A0A087XFJ4_POEFO Loading...

Mitogen-activated protein kinase

Plays a role in various cellular processes such as proliferation, differentiation and cell survival. The upstream activator of MAPK7 is the MAPK kinase MAP2K5. Upon activation, it translocates to the nucleus and phosphorylates various downstream targets including MEF2C. EGF activates MAPK7 through a Ras-independent and MAP2K5-dependent pathway. As part of the MAPK/ERK signaling pathway, acts as a negative regulator of apoptosis in cardiomyocytes via interaction with STUB1/CHIP and promotion of STUB1-mediated ubiquitination and degradation of ICER-type isoforms of CREM. May have a role in muscle cell differentiation. May be important for endothelial function and maintenance of blood vessel integrity. MAP2K5 and MAPK7 interact specifically with one another and not with MEK1/ERK1 or MEK2/ERK2 pathways. Phosphorylates SGK1 at Ser-78 and this is required for growth factor-induced cell cycle progression. Involved in the regulation of p53/TP53 by disrupting the PML-MDM2 interaction.

AlphaFold DB , UniProt , Accession A0A087XFJ4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,066 aa.

						>A0A087XFJ4_POEFO|A0A087XFJ4
MSTKEGGGAKVLASPEKMATDKGRQNQNQRGVEVIPGNTDTSIAAKNLALLKAHSLDVKFDVGEEYDVIETIGTGAYGVVSSARRRDNGQQVAIKKISNAFEVVTNAKRTLRELKILKHFKHDNIIAIKDILQPNLPHSAFKSVYVVLDLMESDLHQIIHSAQTLTPEHTRYFLYQLLRGLKYVHSANVIHRDLKPSNLLVNESCELKIGDFGMARGLSSHPEESYCFMTEYVATRWYRAPELLLSLNHYSLAIDMWSVGCIFAEMMGRKQLFPGKNYVHQLQLILSVLGTPPEGLIGSIRADRVRSYVQSLPSRTPVPLAKLYPQAEASALDLLQAMLQFDPRERISVTEALAHPYVSKYHDPDDEPTCVPAFDFEFDKLPMNKEQIKEAILMEIQDFHKKKLSSRPRLQFRPLPRVEPAAQRSSQPANADLTKKTMVAISHHLEAKQIQQQKMTEANSQKQQNNPPADVNPAFPNQVPHHLPLLSKHVGAPVDVDMPSANSDSGQPETIDLTTPVSTQDAPSETMRDGEGQEGIPAIQSQPMEPNAVPSTQAQTMTALPTSVPSLSLSAAQVQSLSQALSHSLSKNARPPPRAAEGTRKEGAISEDTKNALKKALRNKARGNGGGSGLGIDGGAGGGSVSSVVSSVPESRRPVTAQERQREREEKRRKRQERARERERKMKEKERKEKKLGDSLGGVLLSDNDKSLLQRWTKMIDSCSDKSQTASNDGKTKDCNLNSQRISENNKTNMEARKSQPHEQLVSQVKPNQQGLFPPPATTQQLTLPFSVSQRKPPGDAVRGGIDMMAVTGGYVKNDTLQPHAEGNRETEFAGVGNWSGQQLETRPTQQPNRTPQPASSFLQSQPPPDPKPQPHLLPLESFLPKAPPVAIRETNGSVDVRGQSNLNPLTASPGLMEKLCSSLGEKSVAQSISHLCGTSAVPPSQPHPSLGFTDTGQQGPSVAPDIHTVTLQLSKSQVEDPLPPMFSVTPKGSGAGYGVGFDLDDLFSQSMVELQHGDRDSFDSAPLSASLLSDWSEVHRMTPADLESLQQELQLGSPMILSDTIPHDA
					

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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	30.8	Very low	31.4	Very low	251 Å²	251	142 Å²	142	100%	1.236	88%	0.875	S	S	*	*				0	164	0	-87.9	178	163	0	0	109.4
2	S	29.5	Very low	30.9	Very low	107 Å²	107	143.1 Å²	143.1	75%	0.748	87%	0.87	S	S	*	*			trans	-82.2	146.2	-159.3	-44.7	0	0	0	0	115.6
3	T	35.7	Very low	30.7	Very low	120 Å²	120	137.4 Å²	137.4	74%	0.736	85%	0.847	S	S	*	*			trans	34.7	130.9	134.4	62.2	0	0	0	0	122.8
4	K	41.8	Very low	30.5	Very low	200 Å²	200	136.1 Å²	136.1	87%	0.87	85%	0.846	S	S	*	*			trans	48.4	120.5	130.5	-65	-176.9	175	179.6	0	120.9
5	E	32.9	Very low	31.7	Very low	204 Å²	204	135.3 Å²	135.3	95%	0.953	84%	0.843	S	S	*	*			trans	-153	165.9	135.5	-104.4	172.2	-170.1	0	0	107.3
6	G	30.7	Very low	31.8	Very low	74 Å²	74	135.8 Å²	135.8	76%	0.763	83%	0.832	S	S	*	*			cis	156.4	103.5	-6	0	0	0	0	0	112.9
7	G	29	Very low	31.8	Very low	89 Å²	89	136.2 Å²	136.2	92%	0.918	82%	0.82	S	S	*	*			trans	83	155.5	167.8	0	0	0	0	0	117.3
8	G	26.7	Very low	31.6	Very low	83 Å²	83	137.8 Å²	137.8	86%	0.856	82%	0.82	S	S	*	*			trans	-128.1	-173.1	-175.6	0	0	0	0	0	114.8
9	A	28.2	Very low	31.6	Very low	112 Å²	112	134.6 Å²	134.6	93%	0.926	81%	0.81	S	S	*	*			trans	-149.8	-176.7	-179.7	0	0	0	0	0	113.2
10	K	30.3	Very low	32	Very low	195 Å²	195	134.9 Å²	134.9	85%	0.848	81%	0.812	S	S	*	*			trans	-149.1	145.9	-157.5	-130.4	-174.4	-176.5	-180	0	113.4
11	V	29.8	Very low	32.2	Very low	127 Å²	127	133.6 Å²	133.6	77%	0.77	80%	0.801	S	S	*	*			trans	65.8	158.3	155.9	165.7	0	0	0	0	114
12	L	25.7	Very low	32.5	Very low	155 Å²	155	130.4 Å²	130.4	81%	0.812	78%	0.78	S	S	*	*			cis	-145.7	173.8	13.2	-150.9	139.2	0	0	0	107.6
13	A	28.1	Very low	32.5	Very low	69 Å²	69	128.6 Å²	128.6	57%	0.57	78%	0.778	S	S	*	*				166.3	131.1	-51.4	0	0	0	0	0	108.8
14	S	28.2	Very low	32.3	Very low	120 Å²	120	134 Å²	134	84%	0.839	79%	0.785	S	S	*	*			trans	59.3	146.7	155.4	-54.7	0	0	0	0	120.4
15	P	47.8	Very low	31.9	Very low	124 Å²	124	131.7 Å²	131.7	81%	0.805	78%	0.777	S	S	*	*				-144.3	-177.6	69.2	34.7	-13.8	0	0	0	115.2
16	E	33.3	Very low	31.7	Very low	143 Å²	143	129 Å²	129	67%	0.668	77%	0.769	S	S	*	*			cis	-171.5	162.1	-41.7	-158.6	-153.3	149.9	0	0	109.5
17	K	32.4	Very low	31.7	Very low	142 Å²	142	134.5 Å²	134.5	62%	0.617	78%	0.775	S	S	*	*			trans	72.5	142.5	168.5	-59.8	178	171.3	78.7	0	116.6
18	M	27	Very low	31.8	Very low	166 Å²	166	136.4 Å²	136.4	82%	0.818	77%	0.765	S	S	*	*			cis	-168.1	169.1	-2.2	-105.3	162.9	170.1	0	0	107.9
19	A	33.4	Very low	32	Very low	76 Å²	76	138.9 Å²	138.9	63%	0.628	75%	0.754	S	S	*	*			cis	-175.3	169.1	-31.6	0	0	0	0	0	110.6
20	T	37.7	Very low	32.1	Very low	140 Å²	140	144.1 Å²	144.1	86%	0.859	75%	0.75	S	S	*	*			trans	63.9	153.9	167.6	71.6	0	0	0	0	118.6
21	D	36.3	Very low	32	Very low	109 Å²	109	138.4 Å²	138.4	58%	0.583	75%	0.746	S	S	*	*			cis	-154.4	161.2	8.4	-155.3	-4.5	0	0	0	114.4
22	K	37.1	Very low	31.9	Very low	184 Å²	184	139.2 Å²	139.2	80%	0.8	75%	0.751	S	S	*	*			trans	39.8	142.4	162.4	-75	142.3	-161.6	154	0	122.9
23	G	29.7	Very low	32.2	Very low	68 Å²	68	140.6 Å²	140.6	70%	0.701	75%	0.753	S	S	*	*			cis	157.7	167.5	-8.4	0	0	0	0	0	115.6
24	R	32.5	Very low	32.2	Very low	233 Å²	233	143.9 Å²	143.9	88%	0.879	77%	0.766	S	S	*	*			trans	70	143.9	172.6	-75.4	-173.8	171.3	163.1	-1.7	118
25	Q	32.5	Very low	32.4	Very low	152 Å²	152	145.4 Å²	145.4	71%	0.71	76%	0.763	S	S	*	*			cis	-159.2	152.1	-16.9	-137.6	165.1	-28.9	0	0	112.1
26	N	29.4	Very low	31.9	Very low	147 Å²	147	145.7 Å²	145.7	79%	0.786	77%	0.765	S	S	*	*			trans	-5.8	133.2	175.7	-60.4	7.8	0	0	0	122.6
27	Q	31.3	Very low	31.8	Very low	191 Å²	191	141.8 Å²	141.8	89%	0.893	76%	0.763	S	S	*	*			trans	-85.6	162.2	139.1	-67.8	-179.6	-11.4	0	0	110.7
28	N	30.7	Very low	31.8	Very low	129 Å²	129	142 Å²	142	69%	0.69	77%	0.771	S	S	*	*			trans	-162	118.4	152.4	-149.1	-12.9	0	0	0	113.5
29	Q	31.1	Very low	32.3	Very low	135 Å²	135	139.2 Å²	139.2	63%	0.631	76%	0.764	S	S	*	*			trans	61.5	155.9	164.1	-72.1	164.7	71.5	0	0	117.6
30	R	29.7	Very low	32.7	Very low	222 Å²	222	140.3 Å²	140.3	84%	0.838	76%	0.759	S	S	*	*			cis	-145.7	144.3	1.2	-134	172.6	-117.6	-162	-2.7	108
31	G	28.6	Very low	32.8	Very low	75 Å²	75	139 Å²	139	77%	0.773	75%	0.751	S	S	*	*			trans	-99.4	-168.4	-168.8	0	0	0	0	0	116.2
32	V	28.3	Very low	33.5	Very low	144 Å²	144	136.6 Å²	136.6	87%	0.873	74%	0.742	S	S	*	*			trans	-156.2	147.5	156.6	147.7	0	0	0	0	106.7
33	E	31.8	Very low	34.1	Very low	183 Å²	183	132.9 Å²	132.9	86%	0.855	73%	0.73	S	S	*	*			trans	-83.4	150.9	-180	-63.2	171.5	110.2	0	0	113.1
34	V	27.4	Very low	34.7	Very low	139 Å²	139	132.7 Å²	132.7	84%	0.842	72%	0.722	S	S	*	*			trans	-138	127.5	156.7	-178.6	0	0	0	0	108.3
35	I	32.6	Very low	35.3	Very low	152 Å²	152	124.2 Å²	124.2	78%	0.779	70%	0.702	S	S	*	*			trans	-81.7	135.1	-176.9	-59.6	169.7	0	0	0	109.8	G37	I35-G37 PolarHBondContact O-N 3.05Å
36	P	36.3	Very low	35.8	Very low	129 Å²	129	123 Å²	123	84%	0.838	69%	0.694	S	S	*	*			trans	-81.6	114.1	177.1	31.5	-32.8	0	0	0	111.8
37	G	31.7	Very low	36.6	Very low	61 Å²	61	120.1 Å²	120.1	63%	0.629	68%	0.679	S	S	*	*			trans	-121.3	131.1	166.9	0	0	0	0	0	111.3	I35	I35-G37 PolarHBondContact O-N 3.05Å
38	N	32.2	Very low	37.3	Very low	146 Å²	146	114.7 Å²	114.7	78%	0.781	66%	0.656	S	S	*	*			trans	152.5	101.6	152.8	-82.3	-9.3	0	0	0	110.7
39	T	38.5	Very low	37.9	Very low	109 Å²	109	111.3 Å²	111.3	67%	0.669	65%	0.645	S	S	*	*			trans	-94.7	-19.3	172.4	35	0	0	0	0	113.7	T41 S42	T39-T41 PolarHBondContact O-N 2.86Å; T39-S42 VanDerWaalsContact O-CB 3.26Å; T39-S42 WeakPolarHBondContact O-CB 3.38Å; T39-S42 PolarHBondContact O-N 3.4Å
40	D	40.5	Very low	38.4	Very low	99 Å²	99	109.6 Å²	109.6	53%	0.529	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.1	-21.9	-152.7	-46.6	-26.5	0	0	0	113	S42 I43	D40-S42 PolarHBondContact O-N 2.91Å; D40-S42 VanDerWaalsContact O-N 3.14Å; D40-I43 PolarHBondContact O-N 2.91Å
41	T	40.3	Very low	39.2	Very low	113 Å²	113	104.9 Å²	104.9	69%	0.693	63%	0.631	S	S	*	*	H	α-helix	trans	-60	-19.1	169.4	33.6	0	0	0	0	113.3	T39 A45	T39-T41 PolarHBondContact O-N 2.86Å; T41-A45 VanDerWaalsContact O-CB 3.32Å; T41-A45 WeakPolarHBondContact O-CB 3.26Å
42	S	50.8	Low	39.7	Very low	57 Å²	57	107.6 Å²	107.6	40%	0.399	62%	0.621	S	S	.	*	H	α-helix	trans	-73.4	-41.4	177.9	-165.6	0	0	0	0	112.8	T39 D40 K46	T39-S42 VanDerWaalsContact O-CB 3.26Å; T39-S42 WeakPolarHBondContact O-CB 3.38Å; T39-S42 PolarHBondContact O-N 3.4Å; D40-S42 PolarHBondContact O-N 2.91Å; D40-S42 VanDerWaalsContact O-N 3.14Å; S42-K46 WeakPolarHBondContact O-CB 3.41Å; S42-K46 VanDerWaalsContact O-CG 3.28Å; S42-K46 WeakPolarHBondContact O-CG 3.28Å; S42-K46 PolarHBondContact O-N 2.79Å
43	I	50.1	Low	40.2	Very low	106 Å²	106	103.2 Å²	103.2	54%	0.544	60%	0.6	S	S	.	*	H	α-helix	trans	-75.5	-46.3	-172	-59.1	176.5	0	0	0	110.6	D40 A45 K46 N47	D40-I43 PolarHBondContact O-N 2.91Å; I43-A45 VanDerWaalsContact C-N 3.27Å; I43-A45 PolarHBondContact O-N 3.35Å; I43-K46 PolarHBondContact O-N 3.43Å; I43-N47 WeakPolarHBondContact O-CB 3.23Å; I43-N47 PolarHBondContact O-N 2.81Å; I43-N47 PolarHBondContact O-OD1 3.45Å
44	A	42.8	Very low	40.8	Very low	64 Å²	64	100.8 Å²	100.8	53%	0.529	59%	0.589	S	S	.	*	H	α-helix	trans	-59.9	-37.9	175.5	0	0	0	0	0	112.2	L48	A44-L48 VanDerWaalsContact O-CB 3.29Å; A44-L48 WeakPolarHBondContact O-CB 3.32Å; A44-L48 PolarHBondContact O-N 2.65Å
45	A	44.1	Very low	41.7	Very low	56 Å²	56	95.4 Å²	95.4	46%	0.463	56%	0.557	S	S	.	*	H	α-helix	trans	-67.4	-41.5	175.2	0	0	0	0	0	112.6	T41 I43 A49	T41-A45 VanDerWaalsContact O-CB 3.32Å; T41-A45 WeakPolarHBondContact O-CB 3.26Å; I43-A45 VanDerWaalsContact C-N 3.27Å; I43-A45 PolarHBondContact O-N 3.35Å; A45-A49 WeakPolarHBondContact O-CB 3.49Å; A45-A49 PolarHBondContact O-N 3.16Å
46	K	44.7	Very low	42.3	Very low	126 Å²	126	94.8 Å²	94.8	55%	0.548	56%	0.555	S	S	.	*	H	α-helix	trans	-65.6	-42.6	175.1	-75.5	171.2	-178.6	178.9	0	112.4	S42 I43 A49 L50	S42-K46 WeakPolarHBondContact O-CB 3.41Å; S42-K46 VanDerWaalsContact O-CG 3.28Å; S42-K46 WeakPolarHBondContact O-CG 3.28Å; S42-K46 PolarHBondContact O-N 2.79Å; I43-K46 PolarHBondContact O-N 3.43Å; K46-A49 CarbonylContact O-C 3.58Å; K46-A49 WeakPolarHBondContact O-CB 3.07Å; K46-A49 PolarHBondContact O-N 2.93Å; K46-A49 VanDerWaalsContact O-N 3.16Å; K46-L50 PolarHBondContact O-N 3Å
47	N	45.3	Very low	43	Very low	86 Å²	86	95.3 Å²	95.3	46%	0.46	55%	0.551	S	S	.	*	H	α-helix	trans	-67.9	-38.2	178.4	-68	0.7	0	0	0	111.1	I43 A49 L50 L51	I43-N47 WeakPolarHBondContact O-CB 3.23Å; I43-N47 PolarHBondContact O-N 2.81Å; I43-N47 PolarHBondContact O-OD1 3.45Å; N47-A49 VanDerWaalsContact C-N 3.34Å; N47-L50 PolarHBondContact O-N 3.47Å; N47-L51 WeakPolarHBondContact O-CB 3.33Å; N47-L51 WeakPolarHBondContact O-CG 3.48Å; N47-L51 PolarHBondContact O-N 3.4Å
48	L	46.6	Very low	44.8	Very low	78 Å²	78	94.2 Å²	94.2	41%	0.408	53%	0.531	S	S	.	.	H	α-helix	trans	-65.8	-34.6	170.7	-176.3	62.2	0	0	0	112.4	A44 K52	A44-L48 VanDerWaalsContact O-CB 3.29Å; A44-L48 WeakPolarHBondContact O-CB 3.32Å; A44-L48 PolarHBondContact O-N 2.65Å; L48-K52 WeakPolarHBondContact O-CB 3.48Å; L48-K52 VanDerWaalsContact O-CG 3.3Å; L48-K52 WeakPolarHBondContact O-CG 3.46Å; L48-K52 PolarHBondContact O-N 2.98Å
49	A	42.7	Very low	46.9	Very low	57 Å²	57	94.1 Å²	94.1	47%	0.471	52%	0.524	S	S	.	.	H	α-helix	trans	-70.1	-40.3	174.6	0	0	0	0	0	112.3	A45 K46 N47 K52 A53	A45-A49 WeakPolarHBondContact O-CB 3.49Å; A45-A49 PolarHBondContact O-N 3.16Å; K46-A49 CarbonylContact O-C 3.58Å; K46-A49 WeakPolarHBondContact O-CB 3.07Å; K46-A49 PolarHBondContact O-N 2.93Å; K46-A49 VanDerWaalsContact O-N 3.16Å; N47-A49 VanDerWaalsContact C-N 3.34Å; A49-K52 PolarHBondContact O-N 3.05Å; A49-A53 WeakPolarHBondContact O-CB 3.48Å; A49-A53 PolarHBondContact O-N 3.34Å
50	L	42.4	Very low	48.9	Very low	99 Å²	99	90.4 Å²	90.4	52%	0.518	50%	0.499	S	S	.	.	H	α-helix	trans	-64.2	-46.2	172.9	-83.4	165.3	0	0	0	111.6	K46 N47 K52 A53 H54	K46-L50 PolarHBondContact O-N 3Å; N47-L50 PolarHBondContact O-N 3.47Å; L50-K52 VanDerWaalsContact C-N 3.28Å; L50-K52 PolarHBondContact O-N 3.3Å; L50-A53 PolarHBondContact O-N 3.41Å; L50-A53 VanDerWaalsContact O-N 3.14Å; L50-H54 PolarHBondContact O-CD2 3.26Å; L50-H54 VanDerWaalsContact O-CD2 3.25Å; L50-H54 PolarHBondContact O-N 3.04Å
51	L	45.5	Very low	50.9	Low	124 Å²	124	89.5 Å²	89.5	65%	0.649	49%	0.494	S	S	*	.	H	α-helix	trans	-60.6	-37.6	174.2	-75.2	167.7	0	0	0	111.8	N47 S55	N47-L51 WeakPolarHBondContact O-CB 3.33Å; N47-L51 WeakPolarHBondContact O-CG 3.48Å; N47-L51 PolarHBondContact O-N 3.4Å; L51-S55 WeakPolarHBondContact O-CB 3.48Å; L51-S55 PolarHBondContact O-N 2.94Å
52	K	39.9	Very low	52.9	Low	132 Å²	132	84.8 Å²	84.8	57%	0.574	47%	0.465	S	S	*	.	H	α-helix	trans	-68.5	-38.7	172.2	-78.5	-178.2	174.6	-167.9	0	113.2	L48 A49 L50 S55 L56	L48-K52 WeakPolarHBondContact O-CB 3.48Å; L48-K52 VanDerWaalsContact O-CG 3.3Å; L48-K52 WeakPolarHBondContact O-CG 3.46Å; L48-K52 PolarHBondContact O-N 2.98Å; A49-K52 PolarHBondContact O-N 3.05Å; L50-K52 VanDerWaalsContact C-N 3.28Å; L50-K52 PolarHBondContact O-N 3.3Å; K52-S55 WeakPolarHBondContact O-CB 3.29Å; K52-S55 PolarHBondContact O-N 2.89Å; K52-L56 VanDerWaalsContact O-CG 3.29Å; K52-L56 WeakPolarHBondContact O-CG 3.34Å; K52-L56 PolarHBondContact O-N 3.3Å; K52-L56 VanDerWaalsContact O-N 3.08Å
53	A	37.9	Very low	54.4	Low	52 Å²	52	84.3 Å²	84.3	43%	0.43	47%	0.469	S	S	.	.	H	α-helix	trans	-64.7	-50.6	176.2	0	0	0	0	0	111.2	A49 L50 S55 L56 D57	A49-A53 WeakPolarHBondContact O-CB 3.48Å; A49-A53 PolarHBondContact O-N 3.34Å; L50-A53 PolarHBondContact O-N 3.41Å; L50-A53 VanDerWaalsContact O-N 3.14Å; A53-S55 VanDerWaalsContact C-N 3.27Å; A53-S55 PolarHBondContact O-N 3.3Å; A53-L56 PolarHBondContact O-N 3.47Å; A53-D57 PolarHBondContact O-N 3.41Å
54	H	44.3	Very low	56	Low	132 Å²	132	87.1 Å²	87.1	61%	0.611	48%	0.48	S	S	*	.	H	α-helix	trans	-62.2	-32.3	173.8	-74.5	-68.6	0	0	0	112.7	L50 L56 V58	L50-H54 PolarHBondContact O-CD2 3.26Å; L50-H54 VanDerWaalsContact O-CD2 3.25Å; L50-H54 PolarHBondContact O-N 3.04Å; H54-L56 VanDerWaalsContact C-N 3.3Å; H54-L56 PolarHBondContact O-N 2.97Å; H54-V58 VanDerWaalsContact O-CG2 3.27Å; H54-V58 WeakPolarHBondContact O-CG2 3.48Å
55	S	45.6	Very low	58.2	Low	25 Å²	25	87.7 Å²	87.7	18%	0.175	47%	0.471	C	S	.	.	H	α-helix	trans	-69.1	-22.1	173.4	176.3	0	0	0	0	114.2	L51 K52 A53 T74	L51-S55 WeakPolarHBondContact O-CB 3.48Å; L51-S55 PolarHBondContact O-N 2.94Å; K52-S55 WeakPolarHBondContact O-CB 3.29Å; K52-S55 PolarHBondContact O-N 2.89Å; A53-S55 VanDerWaalsContact C-N 3.27Å; A53-S55 PolarHBondContact O-N 3.3Å; S55-T74 VanDerWaalsContact OG-CG2 3.22Å; S55-T74 WeakPolarHBondContact OG-CG2 3.46Å
56	L	46.3	Very low	60.6	Low	140 Å²	140	85.3 Å²	85.3	73%	0.733	45%	0.45	S	S	*	.	H	α-helix	trans	-89.5	-24.1	178	-73.8	166.3	0	0	0	112.3	K52 A53 H54	K52-L56 VanDerWaalsContact O-CG 3.29Å; K52-L56 WeakPolarHBondContact O-CG 3.34Å; K52-L56 PolarHBondContact O-N 3.3Å; K52-L56 VanDerWaalsContact O-N 3.08Å; A53-L56 PolarHBondContact O-N 3.47Å; H54-L56 VanDerWaalsContact C-N 3.3Å; H54-L56 PolarHBondContact O-N 2.97Å
57	D	50.4	Low	62.8	Low	140 Å²	140	82.3 Å²	82.3	75%	0.749	44%	0.44	S	S	*	.			trans	-96.4	11.3	-176.5	-154.3	28.5	0	0	0	113.7	A53 K59	A53-D57 PolarHBondContact O-N 3.41Å; D57-K59 PolarHBondContact O-N 3.03Å
58	V	70	Confident	65	Low	37 Å²	37	80.9 Å²	80.9	22%	0.224	44%	0.435	C	S	.	.			trans	-74	88.4	173.8	-176.4	0	0	0	0	109.8	H54 F60 V79 K96	H54-V58 VanDerWaalsContact O-CG2 3.27Å; H54-V58 WeakPolarHBondContact O-CG2 3.48Å; V58-F60 HydrophobicContact CG1-CE2 4.4Å; V58-F60 WeakPolarHBondContact O-CD2 3.37Å; V58-F60 PolarHBondContact O-N 3.32Å; V58-V79 HydrophobicContact CB-CG2 4.29Å; V58-V79 HydrophobicContact CG1-CB 4.29Å; V58-V79 HydrophobicContact CG1-CG2 4.1Å; V58-V79 HydrophobicContact CG2-CG2 3.94Å; V58-K96 HydrophobicContact CG1-CD 3.78Å
59	K	75.8	Confident	67.1	Low	145 Å²	145	81.2 Å²	81.2	63%	0.63	44%	0.436	S	S	*	.			trans	-52.9	129.3	176.8	-166.4	-171.4	-176.9	-137.7	0	112.2	D57 D61 K96	D57-K59 PolarHBondContact O-N 3.03Å; K59-D61 VanDerWaalsContact CE-OD1 3.31Å; K59-D61 WeakPolarHBondContact CE-OD1 3.47Å; K59-D61 IonicContact NZ-OD1 3.7Å; K59-D61 PolarHBondContact NZ-OD1 3.38Å; K59-K96 PolarHBondContact O-NZ 2.78Å
60	F	81.4	Confident	69.3	Low	30 Å²	30	84.2 Å²	84.2	13%	0.132	44%	0.44	C	S	.	.			trans	-103.4	102.8	176.4	-87.2	-98.4	0	0	0	110.8	V58 V62 V68 V79 S81 I94 K96 Y145	V58-F60 HydrophobicContact CG1-CE2 4.4Å; V58-F60 WeakPolarHBondContact O-CD2 3.37Å; V58-F60 PolarHBondContact O-N 3.32Å; F60-V62 HydrophobicContact CB-CG1 4.04Å; F60-V62 HydrophobicContact CD1-CG1 4.07Å; F60-V62 PolarHBondContact O-N 2.95Å; F60-V68 HydrophobicContact CB-CG2 3.82Å; F60-V68 HydrophobicContact CG-CG2 4.27Å; F60-V79 HydrophobicContact CE2-CB 4.45Å; F60-V79 HydrophobicContact CE2-CG1 3.84Å; F60-V79 HydrophobicContact CZ-CB 4.19Å; F60-V79 HydrophobicContact CZ-CG1 3.84Å; F60-S81 WeakPolarHBondContact CE2-OG 3.46Å; F60-S81 VanDerWaalsContact CZ-OG 3.22Å; F60-S81 WeakPolarHBondContact CZ-OG 3.29Å; F60-I94 HydrophobicContact CD1-CG2 4.2Å; F60-I94 HydrophobicContact CE1-CB 4.42Å; F60-I94 HydrophobicContact CE1-CG2 4.12Å; F60-K96 HydrophobicContact CD1-CB 4.2Å; F60-K96 HydrophobicContact CE1-CB 3.52Å; F60-K96 HydrophobicContact CZ-CB 3.82Å; F60-Y145 HydrophobicContact CD1-CD1 4.06Å; F60-Y145 AromaticContact CD1-CE1 3.78Å; F60-Y145 HydrophobicContact CD1-CE1 3.78Å; F60-Y145 HydrophobicContact CE1-CD1 4.45Å; F60-Y145 HydrophobicContact CE1-CE1 4.38Å; F60-Y145 HydrophobicContact CG-CE1 4.39Å
61	D	82.3	Confident	71.5	Confident	81 Å²	81	82 Å²	82	43%	0.433	43%	0.431	S	S	.	.			trans	-83.3	61.1	179.1	-60.3	-69.5	0	0	0	111.8	K59 G63 Y145	K59-D61 VanDerWaalsContact CE-OD1 3.31Å; K59-D61 WeakPolarHBondContact CE-OD1 3.47Å; K59-D61 IonicContact NZ-OD1 3.7Å; K59-D61 PolarHBondContact NZ-OD1 3.38Å; D61-G63 PolarHBondContact O-N 3.23Å; D61-Y145 PolarHBondContact N-OH 3.28Å; D61-Y145 VanDerWaalsContact N-OH 3.09Å
62	V	81.8	Confident	73.4	Confident	14 Å²	14	78 Å²	78	9%	0.085	41%	0.41	C	S	.	.			trans	-88	3.6	-171.3	-62.7	0	0	0	0	115.1	F60 Y66 V68 I94 L132 Y145	F60-V62 HydrophobicContact CB-CG1 4.04Å; F60-V62 HydrophobicContact CD1-CG1 4.07Å; F60-V62 PolarHBondContact O-N 2.95Å; V62-Y66 WeakPolarHBondContact CG2-O 3.46Å; V62-V68 HydrophobicContact CG1-CG2 4.35Å; V62-V68 HydrophobicContact CG2-CG2 3.72Å; V62-I94 HydrophobicContact CB-CD1 4.4Å; V62-I94 HydrophobicContact CG1-CD1 3.92Å; V62-I94 HydrophobicContact CG1-CG2 4.13Å; V62-L132 HydrophobicContact CB-CD1 3.74Å; V62-L132 HydrophobicContact CG1-CD1 3.75Å; V62-Y145 HydrophobicContact CG1-CD1 4.15Å; V62-Y145 HydrophobicContact CG1-CE1 4.33Å
63	G	82.1	Confident	75.3	Confident	46 Å²	46	72 Å²	72	47%	0.474	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	-162.5	-177.8	0	0	0	0	0	113.5	D61	D61-G63 PolarHBondContact O-N 3.23Å
64	E	84.9	Confident	77.1	Confident	166 Å²	166	71.3 Å²	71.3	78%	0.776	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-5.1	-177.1	-64.1	-175.6	175.4	0	0	114.4	R86	E64-R86 WeakPolarHBondContact O-CD 3.41Å; E64-R86 PolarHBondContact O-NH1 3.19Å
65	E	88.3	Confident	78.2	Confident	76 Å²	76	66.5 Å²	66.5	36%	0.355	36%	0.361	S	S	.	.	S	Bend	trans	-79.9	-21.3	-176.5	-174.7	169.5	-173.2	0	0	113.2	R85 R86	E65-R85 HydrophobicContact CG-CG 4.1Å; E65-R85 CarbonylContact O-C 3.59Å; E65-R85 WeakPolarHBondContact O-CA 3.41Å; E65-R85 IonicContact OE1-CZ 3.57Å; E65-R85 IonicContact OE1-NE 2.66Å; E65-R85 PolarHBondContact OE1-NE 3.46Å; E65-R85 IonicContact OE1-NH2 3.27Å; E65-R85 PolarHBondContact OE1-NH2 3.07Å; E65-R86 PolarHBondContact O-N 3.43Å
66	Y	93.4	Very high	78.9	Confident	5 Å²	5	68 Å²	68	2%	0.02	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	128.9	-173.6	-61.3	-88.8	0	0	0	112.7	V62 R84 R85 V92 I94 D130 L132 V147	V62-Y66 WeakPolarHBondContact CG2-O 3.46Å; Y66-R84 WeakPolarHBondContact CA-O 3.42Å; Y66-R85 HydrophobicContact CD1-CB 3.92Å; Y66-R85 HydrophobicContact CD1-CG 4Å; Y66-R85 HydrophobicContact CE1-CB 3.77Å; Y66-R85 HydrophobicContact CE1-CG 3.57Å; Y66-V92 HydrophobicContact CD1-CG2 3.93Å; Y66-V92 HydrophobicContact CE1-CG2 3.93Å; Y66-I94 HydrophobicContact CD1-CD1 4.04Å; Y66-I94 HydrophobicContact CG-CD1 3.93Å; Y66-D130 WeakPolarHBondContact OH-CB 3.33Å; Y66-D130 PolarHBondContact OH-OD2 3.49Å; Y66-D130 VanDerWaalsContact OH-OD2 3.07Å; Y66-L132 HydrophobicContact CD2-CD2 4.13Å; Y66-L132 HydrophobicContact CE2-CD2 3.61Å; Y66-V147 HydrophobicContact CE1-CG1 3.93Å; Y66-V147 HydrophobicContact CE1-CG2 4.41Å; Y66-V147 HydrophobicContact CE2-CG2 4.46Å
67	D	91.6	Very high	79.7	Confident	63 Å²	63	62.5 Å²	62.5	34%	0.337	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	113.5	164.9	-67.5	-53.3	0	0	0	109.3	A83 R84 R86	D67-A83 CarbonylContact O-C 3.49Å; D67-A83 WeakPolarHBondContact O-CA 3.46Å; D67-A83 WeakPolarHBondContact O-CB 3.38Å; D67-R84 PolarHBondContact N-O 2.7Å; D67-R84 PolarHBondContact O-N 2.62Å; D67-R86 IonicContact OD1-CZ 2.79Å; D67-R86 IonicContact OD1-NE 2.74Å; D67-R86 PolarHBondContact OD1-NE 3.13Å; D67-R86 IonicContact OD1-NH2 2.73Å; D67-R86 PolarHBondContact OD1-NH2 3.46Å; D67-R86 VanDerWaalsContact OD2-CG 3.31Å; D67-R86 WeakPolarHBondContact OD2-CG 3.39Å; D67-R86 IonicContact OD2-NE 2.79Å; D67-R86 PolarHBondContact OD2-NE 3.02Å
68	V	92.1	Very high	81.1	Confident	57 Å²	57	56.1 Å²	56.1	35%	0.345	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	135.1	171.8	-173.6	0	0	0	0	109.1	F60 V62	F60-V68 HydrophobicContact CB-CG2 3.82Å; F60-V68 HydrophobicContact CG-CG2 4.27Å; V62-V68 HydrophobicContact CG1-CG2 4.35Å; V62-V68 HydrophobicContact CG2-CG2 3.72Å
69	I	90.7	Very high	81.9	Confident	84 Å²	84	55 Å²	55	43%	0.431	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-63	-175.5	-55.6	169.3	0	0	0	110	S82 R84	I69-S82 PolarHBondContact N-O 3.28Å; I69-R84 HydrophobicContact CD1-CB 4.29Å
70	E	88.9	Confident	82.6	Confident	121 Å²	121	48.1 Å²	48.1	57%	0.565	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-154.6	152.9	-173.8	57.7	-179.4	169.9	0	0	111.4	I72 S81 S82	E70-I72 HydrophobicContact CG-CG2 4.14Å; E70-I72 PolarHBondContact O-N 3.15Å; E70-S81 CarbonylContact O-C 2.97Å; E70-S81 WeakPolarHBondContact O-CA 3.41Å; E70-S81 WeakPolarHBondContact O-CB 3.3Å; E70-S82 WeakPolarHBondContact CG-OG 3.42Å; E70-S82 PolarHBondContact O-N 2.89Å
71	T	89.1	Confident	83.1	Confident	51 Å²	51	46.7 Å²	46.7	31%	0.313	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	112	174.7	-63.6	0	0	0	0	110.3	T74 V79 S81	T71-T74 HydrophobicContact CG2-CG2 3.84Å; T71-V79 HydrophobicContact CG2-CG1 3.57Å; T71-S81 WeakPolarHBondContact CA-OG 3.4Å; T71-S81 PolarHBondContact OG1-OG 2.79Å; T71-S81 VanDerWaalsContact OG1-OG 3.11Å
72	I	85.1	Confident	83.6	Confident	42 Å²	42	43 Å²	43	22%	0.215	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-16.8	-176.9	61.8	175.8	0	0	0	113.3	E70 V80 A93 L150 A992 Y994	E70-I72 HydrophobicContact CG-CG2 4.14Å; E70-I72 PolarHBondContact O-N 3.15Å; I72-V80 HydrophobicContact CD1-CG1 4.16Å; I72-V80 HydrophobicContact CG1-CB 4.32Å; I72-V80 HydrophobicContact CG1-CG1 4.11Å; I72-V80 WeakPolarHBondContact CG1-O 3.43Å; I72-V80 PolarHBondContact N-O 3.29Å; I72-A93 HydrophobicContact CD1-CB 4.16Å; I72-L150 HydrophobicContact CD1-CD1 3.65Å; I72-A992 WeakPolarHBondContact O-CB 3.48Å; I72-Y994 HydrophobicContact CD1-CD2 4.32Å; I72-Y994 HydrophobicContact CD1-CE2 3.71Å
73	G	79.1	Confident	84.2	Confident	5 Å²	5	42.4 Å²	42.4	5%	0.052	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.6	158.3	171.1	0	0	0	0	0	116.5	V80 S990	G73-V80 PolarHBondContact N-O 3.41Å; G73-V80 PolarHBondContact O-N 2.61Å; G73-S990 WeakPolarHBondContact CA-O 3.44Å
74	T	75.2	Confident	84.8	Confident	37 Å²	37	44.7 Å²	44.7	23%	0.227	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	155.9	-175	51	0	0	0	0	113.5	S55 T71 V79 S990 G991	S55-T74 VanDerWaalsContact OG-CG2 3.22Å; S55-T74 WeakPolarHBondContact OG-CG2 3.46Å; T71-T74 HydrophobicContact CG2-CG2 3.84Å; T74-V79 HydrophobicContact CG2-CB 4.31Å; T74-V79 HydrophobicContact CG2-CG1 3.95Å; T74-V79 HydrophobicContact CG2-CG2 3.86Å; T74-S990 PolarHBondContact N-O 3.34Å; T74-G991 PolarHBondContact O-N 2.94Å
75	G	68.3	Low	85.3	Confident	31 Å²	31	38.4 Å²	38.4	32%	0.32	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	174.9	-162.5	165.3	0	0	0	0	0	112.3	Y77 G78 V996	G75-Y77 VanDerWaalsContact C-N 3.28Å; G75-Y77 PolarHBondContact O-N 3.18Å; G75-G78 PolarHBondContact N-O 2.63Å; G75-G78 VanDerWaalsContact N-O 3.11Å; G75-G78 PolarHBondContact O-N 3.32Å; G75-G78 VanDerWaalsContact O-O 3.13Å; G75-V996 CarbonylContact C-O 3.59Å; G75-V996 WeakPolarHBondContact CA-O 3.29Å
76	A	60.6	Low	85.4	Confident	56 Å²	56	41.1 Å²	41.1	46%	0.463	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-37.9	-171.9	0	0	0	0	0	114.6	V996 F998	A76-V996 PolarHBondContact N-O 3.18Å; A76-F998 HydrophobicContact CB-CB 4.42Å; A76-F998 HydrophobicContact CB-CD2 3.8Å; A76-F998 HydrophobicContact CB-CE2 4.38Å; A76-F998 HydrophobicContact CB-CG 4.25Å
77	Y	63.1	Low	85.3	Confident	25 Å²	25	45.7 Å²	45.7	10%	0.098	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	3.8	-172.7	-49.4	-85.6	0	0	0	113.9	G75 N106 R109 V996 G997 D1002	G75-Y77 VanDerWaalsContact C-N 3.28Å; G75-Y77 PolarHBondContact O-N 3.18Å; Y77-N106 VanDerWaalsContact CE1-OD1 3.31Å; Y77-N106 WeakPolarHBondContact CE1-OD1 3.4Å; Y77-R109 VanDerWaalsContact CE2-NH1 3.25Å; Y77-R109 PolarHBondContact OH-NH1 3.08Å; Y77-R109 VanDerWaalsContact OH-NH1 3.15Å; Y77-V996 PolarHBondContact N-O 3.4Å; Y77-G997 WeakPolarHBondContact CD2-O 3.22Å; Y77-G997 WeakPolarHBondContact CE2-O 3.22Å; Y77-D1002 PolarHBondContact OH-OD2 2.78Å
78	G	78.6	Confident	85.3	Confident	7 Å²	7	46.7 Å²	46.7	7%	0.072	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.4	-168.1	174	0	0	0	0	0	116.1	G75 K96	G75-G78 PolarHBondContact N-O 2.63Å; G75-G78 VanDerWaalsContact N-O 3.11Å; G75-G78 PolarHBondContact O-N 3.32Å; G75-G78 VanDerWaalsContact O-O 3.13Å; G78-K96 WeakPolarHBondContact CA-O 3.39Å
79	V	88	Confident	85.2	Confident	13 Å²	13	45.6 Å²	45.6	8%	0.079	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	139.4	179.2	177.9	0	0	0	0	109.1	V58 F60 T71 T74 K96	V58-V79 HydrophobicContact CB-CG2 4.29Å; V58-V79 HydrophobicContact CG1-CB 4.29Å; V58-V79 HydrophobicContact CG1-CG2 4.1Å; V58-V79 HydrophobicContact CG2-CG2 3.94Å; F60-V79 HydrophobicContact CE2-CB 4.45Å; F60-V79 HydrophobicContact CE2-CG1 3.84Å; F60-V79 HydrophobicContact CZ-CB 4.19Å; F60-V79 HydrophobicContact CZ-CG1 3.84Å; T71-V79 HydrophobicContact CG2-CG1 3.57Å; T74-V79 HydrophobicContact CG2-CB 4.31Å; T74-V79 HydrophobicContact CG2-CG1 3.95Å; T74-V79 HydrophobicContact CG2-CG2 3.86Å; V79-K96 PolarHBondContact N-O 3.5Å; V79-K96 PolarHBondContact O-N 2.81Å
80	V	90.8	Very high	85.3	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127.8	177.2	-166.6	0	0	0	0	109.7	I72 G73 A93 I94 K95 Y994 V996	I72-V80 HydrophobicContact CD1-CG1 4.16Å; I72-V80 HydrophobicContact CG1-CB 4.32Å; I72-V80 HydrophobicContact CG1-CG1 4.11Å; I72-V80 WeakPolarHBondContact CG1-O 3.43Å; I72-V80 PolarHBondContact N-O 3.29Å; G73-V80 PolarHBondContact N-O 3.41Å; G73-V80 PolarHBondContact O-N 2.61Å; V80-A93 HydrophobicContact CG1-CB 4.04Å; V80-I94 WeakPolarHBondContact CA-O 3.32Å; V80-K95 HydrophobicContact CG1-CB 4.48Å; V80-K95 HydrophobicContact CG2-CB 3.99Å; V80-K95 HydrophobicContact CG2-CG 4.03Å; V80-Y994 HydrophobicContact CB-CD2 4.34Å; V80-Y994 HydrophobicContact CG1-CD2 3.75Å; V80-Y994 HydrophobicContact CG1-CE2 4.27Å; V80-Y994 HydrophobicContact CG1-CG 3.96Å; V80-Y994 HydrophobicContact CG2-CG 4.35Å; V80-V996 HydrophobicContact CG2-CG1 3.63Å; V80-V996 HydrophobicContact CG2-CG2 4.26Å
81	S	91.6	Very high	85.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	143.8	178.2	-57.1	0	0	0	0	110.5	F60 E70 T71 I94	F60-S81 WeakPolarHBondContact CE2-OG 3.46Å; F60-S81 VanDerWaalsContact CZ-OG 3.22Å; F60-S81 WeakPolarHBondContact CZ-OG 3.29Å; E70-S81 CarbonylContact O-C 2.97Å; E70-S81 WeakPolarHBondContact O-CA 3.41Å; E70-S81 WeakPolarHBondContact O-CB 3.3Å; T71-S81 WeakPolarHBondContact CA-OG 3.4Å; T71-S81 PolarHBondContact OG1-OG 2.79Å; T71-S81 VanDerWaalsContact OG1-OG 3.11Å; S81-I94 PolarHBondContact N-O 3.49Å; S81-I94 VanDerWaalsContact N-O 3.11Å; S81-I94 PolarHBondContact O-N 3.37Å
82	S	93	Very high	85.8	Confident	4 Å²	4	42.3 Å²	42.3	3%	0.028	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	143.8	167.5	71.2	0	0	0	0	108.9	I69 E70	I69-S82 PolarHBondContact N-O 3.28Å; E70-S82 WeakPolarHBondContact CG-OG 3.42Å; E70-S82 PolarHBondContact O-N 2.89Å
83	A	94.4	Very high	86.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	161.4	-179	0	0	0	0	0	111.1	D67 Q91 V92 I94	D67-A83 CarbonylContact O-C 3.49Å; D67-A83 WeakPolarHBondContact O-CA 3.46Å; D67-A83 WeakPolarHBondContact O-CB 3.38Å; A83-Q91 CarbonylContact O-C 3.49Å; A83-Q91 WeakPolarHBondContact O-CA 3.21Å; A83-V92 HydrophobicContact CB-CG2 4.05Å; A83-V92 PolarHBondContact N-O 3.23Å; A83-V92 PolarHBondContact O-N 3.04Å; A83-I94 HydrophobicContact CB-CD1 3.52Å; A83-I94 HydrophobicContact CB-CG1 3.85Å
84	R	94.5	Very high	87	Confident	95 Å²	95	40 Å²	40	36%	0.358	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125.5	174.2	-168.2	178.7	-57.4	-73.5	-2.5	109.6	Y66 D67 I69 G89 Q90	Y66-R84 WeakPolarHBondContact CA-O 3.42Å; D67-R84 PolarHBondContact N-O 2.7Å; D67-R84 PolarHBondContact O-N 2.62Å; I69-R84 HydrophobicContact CD1-CB 4.29Å; R84-G89 WeakPolarHBondContact CG-O 3Å; R84-G89 PolarHBondContact NH1-O 2.68Å; R84-Q90 CarbonylContact C-O 3.55Å; R84-Q90 WeakPolarHBondContact CA-O 3.49Å
85	R	94	Very high	87.8	Confident	34 Å²	34	38.3 Å²	38.3	13%	0.128	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	126.3	175.1	-164	169	169.8	-88.9	-18.4	109.6	E65 Y66 D87 G89 Q90	E65-R85 HydrophobicContact CG-CG 4.1Å; E65-R85 CarbonylContact O-C 3.59Å; E65-R85 WeakPolarHBondContact O-CA 3.41Å; E65-R85 IonicContact OE1-CZ 3.57Å; E65-R85 IonicContact OE1-NE 2.66Å; E65-R85 PolarHBondContact OE1-NE 3.46Å; E65-R85 IonicContact OE1-NH2 3.27Å; E65-R85 PolarHBondContact OE1-NH2 3.07Å; Y66-R85 HydrophobicContact CD1-CB 3.92Å; Y66-R85 HydrophobicContact CD1-CG 4Å; Y66-R85 HydrophobicContact CE1-CB 3.77Å; Y66-R85 HydrophobicContact CE1-CG 3.57Å; R85-D87 VanDerWaalsContact CZ-CG 3.46Å; R85-D87 IonicContact CZ-OD1 2.79Å; R85-D87 IonicContact CZ-OD2 2.78Å; R85-D87 IonicContact NE-OD1 2.7Å; R85-D87 IonicContact NH1-OD1 2.76Å; R85-D87 PolarHBondContact NH1-OD1 3.44Å; R85-D87 IonicContact NH1-OD2 3.66Å; R85-D87 PolarHBondContact NH1-OD2 3.18Å; R85-D87 IonicContact NH2-OD1 3.99Å; R85-D87 IonicContact NH2-OD2 3.68Å; R85-D87 PolarHBondContact NH2-OD2 3.13Å; R85-D87 PolarHBondContact O-N 2.97Å; R85-G89 VanDerWaalsContact O-CA 3.3Å; R85-G89 WeakPolarHBondContact O-CA 3.44Å; R85-G89 PolarHBondContact O-N 3.15Å; R85-Q90 PolarHBondContact N-O 3.46Å
86	R	91.6	Very high	88.9	Confident	133 Å²	133	37.8 Å²	37.8	50%	0.502	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-30.7	-167.2	-68.8	-153.6	-177.4	141.3	-6.6	114.9	E64 E65 D67 N88	E64-R86 WeakPolarHBondContact O-CD 3.41Å; E64-R86 PolarHBondContact O-NH1 3.19Å; E65-R86 PolarHBondContact O-N 3.43Å; D67-R86 IonicContact OD1-CZ 2.79Å; D67-R86 IonicContact OD1-NE 2.74Å; D67-R86 PolarHBondContact OD1-NE 3.13Å; D67-R86 IonicContact OD1-NH2 2.73Å; D67-R86 PolarHBondContact OD1-NH2 3.46Å; D67-R86 VanDerWaalsContact OD2-CG 3.31Å; D67-R86 WeakPolarHBondContact OD2-CG 3.39Å; D67-R86 IonicContact OD2-NE 2.79Å; D67-R86 PolarHBondContact OD2-NE 3.02Å; R86-N88 PolarHBondContact O-N 3.48Å
87	D	90.7	Very high	90.3	Very high	101 Å²	101	35.6 Å²	35.6	54%	0.54	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-23.5	-174.6	74.1	-22.7	0	0	0	114.1	R85	R85-D87 VanDerWaalsContact CZ-CG 3.46Å; R85-D87 IonicContact CZ-OD1 2.79Å; R85-D87 IonicContact CZ-OD2 2.78Å; R85-D87 IonicContact NE-OD1 2.7Å; R85-D87 IonicContact NH1-OD1 2.76Å; R85-D87 PolarHBondContact NH1-OD1 3.44Å; R85-D87 IonicContact NH1-OD2 3.66Å; R85-D87 PolarHBondContact NH1-OD2 3.18Å; R85-D87 IonicContact NH2-OD1 3.99Å; R85-D87 IonicContact NH2-OD2 3.68Å; R85-D87 PolarHBondContact NH2-OD2 3.13Å; R85-D87 PolarHBondContact O-N 2.97Å
88	N	91.6	Very high	91.4	Very high	84 Å²	84	36.9 Å²	36.9	45%	0.449	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-138	-3.6	-173.6	72	-1.1	0	0	0	114.5	R86 Q90	R86-N88 PolarHBondContact O-N 3.48Å; N88-Q90 PolarHBondContact ND2-OE1 3.28Å; N88-Q90 PolarHBondContact O-N 3.07Å; N88-Q90 WeakPolarHBondContact OD1-CB 3.46Å; N88-Q90 PolarHBondContact OD1-N 2.76Å
89	G	90.9	Very high	91.6	Very high	34 Å²	34	39.9 Å²	39.9	35%	0.351	20%	0.2	S	C	.	.			trans	72.5	6.9	-179.5	0	0	0	0	0	115.2	R84 R85	R84-G89 WeakPolarHBondContact CG-O 3Å; R84-G89 PolarHBondContact NH1-O 2.68Å; R85-G89 VanDerWaalsContact O-CA 3.3Å; R85-G89 WeakPolarHBondContact O-CA 3.44Å; R85-G89 PolarHBondContact O-N 3.15Å
90	Q	92.9	Very high	91.3	Very high	85 Å²	85	39.4 Å²	39.4	40%	0.397	20%	0.197	S	C	.	.			trans	-68.3	134.4	-176	-178.5	177.8	-2.5	0	0	111.5	R84 R85 N88 V92	R84-Q90 CarbonylContact C-O 3.55Å; R84-Q90 WeakPolarHBondContact CA-O 3.49Å; R85-Q90 PolarHBondContact N-O 3.46Å; N88-Q90 PolarHBondContact ND2-OE1 3.28Å; N88-Q90 PolarHBondContact O-N 3.07Å; N88-Q90 WeakPolarHBondContact OD1-CB 3.46Å; N88-Q90 PolarHBondContact OD1-N 2.76Å; Q90-V92 HydrophobicContact CG-CG1 4.47Å
91	Q	94	Very high	91.1	Very high	98 Å²	98	39.7 Å²	39.7	46%	0.458	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	140.7	172.1	-77.6	164.5	-101.8	0	0	111.5	A83 L150	A83-Q91 CarbonylContact O-C 3.49Å; A83-Q91 WeakPolarHBondContact O-CA 3.21Å; Q91-L150 HydrophobicContact CB-CD2 3.83Å
92	V	94.8	Very high	90.8	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.018	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	163	-177.5	-65	0	0	0	0	109.6	Y66 A83 Q90 I94 V147 L148	Y66-V92 HydrophobicContact CD1-CG2 3.93Å; Y66-V92 HydrophobicContact CE1-CG2 3.93Å; A83-V92 HydrophobicContact CB-CG2 4.05Å; A83-V92 PolarHBondContact N-O 3.23Å; A83-V92 PolarHBondContact O-N 3.04Å; Q90-V92 HydrophobicContact CG-CG1 4.47Å; V92-I94 HydrophobicContact CG2-CG1 4.3Å; V92-V147 HydrophobicContact CB-CG1 3.68Å; V92-V147 HydrophobicContact CG1-CG1 3.99Å; V92-V147 HydrophobicContact CG2-CG1 3.68Å; V92-L148 WeakPolarHBondContact CB-O 3.28Å
93	A	94.8	Very high	90.4	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	139.5	165	0	0	0	0	0	109.8	I72 V80 V147 L148 L150 Y994	I72-A93 HydrophobicContact CD1-CB 4.16Å; V80-A93 HydrophobicContact CG1-CB 4.04Å; A93-V147 CarbonylContact O-C 3.59Å; A93-V147 WeakPolarHBondContact O-CA 3.39Å; A93-L148 HydrophobicContact CB-CB 4.48Å; A93-L148 PolarHBondContact N-O 2.91Å; A93-L148 VanDerWaalsContact N-O 3.08Å; A93-L148 PolarHBondContact O-N 3.48Å; A93-L150 HydrophobicContact CB-CD1 4.09Å; A93-Y994 HydrophobicContact CB-CE1 3.77Å; A93-Y994 HydrophobicContact CB-CE2 3.96Å; A93-Y994 VanDerWaalsContact CB-CZ 3.44Å; A93-Y994 WeakPolarHBondContact CB-OH 3.22Å
94	I	94.1	Very high	90.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	109.1	175.6	-54.6	-175.1	0	0	0	108.8	F60 V62 Y66 V80 S81 A83 V92 Y145 V146 V147	F60-I94 HydrophobicContact CD1-CG2 4.2Å; F60-I94 HydrophobicContact CE1-CB 4.42Å; F60-I94 HydrophobicContact CE1-CG2 4.12Å; V62-I94 HydrophobicContact CB-CD1 4.4Å; V62-I94 HydrophobicContact CG1-CD1 3.92Å; V62-I94 HydrophobicContact CG1-CG2 4.13Å; Y66-I94 HydrophobicContact CD1-CD1 4.04Å; Y66-I94 HydrophobicContact CG-CD1 3.93Å; V80-I94 WeakPolarHBondContact CA-O 3.32Å; S81-I94 PolarHBondContact N-O 3.49Å; S81-I94 VanDerWaalsContact N-O 3.11Å; S81-I94 PolarHBondContact O-N 3.37Å; A83-I94 HydrophobicContact CB-CD1 3.52Å; A83-I94 HydrophobicContact CB-CG1 3.85Å; V92-I94 HydrophobicContact CG2-CG1 4.3Å; I94-Y145 HydrophobicContact CG2-CD1 4.19Å; I94-V146 CarbonylContact C-O 3.6Å; I94-V146 WeakPolarHBondContact CA-O 3.16Å; I94-V147 HydrophobicContact CG1-CG1 4.39Å; I94-V147 HydrophobicContact CG1-CG2 4.24Å
95	K	92.5	Very high	89.6	Confident	1 Å²	1	48.6 Å²	48.6	0%	0.004	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	108.9	173.5	177.9	179	-178	169.5	0	109.1	V80 I97 E113 Y145 V146 L148 Y994 G995 V996	V80-K95 HydrophobicContact CG1-CB 4.48Å; V80-K95 HydrophobicContact CG2-CB 3.99Å; V80-K95 HydrophobicContact CG2-CG 4.03Å; K95-I97 HydrophobicContact CD-CD1 4.48Å; K95-I97 HydrophobicContact CD-CG1 4.34Å; K95-I97 HydrophobicContact CG-CG1 4.07Å; K95-E113 IonicContact NZ-OE1 2.65Å; K95-E113 PolarHBondContact NZ-OE1 3.13Å; K95-E113 IonicContact NZ-OE2 2.68Å; K95-E113 PolarHBondContact NZ-OE2 2.95Å; K95-Y145 WeakPolarHBondContact O-CA 3.48Å; K95-V146 HydrophobicContact CB-CB 4.46Å; K95-V146 PolarHBondContact N-O 3.28Å; K95-V146 PolarHBondContact O-N 2.94Å; K95-L148 HydrophobicContact CB-CD1 4.34Å; K95-Y994 WeakPolarHBondContact CD-O 3.46Å; K95-Y994 VanDerWaalsContact CE-O 3.25Å; K95-Y994 WeakPolarHBondContact CE-O 3.45Å; K95-Y994 PolarHBondContact NZ-O 3.31Å; K95-G995 PolarHBondContact NZ-O 3.38Å; K95-V996 HydrophobicContact CG-CG1 4.32Å
96	K	91.4	Very high	89.2	Confident	20 Å²	20	49 Å²	49	9%	0.087	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	109.7	168.6	-179.7	-174.4	-176.9	178.5	0	109.2	V58 K59 F60 G78 V79 S98 V144 Y145	V58-K96 HydrophobicContact CG1-CD 3.78Å; K59-K96 PolarHBondContact O-NZ 2.78Å; F60-K96 HydrophobicContact CD1-CB 4.2Å; F60-K96 HydrophobicContact CE1-CB 3.52Å; F60-K96 HydrophobicContact CZ-CB 3.82Å; G78-K96 WeakPolarHBondContact CA-O 3.39Å; V79-K96 PolarHBondContact N-O 3.5Å; V79-K96 PolarHBondContact O-N 2.81Å; K96-S98 WeakPolarHBondContact CE-OG 3.25Å; K96-S98 PolarHBondContact O-N 3.47Å; K96-V144 WeakPolarHBondContact CA-O 3.35Å; K96-Y145 HydrophobicContact CB-CD1 3.81Å; K96-Y145 HydrophobicContact CB-CE1 3.76Å; K96-Y145 HydrophobicContact CD-CD1 4.5Å; K96-Y145 HydrophobicContact CD-CE1 3.62Å; K96-Y145 WeakPolarHBondContact CE-OH 3.4Å; K96-Y145 HydrophobicContact CG-CD1 3.93Å; K96-Y145 HydrophobicContact CG-CE1 3.5Å
97	I	89.1	Confident	89.1	Confident	10 Å²	10	42.7 Å²	42.7	5%	0.051	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	93.2	168.8	-52.1	175.6	0	0	0	106.4	K95 A100 T110 S143 V144	K95-I97 HydrophobicContact CD-CD1 4.48Å; K95-I97 HydrophobicContact CD-CG1 4.34Å; K95-I97 HydrophobicContact CG-CG1 4.07Å; I97-A100 HydrophobicContact CB-CB 4.25Å; I97-A100 HydrophobicContact CG2-CB 3.6Å; I97-T110 HydrophobicContact CD1-CG2 3.7Å; I97-S143 CarbonylContact O-C 3.43Å; I97-S143 VanDerWaalsContact O-CA 3.27Å; I97-S143 WeakPolarHBondContact O-CA 3.38Å; I97-V144 HydrophobicContact CB-CB 4.37Å; I97-V144 PolarHBondContact N-O 2.93Å; I97-V144 PolarHBondContact O-N 3.47Å
98	S	85.8	Confident	89	Confident	52 Å²	52	39.5 Å²	39.5	36%	0.364	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	143.2	175.1	-63.5	0	0	0	0	110.5	K96 A100	K96-S98 WeakPolarHBondContact CE-OG 3.25Å; K96-S98 PolarHBondContact O-N 3.47Å; S98-A100 PolarHBondContact O-N 2.68Å; S98-A100 VanDerWaalsContact O-N 3.07Å
99	N	83.1	Confident	88.8	Confident	69 Å²	69	36.2 Å²	36.2	37%	0.369	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	37.7	175.2	-65.3	6.5	0	0	0	114.3	F101 E102 K142	N99-F101 PolarHBondContact O-N 2.73Å; N99-E102 HydrophobicContact CB-CB 4.29Å; N99-E102 HydrophobicContact CB-CG 3.99Å; N99-E102 WeakPolarHBondContact CB-OE2 3.43Å; N99-E102 VanDerWaalsContact CG-OE2 3.31Å; N99-E102 VanDerWaalsContact ND2-CD 3.26Å; N99-E102 PolarHBondContact ND2-OE1 2.93Å; N99-E102 PolarHBondContact ND2-OE2 2.84Å; N99-E102 PolarHBondContact O-N 2.89Å; N99-K142 CarbonylContact C-O 3.59Å; N99-K142 WeakPolarHBondContact CA-O 3.42Å; N99-K142 PolarHBondContact N-O 3.25Å
100	A	82.8	Confident	88.8	Confident	3 Å²	3	34.9 Å²	34.9	3%	0.025	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-15	-169.5	0	0	0	0	0	115.5	I97 S98 A107 K142 V144	I97-A100 HydrophobicContact CB-CB 4.25Å; I97-A100 HydrophobicContact CG2-CB 3.6Å; S98-A100 PolarHBondContact O-N 2.68Å; S98-A100 VanDerWaalsContact O-N 3.07Å; A100-A107 VanDerWaalsContact O-CA 3.26Å; A100-A107 WeakPolarHBondContact O-CA 3.43Å; A100-A107 WeakPolarHBondContact O-CB 3.31Å; A100-A107 PolarHBondContact O-N 3.35Å; A100-K142 PolarHBondContact N-O 3.01Å; A100-V144 HydrophobicContact CB-CG2 3.81Å
101	F	85.9	Confident	88.8	Confident	8 Å²	8	31 Å²	31	4%	0.035	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-4.8	-178.4	-40.4	-67.3	0	0	0	113	N99 V103 F141 V144 K385 K389 I392	N99-F101 PolarHBondContact O-N 2.73Å; F101-V103 PolarHBondContact O-N 3.16Å; F101-F141 HydrophobicContact CE1-CE1 4.33Å; F101-F141 AromaticContact CE2-CD1 3.7Å; F101-F141 HydrophobicContact CE2-CD1 3.7Å; F101-F141 AromaticContact CE2-CE1 3.76Å; F101-F141 HydrophobicContact CE2-CE1 3.76Å; F101-F141 HydrophobicContact CE2-CG 4.19Å; F101-F141 HydrophobicContact CE2-CZ 4.28Å; F101-F141 WeakPolarHBondContact CE2-O 3.46Å; F101-F141 AromaticContact CZ-CD1 3.71Å; F101-F141 HydrophobicContact CZ-CD1 3.71Å; F101-F141 AromaticContact CZ-CE1 3.31Å; F101-F141 HydrophobicContact CZ-CE1 3.31Å; F101-F141 AromaticContact CZ-CZ 3.85Å; F101-F141 HydrophobicContact CZ-CZ 3.85Å; F101-V144 HydrophobicContact CE1-CG2 4.33Å; F101-V144 HydrophobicContact CZ-CG2 3.74Å; F101-K385 HydrophobicContact CB-CG 4.49Å; F101-K385 WeakPolarHBondContact O-CD 3.12Å; F101-K385 WeakPolarHBondContact O-CE 3.22Å; F101-K385 WeakPolarHBondContact O-CG 3.22Å; F101-K389 HydrophobicContact CB-CB 4.48Å; F101-K389 HydrophobicContact CB-CD 4.42Å; F101-K389 HydrophobicContact CD1-CB 3.61Å; F101-K389 HydrophobicContact CD1-CD 4.31Å; F101-K389 HydrophobicContact CD1-CG 3.85Å; F101-K389 HydrophobicContact CD2-CD 3.92Å; F101-K389 HydrophobicContact CD2-CG 4.2Å; F101-K389 HydrophobicContact CE1-CB 4.04Å; F101-K389 HydrophobicContact CE1-CG 3.95Å; F101-K389 HydrophobicContact CE2-CD 4.33Å; F101-K389 HydrophobicContact CE2-CG 4.3Å; F101-K389 HydrophobicContact CG-CB 3.99Å; F101-K389 HydrophobicContact CG-CD 3.93Å; F101-K389 HydrophobicContact CG-CG 3.99Å; F101-K389 HydrophobicContact CZ-CG 4.2Å; F101-I392 HydrophobicContact CD1-CD1 4.24Å; F101-I392 HydrophobicContact CE1-CB 4.17Å; F101-I392 HydrophobicContact CE1-CD1 3.73Å; F101-I392 HydrophobicContact CE1-CG2 4.09Å; F101-I392 HydrophobicContact CZ-CG2 4.38Å
102	E	84.6	Confident	88.7	Confident	82 Å²	82	26.8 Å²	26.8	38%	0.383	15%	0.148	S	C	.	.	S	Bend	trans	-68.8	-38.8	-171.7	-76.5	179.8	179.5	0	0	112.3	N99 K142 K385	N99-E102 HydrophobicContact CB-CB 4.29Å; N99-E102 HydrophobicContact CB-CG 3.99Å; N99-E102 WeakPolarHBondContact CB-OE2 3.43Å; N99-E102 VanDerWaalsContact CG-OE2 3.31Å; N99-E102 VanDerWaalsContact ND2-CD 3.26Å; N99-E102 PolarHBondContact ND2-OE1 2.93Å; N99-E102 PolarHBondContact ND2-OE2 2.84Å; N99-E102 PolarHBondContact O-N 2.89Å; E102-K142 IonicContact OE1-NZ 2.78Å; E102-K142 PolarHBondContact OE1-NZ 3.39Å; E102-K385 PolarHBondContact O-NZ 3Å
103	V	85.9	Confident	88.6	Confident	55 Å²	55	27.2 Å²	27.2	33%	0.333	15%	0.149	S	C	.	.	S	Bend	trans	-110.9	130	174.9	-170.1	0	0	0	0	110.7	F101 T105 N106 A107	F101-V103 PolarHBondContact O-N 3.16Å; V103-T105 WeakPolarHBondContact CG1-OG1 3.11Å; V103-T105 PolarHBondContact O-N 3.37Å; V103-N106 HydrophobicContact CB-CB 4.3Å; V103-N106 PolarHBondContact O-N 3.04Å; V103-A107 PolarHBondContact O-N 2.83Å
104	V	87.2	Confident	88.6	Confident	65 Å²	65	27.4 Å²	27.4	39%	0.394	15%	0.151	S	C	.	.	H	α-helix	trans	-62	-37.9	-174.2	174.5	0	0	0	0	113	A107 K108 K385 I388	V104-A107 PolarHBondContact O-N 3.28Å; V104-K108 PolarHBondContact O-N 3.29Å; V104-K385 HydrophobicContact CG2-CB 4.45Å; V104-I388 HydrophobicContact CG1-CD1 3.79Å
105	T	84.2	Confident	88.6	Confident	84 Å²	84	29.7 Å²	29.7	52%	0.515	16%	0.16	S	C	.	.	H	α-helix	trans	-62.7	-44.1	176.8	52.8	0	0	0	0	111.7	V103 K108 R109	V103-T105 WeakPolarHBondContact CG1-OG1 3.11Å; V103-T105 PolarHBondContact O-N 3.37Å; T105-K108 PolarHBondContact O-N 3.44Å; T105-R109 WeakPolarHBondContact O-CB 3.41Å; T105-R109 PolarHBondContact O-N 3.43Å
106	N	84.8	Confident	88.7	Confident	42 Å²	42	29.6 Å²	29.6	23%	0.225	16%	0.16	C	C	.	.	H	α-helix	trans	-70.1	-34.8	178	-67.4	-17	0	0	0	112.2	Y77 V103 R109 T110	Y77-N106 VanDerWaalsContact CE1-OD1 3.31Å; Y77-N106 WeakPolarHBondContact CE1-OD1 3.4Å; V103-N106 HydrophobicContact CB-CB 4.3Å; V103-N106 PolarHBondContact O-N 3.04Å; N106-R109 WeakPolarHBondContact O-CB 3.25Å; N106-R109 PolarHBondContact O-N 2.88Å; N106-T110 WeakPolarHBondContact O-CB 3.37Å; N106-T110 PolarHBondContact O-N 3.3Å; N106-T110 PolarHBondContact O-OG1 3.32Å
107	A	89.3	Confident	88.9	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.8	-47.9	171.6	0	0	0	0	0	111.1	A100 V103 V104 R109 T110 L111 I388	A100-A107 VanDerWaalsContact O-CA 3.26Å; A100-A107 WeakPolarHBondContact O-CA 3.43Å; A100-A107 WeakPolarHBondContact O-CB 3.31Å; A100-A107 PolarHBondContact O-N 3.35Å; V103-A107 PolarHBondContact O-N 2.83Å; V104-A107 PolarHBondContact O-N 3.28Å; A107-R109 PolarHBondContact O-N 3.07Å; A107-T110 PolarHBondContact O-N 2.94Å; A107-L111 PolarHBondContact O-N 3.38Å; A107-I388 HydrophobicContact CB-CB 4.17Å; A107-I388 HydrophobicContact CB-CD1 4.23Å; A107-I388 HydrophobicContact CB-CG2 3.54Å
108	K	88.6	Confident	89.2	Confident	35 Å²	35	30.2 Å²	30.2	15%	0.152	16%	0.163	C	C	.	.	H	α-helix	trans	-61.4	-41	173.1	-78.4	-157.6	170.1	-164.5	0	112.1	V104 T105 T110 L111 R112 D379 L381 I388	V104-K108 PolarHBondContact O-N 3.29Å; T105-K108 PolarHBondContact O-N 3.44Å; K108-T110 VanDerWaalsContact C-N 3.34Å; K108-T110 PolarHBondContact O-N 2.59Å; K108-L111 PolarHBondContact O-N 3.45Å; K108-R112 VanDerWaalsContact O-CB 3.26Å; K108-R112 WeakPolarHBondContact O-CB 3.5Å; K108-R112 PolarHBondContact O-N 2.69Å; K108-D379 PolarHBondContact NZ-O 2.79Å; K108-L381 PolarHBondContact NZ-O 3.04Å; K108-I388 HydrophobicContact CG-CD1 3.71Å; K108-I388 HydrophobicContact CG-CG1 4.35Å
109	R	88.4	Confident	89.6	Confident	14 Å²	14	30.3 Å²	30.3	5%	0.053	16%	0.157	C	C	.	.	H	α-helix	trans	-55.3	-48.3	173.7	-171.7	-176.3	-176.9	140.8	6.1	111.2	Y77 T105 N106 A107 R112 E113 D211 G213 M214	Y77-R109 VanDerWaalsContact CE2-NH1 3.25Å; Y77-R109 PolarHBondContact OH-NH1 3.08Å; Y77-R109 VanDerWaalsContact OH-NH1 3.15Å; T105-R109 WeakPolarHBondContact O-CB 3.41Å; T105-R109 PolarHBondContact O-N 3.43Å; N106-R109 WeakPolarHBondContact O-CB 3.25Å; N106-R109 PolarHBondContact O-N 2.88Å; A107-R109 PolarHBondContact O-N 3.07Å; R109-R112 PolarHBondContact O-N 3.33Å; R109-E113 WeakPolarHBondContact O-CB 3.44Å; R109-E113 PolarHBondContact O-N 2.7Å; R109-D211 IonicContact CZ-OD1 3.87Å; R109-D211 IonicContact CZ-OD2 3.77Å; R109-D211 IonicContact NE-OD1 3.29Å; R109-D211 IonicContact NH2-OD1 2.85Å; R109-D211 PolarHBondContact NH2-OD1 3.22Å; R109-D211 IonicContact NH2-OD2 3.14Å; R109-D211 PolarHBondContact NH2-OD2 3.34Å; R109-G213 VanDerWaalsContact CG-CA 3.48Å; R109-M214 HydrophobicContact CG-CE 4.22Å
110	T	90.9	Very high	90.2	Very high	7 Å²	7	27.4 Å²	27.4	4%	0.043	14%	0.141	C	C	.	.	H	α-helix	trans	-64.3	-47.4	179.8	-57.6	0	0	0	0	112	I97 N106 A107 K108 R112 E113 L114 V144 I392	I97-T110 HydrophobicContact CD1-CG2 3.7Å; N106-T110 WeakPolarHBondContact O-CB 3.37Å; N106-T110 PolarHBondContact O-N 3.3Å; N106-T110 PolarHBondContact O-OG1 3.32Å; A107-T110 PolarHBondContact O-N 2.94Å; K108-T110 VanDerWaalsContact C-N 3.34Å; K108-T110 PolarHBondContact O-N 2.59Å; T110-R112 VanDerWaalsContact C-N 3.31Å; T110-R112 PolarHBondContact O-N 3.45Å; T110-E113 PolarHBondContact O-N 3.3Å; T110-L114 HydrophobicContact CG2-CD1 4.17Å; T110-L114 WeakPolarHBondContact O-CB 3.36Å; T110-L114 VanDerWaalsContact O-CG 3.31Å; T110-L114 WeakPolarHBondContact O-CG 3.4Å; T110-L114 PolarHBondContact O-N 3.49Å; T110-V144 HydrophobicContact CG2-CG2 4.48Å; T110-I392 HydrophobicContact CG2-CD1 3.9Å
111	L	92.4	Very high	90.8	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-60.1	-41.4	177.2	179.7	61.1	0	0	0	111.9	A107 K108 K115 F378 M383 I388 A391 I392 E395	A107-L111 PolarHBondContact O-N 3.38Å; K108-L111 PolarHBondContact O-N 3.45Å; L111-K115 HydrophobicContact CD1-CD 4.18Å; L111-K115 HydrophobicContact CD1-CG 4.4Å; L111-K115 HydrophobicContact CG-CD 4.26Å; L111-K115 WeakPolarHBondContact O-CB 3.42Å; L111-K115 WeakPolarHBondContact O-CG 3.27Å; L111-K115 PolarHBondContact O-N 2.84Å; L111-F378 HydrophobicContact CD2-CD2 4.06Å; L111-F378 HydrophobicContact CD2-CE2 4.33Å; L111-F378 HydrophobicContact CG-CD2 4.31Å; L111-F378 HydrophobicContact CG-CE2 4.17Å; L111-M383 HydrophobicContact CD2-CE 4.18Å; L111-I388 HydrophobicContact CB-CG2 4.26Å; L111-I388 HydrophobicContact CD2-CG2 4.24Å; L111-A391 HydrophobicContact CD1-CB 3.93Å; L111-A391 HydrophobicContact CD2-CB 3.79Å; L111-I392 HydrophobicContact CB-CD1 4.16Å; L111-I392 HydrophobicContact CB-CG1 3.87Å; L111-I392 HydrophobicContact CD1-CG1 3.89Å; L111-I392 HydrophobicContact CG-CG1 4.44Å; L111-E395 HydrophobicContact CD1-CG 3.97Å
112	R	92.6	Very high	91.3	Very high	10 Å²	10	35.7 Å²	35.7	4%	0.038	18%	0.177	C	C	.	.	H	α-helix	trans	-65.8	-48.9	178.5	-168.9	-174.1	-55.6	104.3	8.2	111.9	K108 R109 T110 L114 K115 I116 G213 A215 R216 F376 F378 D379	K108-R112 VanDerWaalsContact O-CB 3.26Å; K108-R112 WeakPolarHBondContact O-CB 3.5Å; K108-R112 PolarHBondContact O-N 2.69Å; R109-R112 PolarHBondContact O-N 3.33Å; T110-R112 VanDerWaalsContact C-N 3.31Å; T110-R112 PolarHBondContact O-N 3.45Å; R112-L114 VanDerWaalsContact C-N 3.34Å; R112-L114 PolarHBondContact O-N 3.27Å; R112-K115 PolarHBondContact O-N 3.34Å; R112-I116 HydrophobicContact CG-CD1 3.81Å; R112-I116 WeakPolarHBondContact O-CB 3.46Å; R112-I116 WeakPolarHBondContact O-CG1 3.48Å; R112-I116 PolarHBondContact O-N 2.98Å; R112-G213 PolarHBondContact NH1-O 3.34Å; R112-A215 WeakPolarHBondContact CD-O 3.36Å; R112-R216 VanDerWaalsContact CZ-CZ 3.5Å; R112-F376 HydrophobicContact CG-CE1 4.46Å; R112-F378 HydrophobicContact CB-CZ 4.5Å; R112-F378 HydrophobicContact CG-CZ 4.37Å; R112-D379 IonicContact CZ-OD1 2.66Å; R112-D379 IonicContact CZ-OD2 3.62Å; R112-D379 VanDerWaalsContact CZ-OD2 3.25Å; R112-D379 IonicContact NE-OD1 3.76Å; R112-D379 IonicContact NE-OD2 3.47Å; R112-D379 PolarHBondContact NE-OD2 3.04Å; R112-D379 IonicContact NH2-OD1 2.67Å; R112-D379 PolarHBondContact NH2-OD1 3.38Å; R112-D379 IonicContact NH2-OD2 3.56Å; R112-D379 PolarHBondContact NH2-OD2 3.36Å
