A0A077YY80_TRITR Loading...

Dsrm domain containing protein

AlphaFold DB , UniProt , Accession A0A077YY80, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,022 aa.

						>A0A077YY80_TRITR|A0A077YY80
MENPKKARYFINQQLFDVPPYYDWFSGQLQSPYVNLLEHDAYVDTSFDGKRKMEGEFIPLAESGIKRKRGNLAKKTPFMYFCEVFPTSAKQLTIQPICDEGNITYVSSVMVMGEMFHGKGRSKQTSKHSMAESVLARFLPDDFKFLNRVSDEATAASNVTTSANEFSSQQTLLEVEQSGNEQETLTSKDKKCLLPTSGLGNKPPCQLLVELCQRNGNGNLPVFELTKLDDGKVSCKLTIGENSVEAISDGRKRAKNLAAEKALLELLKVEPVWLEKCESERNRAAVLGLTAPNALMKLCGQKRIPVKFSLEKSSDHPGQMKVICQVGDESFEAVGTKRKVRTLASMKALKEIFHVDYEDSEYSSPLVMPKDLQTKTPCQLLNEVLVSQGQTPVEYTGFDVDPSGQGFRAFAKFDDEEYIGCGLSKKKAKQESASSDLIRLGALLAFGSVLLAYIVCRQKKKTKDENIDRKAKEKDWSAGEEFEKDVPPISKGMRKDGASSGAFQSTSPNAAKGERNSSPLFASSLKTAREEDLTGAAKLASYDADTRKRMINLLDSLCEKVNKNADDQPFSISLEQGIAMVELLKDDDKNVAIKSLVVIQAAACTEENRVTTSSDITILCNCGILDQLTLMLNQLPCPGPIGPTLLYCIGNLAANNDLHSKLVVHLRKLISLLKLKKETQLKLATLAALVNFTRIINNSEIGVYKELIPELLKCANCEDDLGQQSYAFAIMHNLSKVPKLASALAKSETEKERSVEHACVKNGMPVFGKVTNDAAPTGAIQSASVNRAETNVPQGTTAILGSLSLTTADDEELATLDQLVGNSADSKKAELDVLNSLCNMVKRNADGHPFDITMDQGRMLAEFLKDADSNLVIRSLIIIQAAACTEKNRTVLSNCGVFDELAVMIDHLPSSGPVAYALLHCIGDMAANNDLHVRMVAYLPKLISLMKLQEKEAQLTLATLAALVNFTRIINDSEIKMYKELIPELLKCANSAEDFGQQSYAFAIIHNLSRVPELASALSENS
					

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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	40.2	Very low	40.8	Very low	232 Å²	232	171.8 Å²	171.8	100%	1.143	82%	0.82	S	S	*	*				0	120.9	0	-65.1	167.9	179.2	0	0	108.3
2	E	32.2	Very low	40.1	Very low	184 Å²	184	169 Å²	169	86%	0.86	81%	0.813	S	S	*	*			cis	179.4	134.2	-35.9	-106.1	178.1	131.1	0	0	105.4
3	N	44.8	Very low	39.7	Very low	156 Å²	156	170.3 Å²	170.3	83%	0.834	82%	0.817	S	S	*	*			trans	-80.7	-157.4	172.8	-141	-13.9	0	0	0	107.6
4	P	56.2	Low	39.1	Very low	83 Å²	83	170.3 Å²	170.3	54%	0.539	82%	0.816	S	S	.	*			cis	-132.2	-167.7	-32.3	38.4	-21	0	0	0	112.2
5	K	46.6	Very low	38.3	Very low	194 Å²	194	167.9 Å²	167.9	84%	0.843	81%	0.808	S	S	*	*				164.9	155.4	127.5	-86.9	150.8	-170.7	171.5	0	113.3
6	K	40	Very low	37.8	Very low	196 Å²	196	170 Å²	170	85%	0.852	81%	0.813	S	S	*	*			cis	-176.3	133.2	-37.8	-140.6	-178.8	-179.2	-177.4	0	113.5
7	A	40.1	Very low	37.3	Very low	94 Å²	94	168.8 Å²	168.8	78%	0.777	81%	0.812	S	S	*	*			trans	166.6	164	154.6	0	0	0	0	0	108.8
8	R	35	Very low	36.7	Very low	220 Å²	220	166.6 Å²	166.6	83%	0.83	81%	0.811	S	S	*	*			cis	83.6	101.4	-33.3	-65.6	-166.1	176	-158.1	-0.3	124.9
9	Y	40.2	Very low	36.2	Very low	219 Å²	219	163.1 Å²	163.1	86%	0.859	80%	0.802	S	S	*	*				-144.4	127.3	128.2	-88.1	-92.4	0	0	0	105.9
10	F	35.7	Very low	36	Very low	163 Å²	163	161.5 Å²	161.5	72%	0.715	80%	0.804	S	S	*	*				78.5	137.5	63.9	-70.1	-50.8	0	0	0	113.8
11	I	37.8	Very low	35.6	Very low	149 Å²	149	163.3 Å²	163.3	76%	0.764	80%	0.803	S	S	*	*			cis	-146.5	-156.5	11.6	-150	163.9	0	0	0	113.8
12	N	32.3	Very low	34.9	Very low	138 Å²	138	162.3 Å²	162.3	74%	0.738	79%	0.788	S	S	*	*			trans	-106.1	159.1	-168.6	-38.8	-65.6	0	0	0	116.5
13	Q	35.3	Very low	34.7	Very low	186 Å²	186	159.9 Å²	159.9	87%	0.869	78%	0.781	S	S	*	*			trans	172.3	118.5	131.7	-95.2	167.8	6.6	0	0	109.1
14	Q	31.3	Very low	33.8	Very low	170 Å²	170	162.9 Å²	162.9	79%	0.794	78%	0.781	S	S	*	*				87.6	112.9	67.6	-93.4	-164.1	-20.2	0	0	116.7
15	L	27.5	Very low	32.4	Very low	134 Å²	134	168.9 Å²	168.9	70%	0.702	80%	0.799	S	S	*	*			trans	51.6	121	157.1	-71.8	121.2	0	0	0	121.5
16	F	29.4	Very low	31.5	Very low	202 Å²	202	164.5 Å²	164.5	89%	0.886	79%	0.793	S	S	*	*				-164.9	146.6	113.6	-109.2	-70.9	0	0	0	111.3
17	D	29.3	Very low	30.8	Very low	150 Å²	150	158.7 Å²	158.7	80%	0.802	79%	0.789	S	S	*	*			trans	-85.3	123.1	-177.1	-62.2	-75.2	0	0	0	113.6
18	V	26.8	Very low	30.2	Very low	129 Å²	129	162.4 Å²	162.4	78%	0.782	79%	0.79	S	S	*	*			trans	-146.1	131.5	161.1	-174.2	0	0	0	0	108.4
19	P	26.5	Very low	29.9	Very low	99 Å²	99	160.6 Å²	160.6	64%	0.643	80%	0.796	S	S	*	*			trans	-75.7	137.2	-179.1	29.9	-34.6	0	0	0	112.2	Y21	P19-Y21 PolarHBondContact O-N 3.28Å
20	P	33.5	Very low	29.5	Very low	131 Å²	131	157.8 Å²	157.8	85%	0.851	79%	0.79	S	S	*	*			trans	-72.2	110.6	172.9	29.2	-32.7	0	0	0	110.3
21	Y	27.7	Very low	29.1	Very low	200 Å²	200	154.4 Å²	154.4	78%	0.784	79%	0.787	S	S	*	*			trans	-78.2	124.1	168.6	-117.9	-102	0	0	0	109.3	P19	P19-Y21 PolarHBondContact O-N 3.28Å
22	Y	25.4	Very low	28.8	Very low	211 Å²	211	153.1 Å²	153.1	83%	0.827	79%	0.789	S	S	*	*			trans	12.3	115.6	163.6	-67.6	-93	0	0	0	118.4
23	D	27	Very low	28.6	Very low	134 Å²	134	155.9 Å²	155.9	72%	0.717	79%	0.79	S	S	*	*			trans	-144.9	143.3	157.8	-125.9	-6.2	0	0	0	114.1
24	W	26.4	Very low	28.3	Very low	218 Å²	218	152.7 Å²	152.7	83%	0.826	78%	0.783	S	S	*	*			trans	59.6	84.3	158.8	-55	-0.8	0	0	0	121.8
25	F	27	Very low	28.1	Very low	210 Å²	210	149.2 Å²	149.2	92%	0.921	77%	0.77	S	S	*	*			trans	-149	152.8	138.7	-86.9	-91.4	0	0	0	107.8
26	S	26.5	Very low	28.3	Very low	102 Å²	102	149.4 Å²	149.4	71%	0.713	77%	0.771	S	S	*	*			cis	-171.4	146.1	-28.3	54.6	0	0	0	0	107.4
27	G	26	Very low	28.4	Very low	74 Å²	74	145.1 Å²	145.1	76%	0.763	76%	0.757	S	S	*	*			trans	128.2	172.7	170.7	0	0	0	0	0	116.5
28	Q	27.7	Very low	28.4	Very low	172 Å²	172	145 Å²	145	80%	0.804	75%	0.751	S	S	*	*			trans	70.4	55.5	-177.2	-55	-171.5	10.9	0	0	117.1	Q30	Q28-Q30 PolarHBondContact O-N 2.91Å
29	L	28.5	Very low	28.5	Very low	181 Å²	181	147.8 Å²	147.8	95%	0.948	76%	0.755	S	S	*	*			trans	-81.9	87.9	146.9	-97.6	165.1	0	0	0	109
30	Q	31	Very low	28.5	Very low	160 Å²	160	149.6 Å²	149.6	75%	0.748	76%	0.759	S	S	*	*			trans	-80.7	135.9	174.4	-73.7	-169.5	-24.9	0	0	111.7	Q28	Q28-Q30 PolarHBondContact O-N 2.91Å
31	S	29.1	Very low	28.2	Very low	93 Å²	93	147.1 Å²	147.1	65%	0.65	75%	0.75	S	S	*	*			trans	-59.9	142	167.1	-177.1	0	0	0	0	110.8	Y33	S31-Y33 PolarHBondContact O-N 3.17Å
32	P	29.8	Very low	28.3	Very low	122 Å²	122	147.4 Å²	147.4	79%	0.792	75%	0.751	S	S	*	*			trans	-70.6	92.1	-171.7	28.2	-36.4	0	0	0	113	V34	P32-V34 PolarHBondContact O-N 3.4Å
33	Y	29.7	Very low	28.4	Very low	196 Å²	196	143 Å²	143	77%	0.769	75%	0.746	S	S	*	*			trans	-68.9	114.2	172.3	-97.6	-91.8	0	0	0	112	S31 N35	S31-Y33 PolarHBondContact O-N 3.17Å; Y33-N35 PolarHBondContact O-N 2.98Å
34	V	28.3	Very low	28.5	Very low	118 Å²	118	143.6 Å²	143.6	72%	0.715	75%	0.749	S	S	*	*			trans	-71.7	110.8	168.1	-179.5	0	0	0	0	108.8	P32 L36	P32-V34 PolarHBondContact O-N 3.4Å; V34-L36 VanDerWaalsContact C-N 3.3Å; V34-L36 HydrophobicContact CG1-CG 4.29Å; V34-L36 PolarHBondContact O-N 3.45Å
35	N	28	Very low	28.5	Very low	98 Å²	98	140 Å²	140	52%	0.524	75%	0.751	S	S	.	*			trans	-74.8	78.4	-179.2	-174.4	15.6	0	0	0	111.6	Y33 L37	Y33-N35 PolarHBondContact O-N 2.98Å; N35-L37 PolarHBondContact O-N 3.21Å
36	L	31.6	Very low	28.5	Very low	138 Å²	138	134.1 Å²	134.1	72%	0.723	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	11.6	-169.6	-110.3	161.3	0	0	0	116.5	V34	V34-L36 VanDerWaalsContact C-N 3.3Å; V34-L36 HydrophobicContact CG1-CG 4.29Å; V34-L36 PolarHBondContact O-N 3.45Å
37	L	31.1	Very low	28.8	Very low	112 Å²	112	139.4 Å²	139.4	59%	0.586	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.7	31.7	-168.4	-80.7	159	0	0	0	113.9	N35 K370	N35-L37 PolarHBondContact O-N 3.21Å; L37-K370 HydrophobicContact CB-CD 4.48Å; L37-K370 VanDerWaalsContact CB-CE 3.45Å; L37-K370 VanDerWaalsContact CB-NZ 3.33Å; L37-K370 HydrophobicContact CD1-CD 3.8Å; L37-K370 HydrophobicContact CD1-CG 3.93Å
38	E	29.5	Very low	29	Very low	147 Å²	147	143.4 Å²	143.4	69%	0.687	75%	0.751	S	S	*	*			trans	-130.1	51.7	165.7	-69.9	-169.8	147.9	0	0	111.6
39	H	27.4	Very low	29.1	Very low	188 Å²	188	138.5 Å²	138.5	87%	0.87	75%	0.746	S	S	*	*			trans	-125.9	70.6	174.2	-80.9	7.2	0	0	0	111.8
40	D	26.3	Very low	29.1	Very low	136 Å²	136	139.3 Å²	139.3	73%	0.727	74%	0.742	S	S	*	*			trans	-131.9	45.4	160.6	-159.1	12.2	0	0	0	108.7	K252	D40-K252 IonicContact OD1-NZ 2.96Å; D40-K252 PolarHBondContact OD1-NZ 3.17Å; D40-K252 IonicContact OD2-NZ 2.7Å; D40-K252 PolarHBondContact OD2-NZ 3.33Å
41	A	29	Very low	29.2	Very low	80 Å²	80	143.6 Å²	143.6	66%	0.661	75%	0.752	S	S	*	*			trans	-119.1	106.4	-179	0	0	0	0	0	110.3	V43	A41-V43 PolarHBondContact O-N 2.78Å
42	Y	28.1	Very low	29.1	Very low	206 Å²	206	147.8 Å²	147.8	81%	0.808	76%	0.758	S	S	*	*			trans	-64.6	116.9	169.9	-115	-99.4	0	0	0	109.3
43	V	28.9	Very low	29	Very low	118 Å²	118	149.2 Å²	149.2	72%	0.715	76%	0.756	S	S	*	*			trans	-107.7	128.1	166.6	179.9	0	0	0	0	108.1	A41 T45	A41-V43 PolarHBondContact O-N 2.78Å; V43-T45 PolarHBondContact O-N 3.14Å
44	D	28.4	Very low	29	Very low	147 Å²	147	148.3 Å²	148.3	79%	0.786	76%	0.759	S	S	*	*			trans	-76.5	111.5	-171.6	-139.6	-19.4	0	0	0	110.3	S46	D44-S46 PolarHBondContact O-N 3.04Å
45	T	26.5	Very low	29.1	Very low	141 Å²	141	146.5 Å²	146.5	87%	0.865	76%	0.764	S	S	*	*			trans	-93.4	67.6	-173.8	33.6	0	0	0	0	111.6	V43	V43-T45 PolarHBondContact O-N 3.14Å
46	S	27.3	Very low	29.2	Very low	88 Å²	88	150.9 Å²	150.9	62%	0.615	78%	0.782	S	S	*	*			trans	-139.6	98.8	165.8	65	0	0	0	0	111.5	D44	D44-S46 PolarHBondContact O-N 3.04Å
47	F	32.8	Very low	29.2	Very low	212 Å²	212	152.3 Å²	152.3	93%	0.93	78%	0.782	S	S	*	*				-165.9	143	121.8	-122.4	-89.8	0	0	0	110.8
48	D	29.5	Very low	29.4	Very low	158 Å²	158	153.9 Å²	153.9	85%	0.845	79%	0.79	S	S	*	*			trans	-84.2	153.3	175.9	-162.7	-9.2	0	0	0	110.5
49	G	30.9	Very low	29.5	Very low	69 Å²	69	152.6 Å²	152.6	71%	0.711	79%	0.794	S	S	*	*			trans	147.2	96.2	173.3	0	0	0	0	0	116.8
50	K	28.5	Very low	29.8	Very low	198 Å²	198	150 Å²	150	86%	0.861	79%	0.786	S	S	*	*			trans	-65	129.9	165.7	-62.6	174.7	-179.1	176.2	0	111.9
51	R	31.7	Very low	30	Very low	251 Å²	251	146.9 Å²	146.9	95%	0.947	78%	0.779	S	S	*	*			trans	-160.7	161.2	141.7	-123.4	160.2	-82.9	-155.1	-1.7	113.1
52	K	28.4	Very low	30.4	Very low	180 Å²	180	151.1 Å²	151.1	78%	0.783	79%	0.785	S	S	*	*			trans	-103	167.4	-169.8	-85.3	-172.6	170.6	-171.7	0	112.6
53	M	27.4	Very low	30.7	Very low	152 Å²	152	146.4 Å²	146.4	75%	0.749	78%	0.782	S	S	*	*			trans	75.6	118.5	154.4	-82.1	153.4	158.7	0	0	118.5
54	E	29	Very low	31.1	Very low	178 Å²	178	142 Å²	142	83%	0.832	76%	0.761	S	S	*	*				58.2	145	129	-67.9	164.8	-172.7	0	0	119.9
55	G	30.4	Very low	31.8	Very low	80 Å²	80	138 Å²	138	83%	0.825	74%	0.739	S	S	*	*			trans	-93.3	131.7	-154.9	0	0	0	0	0	115
56	E	30.4	Very low	32.6	Very low	190 Å²	190	139.7 Å²	139.7	89%	0.888	73%	0.734	S	S	*	*			trans	-147.2	162.8	154.4	-127.7	175.9	-161.6	0	0	111.2
57	F	31.5	Very low	33.7	Very low	167 Å²	167	145.7 Å²	145.7	73%	0.732	74%	0.744	S	S	*	*			trans	-83.4	115.5	-169.6	-140.3	-94.9	0	0	0	111	P59 L139	F57-P59 WeakPolarHBondContact O-CD 3.49Å; F57-L139 HydrophobicContact CE1-CD2 4.47Å; F57-L139 HydrophobicContact CZ-CD2 3.89Å
58	I	34.9	Very low	34.8	Very low	146 Å²	146	139.6 Å²	139.6	75%	0.749	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-98.5	116.8	-177.6	-55.9	-179	0	0	0	111.4
59	P	31.8	Very low	36.1	Very low	119 Å²	119	138.5 Å²	138.5	77%	0.773	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-74.6	139.5	173.8	30.9	-34	0	0	0	111.5	F57	F57-P59 WeakPolarHBondContact O-CD 3.49Å
60	L	33.6	Very low	37.3	Very low	134 Å²	134	137 Å²	137	70%	0.702	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-102	127.3	-174.1	-101.7	162.2	0	0	0	112.9
61	A	31.9	Very low	39	Very low	70 Å²	70	132.2 Å²	132.2	58%	0.579	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-64.1	161	-177.4	0	0	0	0	0	114.3	S63 G64	A61-S63 VanDerWaalsContact C-N 3.28Å; A61-S63 PolarHBondContact O-N 3.47Å; A61-G64 PolarHBondContact O-N 3.38Å
62	E	35.9	Very low	40.6	Very low	169 Å²	169	120.5 Å²	120.5	79%	0.79	63%	0.625	S	S	*	*	H	α-helix	trans	-57.2	-29.6	-161.2	-58.4	-173.8	123.8	0	0	115.9	I65	E62-I65 WeakPolarHBondContact O-CB 3.4Å; E62-I65 PolarHBondContact O-N 3.48Å
63	S	34.6	Very low	42.4	Very low	107 Å²	107	114.1 Å²	114.1	75%	0.748	61%	0.606	S	S	*	*	H	α-helix	trans	-68.3	-33.3	177.3	58	0	0	0	0	113.1	A61 I65	A61-S63 VanDerWaalsContact C-N 3.28Å; A61-S63 PolarHBondContact O-N 3.47Å; S63-I65 VanDerWaalsContact C-N 3.31Å; S63-I65 PolarHBondContact O-N 3.3Å
64	G	38.3	Very low	44.5	Very low	27 Å²	27	114.9 Å²	114.9	28%	0.278	61%	0.605	S	S	.	*	H	α-helix	trans	-68.6	-29.6	176	0	0	0	0	0	113	A61 K66 R67 K68	A61-G64 PolarHBondContact O-N 3.38Å; G64-K66 VanDerWaalsContact C-N 3.32Å; G64-K66 PolarHBondContact O-N 2.82Å; G64-R67 PolarHBondContact O-N 2.91Å; G64-K68 PolarHBondContact O-N 2.79Å
65	I	42.8	Very low	46.9	Very low	63 Å²	63	109.1 Å²	109.1	32%	0.323	58%	0.577	S	S	.	*	H	α-helix	trans	-59.4	-39.6	-174.4	-57.1	-177.3	0	0	0	111.6	E62 S63 K68 R69	E62-I65 WeakPolarHBondContact O-CB 3.4Å; E62-I65 PolarHBondContact O-N 3.48Å; S63-I65 VanDerWaalsContact C-N 3.31Å; S63-I65 PolarHBondContact O-N 3.3Å; I65-K68 PolarHBondContact O-N 3.47Å; I65-R69 HydrophobicContact CG2-CG 4.31Å; I65-R69 WeakPolarHBondContact O-CB 3.36Å; I65-R69 VanDerWaalsContact O-CG 3.31Å; I65-R69 WeakPolarHBondContact O-CG 3.34Å; I65-R69 PolarHBondContact O-N 3.22Å
66	K	43.6	Very low	49.5	Very low	176 Å²	176	107.9 Å²	107.9	77%	0.765	55%	0.553	S	S	*	*	H	α-helix	trans	-64.1	-42.5	179.2	-73.2	-173.9	178.4	179.4	0	112.8	G64 G70	G64-K66 VanDerWaalsContact C-N 3.32Å; G64-K66 PolarHBondContact O-N 2.82Å; K66-G70 PolarHBondContact O-N 3.27Å
67	R	50.2	Low	52.2	Low	214 Å²	214	99.7 Å²	99.7	81%	0.808	52%	0.517	S	S	*	.	H	α-helix	trans	-69.4	-39.5	175	-77.8	-174.9	175.7	174.5	-0.8	111.8	G64 G70 N71	G64-R67 PolarHBondContact O-N 2.91Å; R67-G70 PolarHBondContact O-N 2.88Å; R67-N71 PolarHBondContact O-N 3Å
68	K	55.2	Low	55.1	Low	83 Å²	83	93.5 Å²	93.5	36%	0.361	49%	0.489	S	S	.	.	H	α-helix	trans	-58.5	-50.2	176.4	-158.4	-173.3	-177.6	-163.3	0	111.1	G64 I65 G70 N71 L72 D142	G64-K68 PolarHBondContact O-N 2.79Å; I65-K68 PolarHBondContact O-N 3.47Å; K68-G70 PolarHBondContact O-N 3.5Å; K68-N71 PolarHBondContact O-N 3.2Å; K68-L72 HydrophobicContact CD-CD1 4.39Å; K68-L72 HydrophobicContact CG-CD1 3.95Å; K68-L72 PolarHBondContact O-N 2.93Å; K68-D142 VanDerWaalsContact CE-OD1 3.31Å; K68-D142 WeakPolarHBondContact CE-OD1 3.31Å; K68-D142 WeakPolarHBondContact CE-OD2 3.41Å; K68-D142 IonicContact NZ-OD1 3.97Å; K68-D142 PolarHBondContact NZ-OD1 3.41Å; K68-D142 IonicContact NZ-OD2 3.63Å; K68-D142 PolarHBondContact NZ-OD2 3.18Å
69	R	57.1	Low	57.8	Low	136 Å²	136	91 Å²	91	51%	0.513	48%	0.476	S	S	.	.	H	α-helix	trans	-55.5	-48.2	176.4	-74	-179.6	-173.9	178.4	6.7	112.9	I65 N71 L72 A73 F145	I65-R69 HydrophobicContact CG2-CG 4.31Å; I65-R69 WeakPolarHBondContact O-CB 3.36Å; I65-R69 VanDerWaalsContact O-CG 3.31Å; I65-R69 WeakPolarHBondContact O-CG 3.34Å; I65-R69 PolarHBondContact O-N 3.22Å; R69-N71 PolarHBondContact O-N 2.87Å; R69-L72 PolarHBondContact O-N 3.48Å; R69-A73 PolarHBondContact O-N 3.08Å; R69-A73 VanDerWaalsContact O-N 3.14Å; R69-F145 HydrophobicContact CB-CE1 3.82Å; R69-F145 HydrophobicContact CB-CE2 4.06Å; R69-F145 HydrophobicContact CB-CZ 3.52Å; R69-F145 HydrophobicContact CG-CD1 4.37Å; R69-F145 HydrophobicContact CG-CD2 4.02Å; R69-F145 HydrophobicContact CG-CE1 3.99Å; R69-F145 HydrophobicContact CG-CE2 3.6Å; R69-F145 HydrophobicContact CG-CG 4.4Å; R69-F145 HydrophobicContact CG-CZ 3.59Å; R69-F145 WeakPolarHBondContact O-CE1 3.35Å
70	G	57	Low	60.7	Low	36 Å²	36	86.4 Å²	86.4	37%	0.371	44%	0.443	S	S	.	.	H	α-helix	trans	-64.1	-22.3	-179.5	0	0	0	0	0	115.2	K66 R67 K68	K66-G70 PolarHBondContact O-N 3.27Å; R67-G70 PolarHBondContact O-N 2.88Å; K68-G70 PolarHBondContact O-N 3.5Å
71	N	63.1	Low	63.5	Low	99 Å²	99	80 Å²	80	53%	0.529	41%	0.41	S	S	.	.	H	α-helix	trans	-92.3	-33.5	174.8	-79.9	-11.5	0	0	0	113.2	R67 K68 R69 K75	R67-N71 PolarHBondContact O-N 3Å; K68-N71 PolarHBondContact O-N 3.2Å; R69-N71 PolarHBondContact O-N 2.87Å; N71-K75 VanDerWaalsContact O-CE 3.29Å; N71-K75 WeakPolarHBondContact O-CE 3.37Å
72	L	66.4	Low	66.3	Low	5 Å²	5	78.7 Å²	78.7	3%	0.026	40%	0.396	C	S	.	.	H	α-helix	trans	-63.1	-39.9	173.7	-89.3	152	0	0	0	112.1	K68 R69 K74 K75 Y80 D142 F145 L146	K68-L72 HydrophobicContact CD-CD1 4.39Å; K68-L72 HydrophobicContact CG-CD1 3.95Å; K68-L72 PolarHBondContact O-N 2.93Å; R69-L72 PolarHBondContact O-N 3.48Å; L72-K74 PolarHBondContact O-N 3.38Å; L72-K75 PolarHBondContact O-N 2.94Å; L72-K75 VanDerWaalsContact O-N 3.12Å; L72-Y80 HydrophobicContact CD2-CD1 3.8Å; L72-Y80 HydrophobicContact CD2-CD2 3.9Å; L72-Y80 HydrophobicContact CD2-CE1 3.71Å; L72-Y80 HydrophobicContact CD2-CE2 3.81Å; L72-Y80 HydrophobicContact CD2-CG 3.9Å; L72-Y80 HydrophobicContact CG-CE2 4.36Å; L72-D142 HydrophobicContact CD1-CB 4.3Å; L72-D142 HydrophobicContact CD2-CB 4.29Å; L72-F145 HydrophobicContact CB-CD1 3.85Å; L72-F145 HydrophobicContact CB-CE1 4.11Å; L72-F145 HydrophobicContact CD1-CD1 4.34Å; L72-L146 HydrophobicContact CD2-CD1 4.06Å; L72-L146 HydrophobicContact CD2-CD2 3.96Å; L72-L146 HydrophobicContact CD2-CG 3.82Å
73	A	64.4	Low	68.7	Low	46 Å²	46	75.4 Å²	75.4	38%	0.38	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	2	-178.2	0	0	0	0	0	116	R69 F145 V149	R69-A73 PolarHBondContact O-N 3.08Å; R69-A73 VanDerWaalsContact O-N 3.14Å; A73-F145 HydrophobicContact CB-CE1 4.47Å; A73-V149 HydrophobicContact CB-CG1 3.96Å; A73-V149 HydrophobicContact CB-CG2 4.08Å
74	K	72.2	Confident	71.2	Confident	167 Å²	167	72.8 Å²	72.8	73%	0.726	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.4	5.9	-179	-63.2	177.4	-177.3	171.1	0	113.5	L72	L72-K74 PolarHBondContact O-N 3.38Å
75	K	79.9	Confident	73.6	Confident	58 Å²	58	72.7 Å²	72.7	25%	0.252	35%	0.352	S	S	.	.			trans	-123.6	141.5	-171.5	-55.8	-173	-166.9	-161.9	0	109.7	N71 L72 M79 E83 L146	N71-K75 VanDerWaalsContact O-CE 3.29Å; N71-K75 WeakPolarHBondContact O-CE 3.37Å; L72-K75 PolarHBondContact O-N 2.94Å; L72-K75 VanDerWaalsContact O-N 3.12Å; K75-M79 HydrophobicContact CB-CB 4.12Å; K75-E83 VanDerWaalsContact CD-OE2 3.31Å; K75-E83 WeakPolarHBondContact CD-OE2 3.25Å; K75-E83 IonicContact NZ-OE1 3.98Å; K75-E83 PolarHBondContact NZ-OE1 3.38Å; K75-E83 IonicContact NZ-OE2 2.6Å; K75-E83 PolarHBondContact NZ-OE2 2.85Å; K75-L146 VanDerWaalsContact O-CD2 3.29Å; K75-L146 WeakPolarHBondContact O-CD2 3.41Å
76	T	85.7	Confident	75.6	Confident	53 Å²	53	72.9 Å²	72.9	33%	0.325	36%	0.357	S	S	.	.			trans	-77.9	161.5	168.8	78.7	0	0	0	0	110.2	F78 M79 Y80 H128	T76-F78 PolarHBondContact O-N 3.11Å; T76-F78 PolarHBondContact OG1-N 3.04Å; T76-M79 HydrophobicContact CG2-SD 4.36Å; T76-M79 PolarHBondContact O-N 3.34Å; T76-M79 PolarHBondContact OG1-N 3.4Å; T76-Y80 PolarHBondContact O-N 3.27Å; T76-H128 WeakPolarHBondContact CB-NE2 3.3Å; T76-H128 PolarHBondContact OG1-NE2 3.42Å
77	P	87.3	Confident	77.4	Confident	19 Å²	19	69.2 Å²	69.2	12%	0.123	35%	0.35	C	S	.	.	H	α-helix	trans	-49.2	-41.8	172.7	-30.6	36.2	0	0	0	113.1	Y80 F81 A131 E132 L135	P77-Y80 PolarHBondContact O-N 2.93Å; P77-F81 VanDerWaalsContact O-CB 3.32Å; P77-F81 WeakPolarHBondContact O-CB 3.34Å; P77-F81 PolarHBondContact O-N 3.35Å; P77-A131 HydrophobicContact CB-CB 4.38Å; P77-E132 HydrophobicContact CB-CG 3.8Å; P77-E132 HydrophobicContact CG-CG 3.92Å; P77-L135 HydrophobicContact CB-CD1 4.12Å; P77-L135 WeakPolarHBondContact O-CD1 3.29Å
78	F	92.2	Very high	79.1	Confident	36 Å²	36	59.8 Å²	59.8	16%	0.158	32%	0.317	C	S	.	.	H	α-helix	trans	-67.1	-37.6	177.7	-174.6	-105.4	0	0	0	113.5	T76 F81 C82 L92 K127 M130 A131	T76-F78 PolarHBondContact O-N 3.11Å; T76-F78 PolarHBondContact OG1-N 3.04Å; F78-F81 HydrophobicContact CD2-CD1 4.02Å; F78-F81 AromaticContact CE2-CD1 3.85Å; F78-F81 HydrophobicContact CE2-CD1 3.85Å; F78-F81 HydrophobicContact CE2-CE1 4.09Å; F78-C82 VanDerWaalsContact CE1-SG 3.53Å; F78-C82 WeakPolarHBondContact CZ-SG 3.49Å; F78-C82 PolarHBondContact O-N 3.44Å; F78-C82 VanDerWaalsContact O-N 3.11Å; F78-C82 PolarHBondContact O-SG 3.38Å; F78-L92 HydrophobicContact CE2-CD1 3.47Å; F78-L92 VanDerWaalsContact CE2-CD1 3.47Å; F78-L92 HydrophobicContact CZ-CD1 4.01Å; F78-K127 HydrophobicContact CD1-CD 4.34Å; F78-K127 HydrophobicContact CD2-CB 3.76Å; F78-K127 HydrophobicContact CD2-CD 4.27Å; F78-K127 HydrophobicContact CD2-CG 4.23Å; F78-K127 HydrophobicContact CE1-CD 3.92Å; F78-K127 HydrophobicContact CE2-CB 4.07Å; F78-K127 HydrophobicContact CE2-CD 3.86Å; F78-K127 HydrophobicContact CE2-CG 4.01Å; F78-K127 HydrophobicContact CG-CB 4.12Å; F78-K127 HydrophobicContact CZ-CD 3.67Å; F78-K127 HydrophobicContact CZ-CG 4.34Å; F78-M130 HydrophobicContact CD2-CE 4.22Å; F78-M130 HydrophobicContact CE2-CE 4.13Å; F78-A131 HydrophobicContact CB-CB 4.23Å; F78-A131 HydrophobicContact CD2-CB 4.18Å
79	M	90.6	Very high	80.5	Confident	94 Å²	94	57 Å²	57	46%	0.463	31%	0.309	S	S	.	.	H	α-helix	trans	-64.2	-46.7	174.7	-69.4	177.5	67.9	0	0	111.4	K75 T76 C82 E83	K75-M79 HydrophobicContact CB-CB 4.12Å; T76-M79 HydrophobicContact CG2-SD 4.36Å; T76-M79 PolarHBondContact O-N 3.34Å; T76-M79 PolarHBondContact OG1-N 3.4Å; M79-C82 PolarHBondContact O-N 3.14Å; M79-E83 PolarHBondContact O-N 3.33Å
80	Y	91.8	Very high	81.7	Confident	23 Å²	23	59.4 Å²	59.4	9%	0.09	32%	0.323	C	S	.	.	H	α-helix	trans	-67.1	-38.5	-179.6	-170.2	-123.9	0	0	0	111.9	L72 T76 P77 C82 E83 V84 L135 L139 D142 L146	L72-Y80 HydrophobicContact CD2-CD1 3.8Å; L72-Y80 HydrophobicContact CD2-CD2 3.9Å; L72-Y80 HydrophobicContact CD2-CE1 3.71Å; L72-Y80 HydrophobicContact CD2-CE2 3.81Å; L72-Y80 HydrophobicContact CD2-CG 3.9Å; L72-Y80 HydrophobicContact CG-CE2 4.36Å; T76-Y80 PolarHBondContact O-N 3.27Å; P77-Y80 PolarHBondContact O-N 2.93Å; Y80-C82 VanDerWaalsContact C-N 3.33Å; Y80-C82 PolarHBondContact O-N 3.45Å; Y80-E83 PolarHBondContact O-N 2.84Å; Y80-V84 HydrophobicContact CD1-CG2 4.34Å; Y80-V84 HydrophobicContact CD2-CG2 4.17Å; Y80-V84 HydrophobicContact CE1-CG2 4.02Å; Y80-V84 HydrophobicContact CE2-CG2 3.84Å; Y80-V84 HydrophobicContact CG-CG2 4.41Å; Y80-V84 WeakPolarHBondContact O-CG2 3.4Å; Y80-V84 PolarHBondContact O-N 2.95Å; Y80-L135 HydrophobicContact CD1-CD1 3.98Å; Y80-L135 HydrophobicContact CD1-CD2 3.66Å; Y80-L135 HydrophobicContact CD1-CG 4.5Å; Y80-L135 HydrophobicContact CE1-CD2 4.06Å; Y80-L139 HydrophobicContact CE1-CD1 3.74Å; Y80-D142 HydrophobicContact CE1-CB 3.68Å; Y80-D142 PolarHBondContact OH-OD2 3.13Å; Y80-L146 HydrophobicContact CD1-CD1 3.89Å; Y80-L146 HydrophobicContact CG-CD1 4.37Å
81	F	93	Very high	82.9	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-55.2	-44.4	169.9	162.2	-97	0	0	0	112.6	P77 F78 E83 V84 F85 A89 L92 V109 V111 M130 A131 V134	P77-F81 VanDerWaalsContact O-CB 3.32Å; P77-F81 WeakPolarHBondContact O-CB 3.34Å; P77-F81 PolarHBondContact O-N 3.35Å; F78-F81 HydrophobicContact CD2-CD1 4.02Å; F78-F81 AromaticContact CE2-CD1 3.85Å; F78-F81 HydrophobicContact CE2-CD1 3.85Å; F78-F81 HydrophobicContact CE2-CE1 4.09Å; F81-E83 VanDerWaalsContact C-N 3.31Å; F81-E83 PolarHBondContact O-N 2.9Å; F81-V84 PolarHBondContact O-N 2.81Å; F81-F85 HydrophobicContact CD2-CB 4.23Å; F81-F85 AromaticContact CD2-CD2 3.77Å; F81-F85 HydrophobicContact CD2-CD2 3.77Å; F81-F85 HydrophobicContact CD2-CG 4.4Å; F81-F85 HydrophobicContact CE2-CB 3.91Å; F81-F85 HydrophobicContact CE2-CD2 4.11Å; F81-F85 HydrophobicContact CE2-CG 4.32Å; F81-F85 HydrophobicContact CZ-CB 4.49Å; F81-F85 PolarHBondContact O-N 3.06Å; F81-A89 HydrophobicContact CD1-CB 4.43Å; F81-A89 HydrophobicContact CE1-CB 3.69Å; F81-A89 HydrophobicContact CZ-CB 4.16Å; F81-L92 HydrophobicContact CE1-CD1 4.2Å; F81-V109 HydrophobicContact CE2-CG1 4.42Å; F81-V109 HydrophobicContact CZ-CG1 4.21Å; F81-V109 HydrophobicContact CZ-CG2 4.24Å; F81-V111 HydrophobicContact CE2-CG2 4.16Å; F81-M130 HydrophobicContact CD1-CE 4.09Å; F81-M130 HydrophobicContact CE1-CE 3.8Å; F81-M130 HydrophobicContact CE2-SD 4.33Å; F81-M130 HydrophobicContact CZ-CE 4.09Å; F81-M130 HydrophobicContact CZ-SD 4.25Å; F81-A131 HydrophobicContact CB-CB 3.66Å; F81-A131 HydrophobicContact CD1-CB 4.4Å; F81-A131 HydrophobicContact CG-CB 4Å; F81-V134 HydrophobicContact CD2-CB 4.06Å; F81-V134 HydrophobicContact CD2-CG1 3.8Å; F81-V134 HydrophobicContact CD2-CG2 4.26Å; F81-V134 HydrophobicContact CE2-CB 4.33Å; F81-V134 HydrophobicContact CE2-CG1 3.98Å; F81-V134 HydrophobicContact CE2-CG2 4.09Å
82	C	90.9	Very high	84.2	Confident	42 Å²	42	59.8 Å²	59.8	28%	0.284	31%	0.313	S	S	.	.	H	α-helix	trans	-66.8	-30.2	179.8	-67.1	0	0	0	0	113.5	F78 M79 Y80 P86 A89	F78-C82 VanDerWaalsContact CE1-SG 3.53Å; F78-C82 WeakPolarHBondContact CZ-SG 3.49Å; F78-C82 PolarHBondContact O-N 3.44Å; F78-C82 VanDerWaalsContact O-N 3.11Å; F78-C82 PolarHBondContact O-SG 3.38Å; M79-C82 PolarHBondContact O-N 3.14Å; Y80-C82 VanDerWaalsContact C-N 3.33Å; Y80-C82 PolarHBondContact O-N 3.45Å; C82-P86 WeakPolarHBondContact O-CA 3.17Å; C82-A89 HydrophobicContact CB-CB 4.38Å
83	E	86.9	Confident	85.3	Confident	99 Å²	99	62.7 Å²	62.7	46%	0.463	33%	0.331	S	S	.	.	H	α-helix	trans	-76.4	-39	176.4	-68	176.1	167.2	0	0	112.6	K75 M79 Y80 F81	K75-E83 VanDerWaalsContact CD-OE2 3.31Å; K75-E83 WeakPolarHBondContact CD-OE2 3.25Å; K75-E83 IonicContact NZ-OE1 3.98Å; K75-E83 PolarHBondContact NZ-OE1 3.38Å; K75-E83 IonicContact NZ-OE2 2.6Å; K75-E83 PolarHBondContact NZ-OE2 2.85Å; M79-E83 PolarHBondContact O-N 3.33Å; Y80-E83 PolarHBondContact O-N 2.84Å; F81-E83 VanDerWaalsContact C-N 3.31Å; F81-E83 PolarHBondContact O-N 2.9Å
84	V	86.8	Confident	86.7	Confident	52 Å²	52	63.3 Å²	63.3	32%	0.315	33%	0.327	S	S	.	.	H	α-helix	trans	-79.7	-39.4	-178.5	176.2	0	0	0	0	111.8	Y80 F81 P86 L139	Y80-V84 HydrophobicContact CD1-CG2 4.34Å; Y80-V84 HydrophobicContact CD2-CG2 4.17Å; Y80-V84 HydrophobicContact CE1-CG2 4.02Å; Y80-V84 HydrophobicContact CE2-CG2 3.84Å; Y80-V84 HydrophobicContact CG-CG2 4.41Å; Y80-V84 WeakPolarHBondContact O-CG2 3.4Å; Y80-V84 PolarHBondContact O-N 2.95Å; F81-V84 PolarHBondContact O-N 2.81Å; V84-P86 VanDerWaalsContact O-CD 3.3Å; V84-P86 WeakPolarHBondContact O-CD 3.4Å; V84-L139 HydrophobicContact CB-CD1 4.31Å; V84-L139 HydrophobicContact CG1-CD1 3.72Å; V84-L139 HydrophobicContact CG2-CD1 3.79Å
85	F	88.1	Confident	87.5	Confident	26 Å²	26	61.4 Å²	61.4	11%	0.114	32%	0.321	C	S	.	.			trans	-120.9	55	-174.3	-57.9	-77	0	0	0	112.5	F81 T87 S88 A89 V111 V134 F138	F81-F85 HydrophobicContact CD2-CB 4.23Å; F81-F85 AromaticContact CD2-CD2 3.77Å; F81-F85 HydrophobicContact CD2-CD2 3.77Å; F81-F85 HydrophobicContact CD2-CG 4.4Å; F81-F85 HydrophobicContact CE2-CB 3.91Å; F81-F85 HydrophobicContact CE2-CD2 4.11Å; F81-F85 HydrophobicContact CE2-CG 4.32Å; F81-F85 HydrophobicContact CZ-CB 4.49Å; F81-F85 PolarHBondContact O-N 3.06Å; F85-T87 PolarHBondContact O-N 3.33Å; F85-T87 VanDerWaalsContact O-N 3.14Å; F85-S88 PolarHBondContact O-N 3.32Å; F85-A89 WeakPolarHBondContact O-CB 3.48Å; F85-A89 PolarHBondContact O-N 2.74Å; F85-V111 HydrophobicContact CD1-CG1 3.64Å; F85-V111 HydrophobicContact CE1-CG1 3.58Å; F85-V111 HydrophobicContact CG-CG1 4.25Å; F85-V111 HydrophobicContact CZ-CG1 4.16Å; F85-V134 HydrophobicContact CD2-CG1 3.91Å; F85-V134 HydrophobicContact CE2-CG1 3.65Å; F85-V134 HydrophobicContact CZ-CG1 4.25Å; F85-F138 HydrophobicContact CZ-CB 3.85Å; F85-F138 HydrophobicContact CZ-CD2 4.09Å; F85-F138 HydrophobicContact CZ-CG 4.17Å
86	P	85.3	Confident	87.8	Confident	66 Å²	66	63 Å²	63	43%	0.429	34%	0.337	S	S	.	.	H	α-helix	trans	-62.7	-25.7	-172.4	26.2	-35.9	0	0	0	113.9	C82 V84 K90	C82-P86 WeakPolarHBondContact O-CA 3.17Å; V84-P86 VanDerWaalsContact O-CD 3.3Å; V84-P86 WeakPolarHBondContact O-CD 3.4Å; P86-K90 WeakPolarHBondContact O-CG 3.46Å; P86-K90 PolarHBondContact O-N 3.09Å
87	T	80.5	Confident	87.8	Confident	100 Å²	100	63 Å²	63	61%	0.613	34%	0.335	S	S	*	.	H	α-helix	trans	-72.2	-51.4	175	-50.8	0	0	0	0	111.2	F85 A89 K90	F85-T87 PolarHBondContact O-N 3.33Å; F85-T87 VanDerWaalsContact O-N 3.14Å; T87-A89 VanDerWaalsContact C-N 3.33Å; T87-A89 PolarHBondContact O-N 3.36Å; T87-K90 WeakPolarHBondContact O-CB 3.4Å; T87-K90 PolarHBondContact O-N 3.28Å
88	S	86.6	Confident	87.3	Confident	16 Å²	16	67 Å²	67	11%	0.112	36%	0.362	C	S	.	.	H	α-helix	trans	-64.4	-36.6	175.8	-63.8	0	0	0	0	112.2	F85 K90 Q91 L92 V109 M110	F85-S88 PolarHBondContact O-N 3.32Å; S88-K90 PolarHBondContact O-N 3.39Å; S88-Q91 CarbonylContact O-C 3.59Å; S88-Q91 WeakPolarHBondContact O-CA 3.37Å; S88-Q91 WeakPolarHBondContact O-CB 3.38Å; S88-Q91 PolarHBondContact O-N 3.09Å; S88-L92 PolarHBondContact O-N 3.35Å; S88-V109 WeakPolarHBondContact O-CG2 3.37Å; S88-M110 VanDerWaalsContact CB-O 3.24Å; S88-M110 WeakPolarHBondContact CB-O 3.43Å; S88-M110 PolarHBondContact OG-O 3.02Å
89	A	85.1	Confident	86.4	Confident	24 Å²	24	67.9 Å²	67.9	20%	0.198	37%	0.368	C	S	.	.	H	α-helix	trans	-60.7	-27.6	176.6	0	0	0	0	0	113.3	F81 C82 F85 T87 L92	F81-A89 HydrophobicContact CD1-CB 4.43Å; F81-A89 HydrophobicContact CE1-CB 3.69Å; F81-A89 HydrophobicContact CZ-CB 4.16Å; C82-A89 HydrophobicContact CB-CB 4.38Å; F85-A89 WeakPolarHBondContact O-CB 3.48Å; F85-A89 PolarHBondContact O-N 2.74Å; T87-A89 VanDerWaalsContact C-N 3.33Å; T87-A89 PolarHBondContact O-N 3.36Å; A89-L92 WeakPolarHBondContact O-CB 3.25Å
90	K	82.1	Confident	85.7	Confident	187 Å²	187	72.2 Å²	72.2	81%	0.813	39%	0.387	S	S	*	.	H	α-helix	trans	-76.7	-20.2	171.2	-69.2	169.2	-178.8	-179.4	0	113.6	P86 T87 S88	P86-K90 WeakPolarHBondContact O-CG 3.46Å; P86-K90 PolarHBondContact O-N 3.09Å; T87-K90 WeakPolarHBondContact O-CB 3.4Å; T87-K90 PolarHBondContact O-N 3.28Å; S88-K90 PolarHBondContact O-N 3.39Å
91	Q	83.1	Confident	84.4	Confident	116 Å²	116	74.5 Å²	74.5	54%	0.542	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	6.6	177.5	-62.8	176	-14.7	0	0	112.8	S88 T93	S88-Q91 CarbonylContact O-C 3.59Å; S88-Q91 WeakPolarHBondContact O-CA 3.37Å; S88-Q91 WeakPolarHBondContact O-CB 3.38Å; S88-Q91 PolarHBondContact O-N 3.09Å; Q91-T93 PolarHBondContact O-N 2.91Å
