 HydrophobicContact CG-CD2 4.14Å; L941-L945 WeakPolarHBondContact O-CD2 3.45Å; L941-L945 WeakPolarHBondContact O-CG 3.24Å; L941-L945 PolarHBondContact O-N 3.44Å
942	V	89.8	Confident	86.8	Confident	1 Å²	1	20.6 Å²	20.6	1%	0.006	11%	0.105	C	C	.	.	H	α-helix	trans	-67.5	-26.6	-171.3	170	0	0	0	0	113.1	I841 Y910 R911 I914 T938 L939 I940	I841-V942 HydrophobicContact CG2-CG2 3.82Å; Y910-V942 HydrophobicContact CD2-CG1 3.45Å; Y910-V942 VanDerWaalsContact CD2-CG1 3.45Å; Y910-V942 HydrophobicContact CE2-CG1 3.63Å; R911-V942 HydrophobicContact CG-CG1 3.82Å; R911-V942 PolarHBondContact NE-O 3.02Å; I914-V942 HydrophobicContact CD1-CG1 4.43Å; I914-V942 HydrophobicContact CD1-CG2 3.94Å; T938-V942 HydrophobicContact CG2-CG2 4.1Å; T938-V942 VanDerWaalsContact O-CB 3.31Å; T938-V942 WeakPolarHBondContact O-CB 3.28Å; T938-V942 WeakPolarHBondContact O-CG2 3.39Å; T938-V942 PolarHBondContact O-N 2.73Å; L939-V942 PolarHBondContact O-N 2.67Å; I940-V942 PolarHBondContact O-N 3.26Å
943	N	88.9	Confident	87.4	Confident	16 Å²	16	21.9 Å²	21.9	9%	0.086	11%	0.111	C	C	.	.	H	α-helix	trans	-94.2	-1.8	173.6	-67.9	-90.7	0	0	0	113	E689 I704 R911 L939 I940 L941	E689-N943 PolarHBondContact OE2-OD1 3.31Å; I704-N943 HydrophobicContact CD1-CB 3.43Å; I704-N943 VanDerWaalsContact CD1-CB 3.43Å; R911-N943 WeakPolarHBondContact CD-OD1 3.27Å; L939-N943 WeakPolarHBondContact O-CB 3.25Å; L939-N943 PolarHBondContact O-N 2.8Å; L939-N943 VanDerWaalsContact O-N 3.13Å; L939-N943 PolarHBondContact O-ND2 2.87Å; I940-N943 PolarHBondContact O-N 3.29Å; L941-N943 VanDerWaalsContact C-N 3.28Å; L941-N943 PolarHBondContact O-N 2.81Å
944	S	89.6	Confident	87.2	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-108.2	-1.7	176.8	-53.4	0	0	0	0	113.7	I940 L941 I947 L948	I940-S944 VanDerWaalsContact O-CB 3.29Å; I940-S944 WeakPolarHBondContact O-CB 3.47Å; I940-S944 PolarHBondContact O-N 3.14Å; I940-S944 VanDerWaalsContact O-N 3.1Å; I940-S944 PolarHBondContact O-OG 2.9Å; L941-S944 PolarHBondContact O-N 3.37Å; S944-I947 WeakPolarHBondContact O-CG2 3.41Å; S944-L948 WeakPolarHBondContact O-CB 3.19Å; S944-L948 PolarHBondContact O-N 2.98Å; S944-L948 VanDerWaalsContact O-N 3.16Å
945	L	89	Confident	86.2	Confident	4 Å²	4	24.6 Å²	24.6	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-64.9	-39.8	-178.2	-63.5	-171.5	0	0	0	112.5	I744 L829 V838 L941 L948 R949	I744-L945 HydrophobicContact CD1-CD2 4.3Å; L829-L945 HydrophobicContact CD2-CD2 3.97Å; V838-L945 HydrophobicContact CG2-CD1 3.57Å; L941-L945 HydrophobicContact CD2-CD2 4.02Å; L941-L945 HydrophobicContact CD2-CG 4.46Å; L941-L945 HydrophobicContact CG-CD2 4.14Å; L941-L945 WeakPolarHBondContact O-CD2 3.45Å; L941-L945 WeakPolarHBondContact O-CG 3.24Å; L941-L945 PolarHBondContact O-N 3.44Å; L945-L948 PolarHBondContact O-N 3.14Å; L945-R949 WeakPolarHBondContact O-CB 3.47Å; L945-R949 PolarHBondContact O-N 3.12Å