113	E	93.1	Very high	91.9	Very high	12 Å²	12	36 Å²	36	6%	0.056	18%	0.181	C	C	.	.	H	α-helix	trans	-57.3	-47.1	176.3	-171.8	-177.8	169.5	0	0	110.8	K95 R109 T110 L117	K95-E113 IonicContact NZ-OE1 2.65Å; K95-E113 PolarHBondContact NZ-OE1 3.13Å; K95-E113 IonicContact NZ-OE2 2.68Å; K95-E113 PolarHBondContact NZ-OE2 2.95Å; R109-E113 WeakPolarHBondContact O-CB 3.44Å; R109-E113 PolarHBondContact O-N 2.7Å; T110-E113 PolarHBondContact O-N 3.3Å; E113-L117 HydrophobicContact CG-CD1 3.92Å; E113-L117 HydrophobicContact CG-CG 4.43Å; E113-L117 WeakPolarHBondContact O-CB 3.45Å; E113-L117 VanDerWaalsContact O-CG 3.28Å; E113-L117 WeakPolarHBondContact O-CG 3.46Å; E113-L117 PolarHBondContact O-N 3.4Å
114	L	93.6	Very high	92.5	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.026	17%	0.167	C	C	.	.	H	α-helix	trans	-61.5	-48.4	177.9	-72.2	176.6	0	0	0	113	T110 R112 K118 I128 I131 V146 I392	T110-L114 HydrophobicContact CG2-CD1 4.17Å; T110-L114 WeakPolarHBondContact O-CB 3.36Å; T110-L114 VanDerWaalsContact O-CG 3.31Å; T110-L114 WeakPolarHBondContact O-CG 3.4Å; T110-L114 PolarHBondContact O-N 3.49Å; R112-L114 VanDerWaalsContact C-N 3.34Å; R112-L114 PolarHBondContact O-N 3.27Å; L114-K118 WeakPolarHBondContact O-CB 3.4Å; L114-K118 VanDerWaalsContact O-CG 3.23Å; L114-K118 WeakPolarHBondContact O-CG 3.23Å; L114-K118 PolarHBondContact O-N 3.28Å; L114-I128 HydrophobicContact CD2-CD1 3.96Å; L114-I131 HydrophobicContact CD2-CD1 3.97Å; L114-I131 HydrophobicContact CD2-CG1 4.44Å; L114-V146 HydrophobicContact CD2-CG1 4.32Å; L114-V146 HydrophobicContact CD2-CG2 3.83Å; L114-I392 HydrophobicContact CD1-CG1 4.5Å; L114-I392 HydrophobicContact CD1-CG2 4.01Å
115	K	94.7	Very high	93	Very high	47 Å²	47	30.7 Å²	30.7	20%	0.204	15%	0.149	C	C	.	.	H	α-helix	trans	-63.1	-46.1	180	-79.5	174.4	172.1	-71	0	111.9	L111 R112 K118 H119 F374 F378 E395	L111-K115 HydrophobicContact CD1-CD 4.18Å; L111-K115 HydrophobicContact CD1-CG 4.4Å; L111-K115 HydrophobicContact CG-CD 4.26Å; L111-K115 WeakPolarHBondContact O-CB 3.42Å; L111-K115 WeakPolarHBondContact O-CG 3.27Å; L111-K115 PolarHBondContact O-N 2.84Å; R112-K115 PolarHBondContact O-N 3.34Å; K115-K118 PolarHBondContact O-N 3.28Å; K115-H119 PolarHBondContact O-N 3.04Å; K115-H119 VanDerWaalsContact O-N 3.12Å; K115-F374 HydrophobicContact CB-CE2 4.06Å; K115-F374 HydrophobicContact CB-CZ 3.8Å; K115-F378 HydrophobicContact CB-CZ 4.33Å; K115-F378 HydrophobicContact CD-CD1 3.72Å; K115-F378 HydrophobicContact CD-CD2 3.6Å; K115-F378 HydrophobicContact CD-CE1 3.59Å; K115-F378 HydrophobicContact CD-CE2 3.49Å; K115-F378 VanDerWaalsContact CD-CE2 3.49Å; K115-F378 HydrophobicContact CD-CG 3.73Å; K115-F378 HydrophobicContact CD-CZ 3.48Å; K115-F378 VanDerWaalsContact CD-CZ 3.48Å; K115-E395 WeakPolarHBondContact CE-OE1 3.28Å; K115-E395 HydrophobicContact CG-CG 4.02Å; K115-E395 WeakPolarHBondContact CG-OE1 3.32Å; K115-E395 IonicContact NZ-OE1 2.93Å; K115-E395 PolarHBondContact NZ-OE1 2.93Å
116	I	95.1	Very high	93.5	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.7	-48.1	-179.7	-67.8	174.2	0	0	0	110.8	R112 K118 H119 F120 F212 A215 F374 F376	R112-I116 HydrophobicContact CG-CD1 3.81Å; R112-I116 WeakPolarHBondContact O-CB 3.46Å; R112-I116 WeakPolarHBondContact O-CG1 3.48Å; R112-I116 PolarHBondContact O-N 2.98Å; I116-K118 VanDerWaalsContact C-N 3.28Å; I116-K118 PolarHBondContact O-N 3.03Å; I116-H119 WeakPolarHBondContact O-CB 3.34Å; I116-H119 PolarHBondContact O-N 3.11Å; I116-H119 VanDerWaalsContact O-N 3.09Å; I116-F120 HydrophobicContact CG2-CD2 3.53Å; I116-F120 HydrophobicContact CG2-CE2 3.32Å; I116-F120 HydrophobicContact CG2-CG 4.35Å; I116-F120 HydrophobicContact CG2-CZ 3.99Å; I116-F120 PolarHBondContact O-N 3.47Å; I116-F212 HydrophobicContact CB-CB 4.3Å; I116-F212 HydrophobicContact CD1-CB 4.28Å; I116-F212 HydrophobicContact CG2-CB 3.96Å; I116-F212 HydrophobicContact CG2-CD1 3.66Å; I116-F212 HydrophobicContact CG2-CE1 4.35Å; I116-F212 HydrophobicContact CG2-CG 3.82Å; I116-A215 HydrophobicContact CD1-CB 3.73Å; I116-F374 HydrophobicContact CB-CE2 4.43Å; I116-F374 HydrophobicContact CB-CZ 4.38Å; I116-F374 HydrophobicContact CD1-CE1 4.27Å; I116-F374 HydrophobicContact CD1-CZ 4.49Å; I116-F374 HydrophobicContact CG1-CD1 4.17Å; I116-F374 HydrophobicContact CG1-CD2 4.4Å; I116-F374 HydrophobicContact CG1-CE1 3.59Å; I116-F374 HydrophobicContact CG1-CE2 3.86Å; I116-F374 HydrophobicContact CG1-CZ 3.41Å; I116-F374 VanDerWaalsContact CG1-CZ 3.41Å; I116-F376 HydrophobicContact CD1-CE1 4.14Å; I116-F376 HydrophobicContact CD1-CZ 4.07Å
117	L	95.2	Very high	94	Very high	7 Å²	7	26.3 Å²	26.3	4%	0.037	13%	0.126	C	C	.	.	H	α-helix	trans	-70.8	-20.2	-179.7	-65.9	-174.7	0	0	0	113.9	E113 I125 I126 I128 F212	E113-L117 HydrophobicContact CG-CD1 3.92Å; E113-L117 HydrophobicContact CG-CG 4.43Å; E113-L117 WeakPolarHBondContact O-CB 3.45Å; E113-L117 VanDerWaalsContact O-CG 3.28Å; E113-L117 WeakPolarHBondContact O-CG 3.46Å; E113-L117 PolarHBondContact O-N 3.4Å; L117-I125 HydrophobicContact CD2-CG2 4.15Å; L117-I126 HydrophobicContact CD1-CG2 4.02Å; L117-I126 HydrophobicContact CD2-CG2 3.89Å; L117-I126 WeakPolarHBondContact CD2-O 3.4Å; L117-I128 HydrophobicContact CB-CD1 3.58Å; L117-I128 HydrophobicContact CB-CG1 3.86Å; L117-I128 HydrophobicContact CD1-CD1 4.37Å; L117-I128 HydrophobicContact CD1-CG1 4.27Å; L117-F212 HydrophobicContact CD2-CD2 3.45Å; L117-F212 VanDerWaalsContact CD2-CD2 3.45Å; L117-F212 HydrophobicContact CD2-CE2 3.78Å; L117-F212 HydrophobicContact CD2-CG 4.28Å; L117-F212 HydrophobicContact CG-CD2 4.3Å
118	K	94.2	Very high	94.2	Very high	36 Å²	36	27.3 Å²	27.3	16%	0.157	13%	0.131	C	C	.	.	H	α-helix	trans	-76.9	-29.3	168.4	-78.6	178.9	63.8	-174.6	0	113.2	L114 K115 I116 I128 I131 E395 D398 F399	L114-K118 WeakPolarHBondContact O-CB 3.4Å; L114-K118 VanDerWaalsContact O-CG 3.23Å; L114-K118 WeakPolarHBondContact O-CG 3.23Å; L114-K118 PolarHBondContact O-N 3.28Å; K115-K118 PolarHBondContact O-N 3.28Å; I116-K118 VanDerWaalsContact C-N 3.28Å; I116-K118 PolarHBondContact O-N 3.03Å; K118-I128 HydrophobicContact CG-CD1 4.39Å; K118-I131 HydrophobicContact CD-CD1 4.37Å; K118-E395 WeakPolarHBondContact CE-OE2 3.44Å; K118-E395 PolarHBondContact NZ-O 2.83Å; K118-E395 IonicContact NZ-OE2 1.9Å; K118-E395 PolarHBondContact NZ-OE2 2.92Å; K118-D398 IonicContact NZ-OD2 3.79Å; K118-D398 PolarHBondContact NZ-OD2 3.39Å; K118-F399 HydrophobicContact CD-CB 4.41Å; K118-F399 HydrophobicContact CD-CD2 4.32Å; K118-F399 HydrophobicContact CG-CD2 4.15Å
119	H	94.4	Very high	94.5	Very high	53 Å²	53	29 Å²	29	25%	0.245	14%	0.139	C	C	.	.	H	α-helix	trans	-75.9	-46.6	177.2	-170.6	68.3	0	0	0	111.4	K115 I116 P372 F374	K115-H119 PolarHBondContact O-N 3.04Å; K115-H119 VanDerWaalsContact O-N 3.12Å; I116-H119 WeakPolarHBondContact O-CB 3.34Å; I116-H119 PolarHBondContact O-N 3.11Å; I116-H119 VanDerWaalsContact O-N 3.09Å; H119-P372 PolarHBondContact CE1-O 2.86Å; H119-P372 PolarHBondContact NE2-O 3.44Å; H119-F374 HydrophobicContact CB-CD2 3.73Å; H119-F374 HydrophobicContact CB-CE2 4.1Å; H119-F374 AromaticContact CD2-CD2 3.78Å; H119-F374 AromaticContact CG-CD2 3.74Å
120	F	96.1	Very high	94.7	Very high	9 Å²	9	28.6 Å²	28.6	4%	0.039	14%	0.138	C	C	.	.			trans	-74.6	136.5	-172.9	-69.1	-17.5	0	0	0	114.5	I116 I125 Y183 V184 A187 V189 F212	I116-F120 HydrophobicContact CG2-CD2 3.53Å; I116-F120 HydrophobicContact CG2-CE2 3.32Å; I116-F120 HydrophobicContact CG2-CG 4.35Å; I116-F120 HydrophobicContact CG2-CZ 3.99Å; I116-F120 PolarHBondContact O-N 3.47Å; F120-I125 HydrophobicContact CB-CD1 4.2Å; F120-I125 HydrophobicContact CB-CG2 4.23Å; F120-I125 HydrophobicContact CD2-CD1 3.8Å; F120-I125 HydrophobicContact CD2-CG2 4.14Å; F120-I125 HydrophobicContact CE2-CD1 4.34Å; F120-I125 HydrophobicContact CG-CD1 4.11Å; F120-Y183 HydrophobicContact CB-CE1 3.97Å; F120-Y183 HydrophobicContact CD1-CD1 4.14Å; F120-Y183 AromaticContact CD1-CE1 3.6Å; F120-Y183 HydrophobicContact CD1-CE1 3.6Å; F120-Y183 HydrophobicContact CE1-CD1 4.49Å; F120-Y183 HydrophobicContact CE1-CE1 4.27Å; F120-Y183 HydrophobicContact CG-CD1 4.39Å; F120-Y183 AromaticContact CG-CE1 3.95Å; F120-Y183 HydrophobicContact CG-CE1 3.95Å; F120-V184 HydrophobicContact CD2-CG2 4.49Å; F120-V184 HydrophobicContact CE2-CB 4.34Å; F120-V184 HydrophobicContact CE2-CG1 4.17Å; F120-V184 HydrophobicContact CE2-CG2 3.82Å; F120-V184 HydrophobicContact CZ-CB 4.27Å; F120-V184 HydrophobicContact CZ-CG1 4.13Å; F120-V184 HydrophobicContact CZ-CG2 4.2Å; F120-A187 HydrophobicContact CE1-CB 3.6Å; F120-A187 HydrophobicContact CZ-CB 4.07Å; F120-V189 HydrophobicContact CE1-CG2 4.45Å; F120-V189 HydrophobicContact CZ-CB 4.14Å; F120-V189 HydrophobicContact CZ-CG1 4.43Å; F120-V189 HydrophobicContact CZ-CG2 3.8Å; F120-F212 HydrophobicContact CD2-CE1 4.14Å; F120-F212 HydrophobicContact CD2-CZ 4.26Å; F120-F212 HydrophobicContact CE2-CD1 4.09Å; F120-F212 AromaticContact CE2-CE1 3.63Å; F120-F212 HydrophobicContact CE2-CE1 3.63Å; F120-F212 HydrophobicContact CE2-CZ 4.17Å
121	K	95.4	Very high	94.8	Very high	169 Å²	169	28.3 Å²	28.3	74%	0.735	14%	0.136	S	C	*	.			trans	-140.1	78	178.6	-66.7	177.1	-174.6	165	0	110.1	Y183	K121-Y183 PolarHBondContact N-OH 3.31Å
122	H	97.2	Very high	94.7	Very high	15 Å²	15	29.3 Å²	29.3	7%	0.069	14%	0.141	C	C	.	.			trans	-142.3	144.1	-174.3	-172.9	-104.8	0	0	0	111.4	N124 I125 R179 Y183	H122-N124 VanDerWaalsContact C-N 3.27Å; H122-N124 PolarHBondContact CE1-OD1 2.82Å; H122-N124 PolarHBondContact ND1-N 3.42Å; H122-N124 PolarHBondContact O-N 2.94Å; H122-I125 HydrophobicContact CB-CB 4.34Å; H122-I125 HydrophobicContact CB-CD1 3.88Å; H122-I125 HydrophobicContact CB-CG1 4.05Å; H122-I125 PolarHBondContact O-N 2.9Å; H122-R179 PolarHBondContact CE1-O 3.17Å; H122-R179 PolarHBondContact NE2-NH1 2.88Å; H122-Y183 HydrophobicContact CB-CD1 3.83Å; H122-Y183 HydrophobicContact CB-CD2 4.18Å; H122-Y183 HydrophobicContact CB-CE1 4.05Å; H122-Y183 HydrophobicContact CB-CE2 4.4Å; H122-Y183 HydrophobicContact CB-CG 3.88Å; H122-Y183 AromaticContact CG-CG 3.95Å
123	D	96.7	Very high	94.3	Very high	89 Å²	89	33.9 Å²	33.9	48%	0.476	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-28.7	-171.2	-40.1	-67.4	0	0	0	112.9	R179 K208	D123-R179 IonicContact OD2-CZ 3.32Å; D123-R179 IonicContact OD2-NH1 2.77Å; D123-R179 PolarHBondContact OD2-NH1 2.79Å; D123-R179 IonicContact OD2-NH2 3.11Å; D123-R179 PolarHBondContact OD2-NH2 2.93Å; D123-K208 PolarHBondContact O-NZ 3.26Å
124	N	98	Very high	93.7	Very high	6 Å²	6	35.5 Å²	35.5	3%	0.032	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	21.8	179.4	-54.6	107.3	0	0	0	113.8	H122 Q176 R179 L207 K208 I209	H122-N124 VanDerWaalsContact C-N 3.27Å; H122-N124 PolarHBondContact CE1-OD1 2.82Å; H122-N124 PolarHBondContact ND1-N 3.42Å; H122-N124 PolarHBondContact O-N 2.94Å; N124-Q176 WeakPolarHBondContact CB-O 3.49Å; N124-Q176 PolarHBondContact ND2-OE1 3.45Å; N124-R179 PolarHBondContact OD1-NH1 3.46Å; N124-L207 VanDerWaalsContact CA-O 3.26Å; N124-L207 WeakPolarHBondContact CA-O 3.43Å; N124-L207 WeakPolarHBondContact CB-O 3.28Å; N124-L207 PolarHBondContact ND2-O 2.92Å; N124-K208 WeakPolarHBondContact O-CA 3.45Å; N124-I209 PolarHBondContact O-N 2.66Å
125	I	97.6	Very high	92.6	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.015	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-124.8	142	171.2	-61.3	179.1	0	0	0	107.2	L117 F120 H122 A127 Y183 V184 F212	L117-I125 HydrophobicContact CD2-CG2 4.15Å; F120-I125 HydrophobicContact CB-CD1 4.2Å; F120-I125 HydrophobicContact CB-CG2 4.23Å; F120-I125 HydrophobicContact CD2-CD1 3.8Å; F120-I125 HydrophobicContact CD2-CG2 4.14Å; F120-I125 HydrophobicContact CE2-CD1 4.34Å; F120-I125 HydrophobicContact CG-CD1 4.11Å; H122-I125 HydrophobicContact CB-CB 4.34Å; H122-I125 HydrophobicContact CB-CD1 3.88Å; H122-I125 HydrophobicContact CB-CG1 4.05Å; H122-I125 PolarHBondContact O-N 2.9Å; I125-A127 PolarHBondContact O-N 3.22Å; I125-Y183 HydrophobicContact CD1-CD1 3.61Å; I125-Y183 HydrophobicContact CD1-CE1 4.27Å; I125-Y183 HydrophobicContact CD1-CG 4.44Å; I125-V184 HydrophobicContact CD1-CG2 3.58Å; I125-V184 HydrophobicContact CG1-CG2 4.36Å; I125-F212 HydrophobicContact CG2-CE2 3.76Å; I125-F212 HydrophobicContact CG2-CZ 3.86Å
126	I	95.6	Very high	91.6	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.026	22%	0.223	C	C	.	.			trans	-65.3	131.5	177.1	-167.2	58.3	0	0	0	110.2	L117 L148 D149 M151 L200 K208 I209 Y994	L117-I126 HydrophobicContact CD1-CG2 4.02Å; L117-I126 HydrophobicContact CD2-CG2 3.89Å; L117-I126 WeakPolarHBondContact CD2-O 3.4Å; I126-L148 HydrophobicContact CD1-CB 4.34Å; I126-L148 HydrophobicContact CG1-CB 4.21Å; I126-L148 HydrophobicContact CG1-CD1 4.41Å; I126-L148 HydrophobicContact CG1-CD2 4.31Å; I126-D149 HydrophobicContact CD1-CB 3.84Å; I126-M151 HydrophobicContact CD1-CG 4.38Å; I126-L200 HydrophobicContact CB-CD1 4.23Å; I126-L200 HydrophobicContact CD1-CD1 3.75Å; I126-L200 HydrophobicContact CG1-CD1 3.93Å; I126-K208 HydrophobicContact CD1-CD 4.17Å; I126-I209 WeakPolarHBondContact CG2-O 3.2Å; I126-I209 PolarHBondContact N-O 2.96Å; I126-Y994 HydrophobicContact CD1-CE1 4.11Å; I126-Y994 HydrophobicContact CG1-CE1 4.35Å
127	A	94.1	Very high	90.7	Very high	29 Å²	29	48.4 Å²	48.4	24%	0.24	25%	0.25	C	C	.	.			trans	-111.6	130.7	-173.7	0	0	0	0	0	112.4	I125 K129	I125-A127 PolarHBondContact O-N 3.22Å; A127-K129 PolarHBondContact O-N 3.3Å
128	I	94.9	Very high	89.8	Confident	21 Å²	21	52.3 Å²	52.3	11%	0.108	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	118.7	169.6	-66.1	175.3	0	0	0	109.3	L114 L117 K118 D130 I131 V146 L148 F399	L114-I128 HydrophobicContact CD2-CD1 3.96Å; L117-I128 HydrophobicContact CB-CD1 3.58Å; L117-I128 HydrophobicContact CB-CG1 3.86Å; L117-I128 HydrophobicContact CD1-CD1 4.37Å; L117-I128 HydrophobicContact CD1-CG1 4.27Å; K118-I128 HydrophobicContact CG-CD1 4.39Å; I128-D130 WeakPolarHBondContact CG2-O 3.41Å; I128-I131 HydrophobicContact CG2-CD1 4.29Å; I128-I131 HydrophobicContact CG2-CG1 3.66Å; I128-V146 HydrophobicContact CD1-CG1 4.07Å; I128-V146 HydrophobicContact CG1-CG1 3.87Å; I128-V146 HydrophobicContact CG2-CG1 4.41Å; I128-L148 HydrophobicContact CG1-CD2 3.81Å; I128-F399 HydrophobicContact CB-CE2 4.49Å; I128-F399 HydrophobicContact CG2-CD2 4.42Å; I128-F399 HydrophobicContact CG2-CE2 3.7Å; I128-F399 HydrophobicContact CG2-CZ 3.91Å
129	K	93.3	Very high	88.8	Confident	71 Å²	71	55.5 Å²	55.5	31%	0.309	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-38	170.7	-59	-52.6	-167	-117.1	0	111.5	A127 V147 D149	A127-K129 PolarHBondContact O-N 3.3Å; K129-V147 HydrophobicContact CB-CG1 4.29Å; K129-V147 PolarHBondContact N-O 3Å; K129-D149 WeakPolarHBondContact CE-OD1 3.35Å; K129-D149 IonicContact NZ-OD1 3.59Å; K129-D149 PolarHBondContact NZ-OD1 2.88Å; K129-D149 IonicContact NZ-OD2 3.17Å; K129-D149 PolarHBondContact NZ-OD2 3.37Å
130	D	93.2	Very high	88	Confident	5 Å²	5	55.1 Å²	55.1	3%	0.027	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	162.8	178.4	-117.8	-44.5	0	0	0	112	Y66 I128 V147 H400 K403	Y66-D130 WeakPolarHBondContact OH-CB 3.33Å; Y66-D130 PolarHBondContact OH-OD2 3.49Å; Y66-D130 VanDerWaalsContact OH-OD2 3.07Å; I128-D130 WeakPolarHBondContact CG2-O 3.41Å; D130-V147 HydrophobicContact CB-CB 3.68Å; D130-V147 HydrophobicContact CB-CG1 4.43Å; D130-V147 HydrophobicContact CB-CG2 3.73Å; D130-V147 PolarHBondContact N-O 3.14Å; D130-V147 PolarHBondContact O-N 2.91Å; D130-H400 IonicContact OD1-CE1 3.83Å; D130-H400 PolarHBondContact OD1-CE1 2.97Å; D130-H400 VanDerWaalsContact OD1-CE1 3.29Å; D130-H400 IonicContact OD1-NE2 3.16Å; D130-K403 IonicContact OD1-NZ 2.7Å; D130-K403 PolarHBondContact OD1-NZ 3.01Å; D130-K403 IonicContact OD2-NZ 3.72Å; D130-K403 PolarHBondContact OD2-NZ 3.14Å
131	I	92.9	Very high	87.2	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	119.5	164.6	-41	165.3	0	0	0	105.7	L114 K118 I128 Q133 V144 Y145 V146 I396 F399 H400	L114-I131 HydrophobicContact CD2-CD1 3.97Å; L114-I131 HydrophobicContact CD2-CG1 4.44Å; K118-I131 HydrophobicContact CD-CD1 4.37Å; I128-I131 HydrophobicContact CG2-CD1 4.29Å; I128-I131 HydrophobicContact CG2-CG1 3.66Å; I131-Q133 PolarHBondContact O-N 3.23Å; I131-V144 HydrophobicContact CG2-CG1 4.25Å; I131-Y145 WeakPolarHBondContact CA-O 3.46Å; I131-Y145 WeakPolarHBondContact CG2-O 3.37Å; I131-V146 HydrophobicContact CG2-CG2 4.37Å; I131-I396 HydrophobicContact CB-CG1 4.34Å; I131-I396 HydrophobicContact CG2-CD1 4.24Å; I131-I396 HydrophobicContact CG2-CG1 3.78Å; I131-F399 HydrophobicContact CD1-CB 4.13Å; I131-F399 HydrophobicContact CD1-CD2 4.23Å; I131-F399 HydrophobicContact CD1-CG 4.05Å; I131-F399 HydrophobicContact CG1-CD1 4.44Å; I131-F399 HydrophobicContact CG1-CG 4.4Å; I131-H400 PolarHBondContact O-NE2 3.37Å
132	L	90.3	Very high	86.7	Confident	23 Å²	23	52.3 Å²	52.3	12%	0.12	29%	0.288	C	S	.	.			trans	-69	137.2	-171.8	-50.3	-173.5	0	0	0	110.1	V62 Y66 Y145 V147	V62-L132 HydrophobicContact CB-CD1 3.74Å; V62-L132 HydrophobicContact CG1-CD1 3.75Å; Y66-L132 HydrophobicContact CD2-CD2 4.13Å; Y66-L132 HydrophobicContact CE2-CD2 3.61Å; L132-Y145 HydrophobicContact CD1-CG 4.19Å; L132-Y145 PolarHBondContact N-O 3.12Å; L132-V147 HydrophobicContact CD2-CG2 3.85Å; L132-V147 HydrophobicContact CG-CG2 4.3Å
133	Q	84.7	Confident	86.2	Confident	107 Å²	107	52.8 Å²	52.8	50%	0.5	29%	0.293	S	S	.	.			trans	-71.7	147.8	177.8	-61.2	-173.6	23	0	0	110.1	I131 N135 I396 H400	I131-Q133 PolarHBondContact O-N 3.23Å; Q133-N135 PolarHBondContact O-N 3.45Å; Q133-N135 VanDerWaalsContact O-N 3.09Å; Q133-I396 HydrophobicContact CG-CG2 4.37Å; Q133-H400 PolarHBondContact NE2-CD2 2.94Å; Q133-H400 PolarHBondContact NE2-ND1 3.17Å
134	P	79.5	Confident	85.9	Confident	45 Å²	45	48.6 Å²	48.6	29%	0.292	27%	0.271	S	S	.	.			trans	-64.4	112.1	172.2	-12.4	24.7	0	0	0	110.3	L136 F141 L393	P134-L136 PolarHBondContact O-N 2.95Å; P134-F141 HydrophobicContact CB-CB 4.46Å; P134-F141 HydrophobicContact CB-CD2 3.67Å; P134-F141 HydrophobicContact CB-CE2 3.99Å; P134-F141 HydrophobicContact CB-CG 4.07Å; P134-F141 HydrophobicContact CG-CD1 4.3Å; P134-F141 HydrophobicContact CG-CD2 3.82Å; P134-F141 HydrophobicContact CG-CE1 4.21Å; P134-F141 HydrophobicContact CG-CE2 3.72Å; P134-F141 HydrophobicContact CG-CG 4.11Å; P134-F141 HydrophobicContact CG-CZ 3.92Å; P134-L393 HydrophobicContact CG-CD2 3.48Å; P134-L393 VanDerWaalsContact CG-CD2 3.48Å
135	N	71.6	Confident	85.7	Confident	135 Å²	135	49.4 Å²	49.4	72%	0.722	27%	0.274	S	S	*	.	S	Bend	trans	-78	12.4	168.1	-64.1	-31.1	0	0	0	112.4	Q133	Q133-N135 PolarHBondContact O-N 3.45Å; Q133-N135 VanDerWaalsContact O-N 3.09Å
136	L	74.4	Confident	85.5	Confident	103 Å²	103	49.5 Å²	49.5	54%	0.539	27%	0.274	S	S	.	.	S	Bend	trans	-126.3	150.3	-173.6	-66.8	177.3	0	0	0	109.7	P134 A140	P134-L136 PolarHBondContact O-N 2.95Å; L136-A140 HydrophobicContact CB-CB 4.15Å; L136-A140 HydrophobicContact CD1-CB 4.42Å
137	P	76.3	Confident	85.4	Confident	85 Å²	85	49.2 Å²	49.2	55%	0.552	27%	0.273	S	S	*	.			trans	-59.8	154.4	173.5	27	-35.2	0	0	0	111.2	S139 A140 F141	P137-S139 PolarHBondContact O-N 3.36Å; P137-A140 HydrophobicContact CG-CB 4.06Å; P137-A140 PolarHBondContact O-N 3Å; P137-F141 PolarHBondContact O-N 2.65Å
138	H	74.9	Confident	85.5	Confident	90 Å²	90	48 Å²	48	42%	0.417	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-48.7	-41.5	-175.3	180	114.3	0	0	0	112.5	A140 F141 K389 E390 L393	H138-A140 PolarHBondContact O-N 3.07Å; H138-F141 PolarHBondContact O-N 3.32Å; H138-K389 WeakPolarHBondContact NE2-CE 3.36Å; H138-K389 WeakPolarHBondContact O-CE 3.39Å; H138-K389 PolarHBondContact O-NZ 3.09Å; H138-E390 IonicContact CE1-OE2 3.15Å; H138-E390 PolarHBondContact CE1-OE2 3Å; H138-E390 IonicContact ND1-OE2 3.31Å; H138-E390 PolarHBondContact ND1-OE2 2.76Å; H138-L393 WeakPolarHBondContact ND1-CD1 3.33Å
139	S	73.4	Confident	85.4	Confident	103 Å²	103	48.6 Å²	48.6	72%	0.72	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-58.4	-40.9	177.2	49.5	0	0	0	0	113.7	P137	P137-S139 PolarHBondContact O-N 3.36Å
140	A	76.9	Confident	85.5	Confident	45 Å²	45	46.7 Å²	46.7	37%	0.372	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-87.1	-7.8	-178.5	0	0	0	0	0	114.1	L136 P137 H138 K142	L136-A140 HydrophobicContact CB-CB 4.15Å; L136-A140 HydrophobicContact CD1-CB 4.42Å; P137-A140 HydrophobicContact CG-CB 4.06Å; P137-A140 PolarHBondContact O-N 3Å; H138-A140 PolarHBondContact O-N 3.07Å; A140-K142 PolarHBondContact O-N 3.06Å
141	F	81	Confident	85.4	Confident	11 Å²	11	46.7 Å²	46.7	5%	0.048	26%	0.259	C	S	.	.			trans	-68.4	103.2	175.4	-177.3	-130.9	0	0	0	111	F101 P134 P137 H138 S143 V144 K389 L393 I396	F101-F141 HydrophobicContact CE1-CE1 4.33Å; F101-F141 AromaticContact CE2-CD1 3.7Å; F101-F141 HydrophobicContact CE2-CD1 3.7Å; F101-F141 AromaticContact CE2-CE1 3.76Å; F101-F141 HydrophobicContact CE2-CE1 3.76Å; F101-F141 HydrophobicContact CE2-CG 4.19Å; F101-F141 HydrophobicContact CE2-CZ 4.28Å; F101-F141 WeakPolarHBondContact CE2-O 3.46Å; F101-F141 AromaticContact CZ-CD1 3.71Å; F101-F141 HydrophobicContact CZ-CD1 3.71Å; F101-F141 AromaticContact CZ-CE1 3.31Å; F101-F141 HydrophobicContact CZ-CE1 3.31Å; F101-F141 AromaticContact CZ-CZ 3.85Å; F101-F141 HydrophobicContact CZ-CZ 3.85Å; P134-F141 HydrophobicContact CB-CB 4.46Å; P134-F141 HydrophobicContact CB-CD2 3.67Å; P134-F141 HydrophobicContact CB-CE2 3.99Å; P134-F141 HydrophobicContact CB-CG 4.07Å; P134-F141 HydrophobicContact CG-CD1 4.3Å; P134-F141 HydrophobicContact CG-CD2 3.82Å; P134-F141 HydrophobicContact CG-CE1 4.21Å; P134-F141 HydrophobicContact CG-CE2 3.72Å; P134-F141 HydrophobicContact CG-CG 4.11Å; P134-F141 HydrophobicContact CG-CZ 3.92Å; P137-F141 PolarHBondContact O-N 2.65Å; H138-F141 PolarHBondContact O-N 3.32Å; F141-S143 WeakPolarHBondContact CE2-O 3.38Å; F141-V144 HydrophobicContact CZ-CG2 3.99Å; F141-K389 WeakPolarHBondContact O-CE 3.35Å; F141-K389 PolarHBondContact O-NZ 3.32Å; F141-L393 HydrophobicContact CD1-CD1 4.18Å; F141-L393 HydrophobicContact CD1-CD2 3.58Å; F141-L393 HydrophobicContact CD1-CG 3.95Å; F141-L393 HydrophobicContact CE1-CD1 4.48Å; F141-L393 HydrophobicContact CE1-CD2 3.38Å; F141-L393 HydrophobicContact CE1-CG 3.77Å; F141-L393 HydrophobicContact CG-CD2 4.46Å; F141-L393 HydrophobicContact CZ-CD2 4.13Å; F141-I396 HydrophobicContact CZ-CD1 4Å
142	K	83.5	Confident	85.1	Confident	107 Å²	107	51.8 Å²	51.8	47%	0.465	28%	0.282	S	S	.	.			trans	-114.2	-29.6	178.1	-74.2	-162.4	169.6	-146.6	0	115.2	N99 A100 E102 A140	N99-K142 CarbonylContact C-O 3.59Å; N99-K142 WeakPolarHBondContact CA-O 3.42Å; N99-K142 PolarHBondContact N-O 3.25Å; A100-K142 PolarHBondContact N-O 3.01Å; E102-K142 IonicContact OE1-NZ 2.78Å; E102-K142 PolarHBondContact OE1-NZ 3.39Å; A140-K142 PolarHBondContact O-N 3.06Å
143	S	87.9	Confident	85.2	Confident	26 Å²	26	52 Å²	52	18%	0.182	29%	0.286	C	S	.	.			trans	-120.6	136.4	-172	-57.8	0	0	0	0	111.7	I97 F141	I97-S143 CarbonylContact O-C 3.43Å; I97-S143 VanDerWaalsContact O-CA 3.27Å; I97-S143 WeakPolarHBondContact O-CA 3.38Å; F141-S143 WeakPolarHBondContact CE2-O 3.38Å
144	V	90.5	Very high	85.6	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	136	174.9	-175.8	0	0	0	0	109.2	K96 I97 A100 F101 T110 I131 F141 V146 I392	K96-V144 WeakPolarHBondContact CA-O 3.35Å; I97-V144 HydrophobicContact CB-CB 4.37Å; I97-V144 PolarHBondContact N-O 2.93Å; I97-V144 PolarHBondContact O-N 3.47Å; A100-V144 HydrophobicContact CB-CG2 3.81Å; F101-V144 HydrophobicContact CE1-CG2 4.33Å; F101-V144 HydrophobicContact CZ-CG2 3.74Å; T110-V144 HydrophobicContact CG2-CG2 4.48Å; I131-V144 HydrophobicContact CG2-CG1 4.25Å; F141-V144 HydrophobicContact CZ-CG2 3.99Å; V144-V146 HydrophobicContact CG1-CG2 4.01Å; V144-I392 HydrophobicContact CG2-CG2 4.06Å
145	Y	92.4	Very high	86.3	Confident	23 Å²	23	45 Å²	45	9%	0.09	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	112.8	176.3	-65.4	-92	0	0	0	109.9	F60 D61 V62 I94 K95 K96 I131 L132	F60-Y145 HydrophobicContact CD1-CD1 4.06Å; F60-Y145 AromaticContact CD1-CE1 3.78Å; F60-Y145 HydrophobicContact CD1-CE1 3.78Å; F60-Y145 HydrophobicContact CE1-CD1 4.45Å; F60-Y145 HydrophobicContact CE1-CE1 4.38Å; F60-Y145 HydrophobicContact CG-CE1 4.39Å; D61-Y145 PolarHBondContact N-OH 3.28Å; D61-Y145 VanDerWaalsContact N-OH 3.09Å; V62-Y145 HydrophobicContact CG1-CD1 4.15Å; V62-Y145 HydrophobicContact CG1-CE1 4.33Å; I94-Y145 HydrophobicContact CG2-CD1 4.19Å; K95-Y145 WeakPolarHBondContact O-CA 3.48Å; K96-Y145 HydrophobicContact CB-CD1 3.81Å; K96-Y145 HydrophobicContact CB-CE1 3.76Å; K96-Y145 HydrophobicContact CD-CD1 4.5Å; K96-Y145 HydrophobicContact CD-CE1 3.62Å; K96-Y145 WeakPolarHBondContact CE-OH 3.4Å; K96-Y145 HydrophobicContact CG-CD1 3.93Å; K96-Y145 HydrophobicContact CG-CE1 3.5Å; I131-Y145 WeakPolarHBondContact CA-O 3.46Å; I131-Y145 WeakPolarHBondContact CG2-O 3.37Å; L132-Y145 HydrophobicContact CD1-CG 4.19Å; L132-Y145 PolarHBondContact N-O 3.12Å
146	V	93.9	Very high	87.3	Confident	4 Å²	4	42 Å²	42	2%	0.024	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.8	-179.1	-168.6	0	0	0	0	109.5	I94 K95 L114 I128 I131 V144 L148	I94-V146 CarbonylContact C-O 3.6Å; I94-V146 WeakPolarHBondContact CA-O 3.16Å; K95-V146 HydrophobicContact CB-CB 4.46Å; K95-V146 PolarHBondContact N-O 3.28Å; K95-V146 PolarHBondContact O-N 2.94Å; L114-V146 HydrophobicContact CD2-CG1 4.32Å; L114-V146 HydrophobicContact CD2-CG2 3.83Å; I128-V146 HydrophobicContact CD1-CG1 4.07Å; I128-V146 HydrophobicContact CG1-CG1 3.87Å; I128-V146 HydrophobicContact CG2-CG1 4.41Å; I131-V146 HydrophobicContact CG2-CG2 4.37Å; V144-V146 HydrophobicContact CG1-CG2 4.01Å; V146-L148 HydrophobicContact CG1-CD2 3.84Å; V146-L148 HydrophobicContact CG1-CG 4.22Å
147	V	94.8	Very high	88.1	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	124.3	-180	-170.7	0	0	0	0	109.4	Y66 V92 A93 I94 K129 D130 L132	Y66-V147 HydrophobicContact CE1-CG1 3.93Å; Y66-V147 HydrophobicContact CE1-CG2 4.41Å; Y66-V147 HydrophobicContact CE2-CG2 4.46Å; V92-V147 HydrophobicContact CB-CG1 3.68Å; V92-V147 HydrophobicContact CG1-CG1 3.99Å; V92-V147 HydrophobicContact CG2-CG1 3.68Å; A93-V147 CarbonylContact O-C 3.59Å; A93-V147 WeakPolarHBondContact O-CA 3.39Å; I94-V147 HydrophobicContact CG1-CG1 4.39Å; I94-V147 HydrophobicContact CG1-CG2 4.24Å; K129-V147 HydrophobicContact CB-CG1 4.29Å; K129-V147 PolarHBondContact N-O 3Å; D130-V147 HydrophobicContact CB-CB 3.68Å; D130-V147 HydrophobicContact CB-CG1 4.43Å; D130-V147 HydrophobicContact CB-CG2 3.73Å; D130-V147 PolarHBondContact N-O 3.14Å; D130-V147 PolarHBondContact O-N 2.91Å; L132-V147 HydrophobicContact CD2-CG2 3.85Å; L132-V147 HydrophobicContact CG-CG2 4.3Å
148	L	95.2	Very high	88.9	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	169.5	-169.8	-58.4	172.2	0	0	0	110.6	V92 A93 K95 I126 I128 V146 L150 Y994	V92-L148 WeakPolarHBondContact CB-O 3.28Å; A93-L148 HydrophobicContact CB-CB 4.48Å; A93-L148 PolarHBondContact N-O 2.91Å; A93-L148 VanDerWaalsContact N-O 3.08Å; A93-L148 PolarHBondContact O-N 3.48Å; K95-L148 HydrophobicContact CB-CD1 4.34Å; I126-L148 HydrophobicContact CD1-CB 4.34Å; I126-L148 HydrophobicContact CG1-CB 4.21Å; I126-L148 HydrophobicContact CG1-CD1 4.41Å; I126-L148 HydrophobicContact CG1-CD2 4.31Å; I128-L148 HydrophobicContact CG1-CD2 3.81Å; V146-L148 HydrophobicContact CG1-CD2 3.84Å; V146-L148 HydrophobicContact CG1-CG 4.22Å; L148-L150 PolarHBondContact O-N 3.1Å; L148-Y994 HydrophobicContact CB-CD1 4.5Å; L148-Y994 HydrophobicContact CB-CE1 4.07Å; L148-Y994 HydrophobicContact CD1-CD1 3.52Å; L148-Y994 HydrophobicContact CD1-CE1 3.96Å
149	D	93.6	Very high	89.8	Confident	34 Å²	34	33.1 Å²	33.1	18%	0.182	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	137.4	163.3	-69.4	-71.8	0	0	0	110.2	I126 K129 Y994	I126-D149 HydrophobicContact CD1-CB 3.84Å; K129-D149 WeakPolarHBondContact CE-OD1 3.35Å; K129-D149 IonicContact NZ-OD1 3.59Å; K129-D149 PolarHBondContact NZ-OD1 2.88Å; K129-D149 IonicContact NZ-OD2 3.17Å; K129-D149 PolarHBondContact NZ-OD2 3.37Å; D149-Y994 WeakPolarHBondContact O-CE1 3.49Å; D149-Y994 PolarHBondContact O-OH 3.37Å
150	L	93.8	Very high	90.7	Very high	31 Å²	31	32 Å²	32	16%	0.162	16%	0.163	C	C	.	.			trans	-74.8	136.8	165.6	-172.6	61.4	0	0	0	109.2	I72 Q91 A93 L148 Y994	I72-L150 HydrophobicContact CD1-CD1 3.65Å; Q91-L150 HydrophobicContact CB-CD2 3.83Å; A93-L150 HydrophobicContact CB-CD1 4.09Å; L148-L150 PolarHBondContact O-N 3.1Å; L150-Y994 WeakPolarHBondContact CA-OH 3.29Å
151	M	92.7	Very high	91.4	Very high	5 Å²	5	32 Å²	32	3%	0.025	16%	0.161	C	C	.	.			trans	-136.5	126.3	176.7	-56.7	-69.5	-68.6	0	0	105.8	I126 S153 L200 N202 E206 K208 Y994	I126-M151 HydrophobicContact CD1-CG 4.38Å; M151-S153 VanDerWaalsContact C-N 3.3Å; M151-S153 PolarHBondContact O-N 2.68Å; M151-L200 HydrophobicContact CB-CB 3.89Å; M151-L200 HydrophobicContact CB-CD2 4.33Å; M151-L200 HydrophobicContact CE-CB 4.02Å; M151-L200 HydrophobicContact CG-CB 3.8Å; M151-L200 HydrophobicContact CG-CD1 4.14Å; M151-L200 HydrophobicContact CG-CG 4.45Å; M151-N202 HydrophobicContact CE-CB 3.88Å; M151-N202 HydrophobicContact SD-CB 4.04Å; M151-E206 WeakPolarHBondContact CE-O 3.26Å; M151-K208 HydrophobicContact CE-CB 4.15Å; M151-K208 HydrophobicContact CE-CD 3.97Å; M151-K208 HydrophobicContact CE-CG 3.77Å; M151-K208 HydrophobicContact SD-CD 3.67Å; M151-K208 WeakPolarHBondContact SD-CE 3.25Å; M151-K208 HydrophobicContact SD-CG 4.18Å; M151-Y994 PolarHBondContact N-OH 3.27Å
152	E	87.1	Confident	91.8	Very high	107 Å²	107	36.7 Å²	36.7	50%	0.5	20%	0.201	S	C	.	.	S	Bend	trans	-76	-17.7	-169.3	-60	78.8	-165.9	0	0	113.4	N202 E203	E152-N202 WeakPolarHBondContact OE2-CA 3.49Å; E152-N202 WeakPolarHBondContact OE2-CB 3.14Å; E152-E203 HydrophobicContact CG-CG 4.2Å; E152-E203 PolarHBondContact OE2-N 2.8Å
153	S	90.8	Very high	92	Very high	28 Å²	28	36.9 Å²	36.9	20%	0.196	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	-175.4	-179.5	-151.5	0	0	0	0	113.1	M151 Q157 V201	M151-S153 VanDerWaalsContact C-N 3.3Å; M151-S153 PolarHBondContact O-N 2.68Å; S153-Q157 WeakPolarHBondContact OG-CB 3.25Å; S153-V201 CarbonylContact C-O 3.54Å; S153-V201 PolarHBondContact N-O 3.21Å; S153-V201 PolarHBondContact O-N 3.04Å
154	D	92.6	Very high	92	Very high	5 Å²	5	40.8 Å²	40.8	3%	0.027	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	162.1	172.2	63.8	68.6	0	0	0	110.6	H156 Q157 I158 S197 L199	D154-H156 PolarHBondContact O-N 3.5Å; D154-H156 WeakPolarHBondContact OD1-CA 3.34Å; D154-H156 VanDerWaalsContact OD1-CB 3.25Å; D154-H156 WeakPolarHBondContact OD1-CB 3.41Å; D154-H156 PolarHBondContact OD1-N 3.38Å; D154-Q157 PolarHBondContact O-N 3.29Å; D154-Q157 PolarHBondContact OD1-N 2.85Å; D154-Q157 PolarHBondContact OD2-NE2 3.22Å; D154-I158 WeakPolarHBondContact O-CG1 3.25Å; D154-I158 PolarHBondContact O-N 3.47Å; D154-S197 WeakPolarHBondContact CB-O 3.42Å; D154-L199 CarbonylContact C-O 3.56Å; D154-L199 WeakPolarHBondContact CA-O 3.15Å
155	L	94.7	Very high	92.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.3	-24.3	-175.1	-167.9	69.6	0	0	0	112.1	I159 F173 P196 L199 V201 L207 I262 M266	L155-I159 HydrophobicContact CD1-CG1 4.48Å; L155-I159 HydrophobicContact CD2-CD1 4.28Å; L155-I159 HydrophobicContact CG-CD1 3.88Å; L155-I159 HydrophobicContact CG-CG1 4.21Å; L155-I159 WeakPolarHBondContact O-CB 3.42Å; L155-I159 WeakPolarHBondContact O-CG1 3.49Å; L155-I159 PolarHBondContact O-N 2.75Å; L155-F173 HydrophobicContact CD1-CB 4.49Å; L155-F173 HydrophobicContact CD1-CD2 3.73Å; L155-F173 HydrophobicContact CD1-CE2 4.08Å; L155-F173 HydrophobicContact CD1-CG 4.1Å; L155-P196 HydrophobicContact CB-CB 4.19Å; L155-P196 WeakPolarHBondContact CB-O 3.21Å; L155-P196 HydrophobicContact CG-CB 4.41Å; L155-P196 PolarHBondContact N-O 2.79Å; L155-L199 HydrophobicContact CB-CB 3.98Å; L155-L199 HydrophobicContact CD2-CB 4.4Å; L155-L199 HydrophobicContact CD2-CD1 3.85Å; L155-L199 PolarHBondContact N-O 3.4Å; L155-V201 HydrophobicContact CB-CG2 4.29Å; L155-V201 HydrophobicContact CD1-CG2 4.39Å; L155-L207 HydrophobicContact CD2-CD1 4.41Å; L155-I262 HydrophobicContact CD2-CG2 3.87Å; L155-M266 HydrophobicContact CD1-SD 4.24Å; L155-M266 HydrophobicContact CD2-CG 4.24Å; L155-M266 HydrophobicContact CD2-SD 3.97Å
156	H	93.2	Very high	92.2	Very high	71 Å²	71	43.1 Å²	43.1	33%	0.329	24%	0.243	S	C	.	.	H	α-helix	trans	-66.3	-49.2	172.6	-177.7	78.6	0	0	0	110.6	D154 I158 I159 H160 P196	D154-H156 PolarHBondContact O-N 3.5Å; D154-H156 WeakPolarHBondContact OD1-CA 3.34Å; D154-H156 VanDerWaalsContact OD1-CB 3.25Å; D154-H156 WeakPolarHBondContact OD1-CB 3.41Å; D154-H156 PolarHBondContact OD1-N 3.38Å; H156-I158 VanDerWaalsContact C-N 3.32Å; H156-I158 PolarHBondContact O-N 3.4Å; H156-I159 PolarHBondContact O-N 3.36Å; H156-H160 AromaticContact CE1-CD2 3.33Å; H156-H160 PolarHBondContact CE1-CD2 2.86Å; H156-H160 AromaticContact CE1-NE2 3.77Å; H156-H160 AromaticContact CG-CD2 3.89Å; H156-H160 AromaticContact ND1-CD2 3.3Å; H156-H160 PolarHBondContact ND1-CD2 3.26Å; H156-H160 VanDerWaalsContact ND1-CD2 3.3Å; H156-H160 AromaticContact ND1-NE2 3.68Å; H156-H160 AromaticContact NE2-CD2 3.93Å; H156-H160 PolarHBondContact O-CD2 3.47Å; H156-H160 PolarHBondContact O-N 3.4Å; H156-P196 HydrophobicContact CB-CB 3.91Å; H156-P196 PolarHBondContact N-O 2.89Å; H156-P196 VanDerWaalsContact N-O 3.1Å
157	Q	91.8	Very high	92.2	Very high	78 Å²	78	46.7 Å²	46.7	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-57.9	-44.3	175	-70.7	-173.8	73.3	0	0	111.7	S153 D154 S161	S153-Q157 WeakPolarHBondContact OG-CB 3.25Å; D154-Q157 PolarHBondContact O-N 3.29Å; D154-Q157 PolarHBondContact OD1-N 2.85Å; D154-Q157 PolarHBondContact OD2-NE2 3.22Å; Q157-S161 WeakPolarHBondContact O-CB 3.49Å; Q157-S161 PolarHBondContact O-N 3.36Å; Q157-S161 PolarHBondContact O-OG 2.96Å
158	I	92.9	Very high	92.2	Very high	13 Å²	13	49.7 Å²	49.7	7%	0.067	28%	0.28	C	S	.	.	H	α-helix	trans	-62.3	-48.3	177.8	-66.8	172	0	0	0	111.4	D154 H156 H160 S161 L165 V201 R269	D154-I158 WeakPolarHBondContact O-CG1 3.25Å; D154-I158 PolarHBondContact O-N 3.47Å; H156-I158 VanDerWaalsContact C-N 3.32Å; H156-I158 PolarHBondContact O-N 3.4Å; I158-H160 PolarHBondContact O-N 2.84Å; I158-S161 PolarHBondContact O-N 3.44Å; I158-S161 PolarHBondContact O-OG 2.95Å; I158-L165 HydrophobicContact CG2-CD1 4.1Å; I158-V201 HydrophobicContact CD1-CB 3.58Å; I158-V201 HydrophobicContact CD1-CG1 3.51Å; I158-V201 HydrophobicContact CD1-CG2 3.99Å; I158-R269 PolarHBondContact O-NH1 3.38Å
159	I	93.7	Very high	92.2	Very high	1 Å²	1	53 Å²	53	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-62.3	-42.6	-179.1	-71.1	172	0	0	0	111.7	L155 H156 L165 P196 E265 M266 R269	L155-I159 HydrophobicContact CD1-CG1 4.48Å; L155-I159 HydrophobicContact CD2-CD1 4.28Å; L155-I159 HydrophobicContact CG-CD1 3.88Å; L155-I159 HydrophobicContact CG-CG1 4.21Å; L155-I159 WeakPolarHBondContact O-CB 3.42Å; L155-I159 WeakPolarHBondContact O-CG1 3.49Å; L155-I159 PolarHBondContact O-N 2.75Å; H156-I159 PolarHBondContact O-N 3.36Å; I159-L165 HydrophobicContact CG1-CD2 4.41Å; I159-P196 HydrophobicContact CD1-CB 4.12Å; I159-P196 HydrophobicContact CD1-CG 4.26Å; I159-E265 HydrophobicContact CD1-CG 4.1Å; I159-E265 HydrophobicContact CG2-CG 3.94Å; I159-M266 HydrophobicContact CD1-CB 4.39Å; I159-M266 HydrophobicContact CD1-CG 3.57Å; I159-M266 HydrophobicContact CG1-CG 4.07Å; I159-R269 WeakPolarHBondContact O-CD 3.06Å; I159-R269 PolarHBondContact O-NH1 2.86Å
160	H	92.4	Very high	92.3	Very high	79 Å²	79	51.7 Å²	51.7	37%	0.366	29%	0.288	S	S	.	.	H	α-helix	trans	-92.5	1.8	-174.7	-64.1	-67.6	0	0	0	114.2	H156 I158 E265 Q271	H156-H160 AromaticContact CE1-CD2 3.33Å; H156-H160 PolarHBondContact CE1-CD2 2.86Å; H156-H160 AromaticContact CE1-NE2 3.77Å; H156-H160 AromaticContact CG-CD2 3.89Å; H156-H160 AromaticContact ND1-CD2 3.3Å; H156-H160 PolarHBondContact ND1-CD2 3.26Å; H156-H160 VanDerWaalsContact ND1-CD2 3.3Å; H156-H160 AromaticContact ND1-NE2 3.68Å; H156-H160 AromaticContact NE2-CD2 3.93Å; H156-H160 PolarHBondContact O-CD2 3.47Å; H156-H160 PolarHBondContact O-N 3.4Å; I158-H160 PolarHBondContact O-N 2.84Å; H160-E265 IonicContact CD2-OE1 3.15Å; H160-E265 IonicContact CE1-OE1 3.8Å; H160-E265 IonicContact NE2-OE1 2.7Å; H160-E265 PolarHBondContact NE2-OE1 2.67Å; H160-Q271 PolarHBondContact CE1-NE2 2.85Å; H160-Q271 VanDerWaalsContact CE1-NE2 3.26Å; H160-Q271 PolarHBondContact NE2-NE2 3.02Å
161	S	91.7	Very high	92.5	Very high	47 Å²	47	51.4 Å²	51.4	33%	0.329	29%	0.285	S	S	.	.	S	Bend	trans	-84.9	165.6	170.7	75.7	0	0	0	0	113.1	Q157 I158 Q163 R269	Q157-S161 WeakPolarHBondContact O-CB 3.49Å; Q157-S161 PolarHBondContact O-N 3.36Å; Q157-S161 PolarHBondContact O-OG 2.96Å; I158-S161 PolarHBondContact O-N 3.44Å; I158-S161 PolarHBondContact O-OG 2.95Å; S161-Q163 PolarHBondContact O-N 3.42Å; S161-Q163 WeakPolarHBondContact OG-CB 3.47Å; S161-Q163 PolarHBondContact OG-N 2.88Å; S161-Q163 VanDerWaalsContact OG-N 3.13Å; S161-R269 PolarHBondContact O-NH1 2.93Å
162	A	88.4	Confident	92.7	Very high	109 Å²	109	54.7 Å²	54.7	90%	0.901	30%	0.298	S	S	*	.	S	Bend	trans	-70.1	0.4	168.8	0	0	0	0	0	114.2
163	Q	89.1	Confident	93.2	Very high	111 Å²	111	49.8 Å²	49.8	52%	0.519	28%	0.275	S	S	.	.	S	Bend	trans	-65.5	143.9	178.2	-169	179.4	2.8	0	0	111	S161 L165 R269	S161-Q163 PolarHBondContact O-N 3.42Å; S161-Q163 WeakPolarHBondContact OG-CB 3.47Å; S161-Q163 PolarHBondContact OG-N 2.88Å; S161-Q163 VanDerWaalsContact OG-N 3.13Å; Q163-L165 PolarHBondContact O-N 3.24Å; Q163-L165 VanDerWaalsContact O-N 3.1Å; Q163-R269 PolarHBondContact O-NH1 3.2Å; Q163-R269 PolarHBondContact O-NH2 2.89Å
164	T	87.3	Confident	93.6	Very high	107 Å²	107	48.5 Å²	48.5	66%	0.656	27%	0.265	S	S	*	.			trans	-82.1	85.6	-178.2	42.9	0	0	0	0	112.7	T166 H169	T164-T166 PolarHBondContact O-N 2.98Å; T164-H169 PolarHBondContact O-CE1 3.28Å; T164-H169 VanDerWaalsContact O-CE1 3.32Å; T164-H169 PolarHBondContact O-ND1 2.7Å
165	L	92.3	Very high	93.9	Very high	22 Å²	22	49 Å²	49	12%	0.115	27%	0.267	C	S	.	.			trans	-65.9	112.2	160.1	-161.2	75.3	0	0	0	109.1	I158 I159 Q163 H169 F173 M266 R269	I158-L165 HydrophobicContact CG2-CD1 4.1Å; I159-L165 HydrophobicContact CG1-CD2 4.41Å; Q163-L165 PolarHBondContact O-N 3.24Å; Q163-L165 VanDerWaalsContact O-N 3.1Å; L165-H169 HydrophobicContact CD1-CB 3.53Å; L165-H169 HydrophobicContact CG-CB 4.08Å; L165-F173 HydrophobicContact CD1-CD2 3.81Å; L165-F173 HydrophobicContact CD1-CE2 3.58Å; L165-M266 HydrophobicContact CD2-CB 3.9Å; L165-M266 HydrophobicContact CD2-CG 4.08Å; L165-M266 WeakPolarHBondContact CD2-O 3.4Å; L165-R269 VanDerWaalsContact CB-CZ 3.47Å; L165-R269 VanDerWaalsContact CB-NH2 3.32Å
166	T	93.9	Very high	94.1	Very high	52 Å²	52	49.3 Å²	49.3	32%	0.319	27%	0.268	S	S	.	.			trans	-89.9	163.5	175.4	65	0	0	0	0	110.2	T164 E168 H169 T170	T164-T166 PolarHBondContact O-N 2.98Å; T166-E168 PolarHBondContact O-N 3.45Å; T166-E168 VanDerWaalsContact O-N 3.09Å; T166-E168 PolarHBondContact OG1-N 2.83Å; T166-H169 PolarHBondContact N-ND1 3.33Å; T166-H169 WeakPolarHBondContact O-CB 3.35Å; T166-H169 PolarHBondContact O-N 3.27Å; T166-H169 PolarHBondContact OG1-CD2 3.05Å; T166-H169 VanDerWaalsContact OG1-CD2 3.23Å; T166-H169 VanDerWaalsContact OG1-CG 3.23Å; T166-H169 PolarHBondContact OG1-N 2.66Å; T166-H169 VanDerWaalsContact OG1-N 3.12Å; T166-H169 PolarHBondContact OG1-NE2 3.21Å; T166-T170 PolarHBondContact O-N 3.25Å; T166-T170 PolarHBondContact O-OG1 3.12Å
167	P	93.8	Very high	94.3	Very high	78 Å²	78	46 Å²	46	51%	0.506	25%	0.253	S	S	.	.	H	α-helix	trans	-54.6	-28.3	171.4	-26.7	35.7	0	0	0	113.2	R171 Y357	P167-R171 WeakPolarHBondContact O-CB 3.43Å; P167-R171 PolarHBondContact O-N 3.43Å; P167-Y357 PolarHBondContact O-OH 3.38Å
168	E	95	Very high	94.7	Very high	63 Å²	63	42.2 Å²	42.2	29%	0.294	24%	0.236	S	C	.	.	H	α-helix	trans	-72.6	-39.1	174.2	-164.4	70	-100.7	0	0	113	T166 R171 Y172 K360 Y361	T166-E168 PolarHBondContact O-N 3.45Å; T166-E168 VanDerWaalsContact O-N 3.09Å; T166-E168 PolarHBondContact OG1-N 2.83Å; E168-R171 PolarHBondContact O-N 3.3Å; E168-R171 IonicContact OE1-CZ 3.84Å; E168-R171 IonicContact OE1-NH1 3.88Å; E168-R171 PolarHBondContact OE1-NH1 3.03Å; E168-R171 IonicContact OE2-NH1 2.77Å; E168-R171 PolarHBondContact OE2-NH1 3.24Å; E168-Y172 WeakPolarHBondContact O-CB 3.17Å; E168-Y172 PolarHBondContact O-N 2.96Å; E168-K360 IonicContact OE1-NZ 2.7Å; E168-K360 PolarHBondContact OE1-NZ 3.47Å; E168-K360 IonicContact OE2-NZ 2.62Å; E168-K360 PolarHBondContact OE2-NZ 3Å; E168-Y361 PolarHBondContact OE1-OH 3.37Å
169	H	95.1	Very high	94.9	Very high	72 Å²	72	42.2 Å²	42.2	33%	0.333	24%	0.235	S	C	.	.	H	α-helix	trans	-63.7	-44.6	172.9	-58.4	166.4	0	0	0	110.2	T164 L165 T166 R171 Y172 F173	T164-H169 PolarHBondContact O-CE1 3.28Å; T164-H169 VanDerWaalsContact O-CE1 3.32Å; T164-H169 PolarHBondContact O-ND1 2.7Å; L165-H169 HydrophobicContact CD1-CB 3.53Å; L165-H169 HydrophobicContact CG-CB 4.08Å; T166-H169 PolarHBondContact N-ND1 3.33Å; T166-H169 WeakPolarHBondContact O-CB 3.35Å; T166-H169 PolarHBondContact O-N 3.27Å; T166-H169 PolarHBondContact OG1-CD2 3.05Å; T166-H169 VanDerWaalsContact OG1-CD2 3.23Å; T166-H169 VanDerWaalsContact OG1-CG 3.23Å; T166-H169 PolarHBondContact OG1-N 2.66Å; T166-H169 VanDerWaalsContact OG1-N 3.12Å; T166-H169 PolarHBondContact OG1-NE2 3.21Å; H169-R171 PolarHBondContact O-N 3.2Å; H169-Y172 PolarHBondContact O-N 3Å; H169-F173 HydrophobicContact CB-CD2 4.41Å; H169-F173 HydrophobicContact CB-CE2 4.17Å; H169-F173 WeakPolarHBondContact O-CB 3.45Å; H169-F173 WeakPolarHBondContact O-CD2 3.37Å; H169-F173 WeakPolarHBondContact O-CG 3.37Å; H169-F173 PolarHBondContact O-N 1.9Å
170	T	96.3	Very high	95.1	Very high	6 Å²	6	42.2 Å²	42.2	4%	0.037	24%	0.235	C	C	.	.	H	α-helix	trans	-57	-48.4	174.1	-58.3	0	0	0	0	111.8	T166 Y172 L174 F263 M266 M267	T166-T170 PolarHBondContact O-N 3.25Å; T166-T170 PolarHBondContact O-OG1 3.12Å; T170-Y172 PolarHBondContact O-N 3.05Å; T170-L174 VanDerWaalsContact O-CB 3.29Å; T170-L174 WeakPolarHBondContact O-CB 3.43Å; T170-L174 PolarHBondContact O-N 3.3Å; T170-F263 HydrophobicContact CG2-CD2 3.77Å; T170-F263 HydrophobicContact CG2-CE2 3.73Å; T170-M266 HydrophobicContact CG2-CB 3.78Å; T170-M266 HydrophobicContact CG2-CE 4.07Å; T170-M266 HydrophobicContact CG2-SD 4.22Å; T170-M267 HydrophobicContact CG2-CG 4.08Å
171	R	97.4	Very high	95.4	Very high	26 Å²	26	38.4 Å²	38.4	10%	0.098	22%	0.217	C	C	.	.	H	α-helix	trans	-59.8	-43.4	176.8	-172.7	-174.4	-66.1	110.1	3.3	112.3	P167 E168 H169 Y175 E328 Y357 V358 Y361	P167-R171 WeakPolarHBondContact O-CB 3.43Å; P167-R171 PolarHBondContact O-N 3.43Å; E168-R171 PolarHBondContact O-N 3.3Å; E168-R171 IonicContact OE1-CZ 3.84Å; E168-R171 IonicContact OE1-NH1 3.88Å; E168-R171 PolarHBondContact OE1-NH1 3.03Å; E168-R171 IonicContact OE2-NH1 2.77Å; E168-R171 PolarHBondContact OE2-NH1 3.24Å; H169-R171 PolarHBondContact O-N 3.2Å; R171-Y175 WeakPolarHBondContact O-CB 3.48Å; R171-Y175 PolarHBondContact O-N 3.11Å; R171-E328 IonicContact CZ-OE1 3.61Å; R171-E328 IonicContact CZ-OE2 2.68Å; R171-E328 IonicContact NH2-OE1 3.84Å; R171-E328 PolarHBondContact NH2-OE1 3.35Å; R171-E328 IonicContact NH2-OE2 2.68Å; R171-E328 PolarHBondContact NH2-OE2 3.4Å; R171-Y357 HydrophobicContact CB-CE1 4.09Å; R171-Y357 HydrophobicContact CB-CE2 4.45Å; R171-Y357 WeakPolarHBondContact CD-O 3.37Å; R171-Y357 HydrophobicContact CG-CD1 4.47Å; R171-Y357 HydrophobicContact CG-CE1 4.11Å; R171-Y357 WeakPolarHBondContact CG-O 3.43Å; R171-Y357 PolarHBondContact N-OH 3.03Å; R171-Y357 PolarHBondContact NE-O 2.92Å; R171-V358 HydrophobicContact CG-CG1 4.45Å; R171-Y361 HydrophobicContact CG-CD2 4.15Å; R171-Y361 HydrophobicContact CG-CE2 4.07Å
172	Y	97.5	Very high	95.7	Very high	73 Å²	73	37.3 Å²	37.3	29%	0.286	21%	0.207	S	C	.	.	H	α-helix	trans	-73.9	-37.3	-177.2	-173.7	-125.6	0	0	0	113.1	E168 H169 T170 Y175 Q176 C205 Y361	E168-Y172 WeakPolarHBondContact O-CB 3.17Å; E168-Y172 PolarHBondContact O-N 2.96Å; H169-Y172 PolarHBondContact O-N 3Å; T170-Y172 PolarHBondContact O-N 3.05Å; Y172-Y175 HydrophobicContact CD2-CD1 4.45Å; Y172-Y175 HydrophobicContact CE2-CD1 4.48Å; Y172-Q176 HydrophobicContact CE2-CG 4.22Å; Y172-Q176 WeakPolarHBondContact O-CG 3.38Å; Y172-Q176 PolarHBondContact O-N 2.48Å; Y172-Q176 VanDerWaalsContact O-N 3.09Å; Y172-Q176 PolarHBondContact O-NE2 3.07Å; Y172-C205 HydrophobicContact CD1-CB 4.48Å; Y172-C205 HydrophobicContact CE1-CB 4.34Å; Y172-C205 WeakPolarHBondContact CE1-O 3.3Å; Y172-Y361 AromaticContact CD2-CD1 3.75Å; Y172-Y361 HydrophobicContact CD2-CD1 3.75Å; Y172-Y361 HydrophobicContact CD2-CD2 4.42Å; Y172-Y361 AromaticContact CD2-CE1 3.46Å; Y172-Y361 HydrophobicContact CD2-CE1 3.46Å; Y172-Y361 VanDerWaalsContact CD2-CE1 3.46Å; Y172-Y361 HydrophobicContact CD2-CE2 4.18Å; Y172-Y361 HydrophobicContact CD2-CG 4.23Å; Y172-Y361 AromaticContact CD2-CZ 3.71Å; Y172-Y361 HydrophobicContact CE2-CD1 4.07Å; Y172-Y361 AromaticContact CE2-CE1 3.92Å; Y172-Y361 HydrophobicContact CE2-CE1 3.92Å; Y172-Y361 HydrophobicContact CG-CE1 4.31Å
173	F	98.3	Very high	96.2	Very high	5 Å²	5	33.2 Å²	33.2	2%	0.022	17%	0.168	C	C	.	.	H	α-helix	trans	-68.6	-40.6	172	-68.2	-43.4	0	0	0	111.8	L155 L165 H169 Q176 L177 V201 C205 L207 M266	L155-F173 HydrophobicContact CD1-CB 4.49Å; L155-F173 HydrophobicContact CD1-CD2 3.73Å; L155-F173 HydrophobicContact CD1-CE2 4.08Å; L155-F173 HydrophobicContact CD1-CG 4.1Å; L165-F173 HydrophobicContact CD1-CD2 3.81Å; L165-F173 HydrophobicContact CD1-CE2 3.58Å; H169-F173 HydrophobicContact CB-CD2 4.41Å; H169-F173 HydrophobicContact CB-CE2 4.17Å; H169-F173 WeakPolarHBondContact O-CB 3.45Å; H169-F173 WeakPolarHBondContact O-CD2 3.37Å; H169-F173 WeakPolarHBondContact O-CG 3.37Å; H169-F173 PolarHBondContact O-N 1.9Å; F173-Q176 PolarHBondContact O-N 3.21Å; F173-L177 VanDerWaalsContact O-CB 3.32Å; F173-L177 WeakPolarHBondContact O-CB 3.19Å; F173-L177 PolarHBondContact O-N 3.42Å; F173-V201 HydrophobicContact CE1-CG1 3.62Å; F173-V201 HydrophobicContact CE1-CG2 4.18Å; F173-V201 HydrophobicContact CZ-CG1 3.8Å; F173-C205 HydrophobicContact CE1-CB 3.99Å; F173-C205 HydrophobicContact CZ-CB 4.17Å; F173-L207 HydrophobicContact CB-CD1 3.87Å; F173-L207 HydrophobicContact CD1-CB 4.09Å; F173-L207 HydrophobicContact CD1-CD1 3.9Å; F173-L207 HydrophobicContact CG-CD1 4.18Å; F173-M266 HydrophobicContact CB-SD 3.88Å; F173-M266 HydrophobicContact CD2-SD 4.39Å
174	L	98.4	Very high	96.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62	-45.4	174.6	-174.1	64.4	0	0	0	111.7	T170 Q176 L177 L178 V259 F263 M266 L334 M338 Y357 V358	T170-L174 VanDerWaalsContact O-CB 3.29Å; T170-L174 WeakPolarHBondContact O-CB 3.43Å; T170-L174 PolarHBondContact O-N 3.3Å; L174-Q176 PolarHBondContact O-N 3.02Å; L174-L177 PolarHBondContact O-N 3.16Å; L174-L178 HydrophobicContact CD1-CD1 4.34Å; L174-L178 HydrophobicContact CD1-CG 4.34Å; L174-L178 HydrophobicContact CG-CD1 3.97Å; L174-L178 HydrophobicContact CG-CG 4.4Å; L174-L178 WeakPolarHBondContact O-CB 3.44Å; L174-L178 VanDerWaalsContact O-CG 3.29Å; L174-L178 WeakPolarHBondContact O-CG 3.49Å; L174-L178 PolarHBondContact O-N 2.68Å; L174-V259 HydrophobicContact CD1-CG1 3.61Å; L174-F263 HydrophobicContact CD1-CB 4.15Å; L174-F263 HydrophobicContact CD1-CG 4.26Å; L174-F263 HydrophobicContact CD2-CD1 3.79Å; L174-F263 HydrophobicContact CD2-CD2 3.89Å; L174-F263 HydrophobicContact CD2-CE1 3.75Å; L174-F263 HydrophobicContact CD2-CE2 3.86Å; L174-F263 HydrophobicContact CD2-CG 3.85Å; L174-F263 HydrophobicContact CD2-CZ 3.78Å; L174-M266 HydrophobicContact CB-CE 4.22Å; L174-L334 HydrophobicContact CD2-CD2 3.72Å; L174-M338 HydrophobicContact CD1-CE 4.38Å; L174-Y357 HydrophobicContact CD2-CD1 3.99Å; L174-Y357 HydrophobicContact CD2-CE1 3.83Å; L174-V358 HydrophobicContact CD2-CG1 4.4Å
175	Y	98.6	Very high	97	Very high	15 Å²	15	23.2 Å²	23.2	6%	0.059	11%	0.114	C	C	.	.	H	α-helix	trans	-57.1	-46.9	174.6	168.3	-103.3	0	0	0	112.2	R171 Y172 L178 R179 L353 Y361	R171-Y175 WeakPolarHBondContact O-CB 3.48Å; R171-Y175 PolarHBondContact O-N 3.11Å; Y172-Y175 HydrophobicContact CD2-CD1 4.45Å; Y172-Y175 HydrophobicContact CE2-CD1 4.48Å; Y175-L178 PolarHBondContact O-N 3.32Å; Y175-R179 VanDerWaalsContact O-CB 3.31Å; Y175-R179 WeakPolarHBondContact O-CB 3.41Å; Y175-R179 PolarHBondContact O-N 2.85Å; Y175-L353 HydrophobicContact CD2-CD2 3.73Å; Y175-L353 HydrophobicContact CE2-CD2 3.84Å; Y175-Y361 HydrophobicContact CD1-CG 4.18Å; Y175-Y361 WeakPolarHBondContact CE2-O 3.21Å; Y175-Y361 VanDerWaalsContact CG-CB 3.46Å; Y175-Y361 HydrophobicContact CG-CG 4.22Å; Y175-Y361 PolarHBondContact OH-O 3.09Å
176	Q	98.5	Very high	97.2	Very high	7 Å²	7	24 Å²	24	3%	0.033	12%	0.121	C	C	.	.	H	α-helix	trans	-65.8	-38.7	179.4	-75.5	-175.5	91.8	0	0	113.1	N124 Y172 F173 L174 G180 C205 L207	N124-Q176 WeakPolarHBondContact CB-O 3.49Å; N124-Q176 PolarHBondContact ND2-OE1 3.45Å; Y172-Q176 HydrophobicContact CE2-CG 4.22Å; Y172-Q176 WeakPolarHBondContact O-CG 3.38Å; Y172-Q176 PolarHBondContact O-N 2.48Å; Y172-Q176 VanDerWaalsContact O-N 3.09Å; Y172-Q176 PolarHBondContact O-NE2 3.07Å; F173-Q176 PolarHBondContact O-N 3.21Å; L174-Q176 PolarHBondContact O-N 3.02Å; Q176-G180 PolarHBondContact O-N 3.26Å; Q176-C205 PolarHBondContact NE2-O 3.05Å; Q176-L207 HydrophobicContact CB-CB 3.99Å; Q176-L207 HydrophobicContact CB-CD2 4.46Å
177	L	98.7	Very high	97.3	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-61.5	-49.5	173.7	175.5	55.9	0	0	0	110.8	F173 L174 G180 L181 L199 L207 I209 V259 I262	F173-L177 VanDerWaalsContact O-CB 3.32Å; F173-L177 WeakPolarHBondContact O-CB 3.19Å; F173-L177 PolarHBondContact O-N 3.42Å; L174-L177 PolarHBondContact O-N 3.16Å; L177-G180 PolarHBondContact O-N 3.26Å; L177-L181 VanDerWaalsContact O-CB 3.26Å; L177-L181 WeakPolarHBondContact O-CB 3.26Å; L177-L181 PolarHBondContact O-N 2.95Å; L177-L199 HydrophobicContact CD1-CD1 3.85Å; L177-L199 HydrophobicContact CD1-CD2 3.69Å; L177-L199 HydrophobicContact CD1-CG 4.45Å; L177-L199 HydrophobicContact CD2-CD1 3.74Å; L177-L199 HydrophobicContact CG-CD1 4.34Å; L177-L207 HydrophobicContact CB-CD2 4.27Å; L177-I209 HydrophobicContact CD1-CD1 4.09Å; L177-I209 HydrophobicContact CD1-CG1 4.07Å; L177-V259 HydrophobicContact CD2-CB 4.45Å; L177-V259 HydrophobicContact CD2-CG1 4.08Å; L177-V259 HydrophobicContact CD2-CG2 3.98Å; L177-V259 HydrophobicContact CG-CG2 4.11Å; L177-I262 HydrophobicContact CD2-CD1 4.47Å; L177-I262 HydrophobicContact CD2-CG2 4.24Å
178	L	98.7	Very high	97.2	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-63.9	-41.8	177.1	-68.6	171.5	0	0	0	112.3	L174 Y175 G180 L181 K182 M256 V259 M338 V349 A352 L353	L174-L178 HydrophobicContact CD1-CD1 4.34Å; L174-L178 HydrophobicContact CD1-CG 4.34Å; L174-L178 HydrophobicContact CG-CD1 3.97Å; L174-L178 HydrophobicContact CG-CG 4.4Å; L174-L178 WeakPolarHBondContact O-CB 3.44Å; L174-L178 VanDerWaalsContact O-CG 3.29Å; L174-L178 WeakPolarHBondContact O-CG 3.49Å; L174-L178 PolarHBondContact O-N 2.68Å; Y175-L178 PolarHBondContact O-N 3.32Å; L178-G180 PolarHBondContact O-N 3.45Å; L178-L181 PolarHBondContact O-N 3.43Å; L178-K182 WeakPolarHBondContact O-CB 3.45Å; L178-K182 PolarHBondContact O-N 3.42Å; L178-M256 HydrophobicContact CD2-CE 3.84Å; L178-M256 HydrophobicContact CD2-SD 4.22Å; L178-V259 HydrophobicContact CD2-CG1 4.11Å; L178-M338 HydrophobicContact CD1-CE 4.31Å; L178-M338 HydrophobicContact CD2-CE 4.02Å; L178-V349 HydrophobicContact CB-CG2 4.34Å; L178-V349 HydrophobicContact CD2-CG2 4.02Å; L178-V349 VanDerWaalsContact O-CG2 3.23Å; L178-V349 WeakPolarHBondContact O-CG2 3.45Å; L178-A352 HydrophobicContact CD1-CB 3.92Å; L178-A352 HydrophobicContact CD2-CB 3.86Å; L178-L353 HydrophobicContact CB-CD1 4.46Å; L178-L353 HydrophobicContact CB-CD2 3.65Å; L178-L353 HydrophobicContact CB-CG 3.85Å