92	L	89.3	Confident	83.4	Confident	27 Å²	27	79.8 Å²	79.8	14%	0.141	45%	0.446	C	S	.	.			trans	-69.4	117.9	-178.5	-176.1	162	0	0	0	111	F78 F81 S88 A89 I94 V109 K127 M130	F78-L92 HydrophobicContact CE2-CD1 3.47Å; F78-L92 VanDerWaalsContact CE2-CD1 3.47Å; F78-L92 HydrophobicContact CZ-CD1 4.01Å; F81-L92 HydrophobicContact CE1-CD1 4.2Å; S88-L92 PolarHBondContact O-N 3.35Å; A89-L92 WeakPolarHBondContact O-CB 3.25Å; L92-I94 HydrophobicContact CD2-CD1 3.95Å; L92-I94 HydrophobicContact CD2-CG1 3.45Å; L92-I94 VanDerWaalsContact CD2-CG1 3.45Å; L92-V109 HydrophobicContact CB-CG2 4.41Å; L92-K127 HydrophobicContact CD1-CG 4.29Å; L92-K127 HydrophobicContact CD2-CG 4.32Å; L92-M130 HydrophobicContact CD1-CE 3.45Å; L92-M130 VanDerWaalsContact CD1-CE 3.45Å; L92-M130 HydrophobicContact CG-CE 4.33Å
93	T	90.4	Very high	82.5	Confident	66 Å²	66	83.2 Å²	83.2	41%	0.405	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	152	174.8	60.4	0	0	0	0	110.9	Q91 S107 S108	Q91-T93 PolarHBondContact O-N 2.91Å; T93-S107 WeakPolarHBondContact O-CA 3.01Å; T93-S108 PolarHBondContact N-O 2.7Å; T93-S108 PolarHBondContact O-N 2.61Å; T93-S108 PolarHBondContact OG1-O 3.24Å
94	I	92.9	Very high	82.5	Confident	59 Å²	59	79.5 Å²	79.5	30%	0.303	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	120.9	176.5	-42.2	172.7	0	0	0	109.5	L92 Y105 V106 K123 K127	L92-I94 HydrophobicContact CD2-CD1 3.95Å; L92-I94 HydrophobicContact CD2-CG1 3.45Å; L92-I94 VanDerWaalsContact CD2-CG1 3.45Å; I94-Y105 HydrophobicContact CG2-CD1 4.33Å; I94-V106 CarbonylContact C-O 3.43Å; I94-V106 VanDerWaalsContact CA-O 3.31Å; I94-V106 WeakPolarHBondContact CA-O 3.28Å; I94-K123 HydrophobicContact CG2-CG 4.18Å; I94-K127 HydrophobicContact CD1-CD 4.44Å; I94-K127 VanDerWaalsContact CD1-CE 3.43Å
95	Q	88.4	Confident	82.7	Confident	127 Å²	127	79.8 Å²	79.8	59%	0.593	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	133	-179.5	-62.1	-176.7	0.9	0	0	110.5	V106	Q95-V106 PolarHBondContact N-O 3.36Å; Q95-V106 PolarHBondContact O-N 2.98Å
96	P	86.9	Confident	82.9	Confident	90 Å²	90	79.6 Å²	79.6	58%	0.584	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	128.6	167	32.2	-29.8	0	0	0	109.9	I103 Y105	P96-I103 HydrophobicContact CB-CG2 4.22Å; P96-Y105 HydrophobicContact CB-CD1 4.16Å; P96-Y105 HydrophobicContact CB-CE1 4.01Å
97	I	85	Confident	83.4	Confident	55 Å²	55	76.4 Å²	76.4	28%	0.282	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	157	170.7	63.6	168	0	0	0	109.8	D99 T104 V106	I97-D99 HydrophobicContact CD1-CB 4.17Å; I97-D99 HydrophobicContact CG1-CB 4.39Å; I97-T104 HydrophobicContact CD1-CG2 4.38Å; I97-T104 HydrophobicContact CG1-CG2 4.28Å; I97-T104 WeakPolarHBondContact CG1-O 3.48Å; I97-T104 PolarHBondContact N-O 3.39Å; I97-T104 PolarHBondContact O-N 3.42Å; I97-T104 VanDerWaalsContact O-O 3.08Å; I97-V106 HydrophobicContact CD1-CG2 3.64Å; I97-V106 HydrophobicContact CG1-CG2 3.9Å; I97-V106 HydrophobicContact CG2-CG2 3.97Å
98	C	77.4	Confident	84.1	Confident	103 Å²	103	72.6 Å²	72.6	70%	0.696	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	113.8	166.9	-166.8	0	0	0	0	108.2	N102	C98-N102 WeakPolarHBondContact CA-O 3.44Å
99	D	73.8	Confident	84.5	Confident	53 Å²	53	72 Å²	72	28%	0.283	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	119.8	-175.1	-146.8	-11.4	0	0	0	107.1	I97 G101 N102 K119	I97-D99 HydrophobicContact CD1-CB 4.17Å; I97-D99 HydrophobicContact CG1-CB 4.39Å; D99-G101 PolarHBondContact O-N 2.97Å; D99-N102 PolarHBondContact N-O 2.75Å; D99-N102 WeakPolarHBondContact O-CB 3.4Å; D99-N102 PolarHBondContact O-N 2.91Å; D99-N102 VanDerWaalsContact O-O 3.13Å; D99-K119 IonicContact OD2-NZ 3.22Å; D99-K119 PolarHBondContact OD2-NZ 2.95Å
100	E	74.7	Confident	84.8	Confident	186 Å²	186	75.2 Å²	75.2	87%	0.869	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	41.7	-172.6	-58	-174.3	153.2	0	0	114.1	N102	E100-N102 PolarHBondContact O-N 3.31Å; E100-N102 PolarHBondContact O-ND2 3.2Å
101	G	64.7	Low	85.1	Confident	71 Å²	71	66.3 Å²	66.3	73%	0.732	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	2.8	-178.1	0	0	0	0	0	115.3	D99	D99-G101 PolarHBondContact O-N 2.97Å
102	N	72.5	Confident	85.2	Confident	111 Å²	111	68.5 Å²	68.5	59%	0.594	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	150	178.3	-71.5	-92.8	0	0	0	110.8	C98 D99 E100 T104	C98-N102 WeakPolarHBondContact CA-O 3.44Å; D99-N102 PolarHBondContact N-O 2.75Å; D99-N102 WeakPolarHBondContact O-CB 3.4Å; D99-N102 PolarHBondContact O-N 2.91Å; D99-N102 VanDerWaalsContact O-O 3.13Å; E100-N102 PolarHBondContact O-N 3.31Å; E100-N102 PolarHBondContact O-ND2 3.2Å; N102-T104 PolarHBondContact O-N 3.17Å
103	I	71.8	Confident	84.9	Confident	114 Å²	114	70 Å²	70	59%	0.585	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	109.1	173.3	-58.5	177	0	0	0	108.7	P96 Y105	P96-I103 HydrophobicContact CB-CG2 4.22Å; I103-Y105 HydrophobicContact CG2-CE2 4.14Å
104	T	86.6	Confident	84.9	Confident	21 Å²	21	70.4 Å²	70.4	13%	0.129	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	138.8	173	-69.8	0	0	0	0	108.7	I97 N102 K119	I97-T104 HydrophobicContact CD1-CG2 4.38Å; I97-T104 HydrophobicContact CG1-CG2 4.28Å; I97-T104 WeakPolarHBondContact CG1-O 3.48Å; I97-T104 PolarHBondContact N-O 3.39Å; I97-T104 PolarHBondContact O-N 3.42Å; I97-T104 VanDerWaalsContact O-O 3.08Å; N102-T104 PolarHBondContact O-N 3.17Å; T104-K119 HydrophobicContact CG2-CB 4.18Å; T104-K119 HydrophobicContact CG2-CD 4.36Å; T104-K119 HydrophobicContact CG2-CG 4.36Å
105	Y	92	Very high	84.8	Confident	57 Å²	57	73 Å²	73	22%	0.224	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	136	173	-64.9	-90.7	0	0	0	109.5	I94 P96 I103 K119 G120 S122 K123 S126	I94-Y105 HydrophobicContact CG2-CD1 4.33Å; P96-Y105 HydrophobicContact CB-CD1 4.16Å; P96-Y105 HydrophobicContact CB-CE1 4.01Å; I103-Y105 HydrophobicContact CG2-CE2 4.14Å; Y105-K119 CarbonylContact O-C 3.6Å; Y105-K119 WeakPolarHBondContact O-CA 3.29Å; Y105-G120 PolarHBondContact N-O 2.71Å; Y105-G120 PolarHBondContact O-N 3.25Å; Y105-S122 VanDerWaalsContact CD2-C 3.44Å; Y105-S122 VanDerWaalsContact CD2-CA 3.46Å; Y105-K123 HydrophobicContact CD1-CD 4.45Å; Y105-K123 HydrophobicContact CD1-CG 3.49Å; Y105-K123 VanDerWaalsContact CD1-CG 3.49Å; Y105-K123 HydrophobicContact CE1-CD 4.22Å; Y105-K123 HydrophobicContact CE1-CG 3.54Å; Y105-K123 HydrophobicContact CG-CG 4.02Å; Y105-S126 WeakPolarHBondContact CB-OG 3.36Å; Y105-S126 VanDerWaalsContact O-CB 3.22Å; Y105-S126 WeakPolarHBondContact O-CB 3.45Å
106	V	92.8	Very high	85.2	Confident	22 Å²	22	68 Å²	68	13%	0.133	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129.5	165.1	-169.6	0	0	0	0	107.3	I94 Q95 I97 G118 K119	I94-V106 CarbonylContact C-O 3.43Å; I94-V106 VanDerWaalsContact CA-O 3.31Å; I94-V106 WeakPolarHBondContact CA-O 3.28Å; Q95-V106 PolarHBondContact N-O 3.36Å; Q95-V106 PolarHBondContact O-N 2.98Å; I97-V106 HydrophobicContact CD1-CG2 3.64Å; I97-V106 HydrophobicContact CG1-CG2 3.9Å; I97-V106 HydrophobicContact CG2-CG2 3.97Å; V106-G118 CarbonylContact C-O 3.56Å; V106-G118 WeakPolarHBondContact CA-O 3.34Å; V106-K119 HydrophobicContact CG2-CG 4.37Å
107	S	95.3	Very high	85.5	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130.6	163.8	-65.4	0	0	0	0	108.6	T93 H117 G118 S126 K127	T93-S107 WeakPolarHBondContact O-CA 3.01Å; S107-H117 CarbonylContact O-C 3.59Å; S107-H117 WeakPolarHBondContact O-CA 3.35Å; S107-G118 PolarHBondContact N-O 2.92Å; S107-G118 PolarHBondContact O-N 3.5Å; S107-S126 PolarHBondContact OG-OG 3.26Å; S107-K127 PolarHBondContact OG-N 3.29Å
108	S	94.7	Very high	85.9	Confident	20 Å²	20	65.9 Å²	65.9	14%	0.14	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	144.9	179.5	-58	0	0	0	0	111.4	T93 F116 H117	T93-S108 PolarHBondContact N-O 2.7Å; T93-S108 PolarHBondContact O-N 2.61Å; T93-S108 PolarHBondContact OG1-O 3.24Å; S108-F116 CarbonylContact C-O 3.57Å; S108-F116 VanDerWaalsContact CA-O 3.28Å; S108-F116 WeakPolarHBondContact CA-O 3.41Å; S108-H117 PolarHBondContact OG-CD2 2.89Å; S108-H117 PolarHBondContact OG-NE2 3.34Å
109	V	95.1	Very high	86.6	Confident	4 Å²	4	66.5 Å²	66.5	2%	0.024	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	151.2	176.6	73.1	0	0	0	0	111.8	F81 S88 L92 V111 M115 F116 M130 V134	F81-V109 HydrophobicContact CE2-CG1 4.42Å; F81-V109 HydrophobicContact CZ-CG1 4.21Å; F81-V109 HydrophobicContact CZ-CG2 4.24Å; S88-V109 WeakPolarHBondContact O-CG2 3.37Å; L92-V109 HydrophobicContact CB-CG2 4.41Å; V109-V111 HydrophobicContact CG1-CG2 4.02Å; V109-M115 CarbonylContact O-C 3.54Å; V109-M115 WeakPolarHBondContact O-CA 3.46Å; V109-F116 HydrophobicContact CG1-CB 4.18Å; V109-F116 PolarHBondContact N-O 2.97Å; V109-F116 PolarHBondContact O-N 2.91Å; V109-M130 HydrophobicContact CB-SD 4.29Å; V109-M130 HydrophobicContact CG1-CE 4.35Å; V109-M130 HydrophobicContact CG1-CG 3.99Å; V109-M130 HydrophobicContact CG1-SD 3.31Å; V109-M130 WeakPolarHBondContact CG1-SD 3.06Å; V109-V134 HydrophobicContact CG1-CG2 4.19Å
110	M	91.6	Very high	87.4	Confident	91 Å²	91	64.6 Å²	64.6	45%	0.448	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	128.5	170.5	-167.9	179.2	-70.6	0	0	110.6	S88 E114 M115	S88-M110 VanDerWaalsContact CB-O 3.24Å; S88-M110 WeakPolarHBondContact CB-O 3.43Å; S88-M110 PolarHBondContact OG-O 3.02Å; M110-E114 WeakPolarHBondContact CA-O 3.31Å; M110-M115 HydrophobicContact CE-CE 4.02Å
111	V	89.1	Confident	88.1	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	118.6	177.9	-178.3	0	0	0	0	108	F81 F85 V109 G113 E114 F116 V134 F138	F81-V111 HydrophobicContact CE2-CG2 4.16Å; F85-V111 HydrophobicContact CD1-CG1 3.64Å; F85-V111 HydrophobicContact CE1-CG1 3.58Å; F85-V111 HydrophobicContact CG-CG1 4.25Å; F85-V111 HydrophobicContact CZ-CG1 4.16Å; V109-V111 HydrophobicContact CG1-CG2 4.02Å; V111-G113 PolarHBondContact O-N 3.44Å; V111-G113 VanDerWaalsContact O-N 3.16Å; V111-E114 PolarHBondContact N-O 2.93Å; V111-E114 PolarHBondContact O-N 3.47Å; V111-F116 HydrophobicContact CB-CD2 4.05Å; V111-F116 HydrophobicContact CB-CE2 3.9Å; V111-F116 HydrophobicContact CG2-CD2 4.21Å; V111-V134 HydrophobicContact CB-CG1 4.48Å; V111-V134 HydrophobicContact CG1-CG1 4.25Å; V111-V134 HydrophobicContact CG2-CG1 4.02Å; V111-V134 HydrophobicContact CG2-CG2 4.17Å; V111-F138 HydrophobicContact CB-CE2 3.88Å; V111-F138 HydrophobicContact CB-CZ 4.44Å; V111-F138 HydrophobicContact CG1-CD2 3.9Å; V111-F138 HydrophobicContact CG1-CE2 3.45Å; V111-F138 VanDerWaalsContact CG1-CE2 3.45Å; V111-F138 HydrophobicContact CG1-CZ 4.03Å
112	M	85.1	Confident	89.3	Confident	162 Å²	162	65.5 Å²	65.5	80%	0.798	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	33.4	-176.2	-54.5	-54.9	-167.1	0	0	114.3	E114 F138	M112-E114 VanDerWaalsContact C-N 3.27Å; M112-E114 PolarHBondContact O-N 3.47Å; M112-F138 HydrophobicContact CB-CE1 4.22Å; M112-F138 HydrophobicContact CB-CZ 4.18Å; M112-F138 HydrophobicContact CG-CE1 4.24Å; M112-F138 HydrophobicContact CG-CZ 4.39Å
113	G	82.7	Confident	90.2	Very high	59 Å²	59	66 Å²	66	61%	0.608	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	-17.3	-177.6	0	0	0	0	0	115.3	V111	V111-G113 PolarHBondContact O-N 3.44Å; V111-G113 VanDerWaalsContact O-N 3.16Å
114	E	89.3	Confident	91.2	Very high	74 Å²	74	66.9 Å²	66.9	35%	0.346	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	143.2	171	-68.5	-174.2	167.5	0	0	110.6	M110 V111 M112 F116 R137	M110-E114 WeakPolarHBondContact CA-O 3.31Å; V111-E114 PolarHBondContact N-O 2.93Å; V111-E114 PolarHBondContact O-N 3.47Å; M112-E114 VanDerWaalsContact C-N 3.27Å; M112-E114 PolarHBondContact O-N 3.47Å; E114-F116 HydrophobicContact CB-CD2 4.5Å; E114-F116 HydrophobicContact CB-CE2 3.47Å; E114-F116 VanDerWaalsContact CB-CE2 3.47Å; E114-F116 HydrophobicContact CB-CZ 3.64Å; E114-F116 WeakPolarHBondContact O-CE2 3.43Å; E114-F116 WeakPolarHBondContact OE2-CZ 3.3Å; E114-R137 IonicContact OE1-CZ 2.63Å; E114-R137 IonicContact OE1-NE 3.07Å; E114-R137 IonicContact OE1-NH2 2.88Å; E114-R137 PolarHBondContact OE1-NH2 3.07Å; E114-R137 IonicContact OE2-CZ 3.26Å; E114-R137 IonicContact OE2-NE 2.78Å; E114-R137 PolarHBondContact OE2-NE 3.25Å; E114-R137 IonicContact OE2-NH2 2.85Å; E114-R137 PolarHBondContact OE2-NH2 3.17Å
115	M	91.9	Very high	91.4	Very high	112 Å²	112	69.2 Å²	69.2	55%	0.552	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	115.2	-177.3	-165.3	-176.4	-68.1	0	0	111.9	V109 M110 H117	V109-M115 CarbonylContact O-C 3.54Å; V109-M115 WeakPolarHBondContact O-CA 3.46Å; M110-M115 HydrophobicContact CE-CE 4.02Å; M115-H117 PolarHBondContact O-ND1 2.82Å
116	F	95.5	Very high	91.5	Very high	22 Å²	22	66.5 Å²	66.5	10%	0.096	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	141	-174.8	-61.6	-91.6	0	0	0	111.1	S108 V109 V111 E114 M130 V134 R137 F138	S108-F116 CarbonylContact C-O 3.57Å; S108-F116 VanDerWaalsContact CA-O 3.28Å; S108-F116 WeakPolarHBondContact CA-O 3.41Å; V109-F116 HydrophobicContact CG1-CB 4.18Å; V109-F116 PolarHBondContact N-O 2.97Å; V109-F116 PolarHBondContact O-N 2.91Å; V111-F116 HydrophobicContact CB-CD2 4.05Å; V111-F116 HydrophobicContact CB-CE2 3.9Å; V111-F116 HydrophobicContact CG2-CD2 4.21Å; E114-F116 HydrophobicContact CB-CD2 4.5Å; E114-F116 HydrophobicContact CB-CE2 3.47Å; E114-F116 VanDerWaalsContact CB-CE2 3.47Å; E114-F116 HydrophobicContact CB-CZ 3.64Å; E114-F116 WeakPolarHBondContact O-CE2 3.43Å; E114-F116 WeakPolarHBondContact OE2-CZ 3.3Å; F116-M130 HydrophobicContact CB-CG 4.4Å; F116-V134 HydrophobicContact CB-CG2 3.6Å; F116-V134 HydrophobicContact CD1-CG2 3.95Å; F116-V134 HydrophobicContact CD2-CG2 3.83Å; F116-V134 HydrophobicContact CG-CB 4.5Å; F116-V134 HydrophobicContact CG-CG2 3.48Å; F116-V134 VanDerWaalsContact CG-CG2 3.48Å; F116-R137 HydrophobicContact CE1-CB 3.82Å; F116-R137 HydrophobicContact CE1-CG 3.88Å; F116-R137 HydrophobicContact CZ-CB 4.19Å; F116-R137 HydrophobicContact CZ-CG 3.82Å; F116-F138 HydrophobicContact CE1-CE2 4.32Å; F116-F138 AromaticContact CE2-CE2 3.54Å; F116-F138 HydrophobicContact CE2-CE2 3.54Å; F116-F138 AromaticContact CE2-CZ 3.99Å; F116-F138 HydrophobicContact CE2-CZ 3.99Å; F116-F138 HydrophobicContact CZ-CD2 4.39Å; F116-F138 AromaticContact CZ-CE2 3.39Å; F116-F138 HydrophobicContact CZ-CE2 3.39Å; F116-F138 AromaticContact CZ-CZ 3.8Å; F116-F138 HydrophobicContact CZ-CZ 3.8Å
117	H	93.4	Very high	91.6	Very high	101 Å²	101	68.2 Å²	68.2	47%	0.468	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140.6	-174.6	-70.2	82.5	0	0	0	109.8	S107 S108 M115	S107-H117 CarbonylContact O-C 3.59Å; S107-H117 WeakPolarHBondContact O-CA 3.35Å; S108-H117 PolarHBondContact OG-CD2 2.89Å; S108-H117 PolarHBondContact OG-NE2 3.34Å; M115-H117 PolarHBondContact O-ND1 2.82Å
118	G	93.8	Very high	91.5	Very high	1 Å²	1	69.8 Å²	69.8	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	127.6	172.5	0	0	0	0	0	111.4	V106 S107 S126 S129	V106-G118 CarbonylContact C-O 3.56Å; V106-G118 WeakPolarHBondContact CA-O 3.34Å; S107-G118 PolarHBondContact N-O 2.92Å; S107-G118 PolarHBondContact O-N 3.5Å; G118-S126 WeakPolarHBondContact O-CB 3.26Å; G118-S129 WeakPolarHBondContact CA-OG 3.32Å
119	K	92.6	Very high	91.4	Very high	115 Å²	115	70.5 Å²	70.5	50%	0.5	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	148.5	176.4	-76.2	-167.4	173.1	-168.6	0	110.6	D99 T104 Y105 V106	D99-K119 IonicContact OD2-NZ 3.22Å; D99-K119 PolarHBondContact OD2-NZ 2.95Å; T104-K119 HydrophobicContact CG2-CB 4.18Å; T104-K119 HydrophobicContact CG2-CD 4.36Å; T104-K119 HydrophobicContact CG2-CG 4.36Å; Y105-K119 CarbonylContact O-C 3.6Å; Y105-K119 WeakPolarHBondContact O-CA 3.29Å; V106-K119 HydrophobicContact CG2-CG 4.37Å
120	G	90.5	Very high	91.4	Very high	14 Å²	14	70.3 Å²	70.3	14%	0.144	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.5	156	172.5	0	0	0	0	0	114.9	Y105 S122	Y105-G120 PolarHBondContact N-O 2.71Å; Y105-G120 PolarHBondContact O-N 3.25Å; G120-S122 PolarHBondContact O-N 2.75Å
121	R	88.1	Confident	91.6	Very high	231 Å²	231	66 Å²	66	87%	0.872	33%	0.33	S	S	*	.	S	Bend	trans	-64.4	-4.8	178.4	-62.9	-178.9	-179.3	170.2	-0.3	114.3	T125	R121-T125 PolarHBondContact N-OG1 3.27Å
122	S	91.1	Very high	91.8	Very high	44 Å²	44	69.4 Å²	69.4	31%	0.308	35%	0.346	S	S	.	.	S	Bend	trans	-144.8	164.2	171.8	81.5	0	0	0	0	112	Y105 G120 Q124 T125 S126	Y105-S122 VanDerWaalsContact CD2-C 3.44Å; Y105-S122 VanDerWaalsContact CD2-CA 3.46Å; G120-S122 PolarHBondContact O-N 2.75Å; S122-Q124 PolarHBondContact O-N 2.96Å; S122-Q124 VanDerWaalsContact O-N 3.16Å; S122-Q124 PolarHBondContact OG-N 3.12Å; S122-Q124 VanDerWaalsContact OG-N 3.17Å; S122-T125 PolarHBondContact N-OG1 3.44Å; S122-T125 VanDerWaalsContact N-OG1 3.09Å; S122-T125 PolarHBondContact O-N 3.18Å; S122-T125 PolarHBondContact O-OG1 3.04Å; S122-T125 PolarHBondContact OG-N 3.25Å; S122-T125 VanDerWaalsContact OG-N 3.17Å; S122-T125 PolarHBondContact OG-OG1 3.09Å; S122-S126 PolarHBondContact O-N 3.48Å; S122-S126 VanDerWaalsContact O-N 3.09Å; S122-S126 PolarHBondContact O-OG 2.97Å
123	K	91.5	Very high	92.2	Very high	122 Å²	122	64 Å²	64	53%	0.53	32%	0.324	S	S	.	.	H	α-helix	trans	-58.5	-21.1	170.1	-63.7	-170.4	177.2	-172.7	0	113.2	I94 Y105 S126 K127	I94-K123 HydrophobicContact CG2-CG 4.18Å; Y105-K123 HydrophobicContact CD1-CD 4.45Å; Y105-K123 HydrophobicContact CD1-CG 3.49Å; Y105-K123 VanDerWaalsContact CD1-CG 3.49Å; Y105-K123 HydrophobicContact CE1-CD 4.22Å; Y105-K123 HydrophobicContact CE1-CG 3.54Å; Y105-K123 HydrophobicContact CG-CG 4.02Å; K123-S126 WeakPolarHBondContact CA-OG 3.32Å; K123-S126 PolarHBondContact O-OG 3.03Å; K123-K127 WeakPolarHBondContact O-CB 3.41Å; K123-K127 VanDerWaalsContact O-CG 3.24Å; K123-K127 WeakPolarHBondContact O-CG 3.44Å
124	Q	91.9	Very high	92.6	Very high	133 Å²	133	61.2 Å²	61.2	62%	0.621	30%	0.295	S	S	*	.	H	α-helix	trans	-85.2	-43.8	177.7	-175.5	174.3	-9.3	0	0	111.5	S122 K127 H128	S122-Q124 PolarHBondContact O-N 2.96Å; S122-Q124 VanDerWaalsContact O-N 3.16Å; S122-Q124 PolarHBondContact OG-N 3.12Å; S122-Q124 VanDerWaalsContact OG-N 3.17Å; Q124-K127 WeakPolarHBondContact O-CB 3.44Å; Q124-K127 PolarHBondContact O-N 2.83Å; Q124-H128 PolarHBondContact O-N 3.33Å; Q124-H128 PolarHBondContact O-ND1 3.47Å
125	T	91.1	Very high	92.8	Very high	69 Å²	69	57.7 Å²	57.7	42%	0.423	28%	0.279	S	S	.	.	H	α-helix	trans	-71.8	-37.4	-178.9	49.7	0	0	0	0	112.4	R121 S122 K127 H128 S129	R121-T125 PolarHBondContact N-OG1 3.27Å; S122-T125 PolarHBondContact N-OG1 3.44Å; S122-T125 VanDerWaalsContact N-OG1 3.09Å; S122-T125 PolarHBondContact O-N 3.18Å; S122-T125 PolarHBondContact O-OG1 3.04Å; S122-T125 PolarHBondContact OG-N 3.25Å; S122-T125 VanDerWaalsContact OG-N 3.17Å; S122-T125 PolarHBondContact OG-OG1 3.09Å; T125-K127 PolarHBondContact O-N 3.4Å; T125-H128 PolarHBondContact O-N 3.39Å; T125-H128 VanDerWaalsContact O-N 3.16Å; T125-S129 PolarHBondContact O-N 3.11Å
126	S	94.4	Very high	92.8	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.2	-42.6	171	50.7	0	0	0	0	112.7	Y105 S107 G118 S122 K123 H128 M130	Y105-S126 WeakPolarHBondContact CB-OG 3.36Å; Y105-S126 VanDerWaalsContact O-CB 3.22Å; Y105-S126 WeakPolarHBondContact O-CB 3.45Å; S107-S126 PolarHBondContact OG-OG 3.26Å; G118-S126 WeakPolarHBondContact O-CB 3.26Å; S122-S126 PolarHBondContact O-N 3.48Å; S122-S126 VanDerWaalsContact O-N 3.09Å; S122-S126 PolarHBondContact O-OG 2.97Å; K123-S126 WeakPolarHBondContact CA-OG 3.32Å; K123-S126 PolarHBondContact O-OG 3.03Å; S126-H128 VanDerWaalsContact C-N 3.34Å; S126-H128 PolarHBondContact O-N 3.28Å; S126-M130 WeakPolarHBondContact O-CB 3.26Å; S126-M130 PolarHBondContact O-N 3.1Å
127	K	95.4	Very high	92.6	Very high	59 Å²	59	60.4 Å²	60.4	26%	0.257	29%	0.292	S	S	.	.	H	α-helix	trans	-60.1	-37.9	171.4	-84.6	-175.2	172.6	-155.9	0	113.7	F78 L92 I94 S107 K123 Q124 T125 A131	F78-K127 HydrophobicContact CD1-CD 4.34Å; F78-K127 HydrophobicContact CD2-CB 3.76Å; F78-K127 HydrophobicContact CD2-CD 4.27Å; F78-K127 HydrophobicContact CD2-CG 4.23Å; F78-K127 HydrophobicContact CE1-CD 3.92Å; F78-K127 HydrophobicContact CE2-CB 4.07Å; F78-K127 HydrophobicContact CE2-CD 3.86Å; F78-K127 HydrophobicContact CE2-CG 4.01Å; F78-K127 HydrophobicContact CG-CB 4.12Å; F78-K127 HydrophobicContact CZ-CD 3.67Å; F78-K127 HydrophobicContact CZ-CG 4.34Å; L92-K127 HydrophobicContact CD1-CG 4.29Å; L92-K127 HydrophobicContact CD2-CG 4.32Å; I94-K127 HydrophobicContact CD1-CD 4.44Å; I94-K127 VanDerWaalsContact CD1-CE 3.43Å; S107-K127 PolarHBondContact OG-N 3.29Å; K123-K127 WeakPolarHBondContact O-CB 3.41Å; K123-K127 VanDerWaalsContact O-CG 3.24Å; K123-K127 WeakPolarHBondContact O-CG 3.44Å; Q124-K127 WeakPolarHBondContact O-CB 3.44Å; Q124-K127 PolarHBondContact O-N 2.83Å; T125-K127 PolarHBondContact O-N 3.4Å; K127-A131 WeakPolarHBondContact O-CB 3.4Å; K127-A131 PolarHBondContact O-N 2.85Å
128	H	92.5	Very high	92.3	Very high	32 Å²	32	58 Å²	58	15%	0.148	28%	0.28	C	S	.	.	H	α-helix	trans	-71.9	-49.6	178.6	-76.4	63.2	0	0	0	110.9	T76 Q124 T125 S126 M130 A131 E132	T76-H128 WeakPolarHBondContact CB-NE2 3.3Å; T76-H128 PolarHBondContact OG1-NE2 3.42Å; Q124-H128 PolarHBondContact O-N 3.33Å; Q124-H128 PolarHBondContact O-ND1 3.47Å; T125-H128 PolarHBondContact O-N 3.39Å; T125-H128 VanDerWaalsContact O-N 3.16Å; S126-H128 VanDerWaalsContact C-N 3.34Å; S126-H128 PolarHBondContact O-N 3.28Å; H128-M130 VanDerWaalsContact C-N 3.26Å; H128-M130 PolarHBondContact O-N 3.17Å; H128-A131 CarbonylContact O-C 3.6Å; H128-A131 PolarHBondContact O-N 3.03Å; H128-E132 WeakPolarHBondContact O-CB 3.48Å; H128-E132 VanDerWaalsContact O-CD 3.29Å; H128-E132 WeakPolarHBondContact O-CG 3.26Å; H128-E132 PolarHBondContact O-N 2.82Å
129	S	92.9	Very high	92	Very high	35 Å²	35	59.1 Å²	59.1	25%	0.245	29%	0.286	C	S	.	.	H	α-helix	trans	-54.5	-39.1	174.3	169.1	0	0	0	0	113.3	G118 T125 E132 S133	G118-S129 WeakPolarHBondContact CA-OG 3.32Å; T125-S129 PolarHBondContact O-N 3.11Å; S129-E132 WeakPolarHBondContact CA-OE2 3.49Å; S129-S133 PolarHBondContact O-N 3.19Å; S129-S133 PolarHBondContact O-OG 3.5Å
130	M	95.8	Very high	91.6	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.8	-50.1	173.6	176.9	-74.5	-59.9	0	0	111	F78 F81 L92 V109 F116 S126 H128 E132 S133 V134	F78-M130 HydrophobicContact CD2-CE 4.22Å; F78-M130 HydrophobicContact CE2-CE 4.13Å; F81-M130 HydrophobicContact CD1-CE 4.09Å; F81-M130 HydrophobicContact CE1-CE 3.8Å; F81-M130 HydrophobicContact CE2-SD 4.33Å; F81-M130 HydrophobicContact CZ-CE 4.09Å; F81-M130 HydrophobicContact CZ-SD 4.25Å; L92-M130 HydrophobicContact CD1-CE 3.45Å; L92-M130 VanDerWaalsContact CD1-CE 3.45Å; L92-M130 HydrophobicContact CG-CE 4.33Å; V109-M130 HydrophobicContact CB-SD 4.29Å; V109-M130 HydrophobicContact CG1-CE 4.35Å; V109-M130 HydrophobicContact CG1-CG 3.99Å; V109-M130 HydrophobicContact CG1-SD 3.31Å; V109-M130 WeakPolarHBondContact CG1-SD 3.06Å; F116-M130 HydrophobicContact CB-CG 4.4Å; S126-M130 WeakPolarHBondContact O-CB 3.26Å; S126-M130 PolarHBondContact O-N 3.1Å; H128-M130 VanDerWaalsContact C-N 3.26Å; H128-M130 PolarHBondContact O-N 3.17Å; M130-E132 VanDerWaalsContact C-N 3.34Å; M130-E132 PolarHBondContact O-N 3.4Å; M130-S133 WeakPolarHBondContact O-CB 3.49Å; M130-S133 PolarHBondContact O-N 2.97Å; M130-S133 VanDerWaalsContact O-N 3.08Å; M130-V134 WeakPolarHBondContact O-CG2 3.4Å; M130-V134 PolarHBondContact O-N 3.22Å; M130-V134 HydrophobicContact SD-CG2 3.71Å
131	A	94.9	Very high	91	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-65.5	-36.2	-178.2	0	0	0	0	0	112.8	P77 F78 F81 K127 H128 S133 V134 L135	P77-A131 HydrophobicContact CB-CB 4.38Å; F78-A131 HydrophobicContact CB-CB 4.23Å; F78-A131 HydrophobicContact CD2-CB 4.18Å; F81-A131 HydrophobicContact CB-CB 3.66Å; F81-A131 HydrophobicContact CD1-CB 4.4Å; F81-A131 HydrophobicContact CG-CB 4Å; K127-A131 WeakPolarHBondContact O-CB 3.4Å; K127-A131 PolarHBondContact O-N 2.85Å; H128-A131 CarbonylContact O-C 3.6Å; H128-A131 PolarHBondContact O-N 3.03Å; A131-S133 VanDerWaalsContact C-N 3.31Å; A131-S133 PolarHBondContact O-N 2.88Å; A131-V134 PolarHBondContact O-N 3.39Å; A131-L135 VanDerWaalsContact O-CB 3.3Å; A131-L135 WeakPolarHBondContact O-CB 3.45Å; A131-L135 VanDerWaalsContact O-CG 3.23Å; A131-L135 WeakPolarHBondContact O-CG 3.43Å; A131-L135 PolarHBondContact O-N 2.8Å
132	E	93.4	Very high	90.7	Very high	72 Å²	72	50.7 Å²	50.7	34%	0.336	26%	0.263	S	S	.	.	H	α-helix	trans	-57.3	-44.7	170.1	-71.7	154.6	-157.2	0	0	110.6	P77 H128 S129 M130 L135 A136 F143	P77-E132 HydrophobicContact CB-CG 3.8Å; P77-E132 HydrophobicContact CG-CG 3.92Å; H128-E132 WeakPolarHBondContact O-CB 3.48Å; H128-E132 VanDerWaalsContact O-CD 3.29Å; H128-E132 WeakPolarHBondContact O-CG 3.26Å; H128-E132 PolarHBondContact O-N 2.82Å; S129-E132 WeakPolarHBondContact CA-OE2 3.49Å; M130-E132 VanDerWaalsContact C-N 3.34Å; M130-E132 PolarHBondContact O-N 3.4Å; E132-L135 PolarHBondContact O-N 2.92Å; E132-A136 WeakPolarHBondContact O-CB 3.48Å; E132-A136 PolarHBondContact O-N 3.42Å; E132-F143 HydrophobicContact CB-CE2 3.8Å; E132-F143 HydrophobicContact CB-CZ 3.85Å; E132-F143 HydrophobicContact CG-CE2 3.82Å; E132-F143 HydrophobicContact CG-CZ 4.17Å
133	S	92.6	Very high	90.4	Very high	49 Å²	49	50.2 Å²	50.2	34%	0.343	26%	0.256	S	S	.	.	H	α-helix	trans	-65	-42.8	177.4	-55.5	0	0	0	0	112.8	S129 M130 A131 R137	S129-S133 PolarHBondContact O-N 3.19Å; S129-S133 PolarHBondContact O-OG 3.5Å; M130-S133 WeakPolarHBondContact O-CB 3.49Å; M130-S133 PolarHBondContact O-N 2.97Å; M130-S133 VanDerWaalsContact O-N 3.08Å; A131-S133 VanDerWaalsContact C-N 3.31Å; A131-S133 PolarHBondContact O-N 2.88Å; S133-R137 WeakPolarHBondContact O-CB 3.43Å; S133-R137 PolarHBondContact O-N 3.05Å
134	V	93	Very high	89.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.7	-46.9	175.5	177.9	0	0	0	0	111.1	F81 F85 V109 V111 F116 M130 A131 R137 F138	F81-V134 HydrophobicContact CD2-CB 4.06Å; F81-V134 HydrophobicContact CD2-CG1 3.8Å; F81-V134 HydrophobicContact CD2-CG2 4.26Å; F81-V134 HydrophobicContact CE2-CB 4.33Å; F81-V134 HydrophobicContact CE2-CG1 3.98Å; F81-V134 HydrophobicContact CE2-CG2 4.09Å; F85-V134 HydrophobicContact CD2-CG1 3.91Å; F85-V134 HydrophobicContact CE2-CG1 3.65Å; F85-V134 HydrophobicContact CZ-CG1 4.25Å; V109-V134 HydrophobicContact CG1-CG2 4.19Å; V111-V134 HydrophobicContact CB-CG1 4.48Å; V111-V134 HydrophobicContact CG1-CG1 4.25Å; V111-V134 HydrophobicContact CG2-CG1 4.02Å; V111-V134 HydrophobicContact CG2-CG2 4.17Å; F116-V134 HydrophobicContact CB-CG2 3.6Å; F116-V134 HydrophobicContact CD1-CG2 3.95Å; F116-V134 HydrophobicContact CD2-CG2 3.83Å; F116-V134 HydrophobicContact CG-CB 4.5Å; F116-V134 HydrophobicContact CG-CG2 3.48Å; F116-V134 VanDerWaalsContact CG-CG2 3.48Å; M130-V134 WeakPolarHBondContact O-CG2 3.4Å; M130-V134 PolarHBondContact O-N 3.22Å; M130-V134 HydrophobicContact SD-CG2 3.71Å; A131-V134 PolarHBondContact O-N 3.39Å; V134-R137 PolarHBondContact O-N 3.2Å; V134-F138 HydrophobicContact CG1-CD2 3.86Å; V134-F138 HydrophobicContact CG1-CE2 4.29Å; V134-F138 WeakPolarHBondContact O-CD2 3.4Å; V134-F138 PolarHBondContact O-N 3.39Å
135	L	93.1	Very high	89.1	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-69.4	-36.7	-178	-69.8	173.6	0	0	0	111.9	P77 Y80 A131 E132 R137 L139 F143 L146	P77-L135 HydrophobicContact CB-CD1 4.12Å; P77-L135 WeakPolarHBondContact O-CD1 3.29Å; Y80-L135 HydrophobicContact CD1-CD1 3.98Å; Y80-L135 HydrophobicContact CD1-CD2 3.66Å; Y80-L135 HydrophobicContact CD1-CG 4.5Å; Y80-L135 HydrophobicContact CE1-CD2 4.06Å; A131-L135 VanDerWaalsContact O-CB 3.3Å; A131-L135 WeakPolarHBondContact O-CB 3.45Å; A131-L135 VanDerWaalsContact O-CG 3.23Å; A131-L135 WeakPolarHBondContact O-CG 3.43Å; A131-L135 PolarHBondContact O-N 2.8Å; E132-L135 PolarHBondContact O-N 2.92Å; L135-R137 VanDerWaalsContact C-N 3.26Å; L135-R137 PolarHBondContact O-N 3.03Å; L135-L139 HydrophobicContact CD2-CB 4.3Å; L135-L139 HydrophobicContact CD2-CD1 4.03Å; L135-L139 CarbonylContact O-C 3.56Å; L135-L139 VanDerWaalsContact O-CA 3.3Å; L135-L139 WeakPolarHBondContact O-CA 3.43Å; L135-L139 PolarHBondContact O-N 3.17Å; L135-F143 HydrophobicContact CB-CB 4.12Å; L135-F143 HydrophobicContact CB-CD2 3.92Å; L135-F143 HydrophobicContact CB-CG 4.22Å; L135-L146 HydrophobicContact CD1-CD1 3.96Å
136	A	90.6	Very high	88.4	Confident	45 Å²	45	42.8 Å²	42.8	37%	0.372	22%	0.216	S	C	.	.	H	α-helix	trans	-61	-35	171.6	0	0	0	0	0	112.6	E132 F143	E132-A136 WeakPolarHBondContact O-CB 3.48Å; E132-A136 PolarHBondContact O-N 3.42Å; A136-F143 HydrophobicContact CB-CD1 3.62Å; A136-F143 HydrophobicContact CB-CE1 3.69Å; A136-F143 HydrophobicContact CB-CG 4.35Å; A136-F143 HydrophobicContact CB-CZ 4.48Å
137	R	91.1	Very high	87.2	Confident	146 Å²	146	45.4 Å²	45.4	55%	0.551	23%	0.23	S	C	*	.	H	α-helix	trans	-76	-49.6	-179.7	-179.3	62.4	168.3	148.6	-3.2	113.2	E114 F116 S133 V134 L135	E114-R137 IonicContact OE1-CZ 2.63Å; E114-R137 IonicContact OE1-NE 3.07Å; E114-R137 IonicContact OE1-NH2 2.88Å; E114-R137 PolarHBondContact OE1-NH2 3.07Å; E114-R137 IonicContact OE2-CZ 3.26Å; E114-R137 IonicContact OE2-NE 2.78Å; E114-R137 PolarHBondContact OE2-NE 3.25Å; E114-R137 IonicContact OE2-NH2 2.85Å; E114-R137 PolarHBondContact OE2-NH2 3.17Å; F116-R137 HydrophobicContact CE1-CB 3.82Å; F116-R137 HydrophobicContact CE1-CG 3.88Å; F116-R137 HydrophobicContact CZ-CB 4.19Å; F116-R137 HydrophobicContact CZ-CG 3.82Å; S133-R137 WeakPolarHBondContact O-CB 3.43Å; S133-R137 PolarHBondContact O-N 3.05Å; V134-R137 PolarHBondContact O-N 3.2Å; L135-R137 VanDerWaalsContact C-N 3.26Å; L135-R137 PolarHBondContact O-N 3.03Å