946	D	86.9	Confident	84.6	Confident	83 Å²	83	28 Å²	28	44%	0.444	17%	0.165	S	C	.	.	H	α-helix	trans	-68.7	-44.7	-174.9	-56	5.6	0	0	0	111.5	R911 R949 A950	R911-D946 IonicContact CZ-OD2 2.68Å; R911-D946 IonicContact NH1-OD2 3.77Å; R911-D946 IonicContact NH2-OD1 2.7Å; R911-D946 PolarHBondContact NH2-OD1 3.36Å; R911-D946 IonicContact NH2-OD2 2.77Å; R911-D946 PolarHBondContact NH2-OD2 3.27Å; D946-R949 WeakPolarHBondContact O-CB 3.31Å; D946-R949 PolarHBondContact O-N 3.07Å; D946-A950 WeakPolarHBondContact O-CB 3.47Å; D946-A950 PolarHBondContact O-N 3.27Å
947	I	85.9	Confident	82.5	Confident	22 Å²	22	33.5 Å²	33.5	11%	0.113	19%	0.194	C	C	.	.	H	α-helix	trans	-68.8	-35.1	176.6	-170.9	168.2	0	0	0	111.9	V653 L656 L686 L740 S944 A951	V653-I947 HydrophobicContact CG1-CD1 3.76Å; V653-I947 HydrophobicContact CG1-CG1 3.71Å; L656-I947 HydrophobicContact CD2-CD1 3.64Å; L656-I947 HydrophobicContact CG-CD1 4.49Å; L686-I947 HydrophobicContact CB-CG2 4.41Å; L686-I947 WeakPolarHBondContact O-CD1 3.4Å; L740-I947 HydrophobicContact CD2-CG2 4.43Å; S944-I947 WeakPolarHBondContact O-CG2 3.41Å; I947-A951 WeakPolarHBondContact O-CB 3.38Å; I947-A951 PolarHBondContact O-N 3.16Å
948	L	87.9	Confident	80	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-61.6	-44.8	170.1	176.3	67.7	0	0	0	110.9	F648 T737 L740 L741 I744 L829 S944 L945 A952	F648-L948 HydrophobicContact CE2-CD1 4.18Å; T737-L948 HydrophobicContact CG2-CD1 4.47Å; L740-L948 HydrophobicContact CD2-CB 3.98Å; L740-L948 HydrophobicContact CD2-CD1 4.06Å; L740-L948 HydrophobicContact CG-CD1 4.28Å; L741-L948 HydrophobicContact CB-CD1 4.39Å; L741-L948 HydrophobicContact CD1-CD2 3.93Å; I744-L948 HydrophobicContact CD1-CD2 3.9Å; L829-L948 HydrophobicContact CD1-CD2 4.18Å; S944-L948 WeakPolarHBondContact O-CB 3.19Å; S944-L948 PolarHBondContact O-N 2.98Å; S944-L948 VanDerWaalsContact O-N 3.16Å; L945-L948 PolarHBondContact O-N 3.14Å; L948-A952 WeakPolarHBondContact O-CB 3.4Å; L948-A952 PolarHBondContact O-N 2.86Å
949	R	87.7	Confident	77.4	Confident	128 Å²	128	49 Å²	49	48%	0.483	27%	0.272	S	S	.	.	