179	R	98.5	Very high	97.1	Very high	13 Å²	13	18.7 Å²	18.7	5%	0.049	9%	0.089	C	C	.	.	H	α-helix	trans	-61.2	-43.6	175.4	-176.1	-176.2	176.3	-105.7	3.6	111.4	H122 D123 N124 Y175 D366 E367	H122-R179 PolarHBondContact CE1-O 3.17Å; H122-R179 PolarHBondContact NE2-NH1 2.88Å; D123-R179 IonicContact OD2-CZ 3.32Å; D123-R179 IonicContact OD2-NH1 2.77Å; D123-R179 PolarHBondContact OD2-NH1 2.79Å; D123-R179 IonicContact OD2-NH2 3.11Å; D123-R179 PolarHBondContact OD2-NH2 2.93Å; N124-R179 PolarHBondContact OD1-NH1 3.46Å; Y175-R179 VanDerWaalsContact O-CB 3.31Å; Y175-R179 WeakPolarHBondContact O-CB 3.41Å; Y175-R179 PolarHBondContact O-N 2.85Å; R179-D366 VanDerWaalsContact CZ-O 3.25Å; R179-D366 PolarHBondContact NE-O 2.83Å; R179-D366 PolarHBondContact NH2-O 3.42Å; R179-D366 IonicContact NH2-OD1 2.7Å; R179-D366 IonicContact NH2-OD2 3.63Å; R179-E367 HydrophobicContact CG-CG 4.15Å
180	G	98.2	Very high	97.1	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.2	-48.3	172.3	0	0	0	0	0	112.2	Q176 L177 L178 K182 Y183 V184	Q176-G180 PolarHBondContact O-N 3.26Å; L177-G180 PolarHBondContact O-N 3.26Å; L178-G180 PolarHBondContact O-N 3.45Å; G180-K182 PolarHBondContact O-N 2.97Å; G180-Y183 WeakPolarHBondContact O-CB 3.39Å; G180-Y183 PolarHBondContact O-N 2.93Å; G180-V184 WeakPolarHBondContact O-CG2 3.48Å; G180-V184 PolarHBondContact O-N 3.01Å; G180-V184 VanDerWaalsContact O-N 3.16Å
181	L	98.3	Very high	96.9	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-67.4	-34	-176.7	-168.2	62.7	0	0	0	112.5	L177 L178 Y183 V184 H185 L194 I209 D255 M256 V259 V349	L177-L181 VanDerWaalsContact O-CB 3.26Å; L177-L181 WeakPolarHBondContact O-CB 3.26Å; L177-L181 PolarHBondContact O-N 2.95Å; L178-L181 PolarHBondContact O-N 3.43Å; L181-Y183 VanDerWaalsContact C-N 3.28Å; L181-Y183 PolarHBondContact O-N 2.86Å; L181-V184 HydrophobicContact CD1-CB 4.41Å; L181-V184 PolarHBondContact O-N 2.72Å; L181-V184 VanDerWaalsContact O-N 3.15Å; L181-H185 WeakPolarHBondContact CD1-NE2 3.31Å; L181-H185 VanDerWaalsContact O-CB 3.29Å; L181-H185 WeakPolarHBondContact O-CB 3.11Å; L181-H185 PolarHBondContact O-N 3.49Å; L181-L194 HydrophobicContact CD1-CD1 4.06Å; L181-L194 HydrophobicContact CD2-CD1 4.15Å; L181-I209 HydrophobicContact CB-CD1 4.5Å; L181-D255 HydrophobicContact CD1-CB 4.05Å; L181-D255 HydrophobicContact CD2-CB 3.99Å; L181-M256 HydrophobicContact CD2-SD 3.81Å; L181-V259 HydrophobicContact CD2-CG2 3.7Å; L181-V349 HydrophobicContact CB-CG2 3.93Å; L181-V349 HydrophobicContact CD2-CG2 4.35Å; L181-V349 HydrophobicContact CG-CG2 4.19Å
182	K	98.2	Very high	96.6	Very high	24 Å²	24	15.5 Å²	15.5	10%	0.104	7%	0.073	C	C	.	.	H	α-helix	trans	-55	-44.3	171.7	-169.7	-163	-159.4	176.8	0	111.5	L178 G180 S186 V349 L353 E367	L178-K182 WeakPolarHBondContact O-CB 3.45Å; L178-K182 PolarHBondContact O-N 3.42Å; G180-K182 PolarHBondContact O-N 2.97Å; K182-S186 VanDerWaalsContact O-CB 3.31Å; K182-S186 WeakPolarHBondContact O-CB 3.44Å; K182-S186 PolarHBondContact O-N 2.84Å; K182-S186 PolarHBondContact O-OG 3.11Å; K182-V349 HydrophobicContact CB-CG1 4.29Å; K182-V349 HydrophobicContact CB-CG2 4.13Å; K182-L353 HydrophobicContact CB-CD1 3.91Å; K182-L353 HydrophobicContact CD-CD1 3.65Å; K182-L353 HydrophobicContact CG-CD1 4.1Å; K182-E367 HydrophobicContact CD-CB 3.94Å; K182-E367 PolarHBondContact NZ-O 2.99Å; K182-E367 IonicContact NZ-OE2 2.68Å; K182-E367 PolarHBondContact NZ-OE2 3.47Å
183	Y	98.1	Very high	96.3	Very high	22 Å²	22	12.3 Å²	12.3	9%	0.086	6%	0.061	C	C	.	.	H	α-helix	trans	-67	-43.1	177.4	-172.6	-87.7	0	0	0	111.7	F120 K121 H122 I125 G180 L181 S186 A187 P368 C370	F120-Y183 HydrophobicContact CB-CE1 3.97Å; F120-Y183 HydrophobicContact CD1-CD1 4.14Å; F120-Y183 AromaticContact CD1-CE1 3.6Å; F120-Y183 HydrophobicContact CD1-CE1 3.6Å; F120-Y183 HydrophobicContact CE1-CD1 4.49Å; F120-Y183 HydrophobicContact CE1-CE1 4.27Å; F120-Y183 HydrophobicContact CG-CD1 4.39Å; F120-Y183 AromaticContact CG-CE1 3.95Å; F120-Y183 HydrophobicContact CG-CE1 3.95Å; K121-Y183 PolarHBondContact N-OH 3.31Å; H122-Y183 HydrophobicContact CB-CD1 3.83Å; H122-Y183 HydrophobicContact CB-CD2 4.18Å; H122-Y183 HydrophobicContact CB-CE1 4.05Å; H122-Y183 HydrophobicContact CB-CE2 4.4Å; H122-Y183 HydrophobicContact CB-CG 3.88Å; H122-Y183 AromaticContact CG-CG 3.95Å; I125-Y183 HydrophobicContact CD1-CD1 3.61Å; I125-Y183 HydrophobicContact CD1-CE1 4.27Å; I125-Y183 HydrophobicContact CD1-CG 4.44Å; G180-Y183 WeakPolarHBondContact O-CB 3.39Å; G180-Y183 PolarHBondContact O-N 2.93Å; L181-Y183 VanDerWaalsContact C-N 3.28Å; L181-Y183 PolarHBondContact O-N 2.86Å; Y183-S186 PolarHBondContact O-OG 3.11Å; Y183-A187 PolarHBondContact O-N 3.02Å; Y183-P368 HydrophobicContact CD2-CG 4.21Å; Y183-C370 HydrophobicContact CD1-CB 3.97Å; Y183-C370 HydrophobicContact CD2-CB 4.06Å; Y183-C370 HydrophobicContact CE1-CB 3.74Å; Y183-C370 HydrophobicContact CE2-CB 3.83Å; Y183-C370 HydrophobicContact CG-CB 4.14Å; Y183-C370 VanDerWaalsContact O-CB 3.26Å; Y183-C370 WeakPolarHBondContact O-CB 3.49Å
184	V	97.3	Very high	96.2	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-63	-50.3	176.3	178.3	0	0	0	0	111.6	F120 I125 G180 L181 S186 A187 V189 F212	F120-V184 HydrophobicContact CD2-CG2 4.49Å; F120-V184 HydrophobicContact CE2-CB 4.34Å; F120-V184 HydrophobicContact CE2-CG1 4.17Å; F120-V184 HydrophobicContact CE2-CG2 3.82Å; F120-V184 HydrophobicContact CZ-CB 4.27Å; F120-V184 HydrophobicContact CZ-CG1 4.13Å; F120-V184 HydrophobicContact CZ-CG2 4.2Å; I125-V184 HydrophobicContact CD1-CG2 3.58Å; I125-V184 HydrophobicContact CG1-CG2 4.36Å; G180-V184 WeakPolarHBondContact O-CG2 3.48Å; G180-V184 PolarHBondContact O-N 3.01Å; G180-V184 VanDerWaalsContact O-N 3.16Å; L181-V184 HydrophobicContact CD1-CB 4.41Å; L181-V184 PolarHBondContact O-N 2.72Å; L181-V184 VanDerWaalsContact O-N 3.15Å; V184-S186 PolarHBondContact O-N 3.25Å; V184-A187 WeakPolarHBondContact O-CA 3.29Å; V184-A187 VanDerWaalsContact O-CB 3.28Å; V184-A187 WeakPolarHBondContact O-CB 3.44Å; V184-A187 PolarHBondContact O-N 3.2Å; V184-V189 HydrophobicContact CG1-CB 3.73Å; V184-V189 HydrophobicContact CG1-CG1 3.68Å; V184-V189 PolarHBondContact O-N 3.46Å; V184-F212 HydrophobicContact CG1-CE1 4.1Å; V184-F212 HydrophobicContact CG2-CE1 3.85Å; V184-F212 HydrophobicContact CG2-CZ 4.06Å
185	H	96.6	Very high	96	Very high	9 Å²	9	13.2 Å²	13.2	4%	0.042	7%	0.065	C	C	.	.	H	α-helix	trans	-64.6	-40.5	-177.9	-77.8	-170.8	0	0	0	112.8	L181 A187 N188 V189 L252 D255 V349	L181-H185 WeakPolarHBondContact CD1-NE2 3.31Å; L181-H185 VanDerWaalsContact O-CB 3.29Å; L181-H185 WeakPolarHBondContact O-CB 3.11Å; L181-H185 PolarHBondContact O-N 3.49Å; H185-A187 PolarHBondContact O-N 2.88Å; H185-A187 VanDerWaalsContact O-N 3.16Å; H185-N188 PolarHBondContact O-N 3.1Å; H185-V189 PolarHBondContact CD2-O 3.31Å; H185-L252 HydrophobicContact CB-CD1 4.1Å; H185-L252 HydrophobicContact CB-CD2 4.1Å; H185-L252 PolarHBondContact CE1-O 3.42Å; H185-D255 IonicContact CD2-OD2 3.5Å; H185-D255 IonicContact CE1-OD2 2.72Å; H185-D255 IonicContact NE2-OD2 2.57Å; H185-D255 PolarHBondContact NE2-OD2 3.22Å; H185-V349 HydrophobicContact CB-CG1 4.15Å
186	S	96.3	Very high	95.8	Very high	39 Å²	39	12.5 Å²	12.5	27%	0.273	6%	0.062	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-11	173.5	59.6	0	0	0	0	114.2	K182 Y183 V184 N188 T369 C370	K182-S186 VanDerWaalsContact O-CB 3.31Å; K182-S186 WeakPolarHBondContact O-CB 3.44Å; K182-S186 PolarHBondContact O-N 2.84Å; K182-S186 PolarHBondContact O-OG 3.11Å; Y183-S186 PolarHBondContact O-OG 3.11Å; V184-S186 PolarHBondContact O-N 3.25Å; S186-N188 VanDerWaalsContact C-N 3.35Å; S186-T369 VanDerWaalsContact OG-CA 3.29Å; S186-T369 WeakPolarHBondContact OG-CA 3.19Å; S186-T369 WeakPolarHBondContact OG-CB 3.45Å; S186-C370 PolarHBondContact OG-N 3.29Å
187	A	95.3	Very high	95.5	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	6.5	169.1	0	0	0	0	0	114	F120 Y183 V184 H185 V189 C370 F374	F120-A187 HydrophobicContact CE1-CB 3.6Å; F120-A187 HydrophobicContact CZ-CB 4.07Å; Y183-A187 PolarHBondContact O-N 3.02Å; V184-A187 WeakPolarHBondContact O-CA 3.29Å; V184-A187 VanDerWaalsContact O-CB 3.28Å; V184-A187 WeakPolarHBondContact O-CB 3.44Å; V184-A187 PolarHBondContact O-N 3.2Å; H185-A187 PolarHBondContact O-N 2.88Å; H185-A187 VanDerWaalsContact O-N 3.16Å; A187-V189 HydrophobicContact CB-CG2 4.07Å; A187-V189 PolarHBondContact O-N 3.26Å; A187-C370 HydrophobicContact CB-CB 3.78Å; A187-F374 HydrophobicContact CB-CB 4.3Å; A187-F374 PolarHBondContact O-N 2.84Å
188	N	92.6	Very high	95.2	Very high	81 Å²	81	13.8 Å²	13.8	43%	0.433	7%	0.071	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	23.8	-168.9	-64.9	-8.7	0	0	0	114.6	H185 S186 G217 L218	H185-N188 PolarHBondContact O-N 3.1Å; S186-N188 VanDerWaalsContact C-N 3.35Å; N188-G217 WeakPolarHBondContact O-CA 3.38Å; N188-L218 HydrophobicContact CB-CD1 4.17Å; N188-L218 PolarHBondContact O-N 2.91Å
189	V	93.5	Very high	95.1	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.6	175.7	178.8	0	0	0	0	110	F120 V184 H185 A187 A215 F374 F376	F120-V189 HydrophobicContact CE1-CG2 4.45Å; F120-V189 HydrophobicContact CZ-CB 4.14Å; F120-V189 HydrophobicContact CZ-CG1 4.43Å; F120-V189 HydrophobicContact CZ-CG2 3.8Å; V184-V189 HydrophobicContact CG1-CB 3.73Å; V184-V189 HydrophobicContact CG1-CG1 3.68Å; V184-V189 PolarHBondContact O-N 3.46Å; H185-V189 PolarHBondContact CD2-O 3.31Å; A187-V189 HydrophobicContact CB-CG2 4.07Å; A187-V189 PolarHBondContact O-N 3.26Å; V189-A215 HydrophobicContact CG1-CB 3.93Å; V189-F374 HydrophobicContact CG2-CB 3.78Å; V189-F374 HydrophobicContact CG2-CD1 4.19Å; V189-F374 HydrophobicContact CG2-CG 4.2Å; V189-F376 HydrophobicContact CB-CE2 4.45Å; V189-F376 HydrophobicContact CB-CZ 4.49Å; V189-F376 HydrophobicContact CG1-CZ 4.23Å; V189-F376 HydrophobicContact CG2-CE2 3.77Å; V189-F376 HydrophobicContact CG2-CZ 3.96Å
190	I	93.1	Very high	95	Very high	3 Å²	3	13.2 Å²	13.2	2%	0.015	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	134.7	163.9	-49.1	166.7	0	0	0	107.3	R192 A215 R216 L218 L252 I254 D255	I190-R192 HydrophobicContact CB-CG 4.27Å; I190-R192 HydrophobicContact CG2-CG 3.76Å; I190-A215 CarbonylContact O-C 3.53Å; I190-A215 WeakPolarHBondContact O-CA 3.4Å; I190-A215 VanDerWaalsContact O-CB 3.25Å; I190-A215 WeakPolarHBondContact O-CB 3.31Å; I190-R216 PolarHBondContact N-O 3.43Å; I190-R216 PolarHBondContact O-N 2.72Å; I190-L218 HydrophobicContact CD1-CD2 4Å; I190-L218 HydrophobicContact CG1-CD2 4.33Å; I190-L252 HydrophobicContact CG1-CD2 4.05Å; I190-I254 HydrophobicContact CG2-CB 4.24Å; I190-I254 HydrophobicContact CG2-CG2 4.42Å; I190-D255 WeakPolarHBondContact CA-OD2 3.38Å; I190-D255 WeakPolarHBondContact CG2-OD2 3.42Å
191	H	93.7	Very high	94.8	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.005	7%	0.07	C	C	.	.			trans	-78.7	-36.8	-179.7	-166.8	-77.3	0	0	0	113.3	D193 L194 I209 G210 D211 F212 M214 A215 D255	H191-D193 PolarHBondContact CE1-O 2.77Å; H191-D193 VanDerWaalsContact ND1-C 3.35Å; H191-D193 PolarHBondContact ND1-O 3.45Å; H191-D193 PolarHBondContact O-N 3.13Å; H191-L194 HydrophobicContact CB-CD1 4.47Å; H191-L194 HydrophobicContact CB-CD2 4.13Å; H191-L194 HydrophobicContact CB-CG 3.9Å; H191-I209 WeakPolarHBondContact NE2-CG2 3.38Å; H191-G210 PolarHBondContact CE1-O 2.86Å; H191-G210 PolarHBondContact NE2-O 3.35Å; H191-G210 VanDerWaalsContact NE2-O 3.12Å; H191-D211 PolarHBondContact CE1-O 2.82Å; H191-F212 AromaticContact CD2-CD1 3.71Å; H191-F212 AromaticContact CD2-CE1 3.5Å; H191-F212 AromaticContact CD2-CZ 3.88Å; H191-M214 CarbonylContact O-C 3.59Å; H191-A215 PolarHBondContact O-N 3.28Å; H191-D255 WeakPolarHBondContact CB-OD1 3.31Å; H191-D255 PolarHBondContact N-OD1 3.35Å; H191-D255 VanDerWaalsContact N-OD1 3.15Å; H191-D255 PolarHBondContact N-OD2 3.04Å
192	R	90.4	Very high	94.5	Very high	32 Å²	32	14.4 Å²	14.4	12%	0.121	8%	0.076	C	C	.	.	S	Bend	trans	64	-28.1	178.4	-62.8	-177.5	60.5	-175.8	-4.9	117.2	I190 F228 D255	I190-R192 HydrophobicContact CB-CG 4.27Å; I190-R192 HydrophobicContact CG2-CG 3.76Å; R192-F228 PolarHBondContact NH1-O 3.2Å; R192-D255 PolarHBondContact N-OD1 3.13Å
193	D	91	Very high	93.8	Very high	6 Å²	6	21.5 Å²	21.5	3%	0.032	11%	0.109	C	C	.	.			trans	-120.9	54.4	176	-171.8	33.3	0	0	0	111.9	H191 K195 N198 M214 A234	H191-D193 PolarHBondContact CE1-O 2.77Å; H191-D193 VanDerWaalsContact ND1-C 3.35Å; H191-D193 PolarHBondContact ND1-O 3.45Å; H191-D193 PolarHBondContact O-N 3.13Å; D193-K195 WeakPolarHBondContact OD1-CD 3.32Å; D193-K195 WeakPolarHBondContact OD1-CE 3.49Å; D193-K195 IonicContact OD1-NZ 2.75Å; D193-K195 PolarHBondContact OD1-NZ 3.25Å; D193-K195 WeakPolarHBondContact OD2-CE 3.4Å; D193-K195 IonicContact OD2-NZ 2.68Å; D193-K195 PolarHBondContact OD2-NZ 3.4Å; D193-N198 PolarHBondContact O-ND2 2.9Å; D193-N198 PolarHBondContact OD2-ND2 3.25Å; D193-M214 HydrophobicContact CB-CB 3.85Å; D193-M214 HydrophobicContact CB-CG 4.17Å; D193-A234 HydrophobicContact CB-CB 3.86Å
194	L	95.4	Very high	93.3	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.131	C	C	.	.			trans	-79.6	122.3	168.7	-73.7	-179.8	0	0	0	109.8	L181 H191 L199 I209 Y238 D255 S258 V259 I262	L181-L194 HydrophobicContact CD1-CD1 4.06Å; L181-L194 HydrophobicContact CD2-CD1 4.15Å; H191-L194 HydrophobicContact CB-CD1 4.47Å; H191-L194 HydrophobicContact CB-CD2 4.13Å; H191-L194 HydrophobicContact CB-CG 3.9Å; L194-L199 HydrophobicContact CD2-CD2 4.3Å; L194-I209 HydrophobicContact CD2-CG2 3.93Å; L194-Y238 WeakPolarHBondContact O-CB 3.37Å; L194-D255 HydrophobicContact CD1-CB 3.74Å; L194-S258 WeakPolarHBondContact O-CB 3.36Å; L194-V259 HydrophobicContact CD1-CG2 3.99Å; L194-I262 HydrophobicContact CB-CD1 4.11Å
195	K	94.7	Very high	93.1	Very high	24 Å²	24	26.2 Å²	26.2	10%	0.104	15%	0.145	C	C	.	.			trans	-156.8	159.5	177	58.1	-174.3	178.8	-135.7	0	109.5	D193 S197 N198 T235 Y238	D193-K195 WeakPolarHBondContact OD1-CD 3.32Å; D193-K195 WeakPolarHBondContact OD1-CE 3.49Å; D193-K195 IonicContact OD1-NZ 2.75Å; D193-K195 PolarHBondContact OD1-NZ 3.25Å; D193-K195 WeakPolarHBondContact OD2-CE 3.4Å; D193-K195 IonicContact OD2-NZ 2.68Å; D193-K195 PolarHBondContact OD2-NZ 3.4Å; K195-S197 VanDerWaalsContact CE-OG 3.28Å; K195-S197 WeakPolarHBondContact CE-OG 3.46Å; K195-S197 WeakPolarHBondContact CG-OG 3.38Å; K195-S197 PolarHBondContact O-N 3.09Å; K195-S197 VanDerWaalsContact O-N 3.11Å; K195-N198 WeakPolarHBondContact CE-ND2 3.33Å; K195-N198 VanDerWaalsContact CE-OD1 3.24Å; K195-N198 WeakPolarHBondContact CE-OD1 3.43Å; K195-N198 HydrophobicContact CG-CB 4.14Å; K195-N198 PolarHBondContact O-N 3.15Å; K195-T235 HydrophobicContact CD-CG2 4.42Å; K195-T235 WeakPolarHBondContact CD-OG1 3.08Å; K195-T235 PolarHBondContact NZ-OG1 3.15Å; K195-Y238 HydrophobicContact CB-CD1 4.39Å; K195-Y238 HydrophobicContact CB-CD2 3.48Å; K195-Y238 VanDerWaalsContact CB-CD2 3.48Å; K195-Y238 HydrophobicContact CB-CE1 4.41Å; K195-Y238 HydrophobicContact CB-CE2 3.51Å; K195-Y238 HydrophobicContact CB-CG 3.96Å; K195-Y238 HydrophobicContact CD-CE2 4.49Å
196	P	95.2	Very high	93	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-60	-28	-173	-23.6	34.3	0	0	0	114.2	L155 H156 I159 N198 L199 Y238 I262	L155-P196 HydrophobicContact CB-CB 4.19Å; L155-P196 WeakPolarHBondContact CB-O 3.21Å; L155-P196 HydrophobicContact CG-CB 4.41Å; L155-P196 PolarHBondContact N-O 2.79Å; H156-P196 HydrophobicContact CB-CB 3.91Å; H156-P196 PolarHBondContact N-O 2.89Å; H156-P196 VanDerWaalsContact N-O 3.1Å; I159-P196 HydrophobicContact CD1-CB 4.12Å; I159-P196 HydrophobicContact CD1-CG 4.26Å; P196-N198 VanDerWaalsContact C-N 3.34Å; P196-N198 PolarHBondContact O-N 3.29Å; P196-L199 PolarHBondContact O-N 3.28Å; P196-Y238 VanDerWaalsContact CD-CE1 3.46Å; P196-Y238 VanDerWaalsContact CD-CZ 3.41Å; P196-Y238 WeakPolarHBondContact CD-OH 3.03Å; P196-Y238 HydrophobicContact CG-CE1 4.15Å; P196-I262 HydrophobicContact CG-CG1 4.08Å; P196-I262 HydrophobicContact CG-CG2 4.38Å
197	S	91	Very high	93	Very high	28 Å²	28	27.7 Å²	27.7	20%	0.196	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-64.1	-40.3	174	62.1	0	0	0	0	111.6	D154 K195 L199 G993	D154-S197 WeakPolarHBondContact CB-O 3.42Å; K195-S197 VanDerWaalsContact CE-OG 3.28Å; K195-S197 WeakPolarHBondContact CE-OG 3.46Å; K195-S197 WeakPolarHBondContact CG-OG 3.38Å; K195-S197 PolarHBondContact O-N 3.09Å; K195-S197 VanDerWaalsContact O-N 3.11Å; S197-L199 PolarHBondContact O-N 3.4Å; S197-L199 VanDerWaalsContact O-N 3.16Å; S197-G993 WeakPolarHBondContact O-CA 3.25Å; S197-G993 PolarHBondContact O-N 3.32Å
198	N	94.3	Very high	93.2	Very high	7 Å²	7	28.6 Å²	28.6	4%	0.037	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-79.2	5.6	-175.7	-64.8	7.6	0	0	0	112.7	D193 K195 P196 G210	D193-N198 PolarHBondContact O-ND2 2.9Å; D193-N198 PolarHBondContact OD2-ND2 3.25Å; K195-N198 WeakPolarHBondContact CE-ND2 3.33Å; K195-N198 VanDerWaalsContact CE-OD1 3.24Å; K195-N198 WeakPolarHBondContact CE-OD1 3.43Å; K195-N198 HydrophobicContact CG-CB 4.14Å; K195-N198 PolarHBondContact O-N 3.15Å; P196-N198 VanDerWaalsContact C-N 3.34Å; P196-N198 PolarHBondContact O-N 3.29Å; N198-G210 PolarHBondContact O-N 2.85Å
199	L	96.6	Very high	93.4	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	93.9	175.2	-58.7	-174.9	0	0	0	108.9	D154 L155 L177 L194 P196 S197 L207 I209 I262	D154-L199 CarbonylContact C-O 3.56Å; D154-L199 WeakPolarHBondContact CA-O 3.15Å; L155-L199 HydrophobicContact CB-CB 3.98Å; L155-L199 HydrophobicContact CD2-CB 4.4Å; L155-L199 HydrophobicContact CD2-CD1 3.85Å; L155-L199 PolarHBondContact N-O 3.4Å; L177-L199 HydrophobicContact CD1-CD1 3.85Å; L177-L199 HydrophobicContact CD1-CD2 3.69Å; L177-L199 HydrophobicContact CD1-CG 4.45Å; L177-L199 HydrophobicContact CD2-CD1 3.74Å; L177-L199 HydrophobicContact CG-CD1 4.34Å; L194-L199 HydrophobicContact CD2-CD2 4.3Å; P196-L199 PolarHBondContact O-N 3.28Å; S197-L199 PolarHBondContact O-N 3.4Å; S197-L199 VanDerWaalsContact O-N 3.16Å; L199-L207 HydrophobicContact CB-CD1 4.29Å; L199-L207 HydrophobicContact CB-CD2 4.49Å; L199-L207 HydrophobicContact CB-CG 4.36Å; L199-L207 HydrophobicContact CD1-CD1 4.43Å; L199-L207 HydrophobicContact CD2-CD2 4.36Å; L199-I209 HydrophobicContact CD2-CB 4.33Å; L199-I209 HydrophobicContact CD2-CG1 3.89Å; L199-I209 HydrophobicContact CD2-CG2 4.4Å; L199-I262 HydrophobicContact CD1-CD1 4.09Å; L199-I262 HydrophobicContact CD1-CG2 4.08Å
200	L	95.5	Very high	93.4	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	140.2	179.1	-63.9	167.3	0	0	0	110.4	I126 M151 L207 K208 A992 Y994	I126-L200 HydrophobicContact CB-CD1 4.23Å; I126-L200 HydrophobicContact CD1-CD1 3.75Å; I126-L200 HydrophobicContact CG1-CD1 3.93Å; M151-L200 HydrophobicContact CB-CB 3.89Å; M151-L200 HydrophobicContact CB-CD2 4.33Å; M151-L200 HydrophobicContact CE-CB 4.02Å; M151-L200 HydrophobicContact CG-CB 3.8Å; M151-L200 HydrophobicContact CG-CD1 4.14Å; M151-L200 HydrophobicContact CG-CG 4.45Å; L200-L207 CarbonylContact O-C 3.41Å; L200-L207 VanDerWaalsContact O-CA 3.31Å; L200-L207 WeakPolarHBondContact O-CA 3.5Å; L200-K208 HydrophobicContact CB-CB 4.41Å; L200-K208 PolarHBondContact N-O 2.85Å; L200-K208 PolarHBondContact O-N 2.87Å; L200-A992 WeakPolarHBondContact CD2-O 3.49Å; L200-Y994 HydrophobicContact CD1-CD1 3.92Å; L200-Y994 HydrophobicContact CD1-CE1 3.73Å; L200-Y994 HydrophobicContact CD2-CD2 4.19Å; L200-Y994 HydrophobicContact CD2-CE1 4.49Å; L200-Y994 HydrophobicContact CD2-CE2 4.07Å; L200-Y994 HydrophobicContact CD2-CG 4.42Å
201	V	94.4	Very high	93.2	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.024	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	136.8	179.9	-177.6	0	0	0	0	110.5	S153 L155 I158 F173 E206 L207	S153-V201 CarbonylContact C-O 3.54Å; S153-V201 PolarHBondContact N-O 3.21Å; S153-V201 PolarHBondContact O-N 3.04Å; L155-V201 HydrophobicContact CB-CG2 4.29Å; L155-V201 HydrophobicContact CD1-CG2 4.39Å; I158-V201 HydrophobicContact CD1-CB 3.58Å; I158-V201 HydrophobicContact CD1-CG1 3.51Å; I158-V201 HydrophobicContact CD1-CG2 3.99Å; F173-V201 HydrophobicContact CE1-CG1 3.62Å; F173-V201 HydrophobicContact CE1-CG2 4.18Å; F173-V201 HydrophobicContact CZ-CG1 3.8Å; V201-E206 WeakPolarHBondContact CA-O 3.17Å; V201-L207 HydrophobicContact CG2-CB 4.36Å; V201-L207 HydrophobicContact CG2-CD1 4.32Å; V201-L207 HydrophobicContact CG2-CG 4.3Å
202	N	90.4	Very high	93.1	Very high	22 Å²	22	24.8 Å²	24.8	12%	0.118	13%	0.131	C	C	.	.			trans	-106.3	171.2	178.3	69	19.5	0	0	0	113.7	M151 E152 S204 C205 E206	M151-N202 HydrophobicContact CE-CB 3.88Å; M151-N202 HydrophobicContact SD-CB 4.04Å; E152-N202 WeakPolarHBondContact OE2-CA 3.49Å; E152-N202 WeakPolarHBondContact OE2-CB 3.14Å; N202-S204 VanDerWaalsContact CG-OG 3.28Å; N202-S204 PolarHBondContact ND2-OG 2.88Å; N202-S204 PolarHBondContact O-N 3.33Å; N202-S204 VanDerWaalsContact O-N 3.11Å; N202-S204 PolarHBondContact OD1-N 3.36Å; N202-S204 PolarHBondContact OD1-OG 3.35Å; N202-C205 WeakPolarHBondContact O-CA 3.32Å; N202-C205 PolarHBondContact O-N 3.31Å; N202-C205 PolarHBondContact OD1-N 2.97Å; N202-E206 PolarHBondContact N-O 3.02Å; N202-E206 PolarHBondContact ND2-OE2 2.77Å; N202-E206 VanDerWaalsContact OD1-CB 3.31Å; N202-E206 WeakPolarHBondContact OD1-CB 3.37Å; N202-E206 PolarHBondContact OD1-N 2.89Å
203	E	85.3	Confident	92.9	Very high	172 Å²	172	23.3 Å²	23.3	80%	0.804	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-32	179	-69.8	-168.8	166.5	0	0	113.6	E152 C205	E152-E203 HydrophobicContact CG-CG 4.2Å; E152-E203 PolarHBondContact OE2-N 2.8Å; E203-C205 PolarHBondContact O-N 2.91Å
204	S	87.8	Confident	92.7	Very high	78 Å²	78	24.3 Å²	24.3	55%	0.545	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	5.8	175.4	33.1	0	0	0	0	114.7	N202 E206	N202-S204 VanDerWaalsContact CG-OG 3.28Å; N202-S204 PolarHBondContact ND2-OG 2.88Å; N202-S204 PolarHBondContact O-N 3.33Å; N202-S204 VanDerWaalsContact O-N 3.11Å; N202-S204 PolarHBondContact OD1-N 3.36Å; N202-S204 PolarHBondContact OD1-OG 3.35Å; S204-E206 PolarHBondContact O-N 3.22Å
205	C	91.7	Very high	92.4	Very high	43 Å²	43	24.3 Å²	24.3	29%	0.291	13%	0.131	S	C	.	.			trans	58.4	24.7	-173.4	-61.6	0	0	0	0	114.2	Y172 F173 Q176 N202 E203	Y172-C205 HydrophobicContact CD1-CB 4.48Å; Y172-C205 HydrophobicContact CE1-CB 4.34Å; Y172-C205 WeakPolarHBondContact CE1-O 3.3Å; F173-C205 HydrophobicContact CE1-CB 3.99Å; F173-C205 HydrophobicContact CZ-CB 4.17Å; Q176-C205 PolarHBondContact NE2-O 3.05Å; N202-C205 WeakPolarHBondContact O-CA 3.32Å; N202-C205 PolarHBondContact O-N 3.31Å; N202-C205 PolarHBondContact OD1-N 2.97Å; E203-C205 PolarHBondContact O-N 2.91Å
206	E	94.5	Very high	92.1	Very high	80 Å²	80	25.1 Å²	25.1	37%	0.374	13%	0.133	S	C	.	.			trans	-74.1	131.1	167.5	-52.1	-176.4	147.6	0	0	109	M151 V201 N202 S204 K208	M151-E206 WeakPolarHBondContact CE-O 3.26Å; V201-E206 WeakPolarHBondContact CA-O 3.17Å; N202-E206 PolarHBondContact N-O 3.02Å; N202-E206 PolarHBondContact ND2-OE2 2.77Å; N202-E206 VanDerWaalsContact OD1-CB 3.31Å; N202-E206 WeakPolarHBondContact OD1-CB 3.37Å; N202-E206 PolarHBondContact OD1-N 2.89Å; S204-E206 PolarHBondContact O-N 3.22Å; E206-K208 IonicContact OE2-NZ 2.8Å
207	L	97.5	Very high	91.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	133.6	178.1	-179.5	154.5	0	0	0	110.4	N124 L155 F173 Q176 L177 L199 L200 V201	N124-L207 VanDerWaalsContact CA-O 3.26Å; N124-L207 WeakPolarHBondContact CA-O 3.43Å; N124-L207 WeakPolarHBondContact CB-O 3.28Å; N124-L207 PolarHBondContact ND2-O 2.92Å; L155-L207 HydrophobicContact CD2-CD1 4.41Å; F173-L207 HydrophobicContact CB-CD1 3.87Å; F173-L207 HydrophobicContact CD1-CB 4.09Å; F173-L207 HydrophobicContact CD1-CD1 3.9Å; F173-L207 HydrophobicContact CG-CD1 4.18Å; Q176-L207 HydrophobicContact CB-CB 3.99Å; Q176-L207 HydrophobicContact CB-CD2 4.46Å; L177-L207 HydrophobicContact CB-CD2 4.27Å; L199-L207 HydrophobicContact CB-CD1 4.29Å; L199-L207 HydrophobicContact CB-CD2 4.49Å; L199-L207 HydrophobicContact CB-CG 4.36Å; L199-L207 HydrophobicContact CD1-CD1 4.43Å; L199-L207 HydrophobicContact CD2-CD2 4.36Å; L200-L207 CarbonylContact O-C 3.41Å; L200-L207 VanDerWaalsContact O-CA 3.31Å; L200-L207 WeakPolarHBondContact O-CA 3.5Å; V201-L207 HydrophobicContact CG2-CB 4.36Å; V201-L207 HydrophobicContact CG2-CD1 4.32Å; V201-L207 HydrophobicContact CG2-CG 4.3Å
208	K	97.9	Very high	91	Very high	18 Å²	18	28 Å²	28	8%	0.078	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	126.9	176.6	-59.2	-173.4	-161.4	-64.3	0	111.4	D123 N124 I126 M151 L200 E206	D123-K208 PolarHBondContact O-NZ 3.26Å; N124-K208 WeakPolarHBondContact O-CA 3.45Å; I126-K208 HydrophobicContact CD1-CD 4.17Å; M151-K208 HydrophobicContact CE-CB 4.15Å; M151-K208 HydrophobicContact CE-CD 3.97Å; M151-K208 HydrophobicContact CE-CG 3.77Å; M151-K208 HydrophobicContact SD-CD 3.67Å; M151-K208 WeakPolarHBondContact SD-CE 3.25Å; M151-K208 HydrophobicContact SD-CG 4.18Å; L200-K208 HydrophobicContact CB-CB 4.41Å; L200-K208 PolarHBondContact N-O 2.85Å; L200-K208 PolarHBondContact O-N 2.87Å; E206-K208 IonicContact OE2-NZ 2.8Å
209	I	97.8	Very high	89.5	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	133.3	171.7	-55.6	168.9	0	0	0	109	N124 I126 L177 L181 H191 L194 L199 F212	N124-I209 PolarHBondContact O-N 2.66Å; I126-I209 WeakPolarHBondContact CG2-O 3.2Å; I126-I209 PolarHBondContact N-O 2.96Å; L177-I209 HydrophobicContact CD1-CD1 4.09Å; L177-I209 HydrophobicContact CD1-CG1 4.07Å; L181-I209 HydrophobicContact CB-CD1 4.5Å; H191-I209 WeakPolarHBondContact NE2-CG2 3.38Å; L194-I209 HydrophobicContact CD2-CG2 3.93Å; L199-I209 HydrophobicContact CD2-CB 4.33Å; L199-I209 HydrophobicContact CD2-CG1 3.89Å; L199-I209 HydrophobicContact CD2-CG2 4.4Å; I209-F212 HydrophobicContact CB-CZ 4.25Å; I209-F212 HydrophobicContact CG2-CE2 4.05Å; I209-F212 HydrophobicContact CG2-CZ 3.74Å
210	G	93.6	Very high	87.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.2	C	C	.	.			trans	-136.3	175.8	175.7	0	0	0	0	0	113.3	H191 N198	H191-G210 PolarHBondContact CE1-O 2.86Å; H191-G210 PolarHBondContact NE2-O 3.35Å; H191-G210 VanDerWaalsContact NE2-O 3.12Å; N198-G210 PolarHBondContact O-N 2.85Å
211	D	88.8	Confident	85.4	Confident	6 Å²	6	40.3 Å²	40.3	3%	0.032	23%	0.225	C	C	.	.			trans	62.5	58.9	-174.6	-160.5	1.5	0	0	0	115.8	R109 H191 G213 G995	R109-D211 IonicContact CZ-OD1 3.87Å; R109-D211 IonicContact CZ-OD2 3.77Å; R109-D211 IonicContact NE-OD1 3.29Å; R109-D211 IonicContact NH2-OD1 2.85Å; R109-D211 PolarHBondContact NH2-OD1 3.22Å; R109-D211 IonicContact NH2-OD2 3.14Å; R109-D211 PolarHBondContact NH2-OD2 3.34Å; H191-D211 PolarHBondContact CE1-O 2.82Å; D211-G213 PolarHBondContact O-N 3.36Å; D211-G213 PolarHBondContact OD1-N 2.89Å; D211-G995 VanDerWaalsContact CB-CA 3.5Å; D211-G995 WeakPolarHBondContact OD2-CA 3.46Å
212	F	91.9	Very high	83.4	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-71.5	10	170.1	-67.8	-93.4	0	0	0	113.6	I116 L117 F120 I125 V184 H191 I209 M214 A215	I116-F212 HydrophobicContact CB-CB 4.3Å; I116-F212 HydrophobicContact CD1-CB 4.28Å; I116-F212 HydrophobicContact CG2-CB 3.96Å; I116-F212 HydrophobicContact CG2-CD1 3.66Å; I116-F212 HydrophobicContact CG2-CE1 4.35Å; I116-F212 HydrophobicContact CG2-CG 3.82Å; L117-F212 HydrophobicContact CD2-CD2 3.45Å; L117-F212 VanDerWaalsContact CD2-CD2 3.45Å; L117-F212 HydrophobicContact CD2-CE2 3.78Å; L117-F212 HydrophobicContact CD2-CG 4.28Å; L117-F212 HydrophobicContact CG-CD2 4.3Å; F120-F212 HydrophobicContact CD2-CE1 4.14Å; F120-F212 HydrophobicContact CD2-CZ 4.26Å; F120-F212 HydrophobicContact CE2-CD1 4.09Å; F120-F212 AromaticContact CE2-CE1 3.63Å; F120-F212 HydrophobicContact CE2-CE1 3.63Å; F120-F212 HydrophobicContact CE2-CZ 4.17Å; I125-F212 HydrophobicContact CG2-CE2 3.76Å; I125-F212 HydrophobicContact CG2-CZ 3.86Å; V184-F212 HydrophobicContact CG1-CE1 4.1Å; V184-F212 HydrophobicContact CG2-CE1 3.85Å; V184-F212 HydrophobicContact CG2-CZ 4.06Å; H191-F212 AromaticContact CD2-CD1 3.71Å; H191-F212 AromaticContact CD2-CE1 3.5Å; H191-F212 AromaticContact CD2-CZ 3.88Å; I209-F212 HydrophobicContact CB-CZ 4.25Å; I209-F212 HydrophobicContact CG2-CE2 4.05Å; I209-F212 HydrophobicContact CG2-CZ 3.74Å; F212-M214 PolarHBondContact O-N 3.21Å; F212-A215 HydrophobicContact CB-CB 4.37Å; F212-A215 HydrophobicContact CD1-CB 4.37Å; F212-A215 WeakPolarHBondContact O-CB 3.4Å; F212-A215 PolarHBondContact O-N 3.04Å
213	G	86.1	Confident	81.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-60.9	-32.7	178.6	0	0	0	0	0	113	R109 R112 D211	R109-G213 VanDerWaalsContact CG-CA 3.48Å; R112-G213 PolarHBondContact NH1-O 3.34Å; D211-G213 PolarHBondContact O-N 3.36Å; D211-G213 PolarHBondContact OD1-N 2.89Å
214	M	86.6	Confident	79.9	Confident	28 Å²	28	44.9 Å²	44.9	14%	0.138	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-90.6	-5.9	178.6	-73.5	-59	122.6	0	0	115.2	R109 H191 D193 F212 R216 V233 A234	R109-M214 HydrophobicContact CG-CE 4.22Å; H191-M214 CarbonylContact O-C 3.59Å; D193-M214 HydrophobicContact CB-CB 3.85Å; D193-M214 HydrophobicContact CB-CG 4.17Å; F212-M214 PolarHBondContact O-N 3.21Å; M214-R216 PolarHBondContact O-NH1 2.86Å; M214-R216 VanDerWaalsContact O-NH1 3.16Å; M214-V233 HydrophobicContact CE-CG1 4.18Å; M214-V233 HydrophobicContact SD-CB 4.43Å; M214-V233 HydrophobicContact SD-CG1 3.43Å; M214-V233 WeakPolarHBondContact SD-CG1 3.13Å; M214-A234 HydrophobicContact CG-CB 4.44Å
215	A	90.1	Very high	78.2	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.234	C	C	.	.			trans	-59.4	156.9	-177.8	0	0	0	0	0	112.8	R112 I116 V189 I190 H191 F212	R112-A215 WeakPolarHBondContact CD-O 3.36Å; I116-A215 HydrophobicContact CD1-CB 3.73Å; V189-A215 HydrophobicContact CG1-CB 3.93Å; I190-A215 CarbonylContact O-C 3.53Å; I190-A215 WeakPolarHBondContact O-CA 3.4Å; I190-A215 VanDerWaalsContact O-CB 3.25Å; I190-A215 WeakPolarHBondContact O-CB 3.31Å; H191-A215 PolarHBondContact O-N 3.28Å; F212-A215 HydrophobicContact CB-CB 4.37Å; F212-A215 HydrophobicContact CD1-CB 4.37Å; F212-A215 WeakPolarHBondContact O-CB 3.4Å; F212-A215 PolarHBondContact O-N 3.04Å
216	R	87.7	Confident	76.2	Confident	41 Å²	41	44 Å²	44	16%	0.155	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	164.3	171	-71.1	-57.2	-176.9	-63.5	-8.7	110.9	R112 I190 M214 D379	R112-R216 VanDerWaalsContact CZ-CZ 3.5Å; I190-R216 PolarHBondContact N-O 3.43Å; I190-R216 PolarHBondContact O-N 2.72Å; M214-R216 PolarHBondContact O-NH1 2.86Å; M214-R216 VanDerWaalsContact O-NH1 3.16Å; R216-D379 IonicContact NE-OD2 2.73Å; R216-D379 PolarHBondContact NE-OD2 3.35Å
217	G	84.8	Confident	73.9	Confident	21 Å²	21	45.1 Å²	45.1	22%	0.216	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	159.2	170.9	0	0	0	0	0	112.3	N188 S219 F376	N188-G217 WeakPolarHBondContact O-CA 3.38Å; G217-S219 PolarHBondContact O-N 2.83Å; G217-F376 VanDerWaalsContact N-CD2 3.34Å; G217-F376 VanDerWaalsContact N-CZ 3.25Å
218	L	77.8	Confident	71.6	Confident	67 Å²	67	49.1 Å²	49.1	35%	0.351	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-64.7	118	155.6	-63.8	167.6	0	0	0	108.3	N188 I190 L252	N188-L218 HydrophobicContact CB-CD1 4.17Å; N188-L218 PolarHBondContact O-N 2.91Å; I190-L218 HydrophobicContact CD1-CD2 4Å; I190-L218 HydrophobicContact CG1-CD2 4.33Å; L218-L252 HydrophobicContact CD1-CD1 4.28Å; L218-L252 HydrophobicContact CD1-CD2 4.07Å; L218-L252 HydrophobicContact CD1-CG 4.04Å; L218-L252 HydrophobicContact CD2-CD2 4.41Å; L218-L252 HydrophobicContact CD2-CG 4.3Å; L218-L252 HydrophobicContact CG-CD2 4.28Å
219	S	62.6	Low	69.6	Low	39 Å²	39	49.2 Å²	49.2	27%	0.273	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-78.2	144.9	168.4	-172.4	0	0	0	0	110.2	G217 H221 E224	G217-S219 PolarHBondContact O-N 2.83Å; S219-H221 PolarHBondContact O-N 3.38Å; S219-H221 PolarHBondContact OG-N 2.93Å; S219-E224 PolarHBondContact OG-OE2 2.9Å
220	S	51.9	Low	67.6	Low	113 Å²	113	53.1 Å²	53.1	79%	0.79	29%	0.294	S	S	*	.	S	Bend	trans	-73.8	-7.6	172	-58.2	0	0	0	0	112.8
221	H	53.9	Low	65.6	Low	115 Å²	115	55.2 Å²	55.2	53%	0.532	30%	0.303	S	S	.	.			trans	-123.7	117.5	-178.9	-73	-9.2	0	0	0	111.3	S219 E223 E224 S225	S219-H221 PolarHBondContact O-N 3.38Å; S219-H221 PolarHBondContact OG-N 2.93Å; H221-E223 VanDerWaalsContact C-N 3.32Å; H221-E223 PolarHBondContact O-N 3.32Å; H221-E224 HydrophobicContact CB-CB 4.34Å; H221-E224 HydrophobicContact CB-CG 4.03Å; H221-E224 IonicContact CD2-OE1 3.62Å; H221-E224 PolarHBondContact O-N 3.09Å; H221-S225 PolarHBondContact O-N 3.33Å; H221-S225 PolarHBondContact O-OG 3.46Å
222	P	52.8	Low	64	Low	92 Å²	92	60.9 Å²	60.9	60%	0.597	33%	0.325	S	S	*	.	H	α-helix	trans	-59.5	-35.9	-178.5	-28.1	36.1	0	0	0	114.5	S225	P222-S225 VanDerWaalsContact O-CB 3.24Å; P222-S225 WeakPolarHBondContact O-CB 3.29Å; P222-S225 PolarHBondContact O-N 3.08Å
223	E	50.9	Low	62.3	Low	124 Å²	124	62.7 Å²	62.7	58%	0.579	34%	0.336	S	S	*	.	H	α-helix	trans	-72.9	-37.7	-177.2	-62.2	-59.8	115.2	0	0	112.4	H221 S225 Y226 R301	H221-E223 VanDerWaalsContact C-N 3.32Å; H221-E223 PolarHBondContact O-N 3.32Å; E223-S225 PolarHBondContact O-N 3.24Å; E223-Y226 PolarHBondContact O-N 3.44Å; E223-R301 IonicContact OE1-CZ 3.65Å; E223-R301 IonicContact OE1-NH1 3.52Å; E223-R301 IonicContact OE1-NH2 3.5Å; E223-R301 PolarHBondContact OE1-NH2 3.15Å; E223-R301 IonicContact OE2-NH2 2.77Å; E223-R301 PolarHBondContact OE2-NH2 3.16Å
224	E	51.4	Low	61.1	Low	77 Å²	77	63.1 Å²	63.1	36%	0.36	34%	0.339	S	S	.	.	H	α-helix	trans	-59.1	-34.9	169.3	-69.4	179.5	-165.5	0	0	112.2	S219 H221 Y226 C227 F228 K380	S219-E224 PolarHBondContact OG-OE2 2.9Å; H221-E224 HydrophobicContact CB-CB 4.34Å; H221-E224 HydrophobicContact CB-CG 4.03Å; H221-E224 IonicContact CD2-OE1 3.62Å; H221-E224 PolarHBondContact O-N 3.09Å; E224-Y226 PolarHBondContact O-N 3.3Å; E224-C227 PolarHBondContact O-N 2.99Å; E224-F228 PolarHBondContact O-N 2.92Å; E224-K380 IonicContact OE2-NZ 2.85Å
225	S	51.2	Low	60.5	Low	21 Å²	21	63.8 Å²	63.8	15%	0.147	35%	0.345	C	S	.	.	H	α-helix	trans	-63.3	-27.6	-177.2	-53.3	0	0	0	0	112	H221 P222 E223 M229	H221-S225 PolarHBondContact O-N 3.33Å; H221-S225 PolarHBondContact O-OG 3.46Å; P222-S225 VanDerWaalsContact O-CB 3.24Å; P222-S225 WeakPolarHBondContact O-CB 3.29Å; P222-S225 PolarHBondContact O-N 3.08Å; E223-S225 PolarHBondContact O-N 3.24Å; S225-M229 VanDerWaalsContact O-CB 3.31Å; S225-M229 WeakPolarHBondContact O-CB 3.42Å; S225-M229 WeakPolarHBondContact O-CG 3.42Å
226	Y	49.7	Very low	60.2	Low	82 Å²	82	65.6 Å²	65.6	32%	0.322	35%	0.352	S	S	.	.	H	α-helix	trans	-75.2	-35.8	-179.3	-146.9	-94.4	0	0	0	112.3	E223 E224 S246 Y250	E223-Y226 PolarHBondContact O-N 3.44Å; E224-Y226 PolarHBondContact O-N 3.3Å; Y226-S246 WeakPolarHBondContact OH-CB 3.05Å; Y226-Y250 HydrophobicContact CD2-CE2 4.08Å
227	C	46.4	Very low	60.5	Low	103 Å²	103	67.2 Å²	67.2	70%	0.696	36%	0.358	S	S	*	.	H	α-helix	trans	-71.6	-35.5	178.5	-173.1	0	0	0	0	112.7	E224	E224-C227 PolarHBondContact O-N 2.99Å
228	F	49	Very low	61	Low	85 Å²	85	66.8 Å²	66.8	37%	0.373	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-2.7	-178.3	-90.9	-97.4	0	0	0	115.2	R192 E224	R192-F228 PolarHBondContact NH1-O 3.2Å; E224-F228 PolarHBondContact O-N 2.92Å
229	M	56.8	Low	61.6	Low	19 Å²	19	64 Å²	64	9%	0.094	34%	0.335	C	S	.	.			trans	-118.5	57.8	-172.9	-64.7	-167.9	54.7	0	0	112.5	S225 E231 L243 Y250 I254	S225-M229 VanDerWaalsContact O-CB 3.31Å; S225-M229 WeakPolarHBondContact O-CB 3.42Å; S225-M229 WeakPolarHBondContact O-CG 3.42Å; M229-E231 PolarHBondContact O-N 2.91Å; M229-L243 HydrophobicContact CE-CD2 3.56Å; M229-Y250 HydrophobicContact CB-CD2 4.34Å; M229-Y250 HydrophobicContact CB-CE2 4.16Å; M229-Y250 HydrophobicContact CE-CD1 3.64Å; M229-Y250 HydrophobicContact CE-CD2 3.94Å; M229-Y250 HydrophobicContact CE-CE1 4.28Å; M229-Y250 HydrophobicContact CE-CG 3.45Å; M229-Y250 VanDerWaalsContact CE-CG 3.45Å; M229-Y250 HydrophobicContact CG-CD2 4.43Å; M229-Y250 VanDerWaalsContact SD-CB 3.58Å; M229-Y250 HydrophobicContact SD-CD1 4.35Å; M229-Y250 HydrophobicContact SD-CD2 3.54Å; M229-Y250 VanDerWaalsContact SD-CD2 3.54Å; M229-Y250 HydrophobicContact SD-CE2 4.32Å; M229-Y250 HydrophobicContact SD-CG 3.56Å; M229-Y250 VanDerWaalsContact SD-CG 3.56Å; M229-I254 HydrophobicContact CE-CD1 3.7Å
230	T	55.2	Low	63	Low	83 Å²	83	62.2 Å²	62.2	51%	0.509	32%	0.322	S	S	.	.			trans	-50.9	128.3	172.5	44.9	0	0	0	0	112.4	Y232	T230-Y232 VanDerWaalsContact C-N 3.25Å; T230-Y232 PolarHBondContact O-N 3.18Å
231	E	52	Low	64.8	Low	43 Å²	43	56.9 Å²	56.9	20%	0.201	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-32.2	-174.8	-170.8	-166.9	121.5	0	0	112.9	M229 R239 Y278	M229-E231 PolarHBondContact O-N 2.91Å; E231-R239 PolarHBondContact O-NH1 2.92Å; E231-Y278 WeakPolarHBondContact OE1-CD2 3.23Å; E231-Y278 VanDerWaalsContact OE1-CE2 3.3Å; E231-Y278 WeakPolarHBondContact OE1-CE2 3.22Å
232	Y	54.8	Low	66.5	Low	126 Å²	126	51.4 Å²	51.4	49%	0.494	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-9.8	-159.2	-62.4	-62.5	0	0	0	116.8	T230 R239	T230-Y232 VanDerWaalsContact C-N 3.25Å; T230-Y232 PolarHBondContact O-N 3.18Å; Y232-R239 VanDerWaalsContact C-NH2 3.27Å; Y232-R239 PolarHBondContact O-NH2 3.31Å
233	V	56.3	Low	68	Low	37 Å²	37	47.7 Å²	47.7	22%	0.224	24%	0.235	C	C	.	.			trans	-88.7	150.2	-171.1	-161.6	0	0	0	0	112.5	M214 R239	M214-V233 HydrophobicContact CE-CG1 4.18Å; M214-V233 HydrophobicContact SD-CB 4.43Å; M214-V233 HydrophobicContact SD-CG1 3.43Å; M214-V233 WeakPolarHBondContact SD-CG1 3.13Å; V233-R239 VanDerWaalsContact O-CZ 3.31Å; V233-R239 PolarHBondContact O-NE 2.82Å; V233-R239 VanDerWaalsContact O-NE 3.08Å; V233-R239 PolarHBondContact O-NH2 3Å
234	A	61.6	Low	69.6	Low	9 Å²	9	41.8 Å²	41.8	7%	0.074	21%	0.207	C	C	.	.	S	Bend	trans	72.4	169.6	172	0	0	0	0	0	115.9	D193 M214 R236 R239 D999	D193-A234 HydrophobicContact CB-CB 3.86Å; M214-A234 HydrophobicContact CG-CB 4.44Å; A234-R236 PolarHBondContact O-N 2.87Å; A234-R239 VanDerWaalsContact O-CZ 3.32Å; A234-R239 PolarHBondContact O-NE 2.93Å; A234-R239 VanDerWaalsContact O-NE 3.15Å; A234-R239 PolarHBondContact O-NH2 2.83Å; A234-D999 WeakPolarHBondContact CA-OD2 3.33Å; A234-D999 PolarHBondContact N-OD2 3.05Å
235	T	72.6	Confident	71.1	Confident	43 Å²	43	38.2 Å²	38.2	26%	0.264	19%	0.19	S	C	.	.			trans	-70.2	107.1	-164.6	-54.7	0	0	0	0	113.2	K195 W237 Y238	K195-T235 HydrophobicContact CD-CG2 4.42Å; K195-T235 WeakPolarHBondContact CD-OG1 3.08Å; K195-T235 PolarHBondContact NZ-OG1 3.15Å; T235-W237 HydrophobicContact CG2-CD2 4.45Å; T235-W237 HydrophobicContact CG2-CE3 4.39Å; T235-W237 PolarHBondContact O-N 3.34Å; T235-Y238 HydrophobicContact CG2-CD2 4.01Å; T235-Y238 HydrophobicContact CG2-CE2 3.85Å; T235-Y238 PolarHBondContact O-N 3.03Å
236	R	85.6	Confident	72.3	Confident	38 Å²	38	37.8 Å²	37.8	14%	0.143	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-43.7	-35.8	-174.1	-176	176.4	-76	90.9	6.3	116.2	A234 Y238 R239 Q281 D1001	A234-R236 PolarHBondContact O-N 2.87Å; R236-Y238 PolarHBondContact O-N 3.33Å; R236-R239 PolarHBondContact O-N 3.28Å; R236-Q281 HydrophobicContact CG-CB 3.99Å; R236-Q281 HydrophobicContact CG-CG 3.85Å; R236-Q281 PolarHBondContact O-NE2 2.92Å; R236-D1001 IonicContact CZ-OD2 2.66Å; R236-D1001 IonicContact NH1-OD1 2.76Å; R236-D1001 IonicContact NH1-OD2 2.8Å; R236-D1001 PolarHBondContact NH1-OD2 3.49Å; R236-D1001 IonicContact NH2-OD2 3.44Å; R236-D1001 PolarHBondContact NH2-OD2 3.17Å
237	W	93.6	Very high	73.6	Confident	75 Å²	75	34 Å²	34	28%	0.284	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-62.1	-24.5	-174.9	-55.1	-21.7	0	0	0	114.9	T235 Q271 F273 G275 Q281	T235-W237 HydrophobicContact CG2-CD2 4.45Å; T235-W237 HydrophobicContact CG2-CE3 4.39Å; T235-W237 PolarHBondContact O-N 3.34Å; W237-Q271 HydrophobicContact CD2-CG 4.35Å; W237-Q271 HydrophobicContact CE3-CG 3.59Å; W237-Q271 HydrophobicContact CZ3-CG 3.81Å; W237-F273 WeakPolarHBondContact CA-O 3.49Å; W237-F273 WeakPolarHBondContact CB-O 3.37Å; W237-G275 PolarHBondContact NE1-O 3.44Å; W237-Q281 PolarHBondContact O-NE2 2.91Å
238	Y	94.3	Very high	74.5	Confident	12 Å²	12	32.3 Å²	32.3	5%	0.047	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-110.8	3.5	-177.3	-43.9	-88.5	0	0	0	112.9	L194 K195 P196 T235 R236 S258 C261 I262 E265	L194-Y238 WeakPolarHBondContact O-CB 3.37Å; K195-Y238 HydrophobicContact CB-CD1 4.39Å; K195-Y238 HydrophobicContact CB-CD2 3.48Å; K195-Y238 VanDerWaalsContact CB-CD2 3.48Å; K195-Y238 HydrophobicContact CB-CE1 4.41Å; K195-Y238 HydrophobicContact CB-CE2 3.51Å; K195-Y238 HydrophobicContact CB-CG 3.96Å; K195-Y238 HydrophobicContact CD-CE2 4.49Å; P196-Y238 VanDerWaalsContact CD-CE1 3.46Å; P196-Y238 VanDerWaalsContact CD-CZ 3.41Å; P196-Y238 WeakPolarHBondContact CD-OH 3.03Å; P196-Y238 HydrophobicContact CG-CE1 4.15Å; T235-Y238 HydrophobicContact CG2-CD2 4.01Å; T235-Y238 HydrophobicContact CG2-CE2 3.85Å; T235-Y238 PolarHBondContact O-N 3.03Å; R236-Y238 PolarHBondContact O-N 3.33Å; Y238-S258 PolarHBondContact O-OG 3.45Å; Y238-C261 HydrophobicContact CD1-CB 3.86Å; Y238-I262 HydrophobicContact CD1-CG1 4.25Å; Y238-I262 HydrophobicContact CE1-CG1 4.43Å; Y238-E265 PolarHBondContact OH-OE2 2.83Å
239	R	91.1	Very high	75.4	Confident	9 Å²	9	32.7 Å²	32.7	3%	0.034	16%	0.16	C	C	.	.			trans	-68.4	138.8	176.2	-65.5	-174.7	-164.4	162.6	9.3	110.2	E231 Y232 V233 A234 R236 L244 W257 D1001	E231-R239 PolarHBondContact O-NH1 2.92Å; Y232-R239 VanDerWaalsContact C-NH2 3.27Å; Y232-R239 PolarHBondContact O-NH2 3.31Å; V233-R239 VanDerWaalsContact O-CZ 3.31Å; V233-R239 PolarHBondContact O-NE 2.82Å; V233-R239 VanDerWaalsContact O-NE 3.08Å; V233-R239 PolarHBondContact O-NH2 3Å; A234-R239 VanDerWaalsContact O-CZ 3.32Å; A234-R239 PolarHBondContact O-NE 2.93Å; A234-R239 VanDerWaalsContact O-NE 3.15Å; A234-R239 PolarHBondContact O-NH2 2.83Å; R236-R239 PolarHBondContact O-N 3.28Å; R239-L244 HydrophobicContact CB-CD2 4.33Å; R239-L244 HydrophobicContact CB-CG 4.42Å; R239-W257 PolarHBondContact O-NE1 3.46Å; R239-D1001 IonicContact NH2-OD2 2.71Å
240	A	91.9	Very high	76.4	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.162	C	C	.	.			trans	-76.9	154.1	-178.8	0	0	0	0	0	112.9	E242 L243 L244 I254 W257	A240-E242 VanDerWaalsContact CB-CD 3.4Å; A240-E242 HydrophobicContact CB-CG 4.29Å; A240-E242 VanDerWaalsContact CB-OE1 3.32Å; A240-E242 WeakPolarHBondContact CB-OE1 3.37Å; A240-E242 WeakPolarHBondContact CB-OE2 3.46Å; A240-E242 PolarHBondContact O-N 3.43Å; A240-L243 WeakPolarHBondContact O-CB 3.26Å; A240-L243 PolarHBondContact O-N 3.47Å; A240-L244 PolarHBondContact O-N 3.42Å; A240-I254 HydrophobicContact CB-CG2 4.39Å; A240-W257 HydrophobicContact CB-CB 3.72Å; A240-W257 HydrophobicContact CB-CG 3.77Å
241	P	90.6	Very high	78	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.013	15%	0.151	C	C	.	.	H	α-helix	trans	-56.1	-37.3	-179.1	-26.4	35.6	0	0	0	113.1	L243 L244 L245 W257 F341	P241-L243 VanDerWaalsContact C-N 3.27Å; P241-L243 PolarHBondContact O-N 2.99Å; P241-L244 PolarHBondContact O-N 3.13Å; P241-L244 VanDerWaalsContact O-N 3.1Å; P241-L245 VanDerWaalsContact O-CB 3.3Å; P241-L245 WeakPolarHBondContact O-CB 3.46Å; P241-L245 WeakPolarHBondContact O-CG 3.22Å; P241-L245 PolarHBondContact O-N 2.9Å; P241-W257 VanDerWaalsContact CD-CD2 3.49Å; P241-W257 HydrophobicContact CG-CD2 4.23Å; P241-W257 HydrophobicContact CG-CE3 3.97Å; P241-W257 HydrophobicContact CG-CH2 3.68Å; P241-W257 HydrophobicContact CG-CZ2 3.94Å; P241-W257 HydrophobicContact CG-CZ3 3.68Å; P241-F341 HydrophobicContact CB-CD1 3.96Å; P241-F341 HydrophobicContact CG-CD1 4.02Å
242	E	87.8	Confident	79.9	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.9	-29	176.9	62.3	-87.4	-158.8	0	0	113.9	A240 S246 L247 Y250 I254 P343 R346	A240-E242 VanDerWaalsContact CB-CD 3.4Å; A240-E242 HydrophobicContact CB-CG 4.29Å; A240-E242 VanDerWaalsContact CB-OE1 3.32Å; A240-E242 WeakPolarHBondContact CB-OE1 3.37Å; A240-E242 WeakPolarHBondContact CB-OE2 3.46Å; A240-E242 PolarHBondContact O-N 3.43Å; E242-S246 WeakPolarHBondContact O-CA 3.26Å; E242-S246 PolarHBondContact O-N 3.47Å; E242-S246 VanDerWaalsContact O-N 3.17Å; E242-L247 HydrophobicContact CB-CB 4.07Å; E242-L247 HydrophobicContact CB-CD1 4.05Å; E242-L247 HydrophobicContact CB-CG 4.29Å; E242-L247 PolarHBondContact O-N 3.01Å; E242-Y250 HydrophobicContact CG-CD1 4.49Å; E242-I254 HydrophobicContact CG-CG1 4Å; E242-I254 WeakPolarHBondContact OE1-CA 3.32Å; E242-I254 VanDerWaalsContact OE1-CG1 3.23Å; E242-I254 WeakPolarHBondContact OE1-CG1 3.41Å; E242-P343 HydrophobicContact CB-CG 4.36Å; E242-P343 HydrophobicContact CG-CG 4.46Å; E242-R346 IonicContact OE1-CZ 2.75Å; E242-R346 IonicContact OE1-NH1 3.96Å; E242-R346 PolarHBondContact OE1-NH1 3.04Å; E242-R346 IonicContact OE1-NH2 3.53Å; E242-R346 IonicContact OE2-CZ 3.25Å; E242-R346 IonicContact OE2-NH1 3.56Å; E242-R346 PolarHBondContact OE2-NH1 3.4Å; E242-R346 IonicContact OE2-NH2 3.6Å; E242-R346 PolarHBondContact OE2-NH2 3.11Å
243	L	84.9	Confident	81.8	Confident	14 Å²	14	26.1 Å²	26.1	7%	0.073	13%	0.133	C	C	.	.	H	α-helix	trans	-79.8	-24.2	174.4	-67.4	177.2	0	0	0	113	M229 A240 P241 Y250 I254	M229-L243 HydrophobicContact CE-CD2 3.56Å; A240-L243 WeakPolarHBondContact O-CB 3.26Å; A240-L243 PolarHBondContact O-N 3.47Å; P241-L243 VanDerWaalsContact C-N 3.27Å; P241-L243 PolarHBondContact O-N 2.99Å; L243-Y250 HydrophobicContact CD2-CD1 4.03Å; L243-Y250 HydrophobicContact CD2-CE1 3.93Å; L243-I254 HydrophobicContact CD1-CG2 3.75Å; L243-I254 HydrophobicContact CD2-CD1 4.09Å; L243-I254 HydrophobicContact CG-CD1 4.38Å; L243-I254 HydrophobicContact CG-CG1 4.5Å; L243-I254 HydrophobicContact CG-CG2 4.4Å
244	L	84.6	Confident	83.5	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-89.6	-38	178.4	-63.4	172.5	0	0	0	111.1	R239 A240 P241 S246 Y278 Q281 I285	R239-L244 HydrophobicContact CB-CD2 4.33Å; R239-L244 HydrophobicContact CB-CG 4.42Å; A240-L244 PolarHBondContact O-N 3.42Å; P241-L244 PolarHBondContact O-N 3.13Å; P241-L244 VanDerWaalsContact O-N 3.1Å; L244-S246 VanDerWaalsContact C-N 3.33Å; L244-Y278 HydrophobicContact CB-CE2 4.25Å; L244-Y278 HydrophobicContact CD2-CD2 4.19Å; L244-Y278 HydrophobicContact CD2-CE2 4.25Å; L244-Y278 WeakPolarHBondContact O-CE2 3.3Å; L244-Y278 VanDerWaalsContact O-CZ 3.31Å; L244-Y278 PolarHBondContact O-OH 2.92Å; L244-Q281 HydrophobicContact CD1-CG 3.77Å; L244-I285 HydrophobicContact CD1-CD1 3.67Å
245	L	82.4	Confident	85.2	Confident	1 Å²	1	24 Å²	24	1%	0.005	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-0.3	179.9	-61.8	179.1	0	0	0	113	P241 L247 L282 I300 V305 V309	P241-L245 VanDerWaalsContact O-CB 3.3Å; P241-L245 WeakPolarHBondContact O-CB 3.46Å; P241-L245 WeakPolarHBondContact O-CG 3.22Å; P241-L245 PolarHBondContact O-N 2.9Å; L245-L247 HydrophobicContact CB-CD2 3.95Å; L245-L247 HydrophobicContact CB-CG 3.96Å; L245-L247 PolarHBondContact O-N 3.4Å; L245-L282 HydrophobicContact CD2-CD1 3.9Å; L245-L282 HydrophobicContact CD2-CD2 3.93Å; L245-I300 HydrophobicContact CB-CG1 4.29Å; L245-I300 HydrophobicContact CD1-CD1 4.46Å; L245-I300 HydrophobicContact CD2-CD1 4.16Å; L245-V305 HydrophobicContact CD2-CG1 3.58Å; L245-V309 HydrophobicContact CD2-CG2 4.15Å
246	S	77.1	Confident	86.4	Confident	12 Å²	12	22 Å²	22	8%	0.084	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	54.6	179.4	-56.8	0	0	0	0	112.6	Y226 E242 L244	Y226-S246 WeakPolarHBondContact OH-CB 3.05Å; E242-S246 WeakPolarHBondContact O-CA 3.26Å; E242-S246 PolarHBondContact O-N 3.47Å; E242-S246 VanDerWaalsContact O-N 3.17Å; L244-S246 VanDerWaalsContact C-N 3.33Å
247	L	76	Confident	86.9	Confident	3 Å²	3	20.1 Å²	20.1	2%	0.016	10%	0.1	C	C	.	.			trans	-82.3	154	-178.1	-56.9	-177.6	0	0	0	111.6	E242 L245 H249 Y250 L296 I300	E242-L247 HydrophobicContact CB-CB 4.07Å; E242-L247 HydrophobicContact CB-CD1 4.05Å; E242-L247 HydrophobicContact CB-CG 4.29Å; E242-L247 PolarHBondContact O-N 3.01Å; L245-L247 HydrophobicContact CB-CD2 3.95Å; L245-L247 HydrophobicContact CB-CG 3.96Å; L245-L247 PolarHBondContact O-N 3.4Å; L247-H249 PolarHBondContact O-N 3.07Å; L247-Y250 WeakPolarHBondContact O-CE1 3.43Å; L247-L296 HydrophobicContact CD1-CD1 3.85Å; L247-L296 HydrophobicContact CD1-CG 4.23Å; L247-I300 HydrophobicContact CD2-CB 4.46Å; L247-I300 HydrophobicContact CD2-CG1 3.91Å
248	N	65.3	Low	87.1	Confident	68 Å²	68	16.7 Å²	16.7	36%	0.364	9%	0.087	S	C	.	.	S	Bend	trans	-70.8	7.6	-176.1	-59.9	-13.8	0	0	0	115.2	R301	N248-R301 WeakPolarHBondContact OD1-CD 3.42Å; N248-R301 WeakPolarHBondContact OD1-CG 2.98Å; N248-R301 PolarHBondContact OD1-NE 2.78Å; N248-R301 VanDerWaalsContact OD1-NE 3.12Å
249	H	69.4	Low	87.3	Confident	93 Å²	93	16.1 Å²	16.1	43%	0.431	9%	0.085	S	C	.	.			trans	-130.6	67.7	-165.3	-64.4	-29.8	0	0	0	112.1	L247 P343	L247-H249 PolarHBondContact O-N 3.07Å; H249-P343 HydrophobicContact CB-CG 4.1Å
250	Y	78.2	Confident	87.7	Confident	37 Å²	37	15.7 Å²	15.7	15%	0.145	8%	0.083	C	C	.	.			trans	-79.1	126.7	170.3	-56	-48.9	0	0	0	110.8	Y226 M229 E242 L243 L247 I254	Y226-Y250 HydrophobicContact CD2-CE2 4.08Å; M229-Y250 HydrophobicContact CB-CD2 4.34Å; M229-Y250 HydrophobicContact CB-CE2 4.16Å; M229-Y250 HydrophobicContact CE-CD1 3.64Å; M229-Y250 HydrophobicContact CE-CD2 3.94Å; M229-Y250 HydrophobicContact CE-CE1 4.28Å; M229-Y250 HydrophobicContact CE-CG 3.45Å; M229-Y250 VanDerWaalsContact CE-CG 3.45Å; M229-Y250 HydrophobicContact CG-CD2 4.43Å; M229-Y250 VanDerWaalsContact SD-CB 3.58Å; M229-Y250 HydrophobicContact SD-CD1 4.35Å; M229-Y250 HydrophobicContact SD-CD2 3.54Å; M229-Y250 VanDerWaalsContact SD-CD2 3.54Å; M229-Y250 HydrophobicContact SD-CE2 4.32Å; M229-Y250 HydrophobicContact SD-CG 3.56Å; M229-Y250 VanDerWaalsContact SD-CG 3.56Å; E242-Y250 HydrophobicContact CG-CD1 4.49Å; L243-Y250 HydrophobicContact CD2-CD1 4.03Å; L243-Y250 HydrophobicContact CD2-CE1 3.93Å; L247-Y250 WeakPolarHBondContact O-CE1 3.43Å; Y250-I254 HydrophobicContact CD1-CD1 4.23Å
251	S	87.6	Confident	87.9	Confident	39 Å²	39	15.8 Å²	15.8	27%	0.273	8%	0.084	S	C	.	.	S	Bend	trans	-153.1	-178.8	-176.4	80.9	0	0	0	0	112.2	A253 I254	S251-A253 PolarHBondContact O-N 3.1Å; S251-A253 VanDerWaalsContact O-N 3.09Å; S251-A253 VanDerWaalsContact OG-CB 3.28Å; S251-A253 WeakPolarHBondContact OG-CB 3.34Å; S251-A253 PolarHBondContact OG-N 3.42Å; S251-A253 VanDerWaalsContact OG-N 3.11Å; S251-I254 WeakPolarHBondContact O-CB 3.35Å; S251-I254 WeakPolarHBondContact O-CD1 3.32Å; S251-I254 WeakPolarHBondContact O-CG1 3.34Å; S251-I254 PolarHBondContact O-N 3.26Å; S251-I254 VanDerWaalsContact O-N 3.17Å