138	F	87.6	Confident	85.8	Confident	51 Å²	51	50.1 Å²	50.1	22%	0.224	25%	0.246	C	C	.	.	H	α-helix	trans	-105.7	-21.4	-170.3	-60.5	-71.7	0	0	0	115.1	F85 V111 M112 F116 V134 P140	F85-F138 HydrophobicContact CZ-CB 3.85Å; F85-F138 HydrophobicContact CZ-CD2 4.09Å; F85-F138 HydrophobicContact CZ-CG 4.17Å; V111-F138 HydrophobicContact CB-CE2 3.88Å; V111-F138 HydrophobicContact CB-CZ 4.44Å; V111-F138 HydrophobicContact CG1-CD2 3.9Å; V111-F138 HydrophobicContact CG1-CE2 3.45Å; V111-F138 VanDerWaalsContact CG1-CE2 3.45Å; V111-F138 HydrophobicContact CG1-CZ 4.03Å; M112-F138 HydrophobicContact CB-CE1 4.22Å; M112-F138 HydrophobicContact CB-CZ 4.18Å; M112-F138 HydrophobicContact CG-CE1 4.24Å; M112-F138 HydrophobicContact CG-CZ 4.39Å; F116-F138 HydrophobicContact CE1-CE2 4.32Å; F116-F138 AromaticContact CE2-CE2 3.54Å; F116-F138 HydrophobicContact CE2-CE2 3.54Å; F116-F138 AromaticContact CE2-CZ 3.99Å; F116-F138 HydrophobicContact CE2-CZ 3.99Å; F116-F138 HydrophobicContact CZ-CD2 4.39Å; F116-F138 AromaticContact CZ-CE2 3.39Å; F116-F138 HydrophobicContact CZ-CE2 3.39Å; F116-F138 AromaticContact CZ-CZ 3.8Å; F116-F138 HydrophobicContact CZ-CZ 3.8Å; V134-F138 HydrophobicContact CG1-CD2 3.86Å; V134-F138 HydrophobicContact CG1-CE2 4.29Å; V134-F138 WeakPolarHBondContact O-CD2 3.4Å; V134-F138 PolarHBondContact O-N 3.39Å; F138-P140 VanDerWaalsContact C-CD 3.48Å
139	L	87.8	Confident	84.1	Confident	24 Å²	24	50.4 Å²	50.4	13%	0.126	25%	0.25	C	C	.	.			trans	-134.3	53.2	179.7	-69.2	-180	0	0	0	112.1	F57 Y80 V84 L135 D141 D142 F143	F57-L139 HydrophobicContact CE1-CD2 4.47Å; F57-L139 HydrophobicContact CZ-CD2 3.89Å; Y80-L139 HydrophobicContact CE1-CD1 3.74Å; V84-L139 HydrophobicContact CB-CD1 4.31Å; V84-L139 HydrophobicContact CG1-CD1 3.72Å; V84-L139 HydrophobicContact CG2-CD1 3.79Å; L135-L139 HydrophobicContact CD2-CB 4.3Å; L135-L139 HydrophobicContact CD2-CD1 4.03Å; L135-L139 CarbonylContact O-C 3.56Å; L135-L139 VanDerWaalsContact O-CA 3.3Å; L135-L139 WeakPolarHBondContact O-CA 3.43Å; L135-L139 PolarHBondContact O-N 3.17Å; L139-D141 PolarHBondContact O-N 2.99Å; L139-D142 HydrophobicContact CB-CB 4.26Å; L139-D142 PolarHBondContact O-N 3.28Å; L139-D142 VanDerWaalsContact O-N 3.11Å; L139-F143 PolarHBondContact O-N 2.97Å
140	P	83.9	Confident	82.1	Confident	54 Å²	54	51.8 Å²	51.8	35%	0.351	26%	0.26	S	S	.	.	H	α-helix	trans	-57.4	-30.1	-169.6	21.5	-34.1	0	0	0	114.3	F138 K144	F138-P140 VanDerWaalsContact C-CD 3.48Å; P140-K144 WeakPolarHBondContact O-CB 3.42Å; P140-K144 WeakPolarHBondContact O-CD 3.39Å; P140-K144 WeakPolarHBondContact O-CE 3.33Å; P140-K144 WeakPolarHBondContact O-CG 3.32Å; P140-K144 PolarHBondContact O-N 3.28Å
141	D	79.1	Confident	79.8	Confident	110 Å²	110	56.6 Å²	56.6	59%	0.588	29%	0.285	S	S	*	.	H	α-helix	trans	-82.6	-31.7	-179.9	-65.7	-39.3	0	0	0	113.8	L139 F143 K144 F145	L139-D141 PolarHBondContact O-N 2.99Å; D141-F143 VanDerWaalsContact C-N 3.33Å; D141-K144 IonicContact OD1-NZ 2.67Å; D141-K144 PolarHBondContact OD1-NZ 2.96Å; D141-F145 PolarHBondContact O-N 2.86Å; D141-F145 VanDerWaalsContact O-N 3.16Å
142	D	81.4	Confident	77.5	Confident	20 Å²	20	62.6 Å²	62.6	11%	0.107	31%	0.314	C	S	.	.	H	α-helix	trans	-70.9	-35	168.7	-65.8	-30.5	0	0	0	110.5	K68 L72 Y80 L139 F145 L146	K68-D142 VanDerWaalsContact CE-OD1 3.31Å; K68-D142 WeakPolarHBondContact CE-OD1 3.31Å; K68-D142 WeakPolarHBondContact CE-OD2 3.41Å; K68-D142 IonicContact NZ-OD1 3.97Å; K68-D142 PolarHBondContact NZ-OD1 3.41Å; K68-D142 IonicContact NZ-OD2 3.63Å; K68-D142 PolarHBondContact NZ-OD2 3.18Å; L72-D142 HydrophobicContact CD1-CB 4.3Å; L72-D142 HydrophobicContact CD2-CB 4.29Å; Y80-D142 HydrophobicContact CE1-CB 3.68Å; Y80-D142 PolarHBondContact OH-OD2 3.13Å; L139-D142 HydrophobicContact CB-CB 4.26Å; L139-D142 PolarHBondContact O-N 3.28Å; L139-D142 VanDerWaalsContact O-N 3.11Å; D142-F145 WeakPolarHBondContact O-CB 3.49Å; D142-F145 PolarHBondContact O-N 3.25Å; D142-L146 PolarHBondContact O-N 3.28Å
143	F	83.6	Confident	75	Confident	34 Å²	34	62.7 Å²	62.7	15%	0.149	33%	0.326	C	S	.	.	H	α-helix	trans	-65.3	-46.4	175.1	-175.2	-120.6	0	0	0	112.4	E132 L135 A136 L139 D141 F145 L146 N147	E132-F143 HydrophobicContact CB-CE2 3.8Å; E132-F143 HydrophobicContact CB-CZ 3.85Å; E132-F143 HydrophobicContact CG-CE2 3.82Å; E132-F143 HydrophobicContact CG-CZ 4.17Å; L135-F143 HydrophobicContact CB-CB 4.12Å; L135-F143 HydrophobicContact CB-CD2 3.92Å; L135-F143 HydrophobicContact CB-CG 4.22Å; A136-F143 HydrophobicContact CB-CD1 3.62Å; A136-F143 HydrophobicContact CB-CE1 3.69Å; A136-F143 HydrophobicContact CB-CG 4.35Å; A136-F143 HydrophobicContact CB-CZ 4.48Å; L139-F143 PolarHBondContact O-N 2.97Å; D141-F143 VanDerWaalsContact C-N 3.33Å; F143-F145 PolarHBondContact O-N 3.15Å; F143-L146 PolarHBondContact O-N 3.17Å; F143-N147 WeakPolarHBondContact CE1-ND2 3.47Å; F143-N147 WeakPolarHBondContact CE2-OD1 3.45Å; F143-N147 WeakPolarHBondContact CZ-ND2 3.41Å; F143-N147 PolarHBondContact O-N 2.93Å; F143-N147 PolarHBondContact O-OD1 2.83Å
144	K	81.1	Confident	72.3	Confident	108 Å²	108	65.1 Å²	65.1	47%	0.47	34%	0.339	S	S	.	.	H	α-helix	trans	-55.6	-34.6	169.8	-73	164	-154	164.4	0	112	P140 D141 R148	P140-K144 WeakPolarHBondContact O-CB 3.42Å; P140-K144 WeakPolarHBondContact O-CD 3.39Å; P140-K144 WeakPolarHBondContact O-CE 3.33Å; P140-K144 WeakPolarHBondContact O-CG 3.32Å; P140-K144 PolarHBondContact O-N 3.28Å; D141-K144 IonicContact OD1-NZ 2.67Å; D141-K144 PolarHBondContact OD1-NZ 2.96Å; K144-R148 VanDerWaalsContact O-CG 3.28Å; K144-R148 WeakPolarHBondContact O-CG 3.41Å; K144-R148 PolarHBondContact O-N 2.89Å
145	F	76.8	Confident	69.7	Low	50 Å²	50	68.3 Å²	68.3	22%	0.219	37%	0.366	C	S	.	.	H	α-helix	trans	-74.1	-43.3	178.1	-169.1	-95.4	0	0	0	112.5	R69 L72 A73 D141 D142 F143 N147 R148 V149	R69-F145 HydrophobicContact CB-CE1 3.82Å; R69-F145 HydrophobicContact CB-CE2 4.06Å; R69-F145 HydrophobicContact CB-CZ 3.52Å; R69-F145 HydrophobicContact CG-CD1 4.37Å; R69-F145 HydrophobicContact CG-CD2 4.02Å; R69-F145 HydrophobicContact CG-CE1 3.99Å; R69-F145 HydrophobicContact CG-CE2 3.6Å; R69-F145 HydrophobicContact CG-CG 4.4Å; R69-F145 HydrophobicContact CG-CZ 3.59Å; R69-F145 WeakPolarHBondContact O-CE1 3.35Å; L72-F145 HydrophobicContact CB-CD1 3.85Å; L72-F145 HydrophobicContact CB-CE1 4.11Å; L72-F145 HydrophobicContact CD1-CD1 4.34Å; A73-F145 HydrophobicContact CB-CE1 4.47Å; D141-F145 PolarHBondContact O-N 2.86Å; D141-F145 VanDerWaalsContact O-N 3.16Å; D142-F145 WeakPolarHBondContact O-CB 3.49Å; D142-F145 PolarHBondContact O-N 3.25Å; F143-F145 PolarHBondContact O-N 3.15Å; F145-N147 PolarHBondContact O-N 2.83Å; F145-R148 PolarHBondContact O-N 2.95Å; F145-V149 HydrophobicContact CD1-CG2 4.3Å; F145-V149 HydrophobicContact CE1-CG2 3.77Å; F145-V149 HydrophobicContact CZ-CG2 3.92Å; F145-V149 WeakPolarHBondContact O-CG2 3.31Å; F145-V149 PolarHBondContact O-N 3.04Å
146	L	75.2	Confident	66.9	Low	10 Å²	10	71.9 Å²	71.9	5%	0.052	40%	0.395	C	S	.	.	H	α-helix	trans	-55.7	-49.9	173.7	-77.9	164.2	0	0	0	111.5	L72 K75 Y80 L135 D142 F143 R148 V149 S150	L72-L146 HydrophobicContact CD2-CD1 4.06Å; L72-L146 HydrophobicContact CD2-CD2 3.96Å; L72-L146 HydrophobicContact CD2-CG 3.82Å; K75-L146 VanDerWaalsContact O-CD2 3.29Å; K75-L146 WeakPolarHBondContact O-CD2 3.41Å; Y80-L146 HydrophobicContact CD1-CD1 3.89Å; Y80-L146 HydrophobicContact CG-CD1 4.37Å; L135-L146 HydrophobicContact CD1-CD1 3.96Å; D142-L146 PolarHBondContact O-N 3.28Å; F143-L146 PolarHBondContact O-N 3.17Å; L146-R148 PolarHBondContact O-N 2.64Å; L146-V149 PolarHBondContact O-N 3.45Å; L146-S150 PolarHBondContact O-N 3.37Å; L146-S150 PolarHBondContact O-OG 2.7Å
147	N	70.4	Confident	64.1	Low	55 Å²	55	74.4 Å²	74.4	29%	0.294	41%	0.41	S	S	.	.	H	α-helix	trans	-66.4	-38.7	-176.2	-65.1	2.1	0	0	0	112.3	F143 F145 V149 S150 D151	F143-N147 WeakPolarHBondContact CE1-ND2 3.47Å; F143-N147 WeakPolarHBondContact CE2-OD1 3.45Å; F143-N147 WeakPolarHBondContact CZ-ND2 3.41Å; F143-N147 PolarHBondContact O-N 2.93Å; F143-N147 PolarHBondContact O-OD1 2.83Å; F145-N147 PolarHBondContact O-N 2.83Å; N147-V149 VanDerWaalsContact C-N 3.32Å; N147-V149 PolarHBondContact O-N 2.9Å; N147-S150 WeakPolarHBondContact CA-OG 3.49Å; N147-S150 PolarHBondContact O-N 3.14Å; N147-S150 PolarHBondContact O-OG 3.24Å; N147-D151 VanDerWaalsContact O-CG 3.28Å; N147-D151 PolarHBondContact O-N 3.38Å
148	R	64.7	Low	61.2	Low	157 Å²	157	74.1 Å²	74.1	59%	0.592	42%	0.42	S	S	*	.	H	α-helix	trans	-61.4	-39.1	174.7	-76.6	176.6	-174.5	-171.2	1.5	112.6	K144 F145 L146 S150 D151 E152	K144-R148 VanDerWaalsContact O-CG 3.28Å; K144-R148 WeakPolarHBondContact O-CG 3.41Å; K144-R148 PolarHBondContact O-N 2.89Å; F145-R148 PolarHBondContact O-N 2.95Å; L146-R148 PolarHBondContact O-N 2.64Å; R148-S150 VanDerWaalsContact C-N 3.35Å; R148-D151 PolarHBondContact O-N 2.94Å; R148-E152 VanDerWaalsContact O-CB 3.27Å; R148-E152 WeakPolarHBondContact O-CB 3.46Å; R148-E152 VanDerWaalsContact O-CG 3.27Å; R148-E152 WeakPolarHBondContact O-CG 3.37Å; R148-E152 PolarHBondContact O-N 2.94Å
149	V	57.8	Low	58.5	Low	38 Å²	38	77.9 Å²	77.9	23%	0.23	45%	0.447	C	S	.	.	H	α-helix	trans	-67.7	-34.7	177.6	175.4	0	0	0	0	111.6	A73 F145 L146 N147 A153	A73-V149 HydrophobicContact CB-CG1 3.96Å; A73-V149 HydrophobicContact CB-CG2 4.08Å; F145-V149 HydrophobicContact CD1-CG2 4.3Å; F145-V149 HydrophobicContact CE1-CG2 3.77Å; F145-V149 HydrophobicContact CZ-CG2 3.92Å; F145-V149 WeakPolarHBondContact O-CG2 3.31Å; F145-V149 PolarHBondContact O-N 3.04Å; L146-V149 PolarHBondContact O-N 3.45Å; N147-V149 VanDerWaalsContact C-N 3.32Å; N147-V149 PolarHBondContact O-N 2.9Å; V149-A153 VanDerWaalsContact O-CB 3.29Å; V149-A153 WeakPolarHBondContact O-CB 3.46Å; V149-A153 PolarHBondContact O-N 3.42Å; V149-A153 VanDerWaalsContact O-N 3.16Å
150	S	51.5	Low	55.5	Low	64 Å²	64	82.6 Å²	82.6	45%	0.448	48%	0.476	S	S	.	.	H	α-helix	trans	-68.4	-42.5	171.3	42.5	0	0	0	0	112.8	L146 N147 R148 A153 T154	L146-S150 PolarHBondContact O-N 3.37Å; L146-S150 PolarHBondContact O-OG 2.7Å; N147-S150 WeakPolarHBondContact CA-OG 3.49Å; N147-S150 PolarHBondContact O-N 3.14Å; N147-S150 PolarHBondContact O-OG 3.24Å; R148-S150 VanDerWaalsContact C-N 3.35Å; S150-A153 PolarHBondContact O-N 3.1Å; S150-T154 PolarHBondContact O-N 3.41Å; S150-T154 PolarHBondContact O-OG1 2.86Å
151	D	47.3	Very low	52.9	Low	101 Å²	101	86.2 Å²	86.2	54%	0.54	50%	0.498	S	S	.	.	H	α-helix	trans	-66.8	-44.6	-179.5	-66.9	-23.5	0	0	0	111.5	N147 R148 A153 T154 A155	N147-D151 VanDerWaalsContact O-CG 3.28Å; N147-D151 PolarHBondContact O-N 3.38Å; R148-D151 PolarHBondContact O-N 2.94Å; D151-A153 VanDerWaalsContact C-N 3.31Å; D151-A153 PolarHBondContact O-N 3.45Å; D151-T154 PolarHBondContact O-N 2.96Å; D151-T154 PolarHBondContact O-OG1 3.36Å; D151-A155 WeakPolarHBondContact O-CB 3.47Å; D151-A155 PolarHBondContact O-N 2.97Å
152	E	46.2	Very low	50.4	Low	127 Å²	127	86.1 Å²	86.1	59%	0.593	51%	0.506	S	S	*	.	H	α-helix	trans	-62.3	-36.3	175.8	-73.6	170.9	-168.9	0	0	111.7	R148 A155 A156	R148-E152 VanDerWaalsContact O-CB 3.27Å; R148-E152 WeakPolarHBondContact O-CB 3.46Å; R148-E152 VanDerWaalsContact O-CG 3.27Å; R148-E152 WeakPolarHBondContact O-CG 3.37Å; R148-E152 PolarHBondContact O-N 2.94Å; E152-A155 PolarHBondContact O-N 3.02Å; E152-A156 VanDerWaalsContact O-CB 3.24Å; E152-A156 WeakPolarHBondContact O-CB 3.14Å; E152-A156 PolarHBondContact O-N 2.96Å
153	A	41.3	Very low	47.9	Very low	73 Å²	73	89.5 Å²	89.5	60%	0.603	54%	0.536	S	S	*	.	H	α-helix	trans	-66.7	-33.8	175.4	0	0	0	0	0	113.3	V149 S150 D151	V149-A153 VanDerWaalsContact O-CB 3.29Å; V149-A153 WeakPolarHBondContact O-CB 3.46Å; V149-A153 PolarHBondContact O-N 3.42Å; V149-A153 VanDerWaalsContact O-N 3.16Å; S150-A153 PolarHBondContact O-N 3.1Å; D151-A153 VanDerWaalsContact C-N 3.31Å; D151-A153 PolarHBondContact O-N 3.45Å
154	T	35.8	Very low	45.3	Very low	100 Å²	100	93.9 Å²	93.9	61%	0.613	56%	0.561	S	S	*	*	H	α-helix	trans	-79.2	-34.5	171.8	37.4	0	0	0	0	113.5	S150 D151	S150-T154 PolarHBondContact O-N 3.41Å; S150-T154 PolarHBondContact O-OG1 2.86Å; D151-T154 PolarHBondContact O-N 2.96Å; D151-T154 PolarHBondContact O-OG1 3.36Å
155	A	37.3	Very low	42.9	Very low	67 Å²	67	96 Å²	96	55%	0.554	57%	0.573	S	S	*	*	H	α-helix	trans	-70.2	-36.4	178.7	0	0	0	0	0	112.6	D151 E152 S157 N158	D151-A155 WeakPolarHBondContact O-CB 3.47Å; D151-A155 PolarHBondContact O-N 2.97Å; E152-A155 PolarHBondContact O-N 3.02Å; A155-S157 PolarHBondContact O-N 3.25Å; A155-S157 VanDerWaalsContact O-N 3.14Å; A155-N158 PolarHBondContact O-N 3.01Å
156	A	34.4	Very low	40.9	Very low	76 Å²	76	103.5 Å²	103.5	63%	0.628	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-66.4	-11.3	-179.1	0	0	0	0	0	114.6	E152 N158	E152-A156 VanDerWaalsContact O-CB 3.24Å; E152-A156 WeakPolarHBondContact O-CB 3.14Å; E152-A156 PolarHBondContact O-N 2.96Å; A156-N158 PolarHBondContact O-N 3.13Å
157	S	32.3	Very low	38.9	Very low	98 Å²	98	107.6 Å²	107.6	69%	0.685	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-71.8	-7.5	178.9	-169.4	0	0	0	0	114.4	A155	A155-S157 PolarHBondContact O-N 3.25Å; A155-S157 VanDerWaalsContact O-N 3.14Å
158	N	29	Very low	37.2	Very low	140 Å²	140	109.3 Å²	109.3	75%	0.749	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-123.8	24	-166.3	-75.2	-24.5	0	0	0	115.4	A155 A156	A155-N158 PolarHBondContact O-N 3.01Å; A156-N158 PolarHBondContact O-N 3.13Å
159	V	30.8	Very low	35.6	Very low	130 Å²	130	110 Å²	110	79%	0.788	66%	0.661	S	S	*	*			trans	-131.4	129.4	170.3	-177.3	0	0	0	0	111.2
160	T	26.6	Very low	34.4	Very low	122 Å²	122	116.5 Å²	116.5	75%	0.748	69%	0.689	S	S	*	*			trans	-96.1	159.3	-177	45.7	0	0	0	0	114
161	T	27.6	Very low	33.4	Very low	130 Å²	130	119.1 Å²	119.1	80%	0.798	70%	0.703	S	S	*	*			trans	78.9	145	150.9	31.2	0	0	0	0	122.3
162	S	28.4	Very low	32.5	Very low	108 Å²	108	121 Å²	121	76%	0.755	71%	0.712	S	S	*	*			trans	72.6	93	154	54.4	0	0	0	0	122.4
163	A	28.3	Very low	31.9	Very low	91 Å²	91	122.6 Å²	122.6	75%	0.752	72%	0.724	S	S	*	*				84	149.2	101.1	0	0	0	0	0	123.3
164	N	28.7	Very low	31.3	Very low	126 Å²	126	127.1 Å²	127.1	67%	0.674	73%	0.733	S	S	*	*			trans	71.4	112.8	161.1	-72	45.6	0	0	0	122.7
165	E	31.4	Very low	31.2	Very low	154 Å²	154	129.4 Å²	129.4	72%	0.72	75%	0.746	S	S	*	*				47	128.4	116.3	-58.2	172.5	153.3	0	0	120.8
166	F	34.5	Very low	30.9	Very low	206 Å²	206	134.3 Å²	134.3	90%	0.904	76%	0.758	S	S	*	*				-159.7	170.6	100.6	-123.3	-96.3	0	0	0	111.7
167	S	32	Very low	30.9	Very low	97 Å²	97	140.1 Å²	140.1	68%	0.678	77%	0.772	S	S	*	*			trans	-130.7	157.3	-167.7	170.5	0	0	0	0	112.4
168	S	35	Very low	30.7	Very low	91 Å²	91	141.3 Å²	141.3	64%	0.636	78%	0.78	S	S	*	*				159.2	130.1	123.1	-71.4	0	0	0	0	117.5
169	Q	31.1	Very low	30.7	Very low	170 Å²	170	138.2 Å²	138.2	79%	0.794	78%	0.782	S	S	*	*				54.1	124.5	129.3	-55.9	174.4	-4.8	0	0	123.2
170	Q	33.4	Very low	30.5	Very low	175 Å²	175	139.9 Å²	139.9	82%	0.818	79%	0.786	S	S	*	*				177.7	125.3	102	-91.3	-179.7	-5.4	0	0	109.5
171	T	29.5	Very low	30.7	Very low	120 Å²	120	143.5 Å²	143.5	74%	0.736	79%	0.794	S	S	*	*				77.1	99	71	-55.8	0	0	0	0	111.2
172	L	28.2	Very low	30.7	Very low	139 Å²	139	146 Å²	146	73%	0.728	80%	0.797	S	S	*	*				99.6	130.7	59.2	175.7	139.8	0	0	0	112.1
173	L	34.9	Very low	30.8	Very low	161 Å²	161	150.2 Å²	150.2	84%	0.843	81%	0.805	S	S	*	*			trans	-177.3	149.8	140.2	-102.4	168.9	0	0	0	112.4
174	E	27.8	Very low	30.8	Very low	169 Å²	169	151.4 Å²	151.4	79%	0.79	80%	0.803	S	S	*	*			trans	-114.4	156.8	178.9	-61.2	160.3	124	0	0	110.4
175	V	35	Very low	30.9	Very low	147 Å²	147	154.2 Å²	154.2	89%	0.891	82%	0.817	S	S	*	*			trans	-143.3	113.5	159.4	-179.3	0	0	0	0	109.5
176	E	29.1	Very low	30.7	Very low	170 Å²	170	152.2 Å²	152.2	79%	0.794	82%	0.815	S	S	*	*			trans	-82.8	148.7	159.2	-56.3	179.6	119.5	0	0	109.7
177	Q	35.8	Very low	30.4	Very low	198 Å²	198	147.2 Å²	147.2	93%	0.925	81%	0.806	S	S	*	*				-175	166.5	123.1	-101.7	164.7	34.6	0	0	113.1
178	S	27.3	Very low	30.3	Very low	124 Å²	124	151.6 Å²	151.6	87%	0.867	81%	0.813	S	S	*	*			trans	-100.4	158.3	-167.6	50.5	0	0	0	0	113.5
179	G	29.4	Very low	30	Very low	75 Å²	75	153.6 Å²	153.6	77%	0.773	82%	0.816	S	S	*	*			trans	-168.2	120.3	169.6	0	0	0	0	0	111.4
180	N	26.2	Very low	30	Very low	164 Å²	164	155.7 Å²	155.7	88%	0.877	82%	0.823	S	S	*	*			trans	-79.2	147.9	165.9	-70.2	-35.1	0	0	0	109.1
181	E	32.1	Very low	30	Very low	198 Å²	198	155.5 Å²	155.5	93%	0.925	82%	0.819	S	S	*	*				-163.7	166.1	111.9	-109.5	169	-168.6	0	0	111.9
182	Q	27	Very low	30.3	Very low	182 Å²	182	154.3 Å²	154.3	85%	0.85	82%	0.815	S	S	*	*			trans	-93.3	140	-177.6	-60.3	167.3	-105.4	0	0	110
183	E	31	Very low	31	Very low	197 Å²	197	151.7 Å²	151.7	92%	0.921	80%	0.801	S	S	*	*			trans	-141.7	139.2	143.8	-138.4	172.7	-149.1	0	0	112.3
184	T	26.8	Very low	31.6	Very low	117 Å²	117	149.7 Å²	149.7	72%	0.718	79%	0.791	S	S	*	*			trans	-94.7	120.2	-170.5	47.4	0	0	0	0	111.7
185	L	31.5	Very low	32.4	Very low	184 Å²	184	142.6 Å²	142.6	96%	0.963	76%	0.759	S	S	*	*			trans	-112.5	126.1	161.6	-88.4	167.3	0	0	0	111
186	T	27.8	Very low	32.8	Very low	113 Å²	113	140.3 Å²	140.3	69%	0.693	75%	0.745	S	S	*	*			trans	-108.4	134.7	-162.6	52.7	0	0	0	0	114.1
187	S	28.6	Very low	33.4	Very low	100 Å²	100	138.3 Å²	138.3	70%	0.699	75%	0.75	S	S	*	*			trans	78	149.3	147.8	82.3	0	0	0	0	120.1
188	K	28.3	Very low	34.1	Very low	190 Å²	190	131.5 Å²	131.5	83%	0.826	73%	0.734	S	S	*	*			trans	82.1	150.3	168.3	-58.4	178.7	-177.7	177.3	0	117.4
189	D	29.3	Very low	35.5	Very low	133 Å²	133	126.1 Å²	126.1	71%	0.711	70%	0.695	S	S	*	*			trans	57.5	54.6	170.8	-66.7	22.3	0	0	0	119.3	K191	D189-K191 PolarHBondContact O-N 3.5Å
190	K	30.9	Very low	36.8	Very low	214 Å²	214	122.6 Å²	122.6	93%	0.93	66%	0.659	S	S	*	*			trans	-67.6	76.9	151.6	-75.7	-170.6	177	-177.2	0	111.1	C192	K190-C192 PolarHBondContact O-N 3.23Å
191	K	33.5	Very low	38.6	Very low	171 Å²	171	119.5 Å²	119.5	74%	0.743	64%	0.642	S	S	*	*			trans	-79.5	110.3	164.3	-90.5	175.3	174.6	164.4	0	109.6	D189 L193	D189-K191 PolarHBondContact O-N 3.5Å; K191-L193 PolarHBondContact O-N 2.8Å
192	C	35.3	Very low	40.4	Very low	95 Å²	95	112.9 Å²	112.9	64%	0.642	61%	0.61	S	S	*	*			trans	-60.1	129.9	165.3	-67.4	0	0	0	0	109.2	K190 L194	K190-C192 PolarHBondContact O-N 3.23Å; C192-L194 PolarHBondContact O-N 3.39Å
193	L	44.5	Very low	42.8	Very low	83 Å²	83	106.9 Å²	106.9	44%	0.435	59%	0.587	S	S	.	*			trans	-78.6	62.4	-179.2	-67.9	170.9	0	0	0	110.9	K191 P195 N215	K191-L193 PolarHBondContact O-N 2.8Å; L193-P195 WeakPolarHBondContact O-CD 3.48Å; L193-P195 WeakPolarHBondContact O-CG 3.48Å; L193-N215 VanDerWaalsContact CD1-ND2 3.29Å; L193-N215 WeakPolarHBondContact CD1-ND2 3.27Å; L193-N215 WeakPolarHBondContact CD2-OD1 3.42Å
194	L	45.5	Very low	45.3	Very low	120 Å²	120	97.7 Å²	97.7	63%	0.628	55%	0.545	S	S	*	.			trans	-72.1	109.8	173.8	-80.2	169.8	0	0	0	109.9	C192	C192-L194 PolarHBondContact O-N 3.39Å
195	P	45.8	Very low	48.1	Very low	20 Å²	20	93.1 Å²	93.1	13%	0.13	52%	0.517	C	S	.	.			trans	-84.2	137	-174.8	-10.4	31.6	0	0	0	110.7	L193 L199 L211 W273	L193-P195 WeakPolarHBondContact O-CD 3.48Å; L193-P195 WeakPolarHBondContact O-CG 3.48Å; P195-L199 HydrophobicContact CB-CB 4.48Å; P195-L199 HydrophobicContact CB-CD1 3.42Å; P195-L199 VanDerWaalsContact CB-CD1 3.42Å; P195-L211 HydrophobicContact CG-CD2 4.07Å; P195-W273 HydrophobicContact CB-CH2 4.31Å; P195-W273 HydrophobicContact CB-CZ2 3.9Å; P195-W273 VanDerWaalsContact CD-CZ2 3.45Å; P195-W273 HydrophobicContact CG-CH2 3.66Å; P195-W273 HydrophobicContact CG-CZ2 3.46Å; P195-W273 VanDerWaalsContact CG-CZ2 3.46Å; P195-W273 HydrophobicContact CG-CZ3 4.39Å
196	T	42.8	Very low	50.5	Low	98 Å²	98	88.3 Å²	88.3	60%	0.601	49%	0.49	S	S	*	.			trans	-56.3	146.9	178.7	50.6	0	0	0	0	112.7	G198	T196-G198 PolarHBondContact O-N 3.22Å
197	S	42.2	Very low	53.1	Low	128 Å²	128	83.1 Å²	83.1	90%	0.895	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46	123.1	176.8	51.1	0	0	0	0	112.7
198	G	49.7	Very low	55.8	Low	56 Å²	56	78.4 Å²	78.4	58%	0.577	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	129.3	-10.8	-178.1	0	0	0	0	0	115.2	T196	T196-G198 PolarHBondContact O-N 3.22Å
199	L	56.8	Low	58.4	Low	10 Å²	10	71.4 Å²	71.4	5%	0.052	40%	0.398	C	S	.	.			trans	-91.7	-22.8	179.9	-76.7	168.2	0	0	0	115.2	P195 N201 K202 E210	P195-L199 HydrophobicContact CB-CB 4.48Å; P195-L199 HydrophobicContact CB-CD1 3.42Å; P195-L199 VanDerWaalsContact CB-CD1 3.42Å; L199-N201 PolarHBondContact O-N 2.86Å; L199-K202 HydrophobicContact CD2-CD 3.95Å; L199-K202 WeakPolarHBondContact O-CB 3.27Å; L199-K202 PolarHBondContact O-N 3.11Å; L199-K202 VanDerWaalsContact O-N 3.15Å; L199-E210 WeakPolarHBondContact CD2-OE2 3.34Å
200	G	56.7	Low	60.7	Low	2 Å²	2	66.8 Å²	66.8	2%	0.021	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-23.8	-172.3	0	0	0	0	0	115.2	K202 C277 E280 R281	G200-K202 PolarHBondContact O-N 3.21Å; G200-C277 WeakPolarHBondContact CA-SG 3.38Å; G200-E280 WeakPolarHBondContact CA-OE2 3.37Å; G200-R281 WeakPolarHBondContact O-CG 3.5Å
201	N	64.2	Low	62.9	Low	99 Å²	99	57 Å²	57	53%	0.529	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-12.5	176.9	-61.5	-0.6	0	0	0	114	L199	L199-N201 PolarHBondContact O-N 2.86Å
202	K	71.2	Confident	65.1	Low	58 Å²	58	49.4 Å²	49.4	25%	0.252	30%	0.298	S	S	.	.	S	Bend	trans	-90.1	145.1	-170.6	-62.8	-175.7	178.9	-172.6	0	112.6	L199 G200 Q206 E210 R281	L199-K202 HydrophobicContact CD2-CD 3.95Å; L199-K202 WeakPolarHBondContact O-CB 3.27Å; L199-K202 PolarHBondContact O-N 3.11Å; L199-K202 VanDerWaalsContact O-N 3.15Å; G200-K202 PolarHBondContact O-N 3.21Å; K202-Q206 HydrophobicContact CB-CG 4.5Å; K202-Q206 HydrophobicContact CD-CG 4.21Å; K202-E210 WeakPolarHBondContact CD-OE1 3.32Å; K202-E210 IonicContact NZ-OE1 2.74Å; K202-E210 PolarHBondContact NZ-OE1 2.82Å; K202-E210 IonicContact NZ-OE2 2.77Å; K202-E210 PolarHBondContact NZ-OE2 3.03Å; K202-R281 WeakPolarHBondContact O-CD 3.17Å
203	P	76.9	Confident	67	Low	56 Å²	56	50.5 Å²	50.5	36%	0.364	29%	0.294	S	S	.	.			trans	-66.5	153.4	178.4	28.2	-34.8	0	0	0	112	C205 Q206 L207	P203-C205 VanDerWaalsContact C-N 3.31Å; P203-C205 PolarHBondContact O-N 2.54Å; P203-C205 VanDerWaalsContact O-N 3.14Å; P203-Q206 HydrophobicContact CG-CB 3.98Å; P203-Q206 PolarHBondContact O-N 3.27Å; P203-L207 PolarHBondContact O-N 2.65Å
204	P	83.2	Confident	68.1	Low	4 Å²	4	53.6 Å²	53.6	3%	0.026	30%	0.3	C	S	.	.	H	α-helix	trans	-54.4	-40.4	-171.2	-29.3	36.4	0	0	0	114.5	Q206 L207 L208 A259 E260 L263	P204-Q206 VanDerWaalsContact C-N 3.32Å; P204-Q206 PolarHBondContact O-N 3.02Å; P204-L207 PolarHBondContact O-N 3.12Å; P204-L208 VanDerWaalsContact O-CB 3.26Å; P204-L208 WeakPolarHBondContact O-CB 3.43Å; P204-L208 PolarHBondContact O-N 3.44Å; P204-A259 HydrophobicContact CB-CB 4.05Å; P204-E260 HydrophobicContact CB-CB 4.41Å; P204-L263 HydrophobicContact CB-CD1 4.15Å
205	C	85.5	Confident	69	Low	21 Å²	21	50.5 Å²	50.5	14%	0.142	28%	0.284	C	S	.	.	H	α-helix	trans	-59.5	-38.9	175.8	-64.3	0	0	0	0	113.4	P203 V209 F223 K255 N256 A259	P203-C205 VanDerWaalsContact C-N 3.31Å; P203-C205 PolarHBondContact O-N 2.54Å; P203-C205 VanDerWaalsContact O-N 3.14Å; C205-V209 VanDerWaalsContact O-CG2 3.3Å; C205-V209 WeakPolarHBondContact O-CG2 3.49Å; C205-V209 PolarHBondContact O-N 3.38Å; C205-V209 VanDerWaalsContact O-N 3.17Å; C205-F223 HydrophobicContact CB-CZ 4.13Å; C205-K255 VanDerWaalsContact SG-C 3.56Å; C205-K255 PolarHBondContact SG-O 2.78Å; C205-N256 PolarHBondContact SG-OD1 3.32Å; C205-A259 HydrophobicContact CB-CB 4.37Å
206	Q	82.5	Confident	69.2	Low	84 Å²	84	52.6 Å²	52.6	39%	0.393	31%	0.309	S	S	.	.	H	α-helix	trans	-77.6	-43.4	-179.3	-178.5	175.9	-1.7	0	0	111	K202 P203 P204 L208 V209 E210	K202-Q206 HydrophobicContact CB-CG 4.5Å; K202-Q206 HydrophobicContact CD-CG 4.21Å; P203-Q206 HydrophobicContact CG-CB 3.98Å; P203-Q206 PolarHBondContact O-N 3.27Å; P204-Q206 VanDerWaalsContact C-N 3.32Å; P204-Q206 PolarHBondContact O-N 3.02Å; Q206-L208 VanDerWaalsContact C-N 3.27Å; Q206-L208 PolarHBondContact O-N 3.11Å; Q206-V209 PolarHBondContact O-N 3.46Å; Q206-E210 HydrophobicContact CG-CG 4.45Å; Q206-E210 VanDerWaalsContact CG-OE1 3.32Å; Q206-E210 WeakPolarHBondContact CG-OE1 3.42Å; Q206-E210 PolarHBondContact NE2-OE1 2.97Å; Q206-E210 WeakPolarHBondContact O-CG 3.44Å; Q206-E210 PolarHBondContact O-N 3.06Å
207	L	81.9	Confident	69.6	Low	4 Å²	4	54.5 Å²	54.5	2%	0.021	32%	0.316	C	S	.	.	H	α-helix	trans	-54.1	-45.5	172.1	169.6	63.8	0	0	0	111.3	P203 P204 E210 L211 L263 W273 L274	P203-L207 PolarHBondContact O-N 2.65Å; P204-L207 PolarHBondContact O-N 3.12Å; L207-E210 PolarHBondContact O-N 3.26Å; L207-L211 HydrophobicContact CD1-CD1 3.82Å; L207-L211 HydrophobicContact CD1-CG 4.15Å; L207-L211 HydrophobicContact CG-CD1 4.08Å; L207-L211 WeakPolarHBondContact O-CB 3.47Å; L207-L211 VanDerWaalsContact O-CG 3.31Å; L207-L211 WeakPolarHBondContact O-CG 3.41Å; L207-L211 PolarHBondContact O-N 2.93Å; L207-L263 HydrophobicContact CD2-CD1 3.73Å; L207-L263 HydrophobicContact CD2-CD2 4.16Å; L207-L263 HydrophobicContact CG-CD1 4.22Å; L207-L263 HydrophobicContact CG-CD2 4.08Å; L207-W273 HydrophobicContact CD1-CH2 3.78Å; L207-W273 HydrophobicContact CD1-CZ3 4.12Å; L207-W273 HydrophobicContact CD2-CH2 4.18Å; L207-W273 HydrophobicContact CD2-CZ3 3.79Å; L207-L274 HydrophobicContact CD2-CD2 4.1Å
208	L	85.8	Confident	70.2	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.4	-48.3	176.8	-174.6	77	0	0	0	112.3	P204 Q206 E210 L211 C212 P221 F223 L237 I239 A259 A262 L263 L267	P204-L208 VanDerWaalsContact O-CB 3.26Å; P204-L208 WeakPolarHBondContact O-CB 3.43Å; P204-L208 PolarHBondContact O-N 3.44Å; Q206-L208 VanDerWaalsContact C-N 3.27Å; Q206-L208 PolarHBondContact O-N 3.11Å; L208-E210 PolarHBondContact O-N 3.29Å; L208-L211 PolarHBondContact O-N 3.4Å; L208-C212 PolarHBondContact O-N 3.35Å; L208-C212 PolarHBondContact O-SG 3.28Å; L208-P221 HydrophobicContact CD2-CB 3.73Å; L208-P221 HydrophobicContact CD2-CG 4.08Å; L208-P221 HydrophobicContact CG-CB 4.35Å; L208-P221 HydrophobicContact CG-CG 4.31Å; L208-F223 HydrophobicContact CD2-CZ 4.35Å; L208-L237 HydrophobicContact CD2-CD1 3.59Å; L208-L237 HydrophobicContact CD2-CD2 4.01Å; L208-L237 HydrophobicContact CD2-CG 4.41Å; L208-I239 HydrophobicContact CD1-CD1 3.88Å; L208-I239 HydrophobicContact CD2-CD1 4.21Å; L208-I239 HydrophobicContact CG-CD1 4.31Å; L208-A259 HydrophobicContact CB-CB 4.46Å; L208-A259 HydrophobicContact CD2-CB 3.97Å; L208-A262 HydrophobicContact CD1-CB 3.88Å; L208-A262 HydrophobicContact CD2-CB 4.03Å; L208-L263 HydrophobicContact CB-CD2 4.44Å; L208-L263 HydrophobicContact CB-CG 4.49Å; L208-L263 HydrophobicContact CD1-CD2 3.98Å; L208-L263 HydrophobicContact CD1-CG 3.96Å; L208-L267 HydrophobicContact CD1-CD1 3.6Å; L208-L267 HydrophobicContact CD1-CG 4.33Å
209	V	82.2	Confident	71	Confident	44 Å²	44	53 Å²	53	27%	0.267	30%	0.3	S	S	.	.	H	α-helix	trans	-58.9	-46.5	177.3	166.8	0	0	0	0	111	C205 Q206 L211 C212 Q213 P221	C205-V209 VanDerWaalsContact O-CG2 3.3Å; C205-V209 WeakPolarHBondContact O-CG2 3.49Å; C205-V209 PolarHBondContact O-N 3.38Å; C205-V209 VanDerWaalsContact O-N 3.17Å; Q206-V209 PolarHBondContact O-N 3.46Å; V209-L211 PolarHBondContact O-N 3.49Å; V209-C212 PolarHBondContact O-N 2.93Å; V209-Q213 HydrophobicContact CG1-CG 4.38Å; V209-Q213 WeakPolarHBondContact O-CB 3.42Å; V209-Q213 VanDerWaalsContact O-CG 3.26Å; V209-Q213 WeakPolarHBondContact O-CG 3.13Å; V209-Q213 PolarHBondContact O-N 3.1Å; V209-P221 HydrophobicContact CG2-CG 3.6Å
210	E	78.4	Confident	72	Confident	35 Å²	35	57.2 Å²	57.2	16%	0.164	32%	0.322	C	S	.	.	H	α-helix	trans	-68.6	-31.9	-178.8	-69.9	-179.3	-156.6	0	0	112.8	L199 K202 Q206 L207 L208 R214	L199-E210 WeakPolarHBondContact CD2-OE2 3.34Å; K202-E210 WeakPolarHBondContact CD-OE1 3.32Å; K202-E210 IonicContact NZ-OE1 2.74Å; K202-E210 PolarHBondContact NZ-OE1 2.82Å; K202-E210 IonicContact NZ-OE2 2.77Å; K202-E210 PolarHBondContact NZ-OE2 3.03Å; Q206-E210 HydrophobicContact CG-CG 4.45Å; Q206-E210 VanDerWaalsContact CG-OE1 3.32Å; Q206-E210 WeakPolarHBondContact CG-OE1 3.42Å; Q206-E210 PolarHBondContact NE2-OE1 2.97Å; Q206-E210 WeakPolarHBondContact O-CG 3.44Å; Q206-E210 PolarHBondContact O-N 3.06Å; L207-E210 PolarHBondContact O-N 3.26Å; L208-E210 PolarHBondContact O-N 3.29Å; E210-R214 WeakPolarHBondContact O-CB 3.3Å; E210-R214 VanDerWaalsContact O-CG 3.25Å; E210-R214 WeakPolarHBondContact O-CG 3.43Å; E210-R214 PolarHBondContact O-N 3.19Å
211	L	77.1	Confident	73.3	Confident	9 Å²	9	57.9 Å²	57.9	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-70.4	-44.7	171.8	-73.1	171.7	0	0	0	112	P195 L207 L208 V209 Q213 R214 N215 L263 L267 V269	P195-L211 HydrophobicContact CG-CD2 4.07Å; L207-L211 HydrophobicContact CD1-CD1 3.82Å; L207-L211 HydrophobicContact CD1-CG 4.15Å; L207-L211 HydrophobicContact CG-CD1 4.08Å; L207-L211 WeakPolarHBondContact O-CB 3.47Å; L207-L211 VanDerWaalsContact O-CG 3.31Å; L207-L211 WeakPolarHBondContact O-CG 3.41Å; L207-L211 PolarHBondContact O-N 2.93Å; L208-L211 PolarHBondContact O-N 3.4Å; V209-L211 PolarHBondContact O-N 3.49Å; L211-Q213 VanDerWaalsContact C-N 3.33Å; L211-Q213 PolarHBondContact O-N 2.92Å; L211-R214 PolarHBondContact O-N 2.88Å; L211-N215 VanDerWaalsContact O-CG 3.23Å; L211-N215 PolarHBondContact O-N 3.29Å; L211-N215 VanDerWaalsContact O-N 3.14Å; L211-N215 PolarHBondContact O-ND2 2.79Å; L211-L263 HydrophobicContact CD1-CD2 3.62Å; L211-L267 HydrophobicContact CB-CD1 4.16Å; L211-L267 HydrophobicContact CD1-CD1 4.44Å; L211-V269 HydrophobicContact CD1-CG2 4.42Å