H	α-helix	trans	-63.3	-47.3	179.2	-169.5	-176.4	-162.1	-145.1	-5.5	111.5	D832 Q834 L945 D946 A951 F953	D832-R949 WeakPolarHBondContact OD1-CD 3.25Å; D832-R949 WeakPolarHBondContact OD1-CG 3.43Å; D832-R949 IonicContact OD1-CZ 3.19Å; D832-R949 IonicContact OD1-NE 2.87Å; D832-R949 PolarHBondContact OD1-NE 2.98Å; D832-R949 IonicContact OD1-NH2 2.63Å; D832-R949 IonicContact OD2-CZ 2.77Å; D832-R949 IonicContact OD2-NE 2.7Å; D832-R949 PolarHBondContact OD2-NE 3.04Å; D832-R949 VanDerWaalsContact OD2-NE 3.15Å; D832-R949 IonicContact OD2-NH2 2.67Å; D832-R949 PolarHBondContact OD2-NH2 2.99Å; Q834-R949 HydrophobicContact CG-CG 4.29Å; L945-R949 WeakPolarHBondContact O-CB 3.47Å; L945-R949 PolarHBondContact O-N 3.12Å; D946-R949 WeakPolarHBondContact O-CB 3.31Å; D946-R949 PolarHBondContact O-N 3.07Å; R949-A951 PolarHBondContact O-N 3.46Å; R949-F953 HydrophobicContact CG-CD2 4.2Å; R949-F953 PolarHBondContact O-N 3.02Å
950	A	85.4	Confident	74.8	Confident	59 Å²	59	56.2 Å²	56.2	49%	0.488	31%	0.31	S	S	.	.	H	α-helix	trans	-60.1	-44.9	179.1	0	0	0	0	0	111.9	D946 S954	D946-A950 WeakPolarHBondContact O-CB 3.47Å; D946-A950 PolarHBondContact O-N 3.27Å; A950-S954 VanDerWaalsContact O-CB 3.24Å; A950-S954 WeakPolarHBondContact O-CB 3.27Å; A950-S954 PolarHBondContact O-N 2.86Å; A950-S954 PolarHBondContact O-OG 3.07Å
951	A	85.6	Confident	72.1	Confident	5 Å²	5	65.3 Å²	65.3	4%	0.041	35%	0.35	C	S	.	.	H	α-helix	trans	-77.3	-34.4	-178.1	0	0	0	0	0	114.3	V653 T737 I947 R949	V653-A951 HydrophobicContact CB-CB 4.31Å; V653-A951 HydrophobicContact CG1-CB 4.13Å; V653-A951 HydrophobicContact CG2-CB 4.09Å; T737-A951 HydrophobicContact CG2-CB 3.54Å; I947-A951 WeakPolarHBondContact O-CB 3.38Å; I947-A951 PolarHBondContact O-N 3.16Å; R949-A951 PolarHBondContact O-N 3.46Å
952	A	85.4	Confident	69.4	Low	0 Å²	0	71.7 Å²	71.7	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-88.3	-17.9	-173.3	0	0	0	0	0	114.9	F648 Q649 T737 L948	F648-A952 HydrophobicContact CD2-CB 3.68Å; F648-A952 HydrophobicContact CE2-CB 3.56Å; F648-A952 HydrophobicContact CG-CB 4.48Å; F648-A952 HydrophobicContact CZ-CB 4.27Å; Q649-A952 PolarHBondContact N-O 2.97Å; T737-A952 HydrophobicContact CG2-CB 3.97Å; L948-A952 WeakPolarHBondContact O-CB 3.4Å; L948-A952 PolarHBondContact O-N 2.86Å
953	F	84.8	Confident	66.8	Low	41 Å²	41	82.5 Å²	82.5	18%	0.18	44%	0.444	C	S	.	.	H	α-helix	trans	-129.6	3.6	-173.4	-60.2	-70.3	0	0	0	115	P646 F648 L829 D832 R949	P646-F953 HydrophobicContact CB-CD1 3.87Å; P646-F953 HydrophobicContact CB-CE1 4.22Å; P646-F953 HydrophobicContact CG-CD1 4.04Å; P646-F953 HydrophobicContact CG-CE1 4.11Å; F648-F953 HydrophobicContact CB-CE1 4.14Å; F648-F953 HydrophobicContact CB-CZ 4.18Å; F648-F953 HydrophobicContact CD2-CE2 4.5Å; F648-F953 HydrophobicContact CD2-CZ 4.14Å; L829-F953 WeakPolarHBondContact O-CE2 3.43Å; L829-F953 VanDerWaalsContact O-CZ 3.29Å; L829-F953 WeakPolarHBondContact O-CZ 3.33Å; D832-F953 HydrophobicContact CB-CD1 4.49Å; D832-F953 HydrophobicContact CB-CD2 4.14Å; D832-F953 HydrophobicContact CB-CE1 4.19Å; D832-F953 HydrophobicContact CB-CE2 3.85Å; D832-F953 HydrophobicContact CB-CG 4.46Å; D832-F953 HydrophobicContact CB-CZ 3.87Å; R949-F953 HydrophobicContact CG-CD2 4.2Å; R949-F953 PolarHBondContact O-N 3.02Å