252	L	92.3	Very high	88.3	Confident	47 Å²	47	15.7 Å²	15.7	25%	0.246	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-23.1	171.2	-56.9	172.5	0	0	0	113	H185 I190 L218 I254 D255	H185-L252 HydrophobicContact CB-CD1 4.1Å; H185-L252 HydrophobicContact CB-CD2 4.1Å; H185-L252 PolarHBondContact CE1-O 3.42Å; I190-L252 HydrophobicContact CG1-CD2 4.05Å; L218-L252 HydrophobicContact CD1-CD1 4.28Å; L218-L252 HydrophobicContact CD1-CD2 4.07Å; L218-L252 HydrophobicContact CD1-CG 4.04Å; L218-L252 HydrophobicContact CD2-CD2 4.41Å; L218-L252 HydrophobicContact CD2-CG 4.3Å; L218-L252 HydrophobicContact CG-CD2 4.28Å; L252-I254 PolarHBondContact O-N 2.94Å; L252-D255 PolarHBondContact O-N 3.29Å
253	A	94.1	Very high	88.8	Confident	10 Å²	10	15.7 Å²	15.7	8%	0.083	8%	0.083	C	C	.	.	H	α-helix	trans	-62.1	-22.9	178.3	0	0	0	0	0	113.6	S251 D255 M256 W257 P343 R346	S251-A253 PolarHBondContact O-N 3.1Å; S251-A253 VanDerWaalsContact O-N 3.09Å; S251-A253 VanDerWaalsContact OG-CB 3.28Å; S251-A253 WeakPolarHBondContact OG-CB 3.34Å; S251-A253 PolarHBondContact OG-N 3.42Å; S251-A253 VanDerWaalsContact OG-N 3.11Å; A253-D255 VanDerWaalsContact C-N 3.27Å; A253-D255 PolarHBondContact O-N 3.09Å; A253-M256 WeakPolarHBondContact O-CB 3.35Å; A253-M256 PolarHBondContact O-N 3.32Å; A253-W257 PolarHBondContact O-N 3.22Å; A253-W257 VanDerWaalsContact O-N 3.15Å; A253-P343 HydrophobicContact CB-CB 3.84Å; A253-P343 VanDerWaalsContact CB-O 3.22Å; A253-P343 WeakPolarHBondContact CB-O 3.41Å; A253-R346 VanDerWaalsContact C-NH1 3.29Å; A253-R346 HydrophobicContact CB-CB 4.37Å; A253-R346 WeakPolarHBondContact O-CD 3.38Å; A253-R346 PolarHBondContact O-NH1 3.34Å
254	I	93.3	Very high	89.4	Confident	0 Å²	0	15 Å²	15	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-53.6	-47.5	176.3	-70.4	166.4	0	0	0	110.4	I190 M229 A240 E242 L243 Y250 S251 L252 M256 W257 S258	I190-I254 HydrophobicContact CG2-CB 4.24Å; I190-I254 HydrophobicContact CG2-CG2 4.42Å; M229-I254 HydrophobicContact CE-CD1 3.7Å; A240-I254 HydrophobicContact CB-CG2 4.39Å; E242-I254 HydrophobicContact CG-CG1 4Å; E242-I254 WeakPolarHBondContact OE1-CA 3.32Å; E242-I254 VanDerWaalsContact OE1-CG1 3.23Å; E242-I254 WeakPolarHBondContact OE1-CG1 3.41Å; L243-I254 HydrophobicContact CD1-CG2 3.75Å; L243-I254 HydrophobicContact CD2-CD1 4.09Å; L243-I254 HydrophobicContact CG-CD1 4.38Å; L243-I254 HydrophobicContact CG-CG1 4.5Å; L243-I254 HydrophobicContact CG-CG2 4.4Å; Y250-I254 HydrophobicContact CD1-CD1 4.23Å; S251-I254 WeakPolarHBondContact O-CB 3.35Å; S251-I254 WeakPolarHBondContact O-CD1 3.32Å; S251-I254 WeakPolarHBondContact O-CG1 3.34Å; S251-I254 PolarHBondContact O-N 3.26Å; S251-I254 VanDerWaalsContact O-N 3.17Å; L252-I254 PolarHBondContact O-N 2.94Å; I254-M256 VanDerWaalsContact C-N 3.32Å; I254-M256 PolarHBondContact O-N 2.93Å; I254-W257 WeakPolarHBondContact O-CB 3.3Å; I254-W257 PolarHBondContact O-N 3.08Å; I254-S258 PolarHBondContact O-N 3.34Å; I254-S258 PolarHBondContact O-OG 2.83Å
255	D	96.2	Very high	90	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-67.6	-34	179.5	-67	-29.4	0	0	0	111.6	L181 H185 I190 H191 R192 L194 L252 A253 W257 S258 V259	L181-D255 HydrophobicContact CD1-CB 4.05Å; L181-D255 HydrophobicContact CD2-CB 3.99Å; H185-D255 IonicContact CD2-OD2 3.5Å; H185-D255 IonicContact CE1-OD2 2.72Å; H185-D255 IonicContact NE2-OD2 2.57Å; H185-D255 PolarHBondContact NE2-OD2 3.22Å; I190-D255 WeakPolarHBondContact CA-OD2 3.38Å; I190-D255 WeakPolarHBondContact CG2-OD2 3.42Å; H191-D255 WeakPolarHBondContact CB-OD1 3.31Å; H191-D255 PolarHBondContact N-OD1 3.35Å; H191-D255 VanDerWaalsContact N-OD1 3.15Å; H191-D255 PolarHBondContact N-OD2 3.04Å; R192-D255 PolarHBondContact N-OD1 3.13Å; L194-D255 HydrophobicContact CD1-CB 3.74Å; L252-D255 PolarHBondContact O-N 3.29Å; A253-D255 VanDerWaalsContact C-N 3.27Å; A253-D255 PolarHBondContact O-N 3.09Å; D255-W257 VanDerWaalsContact C-N 3.3Å; D255-W257 PolarHBondContact O-N 3.1Å; D255-S258 WeakPolarHBondContact O-CB 3.18Å; D255-S258 PolarHBondContact O-N 3.19Å; D255-S258 VanDerWaalsContact O-N 3.14Å; D255-V259 WeakPolarHBondContact O-CG2 3.41Å; D255-V259 PolarHBondContact O-N 3.19Å
256	M	97.9	Very high	90.7	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-66.4	-30.5	178.7	-66.5	-58.3	-65.9	0	0	112.7	L178 L181 A253 I254 G260 M338 R346 I347 V349 A352	L178-M256 HydrophobicContact CD2-CE 3.84Å; L178-M256 HydrophobicContact CD2-SD 4.22Å; L181-M256 HydrophobicContact CD2-SD 3.81Å; A253-M256 WeakPolarHBondContact O-CB 3.35Å; A253-M256 PolarHBondContact O-N 3.32Å; I254-M256 VanDerWaalsContact C-N 3.32Å; I254-M256 PolarHBondContact O-N 2.93Å; M256-G260 PolarHBondContact O-N 2.81Å; M256-M338 HydrophobicContact CE-CE 3.98Å; M256-M338 HydrophobicContact CE-CG 4.43Å; M256-R346 HydrophobicContact CB-CG 4.34Å; M256-I347 HydrophobicContact CE-CG2 4.14Å; M256-I347 WeakPolarHBondContact CE-O 3.37Å; M256-V349 HydrophobicContact CE-CB 4.47Å; M256-V349 HydrophobicContact SD-CB 3.77Å; M256-V349 HydrophobicContact SD-CG2 4.24Å; M256-A352 HydrophobicContact CE-CB 3.75Å
257	W	97.3	Very high	91.5	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-64.7	-48	168.8	173.8	-90.1	0	0	0	111.4	R239 A240 P241 A253 I254 D255 V259 G260 C261 F273 I285 L289 L339	R239-W257 PolarHBondContact O-NE1 3.46Å; A240-W257 HydrophobicContact CB-CB 3.72Å; A240-W257 HydrophobicContact CB-CG 3.77Å; P241-W257 VanDerWaalsContact CD-CD2 3.49Å; P241-W257 HydrophobicContact CG-CD2 4.23Å; P241-W257 HydrophobicContact CG-CE3 3.97Å; P241-W257 HydrophobicContact CG-CH2 3.68Å; P241-W257 HydrophobicContact CG-CZ2 3.94Å; P241-W257 HydrophobicContact CG-CZ3 3.68Å; A253-W257 PolarHBondContact O-N 3.22Å; A253-W257 VanDerWaalsContact O-N 3.15Å; I254-W257 WeakPolarHBondContact O-CB 3.3Å; I254-W257 PolarHBondContact O-N 3.08Å; D255-W257 VanDerWaalsContact C-N 3.3Å; D255-W257 PolarHBondContact O-N 3.1Å; W257-V259 VanDerWaalsContact C-N 3.29Å; W257-V259 PolarHBondContact O-N 2.58Å; W257-G260 WeakPolarHBondContact O-CA 3.24Å; W257-G260 PolarHBondContact O-N 3.24Å; W257-C261 PolarHBondContact O-N 3.46Å; W257-F273 AromaticContact CH2-CE2 3.95Å; W257-F273 HydrophobicContact CH2-CE2 3.95Å; W257-F273 HydrophobicContact CH2-CZ 4.45Å; W257-F273 HydrophobicContact CZ2-CD2 4.01Å; W257-F273 AromaticContact CZ2-CE2 3.5Å; W257-F273 HydrophobicContact CZ2-CE2 3.5Å; W257-F273 HydrophobicContact CZ2-CZ 4.37Å; W257-I285 HydrophobicContact CH2-CG2 3.88Å; W257-I285 HydrophobicContact CZ2-CD1 4Å; W257-I285 HydrophobicContact CZ2-CG1 4.08Å; W257-I285 HydrophobicContact CZ2-CG2 4.16Å; W257-L289 HydrophobicContact CH2-CD1 4.13Å; W257-L289 HydrophobicContact CH2-CD2 3.73Å; W257-L289 HydrophobicContact CZ3-CD2 3.76Å; W257-L339 HydrophobicContact CD2-CD2 4Å; W257-L339 HydrophobicContact CE3-CD2 3.81Å; W257-L339 HydrophobicContact CH2-CD2 4.12Å; W257-L339 HydrophobicContact CZ2-CD2 4.31Å; W257-L339 HydrophobicContact CZ3-CB 4.14Å; W257-L339 HydrophobicContact CZ3-CD2 3.88Å
258	S	97.3	Very high	92.3	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.014	10%	0.104	C	C	.	.	H	α-helix	trans	-60.8	-38.9	177.9	-51.7	0	0	0	0	111.6	L194 Y238 I254 D255 C261 I262	L194-S258 WeakPolarHBondContact O-CB 3.36Å; Y238-S258 PolarHBondContact O-OG 3.45Å; I254-S258 PolarHBondContact O-N 3.34Å; I254-S258 PolarHBondContact O-OG 2.83Å; D255-S258 WeakPolarHBondContact O-CB 3.18Å; D255-S258 PolarHBondContact O-N 3.19Å; D255-S258 VanDerWaalsContact O-N 3.14Å; S258-C261 PolarHBondContact O-N 3.29Å; S258-I262 WeakPolarHBondContact O-CD1 3.38Å; S258-I262 WeakPolarHBondContact O-CG1 3.4Å; S258-I262 PolarHBondContact O-N 3.29Å
259	V	98.5	Very high	93.7	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-58.9	-43.9	170.2	173.8	0	0	0	0	111.3	L174 L177 L178 L181 L194 D255 W257 I262 F263 M338	L174-V259 HydrophobicContact CD1-CG1 3.61Å; L177-V259 HydrophobicContact CD2-CB 4.45Å; L177-V259 HydrophobicContact CD2-CG1 4.08Å; L177-V259 HydrophobicContact CD2-CG2 3.98Å; L177-V259 HydrophobicContact CG-CG2 4.11Å; L178-V259 HydrophobicContact CD2-CG1 4.11Å; L181-V259 HydrophobicContact CD2-CG2 3.7Å; L194-V259 HydrophobicContact CD1-CG2 3.99Å; D255-V259 WeakPolarHBondContact O-CG2 3.41Å; D255-V259 PolarHBondContact O-N 3.19Å; W257-V259 VanDerWaalsContact C-N 3.29Å; W257-V259 PolarHBondContact O-N 2.58Å; V259-I262 PolarHBondContact O-N 2.91Å; V259-F263 VanDerWaalsContact O-CB 3.32Å; V259-F263 WeakPolarHBondContact O-CB 3.31Å; V259-F263 PolarHBondContact O-N 3.43Å; V259-M338 HydrophobicContact CG1-CE 3.79Å; V259-M338 HydrophobicContact CG1-SD 3.9Å
260	G	98.1	Very high	94.9	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-57.2	-48.3	173.4	0	0	0	0	0	112.7	M256 W257 I262 F263 A264 L335	M256-G260 PolarHBondContact O-N 2.81Å; W257-G260 WeakPolarHBondContact O-CA 3.24Å; W257-G260 PolarHBondContact O-N 3.24Å; G260-I262 PolarHBondContact O-N 3.25Å; G260-F263 PolarHBondContact O-N 3.35Å; G260-A264 WeakPolarHBondContact O-CB 3.32Å; G260-A264 PolarHBondContact O-N 3.05Å; G260-L335 WeakPolarHBondContact O-CD1 3.44Å
261	C	98.1	Very high	95.7	Very high	2 Å²	2	21 Å²	21	1%	0.014	11%	0.11	C	C	.	.	H	α-helix	trans	-60.7	-41.3	175.2	-70.9	0	0	0	0	112.8	Y238 W257 S258 E265	Y238-C261 HydrophobicContact CD1-CB 3.86Å; W257-C261 PolarHBondContact O-N 3.46Å; S258-C261 PolarHBondContact O-N 3.29Å; C261-E265 VanDerWaalsContact O-CB 3.31Å; C261-E265 WeakPolarHBondContact O-CB 3.25Å; C261-E265 PolarHBondContact O-N 2.94Å
262	I	98.2	Very high	96	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-65.9	-40.1	176.7	-67.3	161	0	0	0	111.2	L155 L177 L194 P196 L199 Y238 S258 V259 G260 E265 M266	L155-I262 HydrophobicContact CD2-CG2 3.87Å; L177-I262 HydrophobicContact CD2-CD1 4.47Å; L177-I262 HydrophobicContact CD2-CG2 4.24Å; L194-I262 HydrophobicContact CB-CD1 4.11Å; P196-I262 HydrophobicContact CG-CG1 4.08Å; P196-I262 HydrophobicContact CG-CG2 4.38Å; L199-I262 HydrophobicContact CD1-CD1 4.09Å; L199-I262 HydrophobicContact CD1-CG2 4.08Å; Y238-I262 HydrophobicContact CD1-CG1 4.25Å; Y238-I262 HydrophobicContact CE1-CG1 4.43Å; S258-I262 WeakPolarHBondContact O-CD1 3.38Å; S258-I262 WeakPolarHBondContact O-CG1 3.4Å; S258-I262 PolarHBondContact O-N 3.29Å; V259-I262 PolarHBondContact O-N 2.91Å; G260-I262 PolarHBondContact O-N 3.25Å; I262-E265 PolarHBondContact O-N 2.84Å; I262-M266 HydrophobicContact CG2-CE 4.38Å; I262-M266 WeakPolarHBondContact O-CG 3.46Å; I262-M266 PolarHBondContact O-N 3.48Å
263	F	98.3	Very high	96.2	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-67.2	-44.4	178	-179.6	-154.8	0	0	0	111.8	T170 L174 V259 G260 E265 M266 M267 A331 L334 L335 M338 Y357	T170-F263 HydrophobicContact CG2-CD2 3.77Å; T170-F263 HydrophobicContact CG2-CE2 3.73Å; L174-F263 HydrophobicContact CD1-CB 4.15Å; L174-F263 HydrophobicContact CD1-CG 4.26Å; L174-F263 HydrophobicContact CD2-CD1 3.79Å; L174-F263 HydrophobicContact CD2-CD2 3.89Å; L174-F263 HydrophobicContact CD2-CE1 3.75Å; L174-F263 HydrophobicContact CD2-CE2 3.86Å; L174-F263 HydrophobicContact CD2-CG 3.85Å; L174-F263 HydrophobicContact CD2-CZ 3.78Å; V259-F263 VanDerWaalsContact O-CB 3.32Å; V259-F263 WeakPolarHBondContact O-CB 3.31Å; V259-F263 PolarHBondContact O-N 3.43Å; G260-F263 PolarHBondContact O-N 3.35Å; F263-E265 VanDerWaalsContact C-N 3.3Å; F263-E265 PolarHBondContact O-N 2.99Å; F263-M266 HydrophobicContact CD2-CE 4.4Å; F263-M266 PolarHBondContact O-N 2.82Å; F263-M267 HydrophobicContact CD1-CE 4.29Å; F263-M267 HydrophobicContact CD2-CE 3.87Å; F263-M267 HydrophobicContact CD2-CG 4.25Å; F263-M267 HydrophobicContact CD2-SD 4.32Å; F263-M267 HydrophobicContact CE1-CE 4.15Å; F263-M267 HydrophobicContact CE2-CE 3.71Å; F263-M267 HydrophobicContact CE2-CG 4.09Å; F263-M267 HydrophobicContact CE2-SD 3.76Å; F263-M267 HydrophobicContact CG-CE 4.16Å; F263-M267 HydrophobicContact CZ-CE 3.87Å; F263-M267 HydrophobicContact CZ-SD 4.13Å; F263-M267 PolarHBondContact O-N 3.47Å; F263-A331 VanDerWaalsContact CE1-O 3.25Å; F263-A331 WeakPolarHBondContact CE1-O 3.33Å; F263-A331 HydrophobicContact CE2-CB 4.42Å; F263-A331 HydrophobicContact CZ-CB 3.77Å; F263-L334 HydrophobicContact CE1-CB 4.17Å; F263-L334 HydrophobicContact CE1-CD2 4.26Å; F263-L334 HydrophobicContact CE1-CG 4.22Å; F263-L335 HydrophobicContact CB-CD1 4.47Å; F263-L335 HydrophobicContact CD1-CB 4.02Å; F263-L335 HydrophobicContact CD1-CD1 4.03Å; F263-L335 HydrophobicContact CE1-CB 4Å; F263-M338 HydrophobicContact CD1-SD 4.18Å; F263-Y357 HydrophobicContact CE1-CE1 4.48Å; F263-Y357 HydrophobicContact CE2-CD1 4.48Å; F263-Y357 AromaticContact CE2-CE1 3.63Å; F263-Y357 HydrophobicContact CE2-CE1 3.63Å; F263-Y357 AromaticContact CE2-CZ 3.95Å; F263-Y357 AromaticContact CZ-CD1 3.87Å; F263-Y357 HydrophobicContact CZ-CD1 3.87Å; F263-Y357 AromaticContact CZ-CE1 3.44Å; F263-Y357 HydrophobicContact CZ-CE1 3.44Å; F263-Y357 VanDerWaalsContact CZ-CE1 3.44Å; F263-Y357 AromaticContact CZ-CZ 3.93Å
264	A	97.3	Very high	96.3	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.4	-39.6	171.6	0	0	0	0	0	112.4	G260 M267 G268 L272 Y324 L335	G260-A264 WeakPolarHBondContact O-CB 3.32Å; G260-A264 PolarHBondContact O-N 3.05Å; A264-M267 PolarHBondContact O-N 3.01Å; A264-G268 PolarHBondContact O-N 3.01Å; A264-L272 HydrophobicContact CB-CB 4.07Å; A264-L272 HydrophobicContact CB-CD2 3.72Å; A264-L272 HydrophobicContact CB-CG 4.35Å; A264-Y324 HydrophobicContact CB-CE2 4.38Å; A264-Y324 WeakPolarHBondContact CB-OH 3.36Å; A264-Y324 WeakPolarHBondContact O-CE1 3.46Å; A264-Y324 PolarHBondContact O-OH 2.95Å; A264-Y324 VanDerWaalsContact O-OH 3.13Å; A264-L335 HydrophobicContact CB-CD1 4.05Å; A264-L335 HydrophobicContact CB-CD2 3.94Å
265	E	96.9	Very high	96.2	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-71.6	-36.9	176.9	177.5	165.1	161.2	0	0	112.8	I159 H160 Y238 C261 I262 F263 G268 R269 K270 Q271	I159-E265 HydrophobicContact CD1-CG 4.1Å; I159-E265 HydrophobicContact CG2-CG 3.94Å; H160-E265 IonicContact CD2-OE1 3.15Å; H160-E265 IonicContact CE1-OE1 3.8Å; H160-E265 IonicContact NE2-OE1 2.7Å; H160-E265 PolarHBondContact NE2-OE1 2.67Å; Y238-E265 PolarHBondContact OH-OE2 2.83Å; C261-E265 VanDerWaalsContact O-CB 3.31Å; C261-E265 WeakPolarHBondContact O-CB 3.25Å; C261-E265 PolarHBondContact O-N 2.94Å; I262-E265 PolarHBondContact O-N 2.84Å; F263-E265 VanDerWaalsContact C-N 3.3Å; F263-E265 PolarHBondContact O-N 2.99Å; E265-G268 PolarHBondContact O-N 3.26Å; E265-R269 VanDerWaalsContact O-CA 3.3Å; E265-R269 WeakPolarHBondContact O-CA 3.43Å; E265-R269 PolarHBondContact O-N 2.67Å; E265-K270 WeakPolarHBondContact CA-O 3.26Å; E265-Q271 PolarHBondContact OE1-NE2 2.89Å; E265-Q271 WeakPolarHBondContact OE2-CA 3.31Å; E265-Q271 WeakPolarHBondContact OE2-CG 3.47Å
266	M	96.8	Very high	95.9	Very high	4 Å²	4	29 Å²	29	2%	0.02	14%	0.144	C	C	.	.	H	α-helix	trans	-60.8	-42.7	169.9	-78	-168.1	-71	0	0	112.1	L155 I159 L165 T170 F173 L174 I262 F263	L155-M266 HydrophobicContact CD1-SD 4.24Å; L155-M266 HydrophobicContact CD2-CG 4.24Å; L155-M266 HydrophobicContact CD2-SD 3.97Å; I159-M266 HydrophobicContact CD1-CB 4.39Å; I159-M266 HydrophobicContact CD1-CG 3.57Å; I159-M266 HydrophobicContact CG1-CG 4.07Å; L165-M266 HydrophobicContact CD2-CB 3.9Å; L165-M266 HydrophobicContact CD2-CG 4.08Å; L165-M266 WeakPolarHBondContact CD2-O 3.4Å; T170-M266 HydrophobicContact CG2-CB 3.78Å; T170-M266 HydrophobicContact CG2-CE 4.07Å; T170-M266 HydrophobicContact CG2-SD 4.22Å; F173-M266 HydrophobicContact CB-SD 3.88Å; F173-M266 HydrophobicContact CD2-SD 4.39Å; L174-M266 HydrophobicContact CB-CE 4.22Å; I262-M266 HydrophobicContact CG2-CE 4.38Å; I262-M266 WeakPolarHBondContact O-CG 3.46Å; I262-M266 PolarHBondContact O-N 3.48Å; F263-M266 HydrophobicContact CD2-CE 4.4Å; F263-M266 PolarHBondContact O-N 2.82Å
267	M	94.8	Very high	95.4	Very high	46 Å²	46	33.1 Å²	33.1	23%	0.227	17%	0.166	C	C	.	.	H	α-helix	trans	-71.9	-36.4	178.5	-69.9	-168.3	-72.4	0	0	113	T170 F263 A264 Y324 A327 A331 L335	T170-M267 HydrophobicContact CG2-CG 4.08Å; F263-M267 HydrophobicContact CD1-CE 4.29Å; F263-M267 HydrophobicContact CD2-CE 3.87Å; F263-M267 HydrophobicContact CD2-CG 4.25Å; F263-M267 HydrophobicContact CD2-SD 4.32Å; F263-M267 HydrophobicContact CE1-CE 4.15Å; F263-M267 HydrophobicContact CE2-CE 3.71Å; F263-M267 HydrophobicContact CE2-CG 4.09Å; F263-M267 HydrophobicContact CE2-SD 3.76Å; F263-M267 HydrophobicContact CG-CE 4.16Å; F263-M267 HydrophobicContact CZ-CE 3.87Å; F263-M267 HydrophobicContact CZ-SD 4.13Å; F263-M267 PolarHBondContact O-N 3.47Å; A264-M267 PolarHBondContact O-N 3.01Å; M267-Y324 HydrophobicContact CB-CD1 3.98Å; M267-Y324 HydrophobicContact CB-CE1 4.16Å; M267-A327 HydrophobicContact SD-CB 3.86Å; M267-A331 HydrophobicContact SD-CB 3.85Å; M267-L335 HydrophobicContact CE-CB 4.4Å; M267-L335 HydrophobicContact CE-CD2 3.67Å
268	G	93.2	Very high	94.8	Very high	35 Å²	35	35.2 Å²	35.2	36%	0.361	17%	0.174	S	C	.	.	H	α-helix	trans	-93.1	-13.3	-176.3	0	0	0	0	0	116.4	A264 E265 K270	A264-G268 PolarHBondContact O-N 3.01Å; E265-G268 PolarHBondContact O-N 3.26Å; G268-K270 PolarHBondContact O-N 2.84Å
269	R	94.4	Very high	94.4	Very high	79 Å²	79	37.8 Å²	37.8	30%	0.298	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	30.5	-167.1	-54.9	-55.6	-153.4	89.7	22.4	114	I158 I159 S161 Q163 L165 E265	I158-R269 PolarHBondContact O-NH1 3.38Å; I159-R269 WeakPolarHBondContact O-CD 3.06Å; I159-R269 PolarHBondContact O-NH1 2.86Å; S161-R269 PolarHBondContact O-NH1 2.93Å; Q163-R269 PolarHBondContact O-NH1 3.2Å; Q163-R269 PolarHBondContact O-NH2 2.89Å; L165-R269 VanDerWaalsContact CB-CZ 3.47Å; L165-R269 VanDerWaalsContact CB-NH2 3.32Å; E265-R269 VanDerWaalsContact O-CA 3.3Å; E265-R269 WeakPolarHBondContact O-CA 3.43Å; E265-R269 PolarHBondContact O-N 2.67Å
270	K	93.8	Very high	94	Very high	138 Å²	138	40.4 Å²	40.4	60%	0.6	20%	0.202	S	C	*	.	S	Bend	trans	-159.8	143.5	-174.4	-174	-176.3	172.9	-173.1	0	109.5	E265 G268 L272	E265-K270 WeakPolarHBondContact CA-O 3.26Å; G268-K270 PolarHBondContact O-N 2.84Å; K270-L272 PolarHBondContact O-N 3.31Å
271	Q	94.9	Very high	93.8	Very high	36 Å²	36	40.4 Å²	40.4	17%	0.168	20%	0.202	C	C	.	.			trans	-53.5	132.6	172.4	-66.4	65.7	40	0	0	110.9	H160 W237 E265 P274	H160-Q271 PolarHBondContact CE1-NE2 2.85Å; H160-Q271 VanDerWaalsContact CE1-NE2 3.26Å; H160-Q271 PolarHBondContact NE2-NE2 3.02Å; W237-Q271 HydrophobicContact CD2-CG 4.35Å; W237-Q271 HydrophobicContact CE3-CG 3.59Å; W237-Q271 HydrophobicContact CZ3-CG 3.81Å; E265-Q271 PolarHBondContact OE1-NE2 2.89Å; E265-Q271 WeakPolarHBondContact OE2-CA 3.31Å; E265-Q271 WeakPolarHBondContact OE2-CG 3.47Å; Q271-P274 HydrophobicContact CB-CB 4.02Å; Q271-P274 HydrophobicContact CB-CG 4.35Å
272	L	95.4	Very high	93.4	Very high	25 Å²	25	40.4 Å²	40.4	13%	0.131	20%	0.202	C	C	.	.	S	Bend	trans	-69.9	-46.2	175.7	177.3	61	0	0	0	111.7	A264 K270 P274 L323 L339	A264-L272 HydrophobicContact CB-CB 4.07Å; A264-L272 HydrophobicContact CB-CD2 3.72Å; A264-L272 HydrophobicContact CB-CG 4.35Å; K270-L272 PolarHBondContact O-N 3.31Å; L272-P274 VanDerWaalsContact C-CD 3.48Å; L272-P274 WeakPolarHBondContact O-CD 3.29Å; L272-L323 HydrophobicContact CD1-CD1 4.43Å; L272-L339 HydrophobicContact CD2-CD1 3.52Å
273	F	96.1	Very high	93.1	Very high	3 Å²	3	43.6 Å²	43.6	1%	0.013	22%	0.217	C	C	.	.			trans	-125.6	71.1	-176.9	-54.6	-56.2	0	0	0	112.6	W237 W257 G275 Q281 L284 I285 V288 L289	W237-F273 WeakPolarHBondContact CA-O 3.49Å; W237-F273 WeakPolarHBondContact CB-O 3.37Å; W257-F273 AromaticContact CH2-CE2 3.95Å; W257-F273 HydrophobicContact CH2-CE2 3.95Å; W257-F273 HydrophobicContact CH2-CZ 4.45Å; W257-F273 HydrophobicContact CZ2-CD2 4.01Å; W257-F273 AromaticContact CZ2-CE2 3.5Å; W257-F273 HydrophobicContact CZ2-CE2 3.5Å; W257-F273 HydrophobicContact CZ2-CZ 4.37Å; F273-G275 VanDerWaalsContact C-N 3.27Å; F273-G275 PolarHBondContact O-N 2.91Å; F273-Q281 VanDerWaalsContact CB-NE2 3.28Å; F273-Q281 PolarHBondContact O-NE2 2.92Å; F273-Q281 VanDerWaalsContact O-NE2 3.11Å; F273-Q281 PolarHBondContact O-OE1 3.47Å; F273-L284 HydrophobicContact CB-CB 4.49Å; F273-L284 HydrophobicContact CD1-CB 4.12Å; F273-I285 HydrophobicContact CB-CG1 4.42Å; F273-I285 HydrophobicContact CD1-CG1 4.04Å; F273-I285 HydrophobicContact CD2-CG1 3.9Å; F273-I285 HydrophobicContact CE1-CB 4.48Å; F273-I285 HydrophobicContact CE1-CG1 4.23Å; F273-I285 HydrophobicContact CE2-CG1 4.1Å; F273-I285 HydrophobicContact CG-CG1 3.88Å; F273-I285 HydrophobicContact CZ-CG1 4.26Å; F273-V288 HydrophobicContact CE1-CB 3.91Å; F273-V288 HydrophobicContact CE1-CG2 3.8Å; F273-V288 HydrophobicContact CZ-CB 4.29Å; F273-L289 HydrophobicContact CZ-CD1 3.77Å
274	P	94.6	Very high	92.9	Very high	47 Å²	47	45.3 Å²	45.3	31%	0.305	23%	0.225	S	C	.	.			trans	-77.9	68.3	178.1	33.1	-36	0	0	0	112.3	Q271 L272 L284	Q271-P274 HydrophobicContact CB-CB 4.02Å; Q271-P274 HydrophobicContact CB-CG 4.35Å; L272-P274 VanDerWaalsContact C-CD 3.48Å; L272-P274 WeakPolarHBondContact O-CD 3.29Å; P274-L284 VanDerWaalsContact C-CD1 3.48Å; P274-L284 HydrophobicContact CG-CD1 4.49Å
275	G	92.3	Very high	92.8	Very high	6 Å²	6	45.3 Å²	45.3	6%	0.062	23%	0.225	C	C	.	.			trans	-63.1	144.4	175.9	0	0	0	0	0	112.7	W237 F273	W237-G275 PolarHBondContact NE1-O 3.44Å; F273-G275 VanDerWaalsContact C-N 3.27Å; F273-G275 PolarHBondContact O-N 2.91Å
276	K	89.4	Confident	92.6	Very high	185 Å²	185	45.5 Å²	45.5	80%	0.804	23%	0.226	S	C	*	.	S	Bend	trans	-90.8	-33.7	178.4	-72.9	-176.6	176.2	-175	0	112.3	H280	K276-H280 HydrophobicContact CB-CB 4.47Å; K276-H280 PolarHBondContact N-ND1 2.88Å; K276-H280 VanDerWaalsContact N-ND1 3.15Å
277	N	87.9	Confident	92.4	Very high	86 Å²	86	47.7 Å²	47.7	46%	0.46	24%	0.242	S	C	.	.	S	Bend	trans	-146.8	179.8	176.3	60.1	24	0	0	0	107.9	V279 H280 Q281	N277-V279 PolarHBondContact O-N 2.94Å; N277-V279 PolarHBondContact OD1-N 3.29Å; N277-H280 PolarHBondContact O-N 2.86Å; N277-H280 VanDerWaalsContact OD1-CB 3.27Å; N277-H280 WeakPolarHBondContact OD1-CB 3.35Å; N277-H280 PolarHBondContact OD1-N 3.1Å; N277-Q281 PolarHBondContact O-N 3.18Å
278	Y	85.4	Confident	92.3	Very high	44 Å²	44	46.2 Å²	46.2	17%	0.173	24%	0.236	C	C	.	.	H	α-helix	trans	-52.1	-52.1	179.1	171	-90.6	0	0	0	112.9	E231 L244 H280 Q281 L282 V305	E231-Y278 WeakPolarHBondContact OE1-CD2 3.23Å; E231-Y278 VanDerWaalsContact OE1-CE2 3.3Å; E231-Y278 WeakPolarHBondContact OE1-CE2 3.22Å; L244-Y278 HydrophobicContact CB-CE2 4.25Å; L244-Y278 HydrophobicContact CD2-CD2 4.19Å; L244-Y278 HydrophobicContact CD2-CE2 4.25Å; L244-Y278 WeakPolarHBondContact O-CE2 3.3Å; L244-Y278 VanDerWaalsContact O-CZ 3.31Å; L244-Y278 PolarHBondContact O-OH 2.92Å; Y278-H280 PolarHBondContact O-N 3.44Å; Y278-Q281 WeakPolarHBondContact O-CB 3.4Å; Y278-Q281 PolarHBondContact O-N 2.92Å; Y278-L282 PolarHBondContact O-N 3.47Å; Y278-L282 VanDerWaalsContact O-N 3.17Å; Y278-V305 VanDerWaalsContact OH-CG1 3.31Å; Y278-V305 WeakPolarHBondContact OH-CG1 3.21Å; Y278-V305 VanDerWaalsContact OH-CG2 3.25Å; Y278-V305 WeakPolarHBondContact OH-CG2 3.47Å
279	V	88.1	Confident	92.4	Very high	57 Å²	57	45.7 Å²	45.7	35%	0.345	22%	0.224	S	C	.	.	H	α-helix	trans	-63.3	-45.4	-176.3	-178.4	0	0	0	0	111.4	N277 Q281 L282 Q283 Y308	N277-V279 PolarHBondContact O-N 2.94Å; N277-V279 PolarHBondContact OD1-N 3.29Å; V279-Q281 VanDerWaalsContact C-N 3.33Å; V279-Q281 PolarHBondContact O-N 3.39Å; V279-L282 PolarHBondContact O-N 3.41Å; V279-Q283 HydrophobicContact CG1-CG 4.48Å; V279-Q283 WeakPolarHBondContact O-CG 3.44Å; V279-Q283 PolarHBondContact O-N 2.76Å; V279-Y308 HydrophobicContact CG1-CE1 3.96Å; V279-Y308 HydrophobicContact CG1-CE2 4.1Å; V279-Y308 WeakPolarHBondContact CG1-OH 3.37Å
280	H	90.8	Very high	92.4	Very high	54 Å²	54	41.9 Å²	41.9	25%	0.25	21%	0.21	C	C	.	.	H	α-helix	trans	-66	-34	178.5	-173.9	-140.1	0	0	0	112.3	K276 N277 Y278 Q283 L284	K276-H280 HydrophobicContact CB-CB 4.47Å; K276-H280 PolarHBondContact N-ND1 2.88Å; K276-H280 VanDerWaalsContact N-ND1 3.15Å; N277-H280 PolarHBondContact O-N 2.86Å; N277-H280 VanDerWaalsContact OD1-CB 3.27Å; N277-H280 WeakPolarHBondContact OD1-CB 3.35Å; N277-H280 PolarHBondContact OD1-N 3.1Å; Y278-H280 PolarHBondContact O-N 3.44Å; H280-Q283 PolarHBondContact O-N 2.85Å; H280-L284 VanDerWaalsContact O-CG 3.29Å; H280-L284 WeakPolarHBondContact O-CG 3.42Å; H280-L284 PolarHBondContact O-N 3.02Å
281	Q	92.3	Very high	92.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.1	-49	173	-174.3	69.1	31.3	0	0	110.9	R236 W237 L244 F273 N277 Y278 V279 L284 I285	R236-Q281 HydrophobicContact CG-CB 3.99Å; R236-Q281 HydrophobicContact CG-CG 3.85Å; R236-Q281 PolarHBondContact O-NE2 2.92Å; W237-Q281 PolarHBondContact O-NE2 2.91Å; L244-Q281 HydrophobicContact CD1-CG 3.77Å; F273-Q281 VanDerWaalsContact CB-NE2 3.28Å; F273-Q281 PolarHBondContact O-NE2 2.92Å; F273-Q281 VanDerWaalsContact O-NE2 3.11Å; F273-Q281 PolarHBondContact O-OE1 3.47Å; N277-Q281 PolarHBondContact O-N 3.18Å; Y278-Q281 WeakPolarHBondContact O-CB 3.4Å; Y278-Q281 PolarHBondContact O-N 2.92Å; V279-Q281 VanDerWaalsContact C-N 3.33Å; V279-Q281 PolarHBondContact O-N 3.39Å; Q281-L284 PolarHBondContact O-N 3.23Å; Q281-I285 HydrophobicContact CG-CD1 4.34Å; Q281-I285 WeakPolarHBondContact O-CG1 3.45Å; Q281-I285 PolarHBondContact O-N 2.8Å; Q281-I285 VanDerWaalsContact O-N 3.14Å
282	L	90.4	Very high	92	Very high	2 Å²	2	36 Å²	36	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-63	-44.4	178	179.7	56.7	0	0	0	111.4	L245 Y278 V279 L284 I285 L286 V305 Y308 V309	L245-L282 HydrophobicContact CD2-CD1 3.9Å; L245-L282 HydrophobicContact CD2-CD2 3.93Å; Y278-L282 PolarHBondContact O-N 3.47Å; Y278-L282 VanDerWaalsContact O-N 3.17Å; V279-L282 PolarHBondContact O-N 3.41Å; L282-L284 VanDerWaalsContact C-N 3.3Å; L282-L284 PolarHBondContact O-N 3.06Å; L282-I285 PolarHBondContact O-N 2.77Å; L282-L286 HydrophobicContact CD1-CD1 4Å; L282-L286 HydrophobicContact CD1-CG 4.1Å; L282-L286 HydrophobicContact CG-CD1 3.82Å; L282-L286 HydrophobicContact CG-CG 4.39Å; L282-L286 WeakPolarHBondContact O-CB 3.19Å; L282-L286 WeakPolarHBondContact O-CG 3.5Å; L282-L286 PolarHBondContact O-N 3.18Å; L282-V305 HydrophobicContact CD2-CG1 4.49Å; L282-Y308 HydrophobicContact CD2-CD1 4.12Å; L282-Y308 HydrophobicContact CD2-CE1 4.25Å; L282-V309 HydrophobicContact CD2-CG2 3.97Å
283	Q	91.3	Very high	91.7	Very high	68 Å²	68	39 Å²	39	32%	0.318	21%	0.21	S	C	.	.	H	α-helix	trans	-58.6	-36.7	175.6	-74.6	179.3	-27.3	0	0	113.8	V279 H280 S287 Y308	V279-Q283 HydrophobicContact CG1-CG 4.48Å; V279-Q283 WeakPolarHBondContact O-CG 3.44Å; V279-Q283 PolarHBondContact O-N 2.76Å; H280-Q283 PolarHBondContact O-N 2.85Å; Q283-S287 WeakPolarHBondContact O-CB 3.5Å; Q283-S287 PolarHBondContact O-N 3.08Å; Q283-Y308 WeakPolarHBondContact CG-OH 2.94Å; Q283-Y308 PolarHBondContact NE2-OH 3.09Å
284	L	94.4	Very high	91.2	Very high	35 Å²	35	47.2 Å²	47.2	18%	0.183	25%	0.248	C	C	.	.	H	α-helix	trans	-69.9	-43.2	176.7	-73.6	171.3	0	0	0	111.6	F273 P274 H280 Q281 L282 S287 V288	F273-L284 HydrophobicContact CB-CB 4.49Å; F273-L284 HydrophobicContact CD1-CB 4.12Å; P274-L284 VanDerWaalsContact C-CD1 3.48Å; P274-L284 HydrophobicContact CG-CD1 4.49Å; H280-L284 VanDerWaalsContact O-CG 3.29Å; H280-L284 WeakPolarHBondContact O-CG 3.42Å; H280-L284 PolarHBondContact O-N 3.02Å; Q281-L284 PolarHBondContact O-N 3.23Å; L282-L284 VanDerWaalsContact C-N 3.3Å; L282-L284 PolarHBondContact O-N 3.06Å; L284-S287 WeakPolarHBondContact O-CB 3.45Å; L284-S287 PolarHBondContact O-N 3.29Å; L284-S287 VanDerWaalsContact O-N 3.08Å; L284-S287 PolarHBondContact O-OG 3.01Å; L284-V288 PolarHBondContact O-N 3.1Å
285	I	94.8	Very high	90.8	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.4	-49.7	174.7	-65.6	169	0	0	0	109.9	L244 W257 F273 Q281 L282 S287 V288 L289 F341	L244-I285 HydrophobicContact CD1-CD1 3.67Å; W257-I285 HydrophobicContact CH2-CG2 3.88Å; W257-I285 HydrophobicContact CZ2-CD1 4Å; W257-I285 HydrophobicContact CZ2-CG1 4.08Å; W257-I285 HydrophobicContact CZ2-CG2 4.16Å; F273-I285 HydrophobicContact CB-CG1 4.42Å; F273-I285 HydrophobicContact CD1-CG1 4.04Å; F273-I285 HydrophobicContact CD2-CG1 3.9Å; F273-I285 HydrophobicContact CE1-CB 4.48Å; F273-I285 HydrophobicContact CE1-CG1 4.23Å; F273-I285 HydrophobicContact CE2-CG1 4.1Å; F273-I285 HydrophobicContact CG-CG1 3.88Å; F273-I285 HydrophobicContact CZ-CG1 4.26Å; Q281-I285 HydrophobicContact CG-CD1 4.34Å; Q281-I285 WeakPolarHBondContact O-CG1 3.45Å; Q281-I285 PolarHBondContact O-N 2.8Å; Q281-I285 VanDerWaalsContact O-N 3.14Å; L282-I285 PolarHBondContact O-N 2.77Å; I285-S287 PolarHBondContact O-N 3.14Å; I285-V288 PolarHBondContact O-N 2.67Å; I285-V288 VanDerWaalsContact O-N 3.1Å; I285-L289 HydrophobicContact CG2-CD1 4.33Å; I285-L289 HydrophobicContact CG2-CD2 4.34Å; I285-L289 PolarHBondContact O-N 3.46Å; I285-F341 HydrophobicContact CG2-CE1 3.64Å; I285-F341 HydrophobicContact CG2-CZ 4.09Å
286	L	92.8	Very high	90.4	Very high	5 Å²	5	48.2 Å²	48.2	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-63.1	-18.3	175.3	-66.2	169.3	0	0	0	114	L282 G290 P292 L312 R315 F341	L282-L286 HydrophobicContact CD1-CD1 4Å; L282-L286 HydrophobicContact CD1-CG 4.1Å; L282-L286 HydrophobicContact CG-CD1 3.82Å; L282-L286 HydrophobicContact CG-CG 4.39Å; L282-L286 WeakPolarHBondContact O-CB 3.19Å; L282-L286 WeakPolarHBondContact O-CG 3.5Å; L282-L286 PolarHBondContact O-N 3.18Å; L286-G290 WeakPolarHBondContact CA-O 3.49Å; L286-G290 WeakPolarHBondContact CD2-O 3.49Å; L286-G290 CarbonylContact O-C 3.57Å; L286-G290 WeakPolarHBondContact O-CA 3.31Å; L286-G290 PolarHBondContact O-N 3.21Å; L286-P292 HydrophobicContact CD2-CG 3.72Å; L286-L312 HydrophobicContact CD1-CD1 3.46Å; L286-L312 VanDerWaalsContact CD1-CD1 3.46Å; L286-R315 WeakPolarHBondContact O-CD 3.49Å; L286-F341 HydrophobicContact CD2-CE1 4.46Å; L286-F341 HydrophobicContact CD2-CZ 3.94Å
287	S	92.6	Very high	90.3	Very high	51 Å²	51	40.1 Å²	40.1	36%	0.357	23%	0.23	S	C	.	.	H	α-helix	trans	-82.1	-16	175.6	78.7	0	0	0	0	113.9	Q283 L284 I285 V318	Q283-S287 WeakPolarHBondContact O-CB 3.5Å; Q283-S287 PolarHBondContact O-N 3.08Å; L284-S287 WeakPolarHBondContact O-CB 3.45Å; L284-S287 PolarHBondContact O-N 3.29Å; L284-S287 VanDerWaalsContact O-N 3.08Å; L284-S287 PolarHBondContact O-OG 3.01Å; I285-S287 PolarHBondContact O-N 3.14Å; S287-V318 VanDerWaalsContact O-CG2 3.26Å; S287-V318 WeakPolarHBondContact O-CG2 3.28Å
288	V	94.1	Very high	90.1	Very high	14 Å²	14	38.1 Å²	38.1	9%	0.085	23%	0.23	C	C	.	.	H	α-helix	trans	-109.7	-48.6	177.6	177.8	0	0	0	0	111.2	F273 L284 I285 G290 V318 L320 L323	F273-V288 HydrophobicContact CE1-CB 3.91Å; F273-V288 HydrophobicContact CE1-CG2 3.8Å; F273-V288 HydrophobicContact CZ-CB 4.29Å; L284-V288 PolarHBondContact O-N 3.1Å; I285-V288 PolarHBondContact O-N 2.67Å; I285-V288 VanDerWaalsContact O-N 3.1Å; V288-G290 VanDerWaalsContact C-N 3.31Å; V288-V318 PolarHBondContact O-N 3.27Å; V288-L320 HydrophobicContact CG1-CD2 4.16Å; V288-L323 HydrophobicContact CG1-CD1 3.64Å; V288-L323 HydrophobicContact CG2-CD1 4.07Å
289	L	94.7	Very high	90.1	Very high	24 Å²	24	38.2 Å²	38.2	13%	0.126	24%	0.237	C	C	.	.	S	Bend	trans	-81.8	-10.3	-178.8	-76.9	69.5	0	0	0	113.1	W257 F273 I285 P317 L339 F341	W257-L289 HydrophobicContact CH2-CD1 4.13Å; W257-L289 HydrophobicContact CH2-CD2 3.73Å; W257-L289 HydrophobicContact CZ3-CD2 3.76Å; F273-L289 HydrophobicContact CZ-CD1 3.77Å; I285-L289 HydrophobicContact CG2-CD1 4.33Å; I285-L289 HydrophobicContact CG2-CD2 4.34Å; I285-L289 PolarHBondContact O-N 3.46Å; L289-P317 WeakPolarHBondContact O-CG 2.85Å; L289-L339 WeakPolarHBondContact CD2-O 3.38Å; L289-F341 HydrophobicContact CB-CD2 4.05Å; L289-F341 HydrophobicContact CB-CE1 4.43Å; L289-F341 HydrophobicContact CB-CE2 3.35Å; L289-F341 HydrophobicContact CB-CZ 3.55Å; L289-F341 HydrophobicContact CD2-CD1 4.1Å; L289-F341 HydrophobicContact CD2-CD2 3.91Å; L289-F341 HydrophobicContact CD2-CE1 4.1Å; L289-F341 HydrophobicContact CD2-CE2 3.93Å; L289-F341 HydrophobicContact CD2-CG 3.99Å; L289-F341 HydrophobicContact CD2-CZ 4Å; L289-F341 HydrophobicContact CG-CE2 4.3Å; L289-F341 HydrophobicContact CG-CZ 4.43Å
290	G	93.7	Very high	89.9	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	22%	0.22	C	C	.	.			trans	79.2	-167	-172.9	0	0	0	0	0	112.9	L286 V288 R315 F341	L286-G290 WeakPolarHBondContact CA-O 3.49Å; L286-G290 WeakPolarHBondContact CD2-O 3.49Å; L286-G290 CarbonylContact O-C 3.57Å; L286-G290 WeakPolarHBondContact O-CA 3.31Å; L286-G290 PolarHBondContact O-N 3.21Å; V288-G290 VanDerWaalsContact C-N 3.31Å; G290-R315 CarbonylContact C-O 3.56Å; G290-R315 VanDerWaalsContact CA-O 3.24Å; G290-R315 WeakPolarHBondContact CA-O 3.44Å; G290-F341 WeakPolarHBondContact O-CZ 3.28Å
291	T	91.4	Very high	89.4	Confident	45 Å²	45	37.4 Å²	37.4	28%	0.276	23%	0.225	S	C	.	.	S	Bend	trans	-73.4	140.1	174.9	-62.3	0	0	0	0	110.4	I297 S314 R315	T291-I297 HydrophobicContact CG2-CD1 4.41Å; T291-S314 WeakPolarHBondContact OG1-CA 3.35Å; T291-R315 PolarHBondContact N-O 2.84Å; T291-R315 PolarHBondContact OG1-N 2.7Å
292	P	89.8	Confident	88.8	Confident	6 Å²	6	38.9 Å²	38.9	4%	0.039	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-73.4	157.2	-178.1	-9.7	28.1	0	0	0	111.1	L286 L296 I297 V309 F341	L286-P292 HydrophobicContact CD2-CG 3.72Å; P292-L296 HydrophobicContact CB-CD2 3.91Å; P292-I297 HydrophobicContact CB-CG1 4.33Å; P292-I297 WeakPolarHBondContact O-CD1 3.13Å; P292-V309 HydrophobicContact CG-CG1 4.21Å; P292-F341 HydrophobicContact CB-CD2 4.14Å; P292-F341 HydrophobicContact CB-CE2 4.18Å; P292-F341 HydrophobicContact CB-CG 4.34Å; P292-F341 HydrophobicContact CB-CZ 4.45Å; P292-F341 HydrophobicContact CG-CE1 4.18Å; P292-F341 HydrophobicContact CG-CE2 4.17Å; P292-F341 HydrophobicContact CG-CZ 4Å
293	P	88.4	Confident	88.5	Confident	88 Å²	88	43.4 Å²	43.4	57%	0.571	26%	0.262	S	S	*	.	P	Polyproline II helix	trans	-58.6	144.5	175.7	-23.4	34.1	0	0	0	112.4	G295 L296 I297	P293-G295 VanDerWaalsContact C-N 3.26Å; P293-G295 PolarHBondContact O-N 3.33Å; P293-L296 WeakPolarHBondContact O-CA 3.24Å; P293-L296 WeakPolarHBondContact O-CB 3.44Å; P293-L296 PolarHBondContact O-N 3.42Å; P293-I297 PolarHBondContact O-N 3.03Å; P293-I297 VanDerWaalsContact O-N 3.09Å
294	E	86.3	Confident	88.2	Confident	174 Å²	174	51 Å²	51	81%	0.813	29%	0.287	S	S	*	.	H	α-helix	trans	-56.3	-37.8	-177.3	-64.5	-176.9	163.5	0	0	113.1	L296 I297 G298	E294-L296 PolarHBondContact O-N 2.74Å; E294-I297 PolarHBondContact O-N 3.02Å; E294-I297 VanDerWaalsContact O-N 3.14Å; E294-G298 PolarHBondContact O-N 3.26Å
295	G	85.1	Confident	87.7	Confident	65 Å²	65	50.2 Å²	50.2	67%	0.67	28%	0.284	S	S	*	.	H	α-helix	trans	-63.5	-25.4	174.8	0	0	0	0	0	114.3	P293 S299	P293-G295 VanDerWaalsContact C-N 3.26Å; P293-G295 PolarHBondContact O-N 3.33Å; G295-S299 PolarHBondContact O-N 3.3Å
296	L	85.1	Confident	87.4	Confident	10 Å²	10	53.3 Å²	53.3	5%	0.052	30%	0.296	C	S	.	.	H	α-helix	trans	-80.9	-38.7	171.8	-162.9	81	0	0	0	111.2	L247 P292 P293 E294 G298 S299 I300 F341 D342	L247-L296 HydrophobicContact CD1-CD1 3.85Å; L247-L296 HydrophobicContact CD1-CG 4.23Å; P292-L296 HydrophobicContact CB-CD2 3.91Å; P293-L296 WeakPolarHBondContact O-CA 3.24Å; P293-L296 WeakPolarHBondContact O-CB 3.44Å; P293-L296 PolarHBondContact O-N 3.42Å; E294-L296 PolarHBondContact O-N 2.74Å; L296-G298 PolarHBondContact O-N 2.8Å; L296-S299 PolarHBondContact O-N 2.82Å; L296-S299 VanDerWaalsContact O-N 3.07Å; L296-S299 PolarHBondContact O-OG 3.07Å; L296-I300 PolarHBondContact O-N 2.93Å; L296-F341 HydrophobicContact CD2-CB 3.75Å; L296-F341 HydrophobicContact CD2-CG 4.36Å; L296-D342 HydrophobicContact CD1-CB 4.37Å
297	I	86.5	Confident	87.2	Confident	15 Å²	15	56.1 Å²	56.1	8%	0.077	32%	0.316	C	S	.	.	H	α-helix	trans	-61.2	-38.5	173.6	-60.2	174.8	0	0	0	110.2	T291 P292 P293 E294 S299 I300 R306 V309 Q310	T291-I297 HydrophobicContact CG2-CD1 4.41Å; P292-I297 HydrophobicContact CB-CG1 4.33Å; P292-I297 WeakPolarHBondContact O-CD1 3.13Å; P293-I297 PolarHBondContact O-N 3.03Å; P293-I297 VanDerWaalsContact O-N 3.09Å; E294-I297 PolarHBondContact O-N 3.02Å; E294-I297 VanDerWaalsContact O-N 3.14Å; I297-S299 VanDerWaalsContact C-N 3.31Å; I297-S299 PolarHBondContact O-N 3.21Å; I297-I300 HydrophobicContact CG2-CD1 4.48Å; I297-I300 PolarHBondContact O-N 3.49Å; I297-R306 HydrophobicContact CG2-CG 4.24Å; I297-R306 PolarHBondContact O-NE 2.82Å; I297-V309 HydrophobicContact CD1-CG1 3.94Å; I297-V309 HydrophobicContact CG1-CG1 3.96Å; I297-Q310 HydrophobicContact CG2-CG 3.63Å
298	G	84.6	Confident	86.9	Confident	44 Å²	44	56.4 Å²	56.4	45%	0.454	31%	0.31	S	S	.	.	H	α-helix	trans	-61.2	-33.1	172.3	0	0	0	0	0	114	E294 L296 R306	E294-G298 PolarHBondContact O-N 3.26Å; L296-G298 PolarHBondContact O-N 2.8Å; G298-R306 PolarHBondContact O-NH2 2.82Å
299	S	84.8	Confident	86.6	Confident	45 Å²	45	56 Å²	56	32%	0.315	31%	0.307	S	S	.	.	H	α-helix	trans	-86	-3.6	-178	68.7	0	0	0	0	115.3	G295 L296 I297 R301	G295-S299 PolarHBondContact O-N 3.3Å; L296-S299 PolarHBondContact O-N 2.82Å; L296-S299 VanDerWaalsContact O-N 3.07Å; L296-S299 PolarHBondContact O-OG 3.07Å; I297-S299 VanDerWaalsContact C-N 3.31Å; I297-S299 PolarHBondContact O-N 3.21Å; S299-R301 PolarHBondContact O-N 3.02Å
300	I	85	Confident	86.3	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	33%	0.328	C	S	.	.			trans	-62.9	114.2	171.3	-61.9	173.2	0	0	0	109.8	L245 L247 L296 I297 A302 V305 R306 V309	L245-I300 HydrophobicContact CB-CG1 4.29Å; L245-I300 HydrophobicContact CD1-CD1 4.46Å; L245-I300 HydrophobicContact CD2-CD1 4.16Å; L247-I300 HydrophobicContact CD2-CB 4.46Å; L247-I300 HydrophobicContact CD2-CG1 3.91Å; L296-I300 PolarHBondContact O-N 2.93Å; I297-I300 HydrophobicContact CG2-CD1 4.48Å; I297-I300 PolarHBondContact O-N 3.49Å; I300-A302 WeakPolarHBondContact CG2-O 3.41Å; I300-V305 HydrophobicContact CG2-CB 4.03Å; I300-V305 HydrophobicContact CG2-CG1 4.22Å; I300-R306 HydrophobicContact CB-CB 4.11Å; I300-R306 HydrophobicContact CG2-CB 3.93Å; I300-R306 PolarHBondContact O-NE 2.82Å; I300-R306 PolarHBondContact O-NH2 3.06Å; I300-V309 HydrophobicContact CD1-CG2 4.36Å
301	R	78.8	Confident	86.1	Confident	93 Å²	93	64.9 Å²	64.9	35%	0.351	36%	0.358	S	S	.	.	S	Bend	trans	-68.4	-31	177.3	-95.8	-175.5	167.2	159	-2.8	113.3	E223 N248 S299 D303	E223-R301 IonicContact OE1-CZ 3.65Å; E223-R301 IonicContact OE1-NH1 3.52Å; E223-R301 IonicContact OE1-NH2 3.5Å; E223-R301 PolarHBondContact OE1-NH2 3.15Å; E223-R301 IonicContact OE2-NH2 2.77Å; E223-R301 PolarHBondContact OE2-NH2 3.16Å; N248-R301 WeakPolarHBondContact OD1-CD 3.42Å; N248-R301 WeakPolarHBondContact OD1-CG 2.98Å; N248-R301 PolarHBondContact OD1-NE 2.78Å; N248-R301 VanDerWaalsContact OD1-NE 3.12Å; S299-R301 PolarHBondContact O-N 3.02Å; R301-D303 PolarHBondContact O-N 3.38Å
302	A	80.5	Confident	85.9	Confident	31 Å²	31	64.3 Å²	64.3	26%	0.256	35%	0.353	S	S	.	.			trans	-88.3	103.4	-175.5	0	0	0	0	0	112.2	I300 R304 V305 R306	I300-A302 WeakPolarHBondContact CG2-O 3.41Å; A302-R304 VanDerWaalsContact C-N 3.26Å; A302-R304 PolarHBondContact O-N 3.33Å; A302-R304 VanDerWaalsContact O-N 3.15Å; A302-V305 HydrophobicContact CB-CB 4.1Å; A302-V305 HydrophobicContact CB-CG2 3.78Å; A302-V305 WeakPolarHBondContact O-CA 3.36Å; A302-V305 WeakPolarHBondContact O-CB 3.5Å; A302-V305 PolarHBondContact O-N 2.88Å; A302-R306 PolarHBondContact O-N 3.24Å
303	D	83.9	Confident	85.7	Confident	98 Å²	98	68.3 Å²	68.3	52%	0.524	38%	0.379	S	S	.	.	H	α-helix	trans	-56.2	-34.2	-176.3	-73.3	-56.6	0	0	0	114.8	R301 V305 R306 S307	R301-D303 PolarHBondContact O-N 3.38Å; D303-V305 VanDerWaalsContact C-N 3.31Å; D303-V305 PolarHBondContact O-N 3.16Å; D303-R306 PolarHBondContact O-N 3.45Å; D303-R306 IonicContact OD1-CZ 3.35Å; D303-R306 IonicContact OD1-NH1 2.87Å; D303-R306 PolarHBondContact OD1-NH1 3.11Å; D303-S307 VanDerWaalsContact O-CB 3.25Å; D303-S307 WeakPolarHBondContact O-CB 3.34Å; D303-S307 PolarHBondContact O-N 3.45Å; D303-S307 PolarHBondContact O-OG 3.21Å
304	R	84.6	Confident	85.8	Confident	226 Å²	226	69.4 Å²	69.4	85%	0.853	39%	0.388	S	S	*	.	H	α-helix	trans	-60.4	-40.9	173	-65.9	-178.2	-180	176.5	-0.2	111.8	A302 Y308	A302-R304 VanDerWaalsContact C-N 3.26Å; A302-R304 PolarHBondContact O-N 3.33Å; A302-R304 VanDerWaalsContact O-N 3.15Å; R304-Y308 VanDerWaalsContact O-CB 3.26Å; R304-Y308 WeakPolarHBondContact O-CB 3.5Å; R304-Y308 PolarHBondContact O-N 3.17Å
305	V	83.9	Confident	86	Confident	19 Å²	19	65.7 Å²	65.7	12%	0.115	37%	0.367	C	S	.	.	H	α-helix	trans	-75.8	-41.7	179.9	-176.2	0	0	0	0	110.7	L245 Y278 L282 I300 A302 D303 Y308 V309	L245-V305 HydrophobicContact CD2-CG1 3.58Å; Y278-V305 VanDerWaalsContact OH-CG1 3.31Å; Y278-V305 WeakPolarHBondContact OH-CG1 3.21Å; Y278-V305 VanDerWaalsContact OH-CG2 3.25Å; Y278-V305 WeakPolarHBondContact OH-CG2 3.47Å; L282-V305 HydrophobicContact CD2-CG1 4.49Å; I300-V305 HydrophobicContact CG2-CB 4.03Å; I300-V305 HydrophobicContact CG2-CG1 4.22Å; A302-V305 HydrophobicContact CB-CB 4.1Å; A302-V305 HydrophobicContact CB-CG2 3.78Å; A302-V305 WeakPolarHBondContact O-CA 3.36Å; A302-V305 WeakPolarHBondContact O-CB 3.5Å; A302-V305 PolarHBondContact O-N 2.88Å; D303-V305 VanDerWaalsContact C-N 3.31Å; D303-V305 PolarHBondContact O-N 3.16Å; V305-Y308 PolarHBondContact O-N 2.93Å; V305-V309 WeakPolarHBondContact O-CG2 3.46Å; V305-V309 PolarHBondContact O-N 2.68Å
306	R	88.2	Confident	86.3	Confident	65 Å²	65	68.5 Å²	68.5	25%	0.245	37%	0.371	C	S	.	.	H	α-helix	trans	-55.9	-54.1	173.1	-179	-172.2	-78.7	152.5	-15.5	110.7	I297 G298 I300 A302 D303 Y308 V309 Q310	I297-R306 HydrophobicContact CG2-CG 4.24Å; I297-R306 PolarHBondContact O-NE 2.82Å; G298-R306 PolarHBondContact O-NH2 2.82Å; I300-R306 HydrophobicContact CB-CB 4.11Å; I300-R306 HydrophobicContact CG2-CB 3.93Å; I300-R306 PolarHBondContact O-NE 2.82Å; I300-R306 PolarHBondContact O-NH2 3.06Å; A302-R306 PolarHBondContact O-N 3.24Å; D303-R306 PolarHBondContact O-N 3.45Å; D303-R306 IonicContact OD1-CZ 3.35Å; D303-R306 IonicContact OD1-NH1 2.87Å; D303-R306 PolarHBondContact OD1-NH1 3.11Å; R306-Y308 VanDerWaalsContact C-N 3.31Å; R306-Y308 PolarHBondContact O-N 3.15Å; R306-V309 PolarHBondContact O-N 2.77Å; R306-Q310 WeakPolarHBondContact O-CB 3.21Å; R306-Q310 WeakPolarHBondContact O-CG 3.42Å; R306-Q310 PolarHBondContact O-N 2.7Å
307	S	88.3	Confident	86.7	Confident	64 Å²	64	72.3 Å²	72.3	45%	0.448	40%	0.397	S	S	.	.	H	α-helix	trans	-61.2	-38.9	178.1	-53.1	0	0	0	0	111.9	D303 Q310 S311	D303-S307 VanDerWaalsContact O-CB 3.25Å; D303-S307 WeakPolarHBondContact O-CB 3.34Å; D303-S307 PolarHBondContact O-N 3.45Å; D303-S307 PolarHBondContact O-OG 3.21Å; S307-Q310 PolarHBondContact O-N 3.32Å; S307-S311 WeakPolarHBondContact O-CB 3.15Å; S307-S311 PolarHBondContact O-N 3.35Å; S307-S311 PolarHBondContact O-OG 3.31Å
308	Y	87.6	Confident	87	Confident	58 Å²	58	73.6 Å²	73.6	23%	0.227	41%	0.405	C	S	.	.	H	α-helix	trans	-61.8	-50.4	175.1	179.3	-102.7	0	0	0	111.6	V279 L282 Q283 R304 V305 R306 Q310 S311 L312	V279-Y308 HydrophobicContact CG1-CE1 3.96Å; V279-Y308 HydrophobicContact CG1-CE2 4.1Å; V279-Y308 WeakPolarHBondContact CG1-OH 3.37Å; L282-Y308 HydrophobicContact CD2-CD1 4.12Å; L282-Y308 HydrophobicContact CD2-CE1 4.25Å; Q283-Y308 WeakPolarHBondContact CG-OH 2.94Å; Q283-Y308 PolarHBondContact NE2-OH 3.09Å; R304-Y308 VanDerWaalsContact O-CB 3.26Å; R304-Y308 WeakPolarHBondContact O-CB 3.5Å; R304-Y308 PolarHBondContact O-N 3.17Å; V305-Y308 PolarHBondContact O-N 2.93Å; R306-Y308 VanDerWaalsContact C-N 3.31Å; R306-Y308 PolarHBondContact O-N 3.15Å; Y308-Q310 VanDerWaalsContact C-N 3.29Å; Y308-Q310 PolarHBondContact O-N 3.18Å; Y308-S311 PolarHBondContact O-N 2.8Å; Y308-S311 VanDerWaalsContact O-N 3.15Å; Y308-S311 PolarHBondContact O-OG 2.77Å; Y308-L312 HydrophobicContact CD1-CD1 4.37Å; Y308-L312 HydrophobicContact CE1-CD1 3.75Å; Y308-L312 HydrophobicContact CE1-CG 4.32Å; Y308-L312 PolarHBondContact O-N 2.8Å
309	V	87	Confident	87.5	Confident	4 Å²	4	75.8 Å²	75.8	2%	0.024	41%	0.411	C	S	.	.	H	α-helix	trans	-61.8	-37.3	178	174.5	0	0	0	0	111.6	L245 L282 P292 I297 I300 V305 R306 L312	L245-V309 HydrophobicContact CD2-CG2 4.15Å; L282-V309 HydrophobicContact CD2-CG2 3.97Å; P292-V309 HydrophobicContact CG-CG1 4.21Å; I297-V309 HydrophobicContact CD1-CG1 3.94Å; I297-V309 HydrophobicContact CG1-CG1 3.96Å; I300-V309 HydrophobicContact CD1-CG2 4.36Å; V305-V309 WeakPolarHBondContact O-CG2 3.46Å; V305-V309 PolarHBondContact O-N 2.68Å; R306-V309 PolarHBondContact O-N 2.77Å; V309-L312 PolarHBondContact O-N 2.83Å
310	Q	88.5	Confident	87.9	Confident	122 Å²	122	74.5 Å²	74.5	57%	0.57	40%	0.401	S	S	*	.	H	α-helix	trans	-69.3	-29.1	175.6	-72.2	172.1	-40	0	0	113.9	I297 R306 S307 Y308 L312	I297-Q310 HydrophobicContact CG2-CG 3.63Å; R306-Q310 WeakPolarHBondContact O-CB 3.21Å; R306-Q310 WeakPolarHBondContact O-CG 3.42Å; R306-Q310 PolarHBondContact O-N 2.7Å; S307-Q310 PolarHBondContact O-N 3.32Å; Y308-Q310 VanDerWaalsContact C-N 3.29Å; Y308-Q310 PolarHBondContact O-N 3.18Å; Q310-L312 VanDerWaalsContact C-N 3.32Å
311	S	89.3	Confident	88.4	Confident	89 Å²	89	77 Å²	77	62%	0.622	42%	0.422	S	S	*	.	H	α-helix	trans	-80.5	-9.3	177.4	65.3	0	0	0	0	114.1	S307 Y308	S307-S311 WeakPolarHBondContact O-CB 3.15Å; S307-S311 PolarHBondContact O-N 3.35Å; S307-S311 PolarHBondContact O-OG 3.31Å; Y308-S311 PolarHBondContact O-N 2.8Å; Y308-S311 VanDerWaalsContact O-N 3.15Å; Y308-S311 PolarHBondContact O-OG 2.77Å
312	L	87.4	Confident	89.1	Confident	33 Å²	33	80.3 Å²	80.3	17%	0.173	44%	0.439	C	S	.	.	S	Bend	trans	-79.9	139.8	175.3	-69.3	175.3	0	0	0	111.4	L286 Y308 V309 Q310	L286-L312 HydrophobicContact CD1-CD1 3.46Å; L286-L312 VanDerWaalsContact CD1-CD1 3.46Å; Y308-L312 HydrophobicContact CD1-CD1 4.37Å; Y308-L312 HydrophobicContact CE1-CD1 3.75Å; Y308-L312 HydrophobicContact CE1-CG 4.32Å; Y308-L312 PolarHBondContact O-N 2.8Å; V309-L312 PolarHBondContact O-N 2.83Å; Q310-L312 VanDerWaalsContact C-N 3.32Å
313	P	86.9	Confident	89.7	Confident	90 Å²	90	82.2 Å²	82.2	58%	0.584	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-62.9	142	175.9	27.6	-35	0	0	0	110.7	R315	P313-R315 PolarHBondContact O-N 2.67Å
314	S	88.7	Confident	90.3	Very high	111 Å²	111	78.7 Å²	78.7	78%	0.776	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-59.2	134.8	180	-172.2	0	0	0	0	112	T291	T291-S314 WeakPolarHBondContact OG1-CA 3.35Å
315	R	90.8	Very high	90.7	Very high	96 Å²	96	72.5 Å²	72.5	36%	0.362	41%	0.413	S	S	.	.			trans	-127	132.1	-177.9	-69.5	175.7	-178.3	-174.4	-0.9	110.7	L286 G290 T291 P313	L286-R315 WeakPolarHBondContact O-CD 3.49Å; G290-R315 CarbonylContact C-O 3.56Å; G290-R315 VanDerWaalsContact CA-O 3.24Å; G290-R315 WeakPolarHBondContact CA-O 3.44Å; T291-R315 PolarHBondContact N-O 2.84Å; T291-R315 PolarHBondContact OG1-N 2.7Å; P313-R315 PolarHBondContact O-N 2.67Å
316	T	91.8	Very high	91	Very high	125 Å²	125	80.4 Å²	80.4	77%	0.767	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-74	148.7	168.4	47	0	0	0	0	111
317	P	93.2	Very high	91.3	Very high	90 Å²	90	78.7 Å²	78.7	58%	0.584	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-61.7	143.5	173.3	-18.9	30	0	0	0	111.9	L289 P319	L289-P317 WeakPolarHBondContact O-CG 2.85Å; P317-P319 WeakPolarHBondContact O-CD 3.43Å
318	V	94.3	Very high	91.6	Very high	41 Å²	41	79.1 Å²	79.1	25%	0.248	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-87.7	119.5	174.1	178.6	0	0	0	0	109	S287 V288 L320 K322 L323	S287-V318 VanDerWaalsContact O-CG2 3.26Å; S287-V318 WeakPolarHBondContact O-CG2 3.28Å; V288-V318 PolarHBondContact O-N 3.27Å; V318-L320 PolarHBondContact O-N 3.12Å; V318-K322 HydrophobicContact CG1-CB 4.46Å; V318-K322 HydrophobicContact CG1-CD 4.28Å; V318-L323 HydrophobicContact CG1-CD2 4.28Å; V318-L323 HydrophobicContact CG1-CG 4.23Å
319	P	94.2	Very high	92	Very high	90 Å²	90	80.3 Å²	80.3	58%	0.584	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-58	127.2	178.1	-25.5	34.8	0	0	0	111.4	P317 A321 K322	P317-P319 WeakPolarHBondContact O-CD 3.43Å; P319-A321 PolarHBondContact O-N 2.76Å; P319-A321 VanDerWaalsContact O-N 3.11Å; P319-K322 VanDerWaalsContact O-CB 3.25Å; P319-K322 WeakPolarHBondContact O-CB 3.37Å; P319-K322 PolarHBondContact O-N 2.91Å
320	L	93.4	Very high	92.5	Very high	18 Å²	18	82 Å²	82	9%	0.094	48%	0.477	C	S	.	.	H	α-helix	trans	-59.6	-29	-174.6	-60.6	-179.1	0	0	0	112.9	V288 V318 K322 L323 Y324 L332 L335 Q336	V288-L320 HydrophobicContact CG1-CD2 4.16Å; V318-L320 PolarHBondContact O-N 3.12Å; L320-K322 PolarHBondContact O-N 3.35Å; L320-L323 HydrophobicContact CD2-CD1 4.32Å; L320-L323 PolarHBondContact O-N 2.94Å; L320-Y324 PolarHBondContact O-N 3.44Å; L320-L332 HydrophobicContact CB-CD2 4.03Å; L320-L335 HydrophobicContact CD1-CB 4.17Å; L320-L335 HydrophobicContact CD1-CD2 4.08Å; L320-L335 HydrophobicContact CD1-CG 3.94Å; L320-Q336 HydrophobicContact CD1-CB 3.86Å
321	A	94.7	Very high	92.9	Very high	55 Å²	55	76.2 Å²	76.2	46%	0.455	45%	0.45	S	S	.	.	H	α-helix	trans	-59.2	-23.9	171.9	0	0	0	0	0	114.1	P319 Y324 P325 L332	P319-A321 PolarHBondContact O-N 2.76Å; P319-A321 VanDerWaalsContact O-N 3.11Å; A321-Y324 CarbonylContact O-C 3.58Å; A321-P325 VanDerWaalsContact O-CA 3.23Å; A321-P325 WeakPolarHBondContact O-CA 3.41Å; A321-L332 HydrophobicContact CB-CD1 3.81Å
322	K	94.7	Very high	93.3	Very high	162 Å²	162	73.1 Å²	73.1	70%	0.704	43%	0.427	S	S	*	.	H	α-helix	trans	-77.5	-30	174	-171.9	-179.7	176.1	-175.9	0	112.3	V318 P319 L320	V318-K322 HydrophobicContact CG1-CB 4.46Å; V318-K322 HydrophobicContact CG1-CD 4.28Å; P319-K322 VanDerWaalsContact O-CB 3.25Å; P319-K322 WeakPolarHBondContact O-CB 3.37Å; P319-K322 PolarHBondContact O-N 2.91Å; L320-K322 PolarHBondContact O-N 3.35Å
323	L	93.3	Very high	93.7	Very high	70 Å²	70	75.7 Å²	75.7	37%	0.366	44%	0.441	S	S	.	.	H	α-helix	trans	-81.4	-36.6	175	-60.9	179.4	0	0	0	111.5	L272 V288 V318 L320 P325	L272-L323 HydrophobicContact CD1-CD1 4.43Å; V288-L323 HydrophobicContact CG1-CD1 3.64Å; V288-L323 HydrophobicContact CG2-CD1 4.07Å; V318-L323 HydrophobicContact CG1-CD2 4.28Å; V318-L323 HydrophobicContact CG1-CG 4.23Å; L320-L323 HydrophobicContact CD2-CD1 4.32Å; L320-L323 PolarHBondContact O-N 2.94Å; L323-P325 VanDerWaalsContact C-CD 3.42Å; L323-P325 WeakPolarHBondContact O-CD 3.2Å
324	Y	95.2	Very high	94.3	Very high	25 Å²	25	71.4 Å²	71.4	10%	0.098	41%	0.413	C	S	.	.			trans	-125.9	63.8	-174.6	-58.6	-73.2	0	0	0	111.8	A264 M267 L320 A321 Q326 A327 L332 L335	A264-Y324 HydrophobicContact CB-CE2 4.38Å; A264-Y324 WeakPolarHBondContact CB-OH 3.36Å; A264-Y324 WeakPolarHBondContact O-CE1 3.46Å; A264-Y324 PolarHBondContact O-OH 2.95Å; A264-Y324 VanDerWaalsContact O-OH 3.13Å; M267-Y324 HydrophobicContact CB-CD1 3.98Å; M267-Y324 HydrophobicContact CB-CE1 4.16Å; L320-Y324 PolarHBondContact O-N 3.44Å; A321-Y324 CarbonylContact O-C 3.58Å; Y324-Q326 PolarHBondContact O-N 3.14Å; Y324-A327 WeakPolarHBondContact O-CB 3.49Å; Y324-A327 PolarHBondContact O-N 3.41Å; Y324-L332 HydrophobicContact CD2-CD2 4.46Å; Y324-L335 HydrophobicContact CD2-CD2 4.35Å; Y324-L335 HydrophobicContact CE2-CD2 4.12Å