212	C	79.3	Confident	74.4	Confident	11 Å²	11	57 Å²	57	7%	0.074	32%	0.324	C	S	.	.	H	α-helix	trans	-61.7	-40.3	175	-71.2	0	0	0	0	112.1	L208 V209 N215	L208-C212 PolarHBondContact O-N 3.35Å; L208-C212 PolarHBondContact O-SG 3.28Å; V209-C212 PolarHBondContact O-N 2.93Å; C212-N215 PolarHBondContact O-N 3.39Å
213	Q	75.8	Confident	75.3	Confident	118 Å²	118	56.2 Å²	56.2	55%	0.551	32%	0.321	S	S	*	.	H	α-helix	trans	-63.3	-46.1	175.1	-75.8	172.2	-13.8	0	0	112.3	V209 L211 N215 G216 L220	V209-Q213 HydrophobicContact CG1-CG 4.38Å; V209-Q213 WeakPolarHBondContact O-CB 3.42Å; V209-Q213 VanDerWaalsContact O-CG 3.26Å; V209-Q213 WeakPolarHBondContact O-CG 3.13Å; V209-Q213 PolarHBondContact O-N 3.1Å; L211-Q213 VanDerWaalsContact C-N 3.33Å; L211-Q213 PolarHBondContact O-N 2.92Å; Q213-N215 PolarHBondContact O-N 3.48Å; Q213-G216 PolarHBondContact O-N 3.2Å; Q213-L220 HydrophobicContact CG-CD2 3.79Å
214	R	67	Low	76	Confident	149 Å²	149	57.9 Å²	57.9	56%	0.562	32%	0.324	S	S	*	.	H	α-helix	trans	-62.8	-27	178.2	-79.1	176	176	-149.9	-2.7	113.7	E210 L211 G216	E210-R214 WeakPolarHBondContact O-CB 3.3Å; E210-R214 VanDerWaalsContact O-CG 3.25Å; E210-R214 WeakPolarHBondContact O-CG 3.43Å; E210-R214 PolarHBondContact O-N 3.19Å; L211-R214 PolarHBondContact O-N 2.88Å; R214-G216 VanDerWaalsContact C-N 3.32Å; R214-G216 PolarHBondContact O-N 2.87Å
215	N	63.2	Low	76.3	Confident	54 Å²	54	60.9 Å²	60.9	29%	0.289	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-1.4	-178	-71	-13.8	0	0	0	114.3	L193 L211 C212 Q213 N217	L193-N215 VanDerWaalsContact CD1-ND2 3.29Å; L193-N215 WeakPolarHBondContact CD1-ND2 3.27Å; L193-N215 WeakPolarHBondContact CD2-OD1 3.42Å; L211-N215 VanDerWaalsContact O-CG 3.23Å; L211-N215 PolarHBondContact O-N 3.29Å; L211-N215 VanDerWaalsContact O-N 3.14Å; L211-N215 PolarHBondContact O-ND2 2.79Å; C212-N215 PolarHBondContact O-N 3.39Å; Q213-N215 PolarHBondContact O-N 3.48Å; N215-N217 PolarHBondContact O-N 3.48Å; N215-N217 PolarHBondContact O-OD1 3.33Å
216	G	50	Low	76.5	Confident	65 Å²	65	63.9 Å²	63.9	67%	0.67	36%	0.357	S	S	*	.			trans	69.8	-23.3	168.5	0	0	0	0	0	117.6	Q213 R214 G218	Q213-G216 PolarHBondContact O-N 3.2Å; R214-G216 VanDerWaalsContact C-N 3.32Å; R214-G216 PolarHBondContact O-N 2.87Å; G216-G218 PolarHBondContact O-N 3.14Å
217	N	52.9	Low	76.7	Confident	137 Å²	137	67.4 Å²	67.4	73%	0.733	37%	0.371	S	S	*	.	S	Bend	trans	-76.4	25.5	-168.5	-67.8	-10.3	0	0	0	115.6	N215 N219	N215-N217 PolarHBondContact O-N 3.48Å; N215-N217 PolarHBondContact O-OD1 3.33Å; N217-N219 PolarHBondContact O-N 3.05Å
218	G	54.2	Low	76.9	Confident	65 Å²	65	69.8 Å²	69.8	67%	0.67	38%	0.383	S	S	*	.	S	Bend	trans	67.4	-22	173.1	0	0	0	0	0	117.8	G216 L220	G216-G218 PolarHBondContact O-N 3.14Å; G218-L220 VanDerWaalsContact C-N 3.32Å; G218-L220 PolarHBondContact O-N 3.13Å
219	N	65.8	Low	76.6	Confident	87 Å²	87	78.3 Å²	78.3	47%	0.465	43%	0.429	S	S	.	.			trans	-74	74.8	-173.9	-70.3	-22.3	0	0	0	112.8	N217 I239	N217-N219 PolarHBondContact O-N 3.05Å; N219-I239 HydrophobicContact CB-CG2 4.14Å
220	L	77.5	Confident	76.7	Confident	100 Å²	100	80.9 Å²	80.9	52%	0.524	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-66.1	143.6	169.1	-67.8	172.7	0	0	0	111	Q213 G218 V222	Q213-L220 HydrophobicContact CG-CD2 3.79Å; G218-L220 VanDerWaalsContact C-N 3.32Å; G218-L220 PolarHBondContact O-N 3.13Å; L220-V222 PolarHBondContact O-N 3.04Å
221	P	84.9	Confident	76.8	Confident	15 Å²	15	81.2 Å²	81.2	10%	0.097	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-73.4	120.8	-178.1	28.6	-34.1	0	0	0	112.1	L208 V209 F223 L237 T238 I239	L208-P221 HydrophobicContact CD2-CB 3.73Å; L208-P221 HydrophobicContact CD2-CG 4.08Å; L208-P221 HydrophobicContact CG-CB 4.35Å; L208-P221 HydrophobicContact CG-CG 4.31Å; V209-P221 HydrophobicContact CG2-CG 3.6Å; P221-F223 HydrophobicContact CB-CE2 4.03Å; P221-F223 HydrophobicContact CG-CE2 4.13Å; P221-F223 WeakPolarHBondContact O-CD2 3.18Å; P221-L237 HydrophobicContact CB-CD2 3.79Å; P221-T238 WeakPolarHBondContact CA-O 3.24Å; P221-I239 HydrophobicContact CB-CD1 4.4Å; P221-I239 HydrophobicContact CB-CG1 4.12Å
222	V	87.7	Confident	77.3	Confident	82 Å²	82	84.2 Å²	84.2	50%	0.497	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	133.1	175.2	-179	0	0	0	0	109.3	L220 L237 T238	L220-V222 PolarHBondContact O-N 3.04Å; V222-L237 CarbonylContact O-C 3.58Å; V222-L237 VanDerWaalsContact O-CA 3.26Å; V222-L237 WeakPolarHBondContact O-CA 3.44Å; V222-T238 PolarHBondContact N-O 2.96Å; V222-T238 PolarHBondContact O-N 3.31Å
223	F	90.3	Very high	77.7	Confident	41 Å²	41	84.3 Å²	84.3	18%	0.18	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	103.8	-178.2	-67.7	-102.2	0	0	0	111.7	C205 L208 P221 L237 K255 A259	C205-F223 HydrophobicContact CB-CZ 4.13Å; L208-F223 HydrophobicContact CD2-CZ 4.35Å; P221-F223 HydrophobicContact CB-CE2 4.03Å; P221-F223 HydrophobicContact CG-CE2 4.13Å; P221-F223 WeakPolarHBondContact O-CD2 3.18Å; F223-L237 HydrophobicContact CD1-CD1 3.88Å; F223-L237 HydrophobicContact CD1-CG 3.99Å; F223-L237 HydrophobicContact CE1-CD1 3.34Å; F223-L237 HydrophobicContact CE1-CG 3.93Å; F223-L237 HydrophobicContact CE2-CD1 4.45Å; F223-L237 HydrophobicContact CG-CG 4.37Å; F223-L237 HydrophobicContact CZ-CD1 3.68Å; F223-L237 HydrophobicContact CZ-CG 4.23Å; F223-K255 HydrophobicContact CB-CD 4.27Å; F223-K255 HydrophobicContact CD1-CB 4.13Å; F223-K255 HydrophobicContact CD1-CD 3.81Å; F223-K255 HydrophobicContact CD1-CG 3.82Å; F223-K255 HydrophobicContact CE1-CB 4.19Å; F223-K255 HydrophobicContact CE1-CD 4.32Å; F223-K255 HydrophobicContact CE1-CG 4.36Å; F223-K255 HydrophobicContact CG-CD 4.14Å; F223-A259 HydrophobicContact CE1-CB 4.32Å; F223-A259 HydrophobicContact CZ-CB 4.43Å
224	E	89.8	Confident	78.4	Confident	91 Å²	91	78.8 Å²	78.8	43%	0.425	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	141.3	172.3	-67.4	165.9	-170	0	0	109.7	C235 K236	E224-C235 VanDerWaalsContact O-CA 3.27Å; E224-C235 WeakPolarHBondContact O-CA 3.44Å; E224-C235 PolarHBondContact O-SG 3.32Å; E224-K236 HydrophobicContact CB-CB 4.3Å; E224-K236 PolarHBondContact N-O 2.86Å; E224-K236 PolarHBondContact O-N 2.9Å; E224-K236 VanDerWaalsContact O-N 3.11Å; E224-K236 WeakPolarHBondContact OE2-CD 3.47Å; E224-K236 IonicContact OE2-NZ 2.75Å
225	L	90.4	Very high	79.7	Confident	66 Å²	66	71.7 Å²	71.7	35%	0.346	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	111.7	-177.1	-78.3	173.9	0	0	0	111.9	V233 S234 C235 R251 K255	L225-V233 HydrophobicContact CD2-CG1 3.7Å; L225-S234 WeakPolarHBondContact CA-O 3.37Å; L225-C235 HydrophobicContact CD2-CB 3.61Å; L225-R251 HydrophobicContact CD1-CB 4.22Å; L225-R251 HydrophobicContact CD1-CG 4.17Å; L225-K255 HydrophobicContact CD1-CG 4.44Å; L225-K255 HydrophobicContact CD2-CG 4.16Å
226	T	89.5	Confident	81.1	Confident	84 Å²	84	72.7 Å²	72.7	52%	0.515	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	132.7	179.3	-56.5	0	0	0	0	109.7	V233 S234	T226-V233 CarbonylContact O-C 3.6Å; T226-V233 WeakPolarHBondContact O-CA 3.49Å; T226-S234 PolarHBondContact N-O 3.21Å; T226-S234 PolarHBondContact O-N 3.41Å
227	K	86.6	Confident	83.1	Confident	158 Å²	158	69.6 Å²	69.6	69%	0.687	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	133.8	171.4	-168	-165.1	168.5	-161.8	0	108.9
228	L	87.4	Confident	84.8	Confident	55 Å²	55	64.5 Å²	64.5	29%	0.288	36%	0.358	S	S	.	.			trans	-96.5	160.1	177.6	-56.9	178.5	0	0	0	111.1	D230 G231 K232 I247	L228-D230 VanDerWaalsContact C-N 3.29Å; L228-D230 WeakPolarHBondContact CB-OD1 3.48Å; L228-D230 PolarHBondContact O-N 3.27Å; L228-G231 PolarHBondContact O-N 3.49Å; L228-K232 HydrophobicContact CD1-CB 4.4Å; L228-K232 PolarHBondContact N-O 3.03Å; L228-I247 HydrophobicContact CD1-CD1 4.03Å; L228-I247 HydrophobicContact CD1-CG1 4.2Å; L228-I247 HydrophobicContact CD1-CG2 3.65Å
229	D	79.2	Confident	86.3	Confident	179 Å²	179	62.3 Å²	62.3	96%	0.957	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-28.8	-175.5	-61.2	-47.6	0	0	0	113.3	G231	D229-G231 PolarHBondContact O-N 3.28Å; D229-G231 VanDerWaalsContact O-N 3.14Å
230	D	84.1	Confident	87	Confident	97 Å²	97	59.6 Å²	59.6	52%	0.519	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	3.3	172.7	75.9	-15.5	0	0	0	113.7	L228 K232	L228-D230 VanDerWaalsContact C-N 3.29Å; L228-D230 WeakPolarHBondContact CB-OD1 3.48Å; L228-D230 PolarHBondContact O-N 3.27Å; D230-K232 VanDerWaalsContact C-N 3.31Å; D230-K232 PolarHBondContact O-N 2.81Å; D230-K232 VanDerWaalsContact OD1-CB 3.23Å; D230-K232 WeakPolarHBondContact OD1-CB 3.44Å; D230-K232 WeakPolarHBondContact OD1-CG 3.3Å; D230-K232 PolarHBondContact OD1-N 3.24Å; D230-K232 WeakPolarHBondContact OD2-CD 3.44Å; D230-K232 WeakPolarHBondContact OD2-CG 3.32Å; D230-K232 IonicContact OD2-NZ 2.64Å; D230-K232 PolarHBondContact OD2-NZ 3.02Å
231	G	80.1	Confident	87.3	Confident	42 Å²	42	64.1 Å²	64.1	43%	0.433	34%	0.342	S	S	.	.	S	Bend	trans	85.8	-6.9	-179.3	0	0	0	0	0	114.7	L228 D229	L228-G231 PolarHBondContact O-N 3.49Å; D229-G231 PolarHBondContact O-N 3.28Å; D229-G231 VanDerWaalsContact O-N 3.14Å
232	K	86.9	Confident	87.4	Confident	73 Å²	73	68.2 Å²	68.2	32%	0.317	36%	0.363	S	S	.	.			trans	-72.1	173.7	174.5	-61.4	-167.3	-170.7	89	0	111.5	L228 D230 I247 D249	L228-K232 HydrophobicContact CD1-CB 4.4Å; L228-K232 PolarHBondContact N-O 3.03Å; D230-K232 VanDerWaalsContact C-N 3.31Å; D230-K232 PolarHBondContact O-N 2.81Å; D230-K232 VanDerWaalsContact OD1-CB 3.23Å; D230-K232 WeakPolarHBondContact OD1-CB 3.44Å; D230-K232 WeakPolarHBondContact OD1-CG 3.3Å; D230-K232 PolarHBondContact OD1-N 3.24Å; D230-K232 WeakPolarHBondContact OD2-CD 3.44Å; D230-K232 WeakPolarHBondContact OD2-CG 3.32Å; D230-K232 IonicContact OD2-NZ 2.64Å; D230-K232 PolarHBondContact OD2-NZ 3.02Å; K232-I247 HydrophobicContact CB-CG2 3.94Å; K232-I247 HydrophobicContact CD-CG2 3.9Å; K232-D249 WeakPolarHBondContact CD-OD1 3.45Å; K232-D249 WeakPolarHBondContact CE-OD1 3.23Å; K232-D249 WeakPolarHBondContact CG-OD1 3.4Å
233	V	87.5	Confident	87.5	Confident	13 Å²	13	67.2 Å²	67.2	8%	0.079	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	121.7	177.3	-179.6	0	0	0	0	108	L225 T226 I247 S248 R251 A254	L225-V233 HydrophobicContact CD2-CG1 3.7Å; T226-V233 CarbonylContact O-C 3.6Å; T226-V233 WeakPolarHBondContact O-CA 3.49Å; V233-I247 WeakPolarHBondContact O-CA 3.07Å; V233-S248 PolarHBondContact N-O 3.19Å; V233-S248 PolarHBondContact O-N 2.84Å; V233-R251 HydrophobicContact CG1-CG 4.05Å; V233-R251 HydrophobicContact CG2-CG 4.17Å; V233-A254 HydrophobicContact CB-CB 4.41Å; V233-A254 HydrophobicContact CG1-CB 4.28Å; V233-A254 WeakPolarHBondContact O-CB 3.37Å
234	S	91.7	Very high	87.6	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.007	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	142.5	161.9	-164.1	0	0	0	0	110.4	L225 T226 E245	L225-S234 WeakPolarHBondContact CA-O 3.37Å; T226-S234 PolarHBondContact N-O 3.21Å; T226-S234 PolarHBondContact O-N 3.41Å; S234-E245 WeakPolarHBondContact CB-OE1 3.49Å; S234-E245 VanDerWaalsContact OG-CD 3.29Å; S234-E245 WeakPolarHBondContact OG-CG 3.42Å; S234-E245 PolarHBondContact OG-OE1 3.04Å
235	C	93.1	Very high	87.7	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	118	164.3	-167.9	0	0	0	0	109.4	E224 L225 E245 A246 A254 A258	E224-C235 VanDerWaalsContact O-CA 3.27Å; E224-C235 WeakPolarHBondContact O-CA 3.44Å; E224-C235 PolarHBondContact O-SG 3.32Å; L225-C235 HydrophobicContact CD2-CB 3.61Å; C235-E245 WeakPolarHBondContact O-CA 3.17Å; C235-A246 PolarHBondContact N-O 3.15Å; C235-A246 PolarHBondContact O-N 2.91Å; C235-A254 HydrophobicContact CB-CB 3.76Å; C235-A258 HydrophobicContact CB-CB 4.16Å
236	K	93.3	Very high	87.8	Confident	75 Å²	75	63.4 Å²	63.4	33%	0.326	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	135.7	166.1	179.7	-179.7	166.8	-154.7	0	108.3	E224 S243 V244 E245	E224-K236 HydrophobicContact CB-CB 4.3Å; E224-K236 PolarHBondContact N-O 2.86Å; E224-K236 PolarHBondContact O-N 2.9Å; E224-K236 VanDerWaalsContact O-N 3.11Å; E224-K236 WeakPolarHBondContact OE2-CD 3.47Å; E224-K236 IonicContact OE2-NZ 2.75Å; K236-S243 VanDerWaalsContact CE-OG 3.25Å; K236-S243 WeakPolarHBondContact CE-OG 3.34Å; K236-V244 CarbonylContact C-O 3.58Å; K236-V244 WeakPolarHBondContact CA-O 3.33Å; K236-E245 HydrophobicContact CB-CG 4.44Å
237	L	91.4	Very high	87.9	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	119.6	-177.7	-167.5	175	0	0	0	109.1	L208 P221 V222 F223 I239 S243 V244 A258 A259 A262	L208-L237 HydrophobicContact CD2-CD1 3.59Å; L208-L237 HydrophobicContact CD2-CD2 4.01Å; L208-L237 HydrophobicContact CD2-CG 4.41Å; P221-L237 HydrophobicContact CB-CD2 3.79Å; V222-L237 CarbonylContact O-C 3.58Å; V222-L237 VanDerWaalsContact O-CA 3.26Å; V222-L237 WeakPolarHBondContact O-CA 3.44Å; F223-L237 HydrophobicContact CD1-CD1 3.88Å; F223-L237 HydrophobicContact CD1-CG 3.99Å; F223-L237 HydrophobicContact CE1-CD1 3.34Å; F223-L237 HydrophobicContact CE1-CG 3.93Å; F223-L237 HydrophobicContact CE2-CD1 4.45Å; F223-L237 HydrophobicContact CG-CG 4.37Å; F223-L237 HydrophobicContact CZ-CD1 3.68Å; F223-L237 HydrophobicContact CZ-CG 4.23Å; L237-I239 HydrophobicContact CD2-CD1 3.97Å; L237-I239 HydrophobicContact CD2-CG1 3.59Å; L237-S243 CarbonylContact O-C 3.58Å; L237-S243 WeakPolarHBondContact O-CA 3.29Å; L237-S243 WeakPolarHBondContact O-CB 3.43Å; L237-V244 HydrophobicContact CB-CG2 4.15Å; L237-V244 PolarHBondContact N-O 2.8Å; L237-V244 PolarHBondContact O-N 3.24Å; L237-A258 HydrophobicContact CB-CB 3.88Å; L237-A258 HydrophobicContact CD1-CB 4.11Å; L237-A259 HydrophobicContact CD1-CB 4Å; L237-A262 HydrophobicContact CD1-CB 4.09Å; L237-A262 HydrophobicContact CD2-CB 4.13Å
238	T	89	Confident	87.9	Confident	30 Å²	30	56.7 Å²	56.7	18%	0.184	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	135.4	-176.2	-51.6	0	0	0	0	110.8	P221 V222 G240 N242	P221-T238 WeakPolarHBondContact CA-O 3.24Å; V222-T238 PolarHBondContact N-O 2.96Å; V222-T238 PolarHBondContact O-N 3.31Å; T238-G240 VanDerWaalsContact CG2-O 3.31Å; T238-G240 WeakPolarHBondContact CG2-O 3.42Å; T238-N242 CarbonylContact C-O 3.54Å; T238-N242 WeakPolarHBondContact CA-O 3.45Å
239	I	85.3	Confident	87.6	Confident	19 Å²	19	57.5 Å²	57.5	10%	0.097	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	103.8	175.1	-51.9	-178.4	0	0	0	108.3	L208 N219 P221 L237 E241 N242 A262 L266	L208-I239 HydrophobicContact CD1-CD1 3.88Å; L208-I239 HydrophobicContact CD2-CD1 4.21Å; L208-I239 HydrophobicContact CG-CD1 4.31Å; N219-I239 HydrophobicContact CB-CG2 4.14Å; P221-I239 HydrophobicContact CB-CD1 4.4Å; P221-I239 HydrophobicContact CB-CG1 4.12Å; L237-I239 HydrophobicContact CD2-CD1 3.97Å; L237-I239 HydrophobicContact CD2-CG1 3.59Å; I239-E241 PolarHBondContact O-N 3.41Å; I239-N242 PolarHBondContact N-O 3.47Å; I239-N242 PolarHBondContact O-N 3.5Å; I239-A262 HydrophobicContact CD1-CB 4.02Å; I239-L266 HydrophobicContact CB-CD1 4.2Å; I239-L266 HydrophobicContact CD1-CD1 4.05Å; I239-L266 HydrophobicContact CG1-CD1 4.07Å
240	G	81.7	Confident	87.7	Confident	31 Å²	31	49.9 Å²	49.9	32%	0.32	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	-126.9	-167.9	0	0	0	0	0	110.2	T238	T238-G240 VanDerWaalsContact CG2-O 3.31Å; T238-G240 WeakPolarHBondContact CG2-O 3.42Å
241	E	83	Confident	87.7	Confident	195 Å²	195	53.7 Å²	53.7	91%	0.911	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-14.3	-179.3	-62.6	173.5	165.5	0	0	113.7	I239	I239-E241 PolarHBondContact O-N 3.41Å
242	N	87.8	Confident	87.9	Confident	101 Å²	101	58 Å²	58	54%	0.54	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	143	-175.1	-60.2	-82.4	0	0	0	111.5	T238 I239 L266	T238-N242 CarbonylContact C-O 3.54Å; T238-N242 WeakPolarHBondContact CA-O 3.45Å; I239-N242 PolarHBondContact N-O 3.47Å; I239-N242 PolarHBondContact O-N 3.5Å; N242-L266 HydrophobicContact CB-CD1 4.25Å; N242-L266 HydrophobicContact CB-CD2 3.65Å
243	S	89.7	Confident	87.6	Confident	60 Å²	60	59.2 Å²	59.2	42%	0.42	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	144.5	174.9	69.3	0	0	0	0	113.6	K236 L237	K236-S243 VanDerWaalsContact CE-OG 3.25Å; K236-S243 WeakPolarHBondContact CE-OG 3.34Å; L237-S243 CarbonylContact O-C 3.58Å; L237-S243 WeakPolarHBondContact O-CA 3.29Å; L237-S243 WeakPolarHBondContact O-CB 3.43Å
244	V	92.9	Very high	87.6	Confident	7 Å²	7	58.6 Å²	58.6	4%	0.042	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	155.4	172.4	-64.2	0	0	0	0	110.7	K236 L237 A258 K261 A262 E265 L266	K236-V244 CarbonylContact C-O 3.58Å; K236-V244 WeakPolarHBondContact CA-O 3.33Å; L237-V244 HydrophobicContact CB-CG2 4.15Å; L237-V244 PolarHBondContact N-O 2.8Å; L237-V244 PolarHBondContact O-N 3.24Å; V244-A258 VanDerWaalsContact CG2-O 3.32Å; V244-A258 WeakPolarHBondContact CG2-O 3.47Å; V244-K261 HydrophobicContact CB-CB 4.12Å; V244-K261 HydrophobicContact CB-CD 4.48Å; V244-K261 HydrophobicContact CG1-CB 4.45Å; V244-K261 HydrophobicContact CG2-CB 3.98Å; V244-A262 HydrophobicContact CG2-CB 3.89Å; V244-E265 HydrophobicContact CG1-CB 4.11Å; V244-E265 VanDerWaalsContact CG1-OE2 3.32Å; V244-E265 WeakPolarHBondContact CG1-OE2 3.5Å; V244-L266 HydrophobicContact CG1-CD1 4.08Å; V244-L266 HydrophobicContact CG1-CD2 3.92Å; V244-L266 HydrophobicContact CG1-CG 3.83Å; V244-L266 HydrophobicContact CG2-CD1 4.48Å
245	E	92.3	Very high	87.5	Confident	103 Å²	103	60.8 Å²	60.8	48%	0.481	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	139.6	179.9	-169.6	171.9	-179.1	0	0	112.3	S234 C235 K236 K261	S234-E245 WeakPolarHBondContact CB-OE1 3.49Å; S234-E245 VanDerWaalsContact OG-CD 3.29Å; S234-E245 WeakPolarHBondContact OG-CG 3.42Å; S234-E245 PolarHBondContact OG-OE1 3.04Å; C235-E245 WeakPolarHBondContact O-CA 3.17Å; K236-E245 HydrophobicContact CB-CG 4.44Å; E245-K261 WeakPolarHBondContact O-CD 3.48Å; E245-K261 WeakPolarHBondContact O-CE 3.35Å; E245-K261 PolarHBondContact O-NZ 3.15Å
246	A	91.8	Very high	87.2	Confident	9 Å²	9	63.1 Å²	63.1	7%	0.074	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	129.7	176.3	0	0	0	0	0	112.4	C235 L257 A258 K261	C235-A246 PolarHBondContact N-O 3.15Å; C235-A246 PolarHBondContact O-N 2.91Å; A246-L257 HydrophobicContact CB-CB 3.66Å; A246-A258 HydrophobicContact CB-CB 4.03Å; A246-K261 HydrophobicContact CB-CD 4.49Å
247	I	90.5	Very high	86.9	Confident	93 Å²	93	62.5 Å²	62.5	48%	0.477	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	135.6	-179.4	-60.2	169.5	0	0	0	109.9	L228 K232 V233	L228-I247 HydrophobicContact CD1-CD1 4.03Å; L228-I247 HydrophobicContact CD1-CG1 4.2Å; L228-I247 HydrophobicContact CD1-CG2 3.65Å; K232-I247 HydrophobicContact CB-CG2 3.94Å; K232-I247 HydrophobicContact CD-CG2 3.9Å; V233-I247 WeakPolarHBondContact O-CA 3.07Å
248	S	87.4	Confident	86.9	Confident	8 Å²	8	62.5 Å²	62.5	6%	0.056	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	163.3	178.2	-144	0	0	0	0	114.4	V233 G250 R253	V233-S248 PolarHBondContact N-O 3.19Å; V233-S248 PolarHBondContact O-N 2.84Å; S248-G250 PolarHBondContact O-N 2.87Å; S248-R253 VanDerWaalsContact OG-CD 3.24Å; S248-R253 WeakPolarHBondContact OG-CD 3.49Å; S248-R253 VanDerWaalsContact OG-CG 3.31Å; S248-R253 WeakPolarHBondContact OG-CG 3.5Å
249	D	81.8	Confident	86.9	Confident	71 Å²	71	61 Å²	61	38%	0.38	31%	0.305	S	S	.	.	S	Bend	trans	-75.4	35.2	-175	-40.1	-52.3	0	0	0	114	K232 R253 R303	K232-D249 WeakPolarHBondContact CD-OD1 3.45Å; K232-D249 WeakPolarHBondContact CE-OD1 3.23Å; K232-D249 WeakPolarHBondContact CG-OD1 3.4Å; D249-R253 IonicContact OD2-NH1 3.6Å; D249-R303 PolarHBondContact O-NH1 3Å; D249-R303 PolarHBondContact O-NH2 2.64Å
250	G	80.4	Confident	87	Confident	20 Å²	20	62.6 Å²	62.6	21%	0.206	31%	0.312	C	S	.	.	S	Bend	trans	158.2	143.5	177.8	0	0	0	0	0	114.4	S248 K252 R253 A254	S248-G250 PolarHBondContact O-N 2.87Å; G250-K252 PolarHBondContact O-N 3.3Å; G250-R253 PolarHBondContact O-N 3.2Å; G250-A254 PolarHBondContact O-N 3.18Å
251	R	84.4	Confident	87.4	Confident	177 Å²	177	65 Å²	65	67%	0.668	31%	0.314	S	S	*	.	H	α-helix	trans	-49	-46	-174.1	-65.1	177	176	-177.1	-3.2	114.7	L225 V233 R253 K255	L225-R251 HydrophobicContact CD1-CB 4.22Å; L225-R251 HydrophobicContact CD1-CG 4.17Å; V233-R251 HydrophobicContact CG1-CG 4.05Å; V233-R251 HydrophobicContact CG2-CG 4.17Å; R251-R253 VanDerWaalsContact C-N 3.34Å; R251-R253 PolarHBondContact O-N 3.21Å; R251-K255 PolarHBondContact O-N 3.17Å
252	K	83.6	Confident	87.8	Confident	133 Å²	133	55.7 Å²	55.7	58%	0.578	27%	0.27	S	S	*	.	H	α-helix	trans	-66.6	-32.5	-178.4	-163.9	164	-176.6	163.7	0	112.1	D40 G250 N256	D40-K252 IonicContact OD1-NZ 2.96Å; D40-K252 PolarHBondContact OD1-NZ 3.17Å; D40-K252 IonicContact OD2-NZ 2.7Å; D40-K252 PolarHBondContact OD2-NZ 3.33Å; G250-K252 PolarHBondContact O-N 3.3Å; K252-N256 PolarHBondContact O-N 3.21Å
253	R	81.3	Confident	87.7	Confident	98 Å²	98	51 Å²	51	37%	0.37	25%	0.245	S	C	.	.	H	α-helix	trans	-79.6	-42.4	177.3	-163.1	175.7	-175.2	-167.8	12.8	111.7	S248 D249 G250 R251 N256 L257 K302	S248-R253 VanDerWaalsContact OG-CD 3.24Å; S248-R253 WeakPolarHBondContact OG-CD 3.49Å; S248-R253 VanDerWaalsContact OG-CG 3.31Å; S248-R253 WeakPolarHBondContact OG-CG 3.5Å; D249-R253 IonicContact OD2-NH1 3.6Å; G250-R253 PolarHBondContact O-N 3.2Å; R251-R253 VanDerWaalsContact C-N 3.34Å; R251-R253 PolarHBondContact O-N 3.21Å; R253-N256 PolarHBondContact O-N 2.95Å; R253-L257 HydrophobicContact CG-CD1 4.1Å; R253-L257 WeakPolarHBondContact O-CB 3.28Å; R253-L257 WeakPolarHBondContact O-CG 3.4Å; R253-L257 PolarHBondContact O-N 3.28Å; R253-K302 PolarHBondContact NH2-O 2.93Å; R253-K302 VanDerWaalsContact NH2-O 3.16Å
254	A	87	Confident	87.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.8	-46.6	174.6	0	0	0	0	0	112	V233 C235 G250 N256 L257 A258	V233-A254 HydrophobicContact CB-CB 4.41Å; V233-A254 HydrophobicContact CG1-CB 4.28Å; V233-A254 WeakPolarHBondContact O-CB 3.37Å; C235-A254 HydrophobicContact CB-CB 3.76Å; G250-A254 PolarHBondContact O-N 3.18Å; A254-N256 PolarHBondContact O-N 3.43Å; A254-L257 PolarHBondContact O-N 3.49Å; A254-A258 WeakPolarHBondContact O-CB 3.5Å; A254-A258 PolarHBondContact O-N 3.43Å
255	K	89.4	Confident	87.3	Confident	47 Å²	47	56.1 Å²	56.1	20%	0.204	26%	0.264	C	S	.	.	H	α-helix	trans	-58	-48.2	173.6	-78	-154.4	172.7	-158.7	0	112.7	C205 F223 L225 R251 A258 A259	C205-K255 VanDerWaalsContact SG-C 3.56Å; C205-K255 PolarHBondContact SG-O 2.78Å; F223-K255 HydrophobicContact CB-CD 4.27Å; F223-K255 HydrophobicContact CD1-CB 4.13Å; F223-K255 HydrophobicContact CD1-CD 3.81Å; F223-K255 HydrophobicContact CD1-CG 3.82Å; F223-K255 HydrophobicContact CE1-CB 4.19Å; F223-K255 HydrophobicContact CE1-CD 4.32Å; F223-K255 HydrophobicContact CE1-CG 4.36Å; F223-K255 HydrophobicContact CG-CD 4.14Å; L225-K255 HydrophobicContact CD1-CG 4.44Å; L225-K255 HydrophobicContact CD2-CG 4.16Å; R251-K255 PolarHBondContact O-N 3.17Å; K255-A258 PolarHBondContact O-N 2.92Å; K255-A259 WeakPolarHBondContact O-CB 3.5Å; K255-A259 PolarHBondContact O-N 3.42Å
256	N	86.6	Confident	87	Confident	49 Å²	49	53.4 Å²	53.4	26%	0.262	25%	0.252	S	S	.	.	H	α-helix	trans	-62.5	-44.2	-179.7	-82.2	-2.3	0	0	0	112.2	C205 K252 R253 A254 A259 E260	C205-N256 PolarHBondContact SG-OD1 3.32Å; K252-N256 PolarHBondContact O-N 3.21Å; R253-N256 PolarHBondContact O-N 2.95Å; A254-N256 PolarHBondContact O-N 3.43Å; N256-A259 PolarHBondContact O-N 2.92Å; N256-E260 WeakPolarHBondContact O-CB 3.48Å; N256-E260 PolarHBondContact O-N 3.47Å
257	L	87	Confident	86.5	Confident	61 Å²	61	54.9 Å²	54.9	32%	0.319	26%	0.259	S	S	.	.	H	α-helix	trans	-65.8	-37.6	177.9	-71.1	168.4	0	0	0	112.3	A246 R253 A254 A259 E260 K261	A246-L257 HydrophobicContact CB-CB 3.66Å; R253-L257 HydrophobicContact CG-CD1 4.1Å; R253-L257 WeakPolarHBondContact O-CB 3.28Å; R253-L257 WeakPolarHBondContact O-CG 3.4Å; R253-L257 PolarHBondContact O-N 3.28Å; A254-L257 PolarHBondContact O-N 3.49Å; L257-A259 VanDerWaalsContact C-N 3.35Å; L257-E260 PolarHBondContact O-N 2.7Å; L257-K261 WeakPolarHBondContact O-CB 3.33Å; L257-K261 PolarHBondContact O-N 3.48Å
258	A	91.3	Very high	86.1	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.2	-38	173.8	0	0	0	0	0	111.6	C235 L237 V244 A246 A254 K255 A262	C235-A258 HydrophobicContact CB-CB 4.16Å; L237-A258 HydrophobicContact CB-CB 3.88Å; L237-A258 HydrophobicContact CD1-CB 4.11Å; V244-A258 VanDerWaalsContact CG2-O 3.32Å; V244-A258 WeakPolarHBondContact CG2-O 3.47Å; A246-A258 HydrophobicContact CB-CB 4.03Å; A254-A258 WeakPolarHBondContact O-CB 3.5Å; A254-A258 PolarHBondContact O-N 3.43Å; K255-A258 PolarHBondContact O-N 2.92Å; A258-A262 WeakPolarHBondContact O-CB 3.49Å; A258-A262 PolarHBondContact O-N 3.46Å
259	A	90.8	Very high	85.7	Confident	0 Å²	0	59 Å²	59	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-69.2	-36.5	174.6	0	0	0	0	0	113	P204 C205 L208 F223 L237 K255 N256 L257 A262 L263	P204-A259 HydrophobicContact CB-CB 4.05Å; C205-A259 HydrophobicContact CB-CB 4.37Å; L208-A259 HydrophobicContact CB-CB 4.46Å; L208-A259 HydrophobicContact CD2-CB 3.97Å; F223-A259 HydrophobicContact CE1-CB 4.32Å; F223-A259 HydrophobicContact CZ-CB 4.43Å; L237-A259 HydrophobicContact CD1-CB 4Å; K255-A259 WeakPolarHBondContact O-CB 3.5Å; K255-A259 PolarHBondContact O-N 3.42Å; N256-A259 PolarHBondContact O-N 2.92Å; L257-A259 VanDerWaalsContact C-N 3.35Å; A259-A262 PolarHBondContact O-N 3.49Å; A259-L263 WeakPolarHBondContact O-CD1 3.22Å; A259-L263 VanDerWaalsContact O-CG 3.27Å; A259-L263 WeakPolarHBondContact O-CG 3.17Å; A259-L263 PolarHBondContact O-N 3.45Å
260	E	87.4	Confident	85.6	Confident	51 Å²	51	60.9 Å²	60.9	24%	0.238	28%	0.28	C	S	.	.	H	α-helix	trans	-67.1	-43.6	175.9	-164.2	151.2	-117.9	0	0	111.4	P204 N256 L257 A262 L263 L264 R281	P204-E260 HydrophobicContact CB-CB 4.41Å; N256-E260 WeakPolarHBondContact O-CB 3.48Å; N256-E260 PolarHBondContact O-N 3.47Å; L257-E260 PolarHBondContact O-N 2.7Å; E260-A262 PolarHBondContact O-N 3Å; E260-L263 PolarHBondContact O-N 3.03Å; E260-L264 PolarHBondContact O-N 2.97Å; E260-L264 VanDerWaalsContact O-N 3.17Å; E260-R281 IonicContact OE1-NH2 3.25Å
261	K	90.3	Very high	85.6	Confident	82 Å²	82	63.4 Å²	63.4	36%	0.357	29%	0.293	S	S	.	.	H	α-helix	trans	-57.4	-45.1	165.6	-79.1	-167.7	166.4	-164.6	0	112.6	V244 E245 A246 L257 L263 L264 E265	V244-K261 HydrophobicContact CB-CB 4.12Å; V244-K261 HydrophobicContact CB-CD 4.48Å; V244-K261 HydrophobicContact CG1-CB 4.45Å; V244-K261 HydrophobicContact CG2-CB 3.98Å; E245-K261 WeakPolarHBondContact O-CD 3.48Å; E245-K261 WeakPolarHBondContact O-CE 3.35Å; E245-K261 PolarHBondContact O-NZ 3.15Å; A246-K261 HydrophobicContact CB-CD 4.49Å; L257-K261 WeakPolarHBondContact O-CB 3.33Å; L257-K261 PolarHBondContact O-N 3.48Å; K261-L263 VanDerWaalsContact C-N 3.31Å; K261-L263 PolarHBondContact O-N 2.86Å; K261-L264 PolarHBondContact O-N 2.82Å; K261-E265 WeakPolarHBondContact CD-OE1 3.45Å; K261-E265 VanDerWaalsContact CG-OE1 3.29Å; K261-E265 WeakPolarHBondContact CG-OE1 3.22Å; K261-E265 VanDerWaalsContact O-CB 3.3Å; K261-E265 WeakPolarHBondContact O-CB 3.47Å; K261-E265 WeakPolarHBondContact O-CG 3.38Å; K261-E265 PolarHBondContact O-N 2.91Å
262	A	89.4	Confident	85.3	Confident	0 Å²	0	60 Å²	60	0%	0	29%	0.291	C	S	.	.	I	π-helix	trans	-64.9	-34.7	-179.2	0	0	0	0	0	112.6	L208 L237 I239 V244 A258 A259 E260 L266 L267	L208-A262 HydrophobicContact CD1-CB 3.88Å; L208-A262 HydrophobicContact CD2-CB 4.03Å; L237-A262 HydrophobicContact CD1-CB 4.09Å; L237-A262 HydrophobicContact CD2-CB 4.13Å; I239-A262 HydrophobicContact CD1-CB 4.02Å; V244-A262 HydrophobicContact CG2-CB 3.89Å; A258-A262 WeakPolarHBondContact O-CB 3.49Å; A258-A262 PolarHBondContact O-N 3.46Å; A259-A262 PolarHBondContact O-N 3.49Å; E260-A262 PolarHBondContact O-N 3Å; A262-L266 HydrophobicContact CB-CD1 4.2Å; A262-L266 HydrophobicContact CB-CG 4.47Å; A262-L266 WeakPolarHBondContact O-CA 3.3Å; A262-L266 WeakPolarHBondContact O-CB 3.4Å; A262-L266 PolarHBondContact O-N 3.19Å; A262-L266 VanDerWaalsContact O-N 3.11Å; A262-L267 PolarHBondContact O-N 2.74Å
263	L	87.1	Confident	85	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	27%	0.271	C	S	.	.	I	π-helix	trans	-63.7	-43.3	173.2	-71.6	160	0	0	0	111.5	P204 L207 L208 L211 A259 E260 K261 L267 K268 V269 L274	P204-L263 HydrophobicContact CB-CD1 4.15Å; L207-L263 HydrophobicContact CD2-CD1 3.73Å; L207-L263 HydrophobicContact CD2-CD2 4.16Å; L207-L263 HydrophobicContact CG-CD1 4.22Å; L207-L263 HydrophobicContact CG-CD2 4.08Å; L208-L263 HydrophobicContact CB-CD2 4.44Å; L208-L263 HydrophobicContact CB-CG 4.49Å; L208-L263 HydrophobicContact CD1-CD2 3.98Å; L208-L263 HydrophobicContact CD1-CG 3.96Å; L211-L263 HydrophobicContact CD1-CD2 3.62Å; A259-L263 WeakPolarHBondContact O-CD1 3.22Å; A259-L263 VanDerWaalsContact O-CG 3.27Å; A259-L263 WeakPolarHBondContact O-CG 3.17Å; A259-L263 PolarHBondContact O-N 3.45Å; E260-L263 PolarHBondContact O-N 3.03Å; K261-L263 VanDerWaalsContact C-N 3.31Å; K261-L263 PolarHBondContact O-N 2.86Å; L263-L267 HydrophobicContact CD2-CD1 4.29Å; L263-L267 CarbonylContact O-C 3.5Å; L263-K268 PolarHBondContact O-N 3.16Å; L263-K268 VanDerWaalsContact O-N 3.08Å; L263-V269 HydrophobicContact CB-CG2 4.33Å; L263-V269 HydrophobicContact CD2-CG2 4.04Å; L263-V269 WeakPolarHBondContact O-CB 3.12Å; L263-V269 WeakPolarHBondContact O-CG2 3.46Å; L263-V269 PolarHBondContact O-N 3.44Å; L263-L274 HydrophobicContact CB-CD1 4.06Å; L263-L274 HydrophobicContact CB-CD2 4.2Å; L263-L274 HydrophobicContact CD1-CD2 3.97Å