954	S	76	Confident	65.7	Low	32 Å²	32	85.8 Å²	85.8	22%	0.224	46%	0.462	C	S	.	.	S	Bend	trans	-63.4	148.5	172	58.2	0	0	0	0	111.7	R651 A950	R651-S954 PolarHBondContact NH1-O 3.12Å; R651-S954 PolarHBondContact NH1-OG 3.48Å; R651-S954 VanDerWaalsContact NH1-OG 3.09Å; R651-S954 PolarHBondContact NH2-O 2.79Å; A950-S954 VanDerWaalsContact O-CB 3.24Å; A950-S954 WeakPolarHBondContact O-CB 3.27Å; A950-S954 PolarHBondContact O-N 2.86Å; A950-S954 PolarHBondContact O-OG 3.07Å
955	P	63.7	Low	64.4	Low	108 Å²	108	90.3 Å²	90.3	70%	0.701	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-54.8	154.9	154.6	29.2	-34.5	0	0	0	109	D957	P955-D957 PolarHBondContact O-N 3.19Å
956	A	50.8	Low	63.1	Low	70 Å²	70	95.1 Å²	95.1	58%	0.579	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-67.6	129.7	169.8	0	0	0	0	0	108.3	Q958	A956-Q958 PolarHBondContact O-N 2.87Å
957	D	43.6	Very low	61.7	Low	125 Å²	125	95.8 Å²	95.8	67%	0.668	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-60.1	128.5	173	-58.3	-58.7	0	0	0	108.4	P955 D959	P955-D957 PolarHBondContact O-N 3.19Å; D957-D959 VanDerWaalsContact C-N 3.27Å
958	Q	36.3	Very low	60.1	Low	174 Å²	174	100.4 Å²	100.4	81%	0.813	54%	0.541	S	S	*	.	S	Bend	trans	-83.4	-4.8	-179.8	-68.3	-169.6	-80.3	0	0	112.9	A956 D960	A956-Q958 PolarHBondContact O-N 2.87Å; Q958-D960 VanDerWaalsContact C-N 3.27Å; Q958-D960 PolarHBondContact O-N 3.44Å; Q958-D960 VanDerWaalsContact O-N 3.14Å
959	D	35.9	Very low	58.3	Low	154 Å²	154	107 Å²	107	82%	0.824	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	33.8	-169.7	-63.7	-24.6	0	0	0	114.1	D957	D957-D959 VanDerWaalsContact C-N 3.27Å
960	D	35.4	Very low	56.2	Low	151 Å²	151	105.5 Å²	105.5	81%	0.807	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.4	23.7	173.7	-113.7	-27.5	0	0	0	113.1	Q958	Q958-D960 VanDerWaalsContact C-N 3.27Å; Q958-D960 PolarHBondContact O-N 3.44Å; Q958-D960 VanDerWaalsContact O-N 3.14Å
961	F	33.6	Very low	53.9	Low	196 Å²	196	109.1 Å²	109.1	86%	0.86	59%	0.591	S	S	*	*			trans	-103	72.2	161.3	-81.9	-73.4	0	0	0	110.8
962	V	35.1	Very low	51.3	Low	134 Å²	134	117.8 Å²	117.8	81%	0.812	64%	0.636	S	S	*	*			trans	-72.1	124.2	160.7	-178	0	0	0	0	108.1
963	I	35	Very low	48.2	Very low	228 Å²	228	128.5 Å²	128.5	100%	1.169	69%	0.694	S	S	*	*			trans	-100.3	0	170	-59.9	178	0	0	0	108.2

Retrieved 963 of 963 residues in 245.3 ms (Link to these results)

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