325	P	93.5	Very high	94.7	Very high	96 Å²	96	66.1 Å²	66.1	62%	0.623	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-3.4	-174.1	29.4	-37.6	0	0	0	114.9	A321 L323	A321-P325 VanDerWaalsContact O-CA 3.23Å; A321-P325 WeakPolarHBondContact O-CA 3.41Å; L323-P325 VanDerWaalsContact C-CD 3.42Å; L323-P325 WeakPolarHBondContact O-CD 3.2Å
326	Q	90.4	Very high	95	Very high	184 Å²	184	67 Å²	67	86%	0.86	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	4.7	176.9	-57.7	-62.1	-36.5	0	0	112.6	Y324	Y324-Q326 PolarHBondContact O-N 3.14Å
327	A	94.1	Very high	95.3	Very high	30 Å²	30	62.4 Å²	62.4	25%	0.248	36%	0.358	C	S	.	.	S	Bend	trans	-84.6	151.9	178.4	0	0	0	0	0	112.1	M267 Y324 L332	M267-A327 HydrophobicContact SD-CB 3.86Å; Y324-A327 WeakPolarHBondContact O-CB 3.49Å; Y324-A327 PolarHBondContact O-N 3.41Å; A327-L332 HydrophobicContact CB-CD2 3.82Å; A327-L332 HydrophobicContact CB-CG 4.06Å
328	E	94.7	Very high	95.5	Very high	73 Å²	73	58.1 Å²	58.1	34%	0.341	33%	0.331	S	S	.	.			trans	-66.9	143.4	173.2	-62.2	172.5	-170.2	0	0	110.6	R171 S330 A331 L332 Y357	R171-E328 IonicContact CZ-OE1 3.61Å; R171-E328 IonicContact CZ-OE2 2.68Å; R171-E328 IonicContact NH2-OE1 3.84Å; R171-E328 PolarHBondContact NH2-OE1 3.35Å; R171-E328 IonicContact NH2-OE2 2.68Å; R171-E328 PolarHBondContact NH2-OE2 3.4Å; E328-S330 VanDerWaalsContact C-N 3.26Å; E328-S330 PolarHBondContact O-N 2.9Å; E328-A331 HydrophobicContact CB-CB 4.19Å; E328-A331 WeakPolarHBondContact O-CA 3.18Å; E328-A331 VanDerWaalsContact O-CB 3.27Å; E328-A331 WeakPolarHBondContact O-CB 2.97Å; E328-A331 PolarHBondContact O-N 2.66Å; E328-L332 PolarHBondContact O-N 3.41Å; E328-L332 VanDerWaalsContact O-N 3.14Å; E328-Y357 WeakPolarHBondContact OE2-CE2 3.44Å
329	A	96.1	Very high	95.7	Very high	83 Å²	83	56.6 Å²	56.6	69%	0.686	32%	0.321	S	S	*	.	H	α-helix	trans	-56.8	-38.5	-179.5	0	0	0	0	0	113	A331 L332 D333	A329-A331 VanDerWaalsContact C-N 3.31Å; A329-A331 PolarHBondContact O-N 3.08Å; A329-L332 PolarHBondContact O-N 3.45Å; A329-D333 WeakPolarHBondContact O-CB 3.47Å; A329-D333 PolarHBondContact O-N 2.83Å
330	S	96.9	Very high	95.7	Very high	38 Å²	38	55.3 Å²	55.3	27%	0.266	31%	0.307	S	S	.	.	H	α-helix	trans	-69.3	-24.8	175.3	51	0	0	0	0	113.7	E328 L334 H355	E328-S330 VanDerWaalsContact C-N 3.26Å; E328-S330 PolarHBondContact O-N 2.9Å; S330-L334 PolarHBondContact O-N 3.19Å; S330-H355 VanDerWaalsContact CA-CE1 3.41Å; S330-H355 WeakPolarHBondContact CA-CE1 3.29Å; S330-H355 PolarHBondContact O-CE1 3.43Å
331	A	97	Very high	95.6	Very high	2 Å²	2	55.2 Å²	55.2	2%	0.017	31%	0.306	C	S	.	.	H	α-helix	trans	-71.7	-41.1	172	0	0	0	0	0	111.1	F263 M267 E328 A329 L335 Y357	F263-A331 VanDerWaalsContact CE1-O 3.25Å; F263-A331 WeakPolarHBondContact CE1-O 3.33Å; F263-A331 HydrophobicContact CE2-CB 4.42Å; F263-A331 HydrophobicContact CZ-CB 3.77Å; M267-A331 HydrophobicContact SD-CB 3.85Å; E328-A331 HydrophobicContact CB-CB 4.19Å; E328-A331 WeakPolarHBondContact O-CA 3.18Å; E328-A331 VanDerWaalsContact O-CB 3.27Å; E328-A331 WeakPolarHBondContact O-CB 2.97Å; E328-A331 PolarHBondContact O-N 2.66Å; A329-A331 VanDerWaalsContact C-N 3.31Å; A329-A331 PolarHBondContact O-N 3.08Å; A331-L335 WeakPolarHBondContact O-CB 3.31Å; A331-L335 PolarHBondContact O-N 2.88Å; A331-Y357 HydrophobicContact CB-CD2 3.83Å; A331-Y357 HydrophobicContact CB-CE2 3.59Å; A331-Y357 HydrophobicContact CB-CG 4.43Å
332	L	97.3	Very high	95.4	Very high	24 Å²	24	53.8 Å²	53.8	13%	0.126	29%	0.291	C	S	.	.	H	α-helix	trans	-66.9	-41	176.4	-61.3	177.2	0	0	0	112.1	L320 A321 Y324 A327 E328 A329 L335 Q336	L320-L332 HydrophobicContact CB-CD2 4.03Å; A321-L332 HydrophobicContact CB-CD1 3.81Å; Y324-L332 HydrophobicContact CD2-CD2 4.46Å; A327-L332 HydrophobicContact CB-CD2 3.82Å; A327-L332 HydrophobicContact CB-CG 4.06Å; E328-L332 PolarHBondContact O-N 3.41Å; E328-L332 VanDerWaalsContact O-N 3.14Å; A329-L332 PolarHBondContact O-N 3.45Å; L332-L335 PolarHBondContact O-N 3.38Å; L332-Q336 WeakPolarHBondContact O-CB 3.49Å; L332-Q336 PolarHBondContact O-N 3.16Å
333	D	97.8	Very high	95.3	Very high	86 Å²	86	46.5 Å²	46.5	46%	0.46	26%	0.26	S	S	.	.	H	α-helix	trans	-59	-51	176.1	-173.9	57.6	0	0	0	111.6	A329 L335 Q336 A337 H355	A329-D333 WeakPolarHBondContact O-CB 3.47Å; A329-D333 PolarHBondContact O-N 2.83Å; D333-L335 VanDerWaalsContact C-N 3.34Å; D333-L335 PolarHBondContact O-N 2.94Å; D333-Q336 PolarHBondContact O-N 3.49Å; D333-A337 PolarHBondContact O-N 3.11Å; D333-H355 IonicContact OD1-NE2 2.65Å; D333-H355 IonicContact OD2-CE1 3.38Å; D333-H355 PolarHBondContact OD2-CE1 3.11Å; D333-H355 IonicContact OD2-NE2 2.66Å; D333-H355 PolarHBondContact OD2-NE2 2.93Å
334	L	98.2	Very high	95.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.9	-39.1	175.1	-176.3	56.4	0	0	0	112.5	L174 F263 S330 A337 M338 I347 A352 H355 Y357	L174-L334 HydrophobicContact CD2-CD2 3.72Å; F263-L334 HydrophobicContact CE1-CB 4.17Å; F263-L334 HydrophobicContact CE1-CD2 4.26Å; F263-L334 HydrophobicContact CE1-CG 4.22Å; S330-L334 PolarHBondContact O-N 3.19Å; L334-A337 PolarHBondContact O-N 3Å; L334-M338 HydrophobicContact CD1-CE 3.84Å; L334-M338 HydrophobicContact CD2-CE 4.17Å; L334-M338 HydrophobicContact CG-CE 3.84Å; L334-M338 HydrophobicContact CG-SD 4.35Å; L334-M338 WeakPolarHBondContact O-CG 3.28Å; L334-M338 PolarHBondContact O-N 3.07Å; L334-M338 VanDerWaalsContact O-N 3.08Å; L334-I347 HydrophobicContact CD1-CD1 3.99Å; L334-A352 HydrophobicContact CD1-CB 4.11Å; L334-H355 HydrophobicContact CD1-CB 3.98Å; L334-H355 HydrophobicContact CD2-CB 4.42Å; L334-Y357 HydrophobicContact CD2-CD1 3.92Å
335	L	98.1	Very high	95.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65.6	-38.9	177.2	-178.3	61	0	0	0	111.8	G260 F263 A264 M267 L320 Y324 A331 L332 D333 A337 M338 L339	G260-L335 WeakPolarHBondContact O-CD1 3.44Å; F263-L335 HydrophobicContact CB-CD1 4.47Å; F263-L335 HydrophobicContact CD1-CB 4.02Å; F263-L335 HydrophobicContact CD1-CD1 4.03Å; F263-L335 HydrophobicContact CE1-CB 4Å; A264-L335 HydrophobicContact CB-CD1 4.05Å; A264-L335 HydrophobicContact CB-CD2 3.94Å; M267-L335 HydrophobicContact CE-CB 4.4Å; M267-L335 HydrophobicContact CE-CD2 3.67Å; L320-L335 HydrophobicContact CD1-CB 4.17Å; L320-L335 HydrophobicContact CD1-CD2 4.08Å; L320-L335 HydrophobicContact CD1-CG 3.94Å; Y324-L335 HydrophobicContact CD2-CD2 4.35Å; Y324-L335 HydrophobicContact CE2-CD2 4.12Å; A331-L335 WeakPolarHBondContact O-CB 3.31Å; A331-L335 PolarHBondContact O-N 2.88Å; L332-L335 PolarHBondContact O-N 3.38Å; D333-L335 VanDerWaalsContact C-N 3.34Å; D333-L335 PolarHBondContact O-N 2.94Å; L335-A337 VanDerWaalsContact C-N 3.33Å; L335-M338 PolarHBondContact O-N 2.69Å; L335-L339 HydrophobicContact CD1-CD1 3.67Å; L335-L339 HydrophobicContact CD1-CG 3.87Å; L335-L339 HydrophobicContact CD2-CD1 4.45Å; L335-L339 HydrophobicContact CG-CD1 3.92Å; L335-L339 HydrophobicContact CG-CG 4.37Å; L335-L339 WeakPolarHBondContact O-CB 3.37Å; L335-L339 PolarHBondContact O-N 3.21Å
336	Q	96.8	Very high	95.2	Very high	116 Å²	116	52.4 Å²	52.4	54%	0.542	27%	0.271	S	S	.	.	H	α-helix	trans	-65.6	-36.8	175	-173.9	168.7	-34.6	0	0	111.7	L320 L332 D333 M338 Q340	L320-Q336 HydrophobicContact CD1-CB 3.86Å; L332-Q336 WeakPolarHBondContact O-CB 3.49Å; L332-Q336 PolarHBondContact O-N 3.16Å; D333-Q336 PolarHBondContact O-N 3.49Å; Q336-M338 VanDerWaalsContact C-N 3.29Å; Q336-M338 PolarHBondContact O-N 2.85Å; Q336-Q340 PolarHBondContact O-NE2 2.78Å
337	A	97.6	Very high	95.5	Very high	27 Å²	27	44.9 Å²	44.9	22%	0.223	24%	0.236	C	C	.	.	H	α-helix	trans	-69.2	-25.4	175.1	0	0	0	0	0	113.2	D333 L334 L335 I347	D333-A337 PolarHBondContact O-N 3.11Å; L334-A337 PolarHBondContact O-N 3Å; L335-A337 VanDerWaalsContact C-N 3.33Å; A337-I347 HydrophobicContact CB-CB 3.88Å; A337-I347 HydrophobicContact CB-CD1 4.1Å; A337-I347 HydrophobicContact CB-CG2 3.88Å; A337-I347 WeakPolarHBondContact O-CG2 3.23Å; A337-I347 PolarHBondContact O-N 3.03Å
338	M	97.9	Very high	95.7	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-84.4	-36.3	174.1	-70.3	172.3	174	0	0	113.7	L174 L178 M256 V259 F263 L334 L335 Q336 Q340 R346 I347 A352	L174-M338 HydrophobicContact CD1-CE 4.38Å; L178-M338 HydrophobicContact CD1-CE 4.31Å; L178-M338 HydrophobicContact CD2-CE 4.02Å; M256-M338 HydrophobicContact CE-CE 3.98Å; M256-M338 HydrophobicContact CE-CG 4.43Å; V259-M338 HydrophobicContact CG1-CE 3.79Å; V259-M338 HydrophobicContact CG1-SD 3.9Å; F263-M338 HydrophobicContact CD1-SD 4.18Å; L334-M338 HydrophobicContact CD1-CE 3.84Å; L334-M338 HydrophobicContact CD2-CE 4.17Å; L334-M338 HydrophobicContact CG-CE 3.84Å; L334-M338 HydrophobicContact CG-SD 4.35Å; L334-M338 WeakPolarHBondContact O-CG 3.28Å; L334-M338 PolarHBondContact O-N 3.07Å; L334-M338 VanDerWaalsContact O-N 3.08Å; L335-M338 PolarHBondContact O-N 2.69Å; Q336-M338 VanDerWaalsContact C-N 3.29Å; Q336-M338 PolarHBondContact O-N 2.85Å; M338-Q340 VanDerWaalsContact C-N 3.33Å; M338-Q340 PolarHBondContact O-N 2.83Å; M338-R346 WeakPolarHBondContact O-CD 3.49Å; M338-R346 WeakPolarHBondContact O-CG 3.08Å; M338-I347 HydrophobicContact CG-CG2 3.77Å; M338-A352 HydrophobicContact CE-CB 4.08Å
339	L	97.1	Very high	95.8	Very high	9 Å²	9	42.6 Å²	42.6	5%	0.047	23%	0.226	C	C	.	.	S	Bend	trans	-92.8	57.7	-176.2	-64.7	-177.6	0	0	0	112.4	W257 L272 L289 L335	W257-L339 HydrophobicContact CD2-CD2 4Å; W257-L339 HydrophobicContact CE3-CD2 3.81Å; W257-L339 HydrophobicContact CH2-CD2 4.12Å; W257-L339 HydrophobicContact CZ2-CD2 4.31Å; W257-L339 HydrophobicContact CZ3-CB 4.14Å; W257-L339 HydrophobicContact CZ3-CD2 3.88Å; L272-L339 HydrophobicContact CD2-CD1 3.52Å; L289-L339 WeakPolarHBondContact CD2-O 3.38Å; L335-L339 HydrophobicContact CD1-CD1 3.67Å; L335-L339 HydrophobicContact CD1-CG 3.87Å; L335-L339 HydrophobicContact CD2-CD1 4.45Å; L335-L339 HydrophobicContact CG-CD1 3.92Å; L335-L339 HydrophobicContact CG-CG 4.37Å; L335-L339 WeakPolarHBondContact O-CB 3.37Å; L335-L339 PolarHBondContact O-N 3.21Å
340	Q	95.1	Very high	95.9	Very high	64 Å²	64	42.5 Å²	42.5	30%	0.299	22%	0.217	S	C	.	.			trans	-98.6	140.5	173.1	-67.4	-57.6	-32.5	0	0	112.3	Q336 M338 E345 R346	Q336-Q340 PolarHBondContact O-NE2 2.78Å; M338-Q340 VanDerWaalsContact C-N 3.33Å; M338-Q340 PolarHBondContact O-N 2.83Å; Q340-E345 HydrophobicContact CB-CB 4.4Å; Q340-E345 HydrophobicContact CG-CB 4.42Å; Q340-R346 HydrophobicContact CB-CB 4.24Å; Q340-R346 HydrophobicContact CB-CG 4.48Å; Q340-R346 PolarHBondContact O-NE 3.48Å; Q340-R346 PolarHBondContact O-NH2 3.44Å
341	F	91.8	Very high	95.9	Very high	15 Å²	15	45.9 Å²	45.9	7%	0.066	23%	0.229	C	C	.	.	S	Bend	trans	-65.9	-46.2	176	-87.1	-59	0	0	0	112.4	P241 I285 L286 L289 G290 P292 L296	P241-F341 HydrophobicContact CB-CD1 3.96Å; P241-F341 HydrophobicContact CG-CD1 4.02Å; I285-F341 HydrophobicContact CG2-CE1 3.64Å; I285-F341 HydrophobicContact CG2-CZ 4.09Å; L286-F341 HydrophobicContact CD2-CE1 4.46Å; L286-F341 HydrophobicContact CD2-CZ 3.94Å; L289-F341 HydrophobicContact CB-CD2 4.05Å; L289-F341 HydrophobicContact CB-CE1 4.43Å; L289-F341 HydrophobicContact CB-CE2 3.35Å; L289-F341 HydrophobicContact CB-CZ 3.55Å; L289-F341 HydrophobicContact CD2-CD1 4.1Å; L289-F341 HydrophobicContact CD2-CD2 3.91Å; L289-F341 HydrophobicContact CD2-CE1 4.1Å; L289-F341 HydrophobicContact CD2-CE2 3.93Å; L289-F341 HydrophobicContact CD2-CG 3.99Å; L289-F341 HydrophobicContact CD2-CZ 4Å; L289-F341 HydrophobicContact CG-CE2 4.3Å; L289-F341 HydrophobicContact CG-CZ 4.43Å; G290-F341 WeakPolarHBondContact O-CZ 3.28Å; P292-F341 HydrophobicContact CB-CD2 4.14Å; P292-F341 HydrophobicContact CB-CE2 4.18Å; P292-F341 HydrophobicContact CB-CG 4.34Å; P292-F341 HydrophobicContact CB-CZ 4.45Å; P292-F341 HydrophobicContact CG-CE1 4.18Å; P292-F341 HydrophobicContact CG-CE2 4.17Å; P292-F341 HydrophobicContact CG-CZ 4Å; L296-F341 HydrophobicContact CD2-CB 3.75Å; L296-F341 HydrophobicContact CD2-CG 4.36Å
342	D	90.4	Very high	96	Very high	26 Å²	26	45.8 Å²	45.8	14%	0.139	23%	0.228	C	C	.	.	S	Bend	trans	-79.9	124.3	176.5	-165.1	-46.6	0	0	0	109.3	L296 R344 E345	L296-D342 HydrophobicContact CD1-CB 4.37Å; D342-R344 PolarHBondContact O-N 2.84Å; D342-R344 VanDerWaalsContact O-N 3.16Å; D342-R344 WeakPolarHBondContact OD1-CB 3.32Å; D342-R344 VanDerWaalsContact OD1-CG 3.3Å; D342-R344 WeakPolarHBondContact OD1-CG 3.25Å; D342-R344 IonicContact OD1-CZ 2.84Å; D342-R344 PolarHBondContact OD1-N 2.82Å; D342-R344 IonicContact OD1-NE 2.67Å; D342-R344 PolarHBondContact OD1-NE 2.87Å; D342-R344 IonicContact OD1-NH2 3.07Å; D342-R344 IonicContact OD2-CZ 3.19Å; D342-R344 IonicContact OD2-NE 2.85Å; D342-R344 PolarHBondContact OD2-NE 2.86Å; D342-R344 IonicContact OD2-NH2 2.69Å; D342-R344 PolarHBondContact OD2-NH2 2.83Å; D342-E345 HydrophobicContact CB-CB 4.37Å; D342-E345 HydrophobicContact CB-CG 3.99Å; D342-E345 PolarHBondContact O-N 2.73Å
343	P	91.4	Very high	96	Very high	9 Å²	9	44.7 Å²	44.7	6%	0.058	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-10.1	178.7	27.2	-34.6	0	0	0	113.8	E242 H249 A253	E242-P343 HydrophobicContact CB-CG 4.36Å; E242-P343 HydrophobicContact CG-CG 4.46Å; H249-P343 HydrophobicContact CB-CG 4.1Å; A253-P343 HydrophobicContact CB-CB 3.84Å; A253-P343 VanDerWaalsContact CB-O 3.22Å; A253-P343 WeakPolarHBondContact CB-O 3.41Å
344	R	90.9	Very high	96	Very high	166 Å²	166	43.5 Å²	43.5	63%	0.626	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-31.8	177.2	-57.1	171.7	-67.7	175.9	5.5	112.9	D342 R346	D342-R344 PolarHBondContact O-N 2.84Å; D342-R344 VanDerWaalsContact O-N 3.16Å; D342-R344 WeakPolarHBondContact OD1-CB 3.32Å; D342-R344 VanDerWaalsContact OD1-CG 3.3Å; D342-R344 WeakPolarHBondContact OD1-CG 3.25Å; D342-R344 IonicContact OD1-CZ 2.84Å; D342-R344 PolarHBondContact OD1-N 2.82Å; D342-R344 IonicContact OD1-NE 2.67Å; D342-R344 PolarHBondContact OD1-NE 2.87Å; D342-R344 IonicContact OD1-NH2 3.07Å; D342-R344 IonicContact OD2-CZ 3.19Å; D342-R344 IonicContact OD2-NE 2.85Å; D342-R344 PolarHBondContact OD2-NE 2.86Å; D342-R344 IonicContact OD2-NH2 2.69Å; D342-R344 PolarHBondContact OD2-NH2 2.83Å; R344-R346 VanDerWaalsContact C-N 3.25Å
345	E	93.2	Very high	96	Very high	137 Å²	137	44.5 Å²	44.5	64%	0.64	23%	0.229	S	C	*	.	S	Bend	trans	-83.2	-3.9	176.4	-57.1	-58.8	130	0	0	112.4	Q340 D342	Q340-E345 HydrophobicContact CB-CB 4.4Å; Q340-E345 HydrophobicContact CG-CB 4.42Å; D342-E345 HydrophobicContact CB-CB 4.37Å; D342-E345 HydrophobicContact CB-CG 3.99Å; D342-E345 PolarHBondContact O-N 2.73Å
346	R	96.3	Very high	96	Very high	12 Å²	12	48.7 Å²	48.7	5%	0.045	26%	0.256	C	S	.	.	S	Bend	trans	-84.8	127.1	-176.3	-160.3	177.6	-59.6	143.4	5.8	110.6	E242 A253 M256 M338 Q340 R344 S348	E242-R346 IonicContact OE1-CZ 2.75Å; E242-R346 IonicContact OE1-NH1 3.96Å; E242-R346 PolarHBondContact OE1-NH1 3.04Å; E242-R346 IonicContact OE1-NH2 3.53Å; E242-R346 IonicContact OE2-CZ 3.25Å; E242-R346 IonicContact OE2-NH1 3.56Å; E242-R346 PolarHBondContact OE2-NH1 3.4Å; E242-R346 IonicContact OE2-NH2 3.6Å; E242-R346 PolarHBondContact OE2-NH2 3.11Å; A253-R346 VanDerWaalsContact C-NH1 3.29Å; A253-R346 HydrophobicContact CB-CB 4.37Å; A253-R346 WeakPolarHBondContact O-CD 3.38Å; A253-R346 PolarHBondContact O-NH1 3.34Å; M256-R346 HydrophobicContact CB-CG 4.34Å; M338-R346 WeakPolarHBondContact O-CD 3.49Å; M338-R346 WeakPolarHBondContact O-CG 3.08Å; Q340-R346 HydrophobicContact CB-CB 4.24Å; Q340-R346 HydrophobicContact CB-CG 4.48Å; Q340-R346 PolarHBondContact O-NE 3.48Å; Q340-R346 PolarHBondContact O-NH2 3.44Å; R344-R346 VanDerWaalsContact C-N 3.25Å; R346-S348 PolarHBondContact O-N 2.94Å
347	I	97.9	Very high	96	Very high	25 Å²	25	43.5 Å²	43.5	13%	0.128	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-53.9	133.6	-176.8	-165.8	170.5	0	0	0	112.2	M256 L334 A337 M338 E351 A352	M256-I347 HydrophobicContact CE-CG2 4.14Å; M256-I347 WeakPolarHBondContact CE-O 3.37Å; L334-I347 HydrophobicContact CD1-CD1 3.99Å; A337-I347 HydrophobicContact CB-CB 3.88Å; A337-I347 HydrophobicContact CB-CD1 4.1Å; A337-I347 HydrophobicContact CB-CG2 3.88Å; A337-I347 WeakPolarHBondContact O-CG2 3.23Å; A337-I347 PolarHBondContact O-N 3.03Å; M338-I347 HydrophobicContact CG-CG2 3.77Å; I347-E351 HydrophobicContact CD1-CB 3.98Å; I347-E351 HydrophobicContact CG1-CB 3.55Å; I347-A352 HydrophobicContact CD1-CB 4.26Å; I347-A352 HydrophobicContact CG1-CB 4.39Å; I347-A352 HydrophobicContact CG2-CB 4.39Å
348	S	97.3	Very high	96	Very high	46 Å²	46	42.2 Å²	42.2	32%	0.322	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-73.3	159.4	175.4	75.5	0	0	0	0	111.6	R346 T350 E351 A352	R346-S348 PolarHBondContact O-N 2.94Å; S348-T350 PolarHBondContact O-N 3.24Å; S348-E351 WeakPolarHBondContact CB-OE2 3.32Å; S348-E351 PolarHBondContact N-OE2 3.3Å; S348-E351 PolarHBondContact O-N 3.14Å; S348-E351 VanDerWaalsContact OG-CD 3.27Å; S348-E351 WeakPolarHBondContact OG-CG 3.32Å; S348-E351 PolarHBondContact OG-N 3.33Å; S348-E351 PolarHBondContact OG-OE2 3.01Å; S348-A352 WeakPolarHBondContact O-CB 3.48Å; S348-A352 PolarHBondContact O-N 2.93Å
349	V	97.7	Very high	95.9	Very high	9 Å²	9	45.7 Å²	45.7	6%	0.055	25%	0.245	C	C	.	.	H	α-helix	trans	-59.6	-28.3	177.1	68.8	0	0	0	0	113.3	L178 L181 K182 H185 M256 L353	L178-V349 HydrophobicContact CB-CG2 4.34Å; L178-V349 HydrophobicContact CD2-CG2 4.02Å; L178-V349 VanDerWaalsContact O-CG2 3.23Å; L178-V349 WeakPolarHBondContact O-CG2 3.45Å; L181-V349 HydrophobicContact CB-CG2 3.93Å; L181-V349 HydrophobicContact CD2-CG2 4.35Å; L181-V349 HydrophobicContact CG-CG2 4.19Å; K182-V349 HydrophobicContact CB-CG1 4.29Å; K182-V349 HydrophobicContact CB-CG2 4.13Å; H185-V349 HydrophobicContact CB-CG1 4.15Å; M256-V349 HydrophobicContact CE-CB 4.47Å; M256-V349 HydrophobicContact SD-CB 3.77Å; M256-V349 HydrophobicContact SD-CG2 4.24Å; V349-L353 WeakPolarHBondContact O-CG 3.49Å; V349-L353 PolarHBondContact O-N 3.43Å
350	T	96.9	Very high	95.9	Very high	81 Å²	81	50.9 Å²	50.9	50%	0.497	27%	0.267	S	S	.	.	H	α-helix	trans	-74.2	-43.1	177.5	-58.1	0	0	0	0	111.6	S348 L353 A354	S348-T350 PolarHBondContact O-N 3.24Å; T350-L353 PolarHBondContact O-N 2.86Å; T350-A354 PolarHBondContact O-N 2.89Å
351	E	97.6	Very high	95.9	Very high	110 Å²	110	50.6 Å²	50.6	51%	0.514	26%	0.264	S	S	.	.	H	α-helix	trans	-70.1	-37.2	176.7	-67.2	155.4	140.3	0	0	111.1	I347 S348 L353 A354 H355	I347-E351 HydrophobicContact CD1-CB 3.98Å; I347-E351 HydrophobicContact CG1-CB 3.55Å; S348-E351 WeakPolarHBondContact CB-OE2 3.32Å; S348-E351 PolarHBondContact N-OE2 3.3Å; S348-E351 PolarHBondContact O-N 3.14Å; S348-E351 VanDerWaalsContact OG-CD 3.27Å; S348-E351 WeakPolarHBondContact OG-CG 3.32Å; S348-E351 PolarHBondContact OG-N 3.33Å; S348-E351 PolarHBondContact OG-OE2 3.01Å; E351-L353 VanDerWaalsContact C-N 3.26Å; E351-L353 PolarHBondContact O-N 3.03Å; E351-A354 CarbonylContact O-C 3.44Å; E351-A354 PolarHBondContact O-N 3.09Å; E351-A354 VanDerWaalsContact O-N 3.11Å; E351-H355 PolarHBondContact O-N 3.15Å; E351-H355 VanDerWaalsContact O-N 3.07Å
352	A	98.2	Very high	96.2	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.5	-30.4	174.1	0	0	0	0	0	112.9	L178 M256 L334 M338 I347 S348 H355 V358	L178-A352 HydrophobicContact CD1-CB 3.92Å; L178-A352 HydrophobicContact CD2-CB 3.86Å; M256-A352 HydrophobicContact CE-CB 3.75Å; L334-A352 HydrophobicContact CD1-CB 4.11Å; M338-A352 HydrophobicContact CE-CB 4.08Å; I347-A352 HydrophobicContact CD1-CB 4.26Å; I347-A352 HydrophobicContact CG1-CB 4.39Å; I347-A352 HydrophobicContact CG2-CB 4.39Å; S348-A352 WeakPolarHBondContact O-CB 3.48Å; S348-A352 PolarHBondContact O-N 2.93Å; A352-H355 WeakPolarHBondContact O-CB 3.4Å; A352-V358 WeakPolarHBondContact O-CG2 3.39Å
353	L	97.9	Very high	96.4	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-75.9	-32.6	172	-77.4	166.1	0	0	0	113.1	Y175 L178 K182 V349 T350 E351 H355 V358 H362	Y175-L353 HydrophobicContact CD2-CD2 3.73Å; Y175-L353 HydrophobicContact CE2-CD2 3.84Å; L178-L353 HydrophobicContact CB-CD1 4.46Å; L178-L353 HydrophobicContact CB-CD2 3.65Å; L178-L353 HydrophobicContact CB-CG 3.85Å; K182-L353 HydrophobicContact CB-CD1 3.91Å; K182-L353 HydrophobicContact CD-CD1 3.65Å; K182-L353 HydrophobicContact CG-CD1 4.1Å; V349-L353 WeakPolarHBondContact O-CG 3.49Å; V349-L353 PolarHBondContact O-N 3.43Å; T350-L353 PolarHBondContact O-N 2.86Å; E351-L353 VanDerWaalsContact C-N 3.26Å; E351-L353 PolarHBondContact O-N 3.03Å; L353-H355 PolarHBondContact O-N 3.28Å; L353-V358 WeakPolarHBondContact O-CG2 3.43Å; L353-H362 VanDerWaalsContact O-CG 3.24Å; L353-H362 PolarHBondContact O-ND1 3.11Å
354	A	97.6	Very high	96.6	Very high	60 Å²	60	58.1 Å²	58.1	50%	0.496	31%	0.307	S	S	.	.	H	α-helix	trans	-75	-8.5	172.7	0	0	0	0	0	113.4	T350 E351	T350-A354 PolarHBondContact O-N 2.89Å; E351-A354 CarbonylContact O-C 3.44Å; E351-A354 PolarHBondContact O-N 3.09Å; E351-A354 VanDerWaalsContact O-N 3.11Å
355	H	98.3	Very high	96.7	Very high	22 Å²	22	54.5 Å²	54.5	10%	0.102	30%	0.3	C	S	.	.	S	Bend	trans	-67.3	139.6	-172	-168.2	-85.7	0	0	0	113.1	S330 D333 L334 E351 A352 L353 Y357 V358 S359	S330-H355 VanDerWaalsContact CA-CE1 3.41Å; S330-H355 WeakPolarHBondContact CA-CE1 3.29Å; S330-H355 PolarHBondContact O-CE1 3.43Å; D333-H355 IonicContact OD1-NE2 2.65Å; D333-H355 IonicContact OD2-CE1 3.38Å; D333-H355 PolarHBondContact OD2-CE1 3.11Å; D333-H355 IonicContact OD2-NE2 2.66Å; D333-H355 PolarHBondContact OD2-NE2 2.93Å; L334-H355 HydrophobicContact CD1-CB 3.98Å; L334-H355 HydrophobicContact CD2-CB 4.42Å; E351-H355 PolarHBondContact O-N 3.15Å; E351-H355 VanDerWaalsContact O-N 3.07Å; A352-H355 WeakPolarHBondContact O-CB 3.4Å; L353-H355 PolarHBondContact O-N 3.28Å; H355-Y357 PolarHBondContact ND1-N 2.94Å; H355-Y357 VanDerWaalsContact ND1-N 3.11Å; H355-Y357 PolarHBondContact O-N 3.5Å; H355-V358 PolarHBondContact O-N 3.46Å; H355-S359 PolarHBondContact O-N 3.48Å; H355-S359 VanDerWaalsContact O-N 3.13Å
356	P	97.7	Very high	96.8	Very high	88 Å²	88	49.4 Å²	49.4	57%	0.571	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	-32	179.1	-32.5	36.9	0	0	0	115.8	V358 S359	P356-V358 PolarHBondContact O-N 3.4Å; P356-S359 WeakPolarHBondContact O-CB 3.3Å; P356-S359 PolarHBondContact O-OG 3.42Å
357	Y	98	Very high	96.8	Very high	7 Å²	7	49 Å²	49	3%	0.027	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-38	179	-179.2	-114.1	0	0	0	113.8	P167 R171 L174 F263 E328 A331 L334 H355	P167-Y357 PolarHBondContact O-OH 3.38Å; R171-Y357 HydrophobicContact CB-CE1 4.09Å; R171-Y357 HydrophobicContact CB-CE2 4.45Å; R171-Y357 WeakPolarHBondContact CD-O 3.37Å; R171-Y357 HydrophobicContact CG-CD1 4.47Å; R171-Y357 HydrophobicContact CG-CE1 4.11Å; R171-Y357 WeakPolarHBondContact CG-O 3.43Å; R171-Y357 PolarHBondContact N-OH 3.03Å; R171-Y357 PolarHBondContact NE-O 2.92Å; L174-Y357 HydrophobicContact CD2-CD1 3.99Å; L174-Y357 HydrophobicContact CD2-CE1 3.83Å; F263-Y357 HydrophobicContact CE1-CE1 4.48Å; F263-Y357 HydrophobicContact CE2-CD1 4.48Å; F263-Y357 AromaticContact CE2-CE1 3.63Å; F263-Y357 HydrophobicContact CE2-CE1 3.63Å; F263-Y357 AromaticContact CE2-CZ 3.95Å; F263-Y357 AromaticContact CZ-CD1 3.87Å; F263-Y357 HydrophobicContact CZ-CD1 3.87Å; F263-Y357 AromaticContact CZ-CE1 3.44Å; F263-Y357 HydrophobicContact CZ-CE1 3.44Å; F263-Y357 VanDerWaalsContact CZ-CE1 3.44Å; F263-Y357 AromaticContact CZ-CZ 3.93Å; E328-Y357 WeakPolarHBondContact OE2-CE2 3.44Å; A331-Y357 HydrophobicContact CB-CD2 3.83Å; A331-Y357 HydrophobicContact CB-CE2 3.59Å; A331-Y357 HydrophobicContact CB-CG 4.43Å; L334-Y357 HydrophobicContact CD2-CD1 3.92Å; H355-Y357 PolarHBondContact ND1-N 2.94Å; H355-Y357 VanDerWaalsContact ND1-N 3.11Å; H355-Y357 PolarHBondContact O-N 3.5Å
358	V	97.1	Very high	96.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-3.1	-179.2	-62.9	0	0	0	0	113.8	R171 L174 A352 L353 H355 P356 K360 Y361 H362	R171-V358 HydrophobicContact CG-CG1 4.45Å; L174-V358 HydrophobicContact CD2-CG1 4.4Å; A352-V358 WeakPolarHBondContact O-CG2 3.39Å; L353-V358 WeakPolarHBondContact O-CG2 3.43Å; H355-V358 PolarHBondContact O-N 3.46Å; P356-V358 PolarHBondContact O-N 3.4Å; V358-K360 PolarHBondContact O-N 2.66Å; V358-Y361 PolarHBondContact O-N 3.12Å; V358-H362 PolarHBondContact O-N 3.18Å
359	S	96	Very high	96.7	Very high	72 Å²	72	51.4 Å²	51.4	50%	0.503	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.8	-29.7	178.6	64	0	0	0	0	116	H355 P356 Y361	H355-S359 PolarHBondContact O-N 3.48Å; H355-S359 VanDerWaalsContact O-N 3.13Å; P356-S359 WeakPolarHBondContact O-CB 3.3Å; P356-S359 PolarHBondContact O-OG 3.42Å; S359-Y361 PolarHBondContact O-N 3.16Å
360	K	96.3	Very high	96.6	Very high	118 Å²	118	51.3 Å²	51.3	51%	0.513	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-29.8	173.8	-177.1	-173.5	171.4	-157.4	0	113.8	E168 V358	E168-K360 IonicContact OE1-NZ 2.7Å; E168-K360 PolarHBondContact OE1-NZ 3.47Å; E168-K360 IonicContact OE2-NZ 2.62Å; E168-K360 PolarHBondContact OE2-NZ 3Å; V358-K360 PolarHBondContact O-N 2.66Å
361	Y	96.5	Very high	96.3	Very high	59 Å²	59	53.3 Å²	53.3	23%	0.231	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-17.5	-174.9	-66	-73.4	0	0	0	113.6	E168 R171 Y172 Y175 V358 S359 D363	E168-Y361 PolarHBondContact OE1-OH 3.37Å; R171-Y361 HydrophobicContact CG-CD2 4.15Å; R171-Y361 HydrophobicContact CG-CE2 4.07Å; Y172-Y361 AromaticContact CD2-CD1 3.75Å; Y172-Y361 HydrophobicContact CD2-CD1 3.75Å; Y172-Y361 HydrophobicContact CD2-CD2 4.42Å; Y172-Y361 AromaticContact CD2-CE1 3.46Å; Y172-Y361 HydrophobicContact CD2-CE1 3.46Å; Y172-Y361 VanDerWaalsContact CD2-CE1 3.46Å; Y172-Y361 HydrophobicContact CD2-CE2 4.18Å; Y172-Y361 HydrophobicContact CD2-CG 4.23Å; Y172-Y361 AromaticContact CD2-CZ 3.71Å; Y172-Y361 HydrophobicContact CE2-CD1 4.07Å; Y172-Y361 AromaticContact CE2-CE1 3.92Å; Y172-Y361 HydrophobicContact CE2-CE1 3.92Å; Y172-Y361 HydrophobicContact CG-CE1 4.31Å; Y175-Y361 HydrophobicContact CD1-CG 4.18Å; Y175-Y361 WeakPolarHBondContact CE2-O 3.21Å; Y175-Y361 VanDerWaalsContact CG-CB 3.46Å; Y175-Y361 HydrophobicContact CG-CG 4.22Å; Y175-Y361 PolarHBondContact OH-O 3.09Å; V358-Y361 PolarHBondContact O-N 3.12Å; S359-Y361 PolarHBondContact O-N 3.16Å; Y361-D363 PolarHBondContact O-N 2.72Å
362	H	96.6	Very high	96.1	Very high	66 Å²	66	52.3 Å²	52.3	31%	0.306	31%	0.305	S	S	.	.			trans	-56.7	121.9	-179.5	-175.8	43.4	0	0	0	112.2	L353 V358 E367	L353-H362 VanDerWaalsContact O-CG 3.24Å; L353-H362 PolarHBondContact O-ND1 3.11Å; V358-H362 PolarHBondContact O-N 3.18Å; H362-E367 WeakPolarHBondContact CA-OE1 3.36Å; H362-E367 IonicContact CE1-OE1 3.91Å; H362-E367 IonicContact CE1-OE2 3.35Å; H362-E367 IonicContact CG-OE1 3.65Å; H362-E367 IonicContact ND1-OE1 3.51Å; H362-E367 PolarHBondContact ND1-OE1 3.07Å; H362-E367 IonicContact ND1-OE2 3.86Å; H362-E367 PolarHBondContact ND1-OE2 2.57Å
363	D	95.8	Very high	95.8	Very high	51 Å²	51	54.7 Å²	54.7	27%	0.273	33%	0.325	S	S	.	.			trans	-143.5	91.5	177.5	-178.1	-0.4	0	0	0	108.6	Y361 D365 D366 E367 R671	Y361-D363 PolarHBondContact O-N 2.72Å; D363-D365 PolarHBondContact O-N 2.99Å; D363-D365 WeakPolarHBondContact OD1-CB 3.37Å; D363-D365 PolarHBondContact OD1-N 3.15Å; D363-D366 HydrophobicContact CB-CB 4.1Å; D363-D366 CarbonylContact O-C 3.53Å; D363-D366 PolarHBondContact O-N 2.97Å; D363-D366 WeakPolarHBondContact OD2-CB 3.44Å; D363-E367 PolarHBondContact N-OE1 3.39Å; D363-E367 WeakPolarHBondContact O-CG 3.43Å; D363-E367 PolarHBondContact O-N 3.35Å; D363-E367 VanDerWaalsContact O-N 3.12Å; D363-R671 IonicContact OD2-NH2 3.9Å; D363-R671 PolarHBondContact OD2-NH2 3Å
364	P	94.3	Very high	95.6	Very high	91 Å²	91	55.8 Å²	55.8	59%	0.591	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-22.7	-179	-28.7	35	0	0	0	115	D366	P364-D366 VanDerWaalsContact C-N 3.33Å
365	D	93.8	Very high	95.2	Very high	89 Å²	89	57.9 Å²	57.9	48%	0.476	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-16.2	179.5	-138.5	22	0	0	0	112.1	D363 K667	D363-D365 PolarHBondContact O-N 2.99Å; D363-D365 WeakPolarHBondContact OD1-CB 3.37Å; D363-D365 PolarHBondContact OD1-N 3.15Å; D365-K667 IonicContact OD2-NZ 2.84Å; D365-K667 PolarHBondContact OD2-NZ 3.46Å
366	D	95.1	Very high	94.7	Very high	30 Å²	30	57.9 Å²	57.9	16%	0.16	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	5.5	-178.6	-168.1	49.1	0	0	0	113.9	R179 D363 P364 P368 R671	R179-D366 VanDerWaalsContact CZ-O 3.25Å; R179-D366 PolarHBondContact NE-O 2.83Å; R179-D366 PolarHBondContact NH2-O 3.42Å; R179-D366 IonicContact NH2-OD1 2.7Å; R179-D366 IonicContact NH2-OD2 3.63Å; D363-D366 HydrophobicContact CB-CB 4.1Å; D363-D366 CarbonylContact O-C 3.53Å; D363-D366 PolarHBondContact O-N 2.97Å; D363-D366 WeakPolarHBondContact OD2-CB 3.44Å; P364-D366 VanDerWaalsContact C-N 3.33Å; D366-P368 VanDerWaalsContact C-CD 3.43Å; D366-P368 WeakPolarHBondContact O-CD 3.25Å; D366-R671 IonicContact OD1-CZ 2.73Å; D366-R671 IonicContact OD1-NH1 3.83Å; D366-R671 PolarHBondContact OD1-NH1 3.3Å; D366-R671 IonicContact OD2-CZ 2.69Å; D366-R671 IonicContact OD2-NH1 2.79Å; D366-R671 PolarHBondContact OD2-NH1 3.29Å; D366-R671 IonicContact OD2-NH2 3.76Å
367	E	96.3	Very high	94.2	Very high	5 Å²	5	58.6 Å²	58.6	2%	0.023	33%	0.328	C	S	.	.	S	Bend	trans	-109.3	74.8	174.6	-67.5	167.3	-164.9	0	0	111.1	R179 K182 H362 D363	R179-E367 HydrophobicContact CG-CG 4.15Å; K182-E367 HydrophobicContact CD-CB 3.94Å; K182-E367 PolarHBondContact NZ-O 2.99Å; K182-E367 IonicContact NZ-OE2 2.68Å; K182-E367 PolarHBondContact NZ-OE2 3.47Å; H362-E367 WeakPolarHBondContact CA-OE1 3.36Å; H362-E367 IonicContact CE1-OE1 3.91Å; H362-E367 IonicContact CE1-OE2 3.35Å; H362-E367 IonicContact CG-OE1 3.65Å; H362-E367 IonicContact ND1-OE1 3.51Å; H362-E367 PolarHBondContact ND1-OE1 3.07Å; H362-E367 IonicContact ND1-OE2 3.86Å; H362-E367 PolarHBondContact ND1-OE2 2.57Å; D363-E367 PolarHBondContact N-OE1 3.39Å; D363-E367 WeakPolarHBondContact O-CG 3.43Å; D363-E367 PolarHBondContact O-N 3.35Å; D363-E367 VanDerWaalsContact O-N 3.12Å
368	P	96.1	Very high	93.6	Very high	39 Å²	39	59.7 Å²	59.7	25%	0.253	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-70.5	153	-172.4	31.3	-37.8	0	0	0	112.8	Y183 D366	Y183-P368 HydrophobicContact CD2-CG 4.21Å; D366-P368 VanDerWaalsContact C-CD 3.43Å; D366-P368 WeakPolarHBondContact O-CD 3.25Å
369	T	96.4	Very high	93	Very high	82 Å²	82	60 Å²	60	50%	0.503	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-88.8	160.3	162.1	50	0	0	0	0	111.1	S186	S186-T369 VanDerWaalsContact OG-CA 3.29Å; S186-T369 WeakPolarHBondContact OG-CA 3.19Å; S186-T369 WeakPolarHBondContact OG-CB 3.45Å
370	C	95.8	Very high	92.3	Very high	6 Å²	6	60.1 Å²	60.1	4%	0.041	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-87.1	131.7	171.5	-167.4	0	0	0	0	110.1	Y183 S186 A187	Y183-C370 HydrophobicContact CD1-CB 3.97Å; Y183-C370 HydrophobicContact CD2-CB 4.06Å; Y183-C370 HydrophobicContact CE1-CB 3.74Å; Y183-C370 HydrophobicContact CE2-CB 3.83Å; Y183-C370 HydrophobicContact CG-CB 4.14Å; Y183-C370 VanDerWaalsContact O-CB 3.26Å; Y183-C370 WeakPolarHBondContact O-CB 3.49Å; S186-C370 PolarHBondContact OG-N 3.29Å; A187-C370 HydrophobicContact CB-CB 3.78Å
371	V	91.4	Very high	91.6	Very high	123 Å²	123	59.1 Å²	59.1	75%	0.745	33%	0.326	S	S	*	.	S	Bend	trans	-142.6	130.6	174.5	-177.3	0	0	0	0	108.3
372	P	92.5	Very high	90.9	Very high	89 Å²	89	62.1 Å²	62.1	58%	0.578	35%	0.352	S	S	*	.	S	Bend	cis	-71.2	170.6	-4.5	32.1	-34.7	0	0	0	112.5	H119	H119-P372 PolarHBondContact CE1-O 2.86Å; H119-P372 PolarHBondContact NE2-O 3.44Å
373	A	92.2	Very high	90.3	Very high	51 Å²	51	60.6 Å²	60.6	42%	0.421	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-59.1	159.1	167.5	0	0	0	0	0	111.2
374	F	93	Very high	90	Very high	23 Å²	23	61.9 Å²	61.9	10%	0.101	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-87.7	135	-179.8	-177.6	-92.8	0	0	0	110.9	K115 I116 H119 A187 V189 F376 F378	K115-F374 HydrophobicContact CB-CE2 4.06Å; K115-F374 HydrophobicContact CB-CZ 3.8Å; I116-F374 HydrophobicContact CB-CE2 4.43Å; I116-F374 HydrophobicContact CB-CZ 4.38Å; I116-F374 HydrophobicContact CD1-CE1 4.27Å; I116-F374 HydrophobicContact CD1-CZ 4.49Å; I116-F374 HydrophobicContact CG1-CD1 4.17Å; I116-F374 HydrophobicContact CG1-CD2 4.4Å; I116-F374 HydrophobicContact CG1-CE1 3.59Å; I116-F374 HydrophobicContact CG1-CE2 3.86Å; I116-F374 HydrophobicContact CG1-CZ 3.41Å; I116-F374 VanDerWaalsContact CG1-CZ 3.41Å; H119-F374 HydrophobicContact CB-CD2 3.73Å; H119-F374 HydrophobicContact CB-CE2 4.1Å; H119-F374 AromaticContact CD2-CD2 3.78Å; H119-F374 AromaticContact CG-CD2 3.74Å; A187-F374 HydrophobicContact CB-CB 4.3Å; A187-F374 PolarHBondContact O-N 2.84Å; V189-F374 HydrophobicContact CG2-CB 3.78Å; V189-F374 HydrophobicContact CG2-CD1 4.19Å; V189-F374 HydrophobicContact CG2-CG 4.2Å; F374-F376 HydrophobicContact CD1-CD1 4.33Å; F374-F376 AromaticContact CD1-CD2 3.64Å; F374-F376 HydrophobicContact CD1-CD2 3.64Å; F374-F376 HydrophobicContact CD1-CE1 4.1Å; F374-F376 AromaticContact CD1-CE2 3.4Å; F374-F376 HydrophobicContact CD1-CE2 3.4Å; F374-F376 VanDerWaalsContact CD1-CE2 3.4Å; F374-F376 HydrophobicContact CD1-CG 4.12Å; F374-F376 AromaticContact CD1-CZ 3.64Å; F374-F376 HydrophobicContact CD1-CZ 3.64Å; F374-F376 AromaticContact CE1-CD1 3.95Å; F374-F376 HydrophobicContact CE1-CD1 3.95Å; F374-F376 HydrophobicContact CE1-CD2 4.09Å; F374-F376 AromaticContact CE1-CE1 3.77Å; F374-F376 HydrophobicContact CE1-CE1 3.77Å; F374-F376 AromaticContact CE1-CE2 3.95Å; F374-F376 HydrophobicContact CE1-CE2 3.95Å; F374-F376 HydrophobicContact CE1-CG 4.1Å; F374-F376 AromaticContact CE1-CZ 3.77Å; F374-F376 HydrophobicContact CE1-CZ 3.77Å; F374-F376 HydrophobicContact CG-CE2 4.49Å; F374-F378 AromaticContact CE1-CE1 3.75Å; F374-F378 HydrophobicContact CE1-CE1 3.75Å; F374-F378 HydrophobicContact CE1-CZ 4.3Å; F374-F378 AromaticContact CZ-CE1 3.71Å; F374-F378 HydrophobicContact CZ-CE1 3.71Å; F374-F378 HydrophobicContact CZ-CZ 4.18Å
375	D	90	Very high	89.8	Confident	104 Å²	104	61.1 Å²	61.1	56%	0.556	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-91.9	126.6	-178.6	177.1	12.6	0	0	0	111.3	E377 F378	D375-E377 WeakPolarHBondContact OD1-CB 3.44Å; D375-E377 WeakPolarHBondContact OD1-CG 3.45Å; D375-E377 PolarHBondContact OD1-N 3.19Å; D375-F378 WeakPolarHBondContact O-CD1 3.1Å; D375-F378 VanDerWaalsContact O-CE1 3.27Å; D375-F378 WeakPolarHBondContact O-CE1 3.4Å
376	F	88.4	Confident	89.5	Confident	23 Å²	23	62 Å²	62	10%	0.101	34%	0.341	C	S	.	.			trans	-106.7	2.6	179.6	-80.2	-83.4	0	0	0	114.4	R112 I116 V189 G217 F374 F378 D379 K380	R112-F376 HydrophobicContact CG-CE1 4.46Å; I116-F376 HydrophobicContact CD1-CE1 4.14Å; I116-F376 HydrophobicContact CD1-CZ 4.07Å; V189-F376 HydrophobicContact CB-CE2 4.45Å; V189-F376 HydrophobicContact CB-CZ 4.49Å; V189-F376 HydrophobicContact CG1-CZ 4.23Å; V189-F376 HydrophobicContact CG2-CE2 3.77Å; V189-F376 HydrophobicContact CG2-CZ 3.96Å; G217-F376 VanDerWaalsContact N-CD2 3.34Å; G217-F376 VanDerWaalsContact N-CZ 3.25Å; F374-F376 HydrophobicContact CD1-CD1 4.33Å; F374-F376 AromaticContact CD1-CD2 3.64Å; F374-F376 HydrophobicContact CD1-CD2 3.64Å; F374-F376 HydrophobicContact CD1-CE1 4.1Å; F374-F376 AromaticContact CD1-CE2 3.4Å; F374-F376 HydrophobicContact CD1-CE2 3.4Å; F374-F376 VanDerWaalsContact CD1-CE2 3.4Å; F374-F376 HydrophobicContact CD1-CG 4.12Å; F374-F376 AromaticContact CD1-CZ 3.64Å; F374-F376 HydrophobicContact CD1-CZ 3.64Å; F374-F376 AromaticContact CE1-CD1 3.95Å; F374-F376 HydrophobicContact CE1-CD1 3.95Å; F374-F376 HydrophobicContact CE1-CD2 4.09Å; F374-F376 AromaticContact CE1-CE1 3.77Å; F374-F376 HydrophobicContact CE1-CE1 3.77Å; F374-F376 AromaticContact CE1-CE2 3.95Å; F374-F376 HydrophobicContact CE1-CE2 3.95Å; F374-F376 HydrophobicContact CE1-CG 4.1Å; F374-F376 AromaticContact CE1-CZ 3.77Å; F374-F376 HydrophobicContact CE1-CZ 3.77Å; F374-F376 HydrophobicContact CG-CE2 4.49Å; F376-F378 PolarHBondContact O-N 2.84Å; F376-F378 VanDerWaalsContact O-N 3.12Å; F376-D379 HydrophobicContact CD1-CB 4.44Å; F376-D379 WeakPolarHBondContact O-CB 3.39Å; F376-D379 PolarHBondContact O-N 3.14Å; F376-K380 PolarHBondContact O-N 3.07Å
377	E	86.3	Confident	89.4	Confident	102 Å²	102	65.4 Å²	65.4	48%	0.477	36%	0.356	S	S	.	.	H	α-helix	trans	-57.3	-32.8	-177.9	-69.2	-57.6	117.8	0	0	112.2	D375 D379 K380 L381	D375-E377 WeakPolarHBondContact OD1-CB 3.44Å; D375-E377 WeakPolarHBondContact OD1-CG 3.45Å; D375-E377 PolarHBondContact OD1-N 3.19Å; E377-D379 PolarHBondContact O-N 3.22Å; E377-K380 PolarHBondContact O-N 2.85Å; E377-K380 WeakPolarHBondContact OE1-CD 3.41Å; E377-K380 WeakPolarHBondContact OE1-CE 3.36Å; E377-K380 IonicContact OE1-NZ 3.25Å; E377-K380 PolarHBondContact OE1-NZ 2.8Å; E377-K380 IonicContact OE2-NZ 3.57Å; E377-L381 PolarHBondContact O-N 2.87Å
378	F	86.4	Confident	89.1	Confident	31 Å²	31	65.2 Å²	65.2	14%	0.136	36%	0.355	C	S	.	.	H	α-helix	trans	-59.9	-27.3	173.9	80.2	-88.1	0	0	0	114.2	L111 R112 K115 F374 D375 F376 M383	L111-F378 HydrophobicContact CD2-CD2 4.06Å; L111-F378 HydrophobicContact CD2-CE2 4.33Å; L111-F378 HydrophobicContact CG-CD2 4.31Å; L111-F378 HydrophobicContact CG-CE2 4.17Å; R112-F378 HydrophobicContact CB-CZ 4.5Å; R112-F378 HydrophobicContact CG-CZ 4.37Å; K115-F378 HydrophobicContact CB-CZ 4.33Å; K115-F378 HydrophobicContact CD-CD1 3.72Å; K115-F378 HydrophobicContact CD-CD2 3.6Å; K115-F378 HydrophobicContact CD-CE1 3.59Å; K115-F378 HydrophobicContact CD-CE2 3.49Å; K115-F378 VanDerWaalsContact CD-CE2 3.49Å; K115-F378 HydrophobicContact CD-CG 3.73Å; K115-F378 HydrophobicContact CD-CZ 3.48Å; K115-F378 VanDerWaalsContact CD-CZ 3.48Å; F374-F378 AromaticContact CE1-CE1 3.75Å; F374-F378 HydrophobicContact CE1-CE1 3.75Å; F374-F378 HydrophobicContact CE1-CZ 4.3Å; F374-F378 AromaticContact CZ-CE1 3.71Å; F374-F378 HydrophobicContact CZ-CE1 3.71Å; F374-F378 HydrophobicContact CZ-CZ 4.18Å; D375-F378 WeakPolarHBondContact O-CD1 3.1Å; D375-F378 VanDerWaalsContact O-CE1 3.27Å; D375-F378 WeakPolarHBondContact O-CE1 3.4Å; F376-F378 PolarHBondContact O-N 2.84Å; F376-F378 VanDerWaalsContact O-N 3.12Å; F378-M383 WeakPolarHBondContact O-CE 3.36Å
379	D	84.3	Confident	88.8	Confident	5 Å²	5	64.4 Å²	64.4	3%	0.027	35%	0.348	C	S	.	.	H	α-helix	trans	-86.6	-29.8	-175.9	-164.1	29.1	0	0	0	111.5	K108 R112 R216 F376 E377 L381	K108-D379 PolarHBondContact NZ-O 2.79Å; R112-D379 IonicContact CZ-OD1 2.66Å; R112-D379 IonicContact CZ-OD2 3.62Å; R112-D379 VanDerWaalsContact CZ-OD2 3.25Å; R112-D379 IonicContact NE-OD1 3.76Å; R112-D379 IonicContact NE-OD2 3.47Å; R112-D379 PolarHBondContact NE-OD2 3.04Å; R112-D379 IonicContact NH2-OD1 2.67Å; R112-D379 PolarHBondContact NH2-OD1 3.38Å; R112-D379 IonicContact NH2-OD2 3.56Å; R112-D379 PolarHBondContact NH2-OD2 3.36Å; R216-D379 IonicContact NE-OD2 2.73Å; R216-D379 PolarHBondContact NE-OD2 3.35Å; F376-D379 HydrophobicContact CD1-CB 4.44Å; F376-D379 WeakPolarHBondContact O-CB 3.39Å; F376-D379 PolarHBondContact O-N 3.14Å; E377-D379 PolarHBondContact O-N 3.22Å; D379-L381 VanDerWaalsContact C-N 3.34Å
380	K	80.9	Confident	88.6	Confident	75 Å²	75	63.8 Å²	63.8	33%	0.326	34%	0.339	S	S	.	.	H	α-helix	trans	-62.9	-38.2	172.7	-67.5	-176.7	175.5	176.1	0	112.3	E224 F376 E377	E224-K380 IonicContact OE2-NZ 2.85Å; F376-K380 PolarHBondContact O-N 3.07Å; E377-K380 PolarHBondContact O-N 2.85Å; E377-K380 WeakPolarHBondContact OE1-CD 3.41Å; E377-K380 WeakPolarHBondContact OE1-CE 3.36Å; E377-K380 IonicContact OE1-NZ 3.25Å; E377-K380 PolarHBondContact OE1-NZ 2.8Å; E377-K380 IonicContact OE2-NZ 3.57Å
381	L	81.3	Confident	88.4	Confident	98 Å²	98	64.2 Å²	64.2	51%	0.513	34%	0.343	S	S	.	.	S	Bend	trans	-56.5	130.7	-176.2	-67.2	175	0	0	0	111.7	K108 E377 D379 M383	K108-L381 PolarHBondContact NZ-O 3.04Å; E377-L381 PolarHBondContact O-N 2.87Å; D379-L381 VanDerWaalsContact C-N 3.34Å; L381-M383 HydrophobicContact CB-CG 4.14Å; L381-M383 PolarHBondContact O-N 3.43Å
382	P	81.6	Confident	88.5	Confident	121 Å²	121	58.4 Å²	58.4	79%	0.786	31%	0.308	S	S	*	.			trans	-63.9	125.6	163.9	28.4	-32.1	0	0	0	107.8
383	M	84.5	Confident	88.4	Confident	35 Å²	35	54.8 Å²	54.8	17%	0.172	28%	0.284	C	S	.	.			trans	-139.3	133.9	-178.9	-67.2	-177.9	-72	0	0	109.3	L111 F378 L381 Q387 I388	L111-M383 HydrophobicContact CD2-CE 4.18Å; F378-M383 WeakPolarHBondContact O-CE 3.36Å; L381-M383 HydrophobicContact CB-CG 4.14Å; L381-M383 PolarHBondContact O-N 3.43Å; M383-Q387 VanDerWaalsContact CA-OE1 3.3Å; M383-Q387 HydrophobicContact CB-CB 4.16Å; M383-I388 HydrophobicContact CB-CD1 4.17Å; M383-I388 HydrophobicContact CB-CG1 3.67Å; M383-I388 HydrophobicContact CE-CG1 4.19Å; M383-I388 HydrophobicContact SD-CG1 4.39Å
384	N	89.9	Confident	88.3	Confident	78 Å²	78	57.4 Å²	57.4	42%	0.417	29%	0.289	S	S	.	.			trans	-76.9	173	170.8	73.6	13	0	0	0	111.5	E386 Q387 I388	N384-E386 VanDerWaalsContact C-N 3.3Å; N384-E386 PolarHBondContact O-N 3.32Å; N384-E386 PolarHBondContact OD1-N 3.23Å; N384-Q387 PolarHBondContact O-N 3.3Å; N384-Q387 VanDerWaalsContact OD1-CB 3.32Å; N384-Q387 WeakPolarHBondContact OD1-CB 3.27Å; N384-Q387 WeakPolarHBondContact OD1-CG 3.4Å; N384-Q387 PolarHBondContact OD1-N 2.8Å; N384-Q387 PolarHBondContact OD1-OE1 3.09Å; N384-I388 VanDerWaalsContact O-CG1 3.31Å; N384-I388 WeakPolarHBondContact O-CG1 3.2Å; N384-I388 PolarHBondContact O-N 3.01Å
385	K	88.8	Confident	88.4	Confident	75 Å²	75	57.9 Å²	57.9	33%	0.326	29%	0.291	S	S	.	.	H	α-helix	trans	-54.9	-42.8	-178.5	170.8	166.5	176.7	164	0	113	F101 E102 V104 I388 K389	F101-K385 HydrophobicContact CB-CG 4.49Å; F101-K385 WeakPolarHBondContact O-CD 3.12Å; F101-K385 WeakPolarHBondContact O-CE 3.22Å; F101-K385 WeakPolarHBondContact O-CG 3.22Å; E102-K385 PolarHBondContact O-NZ 3Å; V104-K385 HydrophobicContact CG2-CB 4.45Å; K385-I388 PolarHBondContact O-N 2.82Å; K385-K389 VanDerWaalsContact O-CB 3.29Å; K385-K389 WeakPolarHBondContact O-CB 3.07Å; K385-K389 PolarHBondContact O-N 2.83Å
386	E	89.1	Confident	88.5	Confident	106 Å²	106	53 Å²	53	50%	0.495	27%	0.265	S	S	.	.	H	α-helix	trans	-71.1	-41.8	-177.8	-68.9	58.5	-129.7	0	0	111.2	N384 K389 E390	N384-E386 VanDerWaalsContact C-N 3.3Å; N384-E386 PolarHBondContact O-N 3.32Å; N384-E386 PolarHBondContact OD1-N 3.23Å; E386-K389 PolarHBondContact O-N 2.83Å; E386-E390 PolarHBondContact O-N 2.78Å
387	Q	91.5	Very high	88.6	Confident	103 Å²	103	57.7 Å²	57.7	48%	0.481	29%	0.287	S	S	.	.	H	α-helix	trans	-63	-42.9	174.2	-73.4	163.7	-21.5	0	0	111.8	M383 N384 E390 A391	M383-Q387 VanDerWaalsContact CA-OE1 3.3Å; M383-Q387 HydrophobicContact CB-CB 4.16Å; N384-Q387 PolarHBondContact O-N 3.3Å; N384-Q387 VanDerWaalsContact OD1-CB 3.32Å; N384-Q387 WeakPolarHBondContact OD1-CB 3.27Å; N384-Q387 WeakPolarHBondContact OD1-CG 3.4Å; N384-Q387 PolarHBondContact OD1-N 2.8Å; N384-Q387 PolarHBondContact OD1-OE1 3.09Å; Q387-E390 PolarHBondContact O-N 3.1Å; Q387-A391 WeakPolarHBondContact O-CB 3.21Å; Q387-A391 PolarHBondContact O-N 2.87Å
388	I	90.5	Very high	88.9	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-68	-38.9	176.8	-60.3	160	0	0	0	110.8	V104 A107 K108 L111 M383 N384 K385 A391 I392	V104-I388 HydrophobicContact CG1-CD1 3.79Å; A107-I388 HydrophobicContact CB-CB 4.17Å; A107-I388 HydrophobicContact CB-CD1 4.23Å; A107-I388 HydrophobicContact CB-CG2 3.54Å; K108-I388 HydrophobicContact CG-CD1 3.71Å; K108-I388 HydrophobicContact CG-CG1 4.35Å; L111-I388 HydrophobicContact CB-CG2 4.26Å; L111-I388 HydrophobicContact CD2-CG2 4.24Å; M383-I388 HydrophobicContact CB-CD1 4.17Å; M383-I388 HydrophobicContact CB-CG1 3.67Å; M383-I388 HydrophobicContact CE-CG1 4.19Å; M383-I388 HydrophobicContact SD-CG1 4.39Å; N384-I388 VanDerWaalsContact O-CG1 3.31Å; N384-I388 WeakPolarHBondContact O-CG1 3.2Å; N384-I388 PolarHBondContact O-N 3.01Å; K385-I388 PolarHBondContact O-N 2.82Å; I388-A391 PolarHBondContact O-N 2.7Å; I388-I392 HydrophobicContact CG2-CD1 4.07Å; I388-I392 WeakPolarHBondContact O-CG1 3.3Å; I388-I392 PolarHBondContact O-N 2.79Å
389	K	90.9	Very high	89.1	Confident	22 Å²	22	55.2 Å²	55.2	10%	0.096	28%	0.277	C	S	.	.	H	α-helix	trans	-61.5	-45	174.9	175.6	170.3	170.1	168.3	0	111.9	F101 H138 F141 K385 E386 I392 L393	F101-K389 HydrophobicContact CB-CB 4.48Å; F101-K389 HydrophobicContact CB-CD 4.42Å; F101-K389 HydrophobicContact CD1-CB 3.61Å; F101-K389 HydrophobicContact CD1-CD 4.31Å; F101-K389 HydrophobicContact CD1-CG 3.85Å; F101-K389 HydrophobicContact CD2-CD 3.92Å; F101-K389 HydrophobicContact CD2-CG 4.2Å; F101-K389 HydrophobicContact CE1-CB 4.04Å; F101-K389 HydrophobicContact CE1-CG 3.95Å; F101-K389 HydrophobicContact CE2-CD 4.33Å; F101-K389 HydrophobicContact CE2-CG 4.3Å; F101-K389 HydrophobicContact CG-CB 3.99Å; F101-K389 HydrophobicContact CG-CD 3.93Å; F101-K389 HydrophobicContact CG-CG 3.99Å; F101-K389 HydrophobicContact CZ-CG 4.2Å; H138-K389 WeakPolarHBondContact NE2-CE 3.36Å; H138-K389 WeakPolarHBondContact O-CE 3.39Å; H138-K389 PolarHBondContact O-NZ 3.09Å; F141-K389 WeakPolarHBondContact O-CE 3.35Å; F141-K389 PolarHBondContact O-NZ 3.32Å; K385-K389 VanDerWaalsContact O-CB 3.29Å; K385-K389 WeakPolarHBondContact O-CB 3.07Å; K385-K389 PolarHBondContact O-N 2.83Å; E386-K389 PolarHBondContact O-N 2.83Å; K389-I392 PolarHBondContact O-N 3.25Å; K389-L393 HydrophobicContact CG-CD1 4.45Å; K389-L393 WeakPolarHBondContact O-CG 3.47Å; K389-L393 PolarHBondContact O-N 3.4Å
390	E	90.9	Very high	89.3	Confident	69 Å²	69	56.1 Å²	56.1	32%	0.322	28%	0.281	S	S	.	.	H	α-helix	trans	-68.5	-36.9	175.8	-168.8	55.3	-145.2	0	0	111.8	H138 E386 Q387 I392 L393 M394	H138-E390 IonicContact CE1-OE2 3.15Å; H138-E390 PolarHBondContact CE1-OE2 3Å; H138-E390 IonicContact ND1-OE2 3.31Å; H138-E390 PolarHBondContact ND1-OE2 2.76Å; E386-E390 PolarHBondContact O-N 2.78Å; Q387-E390 PolarHBondContact O-N 3.1Å; E390-I392 VanDerWaalsContact C-N 3.34Å; E390-I392 PolarHBondContact O-N 2.79Å; E390-L393 WeakPolarHBondContact O-CB 3.37Å; E390-L393 PolarHBondContact O-N 2.95Å; E390-L393 WeakPolarHBondContact OE2-CD1 3.5Å; E390-M394 HydrophobicContact CG-CE 4.46Å; E390-M394 WeakPolarHBondContact O-CG 3.29Å; E390-M394 PolarHBondContact O-N 3.36Å
391	A	92.7	Very high	89.7	Confident	16 Å²	16	60.1 Å²	60.1	13%	0.132	30%	0.298	C	S	.	.	H	α-helix	trans	-59.8	-42.6	171.8	0	0	0	0	0	112.3	L111 Q387 I388 M394 E395	L111-A391 HydrophobicContact CD1-CB 3.93Å; L111-A391 HydrophobicContact CD2-CB 3.79Å; Q387-A391 WeakPolarHBondContact O-CB 3.21Å; Q387-A391 PolarHBondContact O-N 2.87Å; I388-A391 PolarHBondContact O-N 2.7Å; A391-M394 PolarHBondContact O-N 3.44Å; A391-E395 WeakPolarHBondContact O-CG 3.47Å; A391-E395 PolarHBondContact O-N 2.9Å
392	I	92.3	Very high	89.8	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.1	-40.8	174.3	-72.1	169.2	0	0	0	111.1	F101 T110 L111 L114 V144 I388 K389 E390 E395 I396	F101-I392 HydrophobicContact CD1-CD1 4.24Å; F101-I392 HydrophobicContact CE1-CB 4.17Å; F101-I392 HydrophobicContact CE1-CD1 3.73Å; F101-I392 HydrophobicContact CE1-CG2 4.09Å; F101-I392 HydrophobicContact CZ-CG2 4.38Å; T110-I392 HydrophobicContact CG2-CD1 3.9Å; L111-I392 HydrophobicContact CB-CD1 4.16Å; L111-I392 HydrophobicContact CB-CG1 3.87Å; L111-I392 HydrophobicContact CD1-CG1 3.89Å; L111-I392 HydrophobicContact CG-CG1 4.44Å; L114-I392 HydrophobicContact CD1-CG1 4.5Å; L114-I392 HydrophobicContact CD1-CG2 4.01Å; V144-I392 HydrophobicContact CG2-CG2 4.06Å; I388-I392 HydrophobicContact CG2-CD1 4.07Å; I388-I392 WeakPolarHBondContact O-CG1 3.3Å; I388-I392 PolarHBondContact O-N 2.79Å; K389-I392 PolarHBondContact O-N 3.25Å; E390-I392 VanDerWaalsContact C-N 3.34Å; E390-I392 PolarHBondContact O-N 2.79Å; I392-E395 PolarHBondContact O-N 2.97Å; I392-I396 HydrophobicContact CG2-CD1 4.08Å; I392-I396 WeakPolarHBondContact O-CG1 3.29Å; I392-I396 PolarHBondContact O-N 3.44Å
393	L	90.6	Very high	89.6	Confident	13 Å²	13	58 Å²	58	7%	0.068	27%	0.273	C	S	.	.	H	α-helix	trans	-62.8	-44.3	175	-76.1	169.4	0	0	0	112.5	P134 H138 F141 K389 E390 E395 I396 Q397	P134-L393 HydrophobicContact CG-CD2 3.48Å; P134-L393 VanDerWaalsContact CG-CD2 3.48Å; H138-L393 WeakPolarHBondContact ND1-CD1 3.33Å; F141-L393 HydrophobicContact CD1-CD1 4.18Å; F141-L393 HydrophobicContact CD1-CD2 3.58Å; F141-L393 HydrophobicContact CD1-CG 3.95Å; F141-L393 HydrophobicContact CE1-CD1 4.48Å; F141-L393 HydrophobicContact CE1-CD2 3.38Å; F141-L393 HydrophobicContact CE1-CG 3.77Å; F141-L393 HydrophobicContact CG-CD2 4.46Å; F141-L393 HydrophobicContact CZ-CD2 4.13Å; K389-L393 HydrophobicContact CG-CD1 4.45Å; K389-L393 WeakPolarHBondContact O-CG 3.47Å; K389-L393 PolarHBondContact O-N 3.4Å; E390-L393 WeakPolarHBondContact O-CB 3.37Å; E390-L393 PolarHBondContact O-N 2.95Å; E390-L393 WeakPolarHBondContact OE2-CD1 3.5Å; L393-E395 VanDerWaalsContact C-N 3.33Å; L393-E395 PolarHBondContact O-N 3.01Å; L393-I396 PolarHBondContact O-N 3.27Å; L393-Q397 WeakPolarHBondContact O-CG 3.47Å; L393-Q397 PolarHBondContact O-N 3.17Å
394	M	91.5	Very high	89	Confident	107 Å²	107	62.3 Å²	62.3	53%	0.527	30%	0.296	S	S	.	.	H	α-helix	trans	-61.2	-40.6	174.6	-72.7	-170.1	-71.7	0	0	111.9	E390 A391 I396 Q397 D398	E390-M394 HydrophobicContact CG-CE 4.46Å; E390-M394 WeakPolarHBondContact O-CG 3.29Å; E390-M394 PolarHBondContact O-N 3.36Å; A391-M394 PolarHBondContact O-N 3.44Å; M394-I396 PolarHBondContact O-N 3.11Å; M394-Q397 PolarHBondContact O-N 2.82Å; M394-D398 VanDerWaalsContact O-CB 3.31Å; M394-D398 WeakPolarHBondContact O-CB 3.26Å; M394-D398 PolarHBondContact O-N 3.23Å
395	E	93.3	Very high	87.9	Confident	32 Å²	32	63.2 Å²	63.2	15%	0.15	31%	0.308	C	S	.	.	H	α-helix	trans	-63.6	-38	175.5	-73	-62.6	154.3	0	0	112.7	L111 K115 K118 A391 I392 L393 F399	L111-E395 HydrophobicContact CD1-CG 3.97Å; K115-E395 WeakPolarHBondContact CE-OE1 3.28Å; K115-E395 HydrophobicContact CG-CG 4.02Å; K115-E395 WeakPolarHBondContact CG-OE1 3.32Å; K115-E395 IonicContact NZ-OE1 2.93Å; K115-E395 PolarHBondContact NZ-OE1 2.93Å; K118-E395 WeakPolarHBondContact CE-OE2 3.44Å; K118-E395 PolarHBondContact NZ-O 2.83Å; K118-E395 IonicContact NZ-OE2 1.9Å; K118-E395 PolarHBondContact NZ-OE2 2.92Å; A391-E395 WeakPolarHBondContact O-CG 3.47Å; A391-E395 PolarHBondContact O-N 2.9Å; I392-E395 PolarHBondContact O-N 2.97Å; L393-E395 VanDerWaalsContact C-N 3.33Å; L393-E395 PolarHBondContact O-N 3.01Å; E395-F399 WeakPolarHBondContact O-CB 3.46Å; E395-F399 PolarHBondContact O-N 3.11Å; E395-F399 VanDerWaalsContact O-N 3.12Å
396	I	91.9	Very high	86.4	Confident	3 Å²	3	63.7 Å²	63.7	2%	0.015	32%	0.321	C	S	.	.	H	α-helix	trans	-65.6	-48.4	173.7	-65.7	164.3	0	0	0	110.5	I131 Q133 F141 I392 L393 M394 D398 F399 H400	I131-I396 HydrophobicContact CB-CG1 4.34Å; I131-I396 HydrophobicContact CG2-CD1 4.24Å; I131-I396 HydrophobicContact CG2-CG1 3.78Å; Q133-I396 HydrophobicContact CG-CG2 4.37Å; F141-I396 HydrophobicContact CZ-CD1 4Å; I392-I396 HydrophobicContact CG2-CD1 4.08Å; I392-I396 WeakPolarHBondContact O-CG1 3.29Å; I392-I396 PolarHBondContact O-N 3.44Å; L393-I396 PolarHBondContact O-N 3.27Å; M394-I396 PolarHBondContact O-N 3.11Å; I396-D398 PolarHBondContact O-N 3.01Å; I396-F399 WeakPolarHBondContact O-CB 3.43Å; I396-F399 PolarHBondContact O-N 2.79Å; I396-H400 PolarHBondContact O-CD2 2.8Å; I396-H400 PolarHBondContact O-N 3.43Å