264	L	86.1	Confident	84.8	Confident	75 Å²	75	51.3 Å²	51.3	39%	0.393	26%	0.256	S	S	.	.	I	π-helix	trans	-74.7	-54	179.2	-72.6	166	0	0	0	113.5	E260 K261 K268 P271 L274	E260-L264 PolarHBondContact O-N 2.97Å; E260-L264 VanDerWaalsContact O-N 3.17Å; K261-L264 PolarHBondContact O-N 2.82Å; L264-K268 WeakPolarHBondContact O-CA 3.16Å; L264-K268 PolarHBondContact O-N 2.88Å; L264-P271 HydrophobicContact CD2-CB 4.33Å; L264-P271 HydrophobicContact CD2-CG 3.93Å; L264-L274 HydrophobicContact CD2-CD1 3.62Å; L264-L274 HydrophobicContact CG-CD1 3.7Å
265	E	87.6	Confident	84.4	Confident	101 Å²	101	56.9 Å²	56.9	47%	0.472	28%	0.282	S	S	.	.	I	π-helix	trans	-84.3	-44.2	-168.1	-61	173.2	-145.4	0	0	111.9	V244 K261	V244-E265 HydrophobicContact CG1-CB 4.11Å; V244-E265 VanDerWaalsContact CG1-OE2 3.32Å; V244-E265 WeakPolarHBondContact CG1-OE2 3.5Å; K261-E265 WeakPolarHBondContact CD-OE1 3.45Å; K261-E265 VanDerWaalsContact CG-OE1 3.29Å; K261-E265 WeakPolarHBondContact CG-OE1 3.22Å; K261-E265 VanDerWaalsContact O-CB 3.3Å; K261-E265 WeakPolarHBondContact O-CB 3.47Å; K261-E265 WeakPolarHBondContact O-CG 3.38Å; K261-E265 PolarHBondContact O-N 2.91Å
266	L	85.4	Confident	83.9	Confident	45 Å²	45	60.4 Å²	60.4	24%	0.236	30%	0.297	C	S	.	.	I	π-helix	trans	-92.6	-47.7	-173.5	-52.4	-173.3	0	0	0	112.6	I239 N242 V244 A262	I239-L266 HydrophobicContact CB-CD1 4.2Å; I239-L266 HydrophobicContact CD1-CD1 4.05Å; I239-L266 HydrophobicContact CG1-CD1 4.07Å; N242-L266 HydrophobicContact CB-CD1 4.25Å; N242-L266 HydrophobicContact CB-CD2 3.65Å; V244-L266 HydrophobicContact CG1-CD1 4.08Å; V244-L266 HydrophobicContact CG1-CD2 3.92Å; V244-L266 HydrophobicContact CG1-CG 3.83Å; V244-L266 HydrophobicContact CG2-CD1 4.48Å; A262-L266 HydrophobicContact CB-CD1 4.2Å; A262-L266 HydrophobicContact CB-CG 4.47Å; A262-L266 WeakPolarHBondContact O-CA 3.3Å; A262-L266 WeakPolarHBondContact O-CB 3.4Å; A262-L266 PolarHBondContact O-N 3.19Å; A262-L266 VanDerWaalsContact O-N 3.11Å
267	L	81	Confident	83.4	Confident	40 Å²	40	58.2 Å²	58.2	21%	0.209	29%	0.286	C	S	.	.	S	Bend	trans	-90.9	-10.6	-179.8	-64.1	-174.4	0	0	0	114.2	L208 L211 A262 L263 V269	L208-L267 HydrophobicContact CD1-CD1 3.6Å; L208-L267 HydrophobicContact CD1-CG 4.33Å; L211-L267 HydrophobicContact CB-CD1 4.16Å; L211-L267 HydrophobicContact CD1-CD1 4.44Å; A262-L267 PolarHBondContact O-N 2.74Å; L263-L267 HydrophobicContact CD2-CD1 4.29Å; L263-L267 CarbonylContact O-C 3.5Å; L267-V269 VanDerWaalsContact C-N 3.28Å; L267-V269 HydrophobicContact CB-CG2 4.13Å; L267-V269 PolarHBondContact O-N 3.36Å
268	K	82.5	Confident	83.1	Confident	169 Å²	169	58 Å²	58	74%	0.735	28%	0.283	S	S	*	.			trans	56.4	39.3	175.2	-54.9	-178.9	-175.7	178.6	0	113.4	L263 L264	L263-K268 PolarHBondContact O-N 3.16Å; L263-K268 VanDerWaalsContact O-N 3.08Å; L264-K268 WeakPolarHBondContact O-CA 3.16Å; L264-K268 PolarHBondContact O-N 2.88Å
269	V	79.7	Confident	82.4	Confident	19 Å²	19	59.7 Å²	59.7	12%	0.115	30%	0.295	C	S	.	.			trans	-68.6	137.1	172.6	-177.4	0	0	0	0	109.3	L211 L263 L267 W273 L274	L211-V269 HydrophobicContact CD1-CG2 4.42Å; L263-V269 HydrophobicContact CB-CG2 4.33Å; L263-V269 HydrophobicContact CD2-CG2 4.04Å; L263-V269 WeakPolarHBondContact O-CB 3.12Å; L263-V269 WeakPolarHBondContact O-CG2 3.46Å; L263-V269 PolarHBondContact O-N 3.44Å; L267-V269 VanDerWaalsContact C-N 3.28Å; L267-V269 HydrophobicContact CB-CG2 4.13Å; L267-V269 PolarHBondContact O-N 3.36Å; V269-W273 HydrophobicContact CG1-CD2 4.38Å; V269-W273 HydrophobicContact CG1-CE3 3.54Å; V269-W273 HydrophobicContact CG1-CZ3 4.11Å; V269-L274 HydrophobicContact CB-CD1 4.3Å; V269-L274 HydrophobicContact CB-CG 4.44Å; V269-L274 HydrophobicContact CG1-CD1 4.26Å; V269-L274 HydrophobicContact CG1-CD2 4Å; V269-L274 HydrophobicContact CG1-CG 3.87Å
270	E	79.8	Confident	81.6	Confident	110 Å²	110	62.1 Å²	62.1	51%	0.514	31%	0.307	S	S	.	.			trans	-62.5	130.5	-178.1	-66.5	179.8	174.4	0	0	111.7	V272 W273 L274	E270-V272 VanDerWaalsContact C-N 3.32Å; E270-V272 PolarHBondContact O-N 2.92Å; E270-W273 HydrophobicContact CB-CB 4.31Å; E270-W273 WeakPolarHBondContact O-CB 3.22Å; E270-W273 PolarHBondContact O-N 3.47Å; E270-L274 PolarHBondContact O-N 2.87Å
271	P	79.5	Confident	81.3	Confident	74 Å²	74	62 Å²	62	48%	0.481	30%	0.304	S	S	.	.	H	α-helix	trans	-54.7	-44.2	-179.1	-28.1	34.7	0	0	0	113.5	L264 W273 L274 E275	L264-P271 HydrophobicContact CD2-CB 4.33Å; L264-P271 HydrophobicContact CD2-CG 3.93Å; P271-W273 PolarHBondContact O-N 2.89Å; P271-L274 CarbonylContact O-C 3.58Å; P271-L274 WeakPolarHBondContact O-CA 3.28Å; P271-L274 WeakPolarHBondContact O-CB 3.48Å; P271-L274 PolarHBondContact O-N 3.46Å; P271-E275 WeakPolarHBondContact O-CG 3.27Å; P271-E275 PolarHBondContact O-N 3.25Å
272	V	77.9	Confident	80.9	Confident	104 Å²	104	58.8 Å²	58.8	63%	0.63	29%	0.29	S	S	*	.	H	α-helix	trans	-57.4	-32.6	177.9	-175.8	0	0	0	0	112.2	E270 K276	E270-V272 VanDerWaalsContact C-N 3.32Å; E270-V272 PolarHBondContact O-N 2.92Å; V272-K276 WeakPolarHBondContact O-CB 3.33Å; V272-K276 PolarHBondContact O-N 3.43Å
273	W	78	Confident	80.4	Confident	39 Å²	39	63.4 Å²	63.4	15%	0.148	31%	0.308	C	S	.	.	H	α-helix	trans	-75.2	-36.3	176.5	-171.3	91.6	0	0	0	111.7	P195 L207 V269 E270 P271 K276 C277	P195-W273 HydrophobicContact CB-CH2 4.31Å; P195-W273 HydrophobicContact CB-CZ2 3.9Å; P195-W273 VanDerWaalsContact CD-CZ2 3.45Å; P195-W273 HydrophobicContact CG-CH2 3.66Å; P195-W273 HydrophobicContact CG-CZ2 3.46Å; P195-W273 VanDerWaalsContact CG-CZ2 3.46Å; P195-W273 HydrophobicContact CG-CZ3 4.39Å; L207-W273 HydrophobicContact CD1-CH2 3.78Å; L207-W273 HydrophobicContact CD1-CZ3 4.12Å; L207-W273 HydrophobicContact CD2-CH2 4.18Å; L207-W273 HydrophobicContact CD2-CZ3 3.79Å; V269-W273 HydrophobicContact CG1-CD2 4.38Å; V269-W273 HydrophobicContact CG1-CE3 3.54Å; V269-W273 HydrophobicContact CG1-CZ3 4.11Å; E270-W273 HydrophobicContact CB-CB 4.31Å; E270-W273 WeakPolarHBondContact O-CB 3.22Å; E270-W273 PolarHBondContact O-N 3.47Å; P271-W273 PolarHBondContact O-N 2.89Å; W273-K276 PolarHBondContact O-N 3.39Å; W273-C277 WeakPolarHBondContact CH2-SG 3.49Å; W273-C277 VanDerWaalsContact CZ2-SG 3.54Å; W273-C277 WeakPolarHBondContact CZ3-SG 3.42Å; W273-C277 PolarHBondContact O-N 2.82Å; W273-C277 PolarHBondContact O-SG 2.93Å
274	L	78.1	Confident	79.8	Confident	11 Å²	11	65.7 Å²	65.7	6%	0.058	33%	0.327	C	S	.	.	H	α-helix	trans	-70.2	-39.2	174.2	-67.3	171.3	0	0	0	112.4	L207 L263 L264 V269 E270 P271 K276 C277 E278	L207-L274 HydrophobicContact CD2-CD2 4.1Å; L263-L274 HydrophobicContact CB-CD1 4.06Å; L263-L274 HydrophobicContact CB-CD2 4.2Å; L263-L274 HydrophobicContact CD1-CD2 3.97Å; L264-L274 HydrophobicContact CD2-CD1 3.62Å; L264-L274 HydrophobicContact CG-CD1 3.7Å; V269-L274 HydrophobicContact CB-CD1 4.3Å; V269-L274 HydrophobicContact CB-CG 4.44Å; V269-L274 HydrophobicContact CG1-CD1 4.26Å; V269-L274 HydrophobicContact CG1-CD2 4Å; V269-L274 HydrophobicContact CG1-CG 3.87Å; E270-L274 PolarHBondContact O-N 2.87Å; P271-L274 CarbonylContact O-C 3.58Å; P271-L274 WeakPolarHBondContact O-CA 3.28Å; P271-L274 WeakPolarHBondContact O-CB 3.48Å; P271-L274 PolarHBondContact O-N 3.46Å; L274-K276 VanDerWaalsContact C-N 3.32Å; L274-K276 PolarHBondContact O-N 3.28Å; L274-C277 CarbonylContact O-C 3.57Å; L274-C277 PolarHBondContact O-N 2.87Å; L274-C277 VanDerWaalsContact O-N 3.15Å; L274-E278 PolarHBondContact O-N 3.21Å
275	E	78.5	Confident	79.3	Confident	117 Å²	117	62.8 Å²	62.8	55%	0.547	31%	0.314	S	S	.	.	H	α-helix	trans	-58.4	-43.2	170.5	-71.8	165.4	-171.3	0	0	111.1	P271 E278 S279	P271-E275 WeakPolarHBondContact O-CG 3.27Å; P271-E275 PolarHBondContact O-N 3.25Å; E275-E278 PolarHBondContact O-N 2.91Å; E275-S279 WeakPolarHBondContact O-CB 3.49Å; E275-S279 PolarHBondContact O-N 3.32Å; E275-S279 PolarHBondContact O-OG 2.86Å
276	K	77.8	Confident	79	Confident	121 Å²	121	58 Å²	58	53%	0.526	29%	0.291	S	S	.	.	H	α-helix	trans	-62.3	-42.7	172.9	-166.5	-171.6	-177.3	-140.9	0	111.7	V272 W273 L274 E278 S279 E280	V272-K276 WeakPolarHBondContact O-CB 3.33Å; V272-K276 PolarHBondContact O-N 3.43Å; W273-K276 PolarHBondContact O-N 3.39Å; L274-K276 VanDerWaalsContact C-N 3.32Å; L274-K276 PolarHBondContact O-N 3.28Å; K276-E278 VanDerWaalsContact C-N 3.33Å; K276-E278 PolarHBondContact O-N 3.32Å; K276-S279 WeakPolarHBondContact O-CB 3.44Å; K276-S279 PolarHBondContact O-N 3.01Å; K276-E280 WeakPolarHBondContact CE-OE1 3.41Å; K276-E280 IonicContact NZ-OE1 3.71Å; K276-E280 PolarHBondContact NZ-OE1 3.38Å; K276-E280 WeakPolarHBondContact O-CG 3.27Å; K276-E280 PolarHBondContact O-N 3.01Å
277	C	76.8	Confident	78.3	Confident	3 Å²	3	60.3 Å²	60.3	2%	0.02	30%	0.303	C	S	.	.	H	α-helix	trans	-67.8	-30.4	175.9	-64.1	0	0	0	0	112.7	G200 W273 L274 R281	G200-C277 WeakPolarHBondContact CA-SG 3.38Å; W273-C277 WeakPolarHBondContact CH2-SG 3.49Å; W273-C277 VanDerWaalsContact CZ2-SG 3.54Å; W273-C277 WeakPolarHBondContact CZ3-SG 3.42Å; W273-C277 PolarHBondContact O-N 2.82Å; W273-C277 PolarHBondContact O-SG 2.93Å; L274-C277 CarbonylContact O-C 3.57Å; L274-C277 PolarHBondContact O-N 2.87Å; L274-C277 VanDerWaalsContact O-N 3.15Å; C277-R281 WeakPolarHBondContact O-CB 3.43Å; C277-R281 VanDerWaalsContact O-CG 3.28Å; C277-R281 WeakPolarHBondContact O-CG 3.39Å; C277-R281 PolarHBondContact O-N 3.42Å; C277-R281 PolarHBondContact O-NE 3.37Å
278	E	79.5	Confident	77.6	Confident	55 Å²	55	59.1 Å²	59.1	26%	0.257	30%	0.301	S	S	.	.	H	α-helix	trans	-69.3	-40.2	169.7	-148.2	-152.4	127.1	0	0	111.4	L274 E275 K276 R281 N282 K302	L274-E278 PolarHBondContact O-N 3.21Å; E275-E278 PolarHBondContact O-N 2.91Å; K276-E278 VanDerWaalsContact C-N 3.33Å; K276-E278 PolarHBondContact O-N 3.32Å; E278-R281 VanDerWaalsContact CA-NH2 3.31Å; E278-R281 WeakPolarHBondContact O-CB 3.19Å; E278-R281 PolarHBondContact O-N 3.47Å; E278-N282 WeakPolarHBondContact O-CB 3.33Å; E278-N282 PolarHBondContact O-N 3.49Å; E278-N282 PolarHBondContact O-ND2 3.29Å; E278-N282 PolarHBondContact OE1-ND2 3.33Å; E278-K302 WeakPolarHBondContact OE1-CE 3.48Å; E278-K302 IonicContact OE1-NZ 2.7Å; E278-K302 PolarHBondContact OE1-NZ 2.86Å; E278-K302 IonicContact OE2-NZ 3.2Å
279	S	77.7	Confident	77.4	Confident	37 Å²	37	53.3 Å²	53.3	26%	0.259	28%	0.278	S	S	.	.	H	α-helix	trans	-61.2	-45.4	175	-55.7	0	0	0	0	111.7	E275 K276 N282 R283	E275-S279 WeakPolarHBondContact O-CB 3.49Å; E275-S279 PolarHBondContact O-N 3.32Å; E275-S279 PolarHBondContact O-OG 2.86Å; K276-S279 WeakPolarHBondContact O-CB 3.44Å; K276-S279 PolarHBondContact O-N 3.01Å; S279-N282 PolarHBondContact O-N 2.86Å; S279-R283 WeakPolarHBondContact O-CB 3.34Å; S279-R283 VanDerWaalsContact O-CG 3.23Å; S279-R283 WeakPolarHBondContact O-CG 3.48Å; S279-R283 PolarHBondContact O-N 3.06Å
280	E	74.2	Confident	77.5	Confident	51 Å²	51	55.1 Å²	55.1	24%	0.238	29%	0.289	C	S	.	.	H	α-helix	trans	-63	-42	174.8	-72.7	175.8	-165	0	0	111.4	G200 K276 A284	G200-E280 WeakPolarHBondContact CA-OE2 3.37Å; K276-E280 WeakPolarHBondContact CE-OE1 3.41Å; K276-E280 IonicContact NZ-OE1 3.71Å; K276-E280 PolarHBondContact NZ-OE1 3.38Å; K276-E280 WeakPolarHBondContact O-CG 3.27Å; K276-E280 PolarHBondContact O-N 3.01Å; E280-A284 WeakPolarHBondContact O-CB 3.42Å; E280-A284 PolarHBondContact O-N 2.85Å
281	R	80.2	Confident	77.8	Confident	48 Å²	48	49.9 Å²	49.9	18%	0.181	27%	0.265	C	S	.	.	H	α-helix	trans	-61.2	-45.7	171.5	-79.1	173.7	-75	156.7	-7.9	113.1	G200 K202 E260 C277 E278 A284 A285	G200-R281 WeakPolarHBondContact O-CG 3.5Å; K202-R281 WeakPolarHBondContact O-CD 3.17Å; E260-R281 IonicContact OE1-NH2 3.25Å; C277-R281 WeakPolarHBondContact O-CB 3.43Å; C277-R281 VanDerWaalsContact O-CG 3.28Å; C277-R281 WeakPolarHBondContact O-CG 3.39Å; C277-R281 PolarHBondContact O-N 3.42Å; C277-R281 PolarHBondContact O-NE 3.37Å; E278-R281 VanDerWaalsContact CA-NH2 3.31Å; E278-R281 WeakPolarHBondContact O-CB 3.19Å; E278-R281 PolarHBondContact O-N 3.47Å; R281-A284 PolarHBondContact O-N 3.1Å; R281-A285 VanDerWaalsContact O-CB 3.31Å; R281-A285 WeakPolarHBondContact O-CB 3.48Å; R281-A285 PolarHBondContact O-N 2.99Å
282	N	82.8	Confident	78.2	Confident	14 Å²	14	47 Å²	47	8%	0.075	25%	0.246	C	C	.	.	H	α-helix	trans	-65.2	-44.3	-178.8	-71.5	-25.4	0	0	0	110.4	E278 S279 A285 V286 L298 V355	E278-N282 WeakPolarHBondContact O-CB 3.33Å; E278-N282 PolarHBondContact O-N 3.49Å; E278-N282 PolarHBondContact O-ND2 3.29Å; E278-N282 PolarHBondContact OE1-ND2 3.33Å; S279-N282 PolarHBondContact O-N 2.86Å; N282-A285 PolarHBondContact O-N 3.04Å; N282-V286 PolarHBondContact O-N 3.02Å; N282-L298 HydrophobicContact CB-CD1 4.41Å; N282-L298 HydrophobicContact CB-CD2 4.31Å; N282-V355 HydrophobicContact CB-CG2 4.26Å
283	R	79.1	Confident	78.6	Confident	97 Å²	97	46.5 Å²	46.5	37%	0.366	24%	0.24	S	C	.	.	H	α-helix	trans	-56.7	-54.1	171.6	-72.9	171.9	-178.8	-132.7	-1.5	111.6	S279 A285 V286 L287 Y362	S279-R283 WeakPolarHBondContact O-CB 3.34Å; S279-R283 VanDerWaalsContact O-CG 3.23Å; S279-R283 WeakPolarHBondContact O-CG 3.48Å; S279-R283 PolarHBondContact O-N 3.06Å; R283-A285 PolarHBondContact O-N 3.44Å; R283-V286 VanDerWaalsContact O-CG2 3.26Å; R283-V286 WeakPolarHBondContact O-CG2 3.39Å; R283-V286 PolarHBondContact O-N 3.48Å; R283-L287 PolarHBondContact O-N 2.93Å; R283-Y362 HydrophobicContact CB-CE1 3.96Å; R283-Y362 VanDerWaalsContact CD-OH 3.27Å; R283-Y362 WeakPolarHBondContact CD-OH 3.33Å; R283-Y362 HydrophobicContact CG-CE1 3.85Å; R283-Y362 WeakPolarHBondContact CG-OH 3.36Å; R283-Y362 VanDerWaalsContact CZ-OH 3.28Å; R283-Y362 PolarHBondContact NE-OH 3.02Å; R283-Y362 PolarHBondContact NH1-OH 3.23Å
284	A	72.5	Confident	79	Confident	49 Å²	49	44.7 Å²	44.7	41%	0.405	23%	0.233	S	C	.	.	H	α-helix	trans	-59.9	-30.7	178.5	0	0	0	0	0	113.1	E280 R281	E280-A284 WeakPolarHBondContact O-CB 3.42Å; E280-A284 PolarHBondContact O-N 2.85Å; R281-A284 PolarHBondContact O-N 3.1Å
285	A	76.5	Confident	79.6	Confident	14 Å²	14	44.1 Å²	44.1	12%	0.116	23%	0.23	C	C	.	.	H	α-helix	trans	-74.1	-23.1	176	0	0	0	0	0	113.9	R281 N282 R283 K297 L298	R281-A285 VanDerWaalsContact O-CB 3.31Å; R281-A285 WeakPolarHBondContact O-CB 3.48Å; R281-A285 PolarHBondContact O-N 2.99Å; N282-A285 PolarHBondContact O-N 3.04Å; R283-A285 PolarHBondContact O-N 3.44Å; A285-K297 VanDerWaalsContact O-CD 3.31Å; A285-K297 WeakPolarHBondContact O-CD 3.23Å; A285-K297 WeakPolarHBondContact O-CE 3.4Å; A285-K297 PolarHBondContact O-NZ 2.73Å; A285-L298 HydrophobicContact CB-CD2 3.84Å
286	V	80.6	Confident	80.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-101.4	-14.1	-177.8	-60.7	0	0	0	0	115.3	N282 R283 G288 L289 A294 L298 V355 Y357 Y362	N282-V286 PolarHBondContact O-N 3.02Å; R283-V286 VanDerWaalsContact O-CG2 3.26Å; R283-V286 WeakPolarHBondContact O-CG2 3.39Å; R283-V286 PolarHBondContact O-N 3.48Å; V286-G288 PolarHBondContact O-N 3.18Å; V286-L289 WeakPolarHBondContact O-CB 3.35Å; V286-L289 PolarHBondContact O-N 3.01Å; V286-A294 HydrophobicContact CB-CB 3.73Å; V286-A294 HydrophobicContact CG1-CB 3.6Å; V286-L298 HydrophobicContact CG1-CD1 3.55Å; V286-L298 HydrophobicContact CG1-CD2 4.07Å; V286-L298 HydrophobicContact CG1-CG 3.66Å; V286-V355 HydrophobicContact CG2-CG1 3.95Å; V286-Y357 HydrophobicContact CB-CE2 4.39Å; V286-Y357 HydrophobicContact CG2-CE2 4.41Å; V286-Y362 HydrophobicContact CG2-CD1 4.01Å
287	L	72.2	Confident	80.5	Confident	94 Å²	94	41.3 Å²	41.3	49%	0.492	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.4	134.1	177.1	-75.4	172.3	0	0	0	112.2	R283 L289 E361 Y362	R283-L287 PolarHBondContact O-N 2.93Å; L287-L289 VanDerWaalsContact C-N 3.28Å; L287-L289 PolarHBondContact O-N 3.23Å; L287-E361 WeakPolarHBondContact CD2-O 3.49Å; L287-Y362 HydrophobicContact CD2-CD1 4.19Å; L287-Y362 HydrophobicContact CD2-CE1 4.5Å
288	G	65.6	Low	81.1	Confident	16 Å²	16	41.2 Å²	41.2	17%	0.165	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	7.5	177.5	0	0	0	0	0	116.1	V286 P365	V286-G288 PolarHBondContact O-N 3.18Å; G288-P365 WeakPolarHBondContact O-CB 3.46Å
289	L	78.4	Confident	81.5	Confident	47 Å²	47	38.6 Å²	38.6	25%	0.246	21%	0.206	C	C	.	.	S	Bend	trans	-97.8	179.2	174.9	-58.8	179.9	0	0	0	111.8	V286 L287 N293 A294 K297 Y357	V286-L289 WeakPolarHBondContact O-CB 3.35Å; V286-L289 PolarHBondContact O-N 3.01Å; L287-L289 VanDerWaalsContact C-N 3.28Å; L287-L289 PolarHBondContact O-N 3.23Å; L289-N293 HydrophobicContact CB-CB 4.32Å; L289-A294 HydrophobicContact CB-CB 4.25Å; L289-K297 HydrophobicContact CD1-CB 4.29Å; L289-K297 HydrophobicContact CD1-CD 3.49Å; L289-K297 VanDerWaalsContact CD1-CD 3.49Å; L289-Y357 PolarHBondContact O-OH 2.84Å
290	T	82.2	Confident	81.6	Confident	56 Å²	56	39.4 Å²	39.4	34%	0.344	22%	0.219	S	C	.	.			trans	-100.3	152.1	164.1	60.2	0	0	0	0	109.4	P292 N293 A294	T290-P292 VanDerWaalsContact C-CD 3.47Å; T290-P292 VanDerWaalsContact C-N 3.32Å; T290-P292 VanDerWaalsContact O-N 3.11Å; T290-N293 CarbonylContact O-C 3.41Å; T290-N293 WeakPolarHBondContact O-CA 3.07Å; T290-N293 WeakPolarHBondContact O-CB 3.31Å; T290-N293 PolarHBondContact O-N 3.45Å; T290-N293 PolarHBondContact OG1-ND2 2.91Å; T290-A294 PolarHBondContact O-N 3.11Å
291	A	85.9	Confident	81.8	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.008	23%	0.233	C	C	.	.	H	α-helix	trans	-49.6	-41.1	-175.7	0	0	0	0	0	114.8	N293 A294 L295 T342 M346 L349 Y357	A291-N293 PolarHBondContact O-N 3.21Å; A291-A294 PolarHBondContact O-N 3.28Å; A291-L295 WeakPolarHBondContact O-CB 3.17Å; A291-L295 PolarHBondContact O-N 3.42Å; A291-T342 HydrophobicContact CB-CG2 3.97Å; A291-M346 HydrophobicContact CB-CG 3.6Å; A291-L349 HydrophobicContact CB-CD1 4.03Å; A291-L349 WeakPolarHBondContact O-CD1 3.36Å; A291-Y357 HydrophobicContact CB-CD1 3.84Å; A291-Y357 HydrophobicContact CB-CE1 3.89Å; A291-Y357 HydrophobicContact CB-CG 4.17Å
292	P	88	Confident	81.7	Confident	13 Å²	13	43.2 Å²	43.2	8%	0.084	24%	0.238	C	C	.	.	H	α-helix	trans	-65.4	-36.1	174.3	-21.9	34.8	0	0	0	113.7	T290 M296 R341 S345	T290-P292 VanDerWaalsContact C-CD 3.47Å; T290-P292 VanDerWaalsContact C-N 3.32Å; T290-P292 VanDerWaalsContact O-N 3.11Å; P292-M296 WeakPolarHBondContact O-CB 3.44Å; P292-M296 WeakPolarHBondContact O-CG 3.31Å; P292-M296 PolarHBondContact O-N 2.91Å; P292-R341 HydrophobicContact CG-CG 4.33Å; P292-S345 WeakPolarHBondContact CA-OG 3.4Å
293	N	86.3	Confident	81.3	Confident	94 Å²	94	49.7 Å²	49.7	50%	0.503	26%	0.262	S	S	.	.	H	α-helix	trans	-76.1	-37.2	178.2	-71.2	-7.9	0	0	0	111.7	L289 T290 A291 M296 K297	L289-N293 HydrophobicContact CB-CB 4.32Å; T290-N293 CarbonylContact O-C 3.41Å; T290-N293 WeakPolarHBondContact O-CA 3.07Å; T290-N293 WeakPolarHBondContact O-CB 3.31Å; T290-N293 PolarHBondContact O-N 3.45Å; T290-N293 PolarHBondContact OG1-ND2 2.91Å; A291-N293 PolarHBondContact O-N 3.21Å; N293-M296 PolarHBondContact O-N 3.48Å; N293-K297 VanDerWaalsContact O-CB 3.32Å; N293-K297 WeakPolarHBondContact O-CB 3.24Å; N293-K297 PolarHBondContact O-N 3.46Å
294	A	87	Confident	81.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.4	-50.6	171.4	0	0	0	0	0	111.2	V286 L289 T290 A291 K297 L298 L349 Y357	V286-A294 HydrophobicContact CB-CB 3.73Å; V286-A294 HydrophobicContact CG1-CB 3.6Å; L289-A294 HydrophobicContact CB-CB 4.25Å; T290-A294 PolarHBondContact O-N 3.11Å; A291-A294 PolarHBondContact O-N 3.28Å; A294-K297 PolarHBondContact O-N 3.36Å; A294-L298 PolarHBondContact O-N 2.96Å; A294-L349 HydrophobicContact CB-CD1 3.91Å; A294-L349 HydrophobicContact CB-CD2 4.45Å; A294-Y357 HydrophobicContact CB-CE2 3.71Å
295	L	90.6	Very high	82	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59	-51	175.6	-176	68.6	0	0	0	111.4	A291 K297 L298 C299 V306 F308 V326 A348 L349 F353	A291-L295 WeakPolarHBondContact O-CB 3.17Å; A291-L295 PolarHBondContact O-N 3.42Å; L295-K297 PolarHBondContact O-N 3.22Å; L295-L298 PolarHBondContact O-N 3.45Å; L295-C299 VanDerWaalsContact O-CB 3.25Å; L295-C299 WeakPolarHBondContact O-CB 3.11Å; L295-C299 PolarHBondContact O-N 3.38Å; L295-C299 PolarHBondContact O-SG 2.95Å; L295-V306 HydrophobicContact CD2-CG1 4.45Å; L295-F308 HydrophobicContact CD2-CZ 4.23Å; L295-V326 HydrophobicContact CD1-CG2 4.48Å; L295-V326 HydrophobicContact CD2-CG2 4.1Å; L295-A348 HydrophobicContact CD1-CB 3.8Å; L295-A348 HydrophobicContact CD2-CB 3.87Å; L295-L349 HydrophobicContact CB-CD1 4.49Å; L295-L349 HydrophobicContact CB-CD2 4.21Å; L295-L349 HydrophobicContact CB-CG 4.16Å; L295-L349 HydrophobicContact CD1-CD2 4.17Å; L295-L349 HydrophobicContact CD1-CG 4.21Å; L295-F353 HydrophobicContact CD1-CD2 4.22Å; L295-F353 HydrophobicContact CD1-CE2 3.8Å
296	M	89	Confident	82.7	Confident	91 Å²	91	50.4 Å²	50.4	45%	0.448	27%	0.27	S	S	.	.	H	α-helix	trans	-58.5	-34.5	177.9	-72.1	-67.9	-59.4	0	0	112.8	P292 N293 G300 V306 F308	P292-M296 WeakPolarHBondContact O-CB 3.44Å; P292-M296 WeakPolarHBondContact O-CG 3.31Å; P292-M296 PolarHBondContact O-N 2.91Å; N293-M296 PolarHBondContact O-N 3.48Å; M296-G300 PolarHBondContact O-N 3.35Å; M296-V306 HydrophobicContact SD-CB 3.86Å; M296-V306 HydrophobicContact SD-CG1 3.8Å; M296-V306 HydrophobicContact SD-CG2 4.45Å; M296-F308 HydrophobicContact SD-CE2 4.22Å
297	K	86.4	Confident	83.1	Confident	88 Å²	88	56.2 Å²	56.2	38%	0.383	30%	0.295	S	S	.	.	H	α-helix	trans	-71.8	-49.1	177.5	-175	176.9	176.5	-173.5	0	112.1	A285 L289 N293 A294 L295 G300 Q301	A285-K297 VanDerWaalsContact O-CD 3.31Å; A285-K297 WeakPolarHBondContact O-CD 3.23Å; A285-K297 WeakPolarHBondContact O-CE 3.4Å; A285-K297 PolarHBondContact O-NZ 2.73Å; L289-K297 HydrophobicContact CD1-CB 4.29Å; L289-K297 HydrophobicContact CD1-CD 3.49Å; L289-K297 VanDerWaalsContact CD1-CD 3.49Å; N293-K297 VanDerWaalsContact O-CB 3.32Å; N293-K297 WeakPolarHBondContact O-CB 3.24Å; N293-K297 PolarHBondContact O-N 3.46Å; A294-K297 PolarHBondContact O-N 3.36Å; L295-K297 PolarHBondContact O-N 3.22Å; K297-G300 PolarHBondContact O-N 2.79Å; K297-Q301 WeakPolarHBondContact O-CG 3.22Å; K297-Q301 PolarHBondContact O-N 2.88Å
298	L	87.7	Confident	84	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.8	-44	178.6	-67.5	-177	0	0	0	111.8	N282 A285 V286 A294 L295 G300 Q301 K302 L349 F353 V355	N282-L298 HydrophobicContact CB-CD1 4.41Å; N282-L298 HydrophobicContact CB-CD2 4.31Å; A285-L298 HydrophobicContact CB-CD2 3.84Å; V286-L298 HydrophobicContact CG1-CD1 3.55Å; V286-L298 HydrophobicContact CG1-CD2 4.07Å; V286-L298 HydrophobicContact CG1-CG 3.66Å; A294-L298 PolarHBondContact O-N 2.96Å; L295-L298 PolarHBondContact O-N 3.45Å; L298-G300 VanDerWaalsContact C-N 3.34Å; L298-G300 PolarHBondContact O-N 2.98Å; L298-Q301 PolarHBondContact O-N 3.38Å; L298-K302 PolarHBondContact O-N 2.83Å; L298-L349 HydrophobicContact CD1-CD2 3.83Å; L298-F353 HydrophobicContact CB-CD1 3.82Å; L298-F353 HydrophobicContact CB-CE1 3.51Å; L298-F353 HydrophobicContact CB-CE2 4.27Å; L298-F353 HydrophobicContact CB-CG 4.31Å; L298-F353 HydrophobicContact CB-CZ 3.76Å; L298-F353 HydrophobicContact CD1-CB 3.84Å; L298-F353 HydrophobicContact CD1-CD1 3.68Å; L298-F353 HydrophobicContact CD1-CD2 4.24Å; L298-F353 HydrophobicContact CD1-CE1 4.27Å; L298-F353 HydrophobicContact CD1-CG 3.66Å; L298-F353 HydrophobicContact CG-CD1 4.32Å; L298-F353 HydrophobicContact CG-CE1 4.47Å; L298-V355 HydrophobicContact CD1-CG2 4.38Å
299	C	88.2	Confident	85.1	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.007	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-40.4	173.8	-66.8	0	0	0	0	111.8	L295 Q301 K302 R303 I304 V306 V326 F353	L295-C299 VanDerWaalsContact O-CB 3.25Å; L295-C299 WeakPolarHBondContact O-CB 3.11Å; L295-C299 PolarHBondContact O-N 3.38Å; L295-C299 PolarHBondContact O-SG 2.95Å; C299-Q301 VanDerWaalsContact C-N 3.35Å; C299-Q301 PolarHBondContact O-N 2.89Å; C299-K302 CarbonylContact O-C 3.6Å; C299-K302 PolarHBondContact O-N 3.28Å; C299-R303 CarbonylContact O-C 3.6Å; C299-R303 VanDerWaalsContact O-CA 3.3Å; C299-R303 WeakPolarHBondContact O-CA 3.42Å; C299-R303 PolarHBondContact O-N 3.27Å; C299-I304 HydrophobicContact CB-CB 4.21Å; C299-I304 WeakPolarHBondContact CB-O 3.36Å; C299-I304 PolarHBondContact O-N 2.9Å; C299-V306 HydrophobicContact CB-CG2 3.34Å; C299-V306 WeakPolarHBondContact SG-CG2 3.45Å; C299-V326 VanDerWaalsContact SG-CG1 3.58Å; C299-F353 VanDerWaalsContact SG-CZ 3.57Å
300	G	80.9	Confident	85.4	Confident	53 Å²	53	57.7 Å²	57.7	55%	0.546	30%	0.3	S	S	.	.	H	α-helix	trans	-61.4	-39	173.1	0	0	0	0	0	113.4	M296 K297 L298	M296-G300 PolarHBondContact O-N 3.35Å; K297-G300 PolarHBondContact O-N 2.79Å; L298-G300 VanDerWaalsContact C-N 3.34Å; L298-G300 PolarHBondContact O-N 2.98Å
301	Q	77	Confident	85.7	Confident	113 Å²	113	59.8 Å²	59.8	53%	0.528	31%	0.306	S	S	.	.	H	α-helix	trans	-67.6	-43.4	174.7	-74.3	174	-14.8	0	0	112.5	K297 L298 C299 R303	K297-Q301 WeakPolarHBondContact O-CG 3.22Å; K297-Q301 PolarHBondContact O-N 2.88Å; L298-Q301 PolarHBondContact O-N 3.38Å; C299-Q301 VanDerWaalsContact C-N 3.35Å; C299-Q301 PolarHBondContact O-N 2.89Å; Q301-R303 VanDerWaalsContact C-N 3.33Å
302	K	77.8	Confident	85.4	Confident	66 Å²	66	68.3 Å²	68.3	29%	0.287	34%	0.343	S	S	.	.	H	α-helix	trans	-81.1	-7.1	177.5	-65.7	-159	-178	-173.5	0	114.4	R253 E278 L298 C299 I304 F353	R253-K302 PolarHBondContact NH2-O 2.93Å; R253-K302 VanDerWaalsContact NH2-O 3.16Å; E278-K302 WeakPolarHBondContact OE1-CE 3.48Å; E278-K302 IonicContact OE1-NZ 2.7Å; E278-K302 PolarHBondContact OE1-NZ 2.86Å; E278-K302 IonicContact OE2-NZ 3.2Å; L298-K302 PolarHBondContact O-N 2.83Å; C299-K302 CarbonylContact O-C 3.6Å; C299-K302 PolarHBondContact O-N 3.28Å; K302-I304 VanDerWaalsContact C-N 3.32Å; K302-I304 HydrophobicContact CB-CD1 3.8Å; K302-I304 HydrophobicContact CB-CG1 3.88Å; K302-I304 HydrophobicContact CD-CD1 4.14Å; K302-F353 HydrophobicContact CD-CD1 4.49Å; K302-F353 HydrophobicContact CD-CE1 3.77Å; K302-F353 HydrophobicContact CG-CE1 4.24Å
303	R	75.3	Confident	85	Confident	151 Å²	151	68.3 Å²	68.3	57%	0.57	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	36.7	-168.5	-64.4	-168	-179.3	170.3	6.2	114.5	D249 C299 Q301	D249-R303 PolarHBondContact O-NH1 3Å; D249-R303 PolarHBondContact O-NH2 2.64Å; C299-R303 CarbonylContact O-C 3.6Å; C299-R303 VanDerWaalsContact O-CA 3.3Å; C299-R303 WeakPolarHBondContact O-CA 3.42Å; C299-R303 PolarHBondContact O-N 3.27Å; Q301-R303 VanDerWaalsContact C-N 3.33Å
304	I	84.3	Confident	84.7	Confident	48 Å²	48	68.8 Å²	68.8	25%	0.246	35%	0.354	C	S	.	.			trans	-84.7	127.8	172.1	-58	168.4	0	0	0	107.8	C299 K302 V326 I352 F353	C299-I304 HydrophobicContact CB-CB 4.21Å; C299-I304 WeakPolarHBondContact CB-O 3.36Å; C299-I304 PolarHBondContact O-N 2.9Å; K302-I304 VanDerWaalsContact C-N 3.32Å; K302-I304 HydrophobicContact CB-CD1 3.8Å; K302-I304 HydrophobicContact CB-CG1 3.88Å; K302-I304 HydrophobicContact CD-CD1 4.14Å; I304-V326 HydrophobicContact CG2-CG1 3.6Å; I304-I352 HydrophobicContact CD1-CG2 4.48Å; I304-F353 HydrophobicContact CD1-CZ 4.05Å
305	P	83.1	Confident	84.2	Confident	92 Å²	92	74.4 Å²	74.4	60%	0.597	38%	0.384	S	S	*	.			trans	-70.4	140.1	178.3	29.3	-34	0	0	0	110.6	V326 G327	P305-V326 CarbonylContact O-C 3.58Å; P305-V326 WeakPolarHBondContact O-CA 3.48Å; P305-G327 PolarHBondContact O-N 2.89Å
306	V	89.3	Confident	83.5	Confident	35 Å²	35	78.9 Å²	78.9	21%	0.212	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	132.7	177.9	-179.1	0	0	0	0	110.1	L295 M296 C299 F308 Q325 V326	L295-V306 HydrophobicContact CD2-CG1 4.45Å; M296-V306 HydrophobicContact SD-CB 3.86Å; M296-V306 HydrophobicContact SD-CG1 3.8Å; M296-V306 HydrophobicContact SD-CG2 4.45Å; C299-V306 HydrophobicContact CB-CG2 3.34Å; C299-V306 WeakPolarHBondContact SG-CG2 3.45Å; V306-F308 HydrophobicContact CG1-CD2 4.05Å; V306-F308 HydrophobicContact CG1-CE2 3.54Å; V306-F308 HydrophobicContact CG1-CZ 4.24Å; V306-Q325 WeakPolarHBondContact CA-O 3.4Å; V306-V326 HydrophobicContact CG1-CG2 4.37Å; V306-V326 HydrophobicContact CG2-CG1 4.2Å; V306-V326 HydrophobicContact CG2-CG2 4.34Å
307	K	90.5	Very high	82.8	Confident	122 Å²	122	80.3 Å²	80.3	53%	0.53	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	138.8	176.8	-179.9	-177.7	173.7	-170.4	0	109.9	C324 Q325	K307-C324 CarbonylContact O-C 3.54Å; K307-Q325 HydrophobicContact CB-CB 4.36Å; K307-Q325 PolarHBondContact N-O 3.39Å; K307-Q325 PolarHBondContact O-N 3.25Å
308	F	89.8	Confident	82.2	Confident	51 Å²	51	80.2 Å²	80.2	22%	0.224	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	117.1	174.5	-69.7	-93.9	0	0	0	109.4	L295 M296 V306 V322 C324 R341 S345	L295-F308 HydrophobicContact CD2-CZ 4.23Å; M296-F308 HydrophobicContact SD-CE2 4.22Å; V306-F308 HydrophobicContact CG1-CD2 4.05Å; V306-F308 HydrophobicContact CG1-CE2 3.54Å; V306-F308 HydrophobicContact CG1-CZ 4.24Å; F308-V322 HydrophobicContact CD1-CG1 4.01Å; F308-C324 HydrophobicContact CD1-CB 4.02Å; F308-C324 HydrophobicContact CE1-CB 3.92Å; F308-C324 WeakPolarHBondContact CE1-SG 3.23Å; F308-R341 HydrophobicContact CD1-CG 3.65Å; F308-R341 HydrophobicContact CE1-CG 3.53Å; F308-R341 HydrophobicContact CZ-CG 4.33Å; F308-S345 WeakPolarHBondContact CE1-OG 3.09Å; F308-S345 WeakPolarHBondContact CZ-OG 3.31Å
309	S	89.1	Confident	81.9	Confident	40 Å²	40	83.8 Å²	83.8	28%	0.28	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	142.5	167	-59.8	0	0	0	0	109.3	V322 I323	S309-V322 WeakPolarHBondContact O-CA 3.4Å; S309-I323 PolarHBondContact N-O 3.21Å; S309-I323 PolarHBondContact O-N 3.02Å