397	Q	91.4	Very high	84.5	Confident	120 Å²	120	66.8 Å²	66.8	56%	0.561	33%	0.328	S	S	*	.	H	α-helix	trans	-61.5	-44	179.8	-70.1	176.3	36.3	0	0	112.1	L393 M394 F399 H400 K401	L393-Q397 WeakPolarHBondContact O-CG 3.47Å; L393-Q397 PolarHBondContact O-N 3.17Å; M394-Q397 PolarHBondContact O-N 2.82Å; Q397-F399 PolarHBondContact O-N 3.41Å; Q397-H400 PolarHBondContact O-N 3.44Å; Q397-K401 VanDerWaalsContact O-CB 3.31Å; Q397-K401 WeakPolarHBondContact O-CB 2.98Å; Q397-K401 PolarHBondContact O-N 3.33Å
398	D	91.9	Very high	82.2	Confident	48 Å²	48	66.7 Å²	66.7	26%	0.257	34%	0.336	S	S	.	.	H	α-helix	trans	-60.7	-41.8	175.9	169.4	74.8	0	0	0	112.4	K118 M394 I396 H400 K401 K402	K118-D398 IonicContact NZ-OD2 3.79Å; K118-D398 PolarHBondContact NZ-OD2 3.39Å; M394-D398 VanDerWaalsContact O-CB 3.31Å; M394-D398 WeakPolarHBondContact O-CB 3.26Å; M394-D398 PolarHBondContact O-N 3.23Å; I396-D398 PolarHBondContact O-N 3.01Å; D398-H400 PolarHBondContact O-N 3.46Å; D398-K401 PolarHBondContact O-N 2.79Å; D398-K402 WeakPolarHBondContact O-CB 3.47Å; D398-K402 WeakPolarHBondContact O-CG 3.5Å; D398-K402 PolarHBondContact O-N 3.24Å; D398-K402 WeakPolarHBondContact OD1-CE 3.48Å; D398-K402 IonicContact OD1-NZ 3.67Å; D398-K402 PolarHBondContact OD1-NZ 2.98Å; D398-K402 WeakPolarHBondContact OD2-CD 3.35Å; D398-K402 WeakPolarHBondContact OD2-CE 3.46Å; D398-K402 IonicContact OD2-NZ 3.43Å; D398-K402 PolarHBondContact OD2-NZ 3.32Å
399	F	90.7	Very high	79.9	Confident	34 Å²	34	77.1 Å²	77.1	15%	0.149	38%	0.376	C	S	.	.	H	α-helix	trans	-57.8	-49.6	176.6	-179.4	-88.7	0	0	0	111	K118 I128 I131 E395 I396 Q397 K402 K403	K118-F399 HydrophobicContact CD-CB 4.41Å; K118-F399 HydrophobicContact CD-CD2 4.32Å; K118-F399 HydrophobicContact CG-CD2 4.15Å; I128-F399 HydrophobicContact CB-CE2 4.49Å; I128-F399 HydrophobicContact CG2-CD2 4.42Å; I128-F399 HydrophobicContact CG2-CE2 3.7Å; I128-F399 HydrophobicContact CG2-CZ 3.91Å; I131-F399 HydrophobicContact CD1-CB 4.13Å; I131-F399 HydrophobicContact CD1-CD2 4.23Å; I131-F399 HydrophobicContact CD1-CG 4.05Å; I131-F399 HydrophobicContact CG1-CD1 4.44Å; I131-F399 HydrophobicContact CG1-CG 4.4Å; E395-F399 WeakPolarHBondContact O-CB 3.46Å; E395-F399 PolarHBondContact O-N 3.11Å; E395-F399 VanDerWaalsContact O-N 3.12Å; I396-F399 WeakPolarHBondContact O-CB 3.43Å; I396-F399 PolarHBondContact O-N 2.79Å; Q397-F399 PolarHBondContact O-N 3.41Å; F399-K402 PolarHBondContact O-N 3.16Å; F399-K403 HydrophobicContact CE1-CD 4.18Å; F399-K403 WeakPolarHBondContact O-CB 3.45Å; F399-K403 PolarHBondContact O-N 2.87Å
400	H	89.5	Confident	77.8	Confident	24 Å²	24	82.4 Å²	82.4	11%	0.111	40%	0.404	C	S	.	.	H	α-helix	trans	-67.4	-38	177.9	-77.5	-75.8	0	0	0	113.3	D130 I131 Q133 I396 Q397 D398 K402 K403 L404	D130-H400 IonicContact OD1-CE1 3.83Å; D130-H400 PolarHBondContact OD1-CE1 2.97Å; D130-H400 VanDerWaalsContact OD1-CE1 3.29Å; D130-H400 IonicContact OD1-NE2 3.16Å; I131-H400 PolarHBondContact O-NE2 3.37Å; Q133-H400 PolarHBondContact NE2-CD2 2.94Å; Q133-H400 PolarHBondContact NE2-ND1 3.17Å; I396-H400 PolarHBondContact O-CD2 2.8Å; I396-H400 PolarHBondContact O-N 3.43Å; Q397-H400 PolarHBondContact O-N 3.44Å; D398-H400 PolarHBondContact O-N 3.46Å; H400-K402 VanDerWaalsContact C-N 3.31Å; H400-K402 PolarHBondContact O-N 3.15Å; H400-K403 WeakPolarHBondContact O-CB 3.46Å; H400-K403 PolarHBondContact O-N 2.86Å; H400-L404 WeakPolarHBondContact O-CB 3.46Å; H400-L404 WeakPolarHBondContact O-CG 3.23Å; H400-L404 PolarHBondContact O-N 3.2Å
401	K	89.8	Confident	75.5	Confident	158 Å²	158	86.5 Å²	86.5	69%	0.687	42%	0.423	S	S	*	.	H	α-helix	trans	-60.2	-41.2	175.7	-166.3	173.8	-175.8	177.5	0	111.5	Q397 D398 S405	Q397-K401 VanDerWaalsContact O-CB 3.31Å; Q397-K401 WeakPolarHBondContact O-CB 2.98Å; Q397-K401 PolarHBondContact O-N 3.33Å; D398-K401 PolarHBondContact O-N 2.79Å; K401-S405 PolarHBondContact O-N 3.43Å; K401-S405 VanDerWaalsContact O-N 3.14Å; K401-S405 PolarHBondContact O-OG 3.3Å
402	K	82.4	Confident	73.3	Confident	118 Å²	118	94.7 Å²	94.7	51%	0.513	46%	0.456	S	S	.	.	H	α-helix	trans	-70.5	-37.5	173.4	-73.3	166.8	176.5	158.6	0	112.7	D398 F399 H400 L404 S405 S406	D398-K402 WeakPolarHBondContact O-CB 3.47Å; D398-K402 WeakPolarHBondContact O-CG 3.5Å; D398-K402 PolarHBondContact O-N 3.24Å; D398-K402 WeakPolarHBondContact OD1-CE 3.48Å; D398-K402 IonicContact OD1-NZ 3.67Å; D398-K402 PolarHBondContact OD1-NZ 2.98Å; D398-K402 WeakPolarHBondContact OD2-CD 3.35Å; D398-K402 WeakPolarHBondContact OD2-CE 3.46Å; D398-K402 IonicContact OD2-NZ 3.43Å; D398-K402 PolarHBondContact OD2-NZ 3.32Å; F399-K402 PolarHBondContact O-N 3.16Å; H400-K402 VanDerWaalsContact C-N 3.31Å; H400-K402 PolarHBondContact O-N 3.15Å; K402-L404 VanDerWaalsContact C-N 3.32Å; K402-L404 PolarHBondContact O-N 2.9Å; K402-S405 PolarHBondContact O-OG 3.45Å; K402-S406 VanDerWaalsContact O-CB 3.31Å; K402-S406 WeakPolarHBondContact O-CB 3.33Å; K402-S406 PolarHBondContact O-N 3.29Å; K402-S406 VanDerWaalsContact O-N 3.11Å; K402-S406 PolarHBondContact O-OG 3.14Å
403	K	78.3	Confident	71.1	Confident	58 Å²	58	105.8 Å²	105.8	25%	0.252	50%	0.498	S	S	.	.	H	α-helix	trans	-64.7	-32.8	174.9	-165.9	-173	-174.2	-165.9	0	112.7	D130 F399 H400 S406	D130-K403 IonicContact OD1-NZ 2.7Å; D130-K403 PolarHBondContact OD1-NZ 3.01Å; D130-K403 IonicContact OD2-NZ 3.72Å; D130-K403 PolarHBondContact OD2-NZ 3.14Å; F399-K403 HydrophobicContact CE1-CD 4.18Å; F399-K403 WeakPolarHBondContact O-CB 3.45Å; F399-K403 PolarHBondContact O-N 2.87Å; H400-K403 WeakPolarHBondContact O-CB 3.46Å; H400-K403 PolarHBondContact O-N 2.86Å; K403-S406 PolarHBondContact O-OG 2.79Å
404	L	72.1	Confident	69	Low	124 Å²	124	110.8 Å²	110.8	65%	0.649	53%	0.531	S	S	*	.	H	α-helix	trans	-76.9	-44.8	175.7	-73.3	166.8	0	0	0	112.5	H400 K402 S406 R407	H400-L404 WeakPolarHBondContact O-CB 3.46Å; H400-L404 WeakPolarHBondContact O-CG 3.23Å; H400-L404 PolarHBondContact O-N 3.2Å; K402-L404 VanDerWaalsContact C-N 3.32Å; K402-L404 PolarHBondContact O-N 2.9Å; L404-S406 VanDerWaalsContact C-N 3.31Å; L404-S406 PolarHBondContact O-N 3.26Å; L404-R407 PolarHBondContact O-N 2.73Å
405	S	65.4	Low	66.5	Low	97 Å²	97	113.4 Å²	113.4	68%	0.678	55%	0.547	S	S	*	.	H	α-helix	trans	-70.7	-24.3	180	62.6	0	0	0	0	113.8	K401 K402 R407	K401-S405 PolarHBondContact O-N 3.43Å; K401-S405 VanDerWaalsContact O-N 3.14Å; K401-S405 PolarHBondContact O-OG 3.3Å; K402-S405 PolarHBondContact O-OG 3.45Å; S405-R407 VanDerWaalsContact C-N 3.34Å; S405-R407 PolarHBondContact O-N 3.37Å
406	S	56.8	Low	64.1	Low	85 Å²	85	117.5 Å²	117.5	59%	0.594	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	5.7	178.5	55.8	0	0	0	0	115.2	K402 K403 L404 P408	K402-S406 VanDerWaalsContact O-CB 3.31Å; K402-S406 WeakPolarHBondContact O-CB 3.33Å; K402-S406 PolarHBondContact O-N 3.29Å; K402-S406 VanDerWaalsContact O-N 3.11Å; K402-S406 PolarHBondContact O-OG 3.14Å; K403-S406 PolarHBondContact O-OG 2.79Å; L404-S406 VanDerWaalsContact C-N 3.31Å; L404-S406 PolarHBondContact O-N 3.26Å; S406-P408 WeakPolarHBondContact O-CD 3.5Å
407	R	50.2	Low	61.4	Low	172 Å²	172	127.2 Å²	127.2	65%	0.649	61%	0.612	S	S	*	*	S	Bend	trans	-91	95	168.4	-75.1	-177.1	170.9	-171	-2.8	110.3	L404 S405 R409	L404-R407 PolarHBondContact O-N 2.73Å; S405-R407 VanDerWaalsContact C-N 3.34Å; S405-R407 PolarHBondContact O-N 3.37Å; R407-R409 PolarHBondContact O-N 2.89Å; R407-R409 VanDerWaalsContact O-N 3.07Å
408	P	43.2	Very low	59.2	Low	100 Å²	100	128 Å²	128	65%	0.649	63%	0.626	S	S	*	*			trans	-65.1	113.9	175.7	28	-35.1	0	0	0	109.6	S406 L410	S406-P408 WeakPolarHBondContact O-CD 3.5Å; P408-L410 HydrophobicContact CB-CG 4.43Å; P408-L410 PolarHBondContact O-N 3.19Å
409	R	41.7	Very low	56.5	Low	220 Å²	220	131.6 Å²	131.6	83%	0.83	64%	0.641	S	S	*	*			trans	-75.2	71.8	176	-166.3	178	-171.9	169.7	3.7	109.8	R407 Q411	R407-R409 PolarHBondContact O-N 2.89Å; R407-R409 VanDerWaalsContact O-N 3.07Å; R409-Q411 VanDerWaalsContact C-N 3.28Å; R409-Q411 HydrophobicContact CG-CG 4.43Å; R409-Q411 PolarHBondContact O-N 3.41Å
410	L	46.3	Very low	54.1	Low	133 Å²	133	135.5 Å²	135.5	70%	0.696	67%	0.669	S	S	*	*			trans	-63	85.9	175.8	-71.7	174.4	0	0	0	110.2	P408 F412	P408-L410 HydrophobicContact CB-CG 4.43Å; P408-L410 PolarHBondContact O-N 3.19Å; L410-F412 PolarHBondContact O-N 2.92Å; L410-F412 VanDerWaalsContact O-N 3.08Å
411	Q	43.6	Very low	51.7	Low	154 Å²	154	139.5 Å²	139.5	72%	0.72	71%	0.706	S	S	*	*			trans	-70.9	99.3	169	-66.9	-174.1	0.1	0	0	108.3	R409 R413	R409-Q411 VanDerWaalsContact C-N 3.28Å; R409-Q411 HydrophobicContact CG-CG 4.43Å; R409-Q411 PolarHBondContact O-N 3.41Å; Q411-R413 PolarHBondContact O-N 3.38Å
412	F	45.8	Very low	49.1	Very low	188 Å²	188	136.8 Å²	136.8	83%	0.825	71%	0.714	S	S	*	*			trans	-63.1	99.3	168.8	-79.9	-89.9	0	0	0	109.3	L410 P414	L410-F412 PolarHBondContact O-N 2.92Å; L410-F412 VanDerWaalsContact O-N 3.08Å; F412-P414 WeakPolarHBondContact O-CD 3.46Å
413	R	47.3	Very low	46.8	Very low	233 Å²	233	138.6 Å²	138.6	88%	0.879	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-76.3	117.9	168.5	-165.7	175.3	-168.1	167.9	4.1	107.6	Q411 L415	Q411-R413 PolarHBondContact O-N 3.38Å; R413-L415 PolarHBondContact O-N 2.96Å
414	P	45.1	Very low	44.5	Very low	118 Å²	118	146.4 Å²	146.4	77%	0.766	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-59.3	132.6	179.7	-24.4	35.1	0	0	0	110.9	F412	F412-P414 WeakPolarHBondContact O-CD 3.46Å
415	L	39.2	Very low	42.5	Very low	163 Å²	163	145.3 Å²	145.3	85%	0.853	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-71.5	139	171.8	-78.7	166.9	0	0	0	109.5	R413 R417	R413-L415 PolarHBondContact O-N 2.96Å; L415-R417 PolarHBondContact O-N 3.33Å
416	P	44.1	Very low	41	Very low	117 Å²	117	145.8 Å²	145.8	76%	0.76	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-58.6	129.2	174.1	-23.5	34.1	0	0	0	111.2	V418	P416-V418 PolarHBondContact O-N 2.9Å
417	R	35.8	Very low	39.7	Very low	207 Å²	207	150.2 Å²	150.2	78%	0.781	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-75.9	121.6	174.3	-167.8	176.4	-165.8	-143.6	15.9	108.8	L415 E419	L415-R417 PolarHBondContact O-N 3.33Å; R417-E419 WeakPolarHBondContact CD-OE1 3.28Å; R417-E419 IonicContact CZ-OE1 2.68Å; R417-E419 IonicContact NE-OE1 2.82Å; R417-E419 PolarHBondContact NE-OE1 3.26Å; R417-E419 IonicContact NH1-OE1 3.24Å; R417-E419 PolarHBondContact NH1-OE1 3.12Å; R417-E419 PolarHBondContact O-N 3.48Å
418	V	44.1	Very low	39.3	Very low	138 Å²	138	148 Å²	148	84%	0.836	78%	0.777	S	S	*	*			trans	-80.1	103.2	169.9	-177.9	0	0	0	0	107.7	P416	P416-V418 PolarHBondContact O-N 2.9Å
419	E	35.3	Very low	38.6	Very low	123 Å²	123	146.8 Å²	146.8	58%	0.575	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-76.3	132.8	170.6	-66	-75	133.6	0	0	109.5	R417	R417-E419 WeakPolarHBondContact CD-OE1 3.28Å; R417-E419 IonicContact CZ-OE1 2.68Å; R417-E419 IonicContact NE-OE1 2.82Å; R417-E419 PolarHBondContact NE-OE1 3.26Å; R417-E419 IonicContact NH1-OE1 3.24Å; R417-E419 PolarHBondContact NH1-OE1 3.12Å; R417-E419 PolarHBondContact O-N 3.48Å
420	P	40.5	Very low	38.1	Very low	115 Å²	115	144 Å²	144	75%	0.747	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-75.4	145.7	175.7	31.5	-34.1	0	0	0	111.4	A422	P420-A422 PolarHBondContact O-N 3.47Å
421	A	38.5	Very low	37.4	Very low	108 Å²	108	141.7 Å²	141.7	89%	0.893	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-72	126.5	-176.3	0	0	0	0	0	113.1
422	A	35.6	Very low	36.7	Very low	102 Å²	102	141.1 Å²	141.1	84%	0.843	78%	0.779	S	S	*	*			trans	-122.5	149.2	162.7	0	0	0	0	0	109.4	P420	P420-A422 PolarHBondContact O-N 3.47Å
423	Q	34.2	Very low	35.9	Very low	155 Å²	155	137.8 Å²	137.8	72%	0.724	77%	0.769	S	S	*	*			trans	-111.7	149.4	-166.7	-56.5	-177.6	1.8	0	0	113
424	R	30.5	Very low	35.3	Very low	222 Å²	222	133.2 Å²	133.2	84%	0.838	77%	0.768	S	S	*	*			trans	70.7	148.5	161.2	-61.9	161.8	-162.9	-152.9	0.8	114.6
425	S	30.3	Very low	34.7	Very low	102 Å²	102	136.2 Å²	136.2	71%	0.713	77%	0.769	S	S	*	*			cis	-157.9	161.8	-2	37.4	0	0	0	0	112.5
426	S	32.3	Very low	34.1	Very low	107 Å²	107	138.5 Å²	138.5	75%	0.748	77%	0.772	S	S	*	*			trans	53.6	110.8	148.9	58.2	0	0	0	0	120.7
427	Q	30	Very low	33.3	Very low	178 Å²	178	138.9 Å²	138.9	83%	0.832	77%	0.772	S	S	*	*			trans	-91.6	159.5	138.9	-68.2	-174.3	-11.4	0	0	109.3
428	P	42.8	Very low	33	Very low	124 Å²	124	138.1 Å²	138.1	81%	0.805	78%	0.78	S	S	*	*				-120.6	150.1	92.1	0.8	20.6	0	0	0	111.4
429	A	28.5	Very low	32.5	Very low	76 Å²	76	136.3 Å²	136.3	63%	0.628	77%	0.768	S	S	*	*			cis	101.2	102.8	40	0	0	0	0	0	112.9
430	N	30.6	Very low	32.2	Very low	160 Å²	160	134.7 Å²	134.7	86%	0.856	78%	0.776	S	S	*	*			trans	-174	134.3	153.4	-93.1	-22.3	0	0	0	105.6
431	A	30.7	Very low	31.7	Very low	85 Å²	85	136.6 Å²	136.6	70%	0.702	78%	0.778	S	S	*	*			cis	70.2	123.1	46.7	0	0	0	0	0	111.9
432	D	29.7	Very low	31.2	Very low	142 Å²	142	137 Å²	137	76%	0.759	78%	0.775	S	S	*	*			cis	-154.4	166	0.9	-160.6	12	0	0	0	113.6
433	L	29.7	Very low	30.9	Very low	118 Å²	118	140.8 Å²	140.8	62%	0.618	78%	0.775	S	S	*	*			trans	20.3	127.4	157.3	-114.4	63.7	0	0	0	121.6
434	T	32.9	Very low	30.8	Very low	137 Å²	137	142 Å²	142	84%	0.84	78%	0.78	S	S	*	*				-164.5	100.9	110.1	12.7	0	0	0	0	115.9
435	K	32.5	Very low	30.6	Very low	182 Å²	182	138.9 Å²	138.9	79%	0.791	78%	0.779	S	S	*	*			trans	26.8	105.5	142.7	-59.4	175.9	-178.4	174.8	0	120.1
436	K	28.4	Very low	30.5	Very low	210 Å²	210	142.7 Å²	142.7	91%	0.913	79%	0.786	S	S	*	*				-163.8	98.3	116	-116.1	178.7	-178.7	178.5	0	112.2
437	T	27	Very low	30.4	Very low	125 Å²	125	142 Å²	142	77%	0.767	79%	0.786	S	S	*	*			trans	-149.9	115.2	172.9	-38.3	0	0	0	0	110.9	V439	T437-V439 HydrophobicContact CG2-CG2 3.98Å
438	M	29.1	Very low	30.5	Very low	192 Å²	192	143.5 Å²	143.5	95%	0.946	79%	0.79	S	S	*	*			trans	-130.2	97.2	149.1	-85.7	-175.8	167.4	0	0	104.1
439	V	32.6	Very low	30	Very low	99 Å²	99	145.9 Å²	145.9	60%	0.6	79%	0.79	S	S	*	*				66.5	78.1	71.1	-173.6	0	0	0	0	110.9	T437 I441	T437-V439 HydrophobicContact CG2-CG2 3.98Å; V439-I441 WeakPolarHBondContact CG1-O 3.33Å
440	A	28.9	Very low	30.2	Very low	89 Å²	89	149.1 Å²	149.1	74%	0.736	80%	0.795	S	S	*	*	S	Bend		-70.8	167.2	126	0	0	0	0	0	108.7
441	I	30.1	Very low	30.1	Very low	155 Å²	155	150.2 Å²	150.2	80%	0.795	80%	0.796	S	S	*	*			trans	77.7	91.4	-170.9	-46	166.8	0	0	0	113.6	V439	V439-I441 WeakPolarHBondContact CG1-O 3.33Å
442	S	28.6	Very low	29.9	Very low	116 Å²	116	155 Å²	155	81%	0.811	80%	0.804	S	S	*	*			trans	-164.3	94.3	134.9	-83.8	0	0	0	0	109.8
443	H	30.1	Very low	30	Very low	182 Å²	182	156.9 Å²	156.9	84%	0.843	81%	0.807	S	S	*	*			trans	-148	46.2	161.4	-146.6	-68.3	0	0	0	111.6
444	H	30.4	Very low	30	Very low	180 Å²	180	159.9 Å²	159.9	83%	0.833	82%	0.815	S	S	*	*			trans	-138.6	45.4	169.8	-152.6	59.8	0	0	0	113.6
445	L	26.7	Very low	29.6	Very low	157 Å²	157	162 Å²	162	82%	0.822	82%	0.818	S	S	*	*			trans	-132.8	145	139.6	-71	98.9	0	0	0	104.5
446	E	28.4	Very low	29.5	Very low	183 Å²	183	158.7 Å²	158.7	86%	0.855	81%	0.813	S	S	*	*			cis	-112	-177.8	4.2	-60.6	147.3	121.8	0	0	109.8
447	A	30.8	Very low	29.5	Very low	91 Å²	91	157.2 Å²	157.2	75%	0.752	81%	0.809	S	S	*	*			cis	-147.8	133.6	9.9	0	0	0	0	0	112.8
448	K	32.1	Very low	29.5	Very low	211 Å²	211	155.4 Å²	155.4	92%	0.917	81%	0.808	S	S	*	*			trans	-154.5	58.4	147.9	-140.6	178.1	-174	-177.6	0	113.7
449	Q	31.3	Very low	29.5	Very low	174 Å²	174	153.8 Å²	153.8	81%	0.813	80%	0.803	S	S	*	*			trans	-115.6	126.9	154.2	-83	-179.4	-28.9	0	0	106.7
450	I	32.8	Very low	29.2	Very low	143 Å²	143	153.3 Å²	153.3	73%	0.733	80%	0.804	S	S	*	*				62	92.1	78.4	-61.7	174	0	0	0	108.4
451	Q	28.5	Very low	29.3	Very low	184 Å²	184	158.2 Å²	158.2	86%	0.86	81%	0.811	S	S	*	*				66.4	44	74.1	-166.6	69.1	26.2	0	0	112.9
452	Q	28	Very low	29.2	Very low	186 Å²	186	160 Å²	160	87%	0.869	81%	0.813	S	S	*	*			trans	-156.1	93.5	152.1	-145	167.1	36	0	0	115.7
453	Q	30.5	Very low	29.1	Very low	180 Å²	180	162 Å²	162	84%	0.841	81%	0.81	S	S	*	*	S	Bend	trans	-166.1	122.8	142.5	-112.5	174.5	56.8	0	0	110.6
454	K	31	Very low	29.1	Very low	181 Å²	181	160.2 Å²	160.2	79%	0.787	80%	0.802	S	S	*	*			trans	50.7	114.5	167.9	-58	-178.6	-178.8	-179.2	0	116.3
455	M	24.6	Very low	28.9	Very low	183 Å²	183	158.8 Å²	158.8	90%	0.901	80%	0.801	S	S	*	*			cis	57.7	73.6	19.2	-158.2	-171.8	-64.8	0	0	114.5
456	T	29.8	Very low	28.8	Very low	111 Å²	111	158.4 Å²	158.4	68%	0.681	80%	0.799	S	S	*	*			trans	-140.9	105.1	141.3	40.6	0	0	0	0	104.5
457	E	28.8	Very low	30.3	Very low	179 Å²	179	154.6 Å²	154.6	84%	0.836	79%	0.79	S	S	*	*				66.1	99.4	105	-68.3	178.5	143.7	0	0	112.2
458	A	27	Very low	30.9	Very low	88 Å²	88	156.3 Å²	156.3	73%	0.727	79%	0.794	S	S	*	*				83.5	85.8	56.6	0	0	0	0	0	114.2
459	N	28.1	Very low	30.7	Very low	157 Å²	157	150.5 Å²	150.5	84%	0.84	79%	0.786	S	S	*	*			trans	-159.7	151.7	138.5	-96.9	-41.5	0	0	0	107
460	S	26.6	Very low	30.4	Very low	90 Å²	90	149.8 Å²	149.8	63%	0.629	79%	0.787	S	S	*	*			cis	139.2	153.1	-1.7	-86.1	0	0	0	0	105.3
461	Q	31.7	Very low	30.2	Very low	191 Å²	191	148.8 Å²	148.8	89%	0.893	79%	0.787	S	S	*	*			trans	72.8	110.1	-172	-49.6	172.4	-5.4	0	0	111.6
462	K	28	Very low	30.3	Very low	192 Å²	192	147 Å²	147	84%	0.835	78%	0.784	S	S	*	*			cis	78	133.8	21.4	-153.2	-173.6	-177.9	-178.8	0	113.6
463	Q	27	Very low	30.9	Very low	158 Å²	158	143.8 Å²	143.8	74%	0.738	78%	0.779	S	S	*	*			trans	84.1	152.7	179	-51.8	-173.2	68	0	0	113.9
464	Q	28.7	Very low	30.7	Very low	145 Å²	145	138.8 Å²	138.8	68%	0.678	77%	0.769	S	S	*	*			cis	-155.3	150.1	10.9	-144.3	169.4	57.6	0	0	114.2
465	N	27.5	Very low	30.5	Very low	150 Å²	150	139.8 Å²	139.8	80%	0.802	77%	0.774	S	S	*	*			trans	55.7	161.8	147.7	-72.2	4.4	0	0	0	125
466	N	24.4	Very low	31.6	Very low	149 Å²	149	135.8 Å²	135.8	80%	0.797	76%	0.761	S	S	*	*			trans	-108	-161.5	176.7	-150.3	5.8	0	0	0	109.2
467	P	58.5	Low	31.6	Very low	103 Å²	103	136.5 Å²	136.5	67%	0.669	76%	0.761	S	S	*	*			trans	-97.3	-165.9	-138.9	45	-29.3	0	0	0	112.8
468	P	43.3	Very low	31.7	Very low	127 Å²	127	135.7 Å²	135.7	83%	0.825	76%	0.757	S	S	*	*				-142.7	-168.6	73.2	38.7	-19.1	0	0	0	114.2
469	A	28	Very low	32	Very low	90 Å²	90	135.5 Å²	135.5	74%	0.744	75%	0.746	S	S	*	*			trans	-93.3	168.2	172.6	0	0	0	0	0	112.1
470	D	25.5	Very low	32.6	Very low	159 Å²	159	133.4 Å²	133.4	85%	0.85	74%	0.741	S	S	*	*			trans	-160.9	-175	131.1	-132.6	-40.9	0	0	0	113.6
471	V	28.3	Very low	32.8	Very low	121 Å²	121	135.5 Å²	135.5	73%	0.733	74%	0.741	S	S	*	*			trans	-99	161.7	-158.8	170.5	0	0	0	0	115.5
472	N	31.6	Very low	32.5	Very low	146 Å²	146	134 Å²	134	78%	0.781	73%	0.734	S	S	*	*			trans	-13.2	149.6	161	-84.2	-43	0	0	0	118.3
473	P	41.2	Very low	32.4	Very low	119 Å²	119	131.6 Å²	131.6	77%	0.773	73%	0.729	S	S	*	*				-157.8	164.1	58.6	42.9	-21.9	0	0	0	121.8
474	A	26.1	Very low	33.2	Very low	76 Å²	76	128.9 Å²	128.9	63%	0.628	73%	0.725	S	S	*	*			trans	53.6	116	136.6	0	0	0	0	0	124.6
475	F	25.7	Very low	33	Very low	202 Å²	202	129.9 Å²	129.9	89%	0.886	73%	0.734	S	S	*	*				55.3	166.1	121.8	-73.2	-64.3	0	0	0	122.9
476	P	48.4	Very low	33.6	Very low	98 Å²	98	130.5 Å²	130.5	64%	0.636	74%	0.737	S	S	*	*			cis	-134.3	-168.3	-20.7	31.2	-8.8	0	0	0	114.7
477	N	29	Very low	33.7	Very low	127 Å²	127	129.5 Å²	129.5	68%	0.679	74%	0.741	S	S	*	*			trans	109.7	137.3	152.4	-66.3	-10.9	0	0	0	119.1
478	Q	31	Very low	32.2	Very low	162 Å²	162	133.4 Å²	133.4	76%	0.757	75%	0.748	S	S	*	*			cis	-158.2	164.8	-22.3	-125.3	178.4	62.4	0	0	112.9
479	V	32.6	Very low	31.3	Very low	83 Å²	83	135.8 Å²	135.8	50%	0.503	75%	0.748	S	S	.	*			trans	-39.9	159.1	176.9	-96.7	0	0	0	0	117.5
480	P	42.4	Very low	31.2	Very low	113 Å²	113	138.4 Å²	138.4	73%	0.734	75%	0.754	S	S	*	*			cis	-86.1	-177.3	44.9	-18.5	35.7	0	0	0	117.1
481	H	29.9	Very low	31.1	Very low	134 Å²	134	134.5 Å²	134.5	62%	0.62	75%	0.751	S	S	*	*			cis	139.9	140.6	-26.2	-66.9	-48.7	0	0	0	107.9
482	H	25.2	Very low	31.2	Very low	160 Å²	160	133.3 Å²	133.3	74%	0.741	75%	0.754	S	S	*	*			cis	-156.1	156.5	-23.6	-91.2	-55.5	0	0	0	105.9
483	L	25.2	Very low	31.9	Very low	142 Å²	142	131.7 Å²	131.7	74%	0.743	75%	0.752	S	S	*	*			cis	78.5	146.4	32.6	-67.4	170.7	0	0	0	114.8
484	P	44.8	Very low	31.7	Very low	101 Å²	101	131.7 Å²	131.7	66%	0.656	75%	0.749	S	S	*	*			cis	-141.8	176.5	-0.7	41.3	-22.3	0	0	0	118.8
485	L	25.4	Very low	31.9	Very low	165 Å²	165	134.9 Å²	134.9	86%	0.864	76%	0.756	S	S	*	*			trans	81.4	145.7	138.2	-89.2	159.5	0	0	0	124.3
486	L	39.1	Very low	32.2	Very low	164 Å²	164	130.9 Å²	130.9	86%	0.859	75%	0.748	S	S	*	*			trans	-95.5	152.6	165.1	-104.7	73.3	0	0	0	110.6
487	S	25.6	Very low	31.2	Very low	127 Å²	127	132.3 Å²	132.3	89%	0.888	75%	0.75	S	S	*	*			trans	-152.5	-178	168.2	-161.3	0	0	0	0	113.2
488	K	28.1	Very low	31.5	Very low	186 Å²	186	133.7 Å²	133.7	81%	0.809	75%	0.754	S	S	*	*			trans	-109.2	157	-166.7	-54.8	174.5	-179.7	176.4	0	114.1
489	H	24.8	Very low	32.3	Very low	176 Å²	176	131.4 Å²	131.4	82%	0.815	75%	0.753	S	S	*	*			trans	35.9	133.1	142.1	-82.2	-66.7	0	0	0	123.1
490	V	24.9	Very low	32.4	Very low	145 Å²	145	133 Å²	133	88%	0.879	77%	0.768	S	S	*	*			trans	76.3	124.5	145.2	175.4	0	0	0	0	118.3
491	G	24.5	Very low	31.8	Very low	77 Å²	77	131.2 Å²	131.2	79%	0.794	76%	0.763	S	S	*	*			trans	147.6	125.3	163	0	0	0	0	0	114.7
492	A	28.9	Very low	31.9	Very low	96 Å²	96	132 Å²	132	79%	0.793	77%	0.772	S	S	*	*			trans	-120.7	-174.9	165.3	0	0	0	0	0	107.6
493	P	47.8	Very low	32.3	Very low	113 Å²	113	127.8 Å²	127.8	73%	0.734	76%	0.761	S	S	*	*			cis	-145.5	-163.3	10	30.4	-2.2	0	0	0	116.7
494	V	37	Very low	32.8	Very low	119 Å²	119	125 Å²	125	72%	0.721	75%	0.746	S	S	*	*			trans	79.8	145.9	155	-101.2	0	0	0	0	125.4
495	D	29.5	Very low	32.3	Very low	143 Å²	143	125 Å²	125	77%	0.765	75%	0.749	S	S	*	*			trans	69.6	141.6	155.8	-59.5	-16.6	0	0	0	122
496	V	31.2	Very low	32.6	Very low	118 Å²	118	120.3 Å²	120.3	72%	0.715	74%	0.74	S	S	*	*			cis	-159.7	152.1	-13.6	125.2	0	0	0	0	110.9
497	D	28.5	Very low	32.1	Very low	127 Å²	127	121.6 Å²	121.6	68%	0.679	74%	0.742	S	S	*	*			trans	44.4	114.1	162.8	-75.2	-33.7	0	0	0	125
498	M	35.6	Very low	33.2	Very low	156 Å²	156	120.5 Å²	120.5	77%	0.768	73%	0.732	S	S	*	*				48.2	141.6	106.8	-170.2	159.5	51	0	0	120.3
499	P	46.8	Very low	33.8	Very low	114 Å²	114	119.7 Å²	119.7	74%	0.74	73%	0.731	S	S	*	*			cis	-107.1	-174.5	-0.5	4.2	22	0	0	0	112.1
500	S	34.5	Very low	33.8	Very low	116 Å²	116	116.8 Å²	116.8	81%	0.811	73%	0.725	S	S	*	*			cis	-172.6	179	-3.8	-105.3	0	0	0	0	106.4
501	A	31.2	Very low	34	Very low	77 Å²	77	117 Å²	117	64%	0.636	72%	0.72	S	S	*	*			cis	173.4	164.7	-26.3	0	0	0	0	0	105.7
502	N	30.7	Very low	34.4	Very low	149 Å²	149	118.8 Å²	118.8	80%	0.797	71%	0.711	S	S	*	*			cis	-173	166	-18.6	-102.4	48.3	0	0	0	103.9
503	S	33.7	Very low	34.1	Very low	73 Å²	73	118.1 Å²	118.1	51%	0.51	69%	0.694	S	S	.	*			cis	-174.7	153.8	-19.9	-98.4	0	0	0	0	105.9
504	D	36	Very low	33.1	Very low	82 Å²	82	116.5 Å²	116.5	44%	0.439	68%	0.682	S	S	.	*			cis	-147.6	-138.6	-2.8	-139.9	-80.2	0	0	0	112.3	L903	D504-L903 WeakPolarHBondContact OD2-CD1 3.46Å
505	S	35.5	Very low	32.5	Very low	103 Å²	103	116.4 Å²	116.4	72%	0.72	68%	0.682	S	S	*	*			trans	-137.3	-145.1	-171	60.1	0	0	0	0	112.7
506	G	31.2	Very low	33	Very low	65 Å²	65	114.6 Å²	114.6	67%	0.67	68%	0.678	S	S	*	*			trans	-167.7	-166.3	-175.5	0	0	0	0	0	116.4
507	Q	28.1	Very low	32.7	Very low	192 Å²	192	115 Å²	115	90%	0.897	68%	0.681	S	S	*	*			trans	82.3	-177.6	-172.7	-53.1	-157	-45.3	0	0	115
508	P	49.5	Very low	32.6	Very low	103 Å²	103	113.7 Å²	113.7	67%	0.669	68%	0.682	S	S	*	*				-133.2	179	-75.3	41.2	-26.9	0	0	0	116.1
509	E	39.2	Very low	32.2	Very low	169 Å²	169	111.3 Å²	111.3	79%	0.79	68%	0.676	S	S	*	*			trans	40.5	132.3	151.9	-68.1	175.7	-171.2	0	0	122.7
510	T	25.8	Very low	31.3	Very low	115 Å²	115	113.9 Å²	113.9	71%	0.706	68%	0.678	S	S	*	*				163.6	142.3	110.4	41.4	0	0	0	0	116.6
511	I	28.9	Very low	30.9	Very low	150 Å²	150	115.9 Å²	115.9	77%	0.769	68%	0.679	S	S	*	*			trans	55.6	-169.8	160.6	-0.2	-174.4	0	0	0	122.6
512	D	32.5	Very low	30.6	Very low	114 Å²	114	116.3 Å²	116.3	61%	0.61	68%	0.683	S	S	*	*			trans	-152.7	168.4	-140.6	179.2	28.1	0	0	0	112.6	D896	D512-D896 PolarHBondContact O-N 2.74Å
513	L	23.9	Very low	31.1	Very low	83 Å²	83	115.1 Å²	115.1	44%	0.435	68%	0.683	S	S	.	*			trans	136.6	99.7	149.4	-74.1	164.2	0	0	0	118.2
514	T	26.6	Very low	30.8	Very low	79 Å²	79	116.5 Å²	116.5	49%	0.485	69%	0.693	S	S	.	*			trans	62.9	144.7	135.7	50.5	0	0	0	0	125.2	S894	T514-S894 PolarHBondContact O-OG 2.98Å; T514-S894 WeakPolarHBondContact OG1-CA 3.08Å; T514-S894 PolarHBondContact OG1-N 3.19Å; T514-S894 PolarHBondContact OG1-OG 2.77Å
515	T	24.1	Very low	30.3	Very low	116 Å²	116	121.2 Å²	121.2	71%	0.712	71%	0.713	S	S	*	*			trans	73.5	158.8	151.7	37.6	0	0	0	0	120.7	S894	T515-S894 PolarHBondContact OG1-OG 3.43Å
516	P	40	Very low	29.9	Very low	106 Å²	106	121 Å²	121	69%	0.688	71%	0.708	S	S	*	*			cis	-143.8	169.9	-20.4	38.2	-18.8	0	0	0	117.9
517	V	24.9	Very low	29.6	Very low	126 Å²	126	125.2 Å²	125.2	76%	0.764	71%	0.712	S	S	*	*			trans	64.2	126.9	134	165.8	0	0	0	0	124.3
518	S	26	Very low	29.6	Very low	100 Å²	100	125.4 Å²	125.4	70%	0.699	70%	0.704	S	S	*	*			trans	69	157	148.5	-73.1	0	0	0	0	121.4
519	T	26.8	Very low	28.6	Very low	105 Å²	105	127.3 Å²	127.3	64%	0.644	71%	0.708	S	S	*	*			cis	-159.9	155.1	-3.2	8	0	0	0	0	112.3
520	Q	28.3	Very low	28	Very low	168 Å²	168	122.5 Å²	122.5	79%	0.785	71%	0.705	S	S	*	*			trans	64.1	153.1	150.5	-75.4	157.2	-10.2	0	0	117.7
521	D	25.6	Very low	28.1	Very low	158 Å²	158	126.9 Å²	126.9	85%	0.845	72%	0.717	S	S	*	*			cis	-135	175.2	32.6	-106.6	-42.5	0	0	0	115.9
522	A	25	Very low	27.9	Very low	87 Å²	87	123.2 Å²	123.2	72%	0.719	72%	0.716	S	S	*	*			trans	-119.5	158.1	178.5	0	0	0	0	0	113.3
523	P	42.2	Very low	27.6	Very low	123 Å²	123	125.9 Å²	125.9	80%	0.799	73%	0.725	S	S	*	*				-147.1	175.5	109.8	32.8	-14.4	0	0	0	113.7
524	S	26.3	Very low	27.8	Very low	103 Å²	103	130.4 Å²	130.4	72%	0.72	74%	0.744	S	S	*	*			cis	-171.6	172.3	-26.3	-87.2	0	0	0	0	109.4
525	E	26.2	Very low	27.8	Very low	180 Å²	180	130.5 Å²	130.5	84%	0.841	76%	0.76	S	S	*	*			trans	68	141.2	166.6	-54.2	-158.1	143.5	0	0	119
526	T	26.9	Very low	28	Very low	100 Å²	100	132.7 Å²	132.7	61%	0.613	77%	0.766	S	S	*	*			cis	-166.4	137.1	-24.7	27.3	0	0	0	0	110.8
527	M	25.6	Very low	28.2	Very low	153 Å²	153	132.8 Å²	132.8	75%	0.754	77%	0.767	S	S	*	*			trans	62.5	151.4	145.5	-54.6	-70.7	165.7	0	0	118.5
528	R	27.5	Very low	28.3	Very low	195 Å²	195	130.8 Å²	130.8	74%	0.736	76%	0.764	S	S	*	*			cis	-164	167.8	-4.6	-115.4	-178.7	-154.5	-164.7	7.4	112.1
529	D	27.7	Very low	28.4	Very low	143 Å²	143	132.4 Å²	132.4	77%	0.765	76%	0.763	S	S	*	*			trans	0.9	158	145.6	-28.2	-35.5	0	0	0	120.5
530	G	26.4	Very low	28.4	Very low	69 Å²	69	136 Å²	136	71%	0.711	77%	0.772	S	S	*	*			cis	161.8	162.7	-2	0	0	0	0	0	114.7
531	E	27.9	Very low	28.4	Very low	206 Å²	206	133 Å²	133	96%	0.963	77%	0.77	S	S	*	*			trans	63	134.7	156	-54.2	-164.5	126.9	0	0	125.7
532	G	26.4	Very low	28.5	Very low	73 Å²	73	133.7 Å²	133.7	75%	0.753	77%	0.768	S	S	*	*			trans	89.8	162.5	142.2	0	0	0	0	0	121.1
533	Q	26.2	Very low	29.2	Very low	170 Å²	170	134.1 Å²	134.1	79%	0.794	76%	0.764	S	S	*	*			cis	-167.9	153.5	-34.4	-146.3	178.9	-63.8	0	0	111.5
534	E	27.1	Very low	28.5	Very low	179 Å²	179	136.6 Å²	136.6	84%	0.836	77%	0.767	S	S	*	*			trans	65.4	164.3	163.6	-45	-161.5	151.4	0	0	120.6
535	G	26.2	Very low	28.5	Very low	80 Å²	80	139.6 Å²	139.6	83%	0.825	77%	0.769	S	S	*	*			trans	142.5	38.6	163.8	0	0	0	0	0	124.2
536	I	28.5	Very low	29.3	Very low	163 Å²	163	135.7 Å²	135.7	84%	0.836	76%	0.759	S	S	*	*			trans	-38.8	156.1	161.4	-92.2	166.4	0	0	0	115.5
537	P	44.9	Very low	29.3	Very low	108 Å²	108	137.4 Å²	137.4	70%	0.701	77%	0.765	S	S	*	*			cis	-148.1	-163.8	-15.8	41	-18.6	0	0	0	117.2
538	A	27.5	Very low	29.3	Very low	84 Å²	84	133.9 Å²	133.9	69%	0.694	76%	0.76	S	S	*	*			trans	77.2	159.2	137.9	0	0	0	0	0	120.5
539	I	27.8	Very low	29.4	Very low	133 Å²	133	131.1 Å²	131.1	68%	0.682	77%	0.765	S	S	*	*			cis	-166	155	-10.9	-114.2	171.8	0	0	0	111.3
540	Q	27.2	Very low	29.9	Very low	180 Å²	180	130.5 Å²	130.5	84%	0.841	77%	0.768	S	S	*	*			trans	61.2	164.2	161.5	-80.5	159.6	16.3	0	0	118.9
541	S	28	Very low	29.9	Very low	106 Å²	106	131.7 Å²	131.7	74%	0.741	77%	0.766	S	S	*	*			cis	-158.7	175.1	-20.2	55	0	0	0	0	111.6
542	Q	26	Very low	29.9	Very low	172 Å²	172	127 Å²	127	80%	0.804	75%	0.752	S	S	*	*			trans	-70.7	-169.2	159	-47.7	-177	-22.1	0	0	110.8
543	P	41.7	Very low	29.9	Very low	97 Å²	97	132.4 Å²	132.4	63%	0.63	76%	0.757	S	S	*	*			cis	-141.9	-162.9	-0.1	27.7	0	0	0	0	115.9
544	M	25.6	Very low	29.9	Very low	175 Å²	175	128.1 Å²	128.1	86%	0.862	75%	0.751	S	S	*	*			trans	104.1	96.2	148.4	-56.3	-148.9	-173.4	0	0	120.6
545	E	28.1	Very low	29.9	Very low	165 Å²	165	128.4 Å²	128.4	77%	0.771	75%	0.752	S	S	*	*				-36.3	155	124	-90.6	-103.7	168	0	0	112.7
546	P	42	Very low	30.1	Very low	98 Å²	98	131.7 Å²	131.7	64%	0.636	76%	0.757	S	S	*	*			cis	-155.5	-173.6	46.8	43	-21.5	0	0	0	119.2
547	N	26.4	Very low	30	Very low	137 Å²	137	132.3 Å²	132.3	73%	0.733	76%	0.758	S	S	*	*			trans	76.4	109.2	141.5	-79.6	-27	0	0	0	122.2
548	A	26.5	Very low	29.3	Very low	79 Å²	79	134.1 Å²	134.1	65%	0.653	77%	0.767	S	S	*	*				66.5	114.2	110.8	0	0	0	0	0	122.3
549	V	30.1	Very low	29.3	Very low	136 Å²	136	134.1 Å²	134.1	82%	0.824	77%	0.767	S	S	*	*				42.1	116.2	113.1	180	0	0	0	0	116.7
550	P	37.6	Very low	29.5	Very low	130 Å²	130	135.6 Å²	135.6	84%	0.844	78%	0.776	S	S	*	*				-142.2	-171.2	90.1	40.2	-25.3	0	0	0	116.1
551	S	26.7	Very low	30.3	Very low	95 Å²	95	132.3 Å²	132.3	66%	0.664	77%	0.77	S	S	*	*			trans	-120.5	179.9	-157.9	59.6	0	0	0	0	115
552	T	26.6	Very low	30.4	Very low	107 Å²	107	133.9 Å²	133.9	66%	0.656	78%	0.775	S	S	*	*			trans	73.1	121.9	148	34.1	0	0	0	0	121.2
553	Q	27	Very low	30.6	Very low	186 Å²	186	130.7 Å²	130.7	87%	0.869	77%	0.772	S	S	*	*			trans	71.8	148.4	143.4	-62.3	172.5	24.8	0	0	118.2
554	A	26.4	Very low	30.2	Very low	81 Å²	81	133 Å²	133	67%	0.669	78%	0.784	S	S	*	*			cis	-163.2	150.9	-20.2	0	0	0	0	0	112.1
555	Q	28.3	Very low	30.8	Very low	185 Å²	185	129.9 Å²	129.9	86%	0.864	78%	0.777	S	S	*	*			trans	43.8	120.8	151.2	-62.7	177.9	5.9	0	0	122
556	T	28.7	Very low	31.2	Very low	149 Å²	149	127.4 Å²	127.4	91%	0.914	78%	0.778	S	S	*	*				-158.2	170.9	127.1	1.6	0	0	0	0	109.9
557	M	28	Very low	30.8	Very low	176 Å²	176	130.8 Å²	130.8	87%	0.867	79%	0.79	S	S	*	*			trans	-127.2	147.8	-156.5	-46.4	-179	78.5	0	0	115.3
558	T	28.6	Very low	31.3	Very low	145 Å²	145	129.8 Å²	129.8	89%	0.89	79%	0.793	S	S	*	*			trans	-165.1	133.1	133.3	16.5	0	0	0	0	115.3
559	A	28	Very low	31.9	Very low	84 Å²	84	133.4 Å²	133.4	69%	0.694	80%	0.801	S	S	*	*			trans	32.4	115.2	148.2	0	0	0	0	0	124.4
560	L	31.4	Very low	32.5	Very low	165 Å²	165	129.9 Å²	129.9	86%	0.864	78%	0.782	S	S	*	*				43.2	157.7	110.9	-69.7	160.7	0	0	0	122.3
561	P	44.1	Very low	32.9	Very low	111 Å²	111	127.8 Å²	127.8	72%	0.721	78%	0.776	S	S	*	*			cis	-121.3	-170.7	-15.7	34.9	-14.2	0	0	0	111.1
562	T	31.4	Very low	33.8	Very low	138 Å²	138	126.8 Å²	126.8	85%	0.847	77%	0.773	S	S	*	*			cis	-138.7	178.6	19.8	49.5	0	0	0	0	112.1
563	S	30.1	Very low	34.7	Very low	105 Å²	105	126.6 Å²	126.6	73%	0.734	77%	0.765	S	S	*	*			trans	-148.7	158.9	-170.8	59	0	0	0	0	114.7
564	V	32.3	Very low	35.9	Very low	147 Å²	147	122.6 Å²	122.6	89%	0.891	75%	0.753	S	S	*	*			trans	-147.1	120.3	150.6	-96.2	0	0	0	0	108.8
565	P	39.8	Very low	36.6	Very low	109 Å²	109	125.8 Å²	125.8	71%	0.708	75%	0.754	S	S	*	*			trans	-107.1	167.9	-171.2	40.1	-35.8	0	0	0	114.7
566	S	36.4	Very low	37.2	Very low	113 Å²	113	121 Å²	121	79%	0.79	74%	0.741	S	S	*	*			trans	-77.5	160.8	159.9	53.2	0	0	0	0	111.6
567	L	32.8	Very low	37.7	Very low	169 Å²	169	120 Å²	120	89%	0.885	73%	0.73	S	S	*	*			trans	-137.6	130.7	173.6	-75.8	176.8	0	0	0	112.4
568	S	35.9	Very low	38.1	Very low	116 Å²	116	115.5 Å²	115.5	81%	0.811	72%	0.715	S	S	*	*			trans	-108.3	148.8	162.3	51.4	0	0	0	0	109.5
569	L	40.3	Very low	38.6	Very low	155 Å²	155	115.4 Å²	115.4	81%	0.812	71%	0.705	S	S	*	*			trans	-86.2	147.2	-174.9	-77.3	165.6	0	0	0	112.7
570	S	42.7	Very low	39	Very low	61 Å²	61	115.3 Å²	115.3	43%	0.427	70%	0.704	S	S	.	*			trans	-103.7	153.4	-178.3	72.9	0	0	0	0	113	A572 Q573	S570-A572 PolarHBondContact O-N 3.38Å; S570-A572 VanDerWaalsContact O-N 3.13Å; S570-Q573 PolarHBondContact O-N 2.65Å; S570-Q573 PolarHBondContact OG-OE1 3.29Å
571	A	46.3	Very low	39.2	Very low	86 Å²	86	114.9 Å²	114.9	71%	0.711	70%	0.702	S	S	*	*	H	α-helix	trans	-60.4	-25.9	-174.8	0	0	0	0	0	114.6	Q573	A571-Q573 VanDerWaalsContact C-N 3.32Å; A571-Q573 PolarHBondContact O-N 3.36Å
572	A	43.8	Very low	38.7	Very low	74 Å²	74	113.7 Å²	113.7	61%	0.612	70%	0.696	S	S	*	*	H	α-helix	trans	-68.3	-28.8	177.1	0	0	0	0	0	113.1	S570 V574	S570-A572 PolarHBondContact O-N 3.38Å; S570-A572 VanDerWaalsContact O-N 3.13Å; A572-V574 VanDerWaalsContact C-N 3.33Å; A572-V574 PolarHBondContact O-N 3.32Å
573	Q	47.1	Very low	38.8	Very low	103 Å²	103	115.5 Å²	115.5	48%	0.481	69%	0.694	S	S	.	*	H	α-helix	trans	-76	-22.5	-177.4	-67.5	162.7	-66.1	0	0	112.4	S570 A571	S570-Q573 PolarHBondContact O-N 2.65Å; S570-Q573 PolarHBondContact OG-OE1 3.29Å; A571-Q573 VanDerWaalsContact C-N 3.32Å; A571-Q573 PolarHBondContact O-N 3.36Å
574	V	50.7	Low	38.9	Very low	103 Å²	103	115.7 Å²	115.7	62%	0.624	70%	0.696	S	S	*	*	H	α-helix	trans	-70.4	-33.1	176.9	-177.9	0	0	0	0	111.8	A572	A572-V574 VanDerWaalsContact C-N 3.33Å; A572-V574 PolarHBondContact O-N 3.32Å
575	Q	42.9	Very low	38.8	Very low	147 Å²	147	117 Å²	117	69%	0.687	70%	0.697	S	S	*	*	H	α-helix	trans	-76	-29.3	-176.4	-70.6	-174.1	-26.1	0	0	113.6	S578	Q575-S578 PolarHBondContact O-N 3.33Å
576	S	39.2	Very low	38.2	Very low	85 Å²	85	117 Å²	117	59%	0.594	70%	0.699	S	S	*	*	H	α-helix	trans	-66.5	-42.7	176	-173.1	0	0	0	0	112.2	S578 Q579 A580	S576-S578 VanDerWaalsContact C-N 3.26Å; S576-S578 PolarHBondContact O-N 3.38Å; S576-Q579 PolarHBondContact O-N 3.19Å; S576-Q579 VanDerWaalsContact O-N 3.15Å; S576-A580 PolarHBondContact O-N 2.75Å
577	L	39.3	Very low	38	Very low	129 Å²	129	121 Å²	121	68%	0.675	70%	0.702	S	S	*	*	H	α-helix	trans	-65.6	-25.1	177.6	-85.4	157.7	0	0	0	113.7
578	S	37.4	Very low	37.7	Very low	80 Å²	80	120.3 Å²	120.3	56%	0.559	70%	0.699	S	S	*	*	H	α-helix	trans	-70.2	-29.9	174.4	-169.4	0	0	0	0	113.1	Q575 S576 S582	Q575-S578 PolarHBondContact O-N 3.33Å; S576-S578 VanDerWaalsContact C-N 3.26Å; S576-S578 PolarHBondContact O-N 3.38Å; S578-S582 PolarHBondContact O-OG 3.01Å
579	Q	38	Very low	37.4	Very low	144 Å²	144	119.2 Å²	119.2	67%	0.673	70%	0.697	S	S	*	*	H	α-helix	trans	-83.5	-32.6	-176.7	-67.9	-177.3	-14.6	0	0	112.7	S576 L581 S582	S576-Q579 PolarHBondContact O-N 3.19Å; S576-Q579 VanDerWaalsContact O-N 3.15Å; Q579-L581 VanDerWaalsContact C-N 3.29Å; Q579-L581 PolarHBondContact O-N 3.01Å; Q579-S582 PolarHBondContact O-N 3.38Å
580	A	37.9	Very low	36.8	Very low	81 Å²	81	122.9 Å²	122.9	67%	0.669	70%	0.7	S	S	*	*	H	α-helix	trans	-61.9	-32.6	177.9	0	0	0	0	0	113.7	S576	S576-A580 PolarHBondContact O-N 2.75Å
581	L	35.8	Very low	36.5	Very low	157 Å²	157	124.8 Å²	124.8	82%	0.822	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-5.1	179.1	-75.3	167.2	0	0	0	114.2	Q579	Q579-L581 VanDerWaalsContact C-N 3.29Å; Q579-L581 PolarHBondContact O-N 3.01Å
582	S	33.3	Very low	36.1	Very low	85 Å²	85	126.5 Å²	126.5	59%	0.594	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-0.4	-172.1	-66	0	0	0	0	115	S578 Q579	S578-S582 PolarHBondContact O-OG 3.01Å; Q579-S582 PolarHBondContact O-N 3.38Å
583	H	32.1	Very low	36.1	Very low	176 Å²	176	128.3 Å²	128.3	82%	0.815	72%	0.721	S	S	*	*	S	Bend	trans	-113	3.2	-169.3	-94.3	-72.5	0	0	0	117.2
584	S	33.2	Very low	35.3	Very low	110 Å²	110	135 Å²	135	77%	0.769	74%	0.741	S	S	*	*	S	Bend	trans	-133	72	174.5	-163.1	0	0	0	0	113
585	L	30.7	Very low	34.4	Very low	175 Å²	175	134 Å²	134	92%	0.916	74%	0.744	S	S	*	*	S	Bend	trans	176.4	75.4	142.5	-96.8	167	0	0	0	110.5
586	S	27.4	Very low	33.6	Very low	107 Å²	107	131.8 Å²	131.8	75%	0.748	75%	0.751	S	S	*	*			trans	-149.5	123.6	164.2	60.6	0	0	0	0	113
587	K	30.9	Very low	33.2	Very low	198 Å²	198	137.1 Å²	137.1	86%	0.861	77%	0.767	S	S	*	*			trans	164	123.3	165.2	-94.4	161.8	-179.3	178.1	0	105.6
588	N	27.8	Very low	32.6	Very low	154 Å²	154	134.5 Å²	134.5	82%	0.824	77%	0.771	S	S	*	*			cis	-136	161.5	7.9	-78.3	-38.8	0	0	0	112.1
589	A	29	Very low	32.6	Very low	93 Å²	93	137 Å²	137	77%	0.769	78%	0.783	S	S	*	*			trans	-79.3	-172.9	164.2	0	0	0	0	0	110.5
590	R	27.7	Very low	32.2	Very low	232 Å²	232	142 Å²	142	88%	0.875	80%	0.796	S	S	*	*			cis	-176.4	-163.3	32.1	-145.7	-162.8	178.5	173.1	-1.2	108.1
591	P	36.3	Very low	32.4	Very low	101 Å²	101	147.6 Å²	147.6	66%	0.656	81%	0.805	S	S	*	*				-103.6	176.2	-76	34.3	-18.6	0	0	0	114.5
592	P	37.2	Very low	32.4	Very low	122 Å²	122	148.2 Å²	148.2	79%	0.792	80%	0.804	S	S	*	*			trans	-128.6	146.6	155.9	38.3	-26.9	0	0	0	115.7
593	P	44	Very low	33.1	Very low	113 Å²	113	148.7 Å²	148.7	73%	0.734	82%	0.821	S	S	*	*			trans	-90.2	177.5	146.7	38.1	-31.6	0	0	0	110
594	R	29.8	Very low	33.5	Very low	242 Å²	242	143.3 Å²	143.3	91%	0.913	81%	0.807	S	S	*	*			cis	-172.7	158	-24.5	-99.3	-174.3	166.8	-169	-3.9	104.4
595	A	31.6	Very low	34.4	Very low	83 Å²	83	144.4 Å²	144.4	69%	0.686	80%	0.803	S	S	*	*			cis	-170.5	178.5	-19.5	0	0	0	0	0	107.7
596	A	27.8	Very low	35.7	Very low	100 Å²	100	139 Å²	139	83%	0.826	78%	0.78	S	S	*	*			trans	67.4	155.5	175.5	0	0	0	0	0	116.6
597	E	29.8	Very low	36.6	Very low	197 Å²	197	138.8 Å²	138.8	92%	0.921	77%	0.767	S	S	*	*			cis	-167.8	150.8	-30.3	179.4	160.7	-125	0	0	107.6
598	G	27.9	Very low	38	Very low	74 Å²	74	135.4 Å²	135.4	76%	0.763	76%	0.759	S	S	*	*			trans	132	119.4	168.8	0	0	0	0	0	115.4
599	T	36.8	Very low	40	Very low	132 Å²	132	131.7 Å²	131.7	81%	0.81	74%	0.742	S	S	*	*			trans	-94.1	145.7	171.9	53.2	0	0	0	0	111.3
600	R	30.2	Very low	41.4	Very low	251 Å²	251	132.6 Å²	132.6	95%	0.947	73%	0.728	S	S	*	*			trans	-172.3	161.6	138.8	-101.6	147.4	-156.1	-142.7	3.2	112.9
601	K	40.8	Very low	42.7	Very low	197 Å²	197	125.2 Å²	125.2	86%	0.857	71%	0.706	S	S	*	*			trans	-77.7	151.4	169.9	-53.4	171.7	-178.1	177.6	0	109
602	E	35.3	Very low	44	Very low	171 Å²	171	123.2 Å²	123.2	80%	0.799	70%	0.698	S	S	*	*			trans	-175.1	122.4	135.5	-101.7	167	-155.6	0	0	107.6	A604	E602-A604 HydrophobicContact CB-CB 4.29Å; E602-A604 HydrophobicContact CG-CB 3.57Å
603	G	48.5	Very low	44.8	Very low	94 Å²	94	123 Å²	123	97%	0.969	69%	0.69	S	S	*	*				-76.5	111.1	94.4	0	0	0	0	0	116.1
604	A	41.1	Very low	45.5	Very low	63 Å²	63	124.6 Å²	124.6	52%	0.521	69%	0.685	S	S	.	*			trans	-123.2	148.6	153.1	0	0	0	0	0	109.3	E602	E602-A604 HydrophobicContact CB-CB 4.29Å; E602-A604 HydrophobicContact CG-CB 3.57Å
605	I	51.9	Low	46.9	Very low	133 Å²	133	120 Å²	120	68%	0.682	67%	0.672	S	S	*	*			trans	-78.5	131.7	167.4	-30.5	174.8	0	0	0	106.5	T609	I605-T609 HydrophobicContact CG2-CG2 3.77Å
606	S	57.4	Low	48	Very low	61 Å²	61	118.8 Å²	118.8	43%	0.427	66%	0.661	S	S	.	*			trans	-58.4	143.6	-175.9	75.3	0	0	0	0	111.9	D608 T609 K610	S606-D608 PolarHBondContact O-N 3.23Å; S606-D608 VanDerWaalsContact O-N 3.16Å; S606-T609 WeakPolarHBondContact O-CA 3.45Å; S606-T609 WeakPolarHBondContact O-CB 3.32Å; S606-T609 PolarHBondContact O-N 3.44Å; S606-T609 PolarHBondContact OG-N 2.92Å; S606-T609 PolarHBondContact OG-OG1 3.46Å; S606-K610 PolarHBondContact O-N 3Å
607	E	47.7	Very low	49.1	Very low	103 Å²	103	119.4 Å²	119.4	48%	0.481	65%	0.651	S	S	.	*	H	α-helix	trans	-62.9	-25.7	-177.2	-160.9	66.2	-162.6	0	0	111.3	K610 N611	E607-K610 VanDerWaalsContact CD-CD 3.47Å; E607-K610 PolarHBondContact O-N 2.95Å; E607-K610 WeakPolarHBondContact OE1-CD 3.5Å; E607-K610 IonicContact OE1-NZ 3.68Å; E607-K610 PolarHBondContact OE1-NZ 3.43Å; E607-K610 WeakPolarHBondContact OE2-CD 3.31Å; E607-K610 WeakPolarHBondContact OE2-CE 3.45Å; E607-K610 IonicContact OE2-NZ 2.91Å; E607-K610 PolarHBondContact OE2-NZ 3.43Å; E607-N611 VanDerWaalsContact O-CB 3.23Å; E607-N611 WeakPolarHBondContact O-CB 3.45Å; E607-N611 VanDerWaalsContact O-CG 3.29Å; E607-N611 PolarHBondContact O-N 3.21Å; E607-N611 PolarHBondContact O-ND2 3.21Å
608	D	59.7	Low	49.7	Very low	127 Å²	127	118.6 Å²	118.6	68%	0.679	64%	0.639	S	S	*	*	H	α-helix	trans	-65	-43.1	169.5	-63.5	-52.1	0	0	0	112.9	S606 K610 N611 A612	S606-D608 PolarHBondContact O-N 3.23Å; S606-D608 VanDerWaalsContact O-N 3.16Å; D608-K610 VanDerWaalsContact C-N 3.31Å; D608-K610 PolarHBondContact O-N 3.41Å; D608-N611 PolarHBondContact O-N 3.29Å; D608-A612 WeakPolarHBondContact O-CB 3.49Å; D608-A612 PolarHBondContact O-N 2.78Å
609	T	68.9	Low	50.6	Low	76 Å²	76	119.9 Å²	119.9	47%	0.466	63%	0.628	S	S	.	*	H	α-helix	trans	-62.5	-42.4	175.5	-54.9	0	0	0	0	110.5	I605 S606 A612 L613	I605-T609 HydrophobicContact CG2-CG2 3.77Å; S606-T609 WeakPolarHBondContact O-CA 3.45Å; S606-T609 WeakPolarHBondContact O-CB 3.32Å; S606-T609 PolarHBondContact O-N 3.44Å; S606-T609 PolarHBondContact OG-N 2.92Å; S606-T609 PolarHBondContact OG-OG1 3.46Å; T609-A612 PolarHBondContact O-N 3.07Å; T609-L613 WeakPolarHBondContact O-CB 3.49Å; T609-L613 PolarHBondContact O-N 3.42Å
610	K	58.2	Low	51.1	Low	113 Å²	113	122.1 Å²	122.1	49%	0.491	63%	0.627	S	S	.	*	H	α-helix	trans	-68.1	-39.5	178.1	-164.4	-168.2	-176.8	-166	0	111.7	S606 E607 D608 L613 K614	S606-K610 PolarHBondContact O-N 3Å; E607-K610 VanDerWaalsContact CD-CD 3.47Å; E607-K610 PolarHBondContact O-N 2.95Å; E607-K610 WeakPolarHBondContact OE1-CD 3.5Å; E607-K610 IonicContact OE1-NZ 3.68Å; E607-K610 PolarHBondContact OE1-NZ 3.43Å; E607-K610 WeakPolarHBondContact OE2-CD 3.31Å; E607-K610 WeakPolarHBondContact OE2-CE 3.45Å; E607-K610 IonicContact OE2-NZ 2.91Å; E607-K610 PolarHBondContact OE2-NZ 3.43Å; D608-K610 VanDerWaalsContact C-N 3.31Å; D608-K610 PolarHBondContact O-N 3.41Å; K610-L613 PolarHBondContact O-N 3.35Å; K610-K614 VanDerWaalsContact O-CB 3.28Å; K610-K614 WeakPolarHBondContact O-CB 3.16Å; K610-K614 PolarHBondContact O-N 2.95Å
611	N	56	Low	51.7	Low	77 Å²	77	114.3 Å²	114.3	41%	0.412	62%	0.616	S	S	.	*	H	α-helix	trans	-68.7	-38.1	173.4	-81.8	-42.9	0	0	0	112.3	E607 D608 K614 K615	E607-N611 VanDerWaalsContact O-CB 3.23Å; E607-N611 WeakPolarHBondContact O-CB 3.45Å; E607-N611 VanDerWaalsContact O-CG 3.29Å; E607-N611 PolarHBondContact O-N 3.21Å; E607-N611 PolarHBondContact O-ND2 3.21Å; D608-N611 PolarHBondContact O-N 3.29Å; N611-K614 PolarHBondContact O-N 2.76Å; N611-K615 VanDerWaalsContact O-CB 3.26Å; N611-K615 WeakPolarHBondContact O-CB 3.49Å; N611-K615 PolarHBondContact O-N 3.16Å
612	A	62.7	Low	51.7	Low	59 Å²	59	115.1 Å²	115.1	49%	0.488	61%	0.614	S	S	.	*	H	α-helix	trans	-61	-45.6	172.1	0	0	0	0	0	111.2	D608 T609 K615 A616	D608-A612 WeakPolarHBondContact O-CB 3.49Å; D608-A612 PolarHBondContact O-N 2.78Å; T609-A612 PolarHBondContact O-N 3.07Å; A612-K615 PolarHBondContact O-N 3.17Å; A612-A616 WeakPolarHBondContact O-CB 3.45Å; A612-A616 PolarHBondContact O-N 2.89Å
613	L	55.3	Low	51.8	Low	117 Å²	117	110.2 Å²	110.2	61%	0.613	61%	0.61	S	S	*	*	H	α-helix	trans	-64.2	-42.5	176.7	-161	71.2	0	0	0	112	T609 K610 K615 A616 L617	T609-L613 WeakPolarHBondContact O-CB 3.49Å; T609-L613 PolarHBondContact O-N 3.42Å; K610-L613 PolarHBondContact O-N 3.35Å; L613-K615 VanDerWaalsContact C-N 3.34Å; L613-K615 PolarHBondContact O-N 3.49Å; L613-A616 PolarHBondContact O-N 2.83Å; L613-L617 WeakPolarHBondContact O-CG 3.43Å; L613-L617 PolarHBondContact O-N 2.98Å
614	K	57.7	Low	51.3	Low	147 Å²	147	113.4 Å²	113.4	64%	0.639	60%	0.604	S	S	*	*	H	α-helix	trans	-63.2	-37.2	175.3	-165.6	173.2	-174.9	177.8	0	112.1	K610 N611 R618	K610-K614 VanDerWaalsContact O-CB 3.28Å; K610-K614 WeakPolarHBondContact O-CB 3.16Å; K610-K614 PolarHBondContact O-N 2.95Å; N611-K614 PolarHBondContact O-N 2.76Å; K614-R618 WeakPolarHBondContact O-CB 3.25Å; K614-R618 PolarHBondContact O-N 2.85Å
615	K	59	Low	50.7	Low	145 Å²	145	114.2 Å²	114.2	63%	0.63	62%	0.618	S	S	*	*	H	α-helix	trans	-70	-40.8	174.5	-168.2	174.9	-176.9	179	0	111.7	N611 A612 L613 R618 N619	N611-K615 VanDerWaalsContact O-CB 3.26Å; N611-K615 WeakPolarHBondContact O-CB 3.49Å; N611-K615 PolarHBondContact O-N 3.16Å; A612-K615 PolarHBondContact O-N 3.17Å; L613-K615 VanDerWaalsContact C-N 3.34Å; L613-K615 PolarHBondContact O-N 3.49Å; K615-R618 PolarHBondContact O-N 3.32Å; K615-N619 PolarHBondContact O-N 3.15Å
616	A	54.6	Low	49.8	Very low	57 Å²	57	112.1 Å²	112.1	47%	0.471	63%	0.63	S	S	.	*	H	α-helix	trans	-63	-45.5	174.9	0	0	0	0	0	112.2	A612 L613 N619 K620	A612-A616 WeakPolarHBondContact O-CB 3.45Å; A612-A616 PolarHBondContact O-N 2.89Å; L613-A616 PolarHBondContact O-N 2.83Å; A616-N619 PolarHBondContact O-N 2.97Å; A616-K620 PolarHBondContact O-N 3.22Å
617	L	51	Low	48.6	Very low	114 Å²	114	113.2 Å²	113.2	60%	0.597	65%	0.651	S	S	*	*	H	α-helix	trans	-62.5	-43.2	175.1	-75.4	164.5	0	0	0	112.1	L613 N619 K620 A621	L613-L617 WeakPolarHBondContact O-CG 3.43Å; L613-L617 PolarHBondContact O-N 2.98Å; L617-N619 VanDerWaalsContact C-N 3.27Å; L617-N619 PolarHBondContact O-N 3.08Å; L617-K620 PolarHBondContact O-N 2.7Å; L617-A621 WeakPolarHBondContact O-CB 3.31Å; L617-A621 PolarHBondContact O-N 2.61Å
618	R	43.7	Very low	47.9	Very low	180 Å²	180	114.6 Å²	114.6	68%	0.679	67%	0.672	S	S	*	*	H	α-helix	trans	-64.9	-29.1	177.4	-159.6	173.6	86.4	176.5	7.6	113.2	K614 K615	K614-R618 WeakPolarHBondContact O-CB 3.25Å; K614-R618 PolarHBondContact O-N 2.85Å; K615-R618 PolarHBondContact O-N 3.32Å
619	N	46.2	Very low	46.5	Very low	100 Å²	100	112.1 Å²	112.1	54%	0.535	68%	0.676	S	S	.	*	H	α-helix	trans	-77.8	-39.9	173.1	-74.5	4.8	0	0	0	111.9	K615 A616 L617 A621 R622 G623	K615-N619 PolarHBondContact O-N 3.15Å; A616-N619 PolarHBondContact O-N 2.97Å; L617-N619 VanDerWaalsContact C-N 3.27Å; L617-N619 PolarHBondContact O-N 3.08Å; N619-A621 VanDerWaalsContact C-N 3.29Å; N619-A621 PolarHBondContact O-N 3.15Å; N619-R622 PolarHBondContact O-N 2.92Å; N619-G623 PolarHBondContact O-N 2.9Å
620	K	47.4	Very low	44.9	Very low	179 Å²	179	117 Å²	117	78%	0.778	70%	0.698	S	S	*	*	H	α-helix	trans	-64.4	-34.7	176.8	-162.1	172.1	-176.3	-179	0	112.1	A616 L617 R622 G623	A616-K620 PolarHBondContact O-N 3.22Å; L617-K620 PolarHBondContact O-N 2.7Å; K620-R622 PolarHBondContact O-N 3.46Å; K620-G623 PolarHBondContact O-N 3.28Å
621	A	43.4	Very low	43.5	Very low	88 Å²	88	114.7 Å²	114.7	73%	0.727	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-3.9	171.8	0	0	0	0	0	114.9	L617 N619	L617-A621 WeakPolarHBondContact O-CB 3.31Å; L617-A621 PolarHBondContact O-N 2.61Å; N619-A621 VanDerWaalsContact C-N 3.29Å; N619-A621 PolarHBondContact O-N 3.15Å
622	R	39.4	Very low	42.5	Very low	213 Å²	213	118.6 Å²	118.6	80%	0.804	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	-0.3	174.9	-82.3	-174.8	163.7	-163.4	-6.3	113.9	N619 K620	N619-R622 PolarHBondContact O-N 2.92Å; K620-R622 PolarHBondContact O-N 3.46Å
623	G	37.4	Very low	41.1	Very low	69 Å²	69	123 Å²	123	71%	0.711	74%	0.742	S	S	*	*	S	Bend	trans	-88.2	5.8	-173.8	0	0	0	0	0	116	N619 K620	N619-G623 PolarHBondContact O-N 2.9Å; K620-G623 PolarHBondContact O-N 3.28Å
624	N	38.1	Very low	39.9	Very low	161 Å²	161	121.5 Å²	121.5	86%	0.861	75%	0.754	S	S	*	*	S	Bend	trans	-138.7	76.1	-168.4	-162.3	91.7	0	0	0	112.8
625	G	30	Very low	38.5	Very low	79 Å²	79	118.5 Å²	118.5	81%	0.814	77%	0.765	S	S	*	*	S	Bend	trans	159.5	117.5	167.5	0	0	0	0	0	115.8
626	G	31.8	Very low	37.2	Very low	90 Å²	90	116.9 Å²	116.9	93%	0.928	78%	0.779	S	S	*	*			trans	97.4	135.2	162.5	0	0	0	0	0	116.1
627	G	32.1	Very low	36	Very low	84 Å²	84	118 Å²	118	87%	0.866	80%	0.796	S	S	*	*			trans	-179.4	-16.3	179.9	0	0	0	0	0	118.1
628	S	33.2	Very low	34.9	Very low	132 Å²	132	116.8 Å²	116.8	92%	0.923	81%	0.811	S	S	*	*			trans	-115.9	122.5	169.5	-57.8	0	0	0	0	108.4
629	G	30.8	Very low	34.2	Very low	74 Å²	74	112 Å²	112	76%	0.763	82%	0.817	S	S	*	*			trans	-127.7	155.3	-178.2	0	0	0	0	0	112.6
630	L	35	Very low	33.4	Very low	179 Å²	179	112.9 Å²	112.9	94%	0.937	83%	0.831	S	S	*	*			trans	-168.1	128.8	152.8	-105.9	172.8	0	0	0	109.9
631	G	29.8	Very low	32.8	Very low	65 Å²	65	111.1 Å²	111.1	67%	0.67	84%	0.835	S	S	*	*			trans	91	93.7	141	0	0	0	0	0	121.5
632	I	33.9	Very low	32.1	Very low	159 Å²	159	112.7 Å²	112.7	82%	0.815	84%	0.841	S	S	*	*				82.3	130	126.8	-66	170.5	0	0	0	120.6
633	D	33	Very low	31.8	Very low	152 Å²	152	107.5 Å²	107.5	81%	0.813	84%	0.837	S	S	*	*			trans	48.9	109.7	156.6	-58.4	-6.7	0	0	0	124
634	G	30.2	Very low	31.5	Very low	85 Å²	85	110.6 Å²	110.6	88%	0.876	84%	0.842	S	S	*	*				94.9	115.4	93.8	0	0	0	0	0	119.4
635	G	28.6	Very low	30.9	Very low	83 Å²	83	109.7 Å²	109.7	86%	0.856	84%	0.842	S	S	*	*			trans	139.5	125.9	156.4	0	0	0	0	0	116.6
636	A	31	Very low	31.3	Very low	112 Å²	112	111.3 Å²	111.3	93%	0.926	84%	0.841	S	S	*	*			trans	-57.9	167.1	-178.3	0	0	0	0	0	117.9
637	G	29.4	Very low	31.2	Very low	81 Å²	81	112.6 Å²	112.6	84%	0.835	84%	0.835	S	S	*	*			trans	129.6	110	153.7	0	0	0	0	0	115.2
638	G	29.5	Very low	31.3	Very low	88 Å²	88	114.9 Å²	114.9	91%	0.907	83%	0.832	S	S	*	*			trans	-94.1	177.1	174.9	0	0	0	0	0	113.8
639	G	28.5	Very low	31.6	Very low	79 Å²	79	114.4 Å²	114.4	81%	0.814	83%	0.826	S	S	*	*			trans	163	133.3	172.2	0	0	0	0	0	113.3
640	S	29.6	Very low	31.8	Very low	119 Å²	119	119.8 Å²	119.8	83%	0.832	83%	0.831	S	S	*	*			trans	-78.9	134.8	-171.1	-64	0	0	0	0	115.5
641	V	33.4	Very low	31.8	Very low	142 Å²	142	116.7 Å²	116.7	86%	0.861	83%	0.825	S	S	*	*			trans	31.8	116.2	130.1	-161.9	0	0	0	0	119.1
642	S	30.3	Very low	32.6	Very low	121 Å²	121	125 Å²	125	85%	0.846	84%	0.836	S	S	*	*			trans	-154.1	178.2	135.9	-160.7	0	0	0	0	110.1
643	S	32.5	Very low	33.5	Very low	103 Å²	103	128.3 Å²	128.3	72%	0.72	84%	0.838	S	S	*	*			trans	-117.2	169.1	-156.2	56.6	0	0	0	0	116.9
644	V	30.7	Very low	34	Very low	135 Å²	135	127 Å²	127	82%	0.818	84%	0.837	S	S	*	*			trans	73.2	99.9	164.5	-166.3	0	0	0	0	118.4
645	V	26.5	Very low	35.4	Very low	141 Å²	141	125.9 Å²	125.9	86%	0.855	81%	0.814	S	S	*	*			trans	-139.2	155	134.2	-179	0	0	0	0	107.7
646	S	37.2	Very low	37.7	Very low	114 Å²	114	125.7 Å²	125.7	80%	0.797	80%	0.796	S	S	*	*			trans	-74.8	160.9	179.8	52.3	0	0	0	0	114.3
647	S	30.8	Very low	39.2	Very low	116 Å²	116	124.2 Å²	124.2	81%	0.811	78%	0.784	S	S	*	*			trans	-140.3	142.8	164.9	61	0	0	0	0	111.1
648	V	34	Very low	40.7	Very low	133 Å²	133	127 Å²	127	81%	0.806	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-67.4	141.2	-175.2	178.9	0	0	0	0	111.5	E650	V648-E650 PolarHBondContact O-N 3.25Å
649	P	38.8	Very low	42.8	Very low	121 Å²	121	127.9 Å²	127.9	79%	0.786	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-68.7	117.2	171.8	28.1	-34.2	0	0	0	111.2
650	E	35.3	Very low	44.9	Very low	187 Å²	187	130.6 Å²	130.6	87%	0.874	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-68.6	131.2	-178.2	-166.8	174.2	-147.9	0	0	112	V648 R652	V648-E650 PolarHBondContact O-N 3.25Å; E650-R652 PolarHBondContact O-N 3.39Å
651	S	35.3	Very low	46.9	Very low	114 Å²	114	130.3 Å²	130.3	80%	0.797	73%	0.727	S	S	*	*			trans	-74.2	98.8	-169.9	56	0	0	0	0	112.6	R653	S651-R653 PolarHBondContact O-N 2.99Å
652	R	46.4	Very low	49.1	Very low	240 Å²	240	131.9 Å²	131.9	91%	0.906	72%	0.717	S	S	*	*			trans	-59	129.4	170	-71.8	-171.6	175.2	-163.2	-0.4	110.7	E650	E650-R652 PolarHBondContact O-N 3.39Å
653	R	52.5	Low	51.5	Low	229 Å²	229	131.4 Å²	131.4	86%	0.864	70%	0.702	S	S	*	*			trans	-59.8	142.4	178.4	-64.2	-179.3	-179.2	178.5	-0.3	111	S651 V655	S651-R653 PolarHBondContact O-N 2.99Å; R653-V655 PolarHBondContact O-N 3.28Å; R653-V655 VanDerWaalsContact O-N 3.1Å
654	P	43.6	Very low	53.2	Low	123 Å²	123	132.9 Å²	132.9	80%	0.799	69%	0.691	S	S	*	*			trans	-69.4	107.6	-179.2	27.5	-34.1	0	0	0	111.3	T656	P654-T656 PolarHBondContact O-N 2.94Å
655	V	59.4	Low	55.5	Low	63 Å²	63	131.6 Å²	131.6	38%	0.382	68%	0.677	S	S	.	*			trans	-64.5	124	176.5	-179.5	0	0	0	0	109.9	R653 E659 R660	R653-V655 PolarHBondContact O-N 3.28Å; R653-V655 VanDerWaalsContact O-N 3.1Å; V655-E659 HydrophobicContact CG1-CB 3.95Å; V655-E659 HydrophobicContact CG1-CG 3.79Å; V655-R660 HydrophobicContact CG1-CG 3.93Å; V655-R660 PolarHBondContact O-NE 3.29Å; V655-R660 PolarHBondContact O-NH2 2.86Å
656	T	76.9	Confident	58.1	Low	79 Å²	79	129.2 Å²	129.2	49%	0.485	66%	0.656	S	S	.	*			trans	-68.9	158.7	-173.3	67.3	0	0	0	0	112.2	P654 Q658 E659 R660	P654-T656 PolarHBondContact O-N 2.94Å; T656-Q658 VanDerWaalsContact C-N 3.31Å; T656-Q658 PolarHBondContact O-N 3.49Å; T656-E659 PolarHBondContact N-OE2 2.8Å; T656-E659 PolarHBondContact O-N 2.99Å; T656-E659 WeakPolarHBondContact OG1-CB 3.22Å; T656-E659 PolarHBondContact OG1-N 3.41Å; T656-R660 PolarHBondContact O-N 3.09Å
657	A	63	Low	60.3	Low	81 Å²	81	128 Å²	128	67%	0.669	64%	0.637	S	S	*	*	H	α-helix	trans	-61.3	-38.8	178.3	0	0	0	0	0	112.4	Q661	A657-Q661 WeakPolarHBondContact O-CB 3.44Å; A657-Q661 PolarHBondContact O-N 2.95Å
658	Q	61.6	Low	62.6	Low	140 Å²	140	128.8 Å²	128.8	65%	0.654	62%	0.622	S	S	*	*	H	α-helix	trans	-66.3	-35.4	175.6	-69.5	-172.5	-6	0	0	112.7	T656 Q661 R662	T656-Q658 VanDerWaalsContact C-N 3.31Å; T656-Q658 PolarHBondContact O-N 3.49Å; Q658-Q661 PolarHBondContact O-N 3.19Å; Q658-R662 WeakPolarHBondContact O-CG 3.32Å; Q658-R662 PolarHBondContact O-N 2.68Å
659	E	73.6	Confident	65.2	Low	106 Å²	106	129.7 Å²	129.7	50%	0.495	61%	0.611	S	S	.	*	H	α-helix	trans	-69.8	-44.9	178.5	-172.7	170.5	-152	0	0	111.2	V655 T656 Q661 R662 E663	V655-E659 HydrophobicContact CG1-CB 3.95Å; V655-E659 HydrophobicContact CG1-CG 3.79Å; T656-E659 PolarHBondContact N-OE2 2.8Å; T656-E659 PolarHBondContact O-N 2.99Å; T656-E659 WeakPolarHBondContact OG1-CB 3.22Å; T656-E659 PolarHBondContact OG1-N 3.41Å; E659-Q661 VanDerWaalsContact C-N 3.27Å; E659-Q661 PolarHBondContact O-N 3.46Å; E659-R662 PolarHBondContact O-N 2.75Å; E659-E663 PolarHBondContact O-N 3.02Å
660	R	72.4	Confident	67.4	Low	135 Å²	135	129 Å²	129	51%	0.509	60%	0.595	S	S	.	*	H	α-helix	trans	-59.7	-34.6	168.7	-91.9	179.1	-84.1	-174	-6.2	112.9	V655 T656 R664	V655-R660 HydrophobicContact CG1-CG 3.93Å; V655-R660 PolarHBondContact O-NE 3.29Å; V655-R660 PolarHBondContact O-NH2 2.86Å; T656-R660 PolarHBondContact O-N 3.09Å; R660-R664 WeakPolarHBondContact O-CD 3.43Å; R660-R664 VanDerWaalsContact O-CG 3.26Å; R660-R664 WeakPolarHBondContact O-CG 3.3Å; R660-R664 PolarHBondContact O-N 3.23Å
661	Q	71.9	Confident	69.4	Low	114 Å²	114	125.6 Å²	125.6	53%	0.533	57%	0.574	S	S	.	*	H	α-helix	trans	-71	-41	175	-176.5	156.5	-26.2	0	0	112.6	A657 Q658 E659 E663 R664 E665	A657-Q661 WeakPolarHBondContact O-CB 3.44Å; A657-Q661 PolarHBondContact O-N 2.95Å; Q658-Q661 PolarHBondContact O-N 3.19Å; E659-Q661 VanDerWaalsContact C-N 3.27Å; E659-Q661 PolarHBondContact O-N 3.46Å; Q661-E663 VanDerWaalsContact C-N 3.33Å; Q661-E663 PolarHBondContact O-N 2.77Å; Q661-R664 WeakPolarHBondContact O-CB 3.46Å; Q661-R664 PolarHBondContact O-N 3.43Å; Q661-E665 WeakPolarHBondContact CG-OE1 3.03Å; Q661-E665 PolarHBondContact NE2-OE1 3.15Å; Q661-E665 VanDerWaalsContact NE2-OE1 3.1Å; Q661-E665 WeakPolarHBondContact O-CG 3.21Å; Q661-E665 PolarHBondContact O-N 2.81Å
662	R	77.6	Confident	71.5	Confident	175 Å²	175	125.6 Å²	125.6	66%	0.66	56%	0.562	S	S	*	*	H	α-helix	trans	-62.1	-39.3	172.6	-73	174.6	-177	178.4	3.6	112	Q658 E659 E665 E666	Q658-R662 WeakPolarHBondContact O-CG 3.32Å; Q658-R662 PolarHBondContact O-N 2.68Å; E659-R662 PolarHBondContact O-N 2.75Å; R662-E665 PolarHBondContact O-N 2.68Å; R662-E666 WeakPolarHBondContact O-CB 3.33Å; R662-E666 PolarHBondContact O-N 3.35Å
663	E	82.1	Confident	73.4	Confident	110 Å²	110	119.8 Å²	119.8	51%	0.514	55%	0.545	S	S	.	.	H	α-helix	trans	-63.5	-41	174.1	-166.2	-169	163.6	0	0	111.8	E659 Q661 E666 K667	E659-E663 PolarHBondContact O-N 3.02Å; Q661-E663 VanDerWaalsContact C-N 3.33Å; Q661-E663 PolarHBondContact O-N 2.77Å; E663-E666 PolarHBondContact O-N 2.72Å; E663-K667 WeakPolarHBondContact O-CB 3.49Å; E663-K667 PolarHBondContact O-N 3.36Å
664	R	68.8	Low	75.1	Confident	134 Å²	134	116.1 Å²	116.1	51%	0.506	53%	0.531	S	S	.	.	H	α-helix	trans	-64.1	-44.3	174.4	-74.9	166.4	170.7	179	-5.5	112.4	R660 Q661 E666 K667 R668	R660-R664 WeakPolarHBondContact O-CD 3.43Å; R660-R664 VanDerWaalsContact O-CG 3.26Å; R660-R664 WeakPolarHBondContact O-CG 3.3Å; R660-R664 PolarHBondContact O-N 3.23Å; Q661-R664 WeakPolarHBondContact O-CB 3.46Å; Q661-R664 PolarHBondContact O-N 3.43Å; R664-E666 VanDerWaalsContact C-N 3.34Å; R664-K667 PolarHBondContact O-N 3.11Å; R664-R668 WeakPolarHBondContact O-CB 3.11Å; R664-R668 WeakPolarHBondContact O-CG 3.27Å; R664-R668 PolarHBondContact O-N 3.06Å
665	E	77.9	Confident	76.8	Confident	108 Å²	108	112.9 Å²	112.9	51%	0.505	52%	0.515	S	S	.	.	H	α-helix	trans	-64.2	-38.4	175.4	-73.5	171.5	-162.3	0	0	111.5	Q661 R662 R668 R669	Q661-E665 WeakPolarHBondContact CG-OE1 3.03Å; Q661-E665 PolarHBondContact NE2-OE1 3.15Å; Q661-E665 VanDerWaalsContact NE2-OE1 3.1Å; Q661-E665 WeakPolarHBondContact O-CG 3.21Å; Q661-E665 PolarHBondContact O-N 2.81Å; R662-E665 PolarHBondContact O-N 2.68Å; E665-R668 PolarHBondContact O-N 3.08Å; E665-R669 WeakPolarHBondContact O-CB 3.28Å; E665-R669 PolarHBondContact O-N 3.36Å
666	E	82	Confident	78	Confident	91 Å²	91	117 Å²	117	43%	0.425	52%	0.523	S	S	.	.	H	α-helix	trans	-70.1	-42.9	173.4	179	151.9	-130.4	0	0	112.9	R662 E663 R664 R668 R669 K670	R662-E666 WeakPolarHBondContact O-CB 3.33Å; R662-E666 PolarHBondContact O-N 3.35Å; E663-E666 PolarHBondContact O-N 2.72Å; R664-E666 VanDerWaalsContact C-N 3.34Å; E666-R668 VanDerWaalsContact C-N 3.27Å; E666-R668 PolarHBondContact O-N 3.34Å; E666-R669 PolarHBondContact O-N 2.9Å; E666-R669 IonicContact OE1-CZ 2.93Å; E666-R669 IonicContact OE1-NH2 3.63Å; E666-R669 PolarHBondContact OE1-NH2 2.91Å; E666-K670 VanDerWaalsContact O-CB 3.22Å; E666-K670 WeakPolarHBondContact O-CB 3.42Å; E666-K670 PolarHBondContact O-N 3.34Å
667	K	82.3	Confident	78.5	Confident	89 Å²	89	117.6 Å²	117.6	39%	0.387	52%	0.521	S	S	.	.	H	α-helix	trans	-52.9	-47.5	170.7	-88.3	-175.6	-178.5	-179.5	0	110	D365 E663 R664 K670 R671	D365-K667 IonicContact OD2-NZ 2.84Å; D365-K667 PolarHBondContact OD2-NZ 3.46Å; E663-K667 WeakPolarHBondContact O-CB 3.49Å; E663-K667 PolarHBondContact O-N 3.36Å; R664-K667 PolarHBondContact O-N 3.11Å; K667-K670 PolarHBondContact O-N 3.14Å; K667-R671 WeakPolarHBondContact O-CG 3.22Å; K667-R671 PolarHBondContact O-N 3.23Å
668	R	80.1	Confident	79.7	Confident	133 Å²	133	123 Å²	123	50%	0.502	52%	0.524	S	S	.	.	H	α-helix	trans	-63.1	-48.3	177.2	-76.4	177.5	169.8	-179.9	-5.2	112.4	R664 E665 E666 K670 R671 Q672	R664-R668 WeakPolarHBondContact O-CB 3.11Å; R664-R668 WeakPolarHBondContact O-CG 3.27Å; R664-R668 PolarHBondContact O-N 3.06Å; E665-R668 PolarHBondContact O-N 3.08Å; E666-R668 VanDerWaalsContact C-N 3.27Å; E666-R668 PolarHBondContact O-N 3.34Å; R668-K670 VanDerWaalsContact C-N 3.31Å; R668-K670 PolarHBondContact O-N 3.41Å; R668-R671 PolarHBondContact O-N 3.08Å; R668-Q672 PolarHBondContact O-N 3.09Å
669	R	87.9	Confident	80.8	Confident	152 Å²	152	120.7 Å²	120.7	57%	0.574	51%	0.513	S	S	*	.	H	α-helix	trans	-54.5	-46.7	174.5	-177.1	178.3	72.3	159.3	-0.7	111.6	E665 E666 Q672 E673	E665-R669 WeakPolarHBondContact O-CB 3.28Å; E665-R669 PolarHBondContact O-N 3.36Å; E666-R669 PolarHBondContact O-N 2.9Å; E666-R669 IonicContact OE1-CZ 2.93Å; E666-R669 IonicContact OE1-NH2 3.63Å; E666-R669 PolarHBondContact OE1-NH2 2.91Å; R669-Q672 PolarHBondContact O-N 3.45Å; R669-E673 VanDerWaalsContact O-CB 3.32Å; R669-E673 WeakPolarHBondContact O-CB 3.39Å; R669-E673 PolarHBondContact O-N 3.34Å
670	K	83.9	Confident	81.7	Confident	107 Å²	107	124.7 Å²	124.7	47%	0.465	52%	0.523	S	S	.	.	H	α-helix	trans	-71.9	-28.3	-177.1	-154.9	166.1	-163.4	160.6	0	112.8	E666 K667 R668 R674	E666-K670 VanDerWaalsContact O-CB 3.22Å; E666-K670 WeakPolarHBondContact O-CB 3.42Å; E666-K670 PolarHBondContact O-N 3.34Å; K667-K670 PolarHBondContact O-N 3.14Å; R668-K670 VanDerWaalsContact C-N 3.31Å; R668-K670 PolarHBondContact O-N 3.41Å; K670-R674 WeakPolarHBondContact O-CD 3.45Å; K670-R674 VanDerWaalsContact O-CG 3.25Å; K670-R674 WeakPolarHBondContact O-CG 3.2Å; K670-R674 PolarHBondContact O-N 3.22Å
671	R	78.3	Confident	82.5	Confident	114 Å²	114	124 Å²	124	43%	0.43	52%	0.524	S	S	.	.	H	α-helix	trans	-69.4	-48.3	167.9	-74.1	177.4	176.2	-156.9	5.5	111.1	D363 D366 K667 R668 E673 R674 A675	D363-R671 IonicContact OD2-NH2 3.9Å; D363-R671 PolarHBondContact OD2-NH2 3Å; D366-R671 IonicContact OD1-CZ 2.73Å; D366-R671 IonicContact OD1-NH1 3.83Å; D366-R671 PolarHBondContact OD1-NH1 3.3Å; D366-R671 IonicContact OD2-CZ 2.69Å; D366-R671 IonicContact OD2-NH1 2.79Å; D366-R671 PolarHBondContact OD2-NH1 3.29Å; D366-R671 IonicContact OD2-NH2 3.76Å; K667-R671 WeakPolarHBondContact O-CG 3.22Å; K667-R671 PolarHBondContact O-N 3.23Å; R668-R671 PolarHBondContact O-N 3.08Å; R671-E673 PolarHBondContact O-N 2.99Å; R671-R674 PolarHBondContact O-N 3.07Å; R671-A675 PolarHBondContact O-N 3.45Å
672	Q	79.8	Confident	82.8	Confident	115 Å²	115	125.3 Å²	125.3	54%	0.537	53%	0.532	S	S	.	.	H	α-helix	trans	-62.8	-37.9	176.2	-71.6	-176.4	-3.8	0	0	113.2	R668 R669 A675 R676	R668-Q672 PolarHBondContact O-N 3.09Å; R669-Q672 PolarHBondContact O-N 3.45Å; Q672-A675 WeakPolarHBondContact O-CB 3.33Å; Q672-A675 PolarHBondContact O-N 3.05Å; Q672-R676 PolarHBondContact O-N 2.86Å
673	E	86.8	Confident	83.2	Confident	118 Å²	118	122.1 Å²	122.1	55%	0.551	52%	0.523	S	S	*	.	H	α-helix	trans	-62.3	-46.6	175.8	-177.2	171.3	-141.9	0	0	111.5	R669 R671 A675 R676 E677	R669-E673 VanDerWaalsContact O-CB 3.32Å; R669-E673 WeakPolarHBondContact O-CB 3.39Å; R669-E673 PolarHBondContact O-N 3.34Å; R671-E673 PolarHBondContact O-N 2.99Å; E673-A675 VanDerWaalsContact C-N 3.31Å; E673-A675 PolarHBondContact O-N 3.13Å; E673-R676 PolarHBondContact O-N 2.82Å; E673-E677 WeakPolarHBondContact O-CB 3.37Å; E673-E677 PolarHBondContact O-N 3.14Å
674	R	86.2	Confident	83.3	Confident	152 Å²	152	121.6 Å²	121.6	57%	0.574	52%	0.521	S	S	*	.	H	α-helix	trans	-62.3	-34.4	173.5	-73.2	169	174.6	-176.3	-2.9	113	K670 R671 E677 R678	K670-R674 WeakPolarHBondContact O-CD 3.45Å; K670-R674 VanDerWaalsContact O-CG 3.25Å; K670-R674 WeakPolarHBondContact O-CG 3.2Å; K670-R674 PolarHBondContact O-N 3.22Å; R671-R674 PolarHBondContact O-N 3.07Å; R674-E677 PolarHBondContact O-N 2.89Å; R674-R678 VanDerWaalsContact O-CG 3.31Å; R674-R678 WeakPolarHBondContact O-CG 3.49Å; R674-R678 PolarHBondContact O-N 2.92Å
675	A	79.7	Confident	84	Confident	55 Å²	55	120.9 Å²	120.9	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-64.9	-50	173.9	0	0	0	0	0	111.1	R671 Q672 E673 E677 R678 E679	R671-A675 PolarHBondContact O-N 3.45Å; Q672-A675 WeakPolarHBondContact O-CB 3.33Å; Q672-A675 PolarHBondContact O-N 3.05Å; E673-A675 VanDerWaalsContact C-N 3.31Å; E673-A675 PolarHBondContact O-N 3.13Å; A675-E677 VanDerWaalsContact C-N 3.28Å; A675-E677 PolarHBondContact O-N 3.25Å; A675-R678 WeakPolarHBondContact O-CB 3.43Å; A675-R678 PolarHBondContact O-N 3.47Å; A675-R678 VanDerWaalsContact O-N 3.17Å; A675-E679 WeakPolarHBondContact O-CB 3.31Å; A675-E679 PolarHBondContact O-N 2.91Å
676	R	85.8	Confident	83.9	Confident	149 Å²	149	119.7 Å²	119.7	56%	0.562	52%	0.515	S	S	*	.	H	α-helix	trans	-62.4	-31.9	174.7	-70.8	174.8	177.4	157.2	1.6	113.2	Q672 E673 R680	Q672-R676 PolarHBondContact O-N 2.86Å; E673-R676 PolarHBondContact O-N 2.82Å; R676-R680 WeakPolarHBondContact O-CB 3.34Å; R676-R680 VanDerWaalsContact O-CG 3.25Å; R676-R680 WeakPolarHBondContact O-CG 3.27Å; R676-R680 PolarHBondContact O-N 3.41Å
677	E	87.8	Confident	83.7	Confident	91 Å²	91	124.4 Å²	124.4	43%	0.425	53%	0.529	S	S	.	.	H	α-helix	trans	-68.2	-42.5	174.2	-162.5	-157.3	150.7	0	0	111.6	E673 R674 A675 R680 K681	E673-E677 WeakPolarHBondContact O-CB 3.37Å; E673-E677 PolarHBondContact O-N 3.14Å; R674-E677 PolarHBondContact O-N 2.89Å; A675-E677 VanDerWaalsContact C-N 3.28Å; A675-E677 PolarHBondContact O-N 3.25Å; E677-R680 PolarHBondContact O-N 3.43Å; E677-K681 WeakPolarHBondContact O-CB 3.39Å; E677-K681 WeakPolarHBondContact O-CG 3.43Å; E677-K681 PolarHBondContact O-N 3.18Å; E677-K681 WeakPolarHBondContact OE1-CE 3.24Å; E677-K681 IonicContact OE1-NZ 2.65Å; E677-K681 PolarHBondContact OE1-NZ 2.89Å
678	R	86.9	Confident	83.3	Confident	196 Å²	196	126.2 Å²	126.2	74%	0.74	54%	0.537	S	S	*	.	H	α-helix	trans	-63.2	-44.9	173	-73.1	169.4	174.9	-174.1	-3.1	111.6	R674 A675 K681 M682	R674-R678 VanDerWaalsContact O-CG 3.31Å; R674-R678 WeakPolarHBondContact O-CG 3.49Å; R674-R678 PolarHBondContact O-N 2.92Å; A675-R678 WeakPolarHBondContact O-CB 3.43Å; A675-R678 PolarHBondContact O-N 3.47Å; A675-R678 VanDerWaalsContact O-N 3.17Å; R678-K681 PolarHBondContact O-N 2.89Å; R678-M682 WeakPolarHBondContact O-CB 3.31Å; R678-M682 PolarHBondContact O-N 3.23Å
679	E	85.8	Confident	82.6	Confident	91 Å²	91	124.6 Å²	124.6	43%	0.425	54%	0.535	S	S	.	.	H	α-helix	trans	-58.9	-46.7	175.9	-169	-149.5	149.2	0	0	111.5	A675 K681 M682 K683	A675-E679 WeakPolarHBondContact O-CB 3.31Å; A675-E679 PolarHBondContact O-N 2.91Å; E679-K681 PolarHBondContact O-N 2.71Å; E679-M682 PolarHBondContact O-N 3.26Å; E679-K683 HydrophobicContact CG-CD 4.41Å; E679-K683 PolarHBondContact O-N 2.89Å; E679-K683 IonicContact OE1-NZ 2.77Å; E679-K683 PolarHBondContact OE1-NZ 3.29Å
680	R	92.1	Very high	81.3	Confident	189 Å²	189	123.9 Å²	123.9	71%	0.713	54%	0.536	S	S	*	.	H	α-helix	trans	-59.9	-44.9	173.8	-77.8	171.9	175.7	177	-2.1	112	R676 E677 M682 K683 E684	R676-R680 WeakPolarHBondContact O-CB 3.34Å; R676-R680 VanDerWaalsContact O-CG 3.25Å; R676-R680 WeakPolarHBondContact O-CG 3.27Å; R676-R680 PolarHBondContact O-N 3.41Å; E677-R680 PolarHBondContact O-N 3.43Å; R680-M682 VanDerWaalsContact C-N 3.34Å; R680-M682 PolarHBondContact O-N 2.82Å; R680-K683 PolarHBondContact O-N 3.49Å; R680-E684 VanDerWaalsContact O-CB 3.3Å; R680-E684 WeakPolarHBondContact O-CB 3.5Å; R680-E684 PolarHBondContact O-N 2.86Å
681	K	89.5	Confident	79.8	Confident	121 Å²	121	126.7 Å²	126.7	53%	0.526	55%	0.549	S	S	.	.	H	α-helix	trans	-65.9	-34.3	177.3	-78.3	172.1	169.9	172.9	0	112.7	E677 R678 E679 K685	E677-K681 WeakPolarHBondContact O-CB 3.39Å; E677-K681 WeakPolarHBondContact O-CG 3.43Å; E677-K681 PolarHBondContact O-N 3.18Å; E677-K681 WeakPolarHBondContact OE1-CE 3.24Å; E677-K681 IonicContact OE1-NZ 2.65Å; E677-K681 PolarHBondContact OE1-NZ 2.89Å; R678-K681 PolarHBondContact O-N 2.89Å; E679-K681 PolarHBondContact O-N 2.71Å; K681-K685 VanDerWaalsContact O-CB 3.29Å; K681-K685 WeakPolarHBondContact O-CB 3.31Å; K681-K685 PolarHBondContact O-N 2.87Å
682	M	77.7	Confident	78.3	Confident	141 Å²	141	126.8 Å²	126.8	70%	0.695	56%	0.557	S	S	*	*	H	α-helix	trans	-66.5	-49.8	172.9	-175	-179.2	-77.6	0	0	110.9	R678 E679 R680 E684 K685 E686	R678-M682 WeakPolarHBondContact O-CB 3.31Å; R678-M682 PolarHBondContact O-N 3.23Å; E679-M682 PolarHBondContact O-N 3.26Å; R680-M682 VanDerWaalsContact C-N 3.34Å; R680-M682 PolarHBondContact O-N 2.82Å; M682-E684 VanDerWaalsContact C-N 3.29Å; M682-E684 PolarHBondContact O-N 3.48Å; M682-K685 WeakPolarHBondContact O-CB 3.07Å; M682-K685 PolarHBondContact O-N 3.12Å; M682-K685 VanDerWaalsContact O-N 3.16Å; M682-E686 WeakPolarHBondContact O-CB 3.32Å; M682-E686 PolarHBondContact O-N 3.46Å
683	K	85.8	Confident	76.5	Confident	109 Å²	109	123.9 Å²	123.9	47%	0.474	56%	0.558	S	S	.	*	H	α-helix	trans	-64.8	-30.3	176.2	-71.7	174.6	176.1	173.7	0	112.8	E679 R680 R687	E679-K683 HydrophobicContact CG-CD 4.41Å; E679-K683 PolarHBondContact O-N 2.89Å; E679-K683 IonicContact OE1-NZ 2.77Å; E679-K683 PolarHBondContact OE1-NZ 3.29Å; R680-K683 PolarHBondContact O-N 3.49Å; K683-R687 WeakPolarHBondContact O-CB 3.36Å; K683-R687 VanDerWaalsContact O-CG 3.22Å; K683-R687 WeakPolarHBondContact O-CG 3.49Å; K683-R687 PolarHBondContact O-N 3.35Å
684	E	83.8	Confident	74.6	Confident	99 Å²	99	125.2 Å²	125.2	46%	0.463	57%	0.569	S	S	.	*	H	α-helix	trans	-72	-41.4	171.9	-165.3	-167.3	151.3	0	0	111.8	R680 M682 R687 K688	R680-E684 VanDerWaalsContact O-CB 3.3Å; R680-E684 WeakPolarHBondContact O-CB 3.5Å; R680-E684 PolarHBondContact O-N 2.86Å; M682-E684 VanDerWaalsContact C-N 3.29Å; M682-E684 PolarHBondContact O-N 3.48Å; E684-R687 PolarHBondContact O-N 3.35Å; E684-K688 HydrophobicContact CG-CD 4.42Å; E684-K688 WeakPolarHBondContact O-CB 3.26Å; E684-K688 WeakPolarHBondContact O-CG 3.26Å; E684-K688 PolarHBondContact O-N 2.66Å; E684-K688 VanDerWaalsContact OE1-CE 3.29Å; E684-K688 WeakPolarHBondContact OE1-CE 3.2Å; E684-K688 IonicContact OE1-NZ 2.67Å; E684-K688 PolarHBondContact OE1-NZ 3.46Å
685	K	83.2	Confident	72.4	Confident	118 Å²	118	122.4 Å²	122.4	51%	0.513	57%	0.573	S	S	.	*	H	α-helix	trans	-61.1	-46.9	172.9	-179.3	179.6	175.4	-73.9	0	110.8	K681 M682 R687 K688 E689	K681-K685 VanDerWaalsContact O-CB 3.29Å; K681-K685 WeakPolarHBondContact O-CB 3.31Å; K681-K685 PolarHBondContact O-N 2.87Å; M682-K685 WeakPolarHBondContact O-CB 3.07Å; M682-K685 PolarHBondContact O-N 3.12Å; M682-K685 VanDerWaalsContact O-N 3.16Å; K685-R687 PolarHBondContact O-N 3.22Å; K685-K688 CarbonylContact O-C 3.56Å; K685-K688 WeakPolarHBondContact O-CA 3.49Å; K685-K688 WeakPolarHBondContact O-CB 3.47Å; K685-K688 PolarHBondContact O-N 3.34Å; K685-E689 WeakPolarHBondContact CE-OE1 3.37Å; K685-E689 HydrophobicContact CG-CG 4.45Å; K685-E689 WeakPolarHBondContact CG-OE2 3.37Å; K685-E689 IonicContact NZ-OE1 2.67Å; K685-E689 PolarHBondContact NZ-OE1 3.25Å; K685-E689 IonicContact NZ-OE2 2.63Å; K685-E689 PolarHBondContact NZ-OE2 2.95Å; K685-E689 WeakPolarHBondContact O-CG 3.25Å; K685-E689 PolarHBondContact O-N 2.95Å
686	E	77.3	Confident	70.4	Confident	83 Å²	83	126.6 Å²	126.6	39%	0.388	59%	0.587	S	S	.	*	H	α-helix	trans	-59.9	-42.9	176.4	-166.5	-152.6	147.1	0	0	112	M682 K688 E689 K690	M682-E686 WeakPolarHBondContact O-CB 3.32Å; M682-E686 PolarHBondContact O-N 3.46Å; E686-K688 VanDerWaalsContact C-N 3.3Å; E686-K688 PolarHBondContact O-N 3.04Å; E686-E689 PolarHBondContact O-N 3.05Å; E686-K690 HydrophobicContact CG-CD 4.46Å; E686-K690 WeakPolarHBondContact O-CB 3.44Å; E686-K690 WeakPolarHBondContact O-CG 3.5Å; E686-K690 PolarHBondContact O-N 3.32Å; E686-K690 WeakPolarHBondContact OE1-CE 3.16Å; E686-K690 IonicContact OE1-NZ 3.37Å; E686-K690 PolarHBondContact OE1-NZ 3.3Å
687	R	77.8	Confident	68.1	Low	191 Å²	191	123.4 Å²	123.4	72%	0.721	60%	0.6	S	S	*	*	H	α-helix	trans	-68.7	-25.6	174.1	-71.2	176.7	92.5	174.9	9.3	113.2	K683 E684 K685 K691	K683-R687 WeakPolarHBondContact O-CB 3.36Å; K683-R687 VanDerWaalsContact O-CG 3.22Å; K683-R687 WeakPolarHBondContact O-CG 3.49Å; K683-R687 PolarHBondContact O-N 3.35Å; E684-R687 PolarHBondContact O-N 3.35Å; K685-R687 PolarHBondContact O-N 3.22Å; R687-K691 WeakPolarHBondContact O-CB 3.27Å; R687-K691 WeakPolarHBondContact O-CG 3.47Å; R687-K691 PolarHBondContact O-N 3.43Å
688	K	73.8	Confident	65.6	Low	126 Å²	126	122.6 Å²	122.6	55%	0.548	62%	0.617	S	S	.	*	H	α-helix	trans	-78	-39.7	172	-77.6	168.8	172.3	172.6	0	111.8	E684 K685 E686 K691 L692	E684-K688 HydrophobicContact CG-CD 4.42Å; E684-K688 WeakPolarHBondContact O-CB 3.26Å; E684-K688 WeakPolarHBondContact O-CG 3.26Å; E684-K688 PolarHBondContact O-N 2.66Å; E684-K688 VanDerWaalsContact OE1-CE 3.29Å; E684-K688 WeakPolarHBondContact OE1-CE 3.2Å; E684-K688 IonicContact OE1-NZ 2.67Å; E684-K688 PolarHBondContact OE1-NZ 3.46Å; K685-K688 CarbonylContact O-C 3.56Å; K685-K688 WeakPolarHBondContact O-CA 3.49Å; K685-K688 WeakPolarHBondContact O-CB 3.47Å; K685-K688 PolarHBondContact O-N 3.34Å; E686-K688 VanDerWaalsContact C-N 3.3Å; E686-K688 PolarHBondContact O-N 3.04Å; K688-K691 CarbonylContact O-C 3.54Å; K688-K691 PolarHBondContact O-N 3.44Å; K688-L692 WeakPolarHBondContact O-CB 3.2Å; K688-L692 PolarHBondContact O-N 2.8Å
689	E	64.4	Low	63.1	Low	100 Å²	100	119.7 Å²	119.7	47%	0.467	62%	0.62	S	S	.	*	H	α-helix	trans	-69.4	-40.5	177	-73.3	173.8	143.1	0	0	111.4	K685 E686 K691 L692 G693	K685-E689 WeakPolarHBondContact CE-OE1 3.37Å; K685-E689 HydrophobicContact CG-CG 4.45Å; K685-E689 WeakPolarHBondContact CG-OE2 3.37Å; K685-E689 IonicContact NZ-OE1 2.67Å; K685-E689 PolarHBondContact NZ-OE1 3.25Å; K685-E689 IonicContact NZ-OE2 2.63Å; K685-E689 PolarHBondContact NZ-OE2 2.95Å; K685-E689 WeakPolarHBondContact O-CG 3.25Å; K685-E689 PolarHBondContact O-N 2.95Å; E686-E689 PolarHBondContact O-N 3.05Å; E689-K691 VanDerWaalsContact C-N 3.33Å; E689-K691 PolarHBondContact O-N 3.33Å; E689-L692 PolarHBondContact O-N 2.99Å; E689-L692 VanDerWaalsContact O-N 3.07Å; E689-G693 PolarHBondContact O-N 3.47Å
690	K	60.3	Low	61	Low	136 Å²	136	123.5 Å²	123.5	59%	0.591	64%	0.642	S	S	*	*	H	α-helix	trans	-58.8	-41.7	169.1	-76.2	173.8	171.4	172.5	0	112.1	E686 L692	E686-K690 HydrophobicContact CG-CD 4.46Å; E686-K690 WeakPolarHBondContact O-CB 3.44Å; E686-K690 WeakPolarHBondContact O-CG 3.5Å; E686-K690 PolarHBondContact O-N 3.32Å; E686-K690 WeakPolarHBondContact OE1-CE 3.16Å; E686-K690 IonicContact OE1-NZ 3.37Å; E686-K690 PolarHBondContact OE1-NZ 3.3Å; K690-L692 VanDerWaalsContact C-N 3.32Å; K690-L692 PolarHBondContact O-N 3.47Å
691	K	53.9	Low	59.2	Low	166 Å²	166	118.5 Å²	118.5	72%	0.722	63%	0.63	S	S	*	*	H	α-helix	trans	-70.8	-20.5	173.1	-80.3	-171.2	171.3	-161.6	0	115.1	R687 K688 E689	R687-K691 WeakPolarHBondContact O-CB 3.27Å; R687-K691 WeakPolarHBondContact O-CG 3.47Å; R687-K691 PolarHBondContact O-N 3.43Å; K688-K691 CarbonylContact O-C 3.54Å; K688-K691 PolarHBondContact O-N 3.44Å; E689-K691 VanDerWaalsContact C-N 3.33Å; E689-K691 PolarHBondContact O-N 3.33Å
692	L	45.8	Very low	57.8	Low	116 Å²	116	115.5 Å²	115.5	61%	0.607	62%	0.624	S	S	*	*	H	α-helix	trans	-85.1	-32	178.1	-160	69.7	0	0	0	111.1	K688 E689 K690 D694 S695	K688-L692 WeakPolarHBondContact O-CB 3.2Å; K688-L692 PolarHBondContact O-N 2.8Å; E689-L692 PolarHBondContact O-N 2.99Å; E689-L692 VanDerWaalsContact O-N 3.07Å; K690-L692 VanDerWaalsContact C-N 3.32Å; K690-L692 PolarHBondContact O-N 3.47Å; L692-D694 VanDerWaalsContact C-N 3.31Å; L692-D694 PolarHBondContact O-N 2.76Å; L692-S695 PolarHBondContact O-N 2.93Å
693	G	42.3	Very low	56.9	Low	54 Å²	54	114.5 Å²	114.5	56%	0.557	62%	0.621	S	S	*	*	H	α-helix	trans	-60.3	-35.6	173.1	0	0	0	0	0	113.6	E689 S695	E689-G693 PolarHBondContact O-N 3.47Å; G693-S695 PolarHBondContact O-N 2.73Å
694	D	47.6	Very low	55.3	Low	147 Å²	147	115.3 Å²	115.3	79%	0.786	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	-10.8	176.9	-69.6	-29.1	0	0	0	114.1	L692	L692-D694 VanDerWaalsContact C-N 3.31Å; L692-D694 PolarHBondContact O-N 2.76Å
695	S	39.5	Very low	54.3	Low	93 Å²	93	113.8 Å²	113.8	65%	0.65	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	-0.1	-172.6	-168.7	0	0	0	0	115	L692 G693	L692-S695 PolarHBondContact O-N 2.93Å; G693-S695 PolarHBondContact O-N 2.73Å
696	L	37.3	Very low	53.3	Low	142 Å²	142	111.9 Å²	111.9	74%	0.743	62%	0.618	S	S	*	*	S	Bend	trans	-138.8	90.1	176	-76.9	173.7	0	0	0	110.3
697	G	37.5	Very low	52.6	Low	83 Å²	83	111 Å²	111	86%	0.856	62%	0.621	S	S	*	*			trans	-70.6	155	174.7	0	0	0	0	0	112.9
698	G	34.7	Very low	51.8	Low	74 Å²	74	107.4 Å²	107.4	76%	0.763	62%	0.615	S	S	*	*			cis	169.9	-168.5	-2	0	0	0	0	0	112.1
699	V	35.8	Very low	51.3	Low	134 Å²	134	105.7 Å²	105.7	81%	0.812	61%	0.611	S	S	*	*			trans	-122.3	122	171.8	179.4	0	0	0	0	108.7	L701	V699-L701 PolarHBondContact O-N 3.24Å; V699-L701 VanDerWaalsContact O-N 3.13Å
700	L	41.9	Very low	50.9	Low	171 Å²	171	107.6 Å²	107.6	90%	0.895	62%	0.62	S	S	*	*			trans	-77	96.1	174.8	-82.4	166.2	0	0	0	109.9
701	L	53.9	Low	50.6	Low	85 Å²	85	110.1 Å²	110.1	45%	0.445	63%	0.626	S	S	.	*			trans	-60	144.5	162.7	-67.2	174.6	0	0	0	109.9	V699 D705 K706 L709	V699-L701 PolarHBondContact O-N 3.24Å; V699-L701 VanDerWaalsContact O-N 3.13Å; L701-D705 HydrophobicContact CB-CB 4.26Å; L701-D705 HydrophobicContact CD2-CB 4.4Å; L701-K706 HydrophobicContact CB-CG 4.35Å; L701-K706 WeakPolarHBondContact O-CE 3.35Å; L701-K706 PolarHBondContact O-NZ 3.27Å; L701-K706 VanDerWaalsContact O-NZ 3.15Å; L701-L709 HydrophobicContact CD1-CD1 4.05Å
702	S	60.3	Low	50.3	Low	57 Å²	57	109.8 Å²	109.8	40%	0.399	62%	0.62	S	S	.	*			trans	-71.4	160.8	173.5	81.4	0	0	0	0	110.7	N704 D705 K706	S702-N704 PolarHBondContact O-N 3.12Å; S702-N704 PolarHBondContact OG-N 3.4Å; S702-D705 WeakPolarHBondContact CA-OD2 3.31Å; S702-D705 WeakPolarHBondContact CB-OD2 3.31Å; S702-D705 PolarHBondContact N-OD2 3.41Å; S702-D705 PolarHBondContact O-N 2.99Å; S702-D705 VanDerWaalsContact O-N 3.08Å; S702-D705 PolarHBondContact OG-N 3.41Å; S702-D705 PolarHBondContact OG-OD2 2.95Å; S702-K706 WeakPolarHBondContact O-CG 3.27Å; S702-K706 PolarHBondContact O-N 2.95Å; S702-K706 VanDerWaalsContact O-N 3.07Å
703	D	57.2	Low	50.9	Low	120 Å²	120	107.4 Å²	107.4	64%	0.642	61%	0.611	S	S	*	*	H	α-helix	trans	-69	-20.6	179	-59.4	-53.6	0	0	0	112.8	K706 S707	D703-K706 WeakPolarHBondContact OD1-CD 3.4Å; D703-K706 IonicContact OD1-NZ 2.61Å; D703-K706 PolarHBondContact OD1-NZ 2.93Å; D703-S707 VanDerWaalsContact O-CB 3.28Å; D703-S707 WeakPolarHBondContact O-CB 3.38Å; D703-S707 PolarHBondContact O-N 3.48Å
704	N	53.3	Low	51.5	Low	127 Å²	127	112.4 Å²	112.4	68%	0.679	62%	0.617	S	S	*	*	H	α-helix	trans	-67.5	-41.8	167.5	-104.4	8	0	0	0	112	S702 S707 L708	S702-N704 PolarHBondContact O-N 3.12Å; S702-N704 PolarHBondContact OG-N 3.4Å; N704-S707 WeakPolarHBondContact O-CB 3.49Å; N704-S707 PolarHBondContact O-N 3.4Å; N704-L708 PolarHBondContact O-N 3.35Å
705	D	62.8	Low	51.6	Low	66 Å²	66	110.9 Å²	110.9	35%	0.353	61%	0.607	S	S	.	*	H	α-helix	trans	-68.1	-39.6	179.3	-51.9	-50.8	0	0	0	110.9	L701 S702 S707 L708 L709	L701-D705 HydrophobicContact CB-CB 4.26Å; L701-D705 HydrophobicContact CD2-CB 4.4Å; S702-D705 WeakPolarHBondContact CA-OD2 3.31Å; S702-D705 WeakPolarHBondContact CB-OD2 3.31Å; S702-D705 PolarHBondContact N-OD2 3.41Å; S702-D705 PolarHBondContact O-N 2.99Å; S702-D705 VanDerWaalsContact O-N 3.08Å; S702-D705 PolarHBondContact OG-N 3.41Å; S702-D705 PolarHBondContact OG-OD2 2.95Å; D705-S707 VanDerWaalsContact C-N 3.34Å; D705-L708 PolarHBondContact O-N 3.45Å; D705-L709 WeakPolarHBondContact O-CB 3.08Å; D705-L709 PolarHBondContact O-N 2.66Å
706	K	62	Low	52.4	Low	79 Å²	79	110.6 Å²	110.6	34%	0.343	60%	0.597	S	S	.	*	H	α-helix	trans	-61.3	-42.7	172.3	-64.2	169.2	-154	156.7	0	111.3	L701 S702 D703 L709 Q710	L701-K706 HydrophobicContact CB-CG 4.35Å; L701-K706 WeakPolarHBondContact O-CE 3.35Å; L701-K706 PolarHBondContact O-NZ 3.27Å; L701-K706 VanDerWaalsContact O-NZ 3.15Å; S702-K706 WeakPolarHBondContact O-CG 3.27Å; S702-K706 PolarHBondContact O-N 2.95Å; S702-K706 VanDerWaalsContact O-N 3.07Å; D703-K706 WeakPolarHBondContact OD1-CD 3.4Å; D703-K706 IonicContact OD1-NZ 2.61Å; D703-K706 PolarHBondContact OD1-NZ 2.93Å; K706-L709 PolarHBondContact O-N 3.45Å; K706-Q710 WeakPolarHBondContact O-CB 3.24Å; K706-Q710 WeakPolarHBondContact O-CG 3.43Å; K706-Q710 PolarHBondContact O-N 2.85Å
707	S	62.5	Low	52.9	Low	65 Å²	65	108.2 Å²	108.2	46%	0.455	59%	0.585	S	S	.	*	H	α-helix	trans	-63.5	-44.3	176.3	-175.2	0	0	0	0	111.9	D703 N704 D705 Q710 R711	D703-S707 VanDerWaalsContact O-CB 3.28Å; D703-S707 WeakPolarHBondContact O-CB 3.38Å; D703-S707 PolarHBondContact O-N 3.48Å; N704-S707 WeakPolarHBondContact O-CB 3.49Å; N704-S707 PolarHBondContact O-N 3.4Å; D705-S707 VanDerWaalsContact C-N 3.34Å; S707-Q710 PolarHBondContact O-N 3.28Å; S707-R711 VanDerWaalsContact O-CB 3.28Å; S707-R711 WeakPolarHBondContact O-CB 3.36Å; S707-R711 PolarHBondContact O-N 2.85Å
708	L	61.5	Low	53.2	Low	115 Å²	115	108.2 Å²	108.2	60%	0.602	57%	0.572	S	S	*	*	H	α-helix	trans	-61.1	-47.5	174.7	-85.6	164	0	0	0	112.2	N704 D705 R711 W712	N704-L708 PolarHBondContact O-N 3.35Å; D705-L708 PolarHBondContact O-N 3.45Å; L708-R711 PolarHBondContact O-N 2.87Å; L708-W712 WeakPolarHBondContact O-CB 3.38Å; L708-W712 PolarHBondContact O-N 3.45Å
709	L	62.6	Low	53.7	Low	89 Å²	89	110.2 Å²	110.2	47%	0.466	57%	0.573	S	S	.	*	H	α-helix	trans	-59.8	-49.8	176.1	-84.9	159.1	0	0	0	111.8	L701 D705 K706 R711 W712 T713	L701-L709 HydrophobicContact CD1-CD1 4.05Å; D705-L709 WeakPolarHBondContact O-CB 3.08Å; D705-L709 PolarHBondContact O-N 2.66Å; K706-L709 PolarHBondContact O-N 3.45Å; L709-R711 VanDerWaalsContact C-N 3.26Å; L709-R711 PolarHBondContact O-N 3.09Å; L709-W712 PolarHBondContact O-N 2.97Å; L709-W712 VanDerWaalsContact O-N 3.15Å; L709-T713 PolarHBondContact O-N 3.15Å; L709-T713 PolarHBondContact O-OG1 2.72Å
710	Q	55.4	Low	53.9	Low	140 Å²	140	107.9 Å²	107.9	65%	0.654	56%	0.563	S	S	*	*	H	α-helix	trans	-60.1	-34.9	176.8	-74.9	-178	-0.3	0	0	112.9	K706 S707 K714	K706-Q710 WeakPolarHBondContact O-CB 3.24Å; K706-Q710 WeakPolarHBondContact O-CG 3.43Å; K706-Q710 PolarHBondContact O-N 2.85Å; S707-Q710 PolarHBondContact O-N 3.28Å; Q710-K714 WeakPolarHBondContact O-CB 3.31Å; Q710-K714 WeakPolarHBondContact O-CG 3.4Å; Q710-K714 PolarHBondContact O-N 3.07Å; Q710-K714 VanDerWaalsContact O-N 3.09Å
711	R	54.3	Low	53.7	Low	190 Å²	190	106.5 Å²	106.5	72%	0.717	56%	0.556	S	S	*	*	H	α-helix	trans	-74.6	-31.6	177.7	-159.1	174.9	-167	-172	3.8	112.4	S707 L708 L709 M715	S707-R711 VanDerWaalsContact O-CB 3.28Å; S707-R711 WeakPolarHBondContact O-CB 3.36Å; S707-R711 PolarHBondContact O-N 2.85Å; L708-R711 PolarHBondContact O-N 2.87Å; L709-R711 VanDerWaalsContact C-N 3.26Å; L709-R711 PolarHBondContact O-N 3.09Å; R711-M715 PolarHBondContact O-N 3.1Å
712	W	47.7	Very low	52.8	Low	158 Å²	158	112.1 Å²	112.1	60%	0.598	58%	0.577	S	S	*	*	H	α-helix	trans	-74.6	-46.5	175.5	-163.7	68.5	0	0	0	111.7	L708 L709 K714 M715 I716	L708-W712 WeakPolarHBondContact O-CB 3.38Å; L708-W712 PolarHBondContact O-N 3.45Å; L709-W712 PolarHBondContact O-N 2.97Å; L709-W712 VanDerWaalsContact O-N 3.15Å; W712-K714 VanDerWaalsContact C-N 3.33Å; W712-K714 PolarHBondContact O-N 3.27Å; W712-M715 PolarHBondContact O-N 2.69Å; W712-I716 HydrophobicContact CD2-CD1 3.93Å; W712-I716 HydrophobicContact CE3-CD1 3.73Å; W712-I716 HydrophobicContact CH2-CD1 3.85Å; W712-I716 HydrophobicContact CZ2-CD1 4.04Å; W712-I716 HydrophobicContact CZ3-CD1 3.69Å; W712-I716 PolarHBondContact O-N 3.29Å; W712-I716 VanDerWaalsContact O-N 3.13Å
713	T	58.8	Low	51.4	Low	67 Å²	67	114 Å²	114	41%	0.411	59%	0.59	S	S	.	*	H	α-helix	trans	-55.4	-46.8	171.7	-59.4	0	0	0	0	111.2	L709 M715 I716 D717	L709-T713 PolarHBondContact O-N 3.15Å; L709-T713 PolarHBondContact O-OG1 2.72Å; T713-M715 VanDerWaalsContact C-N 3.26Å; T713-M715 PolarHBondContact O-N 2.67Å; T713-I716 PolarHBondContact O-N 3.36Å; T713-I716 VanDerWaalsContact O-N 3.09Å; T713-D717 WeakPolarHBondContact CG2-OD2 3.44Å; T713-D717 PolarHBondContact O-N 3.04Å
714	K	54.8	Low	50.1	Low	159 Å²	159	117 Å²	117	69%	0.691	60%	0.601	S	S	*	*	H	α-helix	trans	-61.2	-26.5	175.6	-84	-174.2	172.9	-178.3	0	114.9	Q710 W712 S718	Q710-K714 WeakPolarHBondContact O-CB 3.31Å; Q710-K714 WeakPolarHBondContact O-CG 3.4Å; Q710-K714 PolarHBondContact O-N 3.07Å; Q710-K714 VanDerWaalsContact O-N 3.09Å; W712-K714 VanDerWaalsContact C-N 3.33Å; W712-K714 PolarHBondContact O-N 3.27Å; K714-S718 VanDerWaalsContact O-CB 3.25Å; K714-S718 WeakPolarHBondContact O-CB 3.45Å; K714-S718 PolarHBondContact O-N 3.33Å; K714-S718 PolarHBondContact O-OG 3.31Å
715	M	50.4	Low	48.9	Very low	115 Å²	115	117.3 Å²	117.3	57%	0.567	61%	0.607	S	S	*	*	H	α-helix	trans	-73.8	-44.6	171.6	-77.1	-165.6	-60.9	0	0	111.3	R711 W712 T713 S718 C719	R711-M715 PolarHBondContact O-N 3.1Å; W712-M715 PolarHBondContact O-N 2.69Å; T713-M715 VanDerWaalsContact C-N 3.26Å; T713-M715 PolarHBondContact O-N 2.67Å; M715-S718 PolarHBondContact O-N 3.2Å; M715-S718 PolarHBondContact O-OG 3.25Å; M715-C719 PolarHBondContact O-N 3.41Å
716	I	55.1	Low	47.3	Very low	87 Å²	87	119 Å²	119	45%	0.446	63%	0.63	S	S	.	*	H	α-helix	trans	-60.1	-52.1	179.5	-66.8	171.7	0	0	0	110.3	W712 T713 S718 C719	W712-I716 HydrophobicContact CD2-CD1 3.93Å; W712-I716 HydrophobicContact CE3-CD1 3.73Å; W712-I716 HydrophobicContact CH2-CD1 3.85Å; W712-I716 HydrophobicContact CZ2-CD1 4.04Å; W712-I716 HydrophobicContact CZ3-CD1 3.69Å; W712-I716 PolarHBondContact O-N 3.29Å; W712-I716 VanDerWaalsContact O-N 3.13Å; T713-I716 PolarHBondContact O-N 3.36Å; T713-I716 VanDerWaalsContact O-N 3.09Å; I716-S718 PolarHBondContact O-N 2.84Å; I716-C719 PolarHBondContact O-N 3.23Å; I716-C719 VanDerWaalsContact O-N 3.1Å
717	D	49.3	Very low	45.7	Very low	91 Å²	91	120.9 Å²	120.9	49%	0.487	65%	0.653	S	S	.	*	H	α-helix	trans	-62.7	-28.9	-179.8	-60.2	-21.9	0	0	0	112.3	T713 C719 S720	T713-D717 WeakPolarHBondContact CG2-OD2 3.44Å; T713-D717 PolarHBondContact O-N 3.04Å; D717-C719 VanDerWaalsContact C-N 3.3Å; D717-C719 PolarHBondContact O-N 3.45Å; D717-S720 WeakPolarHBondContact CA-OG 3.26Å; D717-S720 PolarHBondContact O-OG 2.84Å; D717-S720 VanDerWaalsContact O-OG 3.07Å
718	S	43.1	Very low	44.2	Very low	83 Å²	83	124.5 Å²	124.5	58%	0.58	67%	0.667	S	S	*	*	H	α-helix	trans	-74.5	-15	178.3	74.9	0	0	0	0	114.8	K714 M715 I716	K714-S718 VanDerWaalsContact O-CB 3.25Å; K714-S718 WeakPolarHBondContact O-CB 3.45Å; K714-S718 PolarHBondContact O-N 3.33Å; K714-S718 PolarHBondContact O-OG 3.31Å; M715-S718 PolarHBondContact O-N 3.2Å; M715-S718 PolarHBondContact O-OG 3.25Å; I716-S718 PolarHBondContact O-N 2.84Å
719	C	44.3	Very low	42.6	Very low	116 Å²	116	126 Å²	126	78%	0.784	68%	0.676	S	S	*	*	H	α-helix	trans	-96.8	-18.4	177.1	-76.9	0	0	0	0	113.4	M715 I716 D717	M715-C719 PolarHBondContact O-N 3.41Å; I716-C719 PolarHBondContact O-N 3.23Å; I716-C719 VanDerWaalsContact O-N 3.1Å; D717-C719 VanDerWaalsContact C-N 3.3Å; D717-C719 PolarHBondContact O-N 3.45Å
720	S	40.9	Very low	40.9	Very low	86 Å²	86	125.1 Å²	125.1	60%	0.601	69%	0.688	S	S	*	*	H	α-helix	trans	-87.4	-19.1	-174.3	41.9	0	0	0	0	115.5	D717	D717-S720 WeakPolarHBondContact CA-OG 3.26Å; D717-S720 PolarHBondContact O-OG 2.84Å; D717-S720 VanDerWaalsContact O-OG 3.07Å
721	D	37.3	Very low	39.6	Very low	142 Å²	142	127.8 Å²	127.8	76%	0.759	70%	0.698	S	S	*	*			trans	-118.8	65.2	-163	-151	-0.5	0	0	0	114.1
722	K	36	Very low	38.3	Very low	203 Å²	203	124.1 Å²	124.1	88%	0.883	70%	0.697	S	S	*	*			trans	-141.2	55.4	171.6	-76	-162.9	177.1	177.1	0	114.1
723	S	30.9	Very low	37.4	Very low	97 Å²	97	125.2 Å²	125.2	68%	0.678	71%	0.706	S	S	*	*	S	Bend	trans	-149.3	97.1	166	62.6	0	0	0	0	113.6
724	Q	29.3	Very low	35.8	Very low	183 Å²	183	128.5 Å²	128.5	86%	0.855	72%	0.721	S	S	*	*			trans	68.6	128.4	171.6	-46.2	178.1	12.9	0	0	113.6
725	T	28.8	Very low	34.6	Very low	132 Å²	132	126.3 Å²	126.3	81%	0.81	72%	0.724	S	S	*	*				-157.8	154.8	55.7	39.2	0	0	0	0	114.5
726	A	29.1	Very low	33.6	Very low	102 Å²	102	127.8 Å²	127.8	84%	0.843	74%	0.735	S	S	*	*			trans	26	116.4	152.6	0	0	0	0	0	121.4
727	S	27.8	Very low	32.3	Very low	118 Å²	118	130.7 Å²	130.7	83%	0.825	75%	0.75	S	S	*	*			trans	-78.6	145.6	156.1	-42.2	0	0	0	0	111.6
728	N	30.1	Very low	31.4	Very low	141 Å²	141	132.3 Å²	132.3	75%	0.754	76%	0.759	S	S	*	*			trans	-156.1	145.4	149.5	-128.8	51.8	0	0	0	110.3
729	D	28.6	Very low	30.9	Very low	146 Å²	146	132.3 Å²	132.3	78%	0.781	76%	0.759	S	S	*	*			trans	38.5	120.7	164.1	-50.5	-47	0	0	0	120.3
730	G	27.2	Very low	30.2	Very low	71 Å²	71	133.4 Å²	133.4	73%	0.732	75%	0.752	S	S	*	*			cis	117.7	110.5	-2.8	0	0	0	0	0	114.4
731	K	27.8	Very low	29.6	Very low	197 Å²	197	138.5 Å²	138.5	86%	0.857	76%	0.758	S	S	*	*			trans	-169.3	136.1	158.5	-117.2	163.9	-173	172	0	115
732	T	27.3	Very low	29.1	Very low	112 Å²	112	138.8 Å²	138.8	69%	0.687	76%	0.758	S	S	*	*			trans	45	119.2	149.1	45.3	0	0	0	0	120.1
733	K	27.8	Very low	28.7	Very low	182 Å²	182	133.5 Å²	133.5	79%	0.791	75%	0.747	S	S	*	*				63.8	131.1	80	-69.7	-171.8	177.8	-172.3	0	112.3
734	D	25.6	Very low	28.6	Very low	135 Å²	135	136.7 Å²	136.7	72%	0.722	75%	0.751	S	S	*	*			cis	-134.9	155.6	37.7	-80.5	-49.2	0	0	0	112.5
735	C	29.4	Very low	28.5	Very low	113 Å²	113	133.4 Å²	133.4	76%	0.764	74%	0.739	S	S	*	*				58.8	140.1	76.6	-45.8	0	0	0	0	114
736	N	31	Very low	28.5	Very low	147 Å²	147	133.3 Å²	133.3	79%	0.786	73%	0.734	S	S	*	*			cis	-158.7	-171.3	17.1	-163.6	4.4	0	0	0	111.8
737	L	27.3	Very low	28.4	Very low	147 Å²	147	137 Å²	137	77%	0.77	73%	0.731	S	S	*	*			trans	101.1	133.7	163.3	-59.8	169.3	0	0	0	116.9
738	N	29.4	Very low	28.4	Very low	126 Å²	126	137.7 Å²	137.7	67%	0.674	73%	0.731	S	S	*	*			cis	-166.9	140	-17.6	-165	-0.4	0	0	0	112
739	S	32.8	Very low	28.3	Very low	82 Å²	82	137.8 Å²	137.8	57%	0.573	73%	0.731	S	S	*	*			trans	61.2	163.3	154.5	-73.5	0	0	0	0	118.2
740	Q	30.4	Very low	28.3	Very low	140 Å²	140	137.9 Å²	137.9	65%	0.654	73%	0.729	S	S	*	*			cis	-170.8	167	-17.9	-106.9	179.4	80.9	0	0	106.5
741	R	29	Very low	28.3	Very low	193 Å²	193	142 Å²	142	73%	0.728	73%	0.728	S	S	*	*			cis	-163.6	175.6	-1.5	-142.2	-179.7	175.5	132	-16.1	107.7
742	I	26.6	Very low	28.4	Very low	147 Å²	147	135.9 Å²	135.9	75%	0.754	72%	0.715	S	S	*	*			trans	69.1	158.2	154.2	-71.3	160.6	0	0	0	116.2
743	S	27.6	Very low	28.5	Very low	92 Å²	92	141.4 Å²	141.4	64%	0.643	72%	0.723	S	S	*	*				-161.4	-178.3	-74.6	49.1	0	0	0	0	110.4
744	E	28.7	Very low	28.5	Very low	164 Å²	164	141.4 Å²	141.4	77%	0.766	72%	0.723	S	S	*	*			trans	96.5	124.5	160.9	-59.6	-154.6	-175.5	0	0	122.7
745	N	27.1	Very low	28.6	Very low	115 Å²	115	139 Å²	139	62%	0.615	72%	0.718	S	S	*	*				66.8	115.5	125.5	-63.3	-31.3	0	0	0	125.3
746	N	27.9	Very low	28.4	Very low	129 Å²	129	142.6 Å²	142.6	69%	0.69	72%	0.723	S	S	*	*				66	109.8	123.9	-68.8	-42.9	0	0	0	124.5
747	K	27.1	Very low	29.2	Very low	179 Å²	179	140.3 Å²	140.3	78%	0.778	72%	0.716	S	S	*	*				71.2	142.8	104.6	-139.7	179	-172.5	176.3	0	121.3
748	T	27.8	Very low	29.2	Very low	134 Å²	134	140.9 Å²	140.9	82%	0.822	72%	0.715	S	S	*	*			trans	75.5	162.3	164.4	71.3	0	0	0	0	118.8
749	N	27	Very low	29.3	Very low	143 Å²	143	141.8 Å²	141.8	77%	0.765	72%	0.715	S	S	*	*			cis	-169.8	178	-42.5	-169.4	24.7	0	0	0	108.8
750	M	28.7	Very low	29	Very low	148 Å²	148	144.7 Å²	144.7	73%	0.729	72%	0.719	S	S	*	*			trans	70.1	149.6	173.3	-75.6	173.3	160.4	0	0	115
751	E	28.4	Very low	28.9	Very low	156 Å²	156	144.9 Å²	144.9	73%	0.729	72%	0.724	S	S	*	*			cis	168.6	151.4	-16.2	-106.4	-165.4	111.7	0	0	102.5
752	A	29.6	Very low	28.8	Very low	70 Å²	70	141.5 Å²	141.5	58%	0.579	72%	0.724	S	S	*	*			cis	-162.5	-177.3	-17.7	0	0	0	0	0	104.8
753	R	28.8	Very low	28.9	Very low	228 Å²	228	139 Å²	139	86%	0.86	72%	0.72	S	S	*	*			cis	-141.6	-159.6	19.5	-60.3	173.9	179.2	99.3	8.8	106.2
754	K	28.8	Very low	29	Very low	181 Å²	181	143.3 Å²	143.3	79%	0.787	73%	0.73	S	S	*	*			cis	-160.5	145.8	5.6	-168.2	-148.3	160.7	-154.5	0	109.4
755	S	27	Very low	29	Very low	86 Å²	86	141.7 Å²	141.7	60%	0.601	73%	0.731	S	S	*	*			trans	43.5	101.6	154.2	61.8	0	0	0	0	121
756	Q	26.3	Very low	29.2	Very low	188 Å²	188	145.7 Å²	145.7	88%	0.879	74%	0.743	S	S	*	*			trans	-74.8	-170.5	136.9	-101.8	-178.7	-5.5	0	0	110.5
757	P	46	Very low	30.1	Very low	99 Å²	99	145.2 Å²	145.2	64%	0.643	75%	0.747	S	S	*	*			cis	-125.7	-163.1	7.5	33.2	-9.6	0	0	0	112.7
758	H	28	Very low	30.3	Very low	159 Å²	159	143.3 Å²	143.3	74%	0.736	75%	0.745	S	S	*	*			cis	-134.7	160.8	4.4	-96.1	-79.4	0	0	0	107.6
759	E	30.8	Very low	30.6	Very low	145 Å²	145	143.3 Å²	143.3	68%	0.678	74%	0.736	S	S	*	*				59.4	143.9	56.1	-69.6	-155.9	123.8	0	0	115
760	Q	28.2	Very low	30.9	Very low	142 Å²	142	144.9 Å²	144.9	66%	0.664	74%	0.739	S	S	*	*			cis	-156.6	156.7	4.7	-128.2	178.2	35.7	0	0	112.8
761	L	27.4	Very low	30.8	Very low	144 Å²	144	141.2 Å²	141.2	75%	0.754	74%	0.738	S	S	*	*			trans	29.3	132	144.3	-96.2	66.4	0	0	0	125.3
762	V	27.8	Very low	30.7	Very low	122 Å²	122	142 Å²	142	74%	0.739	75%	0.746	S	S	*	*				85.4	102.2	123.2	168.4	0	0	0	0	123.7
763	S	27	Very low	30.6	Very low	94 Å²	94	147.8 Å²	147.8	66%	0.657	76%	0.759	S	S	*	*				65	132.5	124.4	92.5	0	0	0	0	126.4
764	Q	30.3	Very low	31.6	Very low	184 Å²	184	142.1 Å²	142.1	86%	0.86	75%	0.752	S	S	*	*			trans	74	168.5	136.9	-77.5	-167.4	37.2	0	0	122.1
765	V	28.3	Very low	33	Very low	129 Å²	129	138.7 Å²	138.7	78%	0.782	75%	0.748	S	S	*	*			trans	89.2	129.5	170.6	-171.2	0	0	0	0	118
766	K	32.2	Very low	34.3	Very low	199 Å²	199	140.4 Å²	140.4	87%	0.865	76%	0.757	S	S	*	*			trans	-112.2	152.6	158.2	-70.6	-176.5	175.5	-177.3	0	107.9
767	P	46.9	Very low	34.6	Very low	119 Å²	119	135.4 Å²	135.4	77%	0.773	75%	0.748	S	S	*	*				-150.5	175.7	109.8	37.2	-19.6	0	0	0	117.2
768	N	31.4	Very low	34.2	Very low	140 Å²	140	136.4 Å²	136.4	75%	0.749	75%	0.752	S	S	*	*			trans	-29.5	167.1	156.2	-84.3	-16.4	0	0	0	118.6
769	Q	34.9	Very low	34.4	Very low	133 Å²	133	134.4 Å²	134.4	62%	0.621	75%	0.751	S	S	*	*			cis	176.4	170.4	-15.4	-169.1	-172.6	97.4	0	0	109
770	Q	32.8	Very low	34.4	Very low	177 Å²	177	134.2 Å²	134.2	83%	0.827	75%	0.751	S	S	*	*			trans	74.1	151.9	165.2	-49	175.7	8.8	0	0	116.6
771	G	27	Very low	34.6	Very low	70 Å²	70	135 Å²	135	72%	0.722	75%	0.754	S	S	*	*			cis	154.8	136.2	-10.5	0	0	0	0	0	113
772	L	26.2	Very low	34.5	Very low	172 Å²	172	135.6 Å²	135.6	90%	0.901	76%	0.758	S	S	*	*			trans	-156.9	151.8	176.2	-109	162.4	0	0	0	113.5
773	F	27.1	Very low	34.4	Very low	192 Å²	192	135 Å²	135	84%	0.842	75%	0.754	S	S	*	*			trans	-168.6	-179.9	-171.1	-103.6	-65.8	0	0	0	106.8
774	P	49.9	Very low	34.6	Very low	109 Å²	109	137 Å²	137	71%	0.708	76%	0.757	S	S	*	*			cis	-126.5	-117.7	-15.8	24.8	1.1	0	0	0	115
775	P	57.1	Low	35.3	Very low	110 Å²	110	134.1 Å²	134.1	71%	0.714	75%	0.754	S	S	*	*				-118.9	-169.4	-104.9	39.1	-21.6	0	0	0	114.3
776	P	55.7	Low	35.2	Very low	121 Å²	121	136.7 Å²	136.7	79%	0.786	76%	0.755	S	S	*	*			cis	-119.3	-147.5	1.6	42.7	-24.9	0	0	0	112.2
777	A	32	Very low	35	Very low	83 Å²	83	132.9 Å²	132.9	69%	0.686	75%	0.753	S	S	*	*			cis	-162.9	-178.8	6	0	0	0	0	0	108.9
778	T	37.3	Very low	34.1	Very low	120 Å²	120	133 Å²	133	74%	0.736	75%	0.752	S	S	*	*			cis	-178	151.9	-37.4	-74.6	0	0	0	0	107.1
779	T	31.6	Very low	33.8	Very low	117 Å²	117	132.2 Å²	132.2	72%	0.718	76%	0.757	S	S	*	*			trans	70.1	138.9	175.1	-81	0	0	0	0	115.2
780	Q	31.4	Very low	33.5	Very low	141 Å²	141	134.7 Å²	134.7	66%	0.659	77%	0.769	S	S	*	*			cis	-146.8	165	-18.7	-98.5	177.5	28	0	0	106.1
781	Q	32.1	Very low	33.2	Very low	158 Å²	158	138.2 Å²	138.2	74%	0.738	78%	0.775	S	S	*	*			cis	64.8	148.8	48.9	-80.7	174.8	-35.7	0	0	114.7
782	L	25.3	Very low	33.2	Very low	158 Å²	158	144.5 Å²	144.5	83%	0.827	78%	0.782	S	S	*	*			cis	-102.3	-178.7	2	-70.4	84.1	0	0	0	112.7
783	T	26.1	Very low	33.9	Very low	109 Å²	109	141.9 Å²	141.9	67%	0.669	78%	0.775	S	S	*	*			trans	-162.7	140.3	-151.5	-53	0	0	0	0	115.1
784	L	30.9	Very low	35	Very low	136 Å²	136	139.1 Å²	139.1	71%	0.712	78%	0.776	S	S	*	*			trans	72.9	175.1	157.3	-80.5	177.5	0	0	0	118.7	F786	L784-F786 HydrophobicContact CD2-CD2 3.96Å; L784-F786 HydrophobicContact CD2-CE2 4.2Å
785	P	45	Very low	33.9	Very low	124 Å²	124	137.3 Å²	137.3	81%	0.805	78%	0.778	S	S	*	*			cis	-142.7	-179.3	22.9	44.7	-23.7	0	0	0	122
786	F	27.3	Very low	32.6	Very low	183 Å²	183	140 Å²	140	80%	0.803	79%	0.786	S	S	*	*			trans	-89.2	172.8	178.5	-90.6	-112.4	0	0	0	114.4	L784	L784-F786 HydrophobicContact CD2-CD2 3.96Å; L784-F786 HydrophobicContact CD2-CE2 4.2Å
787	S	26.1	Very low	31.3	Very low	118 Å²	118	138.4 Å²	138.4	83%	0.825	78%	0.783	S	S	*	*				174.2	178.1	105.2	-153.7	0	0	0	0	115.9
788	V	28.2	Very low	31.1	Very low	122 Å²	122	140.7 Å²	140.7	74%	0.739	79%	0.788	S	S	*	*			trans	-135.7	150.3	-160.4	170	0	0	0	0	112.7
789	S	25.3	Very low	30.5	Very low	123 Å²	123	146.6 Å²	146.6	86%	0.86	80%	0.797	S	S	*	*			trans	-162.8	167.8	155.1	-96.1	0	0	0	0	116.7
790	Q	28.2	Very low	30.1	Very low	185 Å²	185	144.9 Å²	144.9	86%	0.864	80%	0.803	S	S	*	*			trans	-104.8	171	-161.9	-48.6	169.2	9.9	0	0	114.8
791	R	28.5	Very low	29.7	Very low	252 Å²	252	141.3 Å²	141.3	95%	0.951	80%	0.803	S	S	*	*			trans	-158.8	167.9	147.9	-111.8	167.9	-152.9	-145.5	4.8	114.3
792	K	26.3	Very low	29.4	Very low	201 Å²	201	141.3 Å²	141.3	87%	0.874	81%	0.807	S	S	*	*			trans	-132	160.4	-174.5	-119.2	-179.3	179.1	175.8	0	110.9
793	P	40.1	Very low	29.3	Very low	118 Å²	118	140.4 Å²	140.4	77%	0.766	80%	0.803	S	S	*	*			trans	-101.8	-160.3	-177.1	45.7	-38.3	0	0	0	112
794	P	51.5	Low	29.2	Very low	133 Å²	133	142.8 Å²	142.8	86%	0.864	81%	0.808	S	S	*	*				-120.5	-171.8	-111.3	30	-6.5	0	0	0	115.2
795	G	26.4	Very low	28.8	Very low	71 Å²	71	144.4 Å²	144.4	73%	0.732	81%	0.814	S	S	*	*			trans	-161.4	163	174.5	0	0	0	0	0	114
796	D	29.4	Very low	27.8	Very low	168 Å²	168	142.3 Å²	142.3	90%	0.898	81%	0.808	S	S	*	*			trans	-104.3	167.1	-159	-61.1	-70.7	0	0	0	118
797	A	28.3	Very low	27.6	Very low	87 Å²	87	140 Å²	140	72%	0.719	81%	0.808	S	S	*	*			trans	103.4	111.9	131.2	0	0	0	0	0	123.6
798	V	27	Very low	27.7	Very low	131 Å²	131	140.9 Å²	140.9	79%	0.794	81%	0.808	S	S	*	*				93.6	141.4	119.5	165.7	0	0	0	0	122.5
799	R	25.1	Very low	27.6	Very low	244 Å²	244	138.5 Å²	138.5	92%	0.921	81%	0.809	S	S	*	*			trans	73.7	139.4	-177.3	-69	-179.9	178.2	-144.8	-1.5	115.4
800	G	23.7	Very low	27.6	Very low	81 Å²	81	135.7 Å²	135.7	84%	0.835	80%	0.8	S	S	*	*			cis	107.6	126.5	-1.8	0	0	0	0	0	113.4
801	G	22.9	Very low	27.6	Very low	65 Å²	65	137.5 Å²	137.5	67%	0.67	80%	0.8	S	S	*	*			cis	-178.7	-136.3	2.6	0	0	0	0	0	110.5
802	I	24.9	Very low	27.7	Very low	159 Å²	159	131.6 Å²	131.6	82%	0.815	79%	0.792	S	S	*	*			trans	91	157.8	164.9	-43.4	154.2	0	0	0	116.6
803	D	24.2	Very low	27.8	Very low	139 Å²	139	130 Å²	130	74%	0.743	79%	0.785	S	S	*	*			trans	67.2	135.3	177.5	-63.6	-33.4	0	0	0	118.2
804	M	24.3	Very low	27.3	Very low	158 Å²	158	129.9 Å²	129.9	78%	0.778	78%	0.778	S	S	*	*			cis	91.9	139	37.2	-82.8	-142.4	-177.1	0	0	115.5
805	M	22.2	Very low	26.2	Very low	170 Å²	170	129.2 Å²	129.2	84%	0.837	77%	0.767	S	S	*	*			trans	1	151.2	158	-54.1	-175.4	-166.9	0	0	119.8
806	A	23.6	Very low	26.2	Very low	81 Å²	81	131.3 Å²	131.3	67%	0.669	77%	0.766	S	S	*	*			cis	179	-177.6	-13.8	0	0	0	0	0	106.6
807	V	24.5	Very low	26	Very low	134 Å²	134	131.5 Å²	131.5	81%	0.812	77%	0.766	S	S	*	*			trans	66.5	133.4	158.7	162.9	0	0	0	0	115
808	T	26.2	Very low	25.7	Very low	136 Å²	136	136 Å²	136	83%	0.834	77%	0.772	S	S	*	*			cis	-158.1	173.3	1.2	14	0	0	0	0	106.5
809	G	27.1	Very low	26.8	Very low	72 Å²	72	134.1 Å²	134.1	74%	0.742	76%	0.762	S	S	*	*			cis	156.8	143.5	1.8	0	0	0	0	0	110.3
810	G	24.3	Very low	26.7	Very low	65 Å²	65	131.2 Å²	131.2	67%	0.67	76%	0.759	S	S	*	*			trans	163	92.1	-177.3	0	0	0	0	0	110.7
811	Y	29.8	Very low	27	Very low	222 Å²	222	131.5 Å²	131.5	87%	0.871	75%	0.753	S	S	*	*				58	119.8	82.7	-71.2	-66.1	0	0	0	111.6
812	V	29.2	Very low	27.1	Very low	129 Å²	129	138.3 Å²	138.3	78%	0.782	77%	0.768	S	S	*	*			cis	-155.7	156.8	20.4	132.9	0	0	0	0	108.6
813	K	29.6	Very low	27.1	Very low	166 Å²	166	133.7 Å²	133.7	72%	0.722	76%	0.759	S	S	*	*			cis	-177.6	168.9	-23.7	-159.1	-175.1	172	-167.5	0	109.1
814	N	29.4	Very low	27.1	Very low	116 Å²	116	134 Å²	134	62%	0.62	76%	0.761	S	S	*	*			trans	77.5	133.6	169	-61.8	51.9	0	0	0	115.8
815	D	27.3	Very low	27.2	Very low	120 Å²	120	136.8 Å²	136.8	64%	0.642	76%	0.763	S	S	*	*			cis	-152.8	131.6	-10.6	-103	-39.2	0	0	0	108.5
816	T	27.5	Very low	27.4	Very low	115 Å²	115	137 Å²	137	71%	0.706	76%	0.762	S	S	*	*				70.4	108	88.6	-54.5	0	0	0	0	110.7
817	L	25.1	Very low	27.5	Very low	172 Å²	172	138.4 Å²	138.4	90%	0.901	76%	0.762	S	S	*	*				-150.4	-178.5	54.3	-103.3	176	0	0	0	115.6
818	Q	21.9	Very low	27.6	Very low	180 Å²	180	140.3 Å²	140.3	84%	0.841	76%	0.762	S	S	*	*			trans	-104.7	-140.5	168.5	-154	-161.1	28.1	0	0	111.1
819	P	50.7	Low	27.7	Very low	92 Å²	92	142.9 Å²	142.9	60%	0.597	76%	0.762	S	S	*	*			trans	-116.5	-177.5	-140.7	42.8	-25.9	0	0	0	116.4
820	H	23	Very low	27.7	Very low	184 Å²	184	144.3 Å²	144.3	85%	0.852	77%	0.767	S	S	*	*			trans	78.2	135	162.3	-96.5	-85.8	0	0	0	120.1
821	A	30.2	Very low	27.8	Very low	86 Å²	86	144.2 Å²	144.2	71%	0.711	77%	0.766	S	S	*	*			trans	64.1	92.1	145.3	0	0	0	0	0	120.5
822	E	23.5	Very low	27.8	Very low	208 Å²	208	140.2 Å²	140.2	97%	0.972	76%	0.764	S	S	*	*			trans	-163.2	154.8	140.1	-108.9	166.8	-153.2	0	0	107.7
823	G	25.4	Very low	27.6	Very low	62 Å²	62	137.2 Å²	137.2	64%	0.639	76%	0.759	S	S	*	*			cis	172.5	151.9	-6.2	0	0	0	0	0	110.7
824	N	25.4	Very low	27.7	Very low	145 Å²	145	135.7 Å²	135.7	78%	0.775	76%	0.759	S	S	*	*			trans	62.3	141.8	176	-70.9	-24	0	0	0	116.7
825	R	24.7	Very low	27.8	Very low	217 Å²	217	140.4 Å²	140.4	82%	0.819	77%	0.768	S	S	*	*			cis	85.7	149.7	39.4	-74.9	-175.6	163.6	-170	-2.9	113.8
826	E	27.2	Very low	27.9	Very low	176 Å²	176	139.6 Å²	139.6	82%	0.822	77%	0.772	S	S	*	*			trans	75.5	147.5	171.6	-64.5	173.9	-162.1	0	0	117.2
827	T	26.6	Very low	27.9	Very low	110 Å²	110	137.7 Å²	137.7	68%	0.675	78%	0.775	S	S	*	*				-163.1	153.6	-56.1	5.5	0	0	0	0	109.6
828	E	25.2	Very low	28.1	Very low	173 Å²	173	137.6 Å²	137.6	81%	0.808	77%	0.77	S	S	*	*			trans	62.3	172.6	152.4	-70.5	-175	143.6	0	0	119
829	F	29.8	Very low	28.4	Very low	190 Å²	190	135.9 Å²	135.9	83%	0.833	76%	0.762	S	S	*	*				-159.9	129.6	-56.9	-149	-78.2	0	0	0	110.5
830	A	26.8	Very low	27.3	Very low	102 Å²	102	137.9 Å²	137.9	84%	0.843	77%	0.767	S	S	*	*			trans	174.9	135.9	155.3	0	0	0	0	0	108.6
831	G	26.7	Very low	27.4	Very low	63 Å²	63	136.4 Å²	136.4	65%	0.649	76%	0.761	S	S	*	*			cis	154.5	161.4	2.1	0	0	0	0	0	108.5
832	V	29	Very low	27.3	Very low	138 Å²	138	138.7 Å²	138.7	84%	0.836	77%	0.766	S	S	*	*			cis	-153.9	147.1	-3.8	-179.6	0	0	0	0	105.2
833	G	25.9	Very low	27.4	Very low	66 Å²	66	139.9 Å²	139.9	68%	0.68	76%	0.761	S	S	*	*			cis	155.1	-160.2	0.7	0	0	0	0	0	110.5
834	N	31.6	Very low	28.3	Very low	134 Å²	134	141.4 Å²	141.4	72%	0.717	76%	0.76	S	S	*	*			trans	58.9	138.4	159.9	-63.8	2.8	0	0	0	120.1
835	W	29.8	Very low	28.4	Very low	216 Å²	216	140.2 Å²	140.2	82%	0.818	76%	0.758	S	S	*	*			cis	-161	161.6	0.1	-129.3	34.2	0	0	0	112.1
836	S	30.1	Very low	28.7	Very low	103 Å²	103	138.9 Å²	138.9	72%	0.72	76%	0.762	S	S	*	*			trans	32.6	137.4	153	61.4	0	0	0	0	122.2
837	G	27.3	Very low	28.8	Very low	75 Å²	75	139 Å²	139	77%	0.773	76%	0.762	S	S	*	*			cis	168.2	176.3	1.1	0	0	0	0	0	114.6
838	Q	28.6	Very low	29.8	Very low	170 Å²	170	139.5 Å²	139.5	79%	0.794	77%	0.767	S	S	*	*			trans	-19.1	159	166.4	-69.7	-176.8	21.6	0	0	119.7
839	Q	28.9	Very low	30	Very low	143 Å²	143	137.9 Å²	137.9	67%	0.668	76%	0.764	S	S	*	*			cis	-166.5	167.2	17.7	-132.1	178	13.4	0	0	112.6
840	L	27.6	Very low	29.9	Very low	135 Å²	135	140 Å²	140	71%	0.707	77%	0.767	S	S	*	*			trans	38.3	153.9	143.2	-99.1	66.2	0	0	0	122
841	E	26	Very low	30.2	Very low	153 Å²	153	141.3 Å²	141.3	72%	0.715	76%	0.764	S	S	*	*			cis	-169.8	176	-7.3	-149.9	-176.8	159.8	0	0	111.9