310	L	85.7	Confident	81.8	Confident	96 Å²	96	85.7 Å²	85.7	50%	0.503	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	118.1	-176	177	71.3	0	0	0	109.9	M320 V322 V340	L310-M320 HydrophobicContact CD1-CB 3.93Å; L310-M320 HydrophobicContact CD1-CE 3.85Å; L310-M320 HydrophobicContact CD1-CG 4.47Å; L310-M320 HydrophobicContact CD2-CE 4.03Å; L310-M320 HydrophobicContact CG-CE 3.7Å; L310-V322 HydrophobicContact CD1-CG2 3.49Å; L310-V322 VanDerWaalsContact CD1-CG2 3.49Å; L310-V340 HydrophobicContact CD1-CG1 4.44Å
311	E	86.9	Confident	82.2	Confident	101 Å²	101	85.5 Å²	85.5	47%	0.472	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	165.9	-173.6	-69	171.2	-168	0	0	110.5	M320 K321	E311-M320 CarbonylContact O-C 3.56Å; E311-M320 WeakPolarHBondContact O-CA 3.31Å; E311-M320 WeakPolarHBondContact O-CE 3.44Å; E311-K321 PolarHBondContact N-O 2.63Å; E311-K321 PolarHBondContact O-N 2.87Å
312	K	81.5	Confident	82.8	Confident	179 Å²	179	80.4 Å²	80.4	78%	0.778	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	138.7	167.8	-68.3	-178.4	179.6	179	0	108.3	S314 M320	K312-S314 PolarHBondContact O-N 3.41Å; K312-M320 HydrophobicContact CG-SD 4.33Å
313	S	79.7	Confident	83.4	Confident	13 Å²	13	79 Å²	79	9%	0.091	43%	0.426	C	S	.	.			trans	-67.7	128.9	171.6	-177.4	0	0	0	0	110.1	D315 H316 Q319	S313-D315 PolarHBondContact OG-N 3.42Å; S313-H316 PolarHBondContact OG-N 3.07Å; S313-Q319 PolarHBondContact N-O 2.78Å
314	S	78.4	Confident	84.1	Confident	104 Å²	104	71.8 Å²	71.8	73%	0.727	40%	0.399	S	S	*	.	S	Bend	trans	-65.2	-42	165	40.6	0	0	0	0	111.5	K312	K312-S314 PolarHBondContact O-N 3.41Å
315	D	77.2	Confident	84.5	Confident	119 Å²	119	73.3 Å²	73.3	64%	0.636	41%	0.406	S	S	*	.	S	Bend	trans	-88.4	-22.7	-164	-34.5	-42.1	0	0	0	112.1	S313	S313-D315 PolarHBondContact OG-N 3.42Å
316	H	76	Confident	84.8	Confident	93 Å²	93	69.1 Å²	69.1	43%	0.431	38%	0.378	S	S	.	.	S	Bend	trans	-129	84.9	-177.4	-63.1	-15.5	0	0	0	110.6	S313 G318 Q319 V334	S313-H316 PolarHBondContact OG-N 3.07Å; H316-G318 PolarHBondContact O-N 3.34Å; H316-Q319 HydrophobicContact CB-CB 3.99Å; H316-Q319 HydrophobicContact CB-CG 3.94Å; H316-Q319 WeakPolarHBondContact O-CB 3.35Å; H316-Q319 PolarHBondContact O-N 3.37Å; H316-V334 HydrophobicContact CB-CG1 4.43Å
317	P	74.6	Confident	84.8	Confident	121 Å²	121	68.2 Å²	68.2	79%	0.786	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	132.7	-179	22	-32.9	0	0	0	111.7
318	G	73.7	Confident	84.6	Confident	86 Å²	86	70.3 Å²	70.3	89%	0.887	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.7	-10.8	-172.8	0	0	0	0	0	114.8	H316	H316-G318 PolarHBondContact O-N 3.34Å
319	Q	81.6	Confident	84.7	Confident	75 Å²	75	73 Å²	73	35%	0.35	41%	0.406	S	S	.	.			trans	-100.9	157.7	175.5	-53.5	-165.4	27.5	0	0	112.5	S313 H316 V334	S313-Q319 PolarHBondContact N-O 2.78Å; H316-Q319 HydrophobicContact CB-CB 3.99Å; H316-Q319 HydrophobicContact CB-CG 3.94Å; H316-Q319 WeakPolarHBondContact O-CB 3.35Å; H316-Q319 PolarHBondContact O-N 3.37Å; Q319-V334 HydrophobicContact CB-CG1 4Å
320	M	85	Confident	84.8	Confident	42 Å²	42	74.9 Å²	74.9	21%	0.207	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	148.5	174.6	-56	-65.2	-66.9	0	0	109.2	L310 E311 K312 V334 G335 K337 V340	L310-M320 HydrophobicContact CD1-CB 3.93Å; L310-M320 HydrophobicContact CD1-CE 3.85Å; L310-M320 HydrophobicContact CD1-CG 4.47Å; L310-M320 HydrophobicContact CD2-CE 4.03Å; L310-M320 HydrophobicContact CG-CE 3.7Å; E311-M320 CarbonylContact O-C 3.56Å; E311-M320 WeakPolarHBondContact O-CA 3.31Å; E311-M320 WeakPolarHBondContact O-CE 3.44Å; K312-M320 HydrophobicContact CG-SD 4.33Å; M320-V334 WeakPolarHBondContact O-CA 3.17Å; M320-G335 PolarHBondContact N-O 2.83Å; M320-G335 PolarHBondContact O-N 2.83Å; M320-K337 HydrophobicContact CG-CB 4.09Å; M320-V340 HydrophobicContact CB-CG1 4.22Å
321	K	89.3	Confident	85.1	Confident	49 Å²	49	70.7 Å²	70.7	21%	0.213	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	134.9	167.6	-177.4	176.9	179.6	-178.5	0	108.9	E311 E332 A333 V334	E311-K321 PolarHBondContact N-O 2.63Å; E311-K321 PolarHBondContact O-N 2.87Å; K321-E332 WeakPolarHBondContact CE-OE1 3.32Å; K321-E332 WeakPolarHBondContact CE-OE2 3.46Å; K321-E332 IonicContact NZ-OE1 3.67Å; K321-E332 PolarHBondContact NZ-OE1 2.88Å; K321-E332 IonicContact NZ-OE2 2.69Å; K321-E332 PolarHBondContact NZ-OE2 3.07Å; K321-A333 CarbonylContact C-O 2.97Å; K321-A333 WeakPolarHBondContact CA-O 3.24Å; K321-V334 HydrophobicContact CB-CG2 4.32Å; K321-V334 HydrophobicContact CG-CG2 4.19Å
322	V	89.6	Confident	85.3	Confident	5 Å²	5	69.8 Å²	69.8	3%	0.03	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.1	167.1	169.5	0	0	0	0	108.9	F308 S309 L310 E332 A333 V340 A344	F308-V322 HydrophobicContact CD1-CG1 4.01Å; S309-V322 WeakPolarHBondContact O-CA 3.4Å; L310-V322 HydrophobicContact CD1-CG2 3.49Å; L310-V322 VanDerWaalsContact CD1-CG2 3.49Å; V322-E332 WeakPolarHBondContact O-CA 3.39Å; V322-A333 PolarHBondContact N-O 3.21Å; V322-A333 PolarHBondContact O-N 3.02Å; V322-V340 HydrophobicContact CB-CG2 3.95Å; V322-V340 HydrophobicContact CG2-CB 4.27Å; V322-V340 HydrophobicContact CG2-CG1 3.66Å; V322-V340 HydrophobicContact CG2-CG2 3.8Å; V322-A344 HydrophobicContact CB-CB 4.27Å; V322-A344 HydrophobicContact CG1-CB 3.75Å
323	I	90	Very high	85.7	Confident	36 Å²	36	61.7 Å²	61.7	19%	0.185	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	113.8	164.8	-49.7	178.8	0	0	0	106.2	S309 E332	S309-I323 PolarHBondContact N-O 3.21Å; S309-I323 PolarHBondContact O-N 3.02Å; I323-E332 WeakPolarHBondContact CD1-OE1 3.27Å; I323-E332 HydrophobicContact CG1-CG 4.28Å; I323-E332 HydrophobicContact CG2-CG 4.46Å
324	C	90.9	Very high	86.1	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	108.7	171.1	-174.3	0	0	0	0	108	K307 F308 S330 F331 A344	K307-C324 CarbonylContact O-C 3.54Å; F308-C324 HydrophobicContact CD1-CB 4.02Å; F308-C324 HydrophobicContact CE1-CB 3.92Å; F308-C324 WeakPolarHBondContact CE1-SG 3.23Å; C324-S330 WeakPolarHBondContact O-CA 3.42Å; C324-F331 HydrophobicContact CB-CB 4.44Å; C324-F331 PolarHBondContact N-O 2.75Å; C324-F331 WeakPolarHBondContact O-CD2 3.39Å; C324-F331 PolarHBondContact O-N 2.96Å; C324-A344 HydrophobicContact CB-CB 3.9Å
325	Q	91.7	Very high	86.3	Confident	81 Å²	81	59 Å²	59	38%	0.379	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	129.7	174.2	-175.5	-179.6	9.6	0	0	109	V306 K307 E329	V306-Q325 WeakPolarHBondContact CA-O 3.4Å; K307-Q325 HydrophobicContact CB-CB 4.36Å; K307-Q325 PolarHBondContact N-O 3.39Å; K307-Q325 PolarHBondContact O-N 3.25Å; Q325-E329 CarbonylContact C-O 3.52Å; Q325-E329 WeakPolarHBondContact CA-O 3.22Å
326	V	90.2	Very high	86.4	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.018	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	104.1	-177	-175.7	0	0	0	0	108.2	L295 C299 I304 P305 V306 D328 E329 F331 A348 I352	L295-V326 HydrophobicContact CD1-CG2 4.48Å; L295-V326 HydrophobicContact CD2-CG2 4.1Å; C299-V326 VanDerWaalsContact SG-CG1 3.58Å; I304-V326 HydrophobicContact CG2-CG1 3.6Å; P305-V326 CarbonylContact O-C 3.58Å; P305-V326 WeakPolarHBondContact O-CA 3.48Å; V306-V326 HydrophobicContact CG1-CG2 4.37Å; V306-V326 HydrophobicContact CG2-CG1 4.2Å; V306-V326 HydrophobicContact CG2-CG2 4.34Å; V326-D328 PolarHBondContact O-N 2.95Å; V326-E329 PolarHBondContact N-O 2.79Å; V326-E329 PolarHBondContact O-N 3.05Å; V326-F331 HydrophobicContact CB-CE2 4.17Å; V326-F331 HydrophobicContact CG2-CD2 4.27Å; V326-F331 HydrophobicContact CG2-CE2 4.3Å; V326-A348 HydrophobicContact CG2-CB 4.16Å; V326-I352 HydrophobicContact CB-CD1 3.61Å; V326-I352 HydrophobicContact CG1-CD1 3.4Å; V326-I352 HydrophobicContact CG2-CD1 4.37Å
327	G	88.5	Confident	86.3	Confident	17 Å²	17	60.8 Å²	60.8	18%	0.175	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	-128.3	-163.8	0	0	0	0	0	110.6	P305	P305-G327 PolarHBondContact O-N 2.89Å
328	D	87.4	Confident	86	Confident	166 Å²	166	63.6 Å²	63.6	89%	0.888	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-9.6	177.7	-56	-53.7	0	0	0	113	V326	V326-D328 PolarHBondContact O-N 2.95Å
329	E	91.4	Very high	86.3	Confident	107 Å²	107	65.5 Å²	65.5	50%	0.5	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	155.2	-178.5	-64.6	178	177.5	0	0	112.2	Q325 V326 F331 I352	Q325-E329 CarbonylContact C-O 3.52Å; Q325-E329 WeakPolarHBondContact CA-O 3.22Å; V326-E329 PolarHBondContact N-O 2.79Å; V326-E329 PolarHBondContact O-N 3.05Å; E329-F331 HydrophobicContact CB-CE2 3.75Å; E329-F331 HydrophobicContact CB-CZ 3.82Å; E329-F331 WeakPolarHBondContact OE2-CZ 3.46Å; E329-I352 VanDerWaalsContact OE2-CG1 3.28Å; E329-I352 WeakPolarHBondContact OE2-CG1 3.47Å
330	S	91.3	Very high	86.5	Confident	79 Å²	79	62 Å²	62	55%	0.552	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.4	128.4	-177.7	68.7	0	0	0	0	113.3	C324	C324-S330 WeakPolarHBondContact O-CA 3.42Å
331	F	92.9	Very high	86.5	Confident	9 Å²	9	65.5 Å²	65.5	4%	0.039	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	115.5	-172.2	-54.5	-87.7	0	0	0	109.9	C324 V326 E329 K347 A348 E351 I352	C324-F331 HydrophobicContact CB-CB 4.44Å; C324-F331 PolarHBondContact N-O 2.75Å; C324-F331 WeakPolarHBondContact O-CD2 3.39Å; C324-F331 PolarHBondContact O-N 2.96Å; V326-F331 HydrophobicContact CB-CE2 4.17Å; V326-F331 HydrophobicContact CG2-CD2 4.27Å; V326-F331 HydrophobicContact CG2-CE2 4.3Å; E329-F331 HydrophobicContact CB-CE2 3.75Å; E329-F331 HydrophobicContact CB-CZ 3.82Å; E329-F331 WeakPolarHBondContact OE2-CZ 3.46Å; F331-K347 HydrophobicContact CB-CB 4.27Å; F331-K347 HydrophobicContact CD1-CB 4.11Å; F331-A348 HydrophobicContact CB-CB 4.46Å; F331-A348 HydrophobicContact CD1-CB 4.33Å; F331-A348 HydrophobicContact CD2-CB 3.61Å; F331-A348 HydrophobicContact CE2-CB 3.98Å; F331-A348 HydrophobicContact CG-CB 3.84Å; F331-A348 HydrophobicContact CZ-CB 4.45Å; F331-E351 HydrophobicContact CE1-CB 3.75Å; F331-E351 HydrophobicContact CE1-CG 4.26Å; F331-E351 WeakPolarHBondContact CE1-OE2 3.31Å; F331-E351 HydrophobicContact CZ-CB 4.42Å; F331-I352 HydrophobicContact CE2-CD1 3.55Å; F331-I352 HydrophobicContact CE2-CG1 4.22Å; F331-I352 HydrophobicContact CZ-CD1 3.62Å; F331-I352 HydrophobicContact CZ-CG1 3.76Å
332	E	90.6	Very high	86.4	Confident	82 Å²	82	65.6 Å²	65.6	38%	0.383	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	138.2	-178.5	-55.7	-156.3	137.8	0	0	112.5	K321 V322 I323 K347	K321-E332 WeakPolarHBondContact CE-OE1 3.32Å; K321-E332 WeakPolarHBondContact CE-OE2 3.46Å; K321-E332 IonicContact NZ-OE1 3.67Å; K321-E332 PolarHBondContact NZ-OE1 2.88Å; K321-E332 IonicContact NZ-OE2 2.69Å; K321-E332 PolarHBondContact NZ-OE2 3.07Å; V322-E332 WeakPolarHBondContact O-CA 3.39Å; I323-E332 WeakPolarHBondContact CD1-OE1 3.27Å; I323-E332 HydrophobicContact CG1-CG 4.28Å; I323-E332 HydrophobicContact CG2-CG 4.46Å; E332-K347 PolarHBondContact O-NZ 3.19Å
333	A	90.1	Very high	86.3	Confident	9 Å²	9	69 Å²	69	7%	0.074	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	148.8	167.5	0	0	0	0	0	110.9	K321 V322 V340 L343 A344	K321-A333 CarbonylContact C-O 2.97Å; K321-A333 WeakPolarHBondContact CA-O 3.24Å; V322-A333 PolarHBondContact N-O 3.21Å; V322-A333 PolarHBondContact O-N 3.02Å; A333-V340 HydrophobicContact CB-CG2 4.21Å; A333-V340 VanDerWaalsContact O-CG2 3.26Å; A333-V340 WeakPolarHBondContact O-CG2 3.43Å; A333-L343 HydrophobicContact CB-CB 3.77Å; A333-A344 HydrophobicContact CB-CB 3.92Å
334	V	87	Confident	86.3	Confident	51 Å²	51	67.2 Å²	67.2	31%	0.309	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	143.7	173.2	-173.8	0	0	0	0	108.3	H316 Q319 M320 K321	H316-V334 HydrophobicContact CB-CG1 4.43Å; Q319-V334 HydrophobicContact CB-CG1 4Å; M320-V334 WeakPolarHBondContact O-CA 3.17Å; K321-V334 HydrophobicContact CB-CG2 4.32Å; K321-V334 HydrophobicContact CG-CG2 4.19Å
335	G	84.1	Confident	86.4	Confident	9 Å²	9	67.2 Å²	67.2	9%	0.093	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.9	-165.4	178.1	0	0	0	0	0	114.4	M320	M320-G335 PolarHBondContact N-O 2.83Å; M320-G335 PolarHBondContact O-N 2.83Å
336	T	79.4	Confident	86.3	Confident	84 Å²	84	65.1 Å²	65.1	52%	0.515	33%	0.325	S	S	.	.			trans	-68.8	147.3	175.8	68.6	0	0	0	0	111.2	R338 K339 V340	T336-R338 PolarHBondContact O-N 3.49Å; T336-K339 PolarHBondContact O-N 2.92Å; T336-V340 WeakPolarHBondContact O-CB 3.47Å; T336-V340 WeakPolarHBondContact O-CG1 3.4Å; T336-V340 PolarHBondContact O-N 2.93Å
337	K	73.9	Confident	86.2	Confident	166 Å²	166	69.6 Å²	69.6	72%	0.722	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-25	178.6	-172	179.3	177.7	-176.7	0	114.1	M320	M320-K337 HydrophobicContact CG-CB 4.09Å
338	R	66.6	Low	86.4	Confident	179 Å²	179	68.8 Å²	68.8	68%	0.675	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-31.9	177	-73	-178.8	174.1	162.1	-3.6	114.1	T336 T391	T336-R338 PolarHBondContact O-N 3.49Å; R338-T391 VanDerWaalsContact NH1-CG2 3.28Å
339	K	80.2	Confident	86.5	Confident	126 Å²	126	60.9 Å²	60.9	55%	0.548	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-25.3	-174.1	-66.3	-166.2	175.7	-171.2	0	115.1	T336 R341 T342 L343	T336-K339 PolarHBondContact O-N 2.92Å; K339-R341 VanDerWaalsContact C-N 3.34Å; K339-R341 PolarHBondContact O-N 3.38Å; K339-T342 WeakPolarHBondContact O-CB 3.34Å; K339-T342 PolarHBondContact O-N 3.03Å; K339-L343 PolarHBondContact O-N 2.9Å
340	V	85.6	Confident	86.4	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-58.8	-36.9	-170.2	64.3	0	0	0	0	114.6	L310 M320 V322 A333 T336 L343 A344	L310-V340 HydrophobicContact CD1-CG1 4.44Å; M320-V340 HydrophobicContact CB-CG1 4.22Å; V322-V340 HydrophobicContact CB-CG2 3.95Å; V322-V340 HydrophobicContact CG2-CB 4.27Å; V322-V340 HydrophobicContact CG2-CG1 3.66Å; V322-V340 HydrophobicContact CG2-CG2 3.8Å; A333-V340 HydrophobicContact CB-CG2 4.21Å; A333-V340 VanDerWaalsContact O-CG2 3.26Å; A333-V340 WeakPolarHBondContact O-CG2 3.43Å; T336-V340 WeakPolarHBondContact O-CB 3.47Å; T336-V340 WeakPolarHBondContact O-CG1 3.4Å; T336-V340 PolarHBondContact O-N 2.93Å; V340-L343 PolarHBondContact O-N 3.03Å; V340-A344 PolarHBondContact O-N 3.04Å
341	R	85.7	Confident	86.3	Confident	116 Å²	116	61.2 Å²	61.2	44%	0.438	29%	0.285	S	S	.	.	H	α-helix	trans	-67.9	-37.4	177	-170.2	178.3	-178.7	-168.6	-1.9	112	P292 F308 K339 S345	P292-R341 HydrophobicContact CG-CG 4.33Å; F308-R341 HydrophobicContact CD1-CG 3.65Å; F308-R341 HydrophobicContact CE1-CG 3.53Å; F308-R341 HydrophobicContact CZ-CG 4.33Å; K339-R341 VanDerWaalsContact C-N 3.34Å; K339-R341 PolarHBondContact O-N 3.38Å; R341-S345 PolarHBondContact O-N 3.38Å; R341-S345 VanDerWaalsContact O-N 3.09Å; R341-S345 PolarHBondContact O-OG 3.5Å
342	T	87.1	Confident	86	Confident	51 Å²	51	62.5 Å²	62.5	31%	0.313	29%	0.292	S	S	.	.	H	α-helix	trans	-61.9	-48.8	176.2	-46.2	0	0	0	0	110.2	A291 K339 A344 S345 M346	A291-T342 HydrophobicContact CB-CG2 3.97Å; K339-T342 WeakPolarHBondContact O-CB 3.34Å; K339-T342 PolarHBondContact O-N 3.03Å; T342-A344 PolarHBondContact O-N 3.38Å; T342-S345 CarbonylContact O-C 3.6Å; T342-S345 WeakPolarHBondContact O-CA 3.28Å; T342-S345 WeakPolarHBondContact O-CB 3.47Å; T342-S345 PolarHBondContact O-N 3.49Å; T342-M346 HydrophobicContact CG2-CG 4.39Å; T342-M346 HydrophobicContact CG2-SD 3.98Å; T342-M346 VanDerWaalsContact O-CG 3.29Å; T342-M346 WeakPolarHBondContact O-CG 3.44Å; T342-M346 PolarHBondContact O-N 3.04Å
343	L	87	Confident	85.8	Confident	76 Å²	76	58.8 Å²	58.8	40%	0.398	28%	0.275	S	S	.	.	H	α-helix	trans	-57.9	-45.5	178.6	-65.2	173	0	0	0	112.8	A333 K339 V340 S345 M346 K347	A333-L343 HydrophobicContact CB-CB 3.77Å; K339-L343 PolarHBondContact O-N 2.9Å; V340-L343 PolarHBondContact O-N 3.03Å; L343-S345 VanDerWaalsContact C-N 3.29Å; L343-S345 PolarHBondContact O-N 3.09Å; L343-M346 PolarHBondContact O-N 3.27Å; L343-K347 PolarHBondContact O-N 3.14Å
344	A	91.5	Very high	85.5	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63.2	-35.3	175.8	0	0	0	0	0	112.4	V322 C324 A333 V340 T342 A348	V322-A344 HydrophobicContact CB-CB 4.27Å; V322-A344 HydrophobicContact CG1-CB 3.75Å; C324-A344 HydrophobicContact CB-CB 3.9Å; A333-A344 HydrophobicContact CB-CB 3.92Å; V340-A344 PolarHBondContact O-N 3.04Å; T342-A344 PolarHBondContact O-N 3.38Å; A344-A348 PolarHBondContact O-N 3.3Å
345	S	91.4	Very high	85.3	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-73.5	-33	175.5	-57.5	0	0	0	0	113.7	P292 F308 R341 T342 L343 A348 L349	P292-S345 WeakPolarHBondContact CA-OG 3.4Å; F308-S345 WeakPolarHBondContact CE1-OG 3.09Å; F308-S345 WeakPolarHBondContact CZ-OG 3.31Å; R341-S345 PolarHBondContact O-N 3.38Å; R341-S345 VanDerWaalsContact O-N 3.09Å; R341-S345 PolarHBondContact O-OG 3.5Å; T342-S345 CarbonylContact O-C 3.6Å; T342-S345 WeakPolarHBondContact O-CA 3.28Å; T342-S345 WeakPolarHBondContact O-CB 3.47Å; T342-S345 PolarHBondContact O-N 3.49Å; L343-S345 VanDerWaalsContact C-N 3.29Å; L343-S345 PolarHBondContact O-N 3.09Å; S345-A348 PolarHBondContact O-N 2.96Å; S345-L349 WeakPolarHBondContact O-CB 3.48Å; S345-L349 VanDerWaalsContact O-CG 3.31Å; S345-L349 WeakPolarHBondContact O-CG 3.02Å; S345-L349 PolarHBondContact O-N 3.43Å
346	M	89.5	Confident	85.2	Confident	36 Å²	36	64.2 Å²	64.2	18%	0.177	29%	0.294	C	S	.	.	H	α-helix	trans	-65.9	-43.1	176.5	-68.5	169.6	68.9	0	0	111.3	A291 T342 L343 L349 K350 Y357 E358	A291-M346 HydrophobicContact CB-CG 3.6Å; T342-M346 HydrophobicContact CG2-CG 4.39Å; T342-M346 HydrophobicContact CG2-SD 3.98Å; T342-M346 VanDerWaalsContact O-CG 3.29Å; T342-M346 WeakPolarHBondContact O-CG 3.44Å; T342-M346 PolarHBondContact O-N 3.04Å; L343-M346 PolarHBondContact O-N 3.27Å; M346-L349 PolarHBondContact O-N 3.08Å; M346-K350 WeakPolarHBondContact O-CB 3.31Å; M346-K350 PolarHBondContact O-N 3.3Å; M346-Y357 HydrophobicContact CG-CD1 4.47Å; M346-E358 HydrophobicContact CE-CG 3.51Å
347	K	90	Very high	85	Confident	98 Å²	98	61 Å²	61	43%	0.426	27%	0.273	S	S	.	.	H	α-helix	trans	-55.6	-54.6	171.2	-72.8	-172.5	175.7	-174.7	0	112	F331 E332 L343 L349 K350 E351	F331-K347 HydrophobicContact CB-CB 4.27Å; F331-K347 HydrophobicContact CD1-CB 4.11Å; E332-K347 PolarHBondContact O-NZ 3.19Å; L343-K347 PolarHBondContact O-N 3.14Å; K347-L349 VanDerWaalsContact C-N 3.27Å; K347-L349 PolarHBondContact O-N 2.96Å; K347-K350 PolarHBondContact O-N 3.39Å; K347-K350 VanDerWaalsContact O-N 3.07Å; K347-E351 WeakPolarHBondContact O-CB 3.45Å; K347-E351 PolarHBondContact O-N 3.31Å
348	A	91.8	Very high	84.7	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.7	-35	179.5	0	0	0	0	0	113.3	L295 V326 F331 A344 S345 I352	L295-A348 HydrophobicContact CD1-CB 3.8Å; L295-A348 HydrophobicContact CD2-CB 3.87Å; V326-A348 HydrophobicContact CG2-CB 4.16Å; F331-A348 HydrophobicContact CB-CB 4.46Å; F331-A348 HydrophobicContact CD1-CB 4.33Å; F331-A348 HydrophobicContact CD2-CB 3.61Å; F331-A348 HydrophobicContact CE2-CB 3.98Å; F331-A348 HydrophobicContact CG-CB 3.84Å; F331-A348 HydrophobicContact CZ-CB 4.45Å; A344-A348 PolarHBondContact O-N 3.3Å; S345-A348 PolarHBondContact O-N 2.96Å; A348-I352 VanDerWaalsContact O-CB 3.27Å; A348-I352 WeakPolarHBondContact O-CB 3.46Å; A348-I352 PolarHBondContact O-N 2.98Å
349	L	89.9	Confident	84.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-69.4	-40	174.6	-77.6	169.6	0	0	0	113.1	A291 A294 L295 L298 S345 M346 K347 F353 H354 V355 Y357	A291-L349 HydrophobicContact CB-CD1 4.03Å; A291-L349 WeakPolarHBondContact O-CD1 3.36Å; A294-L349 HydrophobicContact CB-CD1 3.91Å; A294-L349 HydrophobicContact CB-CD2 4.45Å; L295-L349 HydrophobicContact CB-CD1 4.49Å; L295-L349 HydrophobicContact CB-CD2 4.21Å; L295-L349 HydrophobicContact CB-CG 4.16Å; L295-L349 HydrophobicContact CD1-CD2 4.17Å; L295-L349 HydrophobicContact CD1-CG 4.21Å; L298-L349 HydrophobicContact CD1-CD2 3.83Å; S345-L349 WeakPolarHBondContact O-CB 3.48Å; S345-L349 VanDerWaalsContact O-CG 3.31Å; S345-L349 WeakPolarHBondContact O-CG 3.02Å; S345-L349 PolarHBondContact O-N 3.43Å; M346-L349 PolarHBondContact O-N 3.08Å; K347-L349 VanDerWaalsContact C-N 3.27Å; K347-L349 PolarHBondContact O-N 2.96Å; L349-F353 HydrophobicContact CD2-CD2 4.22Å; L349-F353 CarbonylContact O-C 3.59Å; L349-F353 WeakPolarHBondContact O-CA 3.32Å; L349-F353 WeakPolarHBondContact O-CB 3.33Å; L349-F353 PolarHBondContact O-N 3.14Å; L349-H354 PolarHBondContact O-N 3.32Å; L349-H354 VanDerWaalsContact O-N 3.12Å; L349-V355 CarbonylContact C-O 3.59Å; L349-V355 HydrophobicContact CB-CB 4.38Å; L349-V355 PolarHBondContact O-N 3.01Å; L349-Y357 HydrophobicContact CD1-CD2 3.55Å; L349-Y357 HydrophobicContact CD1-CE2 3.88Å; L349-Y357 HydrophobicContact CD1-CG 4.21Å
350	K	89	Confident	82.9	Confident	79 Å²	79	53.6 Å²	53.6	34%	0.343	26%	0.263	S	S	.	.	H	α-helix	trans	-70.5	-41.8	179.9	-164.5	161	-178.4	149.6	0	111.3	M346 K347 H354 V355 D356 E358	M346-K350 WeakPolarHBondContact O-CB 3.31Å; M346-K350 PolarHBondContact O-N 3.3Å; K347-K350 PolarHBondContact O-N 3.39Å; K347-K350 VanDerWaalsContact O-N 3.07Å; K350-H354 WeakPolarHBondContact O-CA 3.46Å; K350-H354 PolarHBondContact O-N 3.15Å; K350-H354 PolarHBondContact O-ND1 3.03Å; K350-V355 WeakPolarHBondContact CA-O 3.28Å; K350-V355 PolarHBondContact N-O 3.4Å; K350-D356 VanDerWaalsContact CE-CG 3.46Å; K350-D356 WeakPolarHBondContact CE-OD1 3.39Å; K350-D356 WeakPolarHBondContact CE-OD2 3.27Å; K350-D356 IonicContact NZ-OD1 4Å; K350-D356 PolarHBondContact NZ-OD1 3.18Å; K350-D356 IonicContact NZ-OD2 3.64Å; K350-D356 PolarHBondContact NZ-OD2 3.06Å; K350-E358 IonicContact NZ-OE2 3.61Å; K350-E358 PolarHBondContact NZ-OE2 3.3Å
351	E	88.6	Confident	81.4	Confident	113 Å²	113	59.9 Å²	59.9	53%	0.528	29%	0.292	S	S	.	.	H	α-helix	trans	-81.2	-47.8	-176.4	-66.7	172.8	-116.8	0	0	112.6	F331 K347 H354	F331-E351 HydrophobicContact CE1-CB 3.75Å; F331-E351 HydrophobicContact CE1-CG 4.26Å; F331-E351 WeakPolarHBondContact CE1-OE2 3.31Å; F331-E351 HydrophobicContact CZ-CB 4.42Å; K347-E351 WeakPolarHBondContact O-CB 3.45Å; K347-E351 PolarHBondContact O-N 3.31Å; E351-H354 PolarHBondContact O-CE1 3.36Å; E351-H354 VanDerWaalsContact O-CE1 3.28Å; E351-H354 PolarHBondContact O-ND1 3.14Å
352	I	88	Confident	79.9	Confident	36 Å²	36	54.5 Å²	54.5	19%	0.185	27%	0.272	C	S	.	.	H	α-helix	trans	-86.8	-33.8	-175.4	-59.7	175.6	0	0	0	113.5	I304 V326 E329 F331 A348	I304-I352 HydrophobicContact CD1-CG2 4.48Å; V326-I352 HydrophobicContact CB-CD1 3.61Å; V326-I352 HydrophobicContact CG1-CD1 3.4Å; V326-I352 HydrophobicContact CG2-CD1 4.37Å; E329-I352 VanDerWaalsContact OE2-CG1 3.28Å; E329-I352 WeakPolarHBondContact OE2-CG1 3.47Å; F331-I352 HydrophobicContact CE2-CD1 3.55Å; F331-I352 HydrophobicContact CE2-CG1 4.22Å; F331-I352 HydrophobicContact CZ-CD1 3.62Å; F331-I352 HydrophobicContact CZ-CG1 3.76Å; A348-I352 VanDerWaalsContact O-CB 3.27Å; A348-I352 WeakPolarHBondContact O-CB 3.46Å; A348-I352 PolarHBondContact O-N 2.98Å
353	F	86.3	Confident	77.9	Confident	5 Å²	5	54.9 Å²	54.9	2%	0.022	28%	0.277	C	S	.	.	H	α-helix	trans	-116.8	-2	-170.2	-62.6	-84.9	0	0	0	113.9	L295 L298 C299 K302 I304 L349 V355	L295-F353 HydrophobicContact CD1-CD2 4.22Å; L295-F353 HydrophobicContact CD1-CE2 3.8Å; L298-F353 HydrophobicContact CB-CD1 3.82Å; L298-F353 HydrophobicContact CB-CE1 3.51Å; L298-F353 HydrophobicContact CB-CE2 4.27Å; L298-F353 HydrophobicContact CB-CG 4.31Å; L298-F353 HydrophobicContact CB-CZ 3.76Å; L298-F353 HydrophobicContact CD1-CB 3.84Å; L298-F353 HydrophobicContact CD1-CD1 3.68Å; L298-F353 HydrophobicContact CD1-CD2 4.24Å; L298-F353 HydrophobicContact CD1-CE1 4.27Å; L298-F353 HydrophobicContact CD1-CG 3.66Å; L298-F353 HydrophobicContact CG-CD1 4.32Å; L298-F353 HydrophobicContact CG-CE1 4.47Å; C299-F353 VanDerWaalsContact SG-CZ 3.57Å; K302-F353 HydrophobicContact CD-CD1 4.49Å; K302-F353 HydrophobicContact CD-CE1 3.77Å; K302-F353 HydrophobicContact CG-CE1 4.24Å; I304-F353 HydrophobicContact CD1-CZ 4.05Å; L349-F353 HydrophobicContact CD2-CD2 4.22Å; L349-F353 CarbonylContact O-C 3.59Å; L349-F353 WeakPolarHBondContact O-CA 3.32Å; L349-F353 WeakPolarHBondContact O-CB 3.33Å; L349-F353 PolarHBondContact O-N 3.14Å; F353-V355 HydrophobicContact CB-CG2 4.15Å; F353-V355 PolarHBondContact O-N 3.3Å; F353-V355 VanDerWaalsContact O-N 3.17Å
354	H	83.8	Confident	75.8	Confident	133 Å²	133	55.1 Å²	55.1	62%	0.616	29%	0.285	S	S	*	.			trans	52.2	33.2	-176.3	-50.4	-34.4	0	0	0	113.4	L349 K350 E351	L349-H354 PolarHBondContact O-N 3.32Å; L349-H354 VanDerWaalsContact O-N 3.12Å; K350-H354 WeakPolarHBondContact O-CA 3.46Å; K350-H354 PolarHBondContact O-N 3.15Å; K350-H354 PolarHBondContact O-ND1 3.03Å; E351-H354 PolarHBondContact O-CE1 3.36Å; E351-H354 VanDerWaalsContact O-CE1 3.28Å; E351-H354 PolarHBondContact O-ND1 3.14Å
355	V	82.1	Confident	73.5	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.006	29%	0.294	C	S	.	.			trans	-98.3	105.6	173.2	175.7	0	0	0	0	108	N282 V286 L298 L349 K350 F353 Y357	N282-V355 HydrophobicContact CB-CG2 4.26Å; V286-V355 HydrophobicContact CG2-CG1 3.95Å; L298-V355 HydrophobicContact CD1-CG2 4.38Å; L349-V355 CarbonylContact C-O 3.59Å; L349-V355 HydrophobicContact CB-CB 4.38Å; L349-V355 PolarHBondContact O-N 3.01Å; K350-V355 WeakPolarHBondContact CA-O 3.28Å; K350-V355 PolarHBondContact N-O 3.4Å; F353-V355 HydrophobicContact CB-CG2 4.15Å; F353-V355 PolarHBondContact O-N 3.3Å; F353-V355 VanDerWaalsContact O-N 3.17Å; V355-Y357 HydrophobicContact CG1-CD2 3.97Å; V355-Y357 PolarHBondContact O-N 2.85Å; V355-Y357 VanDerWaalsContact O-N 3.14Å
356	D	81.9	Confident	71.1	Confident	49 Å²	49	62.6 Å²	62.6	26%	0.262	33%	0.326	S	S	.	.			trans	-79.3	96	174.4	-155	-21.8	0	0	0	110.6	K350 E358 D359 Y362	K350-D356 VanDerWaalsContact CE-CG 3.46Å; K350-D356 WeakPolarHBondContact CE-OD1 3.39Å; K350-D356 WeakPolarHBondContact CE-OD2 3.27Å; K350-D356 IonicContact NZ-OD1 4Å; K350-D356 PolarHBondContact NZ-OD1 3.18Å; K350-D356 IonicContact NZ-OD2 3.64Å; K350-D356 PolarHBondContact NZ-OD2 3.06Å; D356-E358 PolarHBondContact O-N 3.36Å; D356-E358 PolarHBondContact OD1-N 2.99Å; D356-D359 PolarHBondContact O-N 3.19Å; D356-Y362 VanDerWaalsContact O-CD2 3.23Å; D356-Y362 WeakPolarHBondContact O-CD2 3.3Å; D356-Y362 WeakPolarHBondContact O-CE2 3.45Å
357	Y	74.6	Confident	68.9	Low	17 Å²	17	63.5 Å²	63.5	7%	0.067	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	3.7	-174.9	-138.1	-89.6	0	0	0	113.8	V286 L289 A291 A294 M346 L349 V355 Y362	V286-Y357 HydrophobicContact CB-CE2 4.39Å; V286-Y357 HydrophobicContact CG2-CE2 4.41Å; L289-Y357 PolarHBondContact O-OH 2.84Å; A291-Y357 HydrophobicContact CB-CD1 3.84Å; A291-Y357 HydrophobicContact CB-CE1 3.89Å; A291-Y357 HydrophobicContact CB-CG 4.17Å; A294-Y357 HydrophobicContact CB-CE2 3.71Å; M346-Y357 HydrophobicContact CG-CD1 4.47Å; L349-Y357 HydrophobicContact CD1-CD2 3.55Å; L349-Y357 HydrophobicContact CD1-CE2 3.88Å; L349-Y357 HydrophobicContact CD1-CG 4.21Å; V355-Y357 HydrophobicContact CG1-CD2 3.97Å; V355-Y357 PolarHBondContact O-N 2.85Å; V355-Y357 VanDerWaalsContact O-N 3.14Å; Y357-Y362 PolarHBondContact OH-O 3.39Å
358	E	67.7	Low	66.4	Low	141 Å²	141	63.3 Å²	63.3	66%	0.659	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-18.8	173.6	-64.2	177.9	141.4	0	0	111.8	M346 K350 D356	M346-E358 HydrophobicContact CE-CG 3.51Å; K350-E358 IonicContact NZ-OE2 3.61Å; K350-E358 PolarHBondContact NZ-OE2 3.3Å; D356-E358 PolarHBondContact O-N 3.36Å; D356-E358 PolarHBondContact OD1-N 2.99Å
359	D	61.1	Low	63.7	Low	79 Å²	79	67.7 Å²	67.7	42%	0.422	36%	0.364	S	S	.	.	S	Bend	trans	-67.8	132.7	169.4	-79.6	-30.2	0	0	0	111.1	D356 E361 Y362	D356-D359 PolarHBondContact O-N 3.19Å; D359-E361 PolarHBondContact O-N 3.29Å; D359-Y362 HydrophobicContact CB-CD2 3.93Å; D359-Y362 HydrophobicContact CB-CE2 3.74Å; D359-Y362 WeakPolarHBondContact O-CD2 3.5Å; D359-Y362 PolarHBondContact O-N 3.23Å
360	S	48.3	Very low	61.2	Low	94 Å²	94	72 Å²	72	66%	0.657	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-62.9	-19.7	-171.9	53.8	0	0	0	0	114.8	Y362 S363	S360-Y362 PolarHBondContact O-N 3.43Å; S360-S363 PolarHBondContact O-N 3.09Å; S360-S363 PolarHBondContact O-OG 3.21Å
361	E	54.8	Low	59	Low	133 Å²	133	70.2 Å²	70.2	62%	0.621	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-60	-29.5	178.3	-60.5	-169.7	154.4	0	0	113.4	L287 D359	L287-E361 WeakPolarHBondContact CD2-O 3.49Å; D359-E361 PolarHBondContact O-N 3.29Å
362	Y	53.6	Low	57	Low	3 Å²	3	70.1 Å²	70.1	1%	0.012	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-94.3	-15.2	-177.6	-48.3	-68.9	0	0	0	113.8	R283 V286 L287 D356 Y357 D359 S360	R283-Y362 HydrophobicContact CB-CE1 3.96Å; R283-Y362 VanDerWaalsContact CD-OH 3.27Å; R283-Y362 WeakPolarHBondContact CD-OH 3.33Å; R283-Y362 HydrophobicContact CG-CE1 3.85Å; R283-Y362 WeakPolarHBondContact CG-OH 3.36Å; R283-Y362 VanDerWaalsContact CZ-OH 3.28Å; R283-Y362 PolarHBondContact NE-OH 3.02Å; R283-Y362 PolarHBondContact NH1-OH 3.23Å; V286-Y362 HydrophobicContact CG2-CD1 4.01Å; L287-Y362 HydrophobicContact CD2-CD1 4.19Å; L287-Y362 HydrophobicContact CD2-CE1 4.5Å; D356-Y362 VanDerWaalsContact O-CD2 3.23Å; D356-Y362 WeakPolarHBondContact O-CD2 3.3Å; D356-Y362 WeakPolarHBondContact O-CE2 3.45Å; Y357-Y362 PolarHBondContact OH-O 3.39Å; D359-Y362 HydrophobicContact CB-CD2 3.93Å; D359-Y362 HydrophobicContact CB-CE2 3.74Å; D359-Y362 WeakPolarHBondContact O-CD2 3.5Å; D359-Y362 PolarHBondContact O-N 3.23Å; S360-Y362 PolarHBondContact O-N 3.43Å
363	S	45.2	Very low	54.8	Low	60 Å²	60	75 Å²	75	42%	0.42	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-17.2	-167	68.4	0	0	0	0	115.1	S360 P365	S360-S363 PolarHBondContact O-N 3.09Å; S360-S363 PolarHBondContact O-OG 3.21Å; S363-P365 WeakPolarHBondContact O-CD 3.38Å
364	S	43	Very low	53.2	Low	80 Å²	80	79.9 Å²	79.9	56%	0.559	43%	0.432	S	S	*	.			trans	-100.3	112.8	-174.8	-165.4	0	0	0	0	112	L366	S364-L366 PolarHBondContact O-N 3.26Å
365	P	42	Very low	52.1	Low	31 Å²	31	75.8 Å²	75.8	20%	0.201	41%	0.412	C	S	.	.			trans	-72.9	99.2	168.9	30.8	-33.3	0	0	0	109.4	G288 S363 V367 S387	G288-P365 WeakPolarHBondContact O-CB 3.46Å; S363-P365 WeakPolarHBondContact O-CD 3.38Å; P365-V367 VanDerWaalsContact C-N 3.35Å; P365-V367 PolarHBondContact O-N 2.99Å; P365-S387 VanDerWaalsContact CD-OG 3.25Å; P365-S387 WeakPolarHBondContact CD-OG 3.41Å; P365-S387 WeakPolarHBondContact CG-OG 3.45Å
366	L	41.4	Very low	51.5	Low	126 Å²	126	77.5 Å²	77.5	66%	0.66	42%	0.422	S	S	*	.			trans	-49.9	104.6	150.3	-77.4	156.9	0	0	0	107.9	S364 M368	S364-L366 PolarHBondContact O-N 3.26Å; L366-M368 HydrophobicContact CB-CE 3.69Å; L366-M368 VanDerWaalsContact O-CE 3.23Å; L366-M368 WeakPolarHBondContact O-CE 3.47Å; L366-M368 PolarHBondContact O-N 3.36Å
367	V	43	Very low	50.9	Low	56 Å²	56	76.6 Å²	76.6	34%	0.339	42%	0.419	S	S	.	.			trans	-58.3	106.5	176.4	179.4	0	0	0	0	107.3	P365 D371 L372 L380 V384	P365-V367 VanDerWaalsContact C-N 3.35Å; P365-V367 PolarHBondContact O-N 2.99Å; V367-D371 HydrophobicContact CG1-CB 4.25Å; V367-L372 HydrophobicContact CG1-CD2 3.89Å; V367-L372 HydrophobicContact CG1-CG 3.93Å; V367-L380 HydrophobicContact CG1-CD2 3.72Å; V367-V384 HydrophobicContact CG2-CG2 3.81Å
368	M	38.1	Very low	50.8	Low	94 Å²	94	76.7 Å²	76.7	46%	0.463	42%	0.422	S	S	.	.			trans	-62.7	143.7	-174.3	-72.5	-71.1	105.6	0	0	109.9	L366 K370 D371 L372	L366-M368 HydrophobicContact CB-CE 3.69Å; L366-M368 VanDerWaalsContact O-CE 3.23Å; L366-M368 WeakPolarHBondContact O-CE 3.47Å; L366-M368 PolarHBondContact O-N 3.36Å; M368-K370 PolarHBondContact O-N 2.98Å; M368-D371 HydrophobicContact CB-CB 4.46Å; M368-D371 WeakPolarHBondContact O-CA 3.26Å; M368-D371 WeakPolarHBondContact O-CB 3.42Å; M368-D371 PolarHBondContact O-N 2.69Å; M368-L372 PolarHBondContact O-N 2.94Å
369	P	35.8	Very low	51	Low	91 Å²	91	74.5 Å²	74.5	59%	0.591	41%	0.412	S	S	*	.	H	α-helix	trans	-55.9	-26	177.3	-29.7	36.6	0	0	0	114.4
370	K	38.1	Very low	51.3	Low	90 Å²	90	71.3 Å²	71.3	39%	0.391	40%	0.395	S	S	.	.	H	α-helix	trans	-70.5	-29.8	170.5	-78.6	-165.3	171.4	-179.6	0	114.2	L37 M368 Q373 T374	L37-K370 HydrophobicContact CB-CD 4.48Å; L37-K370 VanDerWaalsContact CB-CE 3.45Å; L37-K370 VanDerWaalsContact CB-NZ 3.33Å; L37-K370 HydrophobicContact CD1-CD 3.8Å; L37-K370 HydrophobicContact CD1-CG 3.93Å; M368-K370 PolarHBondContact O-N 2.98Å; K370-Q373 PolarHBondContact O-N 2.67Å; K370-T374 WeakPolarHBondContact O-CB 3.44Å; K370-T374 WeakPolarHBondContact O-CG2 3.44Å; K370-T374 PolarHBondContact O-N 2.96Å; K370-T374 PolarHBondContact O-OG1 3.02Å
371	D	42.3	Very low	52.3	Low	43 Å²	43	67 Å²	67	23%	0.23	36%	0.364	C	S	.	.	H	α-helix	trans	-72.4	-41.1	179.9	-76.3	-9.8	0	0	0	110.6	V367 M368 Q373 T374 K375 L380	V367-D371 HydrophobicContact CG1-CB 4.25Å; M368-D371 HydrophobicContact CB-CB 4.46Å; M368-D371 WeakPolarHBondContact O-CA 3.26Å; M368-D371 WeakPolarHBondContact O-CB 3.42Å; M368-D371 PolarHBondContact O-N 2.69Å; D371-Q373 PolarHBondContact O-N 3.38Å; D371-Q373 VanDerWaalsContact O-N 3.11Å; D371-T374 PolarHBondContact O-N 2.59Å; D371-T374 VanDerWaalsContact O-N 3.15Å; D371-K375 HydrophobicContact CB-CD 3.89Å; D371-K375 HydrophobicContact CB-CG 4.44Å; D371-K375 WeakPolarHBondContact O-CB 3.42Å; D371-K375 PolarHBondContact O-N 3.28Å; D371-K375 VanDerWaalsContact OD1-CE 3.23Å; D371-K375 WeakPolarHBondContact OD1-CE 3.11Å; D371-K375 IonicContact OD1-NZ 2.82Å; D371-K375 PolarHBondContact OD1-NZ 3.4Å; D371-K375 IonicContact OD2-NZ 3.69Å; D371-K375 PolarHBondContact OD2-NZ 3.31Å; D371-L380 HydrophobicContact CB-CD2 4.15Å
372	L	46.8	Very low	53.1	Low	111 Å²	111	62.4 Å²	62.4	58%	0.581	34%	0.344	S	S	*	.	H	α-helix	trans	-54.5	-28.1	171.7	-68.7	172.3	0	0	0	113.4	V367 M368 L380	V367-L372 HydrophobicContact CG1-CD2 3.89Å; V367-L372 HydrophobicContact CG1-CG 3.93Å; M368-L372 PolarHBondContact O-N 2.94Å; L372-L380 HydrophobicContact CD2-CD1 4.18Å; L372-L380 HydrophobicContact CD2-CD2 4.44Å
373	Q	41.5	Very low	53.6	Low	139 Å²	139	66.2 Å²	66.2	65%	0.65	36%	0.362	S	S	*	.	H	α-helix	trans	-95	-18.1	-178.5	-64.9	-178.9	-4.2	0	0	114.3	K370 D371	K370-Q373 PolarHBondContact O-N 2.67Å; D371-Q373 PolarHBondContact O-N 3.38Å; D371-Q373 VanDerWaalsContact O-N 3.11Å
374	T	51.6	Low	54.4	Low	107 Å²	107	64 Å²	64	66%	0.656	35%	0.346	S	S	*	.	H	α-helix	trans	-116	-25.6	-171.4	55.2	0	0	0	0	113.9	K370 D371	K370-T374 WeakPolarHBondContact O-CB 3.44Å; K370-T374 WeakPolarHBondContact O-CG2 3.44Å; K370-T374 PolarHBondContact O-N 2.96Å; K370-T374 PolarHBondContact O-OG1 3.02Å; D371-T374 PolarHBondContact O-N 2.59Å; D371-T374 VanDerWaalsContact O-N 3.15Å
375	K	60.7	Low	55.4	Low	47 Å²	47	60.3 Å²	60.3	20%	0.204	32%	0.32	C	S	.	.	S	Bend	trans	-99.3	138.8	-179.2	-60.7	-178.7	-175.6	171	0	109.8	D371 Q379 L380 E383	D371-K375 HydrophobicContact CB-CD 3.89Å; D371-K375 HydrophobicContact CB-CG 4.44Å; D371-K375 WeakPolarHBondContact O-CB 3.42Å; D371-K375 PolarHBondContact O-N 3.28Å; D371-K375 VanDerWaalsContact OD1-CE 3.23Å; D371-K375 WeakPolarHBondContact OD1-CE 3.11Å; D371-K375 IonicContact OD1-NZ 2.82Å; D371-K375 PolarHBondContact OD1-NZ 3.4Å; D371-K375 IonicContact OD2-NZ 3.69Å; D371-K375 PolarHBondContact OD2-NZ 3.31Å; K375-Q379 HydrophobicContact CB-CB 4.03Å; K375-L380 HydrophobicContact CB-CD2 3.95Å; K375-L380 HydrophobicContact CB-CG 3.8Å; K375-L380 HydrophobicContact CD-CD2 4.23Å; K375-E383 WeakPolarHBondContact CD-OE2 3.42Å; K375-E383 WeakPolarHBondContact CE-OE1 3.24Å; K375-E383 WeakPolarHBondContact CE-OE2 3.42Å; K375-E383 IonicContact NZ-OE1 2.74Å; K375-E383 PolarHBondContact NZ-OE1 3.49Å; K375-E383 IonicContact NZ-OE2 3.9Å; K375-E383 PolarHBondContact NZ-OE2 3.03Å
376	T	70.7	Confident	56.5	Low	36 Å²	36	62.4 Å²	62.4	22%	0.221	33%	0.332	C	S	.	.			trans	-68.1	158.2	173.9	59.9	0	0	0	0	110.9	C378 Q379 L380	T376-C378 PolarHBondContact O-N 2.87Å; T376-C378 VanDerWaalsContact O-N 3.16Å; T376-Q379 WeakPolarHBondContact O-CA 3.37Å; T376-Q379 WeakPolarHBondContact O-CB 3.12Å; T376-Q379 PolarHBondContact O-N 3.06Å; T376-Q379 WeakPolarHBondContact OG1-CG 2.86Å; T376-Q379 PolarHBondContact OG1-OE1 3.17Å; T376-L380 PolarHBondContact O-N 3.12Å
377	P	69.4	Low	57.1	Low	30 Å²	30	58 Å²	58	20%	0.195	31%	0.312	C	S	.	.	H	α-helix	trans	-49.2	-42.6	174.5	-31	36.9	0	0	0	112.9	Q379 L380 L381 Q430 A433 S434 L437	P377-Q379 PolarHBondContact O-N 3.46Å; P377-L380 PolarHBondContact O-N 3.18Å; P377-L381 VanDerWaalsContact O-CB 3.28Å; P377-L381 WeakPolarHBondContact O-CB 3.19Å; P377-L381 PolarHBondContact O-N 3.31Å; P377-Q430 WeakPolarHBondContact CB-O 3.3Å; P377-A433 HydrophobicContact CB-CB 4.05Å; P377-S434 WeakPolarHBondContact CB-OG 3.41Å; P377-S434 VanDerWaalsContact CG-OG 3.28Å; P377-S434 WeakPolarHBondContact CG-OG 3.35Å; P377-L437 HydrophobicContact CB-CD1 3.84Å; P377-L437 VanDerWaalsContact O-CD1 3.26Å; P377-L437 WeakPolarHBondContact O-CD1 3.31Å
378	C	72.3	Confident	57.7	Low	19 Å²	19	60.4 Å²	60.4	13%	0.128	32%	0.319	C	S	.	.	H	α-helix	trans	-58.8	-30.1	174.8	-51.4	0	0	0	0	114.4	T376 N382 Y395 K429 Q430 A433	T376-C378 PolarHBondContact O-N 2.87Å; T376-C378 VanDerWaalsContact O-N 3.16Å; C378-N382 WeakPolarHBondContact O-CB 3.45Å; C378-N382 PolarHBondContact O-ND2 3.41Å; C378-Y395 PolarHBondContact SG-OH 2.87Å; C378-K429 PolarHBondContact SG-O 3.22Å; C378-Q430 VanDerWaalsContact SG-CA 3.59Å; C378-A433 HydrophobicContact CB-CB 4.34Å
379	Q	71.1	Confident	58.4	Low	95 Å²	95	58.1 Å²	58.1	44%	0.444	32%	0.32	S	S	.	.	H	α-helix	trans	-83.9	-46.9	178.8	-71	165.3	-78.1	0	0	110.6	K375 T376 P377 L381 N382 E383	K375-Q379 HydrophobicContact CB-CB 4.03Å; T376-Q379 WeakPolarHBondContact O-CA 3.37Å; T376-Q379 WeakPolarHBondContact O-CB 3.12Å; T376-Q379 PolarHBondContact O-N 3.06Å; T376-Q379 WeakPolarHBondContact OG1-CG 2.86Å; T376-Q379 PolarHBondContact OG1-OE1 3.17Å; P377-Q379 PolarHBondContact O-N 3.46Å; Q379-L381 PolarHBondContact O-N 3.32Å; Q379-N382 PolarHBondContact O-N 3.44Å; Q379-E383 WeakPolarHBondContact O-CG 3.25Å; Q379-E383 PolarHBondContact O-N 3.23Å
380	L	67	Low	59.4	Low	12 Å²	12	57.2 Å²	57.2	6%	0.063	31%	0.308	C	S	.	.	H	α-helix	trans	-56	-50.3	177	-71	164.5	0	0	0	111.5	V367 D371 L372 K375 T376 P377 N382 E383 V384 L437	V367-L380 HydrophobicContact CG1-CD2 3.72Å; D371-L380 HydrophobicContact CB-CD2 4.15Å; L372-L380 HydrophobicContact CD2-CD1 4.18Å; L372-L380 HydrophobicContact CD2-CD2 4.44Å; K375-L380 HydrophobicContact CB-CD2 3.95Å; K375-L380 HydrophobicContact CB-CG 3.8Å; K375-L380 HydrophobicContact CD-CD2 4.23Å; T376-L380 PolarHBondContact O-N 3.12Å; P377-L380 PolarHBondContact O-N 3.18Å; L380-N382 PolarHBondContact O-N 2.9Å; L380-E383 PolarHBondContact O-N 2.89Å; L380-V384 WeakPolarHBondContact O-CG2 3.36Å; L380-V384 PolarHBondContact O-N 3.21Å; L380-L437 HydrophobicContact CB-CD1 3.88Å; L380-L437 HydrophobicContact CB-CD2 4.47Å
381	L	70.5	Confident	60.8	Low	3 Å²	3	56.6 Å²	56.6	2%	0.016	31%	0.312	C	S	.	.	H	α-helix	trans	-58.1	-49.1	177.1	-178.5	64	0	0	0	111.6	P377 Q379 E383 V384 L385 V393 A433 D436 L437	P377-L381 VanDerWaalsContact O-CB 3.28Å; P377-L381 WeakPolarHBondContact O-CB 3.19Å; P377-L381 PolarHBondContact O-N 3.31Å; Q379-L381 PolarHBondContact O-N 3.32Å; L381-E383 VanDerWaalsContact C-N 3.31Å; L381-E383 PolarHBondContact O-N 2.91Å; L381-V384 PolarHBondContact O-N 3.22Å; L381-L385 HydrophobicContact CD1-CD1 4.26Å; L381-L385 HydrophobicContact CD1-CG 4.31Å; L381-L385 HydrophobicContact CG-CD1 4.1Å; L381-L385 HydrophobicContact CG-CG 4.49Å; L381-L385 VanDerWaalsContact O-CG 3.27Å; L381-L385 WeakPolarHBondContact O-CG 3.25Å; L381-L385 PolarHBondContact O-N 2.83Å; L381-V393 HydrophobicContact CD2-CG2 3.6Å; L381-V393 HydrophobicContact CG-CG2 3.99Å; L381-A433 HydrophobicContact CD2-CB 3.81Å; L381-D436 HydrophobicContact CD1-CB 3.95Å; L381-D436 HydrophobicContact CD2-CB 3.56Å; L381-D436 WeakPolarHBondContact CD2-OD2 3.32Å; L381-D436 HydrophobicContact CG-CB 4.41Å; L381-L437 HydrophobicContact CB-CD1 4.09Å; L381-L437 HydrophobicContact CB-CG 4.11Å; L381-L437 HydrophobicContact CD1-CG 4.38Å
382	N	72	Confident	62.1	Low	37 Å²	37	56.9 Å²	56.9	20%	0.198	32%	0.316	C	S	.	.	H	α-helix	trans	-65.5	-31.8	-179.9	-82.6	-48.9	0	0	0	113.4	C378 Q379 L380 V386 P392 V393	C378-N382 WeakPolarHBondContact O-CB 3.45Å; C378-N382 PolarHBondContact O-ND2 3.41Å; Q379-N382 PolarHBondContact O-N 3.44Å; L380-N382 PolarHBondContact O-N 2.9Å; N382-V386 VanDerWaalsContact O-CB 3.24Å; N382-V386 WeakPolarHBondContact O-CB 3.38Å; N382-V386 WeakPolarHBondContact O-CG2 3.44Å; N382-V386 PolarHBondContact O-N 3.16Å; N382-P392 WeakPolarHBondContact OD1-CA 3.36Å; N382-P392 VanDerWaalsContact OD1-CB 3.23Å; N382-P392 WeakPolarHBondContact OD1-CB 3.36Å; N382-V393 PolarHBondContact OD1-N 2.96Å
383	E	64.3	Low	63.4	Low	84 Å²	84	52.1 Å²	52.1	39%	0.393	29%	0.291	S	S	.	.	H	α-helix	trans	-70.4	-43.4	173.6	-73.5	176.2	162	0	0	111.9	K375 Q379 L380 L381 V386 S387	K375-E383 WeakPolarHBondContact CD-OE2 3.42Å; K375-E383 WeakPolarHBondContact CE-OE1 3.24Å; K375-E383 WeakPolarHBondContact CE-OE2 3.42Å; K375-E383 IonicContact NZ-OE1 2.74Å; K375-E383 PolarHBondContact NZ-OE1 3.49Å; K375-E383 IonicContact NZ-OE2 3.9Å; K375-E383 PolarHBondContact NZ-OE2 3.03Å; Q379-E383 WeakPolarHBondContact O-CG 3.25Å; Q379-E383 PolarHBondContact O-N 3.23Å; L380-E383 PolarHBondContact O-N 2.89Å; L381-E383 VanDerWaalsContact C-N 3.31Å; L381-E383 PolarHBondContact O-N 2.91Å; E383-V386 PolarHBondContact O-N 3.36Å; E383-S387 WeakPolarHBondContact O-CB 3.48Å; E383-S387 PolarHBondContact O-N 3.21Å; E383-S387 PolarHBondContact O-OG 3.41Å
384	V	62	Low	65	Low	14 Å²	14	52.4 Å²	52.4	9%	0.085	29%	0.293	C	S	.	.	H	α-helix	trans	-59	-51.4	174.7	172	0	0	0	0	110.4	V367 L380 L381 V386 S387 Q388 L440	V367-V384 HydrophobicContact CG2-CG2 3.81Å; L380-V384 WeakPolarHBondContact O-CG2 3.36Å; L380-V384 PolarHBondContact O-N 3.21Å; L381-V384 PolarHBondContact O-N 3.22Å; V384-V386 PolarHBondContact O-N 3.26Å; V384-S387 PolarHBondContact O-N 3.47Å; V384-S387 PolarHBondContact O-OG 3.21Å; V384-Q388 WeakPolarHBondContact O-CG 3.31Å; V384-Q388 PolarHBondContact O-N 2.92Å; V384-L440 HydrophobicContact CG1-CD2 3.71Å
385	L	63.9	Low	66.3	Low	2 Å²	2	49.4 Å²	49.4	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-61.1	-47	179.3	-64.9	177.6	0	0	0	112.5	L381 S387 Q388 G389 Q390 V393 F413	L381-L385 HydrophobicContact CD1-CD1 4.26Å; L381-L385 HydrophobicContact CD1-CG 4.31Å; L381-L385 HydrophobicContact CG-CD1 4.1Å; L381-L385 HydrophobicContact CG-CG 4.49Å; L381-L385 VanDerWaalsContact O-CG 3.27Å; L381-L385 WeakPolarHBondContact O-CG 3.25Å; L381-L385 PolarHBondContact O-N 2.83Å; L385-S387 PolarHBondContact O-N 3.02Å; L385-Q388 CarbonylContact O-C 3.58Å; L385-Q388 PolarHBondContact O-N 3.5Å; L385-G389 PolarHBondContact O-N 2.89Å; L385-Q390 HydrophobicContact CB-CB 4.38Å; L385-Q390 VanDerWaalsContact CD2-OE1 3.22Å; L385-Q390 WeakPolarHBondContact O-CA 3.29Å; L385-Q390 WeakPolarHBondContact O-CB 3.3Å; L385-Q390 PolarHBondContact O-N 3.39Å; L385-V393 HydrophobicContact CD1-CG2 3.41Å; L385-V393 VanDerWaalsContact CD1-CG2 3.41Å; L385-F413 HydrophobicContact CD1-CD2 3.74Å; L385-F413 HydrophobicContact CD1-CE2 3.67Å; L385-F413 HydrophobicContact CD1-CZ 4.4Å; L385-F413 HydrophobicContact CD2-CD2 4.25Å; L385-F413 HydrophobicContact CD2-CE1 4.17Å; L385-F413 HydrophobicContact CD2-CE2 3.43Å; L385-F413 VanDerWaalsContact CD2-CE2 3.43Å; L385-F413 HydrophobicContact CD2-CZ 3.38Å; L385-F413 HydrophobicContact CG-CE2 4.11Å; L385-F413 HydrophobicContact CG-CZ 4.5Å
386	V	64.2	Low	66.6	Low	74 Å²	74	51 Å²	51	45%	0.448	28%	0.283	S	S	.	.	H	α-helix	trans	-60.6	-34	177.5	165.2	0	0	0	0	111.7	N382 E383 V384 G389 P392	N382-V386 VanDerWaalsContact O-CB 3.24Å; N382-V386 WeakPolarHBondContact O-CB 3.38Å; N382-V386 WeakPolarHBondContact O-CG2 3.44Å; N382-V386 PolarHBondContact O-N 3.16Å; E383-V386 PolarHBondContact O-N 3.36Å; V384-V386 PolarHBondContact O-N 3.26Å; V386-G389 PolarHBondContact O-N 2.97Å; V386-P392 HydrophobicContact CG2-CG 3.67Å
387	S	54.5	Low	66.9	Low	34 Å²	34	50.3 Å²	50.3	24%	0.238	28%	0.284	C	S	.	.	H	α-helix	trans	-73.8	-34.8	178.1	77.7	0	0	0	0	113.9	P365 E383 V384 L385 G389	P365-S387 VanDerWaalsContact CD-OG 3.25Å; P365-S387 WeakPolarHBondContact CD-OG 3.41Å; P365-S387 WeakPolarHBondContact CG-OG 3.45Å; E383-S387 WeakPolarHBondContact O-CB 3.48Å; E383-S387 PolarHBondContact O-N 3.21Å; E383-S387 PolarHBondContact O-OG 3.41Å; V384-S387 PolarHBondContact O-N 3.47Å; V384-S387 PolarHBondContact O-OG 3.21Å; L385-S387 PolarHBondContact O-N 3.02Å; S387-G389 PolarHBondContact O-N 3.07Å; S387-G389 VanDerWaalsContact O-N 3.1Å
388	Q	55.4	Low	67.4	Low	106 Å²	106	52.7 Å²	52.7	50%	0.495	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	8.1	169.9	-65.1	177.8	1.1	0	0	112	V384 L385 Q390	V384-Q388 WeakPolarHBondContact O-CG 3.31Å; V384-Q388 PolarHBondContact O-N 2.92Å; L385-Q388 CarbonylContact O-C 3.58Å; L385-Q388 PolarHBondContact O-N 3.5Å; Q388-Q390 HydrophobicContact CB-CG 4.46Å; Q388-Q390 PolarHBondContact O-N 3.03Å
389	G	53.1	Low	67.9	Low	46 Å²	46	56.1 Å²	56.1	47%	0.474	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	2.1	179	0	0	0	0	0	114.6	L385 V386 S387	L385-G389 PolarHBondContact O-N 2.89Å; V386-G389 PolarHBondContact O-N 2.97Å; S387-G389 PolarHBondContact O-N 3.07Å; S387-G389 VanDerWaalsContact O-N 3.1Å
390	Q	56.8	Low	68.2	Low	73 Å²	73	56.2 Å²	56.2	34%	0.341	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-80.8	172.6	-179.1	-65.2	174.7	-38.8	0	0	111.5	L385 Q388	L385-Q390 HydrophobicContact CB-CB 4.38Å; L385-Q390 VanDerWaalsContact CD2-OE1 3.22Å; L385-Q390 WeakPolarHBondContact O-CA 3.29Å; L385-Q390 WeakPolarHBondContact O-CB 3.3Å; L385-Q390 PolarHBondContact O-N 3.39Å; Q388-Q390 HydrophobicContact CB-CG 4.46Å; Q388-Q390 PolarHBondContact O-N 3.03Å
391	T	66.4	Low	68.5	Low	77 Å²	77	56.8 Å²	56.8	47%	0.472	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-84.7	141.6	179.4	51.5	0	0	0	0	111.8	R338	R338-T391 VanDerWaalsContact NH1-CG2 3.28Å
392	P	70.6	Confident	68.1	Low	49 Å²	49	62 Å²	62	32%	0.318	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-51.5	144.1	167.4	-25.2	32.9	0	0	0	112.1	N382 V386 E394	N382-P392 WeakPolarHBondContact OD1-CA 3.36Å; N382-P392 VanDerWaalsContact OD1-CB 3.23Å; N382-P392 WeakPolarHBondContact OD1-CB 3.36Å; V386-P392 HydrophobicContact CG2-CG 3.67Å; P392-E394 PolarHBondContact O-N 3.41Å
393	V	73.3	Confident	67.8	Low	11 Å²	11	63.7 Å²	63.7	7%	0.067	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-56.9	122.9	177.8	-179.1	0	0	0	0	110.6	L381 N382 L385 Y395 A411	L381-V393 HydrophobicContact CD2-CG2 3.6Å; L381-V393 HydrophobicContact CG-CG2 3.99Å; N382-V393 PolarHBondContact OD1-N 2.96Å; L385-V393 HydrophobicContact CD1-CG2 3.41Å; L385-V393 VanDerWaalsContact CD1-CG2 3.41Å; V393-Y395 HydrophobicContact CB-CE2 4.32Å; V393-Y395 HydrophobicContact CG1-CE2 4.19Å; V393-A411 HydrophobicContact CG1-CB 3.57Å
394	E	74.6	Confident	68	Low	145 Å²	145	62.4 Å²	62.4	68%	0.678	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	120.2	176.1	-173	147.3	-129.6	0	0	109.6	P392 T396 K412	P392-E394 PolarHBondContact O-N 3.41Å; E394-T396 PolarHBondContact O-N 3.22Å; E394-K412 PolarHBondContact N-O 2.9Å; E394-K412 PolarHBondContact O-N 3.14Å
395	Y	79.5	Confident	68.5	Low	44 Å²	44	69.3 Å²	69.3	17%	0.173	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	95.4	179.9	-69.2	-92.4	0	0	0	109.3	C378 V393 G397 F410 A411 K429	C378-Y395 PolarHBondContact SG-OH 2.87Å; V393-Y395 HydrophobicContact CB-CE2 4.32Å; V393-Y395 HydrophobicContact CG1-CE2 4.19Å; Y395-G397 VanDerWaalsContact C-N 3.32Å; Y395-G397 PolarHBondContact O-N 2.9Å; Y395-F410 CarbonylContact C-O 3.53Å; Y395-F410 WeakPolarHBondContact CA-O 3.46Å; Y395-A411 HydrophobicContact CD1-CB 4.03Å; Y395-A411 HydrophobicContact CE1-CB 4.08Å; Y395-K429 VanDerWaalsContact CB-CE 3.45Å; Y395-K429 HydrophobicContact CD1-CB 4.31Å; Y395-K429 HydrophobicContact CD1-CD 3.56Å; Y395-K429 HydrophobicContact CD1-CG 3.57Å; Y395-K429 HydrophobicContact CD2-CD 4.13Å; Y395-K429 HydrophobicContact CE1-CB 3.71Å; Y395-K429 HydrophobicContact CE1-CD 3.65Å; Y395-K429 HydrophobicContact CE1-CG 3.5Å; Y395-K429 VanDerWaalsContact CE1-CG 3.5Å; Y395-K429 HydrophobicContact CE2-CD 4.23Å; Y395-K429 HydrophobicContact CG-CD 3.8Å; Y395-K429 HydrophobicContact CG-CG 4.32Å
396	T	68	Low	69.4	Low	79 Å²	79	69.7 Å²	69.7	49%	0.485	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	-20.7	-167.2	48.7	0	0	0	0	114.4	E394 F410 K412	E394-T396 PolarHBondContact O-N 3.22Å; T396-F410 PolarHBondContact N-O 2.94Å; T396-F410 VanDerWaalsContact N-O 3.07Å; T396-F410 WeakPolarHBondContact OG1-CB 3.29Å; T396-K412 HydrophobicContact CG2-CB 3.67Å
397	G	75.7	Confident	70.4	Confident	23 Å²	23	69.4 Å²	69.4	24%	0.237	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	169.8	-178.8	0	0	0	0	0	115.6	Y395 F410	Y395-G397 VanDerWaalsContact C-N 3.32Å; Y395-G397 PolarHBondContact O-N 2.9Å; G397-F410 PolarHBondContact O-N 3.46Å; G397-F410 VanDerWaalsContact O-N 3.14Å
398	F	80.5	Confident	71.8	Confident	80 Å²	80	71.2 Å²	71.2	35%	0.351	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	116.6	166.7	-66.6	-80	0	0	0	109.7	R408 A409 K425 K429	F398-R408 CarbonylContact C-O 3.53Å; F398-R408 VanDerWaalsContact CA-O 3.29Å; F398-R408 WeakPolarHBondContact CA-O 3.37Å; F398-A409 HydrophobicContact CD1-CB 4.1Å; F398-A409 HydrophobicContact CE1-CB 4.26Å; F398-K425 HydrophobicContact CB-CD 4.34Å; F398-K425 HydrophobicContact CD1-CB 3.99Å; F398-K425 HydrophobicContact CD1-CD 3.89Å; F398-K425 HydrophobicContact CD1-CG 3.76Å; F398-K425 HydrophobicContact CD2-CD 4.12Å; F398-K425 HydrophobicContact CE1-CB 3.51Å; F398-K425 HydrophobicContact CE1-CD 3.98Å; F398-K425 HydrophobicContact CE1-CG 3.8Å; F398-K425 HydrophobicContact CE2-CD 4.19Å; F398-K425 HydrophobicContact CG-CD 3.92Å; F398-K425 HydrophobicContact CG-CG 4.28Å; F398-K425 HydrophobicContact CZ-CB 3.97Å; F398-K425 HydrophobicContact CZ-CD 4.08Å; F398-K425 HydrophobicContact CZ-CG 4.34Å; F398-K429 HydrophobicContact CE1-CD 4.34Å; F398-K429 HydrophobicContact CE1-CG 4.11Å; F398-K429 HydrophobicContact CZ-CD 4.25Å
399	D	82	Confident	73.3	Confident	90 Å²	90	66.2 Å²	66.2	48%	0.481	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	164.6	168.2	-67.6	-24.2	0	0	0	110.6	F407 R408 F410	D399-F407 WeakPolarHBondContact O-CA 3.21Å; D399-R408 HydrophobicContact CB-CB 4.31Å; D399-R408 PolarHBondContact N-O 3.47Å; D399-R408 PolarHBondContact O-N 2.7Å; D399-F410 HydrophobicContact CB-CE2 4.07Å; D399-F410 VanDerWaalsContact OD2-CE2 3.23Å; D399-F410 WeakPolarHBondContact OD2-CE2 3.18Å; D399-F410 WeakPolarHBondContact OD2-CZ 3.43Å
400	V	78.1	Confident	74.7	Confident	97 Å²	97	66 Å²	66	59%	0.588	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	135.9	156.8	-178.9	0	0	0	0	106.6
401	D	72.7	Confident	75.8	Confident	24 Å²	24	62.5 Å²	62.5	13%	0.128	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-63.8	142.5	178.2	-172.3	78.5	0	0	0	110.8	S403 G404 G406 R408 C421	D401-S403 PolarHBondContact O-N 2.87Å; D401-S403 WeakPolarHBondContact OD2-CB 3.3Å; D401-S403 PolarHBondContact OD2-N 3.36Å; D401-S403 VanDerWaalsContact OD2-N 3.13Å; D401-S403 PolarHBondContact OD2-OG 3.23Å; D401-G404 WeakPolarHBondContact O-CA 3.38Å; D401-G404 PolarHBondContact O-N 3.2Å; D401-G406 PolarHBondContact N-O 3.14Å; D401-R408 IonicContact OD1-CZ 2.71Å; D401-R408 IonicContact OD1-NE 2.73Å; D401-R408 PolarHBondContact OD1-NE 2.97Å; D401-R408 VanDerWaalsContact OD1-NE 3.16Å; D401-R408 IonicContact OD1-NH2 3.13Å; D401-R408 PolarHBondContact OD1-NH2 3.49Å; D401-C421 PolarHBondContact OD1-SG 3.26Å
402	P	61.9	Low	76.1	Confident	114 Å²	114	62.6 Å²	62.6	74%	0.74	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-21	-177.8	-28.7	37.3	0	0	0	115.7	G404	P402-G404 PolarHBondContact O-N 3.06Å
403	S	65.9	Low	75.9	Confident	71 Å²	71	61.8 Å²	61.8	50%	0.497	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-16.6	170.7	60.9	0	0	0	0	114.4	D401 Q405	D401-S403 PolarHBondContact O-N 2.87Å; D401-S403 WeakPolarHBondContact OD2-CB 3.3Å; D401-S403 PolarHBondContact OD2-N 3.36Å; D401-S403 VanDerWaalsContact OD2-N 3.13Å; D401-S403 PolarHBondContact OD2-OG 3.23Å; S403-Q405 PolarHBondContact O-N 3.27Å; S403-Q405 PolarHBondContact OG-N 3.26Å
404	G	69.6	Low	75.4	Confident	58 Å²	58	67.6 Å²	67.6	60%	0.598	37%	0.369	S	S	*	.	S	Bend	trans	74.8	-5.6	-168.8	0	0	0	0	0	114.7	D401 P402	D401-G404 WeakPolarHBondContact O-CA 3.38Å; D401-G404 PolarHBondContact O-N 3.2Å; P402-G404 PolarHBondContact O-N 3.06Å
405	Q	71.7	Confident	75.1	Confident	159 Å²	159	66.9 Å²	66.9	74%	0.743	37%	0.37	S	S	*	.	S	Bend	trans	-93.7	-2.4	-169.4	-58.1	-170.7	16.1	0	0	114.7	S403 L423	S403-Q405 PolarHBondContact O-N 3.27Å; S403-Q405 PolarHBondContact OG-N 3.26Å; Q405-L423 WeakPolarHBondContact O-CD2 3.47Å
406	G	82.5	Confident	74.3	Confident	10 Å²	10	67.9 Å²	67.9	10%	0.103	38%	0.376	C	S	.	.	S	Bend	trans	-162	-173.3	-175.9	0	0	0	0	0	114.9	D401	D401-G406 PolarHBondContact N-O 3.14Å
407	F	85.9	Confident	74.5	Confident	67 Å²	67	69.7 Å²	69.7	29%	0.294	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	136.7	173.9	-64.9	-90.1	0	0	0	109.8	D399 C421 G422 S424 K425 A428	D399-F407 WeakPolarHBondContact O-CA 3.21Å; F407-C421 CarbonylContact O-C 3.56Å; F407-C421 WeakPolarHBondContact O-CA 3.44Å; F407-G422 PolarHBondContact N-O 3.48Å; F407-G422 PolarHBondContact O-N 2.83Å; F407-S424 VanDerWaalsContact CD2-CA 3.49Å; F407-K425 HydrophobicContact CB-CG 4.12Å; F407-K425 HydrophobicContact CD1-CD 4.19Å; F407-K425 HydrophobicContact CD1-CG 3.49Å; F407-K425 VanDerWaalsContact CD1-CG 3.49Å; F407-K425 HydrophobicContact CD2-CG 4.29Å; F407-K425 HydrophobicContact CE1-CD 4.32Å; F407-K425 HydrophobicContact CE1-CG 3.9Å; F407-K425 HydrophobicContact CG-CG 3.69Å; F407-K425 HydrophobicContact CZ-CG 4.45Å; F407-A428 HydrophobicContact CB-CB 4.34Å; F407-A428 WeakPolarHBondContact O-CB 3.49Å
408	R	84.2	Confident	74.5	Confident	73 Å²	73	69.8 Å²	69.8	28%	0.275	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	121.5	171.1	-170.1	170.6	-68.3	-152.2	-3	108.6	F398 D399 D401 F410 I419 G420	F398-R408 CarbonylContact C-O 3.53Å; F398-R408 VanDerWaalsContact CA-O 3.29Å; F398-R408 WeakPolarHBondContact CA-O 3.37Å; D399-R408 HydrophobicContact CB-CB 4.31Å; D399-R408 PolarHBondContact N-O 3.47Å; D399-R408 PolarHBondContact O-N 2.7Å; D401-R408 IonicContact OD1-CZ 2.71Å; D401-R408 IonicContact OD1-NE 2.73Å; D401-R408 PolarHBondContact OD1-NE 2.97Å; D401-R408 VanDerWaalsContact OD1-NE 3.16Å; D401-R408 IonicContact OD1-NH2 3.13Å; D401-R408 PolarHBondContact OD1-NH2 3.49Å; R408-F410 HydrophobicContact CB-CE2 4.45Å; R408-F410 HydrophobicContact CG-CE1 4.46Å; R408-F410 HydrophobicContact CG-CE2 4.03Å; R408-F410 HydrophobicContact CG-CZ 3.9Å; R408-I419 HydrophobicContact CG-CG2 3.51Å; R408-G420 CarbonylContact C-O 3.49Å; R408-G420 WeakPolarHBondContact CA-O 3.41Å
409	A	85.9	Confident	74.5	Confident	0 Å²	0	70 Å²	70	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	134.1	174.5	0	0	0	0	0	109.4	F398 I419 G420 A428 K429	F398-A409 HydrophobicContact CD1-CB 4.1Å; F398-A409 HydrophobicContact CE1-CB 4.26Å; A409-I419 WeakPolarHBondContact O-CA 3.04Å; A409-G420 PolarHBondContact N-O 3.16Å; A409-G420 PolarHBondContact O-N 3.39Å; A409-G420 VanDerWaalsContact O-N 3.11Å; A409-A428 HydrophobicContact CB-CB 3.57Å; A409-K429 HydrophobicContact CB-CG 3.96Å
410	F	81.9	Confident	74.5	Confident	41 Å²	41	65.9 Å²	65.9	18%	0.18	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	135.7	174.7	-57.7	-94.6	0	0	0	109.2	Y395 T396 G397 D399 R408 Y418 I419	Y395-F410 CarbonylContact C-O 3.53Å; Y395-F410 WeakPolarHBondContact CA-O 3.46Å; T396-F410 PolarHBondContact N-O 2.94Å; T396-F410 VanDerWaalsContact N-O 3.07Å; T396-F410 WeakPolarHBondContact OG1-CB 3.29Å; G397-F410 PolarHBondContact O-N 3.46Å; G397-F410 VanDerWaalsContact O-N 3.14Å; D399-F410 HydrophobicContact CB-CE2 4.07Å; D399-F410 VanDerWaalsContact OD2-CE2 3.23Å; D399-F410 WeakPolarHBondContact OD2-CE2 3.18Å; D399-F410 WeakPolarHBondContact OD2-CZ 3.43Å; R408-F410 HydrophobicContact CB-CE2 4.45Å; R408-F410 HydrophobicContact CG-CE1 4.46Å; R408-F410 HydrophobicContact CG-CE2 4.03Å; R408-F410 HydrophobicContact CG-CZ 3.9Å; F410-Y418 WeakPolarHBondContact CA-O 3.38Å; F410-I419 HydrophobicContact CD1-CD1 4.21Å; F410-I419 HydrophobicContact CD1-CG1 3.92Å; F410-I419 HydrophobicContact CE1-CD1 3.93Å; F410-I419 HydrophobicContact CE1-CG1 4.1Å
411	A	80.6	Confident	74.7	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.4	174.6	0	0	0	0	0	108.5	V393 Y395 E417 Y418 S432	V393-A411 HydrophobicContact CG1-CB 3.57Å; Y395-A411 HydrophobicContact CD1-CB 4.03Å; Y395-A411 HydrophobicContact CE1-CB 4.08Å; A411-E417 WeakPolarHBondContact O-CA 2.96Å; A411-Y418 PolarHBondContact N-O 2.8Å; A411-Y418 PolarHBondContact O-N 3.47Å; A411-S432 WeakPolarHBondContact CB-OG 3.47Å
412	K	72.7	Confident	75.2	Confident	79 Å²	79	62.9 Å²	62.9	34%	0.343	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	130.2	173.1	-168	176.7	179.2	-175.4	0	110.2	E394 T396 D415 E416	E394-K412 PolarHBondContact N-O 2.9Å; E394-K412 PolarHBondContact O-N 3.14Å; T396-K412 HydrophobicContact CG2-CB 3.67Å; K412-D415 WeakPolarHBondContact CE-OD1 3.44Å; K412-D415 IonicContact NZ-OD1 2.7Å; K412-D415 PolarHBondContact NZ-OD1 3.44Å; K412-E416 WeakPolarHBondContact CA-O 3.45Å
413	F	67	Low	76.2	Confident	32 Å²	32	63.6 Å²	63.6	14%	0.14	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	128.2	176.8	178	-100.6	0	0	0	109.5	L385 D415 E416 Y418	L385-F413 HydrophobicContact CD1-CD2 3.74Å; L385-F413 HydrophobicContact CD1-CE2 3.67Å; L385-F413 HydrophobicContact CD1-CZ 4.4Å; L385-F413 HydrophobicContact CD2-CD2 4.25Å; L385-F413 HydrophobicContact CD2-CE1 4.17Å; L385-F413 HydrophobicContact CD2-CE2 3.43Å; L385-F413 VanDerWaalsContact CD2-CE2 3.43Å; L385-F413 HydrophobicContact CD2-CZ 3.38Å; L385-F413 HydrophobicContact CG-CE2 4.11Å; L385-F413 HydrophobicContact CG-CZ 4.5Å; F413-D415 VanDerWaalsContact C-N 3.3Å; F413-D415 PolarHBondContact O-N 3.06Å; F413-E416 PolarHBondContact N-O 2.83Å; F413-E416 WeakPolarHBondContact O-CA 3.47Å; F413-E416 WeakPolarHBondContact O-CB 3.47Å; F413-E416 PolarHBondContact O-N 3.4Å; F413-Y418 HydrophobicContact CB-CE2 4.49Å
414	D	63.4	Low	77.1	Confident	133 Å²	133	62.3 Å²	62.3	71%	0.711	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.5	50	179.4	-130.4	24.9	0	0	0	114.4	E416	D414-E416 PolarHBondContact O-N 3.38Å
415	D	67.6	Low	77.8	Confident	131 Å²	131	64.2 Å²	64.2	70%	0.701	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	-1.1	-173.7	-78.9	-38.9	0	0	0	117.9	K412 F413	K412-D415 WeakPolarHBondContact CE-OD1 3.44Å; K412-D415 IonicContact NZ-OD1 2.7Å; K412-D415 PolarHBondContact NZ-OD1 3.44Å; F413-D415 VanDerWaalsContact C-N 3.3Å; F413-D415 PolarHBondContact O-N 3.06Å