842	T	27.9	Very low	31.1	Very low	133 Å²	133	144 Å²	144	82%	0.816	77%	0.77	S	S	*	*			trans	84.4	175.2	156.8	67.1	0	0	0	0	122.6
843	R	25.5	Very low	31.1	Very low	233 Å²	233	145.8 Å²	145.8	88%	0.879	77%	0.769	S	S	*	*			trans	-125	-174.5	-155	-116.1	-175.3	170.1	-173	-1.5	108.9
844	P	44.4	Very low	32.7	Very low	95 Å²	95	148 Å²	148	62%	0.617	77%	0.772	S	S	*	*			cis	-138.5	179.6	-26.9	35.5	-15.2	0	0	0	115.5
845	T	26.8	Very low	32.6	Very low	120 Å²	120	145.5 Å²	145.5	74%	0.736	77%	0.77	S	S	*	*			trans	54.2	124.9	147.9	48.2	0	0	0	0	122.9
846	Q	30.4	Very low	32.7	Very low	189 Å²	189	140.4 Å²	140.4	88%	0.883	77%	0.767	S	S	*	*				-178.8	159.2	107.3	-96.8	177.5	49.2	0	0	112.8
847	Q	30.6	Very low	32.8	Very low	177 Å²	177	140 Å²	140	83%	0.827	76%	0.764	S	S	*	*			trans	-110.6	152	161.2	-67.9	-172.8	-11.8	0	0	108.2
848	P	46.7	Very low	32.9	Very low	122 Å²	122	145.4 Å²	145.4	79%	0.792	77%	0.767	S	S	*	*				-152.2	130.5	95.3	35.3	-15.6	0	0	0	117.5
849	N	29.8	Very low	33	Very low	138 Å²	138	143.9 Å²	143.9	74%	0.738	76%	0.763	S	S	*	*				36.4	108.9	119.9	-167.7	13.4	0	0	0	120.9
850	R	28.7	Very low	33	Very low	235 Å²	235	145.4 Å²	145.4	89%	0.887	77%	0.771	S	S	*	*				177.7	152.6	121.8	-99.6	173.6	-178	-168.9	0.9	115.8
851	T	31.4	Very low	33	Very low	129 Å²	129	144.6 Å²	144.6	79%	0.791	78%	0.776	S	S	*	*			trans	-88.1	172.9	165.3	37.1	0	0	0	0	111.1
852	P	45.8	Very low	33.3	Very low	119 Å²	119	145.9 Å²	145.9	77%	0.773	78%	0.782	S	S	*	*			cis	-145.7	-177.3	25.6	44.2	-23	0	0	0	119.9
853	Q	30.1	Very low	34.6	Very low	176 Å²	176	144.6 Å²	144.6	82%	0.822	78%	0.776	S	S	*	*			trans	-29.8	177.2	152.6	-92.5	-173.8	8.1	0	0	120.1
854	P	59.7	Low	36.2	Very low	112 Å²	112	139.1 Å²	139.1	73%	0.727	77%	0.771	S	S	*	*			cis	-141.4	-147.2	-17	37.5	-14.3	0	0	0	114.3
855	A	27.9	Very low	36.5	Very low	82 Å²	82	140.2 Å²	140.2	68%	0.678	78%	0.778	S	S	*	*			trans	81.6	132	175.6	0	0	0	0	0	115.4
856	S	32.7	Very low	37.1	Very low	109 Å²	109	141.9 Å²	141.9	76%	0.762	78%	0.782	S	S	*	*			cis	76.6	138.1	35.2	89	0	0	0	0	113.5
857	S	31.6	Very low	38.1	Very low	94 Å²	94	138.8 Å²	138.8	66%	0.657	78%	0.779	S	S	*	*			cis	-167.3	164.6	20.2	-9.2	0	0	0	0	113.8
858	F	30.8	Very low	38.4	Very low	189 Å²	189	140 Å²	140	83%	0.829	78%	0.781	S	S	*	*			trans	85.5	145.2	143.3	-91.5	-131	0	0	0	124.4
859	L	29.2	Very low	38.6	Very low	138 Å²	138	140.3 Å²	140.3	72%	0.723	78%	0.783	S	S	*	*			trans	67.1	131.5	161.9	-59.2	161.7	0	0	0	118.1
860	Q	30.6	Very low	38.8	Very low	176 Å²	176	142.3 Å²	142.3	82%	0.822	79%	0.788	S	S	*	*			cis	84.1	117.8	33.7	-163.7	172.6	6.4	0	0	111.8
861	S	27.3	Very low	40	Very low	117 Å²	117	136.4 Å²	136.4	82%	0.818	78%	0.78	S	S	*	*				-155.1	-157	56.1	57.2	0	0	0	0	115.9
862	Q	32.1	Very low	39.9	Very low	180 Å²	180	138.3 Å²	138.3	84%	0.841	78%	0.78	S	S	*	*			trans	-115	-160.6	-170.6	-66.6	-171.3	-21.8	0	0	113.4
863	P	55.1	Low	39.1	Very low	106 Å²	106	140.5 Å²	140.5	69%	0.688	78%	0.784	S	S	*	*				-121.4	-155.6	-71.2	38.9	-21.2	0	0	0	111.5
864	P	58.8	Low	39.2	Very low	119 Å²	119	139.4 Å²	139.4	77%	0.773	78%	0.783	S	S	*	*			cis	-113.3	-110.8	-16.1	35.4	-12.7	0	0	0	111.6
865	P	51.7	Low	38.4	Very low	118 Å²	118	140.1 Å²	140.1	77%	0.766	79%	0.788	S	S	*	*			cis	-128.3	-162.8	-2.7	45.3	-26.9	0	0	0	115.8
866	D	38.2	Very low	38.4	Very low	155 Å²	155	143.4 Å²	143.4	83%	0.829	79%	0.793	S	S	*	*			trans	-119.8	157.6	174.6	-104.5	-37.4	0	0	0	112.1
867	P	52.2	Low	38.1	Very low	124 Å²	124	145.6 Å²	145.6	81%	0.805	79%	0.791	S	S	*	*				-154.3	171.8	113.9	39.1	-21	0	0	0	118.1
868	K	36.5	Very low	37.8	Very low	201 Å²	201	144.6 Å²	144.6	87%	0.874	78%	0.784	S	S	*	*			trans	-116.3	161.7	166.2	-65	-178.4	178.4	177.1	0	111.4
869	P	49.8	Very low	37.5	Very low	130 Å²	130	145.2 Å²	145.2	84%	0.844	79%	0.787	S	S	*	*				-152.5	-176.8	98.9	38.8	-19.5	0	0	0	116.6
870	Q	34.7	Very low	37.6	Very low	180 Å²	180	146.4 Å²	146.4	84%	0.841	79%	0.793	S	S	*	*			trans	-110.1	175.4	168.2	-67.6	-175.8	-32.6	0	0	111.3
871	P	53	Low	38.1	Very low	110 Å²	110	144.3 Å²	144.3	71%	0.714	79%	0.794	S	S	*	*				-153.6	155.9	99.7	34.4	-13.7	0	0	0	119.8
872	H	31.3	Very low	38	Very low	169 Å²	169	148.8 Å²	148.8	78%	0.782	80%	0.799	S	S	*	*			trans	34.4	133.5	146.6	-49.9	-54.9	0	0	0	125.3
873	L	28.8	Very low	38	Very low	166 Å²	166	144.7 Å²	144.7	87%	0.869	80%	0.796	S	S	*	*				-178.4	165.2	95.8	-93.3	173.8	0	0	0	113.7
874	L	31.7	Very low	37.7	Very low	153 Å²	153	145.2 Å²	145.2	80%	0.801	80%	0.799	S	S	*	*			trans	-132.4	166.1	175.7	-61.5	171.9	0	0	0	109.5
875	P	42.9	Very low	37.4	Very low	127 Å²	127	144.6 Å²	144.6	83%	0.825	80%	0.796	S	S	*	*				-153.9	162.5	88.2	39.6	-19.6	0	0	0	119.5
876	L	26.7	Very low	36.4	Very low	150 Å²	150	145.8 Å²	145.8	79%	0.785	80%	0.8	S	S	*	*			trans	-18.5	149.4	161.2	-92.4	65.6	0	0	0	125.2
877	E	26.5	Very low	36	Very low	156 Å²	156	142.5 Å²	142.5	73%	0.729	79%	0.794	S	S	*	*				80	131.5	126.8	-76.9	-68.7	124.8	0	0	126.8
878	S	25.8	Very low	34.9	Very low	72 Å²	72	143.8 Å²	143.8	50%	0.503	79%	0.793	S	S	.	*			trans	28.5	142.7	147.5	50.4	0	0	0	0	125.6
879	F	25.6	Very low	34.6	Very low	203 Å²	203	145.3 Å²	145.3	89%	0.89	79%	0.793	S	S	*	*				179.4	163.4	100.5	-100.8	-76.5	0	0	0	114.3
880	L	30.9	Very low	33.6	Very low	163 Å²	163	147.3 Å²	147.3	85%	0.853	79%	0.792	S	S	*	*			trans	-96.9	162.7	-179.3	-70.5	160.5	0	0	0	112.6
881	P	40.1	Very low	33.5	Very low	131 Å²	131	144.1 Å²	144.1	85%	0.851	78%	0.784	S	S	*	*				-152.7	179.2	104.5	38.6	-19.1	0	0	0	118.5
882	K	26.4	Very low	32.2	Very low	212 Å²	212	146.5 Å²	146.5	92%	0.922	79%	0.791	S	S	*	*			trans	-66.7	172.3	-164.7	-63.5	171	173.7	175.9	0	120
883	A	30.5	Very low	31.9	Very low	93 Å²	93	141.5 Å²	141.5	77%	0.769	79%	0.785	S	S	*	*			trans	-76.6	-161.9	165.9	0	0	0	0	0	112.4
884	P	50.2	Low	31.6	Very low	117 Å²	117	136 Å²	136	76%	0.76	76%	0.76	S	S	*	*			cis	-137.5	-142.8	22.8	43.8	-20.1	0	0	0	111.8
885	P	51.9	Low	31.4	Very low	107 Å²	107	133.5 Å²	133.5	70%	0.695	75%	0.751	S	S	*	*			cis	-134.9	-162.2	-13.4	34	-10	0	0	0	115.2
886	V	31.1	Very low	30.5	Very low	142 Å²	142	129.8 Å²	129.8	86%	0.861	72%	0.724	S	S	*	*			trans	77.5	116.9	171.2	-171.4	0	0	0	0	114
887	A	29.4	Very low	30.7	Very low	86 Å²	86	128 Å²	128	71%	0.711	72%	0.72	S	S	*	*			cis	-161	-170.8	-9.5	0	0	0	0	0	107.9
888	I	29	Very low	30.9	Very low	151 Å²	151	130.7 Å²	130.7	77%	0.774	72%	0.723	S	S	*	*			cis	-157	160.9	9.2	-158.9	165.3	0	0	0	111
889	R	29.4	Very low	31.1	Very low	233 Å²	233	130.3 Å²	130.3	88%	0.879	73%	0.731	S	S	*	*			trans	52.6	77.8	164	-85.8	-178.7	168.3	174.2	-4.5	118.7
890	E	30.1	Very low	31.4	Very low	173 Å²	173	129.3 Å²	129.3	81%	0.808	73%	0.729	S	S	*	*				-19.1	155.2	112.1	-69.1	168	-166.4	0	0	116.2
891	T	31.5	Very low	31.4	Very low	112 Å²	112	125.9 Å²	125.9	69%	0.687	72%	0.718	S	S	*	*			cis	-159.5	152.6	9.3	2.1	0	0	0	0	113.3
892	N	26.2	Very low	30.9	Very low	161 Å²	161	126 Å²	126	86%	0.861	71%	0.712	S	S	*	*			trans	29.8	126.7	148.8	-61.4	-5	0	0	0	123.3
893	G	25.3	Very low	31	Very low	63 Å²	63	120.5 Å²	120.5	65%	0.649	69%	0.692	S	S	*	*			trans	117	162.9	143.3	0	0	0	0	0	117.4
894	S	23.1	Very low	30.9	Very low	51 Å²	51	122.4 Å²	122.4	36%	0.357	69%	0.689	S	S	.	*			trans	32.8	128.5	131.9	-84.5	0	0	0	0	118.9	T514 T515	T514-S894 PolarHBondContact O-OG 2.98Å; T514-S894 WeakPolarHBondContact OG1-CA 3.08Å; T514-S894 PolarHBondContact OG1-N 3.19Å; T514-S894 PolarHBondContact OG1-OG 2.77Å; T515-S894 PolarHBondContact OG1-OG 3.43Å
895	V	26	Very low	30.4	Very low	100 Å²	100	121.5 Å²	121.5	61%	0.606	68%	0.684	S	S	*	*			cis	-151.7	166.4	18.2	-176.4	0	0	0	0	110.7
896	D	25.6	Very low	29.3	Very low	49 Å²	49	123.4 Å²	123.4	26%	0.262	69%	0.687	S	S	.	*			trans	-32.1	163.4	147.6	164.4	53.7	0	0	0	115.4	D512 R898	D512-D896 PolarHBondContact O-N 2.74Å; D896-R898 PolarHBondContact OD1-N 2.91Å
897	V	31	Very low	29	Very low	113 Å²	113	122.5 Å²	122.5	69%	0.685	68%	0.682	S	S	*	*				179.6	97.4	125.5	154.9	0	0	0	0	113.7
898	R	29	Very low	28.9	Very low	212 Å²	212	123.2 Å²	123.2	80%	0.8	69%	0.688	S	S	*	*				54.2	141.7	129.7	-53.9	175.7	-174.8	-159.7	-3.4	125	D896	D896-R898 PolarHBondContact OD1-N 2.91Å
899	G	30.1	Very low	28.7	Very low	65 Å²	65	121.3 Å²	121.3	67%	0.67	69%	0.688	S	S	*	*				165.2	140.4	125.8	0	0	0	0	0	113.6
900	Q	32.3	Very low	29.1	Very low	181 Å²	181	115.4 Å²	115.4	85%	0.846	68%	0.68	S	S	*	*			cis	-153.3	140.2	-5.1	-58.3	-177.1	-19	0	0	108.2
901	S	31.3	Very low	28.9	Very low	91 Å²	91	111 Å²	111	64%	0.636	68%	0.681	S	S	*	*				59.7	136.7	108.9	94.8	0	0	0	0	117
902	N	29.4	Very low	28.8	Very low	133 Å²	133	112 Å²	112	71%	0.711	68%	0.681	S	S	*	*			cis	-152.7	-179.8	7	-73	-59	0	0	0	107.8
903	L	28.6	Very low	28.8	Very low	98 Å²	98	110.7 Å²	110.7	51%	0.513	67%	0.672	S	S	.	*			cis	-144.8	137.5	21.4	-78.2	164.7	0	0	0	113.2	D504	D504-L903 WeakPolarHBondContact OD2-CD1 3.46Å
904	N	27.7	Very low	29.2	Very low	132 Å²	132	114.6 Å²	114.6	71%	0.706	67%	0.673	S	S	*	*				19.9	156	122	-82.5	-8.9	0	0	0	122.4
905	P	41.5	Very low	29.6	Very low	98 Å²	98	118.7 Å²	118.7	64%	0.636	68%	0.684	S	S	*	*			cis	-145.4	174.2	-2.7	39.7	-18.9	0	0	0	118.7
906	L	27.9	Very low	29.6	Very low	147 Å²	147	121.6 Å²	121.6	77%	0.77	70%	0.696	S	S	*	*			trans	48.4	107.7	136.8	-67.5	166.6	0	0	0	123.1
907	T	25.8	Very low	29.6	Very low	124 Å²	124	123.7 Å²	123.7	76%	0.761	71%	0.713	S	S	*	*				37.6	133.7	116.6	63.6	0	0	0	0	122.5
908	A	25.6	Very low	29.4	Very low	101 Å²	101	123.4 Å²	123.4	84%	0.835	72%	0.716	S	S	*	*			trans	-141.5	134.8	138.8	0	0	0	0	0	111.7
909	S	25	Very low	29.3	Very low	111 Å²	111	118.5 Å²	118.5	78%	0.776	71%	0.714	S	S	*	*			trans	-98.6	-161.8	164.3	-29.8	0	0	0	0	108.4
910	P	39.1	Very low	29.1	Very low	108 Å²	108	123.8 Å²	123.8	70%	0.701	73%	0.726	S	S	*	*			cis	-130.4	166.4	-37.7	36.5	-21.9	0	0	0	113.1
911	G	25.3	Very low	28.8	Very low	80 Å²	80	118.5 Å²	118.5	83%	0.825	72%	0.72	S	S	*	*			trans	60.7	-157.2	164.4	0	0	0	0	0	114.8
912	L	29.2	Very low	28.6	Very low	134 Å²	134	121.6 Å²	121.6	70%	0.702	73%	0.725	S	S	*	*			cis	-122.2	153.1	-10.8	-111.9	89.9	0	0	0	108.2
913	M	26.7	Very low	28.5	Very low	134 Å²	134	122.7 Å²	122.7	66%	0.66	72%	0.723	S	S	*	*				46.8	149.5	109.8	-54	-159.9	-145.5	0	0	117	K915	M913-K915 HydrophobicContact SD-CD 4.46Å
914	E	33.1	Very low	28.3	Very low	145 Å²	145	123.2 Å²	123.2	68%	0.678	74%	0.735	S	S	*	*			cis	-149.4	138.5	22.1	-144.1	146.6	-161.2	0	0	109.3
915	K	32.5	Very low	28.1	Very low	137 Å²	137	123.1 Å²	123.1	60%	0.596	74%	0.739	S	S	*	*			cis	72.2	101.8	43.6	158.1	-110.1	-166.2	175.7	0	114.8	M913	M913-K915 HydrophobicContact SD-CD 4.46Å
916	L	26.3	Very low	27.3	Very low	161 Å²	161	122.5 Å²	122.5	84%	0.843	74%	0.742	S	S	*	*			trans	-135.6	113.4	143.8	-78.2	179.9	0	0	0	106.2
917	C	24.5	Very low	27.4	Very low	92 Å²	92	124 Å²	124	62%	0.622	75%	0.745	S	S	*	*				69.4	109.6	91	-68.4	0	0	0	0	111.7
918	S	27.8	Very low	27.4	Very low	107 Å²	107	123.2 Å²	123.2	75%	0.748	75%	0.745	S	S	*	*				79.8	158.7	52.4	-57.8	0	0	0	0	113.6
919	S	27	Very low	27.5	Very low	110 Å²	110	125.3 Å²	125.3	77%	0.769	74%	0.74	S	S	*	*			trans	76.5	154	-175.3	90.6	0	0	0	0	114
920	L	24.7	Very low	27.7	Very low	175 Å²	175	123.7 Å²	123.7	92%	0.916	73%	0.729	S	S	*	*			cis	-177.6	172.2	-30.5	-112.5	157.6	0	0	0	107.1
921	G	25.3	Very low	27.4	Very low	70 Å²	70	125.7 Å²	125.7	72%	0.722	73%	0.729	S	S	*	*			trans	105.6	154.6	157.7	0	0	0	0	0	116.3
922	E	27.1	Very low	27.7	Very low	156 Å²	156	129 Å²	129	73%	0.729	73%	0.726	S	S	*	*			trans	-125.2	165.1	-169	-55.7	-170.6	91.2	0	0	113.8
923	K	27.8	Very low	27.6	Very low	156 Å²	156	127.9 Å²	127.9	68%	0.678	73%	0.729	S	S	*	*			trans	63.9	96	143.7	-73.5	154.8	-174.2	155.2	0	120
924	S	24.5	Very low	27.6	Very low	109 Å²	109	124.1 Å²	124.1	76%	0.762	73%	0.725	S	S	*	*				81.5	166.7	112.9	75.2	0	0	0	0	122.1
925	V	23.7	Very low	27.3	Very low	131 Å²	131	123.6 Å²	123.6	79%	0.794	73%	0.731	S	S	*	*			trans	86.9	88.6	167.8	-171.1	0	0	0	0	118.8
926	A	25.3	Very low	26.9	Very low	84 Å²	84	122.9 Å²	122.9	69%	0.694	74%	0.744	S	S	*	*				75.6	161.7	123.7	0	0	0	0	0	123.7
927	Q	29.1	Very low	27	Very low	178 Å²	178	119.6 Å²	119.6	83%	0.832	74%	0.74	S	S	*	*			trans	70.5	114.5	165.9	-69.2	174.4	10.3	0	0	116.1
928	S	25.6	Very low	27.4	Very low	108 Å²	108	121.7 Å²	121.7	76%	0.755	75%	0.75	S	S	*	*				73.5	132.1	78.8	-62.2	0	0	0	0	111.5
929	I	28.9	Very low	28.1	Very low	146 Å²	146	121.8 Å²	121.8	75%	0.749	75%	0.747	S	S	*	*			cis	-152.9	137.8	35	-129.8	145.3	0	0	0	111.7
930	S	28.9	Very low	28.9	Very low	76 Å²	76	122.1 Å²	122.1	53%	0.531	75%	0.747	S	S	.	*			trans	20.7	152.5	140.8	55.4	0	0	0	0	122.2
931	H	32.4	Very low	29.3	Very low	150 Å²	150	118.7 Å²	118.7	69%	0.694	74%	0.738	S	S	*	*				-161.8	144.8	54.2	-92.9	-78.5	0	0	0	116.9
932	L	31.1	Very low	30.2	Very low	149 Å²	149	124.5 Å²	124.5	78%	0.78	75%	0.746	S	S	*	*			trans	64.6	145.8	142.6	-61	166.2	0	0	0	118.2
933	C	27.6	Very low	31.1	Very low	111 Å²	111	122.1 Å²	122.1	75%	0.75	74%	0.744	S	S	*	*			cis	-155	156	-8.1	-139.7	0	0	0	0	108.2
934	G	25.9	Very low	31.3	Very low	56 Å²	56	123.3 Å²	123.3	58%	0.577	75%	0.752	S	S	*	*			cis	-175.8	160.7	-4.5	0	0	0	0	0	113
935	T	26.6	Very low	32.3	Very low	133 Å²	133	124 Å²	124	82%	0.816	75%	0.754	S	S	*	*			trans	48.5	117.6	135.4	57.8	0	0	0	0	120.1
936	S	24	Very low	32.7	Very low	123 Å²	123	123.1 Å²	123.1	86%	0.86	75%	0.753	S	S	*	*			cis	90.3	159.1	40.6	-167	0	0	0	0	114.7
937	A	29.2	Very low	32.8	Very low	92 Å²	92	127.5 Å²	127.5	76%	0.76	76%	0.764	S	S	*	*			trans	78.4	148.5	-174.6	0	0	0	0	0	116.4
938	V	33.5	Very low	32.5	Very low	136 Å²	136	121.5 Å²	121.5	82%	0.824	75%	0.75	S	S	*	*			cis	-168.7	153.7	-33.4	115.6	0	0	0	0	106.9
939	P	42.7	Very low	32.6	Very low	108 Å²	108	125.4 Å²	125.4	70%	0.701	75%	0.754	S	S	*	*			trans	-91.2	165	-163	40.2	-40.2	0	0	0	114
940	P	42	Very low	32.5	Very low	117 Å²	117	124.1 Å²	124.1	76%	0.76	75%	0.753	S	S	*	*				-147	-178.5	82	40.8	-23.1	0	0	0	116.8
941	S	33.8	Very low	32.5	Very low	103 Å²	103	126.7 Å²	126.7	72%	0.72	76%	0.761	S	S	*	*			trans	70.9	111	159.5	60.8	0	0	0	0	121.3
942	Q	45.1	Very low	32.4	Very low	192 Å²	192	125.4 Å²	125.4	90%	0.897	76%	0.764	S	S	*	*			trans	56.4	-179.6	171.2	-59.4	-174.8	-13.4	0	0	114.5
943	P	44.9	Very low	32.2	Very low	106 Å²	106	122 Å²	122	69%	0.688	77%	0.765	S	S	*	*			cis	-94.2	-175.7	-48.4	39	-31.1	0	0	0	112.2
944	H	33	Very low	32.3	Very low	181 Å²	181	125.4 Å²	125.4	84%	0.838	77%	0.77	S	S	*	*			trans	60.9	177.8	176	-66.9	-70.9	0	0	0	114.9
945	P	44.9	Very low	32.5	Very low	125 Å²	125	131.6 Å²	131.6	81%	0.812	78%	0.783	S	S	*	*			cis	-122.4	-165.4	-9.7	29.6	-7.1	0	0	0	114.1
946	S	32.2	Very low	32.6	Very low	111 Å²	111	128.7 Å²	128.7	78%	0.776	78%	0.78	S	S	*	*			trans	-80.8	156.7	-176.6	53.5	0	0	0	0	117
947	L	26.5	Very low	33.1	Very low	176 Å²	176	129 Å²	129	92%	0.921	78%	0.779	S	S	*	*			trans	-166.3	152.5	140.6	-98.8	167.1	0	0	0	107
948	G	24.5	Very low	33.3	Very low	53 Å²	53	130.1 Å²	130.1	55%	0.546	78%	0.781	S	S	.	*			cis	177.6	-155.9	0	0	0	0	0	0	109.8
949	F	26.1	Very low	33.3	Very low	190 Å²	190	130 Å²	130	83%	0.833	78%	0.781	S	S	*	*			trans	74.1	109	169.7	-69.5	-84.9	0	0	0	116.8
950	T	28.2	Very low	33.1	Very low	118 Å²	118	129 Å²	129	72%	0.724	78%	0.781	S	S	*	*				72	148.9	97.3	62	0	0	0	0	114.1
951	D	28.3	Very low	33.1	Very low	131 Å²	131	128.8 Å²	128.8	70%	0.701	78%	0.78	S	S	*	*			cis	-153.6	-173.4	26.5	-162.5	34.6	0	0	0	115
952	T	29.5	Very low	33.2	Very low	123 Å²	123	129 Å²	129	76%	0.755	77%	0.773	S	S	*	*			trans	-22.4	154.3	168	56.7	0	0	0	0	121
953	G	28.1	Very low	33.2	Very low	78 Å²	78	126.3 Å²	126.3	80%	0.804	76%	0.764	S	S	*	*			trans	170.2	137.3	162.7	0	0	0	0	0	114.6
954	Q	30.2	Very low	33	Very low	181 Å²	181	128 Å²	128	85%	0.846	76%	0.762	S	S	*	*			trans	-100.6	159.1	-179.8	-70.7	-179.8	-13.7	0	0	113.7
955	Q	29	Very low	33.3	Very low	186 Å²	186	122.9 Å²	122.9	87%	0.869	74%	0.743	S	S	*	*			trans	8.2	138.4	146.6	-51	173.5	10.4	0	0	117.9
956	G	28	Very low	33.1	Very low	72 Å²	72	120.5 Å²	120.5	74%	0.742	73%	0.727	S	S	*	*			cis	176.8	-152.5	8.8	0	0	0	0	0	107.7
957	P	36.1	Very low	33.6	Very low	130 Å²	130	119.4 Å²	119.4	84%	0.844	72%	0.715	S	S	*	*			cis	-117.3	-163.3	-6.9	43.3	-29.9	0	0	0	112.6
958	S	32.1	Very low	34.1	Very low	115 Å²	115	116 Å²	116	80%	0.804	70%	0.698	S	S	*	*			trans	-66.5	138.8	-176.3	-173.4	0	0	0	0	115.2
959	V	34	Very low	34.5	Very low	135 Å²	135	120.2 Å²	120.2	82%	0.818	70%	0.703	S	S	*	*			trans	-122.8	130.7	159.2	177	0	0	0	0	107.6
960	A	38.9	Very low	34.9	Very low	86 Å²	86	117.9 Å²	117.9	71%	0.711	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-70.6	137.2	-175.3	0	0	0	0	0	112.2
961	P	41.1	Very low	35.1	Very low	112 Å²	112	116.3 Å²	116.3	73%	0.727	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-76.6	150.1	179.3	31.1	-34.9	0	0	0	112.9
962	D	37.1	Very low	35.3	Very low	107 Å²	107	118.3 Å²	118.3	57%	0.572	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-65.8	133.8	-174.2	-173.1	-11.3	0	0	0	113.3	H964 T965	D962-H964 PolarHBondContact O-N 2.89Å; D962-H964 VanDerWaalsContact O-N 3.13Å; D962-H964 PolarHBondContact OD1-N 3.33Å; D962-T965 VanDerWaalsContact O-CB 3.28Å; D962-T965 WeakPolarHBondContact O-CB 3.35Å; D962-T965 PolarHBondContact O-N 2.8Å; D962-T965 PolarHBondContact O-OG1 3.42Å; D962-T965 VanDerWaalsContact O-OG1 3.07Å
963	I	45.3	Very low	35.3	Very low	137 Å²	137	117 Å²	117	70%	0.703	69%	0.691	S	S	*	*	H	α-helix	trans	-51.9	-32.8	177.3	-63.9	173.2	0	0	0	112	T965 V966 T967	I963-T965 PolarHBondContact O-N 3.34Å; I963-V966 PolarHBondContact O-N 3.28Å; I963-T967 PolarHBondContact O-N 3.37Å; I963-T967 PolarHBondContact O-OG1 2.85Å; I963-T967 VanDerWaalsContact O-OG1 3.08Å
964	H	39.8	Very low	35.4	Very low	142 Å²	142	121.7 Å²	121.7	66%	0.657	69%	0.692	S	S	*	*	H	α-helix	trans	-62.2	-25.5	177.5	-118.4	-75.9	0	0	0	113.3	D962 L968	D962-H964 PolarHBondContact O-N 2.89Å; D962-H964 VanDerWaalsContact O-N 3.13Å; D962-H964 PolarHBondContact OD1-N 3.33Å; H964-L968 PolarHBondContact O-N 3.47Å
965	T	39.2	Very low	35.4	Very low	72 Å²	72	118.6 Å²	118.6	44%	0.442	69%	0.685	S	S	.	*	H	α-helix	trans	-74.8	-44.4	179.1	-42.4	0	0	0	0	111.7	D962 I963 T967 L968 Q969	D962-T965 VanDerWaalsContact O-CB 3.28Å; D962-T965 WeakPolarHBondContact O-CB 3.35Å; D962-T965 PolarHBondContact O-N 2.8Å; D962-T965 PolarHBondContact O-OG1 3.42Å; D962-T965 VanDerWaalsContact O-OG1 3.07Å; I963-T965 PolarHBondContact O-N 3.34Å; T965-T967 VanDerWaalsContact C-N 3.32Å; T965-T967 PolarHBondContact O-N 3.03Å; T965-L968 PolarHBondContact O-N 3.39Å; T965-L968 VanDerWaalsContact O-N 3.14Å; T965-Q969 PolarHBondContact O-N 2.78Å
966	V	42.1	Very low	35.4	Very low	76 Å²	76	118 Å²	118	46%	0.461	68%	0.682	S	S	.	*	H	α-helix	trans	-63.3	-41.5	-179.9	-177.5	0	0	0	0	110.6	I963 L968 Q969 L970	I963-V966 PolarHBondContact O-N 3.28Å; V966-L968 VanDerWaalsContact C-N 3.26Å; V966-L968 PolarHBondContact O-N 2.97Å; V966-Q969 PolarHBondContact O-N 3.22Å; V966-L970 HydrophobicContact CG1-CD1 4.24Å; V966-L970 PolarHBondContact O-N 2.92Å; V966-L970 VanDerWaalsContact O-N 3.09Å
967	T	41.6	Very low	35.4	Very low	87 Å²	87	120.7 Å²	120.7	53%	0.534	68%	0.679	S	S	.	*	H	α-helix	trans	-60.9	-35.5	176.1	-50	0	0	0	0	112	I963 T965 S971	I963-T967 PolarHBondContact O-N 3.37Å; I963-T967 PolarHBondContact O-OG1 2.85Å; I963-T967 VanDerWaalsContact O-OG1 3.08Å; T965-T967 VanDerWaalsContact C-N 3.32Å; T965-T967 PolarHBondContact O-N 3.03Å; T967-S971 PolarHBondContact O-N 2.83Å
968	L	36.2	Very low	35.1	Very low	106 Å²	106	120.2 Å²	120.2	56%	0.555	68%	0.676	S	S	*	*	H	α-helix	trans	-79.1	-31.9	178.3	-130.4	77.6	0	0	0	113.6	H964 T965 V966 S971	H964-L968 PolarHBondContact O-N 3.47Å; T965-L968 PolarHBondContact O-N 3.39Å; T965-L968 VanDerWaalsContact O-N 3.14Å; V966-L968 VanDerWaalsContact C-N 3.26Å; V966-L968 PolarHBondContact O-N 2.97Å; L968-S971 PolarHBondContact O-N 3.23Å; L968-S971 PolarHBondContact O-OG 3Å
969	Q	34.2	Very low	34.8	Very low	140 Å²	140	121.4 Å²	121.4	65%	0.654	67%	0.673	S	S	*	*	H	α-helix	trans	-70.8	-41	176.5	-76	-178	-40.3	0	0	111.5	T965 V966 S971 K972	T965-Q969 PolarHBondContact O-N 2.78Å; V966-Q969 PolarHBondContact O-N 3.22Å; Q969-S971 PolarHBondContact O-N 3.37Å; Q969-K972 PolarHBondContact O-N 3.18Å
970	L	35	Very low	34.4	Very low	141 Å²	141	120.1 Å²	120.1	74%	0.738	67%	0.667	S	S	*	*	H	α-helix	trans	-65.7	-21.8	173.8	-68.6	172.9	0	0	0	113	V966 K972	V966-L970 HydrophobicContact CG1-CD1 4.24Å; V966-L970 PolarHBondContact O-N 2.92Å; V966-L970 VanDerWaalsContact O-N 3.09Å; L970-K972 VanDerWaalsContact C-N 3.32Å; L970-K972 PolarHBondContact O-N 2.91Å
971	S	31.8	Very low	33.8	Very low	86 Å²	86	121.3 Å²	121.3	60%	0.601	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	0.7	176.7	77.1	0	0	0	0	114.8	T967 L968 Q969	T967-S971 PolarHBondContact O-N 2.83Å; L968-S971 PolarHBondContact O-N 3.23Å; L968-S971 PolarHBondContact O-OG 3Å; Q969-S971 PolarHBondContact O-N 3.37Å
972	K	31.3	Very low	33	Very low	172 Å²	172	124.6 Å²	124.6	75%	0.748	68%	0.675	S	S	*	*	S	Bend	trans	-122.2	0.8	-175.5	-81	-169.1	173.3	-175.1	0	115.8	Q969 L970 Q974	Q969-K972 PolarHBondContact O-N 3.18Å; L970-K972 VanDerWaalsContact C-N 3.32Å; L970-K972 PolarHBondContact O-N 2.91Å; K972-Q974 VanDerWaalsContact C-N 3.34Å; K972-Q974 PolarHBondContact O-N 3.48Å
973	S	30.3	Very low	32.3	Very low	96 Å²	96	127.3 Å²	127.3	67%	0.671	68%	0.682	S	S	*	*			trans	-78.6	85.6	169.1	-167.1	0	0	0	0	109.9	V975	S973-V975 PolarHBondContact O-N 2.94Å
974	Q	30.4	Very low	31.4	Very low	177 Å²	177	126.6 Å²	126.6	83%	0.827	69%	0.69	S	S	*	*			trans	-79	101.3	161.2	-73.2	-176.1	-2.5	0	0	108.1	K972	K972-Q974 VanDerWaalsContact C-N 3.34Å; K972-Q974 PolarHBondContact O-N 3.48Å
975	V	30.3	Very low	30.5	Very low	115 Å²	115	124.9 Å²	124.9	70%	0.697	69%	0.689	S	S	*	*			trans	-90.4	109.9	155.6	178.3	0	0	0	0	105.9	S973 D977	S973-V975 PolarHBondContact O-N 2.94Å; V975-D977 PolarHBondContact O-N 3.38Å
976	E	29.6	Very low	30	Very low	174 Å²	174	126.4 Å²	126.4	81%	0.813	70%	0.699	S	S	*	*			trans	-75.3	101.3	166.8	-70.5	-166.5	127	0	0	108.3	P978	E976-P978 WeakPolarHBondContact O-CD 3.18Å
977	D	27.5	Very low	29.2	Very low	128 Å²	128	127.9 Å²	127.9	68%	0.684	71%	0.709	S	S	*	*			trans	-72.5	119.6	175	-133.6	-19.7	0	0	0	108.8	V975 L979	V975-D977 PolarHBondContact O-N 3.38Å; D977-L979 PolarHBondContact O-N 3.13Å
978	P	29.3	Very low	28.7	Very low	120 Å²	120	132.3 Å²	132.3	78%	0.779	72%	0.722	S	S	*	*			trans	-81.4	55.4	-168.9	33.7	-37.1	0	0	0	112.8	E976	E976-P978 WeakPolarHBondContact O-CD 3.18Å
979	L	25.2	Very low	28.7	Very low	140 Å²	140	129.6 Å²	129.6	73%	0.733	72%	0.719	S	S	*	*			trans	-123.7	126.6	177.1	-68.3	175.4	0	0	0	111.2	D977	D977-L979 PolarHBondContact O-N 3.13Å
980	P	26.7	Very low	28.9	Very low	108 Å²	108	126 Å²	126	70%	0.701	71%	0.709	S	S	*	*			trans	-66.3	153.1	-177.9	28	-34.9	0	0	0	111.6	M982	P980-M982 PolarHBondContact O-N 3.15Å
981	P	25.4	Very low	29.3	Very low	112 Å²	112	119.9 Å²	119.9	73%	0.727	68%	0.68	S	S	*	*			trans	-64.8	102.2	-172.8	25.7	-34.9	0	0	0	111.8	F983	P981-F983 WeakPolarHBondContact O-CD2 3.33Å; P981-F983 PolarHBondContact O-N 2.73Å
982	M	25.2	Very low	30.3	Very low	180 Å²	180	116.2 Å²	116.2	89%	0.887	66%	0.655	S	S	*	*			trans	-58.4	97.5	169.6	-89.6	-75.8	-78.2	0	0	110.1	P980 S984	P980-M982 PolarHBondContact O-N 3.15Å; M982-S984 PolarHBondContact O-N 3.47Å
983	F	22.1	Very low	31.5	Very low	164 Å²	164	108 Å²	108	72%	0.719	62%	0.62	S	S	*	*			trans	-54.4	125.8	173	-77.9	-93.2	0	0	0	109.5	P981 V985	P981-F983 WeakPolarHBondContact O-CD2 3.33Å; P981-F983 PolarHBondContact O-N 2.73Å; F983-V985 HydrophobicContact CB-CG2 4.15Å; F983-V985 PolarHBondContact O-N 3.15Å
984	S	25.5	Very low	33.4	Very low	123 Å²	123	103.7 Å²	103.7	86%	0.86	59%	0.589	S	S	*	*			trans	-76	55	176.4	47.3	0	0	0	0	112	M982 T986	M982-S984 PolarHBondContact O-N 3.47Å; S984-T986 PolarHBondContact O-N 3.31Å; S984-T986 VanDerWaalsContact O-N 3.15Å
985	V	22.2	Very low	34.7	Very low	105 Å²	105	95.3 Å²	95.3	64%	0.636	55%	0.55	S	S	*	*			trans	-70.2	103	163.9	-178.6	0	0	0	0	106.7	F983 P987	F983-V985 HydrophobicContact CB-CG2 4.15Å; F983-V985 PolarHBondContact O-N 3.15Å; V985-P987 WeakPolarHBondContact O-CD 3.49Å; V985-P987 VanDerWaalsContact O-N 3.15Å
986	T	28.7	Very low	35.9	Very low	105 Å²	105	89.9 Å²	89.9	64%	0.644	52%	0.517	S	S	*	.			trans	-56.1	117.6	165.1	31.3	0	0	0	0	108.6	S984 K988	S984-T986 PolarHBondContact O-N 3.31Å; S984-T986 VanDerWaalsContact O-N 3.15Å; T986-K988 PolarHBondContact O-N 3.45Å; T986-K988 VanDerWaalsContact O-N 3.17Å
987	P	24.8	Very low	36.8	Very low	106 Å²	106	83.1 Å²	83.1	69%	0.688	49%	0.494	S	S	*	.			trans	-61.2	124.5	174.8	-20.4	33.1	0	0	0	107.9	V985 G989	V985-P987 WeakPolarHBondContact O-CD 3.49Å; V985-P987 VanDerWaalsContact O-N 3.15Å; P987-G989 PolarHBondContact O-N 3.32Å
988	K	32.1	Very low	37.5	Very low	181 Å²	181	83.1 Å²	83.1	79%	0.787	49%	0.488	S	S	*	.			trans	-75.4	50.6	174	-68.2	-170.4	176.5	-174.6	0	111.4	T986 S990	T986-K988 PolarHBondContact O-N 3.45Å; T986-K988 VanDerWaalsContact O-N 3.17Å; K988-S990 VanDerWaalsContact C-N 3.27Å; K988-S990 PolarHBondContact O-N 2.9Å; K988-S990 VanDerWaalsContact O-N 3.09Å
989	G	34.8	Very low	38.3	Very low	49 Å²	49	78.9 Å²	78.9	51%	0.505	46%	0.459	S	S	.	.			trans	-75.1	84.2	164	0	0	0	0	0	108.2	P987 G991	P987-G989 PolarHBondContact O-N 3.32Å; G989-G991 PolarHBondContact O-N 3.5Å
990	S	39	Very low	38.8	Very low	64 Å²	64	76.8 Å²	76.8	45%	0.448	45%	0.448	S	S	.	.			trans	-67.5	76.7	170.2	-66.2	0	0	0	0	109.5	G73 T74 K988 A992	G73-S990 WeakPolarHBondContact CA-O 3.44Å; T74-S990 PolarHBondContact N-O 3.34Å; K988-S990 VanDerWaalsContact C-N 3.27Å; K988-S990 PolarHBondContact O-N 2.9Å; K988-S990 VanDerWaalsContact O-N 3.09Å; S990-A992 VanDerWaalsContact C-N 3.27Å; S990-A992 PolarHBondContact O-N 3.01Å
991	G	44	Very low	39.5	Very low	12 Å²	12	73.6 Å²	73.6	12%	0.124	43%	0.425	C	S	.	.			trans	-70.1	92	157.1	0	0	0	0	0	107.2	T74 G989 G993	T74-G991 PolarHBondContact O-N 2.94Å; G989-G991 PolarHBondContact O-N 3.5Å; G991-G993 PolarHBondContact O-N 3.3Å
992	A	51.4	Low	40.2	Very low	9 Å²	9	70 Å²	70	7%	0.074	40%	0.4	C	S	.	.			trans	-67.9	67.1	-175	0	0	0	0	0	112.1	I72 L200 S990 Y994	I72-A992 WeakPolarHBondContact O-CB 3.48Å; L200-A992 WeakPolarHBondContact CD2-O 3.49Å; S990-A992 VanDerWaalsContact C-N 3.27Å; S990-A992 PolarHBondContact O-N 3.01Å; A992-Y994 WeakPolarHBondContact O-CD2 3.32Å; A992-Y994 PolarHBondContact O-N 2.85Å
993	G	56.4	Low	40.7	Very low	1 Å²	1	66.3 Å²	66.3	1%	0.01	38%	0.383	C	S	.	.	S	Bend	trans	60.7	-14.2	177.3	0	0	0	0	0	119.7	S197 G991 G995	S197-G993 WeakPolarHBondContact O-CA 3.25Å; S197-G993 PolarHBondContact O-N 3.32Å; G991-G993 PolarHBondContact O-N 3.3Å; G993-G995 PolarHBondContact O-N 3.35Å
994	Y	71.1	Confident	41.3	Very low	4 Å²	4	65.2 Å²	65.2	2%	0.016	38%	0.378	C	S	.	.	S	Bend	trans	-71.5	20.9	-179.7	-69	-71.5	0	0	0	115.3	I72 V80 A93 K95 I126 L148 D149 L150 M151 L200 A992	I72-Y994 HydrophobicContact CD1-CD2 4.32Å; I72-Y994 HydrophobicContact CD1-CE2 3.71Å; V80-Y994 HydrophobicContact CB-CD2 4.34Å; V80-Y994 HydrophobicContact CG1-CD2 3.75Å; V80-Y994 HydrophobicContact CG1-CE2 4.27Å; V80-Y994 HydrophobicContact CG1-CG 3.96Å; V80-Y994 HydrophobicContact CG2-CG 4.35Å; A93-Y994 HydrophobicContact CB-CE1 3.77Å; A93-Y994 HydrophobicContact CB-CE2 3.96Å; A93-Y994 VanDerWaalsContact CB-CZ 3.44Å; A93-Y994 WeakPolarHBondContact CB-OH 3.22Å; K95-Y994 WeakPolarHBondContact CD-O 3.46Å; K95-Y994 VanDerWaalsContact CE-O 3.25Å; K95-Y994 WeakPolarHBondContact CE-O 3.45Å; K95-Y994 PolarHBondContact NZ-O 3.31Å; I126-Y994 HydrophobicContact CD1-CE1 4.11Å; I126-Y994 HydrophobicContact CG1-CE1 4.35Å; L148-Y994 HydrophobicContact CB-CD1 4.5Å; L148-Y994 HydrophobicContact CB-CE1 4.07Å; L148-Y994 HydrophobicContact CD1-CD1 3.52Å; L148-Y994 HydrophobicContact CD1-CE1 3.96Å; D149-Y994 WeakPolarHBondContact O-CE1 3.49Å; D149-Y994 PolarHBondContact O-OH 3.37Å; L150-Y994 WeakPolarHBondContact CA-OH 3.29Å; M151-Y994 PolarHBondContact N-OH 3.27Å; L200-Y994 HydrophobicContact CD1-CD1 3.92Å; L200-Y994 HydrophobicContact CD1-CE1 3.73Å; L200-Y994 HydrophobicContact CD2-CD2 4.19Å; L200-Y994 HydrophobicContact CD2-CE1 4.49Å; L200-Y994 HydrophobicContact CD2-CE2 4.07Å; L200-Y994 HydrophobicContact CD2-CG 4.42Å; A992-Y994 WeakPolarHBondContact O-CD2 3.32Å; A992-Y994 PolarHBondContact O-N 2.85Å
995	G	58.1	Low	42	Very low	2 Å²	2	61 Å²	61	2%	0.021	35%	0.349	C	S	.	.	S	Bend	trans	61.8	46.6	175.7	0	0	0	0	0	114.5	K95 D211 G993	K95-G995 PolarHBondContact NZ-O 3.38Å; D211-G995 VanDerWaalsContact CB-CA 3.5Å; D211-G995 WeakPolarHBondContact OD2-CA 3.46Å; G993-G995 PolarHBondContact O-N 3.35Å
996	V	54.5	Low	42.8	Very low	1 Å²	1	59.6 Å²	59.6	1%	0.006	34%	0.335	C	S	.	.			trans	-112.7	-11.1	171.6	-65.3	0	0	0	0	113.6	G75 A76 Y77 V80 K95	G75-V996 CarbonylContact C-O 3.59Å; G75-V996 WeakPolarHBondContact CA-O 3.29Å; A76-V996 PolarHBondContact N-O 3.18Å; Y77-V996 PolarHBondContact N-O 3.4Å; V80-V996 HydrophobicContact CG2-CG1 3.63Å; V80-V996 HydrophobicContact CG2-CG2 4.26Å; K95-V996 HydrophobicContact CG-CG1 4.32Å
997	G	49.2	Very low	43	Very low	32 Å²	32	58.7 Å²	58.7	33%	0.33	33%	0.333	S	S	.	.			trans	-55.5	149.3	-169.8	0	0	0	0	0	115	Y77	Y77-G997 WeakPolarHBondContact CD2-O 3.22Å; Y77-G997 WeakPolarHBondContact CE2-O 3.22Å
998	F	42.3	Very low	43.2	Very low	128 Å²	128	59.7 Å²	59.7	56%	0.561	33%	0.331	S	S	*	.			trans	-79.3	131.7	-179.5	-161.7	-77.3	0	0	0	110.8	A76 L1000	A76-F998 HydrophobicContact CB-CB 4.42Å; A76-F998 HydrophobicContact CB-CD2 3.8Å; A76-F998 HydrophobicContact CB-CE2 4.38Å; A76-F998 HydrophobicContact CB-CG 4.25Å; F998-L1000 HydrophobicContact CD1-CD2 4.37Å; F998-L1000 HydrophobicContact CD1-CG 4.11Å; F998-L1000 HydrophobicContact CE1-CD2 3.77Å; F998-L1000 HydrophobicContact CE1-CG 3.97Å
999	D	45.2	Very low	43.3	Very low	30 Å²	30	55.3 Å²	55.3	16%	0.16	32%	0.319	C	S	.	.			trans	-114	117.6	170	-161.8	-11.5	0	0	0	108.5	A234 D1001 D1002	A234-D999 WeakPolarHBondContact CA-OD2 3.33Å; A234-D999 PolarHBondContact N-OD2 3.05Å; D999-D1001 VanDerWaalsContact C-N 3.33Å; D999-D1001 PolarHBondContact OD1-N 2.88Å; D999-D1002 HydrophobicContact CB-CB 4.33Å
1000	L	36.9	Very low	43.1	Very low	97 Å²	97	61.1 Å²	61.1	51%	0.508	33%	0.333	S	S	.	.	H	α-helix	trans	-69.3	-34	-176.3	-81.6	156.6	0	0	0	111.6	F998 D1002 L1003 F1004	F998-L1000 HydrophobicContact CD1-CD2 4.37Å; F998-L1000 HydrophobicContact CD1-CG 4.11Å; F998-L1000 HydrophobicContact CE1-CD2 3.77Å; F998-L1000 HydrophobicContact CE1-CG 3.97Å; L1000-D1002 PolarHBondContact O-N 3.32Å; L1000-L1003 PolarHBondContact O-N 3.4Å; L1000-F1004 VanDerWaalsContact O-CD2 3.27Å; L1000-F1004 WeakPolarHBondContact O-CD2 3.07Å
1001	D	40.3	Very low	42.8	Very low	41 Å²	41	65 Å²	65	22%	0.219	35%	0.348	C	S	.	.	H	α-helix	trans	-67.7	-26.5	-176.4	-66.3	0.2	0	0	0	111.7	R236 R239 D999 S1005	R236-D1001 IonicContact CZ-OD2 2.66Å; R236-D1001 IonicContact NH1-OD1 2.76Å; R236-D1001 IonicContact NH1-OD2 2.8Å; R236-D1001 PolarHBondContact NH1-OD2 3.49Å; R236-D1001 IonicContact NH2-OD2 3.44Å; R236-D1001 PolarHBondContact NH2-OD2 3.17Å; R239-D1001 IonicContact NH2-OD2 2.71Å; D999-D1001 VanDerWaalsContact C-N 3.33Å; D999-D1001 PolarHBondContact OD1-N 2.88Å; D1001-S1005 WeakPolarHBondContact O-CB 3.21Å; D1001-S1005 PolarHBondContact O-N 3.05Å; D1001-S1005 VanDerWaalsContact O-N 3.1Å; D1001-S1005 PolarHBondContact O-OG 2.75Å
1002	D	40.5	Very low	42.3	Very low	35 Å²	35	71.8 Å²	71.8	19%	0.187	38%	0.376	C	S	.	.	H	α-helix	trans	-74.3	-29.4	179.5	-164	51.4	0	0	0	112.6	Y77 D999 L1000 Q1006	Y77-D1002 PolarHBondContact OH-OD2 2.78Å; D999-D1002 HydrophobicContact CB-CB 4.33Å; L1000-D1002 PolarHBondContact O-N 3.32Å; D1002-Q1006 WeakPolarHBondContact O-CG 3.36Å; D1002-Q1006 PolarHBondContact O-N 3.32Å; D1002-Q1006 PolarHBondContact O-NE2 3.4Å
1003	L	35	Very low	41.3	Very low	103 Å²	103	79.2 Å²	79.2	54%	0.539	41%	0.409	S	S	.	.	H	α-helix	trans	-72	-44.9	175.6	-167.1	77.9	0	0	0	111.3	L1000 S1005	L1000-L1003 PolarHBondContact O-N 3.4Å; L1003-S1005 VanDerWaalsContact C-N 3.3Å; L1003-S1005 PolarHBondContact O-N 3.18Å
1004	F	34.9	Very low	39.9	Very low	142 Å²	142	82.6 Å²	82.6	62%	0.623	44%	0.443	S	S	*	.	H	α-helix	trans	-68.8	-29.1	176.6	-70	-70.4	0	0	0	112.7	L1000	L1000-F1004 VanDerWaalsContact O-CD2 3.27Å; L1000-F1004 WeakPolarHBondContact O-CD2 3.07Å
1005	S	40.7	Very low	37.8	Very low	35 Å²	35	90.2 Å²	90.2	25%	0.245	49%	0.485	C	S	.	.	H	α-helix	trans	-68.4	-36.3	179	-63.8	0	0	0	0	113.1	D1001 L1003 S1007 M1008 V1009	D1001-S1005 WeakPolarHBondContact O-CB 3.21Å; D1001-S1005 PolarHBondContact O-N 3.05Å; D1001-S1005 VanDerWaalsContact O-N 3.1Å; D1001-S1005 PolarHBondContact O-OG 2.75Å; L1003-S1005 VanDerWaalsContact C-N 3.3Å; L1003-S1005 PolarHBondContact O-N 3.18Å; S1005-S1007 VanDerWaalsContact C-N 3.33Å; S1005-S1007 PolarHBondContact O-N 3.31Å; S1005-M1008 PolarHBondContact O-N 3.13Å; S1005-M1008 VanDerWaalsContact O-N 3.15Å; S1005-V1009 WeakPolarHBondContact O-CG2 3.19Å; S1005-V1009 PolarHBondContact O-N 3.28Å; S1005-V1009 VanDerWaalsContact O-N 3.13Å
1006	Q	39.1	Very low	36.8	Very low	74 Å²	74	101.2 Å²	101.2	35%	0.346	53%	0.526	S	S	.	.	H	α-helix	trans	-59.8	-42.7	-178	-76.2	164.3	61.8	0	0	112	D1002 M1008 V1009 E1010	D1002-Q1006 WeakPolarHBondContact O-CG 3.36Å; D1002-Q1006 PolarHBondContact O-N 3.32Å; D1002-Q1006 PolarHBondContact O-NE2 3.4Å; Q1006-M1008 PolarHBondContact O-N 3.11Å; Q1006-V1009 PolarHBondContact O-N 3.33Å; Q1006-E1010 PolarHBondContact O-N 2.87Å
1007	S	31.5	Very low	35.7	Very low	86 Å²	86	108.8 Å²	108.8	60%	0.601	57%	0.566	S	S	*	*	H	α-helix	trans	-60.7	-24.3	177.5	-169.4	0	0	0	0	114.6	S1005	S1005-S1007 VanDerWaalsContact C-N 3.33Å; S1005-S1007 PolarHBondContact O-N 3.31Å
1008	M	29.6	Very low	34.6	Very low	128 Å²	128	112.7 Å²	112.7	63%	0.631	59%	0.588	S	S	*	*	H	α-helix	trans	-99.9	-21.8	178.9	-72.9	-164.2	-72.9	0	0	114.3	S1005 Q1006	S1005-M1008 PolarHBondContact O-N 3.13Å; S1005-M1008 VanDerWaalsContact O-N 3.15Å; Q1006-M1008 PolarHBondContact O-N 3.11Å
1009	V	34.6	Very low	34	Very low	89 Å²	89	116.1 Å²	116.1	54%	0.539	60%	0.603	S	S	.	*	H	α-helix	trans	-77.4	-36.1	179	173.1	0	0	0	0	111.7	S1005 Q1006 L1011 Q1012	S1005-V1009 WeakPolarHBondContact O-CG2 3.19Å; S1005-V1009 PolarHBondContact O-N 3.28Å; S1005-V1009 VanDerWaalsContact O-N 3.13Å; Q1006-V1009 PolarHBondContact O-N 3.33Å; V1009-L1011 PolarHBondContact O-N 3.15Å; V1009-Q1012 PolarHBondContact O-N 2.92Å; V1009-Q1012 VanDerWaalsContact O-N 3.13Å
1010	E	31.1	Very low	33.2	Very low	170 Å²	170	122.4 Å²	122.4	79%	0.794	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-23.8	175.9	-67.6	-172.9	143.5	0	0	112.6	Q1006 Q1012	Q1006-E1010 PolarHBondContact O-N 2.87Å; E1010-Q1012 VanDerWaalsContact C-N 3.31Å; E1010-Q1012 PolarHBondContact O-N 2.91Å
1011	L	32.3	Very low	32.8	Very low	147 Å²	147	122.5 Å²	122.5	77%	0.77	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-3.7	174.8	-75.2	170	0	0	0	114.8	V1009	V1009-L1011 PolarHBondContact O-N 3.15Å
1012	Q	32.3	Very low	32.3	Very low	154 Å²	154	125 Å²	125	72%	0.72	67%	0.672	S	S	*	*	S	Bend	trans	-117.2	-4.5	-174.6	-68.8	-169.1	-12	0	0	115.6	V1009 E1010	V1009-Q1012 PolarHBondContact O-N 2.92Å; V1009-Q1012 VanDerWaalsContact O-N 3.13Å; E1010-Q1012 VanDerWaalsContact C-N 3.31Å; E1010-Q1012 PolarHBondContact O-N 2.91Å
1013	H	32.5	Very low	31.9	Very low	165 Å²	165	129.2 Å²	129.2	76%	0.764	70%	0.701	S	S	*	*			trans	-133.3	38	-178.4	-69.5	83.1	0	0	0	113.1	D1015	H1013-D1015 PolarHBondContact O-N 3.15Å
1014	G	25	Very low	31.6	Very low	71 Å²	71	131.8 Å²	131.8	73%	0.732	72%	0.715	S	S	*	*			trans	-86.5	90.7	170	0	0	0	0	0	111.7
1015	D	28.3	Very low	31.4	Very low	165 Å²	165	128.7 Å²	128.7	88%	0.882	71%	0.711	S	S	*	*			trans	-62.3	138.9	162.8	-102.9	-40	0	0	0	109.7	H1013 D1017	H1013-D1015 PolarHBondContact O-N 3.15Å; D1015-D1017 PolarHBondContact O-N 3.28Å
1016	R	37.2	Very low	31.2	Very low	233 Å²	233	130.4 Å²	130.4	88%	0.879	73%	0.727	S	S	*	*	S	Bend	trans	-74.5	110.1	174.7	-80.9	176.6	160.1	-172.6	-6.3	110
1017	D	30.4	Very low	31.2	Very low	159 Å²	159	130.2 Å²	130.2	85%	0.85	73%	0.734	S	S	*	*				-179.6	170.9	118.1	-90.9	-18.6	0	0	0	111.5	D1015	D1015-D1017 PolarHBondContact O-N 3.28Å
1018	S	27.2	Very low	31.5	Very low	115 Å²	115	131.6 Å²	131.6	80%	0.804	73%	0.734	S	S	*	*			trans	70	77.9	-177.5	-166.7	0	0	0	0	115.9
1019	F	29.6	Very low	32.1	Very low	199 Å²	199	130.6 Å²	130.6	87%	0.873	73%	0.731	S	S	*	*			trans	-60.4	132.8	154.2	-87.5	-99.3	0	0	0	110.4
1020	D	27.2	Very low	32.5	Very low	162 Å²	162	129.6 Å²	129.6	87%	0.866	73%	0.727	S	S	*	*			trans	-141	135.7	147.5	-158.4	-1.8	0	0	0	108.8
1021	S	29.7	Very low	33.1	Very low	100 Å²	100	125.7 Å²	125.7	70%	0.699	71%	0.712	S	S	*	*			trans	-108.3	109.7	-156.6	-70.5	0	0	0	0	112.8
1022	A	29	Very low	33.5	Very low	93 Å²	93	125.1 Å²	125.1	77%	0.769	70%	0.7	S	S	*	*			trans	-114.6	121.4	168	0	0	0	0	0	110.2
1023	P	33.3	Very low	34.1	Very low	123 Å²	123	120.5 Å²	120.5	80%	0.799	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-72.3	137.8	-178.5	29	-34.1	0	0	0	111.5	S1025	P1023-S1025 PolarHBondContact O-N 3.45Å
1024	L	27.1	Very low	34.6	Very low	158 Å²	158	120.3 Å²	120.3	83%	0.827	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-57.9	130.9	165.7	-69.8	171.5	0	0	0	109	A1026	L1024-A1026 PolarHBondContact O-N 3.33Å
1025	S	32.5	Very low	35.7	Very low	77 Å²	77	122.2 Å²	122.2	54%	0.538	68%	0.681	S	S	.	*	P	Polyproline II helix	trans	-67.8	131.1	-169	53.3	0	0	0	0	111.8	P1023 S1027 L1028	P1023-S1025 PolarHBondContact O-N 3.45Å; S1025-S1027 PolarHBondContact O-N 2.94Å; S1025-L1028 PolarHBondContact O-N 3.08Å
1026	A	36.6	Very low	36.6	Very low	70 Å²	70	119.1 Å²	119.1	58%	0.579	66%	0.661	S	S	*	*	H	α-helix	trans	-54.5	-24.1	-175.4	0	0	0	0	0	114.3	L1024 L1028 L1029 S1030	L1024-A1026 PolarHBondContact O-N 3.33Å; A1026-L1028 VanDerWaalsContact C-N 3.26Å; A1026-L1028 PolarHBondContact O-N 3.27Å; A1026-L1029 PolarHBondContact O-N 2.83Å; A1026-L1029 VanDerWaalsContact O-N 3.11Å; A1026-S1030 PolarHBondContact O-N 3.4Å; A1026-S1030 PolarHBondContact O-OG 3.44Å
1027	S	38.5	Very low	36.8	Very low	70 Å²	70	118.7 Å²	118.7	49%	0.49	66%	0.659	S	S	.	*	H	α-helix	trans	-50.8	-43	172.9	-160	0	0	0	0	112.5	S1025 L1029 S1030 D1031	S1025-S1027 PolarHBondContact O-N 2.94Å; S1027-L1029 VanDerWaalsContact C-N 3.34Å; S1027-L1029 PolarHBondContact O-N 3.29Å; S1027-S1030 PolarHBondContact O-N 3.42Å; S1027-D1031 WeakPolarHBondContact O-CB 3.24Å; S1027-D1031 PolarHBondContact O-N 3.11Å
1028	L	37.5	Very low	37.4	Very low	116 Å²	116	115.6 Å²	115.6	61%	0.607	64%	0.641	S	S	*	*	H	α-helix	trans	-66	-35.4	-179.2	-99.1	161	0	0	0	112.6	S1025 A1026 W1032	S1025-L1028 PolarHBondContact O-N 3.08Å; A1026-L1028 VanDerWaalsContact C-N 3.26Å; A1026-L1028 PolarHBondContact O-N 3.27Å; L1028-W1032 VanDerWaalsContact O-CB 3.24Å; L1028-W1032 WeakPolarHBondContact O-CB 3.17Å; L1028-W1032 PolarHBondContact O-N 3Å; L1028-W1032 VanDerWaalsContact O-N 3.08Å
1029	L	43.2	Very low	39.2	Very low	107 Å²	107	113.6 Å²	113.6	56%	0.56	62%	0.624	S	S	*	*	H	α-helix	trans	-75.1	-37.4	175	-88.6	154.8	0	0	0	111.9	A1026 S1027 S1033	A1026-L1029 PolarHBondContact O-N 2.83Å; A1026-L1029 VanDerWaalsContact O-N 3.11Å; S1027-L1029 VanDerWaalsContact C-N 3.34Å; S1027-L1029 PolarHBondContact O-N 3.29Å; L1029-S1033 VanDerWaalsContact O-CB 3.31Å; L1029-S1033 WeakPolarHBondContact O-CB 3.46Å; L1029-S1033 PolarHBondContact O-N 3.27Å; L1029-S1033 PolarHBondContact O-OG 3.5Å
1030	S	43.1	Very low	40	Very low	67 Å²	67	109.6 Å²	109.6	47%	0.469	62%	0.618	S	S	.	*	H	α-helix	trans	-60.7	-54.1	171.4	-63.5	0	0	0	0	111.4	A1026 S1027 W1032 S1033 E1034	A1026-S1030 PolarHBondContact O-N 3.4Å; A1026-S1030 PolarHBondContact O-OG 3.44Å; S1027-S1030 PolarHBondContact O-N 3.42Å; S1030-W1032 VanDerWaalsContact C-N 3.29Å; S1030-W1032 PolarHBondContact O-N 2.78Å; S1030-S1033 PolarHBondContact O-N 3.45Å; S1030-S1033 VanDerWaalsContact O-N 3.15Å; S1030-S1033 PolarHBondContact O-OG 3.28Å; S1030-E1034 PolarHBondContact O-N 3.1Å
1031	D	42.3	Very low	41.1	Very low	88 Å²	88	104.7 Å²	104.7	47%	0.471	60%	0.6	S	S	.	*	H	α-helix	trans	-57.1	-42.2	178.8	-65	-25.2	0	0	0	111.3	S1027 V1035	S1027-D1031 WeakPolarHBondContact O-CB 3.24Å; S1027-D1031 PolarHBondContact O-N 3.11Å; D1031-V1035 WeakPolarHBondContact O-CB 3.31Å; D1031-V1035 VanDerWaalsContact O-CG2 3.25Å; D1031-V1035 WeakPolarHBondContact O-CG2 3.4Å; D1031-V1035 PolarHBondContact O-N 2.91Å; D1031-V1035 VanDerWaalsContact O-N 3.11Å
1032	W	42	Very low	42.2	Very low	136 Å²	136	103.5 Å²	103.5	52%	0.515	59%	0.586	S	S	.	*	H	α-helix	trans	-68.5	-41.1	177.9	-158.6	54.6	0	0	0	112.3	L1028 S1030 H1036	L1028-W1032 VanDerWaalsContact O-CB 3.24Å; L1028-W1032 WeakPolarHBondContact O-CB 3.17Å; L1028-W1032 PolarHBondContact O-N 3Å; L1028-W1032 VanDerWaalsContact O-N 3.08Å; S1030-W1032 VanDerWaalsContact C-N 3.29Å; S1030-W1032 PolarHBondContact O-N 2.78Å; W1032-H1036 AromaticContact CD1-CD2 3.65Å; W1032-H1036 AromaticContact CD1-NE2 3.9Å; W1032-H1036 AromaticContact NE1-CD2 3.59Å; W1032-H1036 AromaticContact NE1-NE2 3.58Å; W1032-H1036 PolarHBondContact O-CD2 2.62Å; W1032-H1036 PolarHBondContact O-N 3.18Å; W1032-H1036 VanDerWaalsContact O-N 3.15Å
1033	S	44	Very low	43	Very low	56 Å²	56	103.4 Å²	103.4	39%	0.392	57%	0.572	S	S	.	*	H	α-helix	trans	-65.5	-38.6	176.2	73.5	0	0	0	0	113	L1029 S1030 H1036 R1037	L1029-S1033 VanDerWaalsContact O-CB 3.31Å; L1029-S1033 WeakPolarHBondContact O-CB 3.46Å; L1029-S1033 PolarHBondContact O-N 3.27Å; L1029-S1033 PolarHBondContact O-OG 3.5Å; S1030-S1033 PolarHBondContact O-N 3.45Å; S1030-S1033 VanDerWaalsContact O-N 3.15Å; S1030-S1033 PolarHBondContact O-OG 3.28Å; S1033-H1036 PolarHBondContact O-N 2.76Å; S1033-R1037 PolarHBondContact O-N 3.31Å
1034	E	43.4	Very low	43.7	Very low	161 Å²	161	103.7 Å²	103.7	75%	0.752	56%	0.563	S	S	*	*	H	α-helix	trans	-74.9	-32.3	-178	-167.8	166.3	-130.1	0	0	112.1	S1030	S1030-E1034 PolarHBondContact O-N 3.1Å
1035	V	48.5	Very low	44.8	Very low	112 Å²	112	99.6 Å²	99.6	68%	0.679	55%	0.547	S	S	*	.	H	α-helix	trans	-67.9	-38.1	171	168.3	0	0	0	0	112.3	D1031	D1031-V1035 WeakPolarHBondContact O-CB 3.31Å; D1031-V1035 VanDerWaalsContact O-CG2 3.25Å; D1031-V1035 WeakPolarHBondContact O-CG2 3.4Å; D1031-V1035 PolarHBondContact O-N 2.91Å; D1031-V1035 VanDerWaalsContact O-N 3.11Å
1036	H	45.4	Very low	45.4	Very low	100 Å²	100	99.6 Å²	99.6	46%	0.463	54%	0.54	S	S	.	.	H	α-helix	trans	-100.6	-12.8	-172.3	-73.5	-73.9	0	0	0	116	W1032 S1033 M1038	W1032-H1036 AromaticContact CD1-CD2 3.65Å; W1032-H1036 AromaticContact CD1-NE2 3.9Å; W1032-H1036 AromaticContact NE1-CD2 3.59Å; W1032-H1036 AromaticContact NE1-NE2 3.58Å; W1032-H1036 PolarHBondContact O-CD2 2.62Å; W1032-H1036 PolarHBondContact O-N 3.18Å; W1032-H1036 VanDerWaalsContact O-N 3.15Å; S1033-H1036 PolarHBondContact O-N 2.76Å; H1036-M1038 HydrophobicContact CB-CE 4.27Å; H1036-M1038 HydrophobicContact CB-CG 4.16Å; H1036-M1038 PolarHBondContact O-N 3.42Å
1037	R	42.3	Very low	45.9	Very low	224 Å²	224	102.3 Å²	102.3	85%	0.845	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	34.2	-177.1	-67.5	-171.7	168	-145.6	-1.8	114.6	S1033 T1039	S1033-R1037 PolarHBondContact O-N 3.31Å; R1037-T1039 PolarHBondContact O-N 3.37Å
1038	M	42.9	Very low	46.3	Very low	93 Å²	93	106.2 Å²	106.2	46%	0.458	55%	0.552	S	S	.	*			trans	-56.6	134.8	173.1	-64.5	-62.9	-172.4	0	0	110.5	H1036 D1042	H1036-M1038 HydrophobicContact CB-CE 4.27Å; H1036-M1038 HydrophobicContact CB-CG 4.16Å; H1036-M1038 PolarHBondContact O-N 3.42Å; M1038-D1042 HydrophobicContact CB-CB 4.36Å; M1038-D1042 HydrophobicContact SD-CB 3.99Å
1039	T	64.5	Low	46.5	Very low	73 Å²	73	108.4 Å²	108.4	45%	0.448	56%	0.559	S	S	.	*			trans	-80.9	163.1	169.7	76	0	0	0	0	110.2	R1037 A1041 D1042 L1043	R1037-T1039 PolarHBondContact O-N 3.37Å; T1039-A1041 PolarHBondContact O-N 3.1Å; T1039-D1042 WeakPolarHBondContact CA-OD2 3.43Å; T1039-D1042 VanDerWaalsContact CB-OD2 3.23Å; T1039-D1042 WeakPolarHBondContact CB-OD2 3.41Å; T1039-D1042 WeakPolarHBondContact CG2-OD2 3.44Å; T1039-D1042 PolarHBondContact N-OD2 3.28Å; T1039-D1042 PolarHBondContact O-N 3.2Å; T1039-D1042 VanDerWaalsContact O-N 3.1Å; T1039-D1042 VanDerWaalsContact OG1-CG 3.31Å; T1039-D1042 PolarHBondContact OG1-N 3.33Å; T1039-D1042 PolarHBondContact OG1-OD2 3.04Å; T1039-L1043 PolarHBondContact O-N 3.35Å
1040	P	47.3	Very low	46.5	Very low	115 Å²	115	110 Å²	110	75%	0.747	57%	0.567	S	S	*	*	H	α-helix	trans	-56.9	-31.2	176.5	-27	36.4	0	0	0	113.8	L1043 E1044	P1040-L1043 PolarHBondContact O-N 3.42Å; P1040-E1044 PolarHBondContact O-N 3Å; P1040-E1044 VanDerWaalsContact O-N 3.11Å
1041	A	49.5	Very low	46.7	Very low	59 Å²	59	113.8 Å²	113.8	49%	0.488	58%	0.578	S	S	.	*	H	α-helix	trans	-72.1	-33.2	177.9	0	0	0	0	0	112.8	T1039 L1043 E1044 S1045	T1039-A1041 PolarHBondContact O-N 3.1Å; A1041-L1043 VanDerWaalsContact C-N 3.3Å; A1041-E1044 PolarHBondContact O-N 3.15Å; A1041-S1045 WeakPolarHBondContact O-CB 3.23Å; A1041-S1045 PolarHBondContact O-N 2.91Å
1042	D	53.8	Low	46.3	Very low	76 Å²	76	118 Å²	118	41%	0.406	60%	0.599	S	S	.	*	H	α-helix	trans	-67.3	-36.7	175.6	-53.5	-56.5	0	0	0	110.6	M1038 T1039 L1046	M1038-D1042 HydrophobicContact CB-CB 4.36Å; M1038-D1042 HydrophobicContact SD-CB 3.99Å; T1039-D1042 WeakPolarHBondContact CA-OD2 3.43Å; T1039-D1042 VanDerWaalsContact CB-OD2 3.23Å; T1039-D1042 WeakPolarHBondContact CB-OD2 3.41Å; T1039-D1042 WeakPolarHBondContact CG2-OD2 3.44Å; T1039-D1042 PolarHBondContact N-OD2 3.28Å; T1039-D1042 PolarHBondContact O-N 3.2Å; T1039-D1042 VanDerWaalsContact O-N 3.1Å; T1039-D1042 VanDerWaalsContact OG1-CG 3.31Å; T1039-D1042 PolarHBondContact OG1-N 3.33Å; T1039-D1042 PolarHBondContact OG1-OD2 3.04Å; D1042-L1046 WeakPolarHBondContact O-CB 3.39Å; D1042-L1046 PolarHBondContact O-N 3.37Å
1043	L	46.1	Very low	45.6	Very low	91 Å²	91	115.1 Å²	115.1	48%	0.476	61%	0.612	S	S	.	*	H	α-helix	trans	-66	-42.4	174.7	-146.7	82	0	0	0	111.9	T1039 P1040 A1041 L1046 Q1047	T1039-L1043 PolarHBondContact O-N 3.35Å; P1040-L1043 PolarHBondContact O-N 3.42Å; A1041-L1043 VanDerWaalsContact C-N 3.3Å; L1043-L1046 PolarHBondContact O-N 3.11Å; L1043-Q1047 WeakPolarHBondContact O-CB 3.41Å; L1043-Q1047 PolarHBondContact O-N 3.05Å
1044	E	47.9	Very low	45	Very low	129 Å²	129	118.4 Å²	118.4	60%	0.603	63%	0.634	S	S	*	*	H	α-helix	trans	-66.3	-39	177.3	-169.7	168.3	-141.4	0	0	111.7	P1040 A1041 Q1047 Q1048	P1040-E1044 PolarHBondContact O-N 3Å; P1040-E1044 VanDerWaalsContact O-N 3.11Å; A1041-E1044 PolarHBondContact O-N 3.15Å; E1044-Q1047 PolarHBondContact O-N 2.72Å; E1044-Q1048 PolarHBondContact O-N 3.34Å; E1044-Q1048 VanDerWaalsContact O-N 3.1Å
1045	S	48.7	Very low	44.7	Very low	71 Å²	71	116.4 Å²	116.4	50%	0.497	64%	0.635	S	S	.	*	H	α-helix	trans	-65.1	-43.8	173.6	-167.4	0	0	0	0	112.2	A1041 Q1047 Q1048 E1049	A1041-S1045 WeakPolarHBondContact O-CB 3.23Å; A1041-S1045 PolarHBondContact O-N 2.91Å; S1045-Q1047 PolarHBondContact O-N 3.26Å; S1045-Q1048 PolarHBondContact O-N 3.23Å; S1045-E1049 PolarHBondContact O-N 3.31Å; S1045-E1049 VanDerWaalsContact O-N 3.15Å
1046	L	46.1	Very low	43.6	Very low	77 Å²	77	120 Å²	120	40%	0.403	65%	0.647	S	S	.	*	H	α-helix	trans	-62.9	-33	176.2	-157.7	86.9	0	0	0	111.7	D1042 L1043	D1042-L1046 WeakPolarHBondContact O-CB 3.39Å; D1042-L1046 PolarHBondContact O-N 3.37Å; L1043-L1046 PolarHBondContact O-N 3.11Å
1047	Q	46.5	Very low	42.9	Very low	128 Å²	128	122.7 Å²	122.7	60%	0.598	66%	0.663	S	S	*	*	H	α-helix	trans	-74.3	-27.6	177.6	-172	169.1	-21.4	0	0	113	L1043 E1044 S1045	L1043-Q1047 WeakPolarHBondContact O-CB 3.41Å; L1043-Q1047 PolarHBondContact O-N 3.05Å; E1044-Q1047 PolarHBondContact O-N 2.72Å; S1045-Q1047 PolarHBondContact O-N 3.26Å
1048	Q	46.3	Very low	42.1	Very low	151 Å²	151	120 Å²	120	71%	0.706	67%	0.665	S	S	*	*	H	α-helix	trans	-73.4	-36.7	170.4	-73.1	-175.4	-0.5	0	0	112.8	E1044 S1045 L1050	E1044-Q1048 PolarHBondContact O-N 3.34Å; E1044-Q1048 VanDerWaalsContact O-N 3.1Å; S1045-Q1048 PolarHBondContact O-N 3.23Å; Q1048-L1050 PolarHBondContact O-N 3.22Å
1049	E	43.1	Very low	41.4	Very low	163 Å²	163	120.1 Å²	120.1	76%	0.762	67%	0.674	S	S	*	*	H	α-helix	trans	-68.6	-21.3	-175.3	-165.7	167.5	-148.5	0	0	113.6	S1045	S1045-E1049 PolarHBondContact O-N 3.31Å; S1045-E1049 VanDerWaalsContact O-N 3.15Å
1050	L	43.5	Very low	39.9	Very low	141 Å²	141	124.3 Å²	124.3	74%	0.738	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	5.9	-173.8	-75.4	169	0	0	0	115.8	Q1048	Q1048-L1050 PolarHBondContact O-N 3.22Å
1051	Q	46.2	Very low	38.9	Very low	146 Å²	146	125.2 Å²	125.2	68%	0.682	70%	0.698	S	S	*	*			trans	-118.9	95	-169.6	-63.1	-171.2	4.7	0	0	114.7
1052	L	33.6	Very low	38.1	Very low	177 Å²	177	130.1 Å²	130.1	93%	0.927	71%	0.714	S	S	*	*			trans	-78.4	143	155.8	-69.7	168.4	0	0	0	109.4
1053	G	28.9	Very low	37.6	Very low	75 Å²	75	130.9 Å²	130.9	77%	0.773	72%	0.723	S	S	*	*	S	Bend	trans	-56.4	155.7	-168.7	0	0	0	0	0	115.5
1054	S	31.4	Very low	36.7	Very low	124 Å²	124	133.9 Å²	133.9	87%	0.867	73%	0.734	S	S	*	*			cis	-146.2	170.3	38.2	-94.3	0	0	0	0	113.5
1055	P	36.9	Very low	36	Very low	120 Å²	120	134.4 Å²	134.4	78%	0.779	74%	0.742	S	S	*	*			trans	-83.9	150.6	-153.3	32.2	-37.3	0	0	0	115.8
1056	M	24.8	Very low	35.3	Very low	188 Å²	188	139.6 Å²	139.6	93%	0.926	79%	0.788	S	S	*	*			trans	-106.2	138.4	150.2	-101.9	-164.1	-66.8	0	0	109.6
1057	I	30.1	Very low	34.8	Very low	155 Å²	155	142.7 Å²	142.7	80%	0.795	81%	0.808	S	S	*	*			trans	-82.1	124.4	178.5	-64.8	169.9	0	0	0	108.8	S1059	I1057-S1059 PolarHBondContact O-N 3.5Å
1058	L	26.2	Very low	34.2	Very low	169 Å²	169	143.5 Å²	143.5	89%	0.885	82%	0.819	S	S	*	*			trans	-75.4	118.9	161.7	-71.9	171.1	0	0	0	108.5
1059	S	28.3	Very low	33.5	Very low	94 Å²	94	143.1 Å²	143.1	66%	0.657	83%	0.825	S	S	*	*			trans	-116.8	108.2	170.2	59.8	0	0	0	0	109.3	I1057 T1061	I1057-S1059 PolarHBondContact O-N 3.5Å; S1059-T1061 PolarHBondContact O-N 3.38Å
1060	D	31.9	Very low	32.9	Very low	161 Å²	161	141.9 Å²	141.9	86%	0.861	83%	0.829	S	S	*	*			trans	-66	120.9	179.7	-68.9	-58.8	0	0	0	112.5
1061	T	27.9	Very low	32.3	Very low	134 Å²	134	141.9 Å²	141.9	82%	0.822	83%	0.834	S	S	*	*			trans	-143.6	75.1	165.6	39.6	0	0	0	0	112.8	S1059	S1059-T1061 PolarHBondContact O-N 3.38Å
1062	I	32.8	Very low	31.4	Very low	162 Å²	162	141.7 Å²	141.7	83%	0.831	84%	0.844	S	S	*	*			trans	-83.1	149.7	147.1	-69.8	171.8	0	0	0	106.4
1063	P	41.5	Very low	31.2	Very low	92 Å²	92	139.1 Å²	139.1	60%	0.597	84%	0.839	S	S	*	*			cis	-133.5	170.3	13.3	19.3	7.1	0	0	0	116.2
1064	H	28.3	Very low	31.4	Very low	154 Å²	154	144.1 Å²	144.1	71%	0.713	84%	0.844	S	S	*	*				161.5	131.7	105.9	-101.3	-72.1	0	0	0	114.7
1065	D	32.1	Very low	31.4	Very low	141 Å²	141	145.8 Å²	145.8	75%	0.754	84%	0.842	S	S	*	*			trans	24.3	115	146.4	-46.6	-25.5	0	0	0	122
1066	A	35.7	Very low	30.9	Very low	179 Å²	179	148.1 Å²	148.1	100%	1.479	85%	0.847	S	S	*	*				-156.1	0	126.6	0	0	0	0	0	110.7

Retrieved 1,066 of 1,066 residues in 807.8 ms (Link to these results)

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