416	E	61.8	Low	78.4	Confident	65 Å²	65	63.4 Å²	63.4	30%	0.304	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	142.7	164.3	-67.7	-172.4	126.8	0	0	112.2	K412 F413 D414 Y418 R439	K412-E416 WeakPolarHBondContact CA-O 3.45Å; F413-E416 PolarHBondContact N-O 2.83Å; F413-E416 WeakPolarHBondContact O-CA 3.47Å; F413-E416 WeakPolarHBondContact O-CB 3.47Å; F413-E416 PolarHBondContact O-N 3.4Å; D414-E416 PolarHBondContact O-N 3.38Å; E416-Y418 HydrophobicContact CB-CD2 4.2Å; E416-Y418 HydrophobicContact CB-CE2 3.56Å; E416-Y418 PolarHBondContact OE2-OH 3.13Å; E416-R439 IonicContact OE1-CZ 3.54Å; E416-R439 VanDerWaalsContact OE1-CZ 3.26Å; E416-R439 IonicContact OE1-NH1 3.58Å; E416-R439 PolarHBondContact OE1-NH1 3.38Å; E416-R439 IonicContact OE1-NH2 3.48Å; E416-R439 PolarHBondContact OE1-NH2 3.49Å; E416-R439 IonicContact OE2-CZ 2.81Å; E416-R439 IonicContact OE2-NH1 2.68Å; E416-R439 PolarHBondContact OE2-NH1 3.22Å; E416-R439 IonicContact OE2-NH2 3.57Å
417	E	72.1	Confident	78.3	Confident	116 Å²	116	68.6 Å²	68.6	54%	0.542	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.4	173.5	-68.7	-175	149	0	0	110.3	A411	A411-E417 WeakPolarHBondContact O-CA 2.96Å
418	Y	76	Confident	78.2	Confident	26 Å²	26	65.4 Å²	65.4	10%	0.102	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	147.1	-179.2	-67.9	-92.6	0	0	0	110.7	F410 A411 F413 E416 D436 R439	F410-Y418 WeakPolarHBondContact CA-O 3.38Å; A411-Y418 PolarHBondContact N-O 2.8Å; A411-Y418 PolarHBondContact O-N 3.47Å; F413-Y418 HydrophobicContact CB-CE2 4.49Å; E416-Y418 HydrophobicContact CB-CD2 4.2Å; E416-Y418 HydrophobicContact CB-CE2 3.56Å; E416-Y418 PolarHBondContact OE2-OH 3.13Å; Y418-D436 WeakPolarHBondContact CB-OD1 3.39Å; Y418-D436 WeakPolarHBondContact CD1-OD1 3.28Å; Y418-D436 WeakPolarHBondContact CE1-OD1 3.38Å; Y418-R439 PolarHBondContact OH-NH1 3.3Å
419	I	80.7	Confident	78.2	Confident	85 Å²	85	64.5 Å²	64.5	44%	0.436	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	131.5	-170.8	-56.6	179.9	0	0	0	109.5	R408 A409 F410	R408-I419 HydrophobicContact CG-CG2 3.51Å; A409-I419 WeakPolarHBondContact O-CA 3.04Å; F410-I419 HydrophobicContact CD1-CD1 4.21Å; F410-I419 HydrophobicContact CD1-CG1 3.92Å; F410-I419 HydrophobicContact CE1-CD1 3.93Å; F410-I419 HydrophobicContact CE1-CG1 4.1Å
420	G	82.6	Confident	78.1	Confident	2 Å²	2	66.9 Å²	66.9	2%	0.021	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	149	168.7	0	0	0	0	0	112	R408 A409	R408-G420 CarbonylContact C-O 3.49Å; R408-G420 WeakPolarHBondContact CA-O 3.41Å; A409-G420 PolarHBondContact N-O 3.16Å; A409-G420 PolarHBondContact O-N 3.39Å; A409-G420 VanDerWaalsContact O-N 3.11Å
421	C	82.7	Confident	78	Confident	53 Å²	53	69.3 Å²	69.3	36%	0.358	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	68	-163.7	-78.2	0	0	0	0	112.5	D401 F407 E431	D401-C421 PolarHBondContact OD1-SG 3.26Å; F407-C421 CarbonylContact O-C 3.56Å; F407-C421 WeakPolarHBondContact O-CA 3.44Å; C421-E431 WeakPolarHBondContact CA-OE2 3.28Å; C421-E431 PolarHBondContact N-OE2 3.2Å
422	G	83.7	Confident	78.1	Confident	5 Å²	5	69.3 Å²	69.3	5%	0.052	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	151.2	-174.3	0	0	0	0	0	115.1	F407 S424 E431	F407-G422 PolarHBondContact N-O 3.48Å; F407-G422 PolarHBondContact O-N 2.83Å; G422-S424 PolarHBondContact O-N 3.06Å; G422-E431 PolarHBondContact N-OE2 2.84Å
423	L	81	Confident	78.2	Confident	129 Å²	129	65.5 Å²	65.5	68%	0.675	32%	0.324	S	S	*	.	S	Bend	trans	-53.8	-5	171.5	-58.4	175.6	0	0	0	115.4	Q405 K427	Q405-L423 WeakPolarHBondContact O-CD2 3.47Å; L423-K427 HydrophobicContact CB-CD 4.48Å
424	S	86	Confident	78.3	Confident	44 Å²	44	65.9 Å²	65.9	31%	0.308	33%	0.33	S	S	.	.	S	Bend	trans	-149.2	155.6	169.3	64.1	0	0	0	0	109.7	F407 G422 K426 K427 A428	F407-S424 VanDerWaalsContact CD2-CA 3.49Å; G422-S424 PolarHBondContact O-N 3.06Å; S424-K426 PolarHBondContact O-N 3.34Å; S424-K427 PolarHBondContact O-N 3.42Å; S424-K427 PolarHBondContact OG-N 3.23Å; S424-K427 VanDerWaalsContact OG-N 3.15Å; S424-A428 PolarHBondContact O-N 3.14Å
425	K	83.7	Confident	78.3	Confident	99 Å²	99	62.6 Å²	62.6	43%	0.43	32%	0.318	S	S	.	.	H	α-helix	trans	-50.1	-26.6	169.9	-69.5	-167.9	177.9	-170.6	0	113.7	F398 F407 K429	F398-K425 HydrophobicContact CB-CD 4.34Å; F398-K425 HydrophobicContact CD1-CB 3.99Å; F398-K425 HydrophobicContact CD1-CD 3.89Å; F398-K425 HydrophobicContact CD1-CG 3.76Å; F398-K425 HydrophobicContact CD2-CD 4.12Å; F398-K425 HydrophobicContact CE1-CB 3.51Å; F398-K425 HydrophobicContact CE1-CD 3.98Å; F398-K425 HydrophobicContact CE1-CG 3.8Å; F398-K425 HydrophobicContact CE2-CD 4.19Å; F398-K425 HydrophobicContact CG-CD 3.92Å; F398-K425 HydrophobicContact CG-CG 4.28Å; F398-K425 HydrophobicContact CZ-CB 3.97Å; F398-K425 HydrophobicContact CZ-CD 4.08Å; F398-K425 HydrophobicContact CZ-CG 4.34Å; F407-K425 HydrophobicContact CB-CG 4.12Å; F407-K425 HydrophobicContact CD1-CD 4.19Å; F407-K425 HydrophobicContact CD1-CG 3.49Å; F407-K425 VanDerWaalsContact CD1-CG 3.49Å; F407-K425 HydrophobicContact CD2-CG 4.29Å; F407-K425 HydrophobicContact CE1-CD 4.32Å; F407-K425 HydrophobicContact CE1-CG 3.9Å; F407-K425 HydrophobicContact CG-CG 3.69Å; F407-K425 HydrophobicContact CZ-CG 4.45Å; K425-K429 WeakPolarHBondContact O-CG 3.5Å
426	K	83.8	Confident	77.9	Confident	142 Å²	142	56.6 Å²	56.6	62%	0.617	29%	0.286	S	S	*	.	H	α-helix	trans	-75.1	-50.9	173.7	-171.4	-177.7	175.4	-178.3	0	111.9	S424 A428 K429 Q430	S424-K426 PolarHBondContact O-N 3.34Å; K426-A428 VanDerWaalsContact C-N 3.34Å; K426-A428 PolarHBondContact O-N 3.48Å; K426-K429 PolarHBondContact O-N 3.4Å; K426-Q430 WeakPolarHBondContact O-CG 3.45Å; K426-Q430 PolarHBondContact O-N 3.22Å; K426-Q430 VanDerWaalsContact O-N 3.09Å
427	K	81.4	Confident	77.8	Confident	118 Å²	118	55.6 Å²	55.6	51%	0.513	28%	0.282	S	S	.	.	H	α-helix	trans	-59	-44.7	177.2	-82.4	-166.5	170.2	-168.6	0	111.6	L423 S424 K429 Q430 E431	L423-K427 HydrophobicContact CB-CD 4.48Å; S424-K427 PolarHBondContact O-N 3.42Å; S424-K427 PolarHBondContact OG-N 3.23Å; S424-K427 VanDerWaalsContact OG-N 3.15Å; K427-K429 VanDerWaalsContact C-N 3.3Å; K427-K429 PolarHBondContact O-N 3.46Å; K427-Q430 WeakPolarHBondContact O-CA 3.23Å; K427-Q430 WeakPolarHBondContact O-CB 3.45Å; K427-Q430 PolarHBondContact O-N 2.62Å; K427-E431 WeakPolarHBondContact O-CB 3.27Å; K427-E431 PolarHBondContact O-N 2.66Å
428	A	83.9	Confident	76.8	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-56.4	-42	179.2	0	0	0	0	0	112.8	F407 A409 S424 K426 S432	F407-A428 HydrophobicContact CB-CB 4.34Å; F407-A428 WeakPolarHBondContact O-CB 3.49Å; A409-A428 HydrophobicContact CB-CB 3.57Å; S424-A428 PolarHBondContact O-N 3.14Å; K426-A428 VanDerWaalsContact C-N 3.34Å; K426-A428 PolarHBondContact O-N 3.48Å; A428-S432 PolarHBondContact O-N 3.04Å; A428-S432 VanDerWaalsContact O-N 3.08Å
429	K	84.8	Confident	75.9	Confident	55 Å²	55	60.5 Å²	60.5	24%	0.239	30%	0.304	C	S	.	.	H	α-helix	trans	-67.4	-40.4	173	-72.8	-162	169.2	-166.3	0	113.2	C378 Y395 F398 A409 K425 K426 K427 E431 A433	C378-K429 PolarHBondContact SG-O 3.22Å; Y395-K429 VanDerWaalsContact CB-CE 3.45Å; Y395-K429 HydrophobicContact CD1-CB 4.31Å; Y395-K429 HydrophobicContact CD1-CD 3.56Å; Y395-K429 HydrophobicContact CD1-CG 3.57Å; Y395-K429 HydrophobicContact CD2-CD 4.13Å; Y395-K429 HydrophobicContact CE1-CB 3.71Å; Y395-K429 HydrophobicContact CE1-CD 3.65Å; Y395-K429 HydrophobicContact CE1-CG 3.5Å; Y395-K429 VanDerWaalsContact CE1-CG 3.5Å; Y395-K429 HydrophobicContact CE2-CD 4.23Å; Y395-K429 HydrophobicContact CG-CD 3.8Å; Y395-K429 HydrophobicContact CG-CG 4.32Å; F398-K429 HydrophobicContact CE1-CD 4.34Å; F398-K429 HydrophobicContact CE1-CG 4.11Å; F398-K429 HydrophobicContact CZ-CD 4.25Å; A409-K429 HydrophobicContact CB-CG 3.96Å; K425-K429 WeakPolarHBondContact O-CG 3.5Å; K426-K429 PolarHBondContact O-N 3.4Å; K427-K429 VanDerWaalsContact C-N 3.3Å; K427-K429 PolarHBondContact O-N 3.46Å; K429-E431 VanDerWaalsContact C-N 3.32Å; K429-A433 WeakPolarHBondContact O-CB 3.46Å; K429-A433 PolarHBondContact O-N 2.87Å
430	Q	82.9	Confident	74.7	Confident	50 Å²	50	58.1 Å²	58.1	23%	0.234	29%	0.292	C	S	.	.	H	α-helix	trans	-64.5	-38.6	179	-69.7	177.5	-87	0	0	111.6	P377 C378 K426 K427 S434	P377-Q430 WeakPolarHBondContact CB-O 3.3Å; C378-Q430 VanDerWaalsContact SG-CA 3.59Å; K426-Q430 WeakPolarHBondContact O-CG 3.45Å; K426-Q430 PolarHBondContact O-N 3.22Å; K426-Q430 VanDerWaalsContact O-N 3.09Å; K427-Q430 WeakPolarHBondContact O-CA 3.23Å; K427-Q430 WeakPolarHBondContact O-CB 3.45Å; K427-Q430 PolarHBondContact O-N 2.62Å; Q430-S434 WeakPolarHBondContact O-CB 3.35Å; Q430-S434 PolarHBondContact O-N 3.19Å; Q430-S434 PolarHBondContact O-OG 3.14Å
431	E	79.7	Confident	73.1	Confident	91 Å²	91	59.6 Å²	59.6	43%	0.425	31%	0.307	S	S	.	.	H	α-helix	trans	-70	-46.6	177.7	-174	178.9	-174.3	0	0	112	C421 G422 K427 K429 A433 S434 S435	C421-E431 WeakPolarHBondContact CA-OE2 3.28Å; C421-E431 PolarHBondContact N-OE2 3.2Å; G422-E431 PolarHBondContact N-OE2 2.84Å; K427-E431 WeakPolarHBondContact O-CB 3.27Å; K427-E431 PolarHBondContact O-N 2.66Å; K429-E431 VanDerWaalsContact C-N 3.32Å; E431-A433 PolarHBondContact O-N 2.75Å; E431-S434 WeakPolarHBondContact O-CA 3.32Å; E431-S434 WeakPolarHBondContact O-CB 3.28Å; E431-S434 PolarHBondContact O-N 2.87Å; E431-S435 PolarHBondContact O-N 3.29Å
432	S	81.8	Confident	71.3	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-53.3	-54.6	171.7	-170.8	0	0	0	0	110.2	A411 A428 S434 S435 D436	A411-S432 WeakPolarHBondContact CB-OG 3.47Å; A428-S432 PolarHBondContact O-N 3.04Å; A428-S432 VanDerWaalsContact O-N 3.08Å; S432-S434 PolarHBondContact O-N 3.41Å; S432-S435 VanDerWaalsContact O-CB 3.29Å; S432-S435 WeakPolarHBondContact O-CB 3.3Å; S432-S435 PolarHBondContact O-N 2.65Å; S432-S435 VanDerWaalsContact O-N 3.08Å; S432-D436 PolarHBondContact O-N 3.11Å
433	A	75.9	Confident	69.7	Low	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-66.3	-18.6	178.6	0	0	0	0	0	114.2	P377 C378 L381 K429 E431 L437	P377-A433 HydrophobicContact CB-CB 4.05Å; C378-A433 HydrophobicContact CB-CB 4.34Å; L381-A433 HydrophobicContact CD2-CB 3.81Å; K429-A433 WeakPolarHBondContact O-CB 3.46Å; K429-A433 PolarHBondContact O-N 2.87Å; E431-A433 PolarHBondContact O-N 2.75Å; A433-L437 VanDerWaalsContact O-CB 3.3Å; A433-L437 WeakPolarHBondContact O-CB 3.16Å; A433-L437 PolarHBondContact O-N 3.06Å
434	S	69.1	Low	68.3	Low	39 Å²	39	64.4 Å²	64.4	27%	0.273	34%	0.336	S	S	.	.	H	α-helix	trans	-77.5	-37.7	172.4	-61.7	0	0	0	0	111.2	P377 Q430 E431 S432 D436 L437 I438	P377-S434 WeakPolarHBondContact CB-OG 3.41Å; P377-S434 VanDerWaalsContact CG-OG 3.28Å; P377-S434 WeakPolarHBondContact CG-OG 3.35Å; Q430-S434 WeakPolarHBondContact O-CB 3.35Å; Q430-S434 PolarHBondContact O-N 3.19Å; Q430-S434 PolarHBondContact O-OG 3.14Å; E431-S434 WeakPolarHBondContact O-CA 3.32Å; E431-S434 WeakPolarHBondContact O-CB 3.28Å; E431-S434 PolarHBondContact O-N 2.87Å; S432-S434 PolarHBondContact O-N 3.41Å; S434-D436 VanDerWaalsContact C-N 3.32Å; S434-L437 PolarHBondContact O-N 3.03Å; S434-I438 WeakPolarHBondContact O-CB 3.34Å; S434-I438 WeakPolarHBondContact O-CD1 3.48Å; S434-I438 WeakPolarHBondContact O-CG1 3.25Å; S434-I438 PolarHBondContact O-N 2.89Å
435	S	64.2	Low	66.3	Low	64 Å²	64	64.9 Å²	64.9	45%	0.448	34%	0.342	S	S	.	.	H	α-helix	trans	-57.5	-48.9	171.1	-163.2	0	0	0	0	110.4	E431 S432 L437 I438 R439	E431-S435 PolarHBondContact O-N 3.29Å; S432-S435 VanDerWaalsContact O-CB 3.29Å; S432-S435 WeakPolarHBondContact O-CB 3.3Å; S432-S435 PolarHBondContact O-N 2.65Å; S432-S435 VanDerWaalsContact O-N 3.08Å; S435-L437 PolarHBondContact O-N 3.35Å; S435-I438 PolarHBondContact O-N 3.16Å; S435-R439 PolarHBondContact O-N 2.68Å
436	D	59	Low	64.4	Low	5 Å²	5	68 Å²	68	3%	0.027	36%	0.356	C	S	.	.	H	α-helix	trans	-59.7	-46.3	176.8	-47.2	-8.8	0	0	0	111.3	L381 Y418 S432 S434 R439 L440	L381-D436 HydrophobicContact CD1-CB 3.95Å; L381-D436 HydrophobicContact CD2-CB 3.56Å; L381-D436 WeakPolarHBondContact CD2-OD2 3.32Å; L381-D436 HydrophobicContact CG-CB 4.41Å; Y418-D436 WeakPolarHBondContact CB-OD1 3.39Å; Y418-D436 WeakPolarHBondContact CD1-OD1 3.28Å; Y418-D436 WeakPolarHBondContact CE1-OD1 3.38Å; S432-D436 PolarHBondContact O-N 3.11Å; S434-D436 VanDerWaalsContact C-N 3.32Å; D436-R439 PolarHBondContact O-N 2.92Å; D436-L440 PolarHBondContact O-N 3.36Å
437	L	58.1	Low	62.6	Low	44 Å²	44	62.7 Å²	62.7	23%	0.23	34%	0.342	C	S	.	.	H	α-helix	trans	-68.6	-30.5	177.9	-92.7	160.5	0	0	0	114.1	P377 L380 L381 A433 S434 S435 G441	P377-L437 HydrophobicContact CB-CD1 3.84Å; P377-L437 VanDerWaalsContact O-CD1 3.26Å; P377-L437 WeakPolarHBondContact O-CD1 3.31Å; L380-L437 HydrophobicContact CB-CD1 3.88Å; L380-L437 HydrophobicContact CB-CD2 4.47Å; L381-L437 HydrophobicContact CB-CD1 4.09Å; L381-L437 HydrophobicContact CB-CG 4.11Å; L381-L437 HydrophobicContact CD1-CG 4.38Å; A433-L437 VanDerWaalsContact O-CB 3.3Å; A433-L437 WeakPolarHBondContact O-CB 3.16Å; A433-L437 PolarHBondContact O-N 3.06Å; S434-L437 PolarHBondContact O-N 3.03Å; S435-L437 PolarHBondContact O-N 3.35Å; L437-G441 VanDerWaalsContact O-CA 3.29Å; L437-G441 WeakPolarHBondContact O-CA 3.47Å; L437-G441 PolarHBondContact O-N 3.32Å
438	I	53	Low	60.8	Low	124 Å²	124	60.3 Å²	60.3	64%	0.636	34%	0.34	S	S	*	.	H	α-helix	trans	-71.2	-39.6	173.2	-71.7	163.1	0	0	0	109.4	S434 S435 G441 A442	S434-I438 WeakPolarHBondContact O-CB 3.34Å; S434-I438 WeakPolarHBondContact O-CD1 3.48Å; S434-I438 WeakPolarHBondContact O-CG1 3.25Å; S434-I438 PolarHBondContact O-N 2.89Å; S435-I438 PolarHBondContact O-N 3.16Å; I438-G441 PolarHBondContact O-N 3.03Å; I438-A442 VanDerWaalsContact O-CB 3.25Å; I438-A442 WeakPolarHBondContact O-CB 3.3Å; I438-A442 PolarHBondContact O-N 3.13Å
439	R	55.7	Low	58.9	Low	121 Å²	121	65.2 Å²	65.2	46%	0.457	37%	0.37	S	S	.	.	H	α-helix	trans	-68.1	-45.3	176.6	-162.9	174	177.4	-168	-4.1	112.1	E416 Y418 S435 D436 L443	E416-R439 IonicContact OE1-CZ 3.54Å; E416-R439 VanDerWaalsContact OE1-CZ 3.26Å; E416-R439 IonicContact OE1-NH1 3.58Å; E416-R439 PolarHBondContact OE1-NH1 3.38Å; E416-R439 IonicContact OE1-NH2 3.48Å; E416-R439 PolarHBondContact OE1-NH2 3.49Å; E416-R439 IonicContact OE2-CZ 2.81Å; E416-R439 IonicContact OE2-NH1 2.68Å; E416-R439 PolarHBondContact OE2-NH1 3.22Å; E416-R439 IonicContact OE2-NH2 3.57Å; Y418-R439 PolarHBondContact OH-NH1 3.3Å; S435-R439 PolarHBondContact O-N 2.68Å; D436-R439 PolarHBondContact O-N 2.92Å; R439-L443 PolarHBondContact O-N 2.92Å
440	L	55.4	Low	57.2	Low	35 Å²	35	66.6 Å²	66.6	18%	0.183	38%	0.379	C	S	.	.	H	α-helix	trans	-64.8	-42.9	171.2	-106.9	85.1	0	0	0	112	V384 D436 L443 L444	V384-L440 HydrophobicContact CG1-CD2 3.71Å; D436-L440 PolarHBondContact O-N 3.36Å; L440-L443 PolarHBondContact O-N 3.36Å; L440-L444 WeakPolarHBondContact O-CG 3.23Å; L440-L444 PolarHBondContact O-N 3.46Å
441	G	50.2	Low	55.7	Low	33 Å²	33	69.6 Å²	69.6	34%	0.34	40%	0.396	S	S	.	.	H	α-helix	trans	-64.6	-39.8	-178.5	0	0	0	0	0	112.4	L437 I438 L444 A445	L437-G441 VanDerWaalsContact O-CA 3.29Å; L437-G441 WeakPolarHBondContact O-CA 3.47Å; L437-G441 PolarHBondContact O-N 3.32Å; I438-G441 PolarHBondContact O-N 3.03Å; G441-L444 PolarHBondContact O-N 2.97Å; G441-A445 VanDerWaalsContact O-CB 3.26Å; G441-A445 WeakPolarHBondContact O-CB 3.33Å; G441-A445 PolarHBondContact O-N 3.1Å
442	A	44.4	Very low	54.4	Low	59 Å²	59	68.2 Å²	68.2	49%	0.488	40%	0.4	S	S	.	.	H	α-helix	trans	-61.7	-45.1	172	0	0	0	0	0	111.6	I438 A445 F446	I438-A442 VanDerWaalsContact O-CB 3.25Å; I438-A442 WeakPolarHBondContact O-CB 3.3Å; I438-A442 PolarHBondContact O-N 3.13Å; A442-A445 PolarHBondContact O-N 3.3Å; A442-F446 WeakPolarHBondContact O-CB 3.26Å; A442-F446 PolarHBondContact O-N 3.41Å
443	L	50	Low	53.1	Low	125 Å²	125	74.7 Å²	74.7	65%	0.654	43%	0.426	S	S	*	.	H	α-helix	trans	-62.4	-42	175.7	-77.2	164.7	0	0	0	112.5	R439 L440 G447	R439-L443 PolarHBondContact O-N 2.92Å; L440-L443 PolarHBondContact O-N 3.36Å; L443-G447 PolarHBondContact O-N 3.17Å
444	L	50.7	Low	52.2	Low	104 Å²	104	78.3 Å²	78.3	55%	0.545	44%	0.444	S	S	.	.	H	α-helix	trans	-70.2	-36.2	177.4	-70.8	168.9	0	0	0	112.6	L440 G441 S448	L440-L444 WeakPolarHBondContact O-CG 3.23Å; L440-L444 PolarHBondContact O-N 3.46Å; G441-L444 PolarHBondContact O-N 2.97Å; L444-S448 VanDerWaalsContact O-CB 3.3Å; L444-S448 WeakPolarHBondContact O-CB 3.12Å; L444-S448 PolarHBondContact O-N 3.42Å; L444-S448 PolarHBondContact O-OG 3.37Å
445	A	45.1	Very low	52	Low	54 Å²	54	80 Å²	80	45%	0.446	45%	0.453	S	S	.	.	H	α-helix	trans	-67	-47.3	174	0	0	0	0	0	111.4	G441 A442 S448 V449	G441-A445 VanDerWaalsContact O-CB 3.26Å; G441-A445 WeakPolarHBondContact O-CB 3.33Å; G441-A445 PolarHBondContact O-N 3.1Å; A442-A445 PolarHBondContact O-N 3.3Å; A445-S448 PolarHBondContact O-N 2.99Å; A445-S448 PolarHBondContact O-OG 3.43Å; A445-S448 VanDerWaalsContact O-OG 3.09Å; A445-V449 WeakPolarHBondContact O-CG2 3.26Å; A445-V449 PolarHBondContact O-N 3.09Å
446	F	44.5	Very low	51.8	Low	165 Å²	165	81 Å²	81	72%	0.724	46%	0.458	S	S	*	.	H	α-helix	trans	-64.7	-42.8	176.6	-129.4	-92.9	0	0	0	111.6	A442 V449 L450	A442-F446 WeakPolarHBondContact O-CB 3.26Å; A442-F446 PolarHBondContact O-N 3.41Å; F446-V449 PolarHBondContact O-N 3.36Å; F446-L450 WeakPolarHBondContact O-CB 3.49Å; F446-L450 PolarHBondContact O-N 3.24Å
447	G	44.4	Very low	52.1	Low	31 Å²	31	88.4 Å²	88.4	32%	0.32	49%	0.486	S	S	.	.	H	α-helix	trans	-64.2	-39.1	177.6	0	0	0	0	0	113.5	L443 L450 L451	L443-G447 PolarHBondContact O-N 3.17Å; G447-L450 PolarHBondContact O-N 2.93Å; G447-L451 WeakPolarHBondContact O-CB 3.34Å; G447-L451 PolarHBondContact O-N 3.34Å
448	S	43.6	Very low	52.4	Low	68 Å²	68	92.2 Å²	92.2	48%	0.476	50%	0.503	S	S	.	.	H	α-helix	trans	-72.5	-36.4	176.3	53	0	0	0	0	112.9	L444 A445 A452	L444-S448 VanDerWaalsContact O-CB 3.3Å; L444-S448 WeakPolarHBondContact O-CB 3.12Å; L444-S448 PolarHBondContact O-N 3.42Å; L444-S448 PolarHBondContact O-OG 3.37Å; A445-S448 PolarHBondContact O-N 2.99Å; A445-S448 PolarHBondContact O-OG 3.43Å; A445-S448 VanDerWaalsContact O-OG 3.09Å; S448-A452 VanDerWaalsContact O-CB 3.28Å; S448-A452 WeakPolarHBondContact O-CB 3.36Å; S448-A452 PolarHBondContact O-N 3.03Å
449	V	44.9	Very low	53	Low	103 Å²	103	92.3 Å²	92.3	62%	0.624	50%	0.499	S	S	*	.	H	α-helix	trans	-63.4	-42.6	169.7	170.8	0	0	0	0	111.1	A445 F446 A452 Y453	A445-V449 WeakPolarHBondContact O-CG2 3.26Å; A445-V449 PolarHBondContact O-N 3.09Å; F446-V449 PolarHBondContact O-N 3.36Å; V449-A452 PolarHBondContact O-N 3.36Å; V449-Y453 WeakPolarHBondContact O-CB 3.26Å; V449-Y453 PolarHBondContact O-N 2.88Å
450	L	47.7	Very low	53.5	Low	83 Å²	83	93.2 Å²	93.2	44%	0.435	51%	0.506	S	S	.	.	H	α-helix	trans	-66.1	-43.6	177.9	-165.4	73.1	0	0	0	111.9	F446 G447 Y453 I454	F446-L450 WeakPolarHBondContact O-CB 3.49Å; F446-L450 PolarHBondContact O-N 3.24Å; G447-L450 PolarHBondContact O-N 2.93Å; L450-Y453 PolarHBondContact O-N 3.11Å; L450-I454 HydrophobicContact CG-CD1 4.09Å; L450-I454 WeakPolarHBondContact O-CB 3.3Å; L450-I454 VanDerWaalsContact O-CG1 3.27Å; L450-I454 WeakPolarHBondContact O-CG1 3.29Å; L450-I454 PolarHBondContact O-N 3.21Å
451	L	51.5	Low	54.1	Low	114 Å²	114	97.9 Å²	97.9	60%	0.597	53%	0.525	S	S	*	.	H	α-helix	trans	-61.6	-45	173.4	-90	161.4	0	0	0	111.9	G447 Y453 I454 V455	G447-L451 WeakPolarHBondContact O-CB 3.34Å; G447-L451 PolarHBondContact O-N 3.34Å; L451-Y453 VanDerWaalsContact C-N 3.32Å; L451-Y453 PolarHBondContact O-N 2.93Å; L451-I454 PolarHBondContact O-N 3.36Å; L451-V455 WeakPolarHBondContact O-CB 3.48Å; L451-V455 VanDerWaalsContact O-CG2 3.3Å; L451-V455 WeakPolarHBondContact O-CG2 3.15Å; L451-V455 PolarHBondContact O-N 3.43Å
452	A	52.5	Low	54.8	Low	61 Å²	61	99.6 Å²	99.6	50%	0.504	53%	0.528	S	S	.	.	H	α-helix	trans	-60.7	-42	175.8	0	0	0	0	0	111.6	S448 V449 C456	S448-A452 VanDerWaalsContact O-CB 3.28Å; S448-A452 WeakPolarHBondContact O-CB 3.36Å; S448-A452 PolarHBondContact O-N 3.03Å; V449-A452 PolarHBondContact O-N 3.36Å; A452-C456 WeakPolarHBondContact O-CB 3.48Å; A452-C456 PolarHBondContact O-N 3.19Å
453	Y	54.8	Low	55.9	Low	137 Å²	137	102.6 Å²	102.6	54%	0.537	53%	0.531	S	S	.	.	H	α-helix	trans	-62.7	-46.6	174.8	178.6	-102.5	0	0	0	112.2	V449 L450 L451 C456 R457	V449-Y453 WeakPolarHBondContact O-CB 3.26Å; V449-Y453 PolarHBondContact O-N 2.88Å; L450-Y453 PolarHBondContact O-N 3.11Å; L451-Y453 VanDerWaalsContact C-N 3.32Å; L451-Y453 PolarHBondContact O-N 2.93Å; Y453-C456 PolarHBondContact O-N 2.74Å; Y453-R457 WeakPolarHBondContact O-CB 3.25Å; Y453-R457 PolarHBondContact O-N 2.73Å
454	I	58	Low	56.9	Low	76 Å²	76	100.6 Å²	100.6	39%	0.39	52%	0.521	S	S	.	.	H	α-helix	trans	-62.4	-48.4	177.8	-69.7	164.4	0	0	0	111	L450 L451 C456 R457 Q458	L450-I454 HydrophobicContact CG-CD1 4.09Å; L450-I454 WeakPolarHBondContact O-CB 3.3Å; L450-I454 VanDerWaalsContact O-CG1 3.27Å; L450-I454 WeakPolarHBondContact O-CG1 3.29Å; L450-I454 PolarHBondContact O-N 3.21Å; L451-I454 PolarHBondContact O-N 3.36Å; I454-C456 VanDerWaalsContact C-N 3.33Å; I454-C456 PolarHBondContact O-N 2.82Å; I454-R457 PolarHBondContact O-N 2.9Å; I454-Q458 WeakPolarHBondContact O-CG 3.36Å; I454-Q458 PolarHBondContact O-N 3.07Å
455	V	63.5	Low	57.9	Low	75 Å²	75	101.6 Å²	101.6	46%	0.455	52%	0.522	S	S	.	.	H	α-helix	trans	-62.5	-40.2	178	170.4	0	0	0	0	111.1	L451 Q458 K459	L451-V455 WeakPolarHBondContact O-CB 3.48Å; L451-V455 VanDerWaalsContact O-CG2 3.3Å; L451-V455 WeakPolarHBondContact O-CG2 3.15Å; L451-V455 PolarHBondContact O-N 3.43Å; V455-Q458 PolarHBondContact O-N 3.24Å; V455-K459 WeakPolarHBondContact O-CB 3.35Å; V455-K459 PolarHBondContact O-N 3.27Å
456	C	59.9	Low	59	Low	83 Å²	83	103.4 Å²	103.4	56%	0.561	53%	0.525	S	S	*	.	H	α-helix	trans	-65.3	-41.9	175.4	-166.8	0	0	0	0	111.7	A452 Y453 I454 Q458 K459 K460	A452-C456 WeakPolarHBondContact O-CB 3.48Å; A452-C456 PolarHBondContact O-N 3.19Å; Y453-C456 PolarHBondContact O-N 2.74Å; I454-C456 VanDerWaalsContact C-N 3.33Å; I454-C456 PolarHBondContact O-N 2.82Å; C456-Q458 PolarHBondContact O-N 3.28Å; C456-K459 PolarHBondContact O-N 3.05Å; C456-K460 PolarHBondContact O-N 2.88Å
457	R	65.5	Low	60.3	Low	162 Å²	162	100.9 Å²	100.9	61%	0.611	52%	0.518	S	S	*	.	H	α-helix	trans	-64.8	-36.1	176.5	-159.7	175.2	-171.9	-167.1	4.4	112.2	Y453 I454 K461	Y453-R457 WeakPolarHBondContact O-CB 3.25Å; Y453-R457 PolarHBondContact O-N 2.73Å; I454-R457 PolarHBondContact O-N 2.9Å; R457-K461 PolarHBondContact O-N 3.14Å
458	Q	64.9	Low	61.5	Low	124 Å²	124	103.5 Å²	103.5	58%	0.579	52%	0.524	S	S	*	.	H	α-helix	trans	-71.5	-42.2	172.1	-71.1	-173.4	4.3	0	0	112.8	I454 V455 C456 K460 K461 T462	I454-Q458 WeakPolarHBondContact O-CG 3.36Å; I454-Q458 PolarHBondContact O-N 3.07Å; V455-Q458 PolarHBondContact O-N 3.24Å; C456-Q458 PolarHBondContact O-N 3.28Å; Q458-K460 PolarHBondContact O-N 3.31Å; Q458-K461 PolarHBondContact O-N 3.37Å; Q458-T462 PolarHBondContact O-N 3.02Å; Q458-T462 PolarHBondContact O-OG1 3.2Å
459	K	65.9	Low	62.7	Low	126 Å²	126	107.9 Å²	107.9	55%	0.548	53%	0.53	S	S	.	.	H	α-helix	trans	-58.5	-33.9	171.6	-96.3	-173.1	171.1	-175.3	0	112.3	V455 C456 T462 K463	V455-K459 WeakPolarHBondContact O-CB 3.35Å; V455-K459 PolarHBondContact O-N 3.27Å; C456-K459 PolarHBondContact O-N 3.05Å; K459-T462 WeakPolarHBondContact CA-OG1 3.37Å; K459-T462 PolarHBondContact O-OG1 2.87Å; K459-K463 WeakPolarHBondContact O-CB 3.44Å; K459-K463 WeakPolarHBondContact O-CG 3.22Å; K459-K463 PolarHBondContact O-N 2.89Å
460	K	66.7	Low	64	Low	139 Å²	139	110 Å²	110	60%	0.604	53%	0.531	S	S	*	.	H	α-helix	trans	-69.9	-53.7	177	-160.4	169.3	-175.3	176.2	0	111.5	C456 Q458 T462 K463 D464	C456-K460 PolarHBondContact O-N 2.88Å; Q458-K460 PolarHBondContact O-N 3.31Å; K460-T462 VanDerWaalsContact C-N 3.29Å; K460-T462 PolarHBondContact O-N 2.98Å; K460-K463 PolarHBondContact O-N 3.44Å; K460-D464 VanDerWaalsContact O-CG 3.22Å; K460-D464 PolarHBondContact O-N 2.93Å
461	K	67.2	Low	65	Low	133 Å²	133	108.2 Å²	108.2	58%	0.578	53%	0.528	S	S	*	.	H	α-helix	trans	-50	-47.8	173.5	-76	-168.5	174	-170.5	0	112.6	R457 Q458 K463 D464 E465	R457-K461 PolarHBondContact O-N 3.14Å; Q458-K461 PolarHBondContact O-N 3.37Å; K461-K463 PolarHBondContact O-N 3.02Å; K461-D464 PolarHBondContact O-N 3.32Å; K461-E465 WeakPolarHBondContact O-CB 3.48Å; K461-E465 VanDerWaalsContact O-CG 3.31Å; K461-E465 WeakPolarHBondContact O-CG 3.21Å; K461-E465 PolarHBondContact O-N 3.41Å
462	T	66	Low	66	Low	69 Å²	69	108.6 Å²	108.6	42%	0.423	53%	0.525	S	S	.	.	H	α-helix	trans	-73.3	-23.4	-178.7	50.1	0	0	0	0	114.2	Q458 K459 K460 N466	Q458-T462 PolarHBondContact O-N 3.02Å; Q458-T462 PolarHBondContact O-OG1 3.2Å; K459-T462 WeakPolarHBondContact CA-OG1 3.37Å; K459-T462 PolarHBondContact O-OG1 2.87Å; K460-T462 VanDerWaalsContact C-N 3.29Å; K460-T462 PolarHBondContact O-N 2.98Å; T462-N466 WeakPolarHBondContact O-CB 3.17Å; T462-N466 PolarHBondContact O-N 3.38Å; T462-N466 PolarHBondContact O-ND2 3.04Å
463	K	67.4	Low	66.8	Low	122 Å²	122	110.7 Å²	110.7	53%	0.53	53%	0.525	S	S	.	.	H	α-helix	trans	-70.2	-48.6	165.4	-85.3	-177	175.9	177.6	0	110.5	K459 K460 K461 E465 N466 I467	K459-K463 WeakPolarHBondContact O-CB 3.44Å; K459-K463 WeakPolarHBondContact O-CG 3.22Å; K459-K463 PolarHBondContact O-N 2.89Å; K460-K463 PolarHBondContact O-N 3.44Å; K461-K463 PolarHBondContact O-N 3.02Å; K463-E465 PolarHBondContact O-N 3.27Å; K463-N466 PolarHBondContact O-N 2.88Å; K463-I467 WeakPolarHBondContact O-CG1 3.28Å; K463-I467 PolarHBondContact O-N 2.72Å
464	D	70	Confident	67.3	Low	83 Å²	83	111.8 Å²	111.8	44%	0.444	53%	0.532	S	S	.	.	H	α-helix	trans	-61.9	-46.3	-177.2	-59.8	-26.4	0	0	0	111.3	K460 K461 N466 I467 D468	K460-D464 VanDerWaalsContact O-CG 3.22Å; K460-D464 PolarHBondContact O-N 2.93Å; K461-D464 PolarHBondContact O-N 3.32Å; D464-N466 VanDerWaalsContact C-N 3.34Å; D464-N466 PolarHBondContact O-N 3.46Å; D464-I467 PolarHBondContact O-N 3.04Å; D464-D468 WeakPolarHBondContact O-CB 3.26Å; D464-D468 PolarHBondContact O-N 3.4Å
465	E	71.5	Confident	67.6	Low	125 Å²	125	114.3 Å²	114.3	58%	0.584	55%	0.546	S	S	*	.	H	α-helix	trans	-60.8	-37	174.6	-73.5	168.1	-168.3	0	0	113	K461 K463 R469	K461-E465 WeakPolarHBondContact O-CB 3.48Å; K461-E465 VanDerWaalsContact O-CG 3.31Å; K461-E465 WeakPolarHBondContact O-CG 3.21Å; K461-E465 PolarHBondContact O-N 3.41Å; K463-E465 PolarHBondContact O-N 3.27Å; E465-R469 VanDerWaalsContact O-CB 3.28Å; E465-R469 WeakPolarHBondContact O-CB 3.38Å; E465-R469 PolarHBondContact O-N 3.37Å
466	N	67.9	Low	67.3	Low	92 Å²	92	122.1 Å²	122.1	49%	0.492	57%	0.568	S	S	.	*	H	α-helix	trans	-74.8	-30.4	176.5	-88.4	-69.2	0	0	0	113.1	T462 K463 D464 K470	T462-N466 WeakPolarHBondContact O-CB 3.17Å; T462-N466 PolarHBondContact O-N 3.38Å; T462-N466 PolarHBondContact O-ND2 3.04Å; K463-N466 PolarHBondContact O-N 2.88Å; D464-N466 VanDerWaalsContact C-N 3.34Å; D464-N466 PolarHBondContact O-N 3.46Å; N466-K470 WeakPolarHBondContact O-CB 3.34Å; N466-K470 WeakPolarHBondContact O-CG 3.48Å; N466-K470 PolarHBondContact O-N 3.17Å
467	I	72.4	Confident	67	Low	113 Å²	113	122.6 Å²	122.6	58%	0.579	57%	0.572	S	S	*	*	H	α-helix	trans	-67.8	-48	172.9	-69.9	164.2	0	0	0	109.4	K463 D464 R469 K470 A471	K463-I467 WeakPolarHBondContact O-CG1 3.28Å; K463-I467 PolarHBondContact O-N 2.72Å; D464-I467 PolarHBondContact O-N 3.04Å; I467-R469 VanDerWaalsContact C-N 3.33Å; I467-R469 PolarHBondContact O-N 3.09Å; I467-K470 PolarHBondContact O-N 2.98Å; I467-A471 PolarHBondContact O-N 3.23Å
468	D	69.6	Low	66.4	Low	86 Å²	86	119.3 Å²	119.3	46%	0.46	58%	0.579	S	S	.	*	H	α-helix	trans	-64.7	-35.9	179.7	-164.6	57.9	0	0	0	112.2	D464 K472	D464-D468 WeakPolarHBondContact O-CB 3.26Å; D464-D468 PolarHBondContact O-N 3.4Å; D468-K472 WeakPolarHBondContact O-CD 3.42Å; D468-K472 WeakPolarHBondContact O-CG 3.4Å; D468-K472 PolarHBondContact O-N 3.33Å; D468-K472 IonicContact OD1-NZ 2.61Å; D468-K472 IonicContact OD2-NZ 3.18Å; D468-K472 PolarHBondContact OD2-NZ 3.32Å
469	R	68.9	Low	65.2	Low	159 Å²	159	116.6 Å²	116.6	60%	0.6	59%	0.585	S	S	*	*	H	α-helix	trans	-66.8	-44	171	-173.4	174.4	-177.4	150.7	4.2	112.8	E465 I467 A471 K472 E473	E465-R469 VanDerWaalsContact O-CB 3.28Å; E465-R469 WeakPolarHBondContact O-CB 3.38Å; E465-R469 PolarHBondContact O-N 3.37Å; I467-R469 VanDerWaalsContact C-N 3.33Å; I467-R469 PolarHBondContact O-N 3.09Å; R469-A471 VanDerWaalsContact C-N 3.34Å; R469-A471 PolarHBondContact O-N 2.7Å; R469-K472 PolarHBondContact O-N 2.95Å; R469-E473 IonicContact NE-OE1 2.7Å; R469-E473 PolarHBondContact NE-OE1 2.93Å; R469-E473 PolarHBondContact O-N 2.92Å
470	K	71.8	Confident	64.1	Low	147 Å²	147	119.7 Å²	119.7	64%	0.639	60%	0.602	S	S	*	*	H	α-helix	trans	-68.6	-30.1	177.6	-79.7	-177	175	-176.4	0	113.3	N466 I467 K474	N466-K470 WeakPolarHBondContact O-CB 3.34Å; N466-K470 WeakPolarHBondContact O-CG 3.48Å; N466-K470 PolarHBondContact O-N 3.17Å; I467-K470 PolarHBondContact O-N 2.98Å; K470-K474 WeakPolarHBondContact O-CB 3.35Å; K470-K474 PolarHBondContact O-N 2.89Å; K470-K474 VanDerWaalsContact O-N 3.14Å
471	A	69.3	Low	63	Low	46 Å²	46	121.4 Å²	121.4	38%	0.38	61%	0.612	S	S	.	*	H	α-helix	trans	-61.4	-51.5	169.6	0	0	0	0	0	110.2	I467 R469 E473 K474 D475	I467-A471 PolarHBondContact O-N 3.23Å; R469-A471 VanDerWaalsContact C-N 3.34Å; R469-A471 PolarHBondContact O-N 2.7Å; A471-E473 PolarHBondContact O-N 3.24Å; A471-K474 PolarHBondContact O-N 3.47Å; A471-D475 PolarHBondContact O-N 2.89Å
472	K	72.1	Confident	61.8	Low	122 Å²	122	124.9 Å²	124.9	53%	0.53	63%	0.627	S	S	.	*	H	α-helix	trans	-62.5	-38.6	179.5	-71.9	162.8	-176.9	163.2	0	113.6	D468 R469 K474 W476	D468-K472 WeakPolarHBondContact O-CD 3.42Å; D468-K472 WeakPolarHBondContact O-CG 3.4Å; D468-K472 PolarHBondContact O-N 3.33Å; D468-K472 IonicContact OD1-NZ 2.61Å; D468-K472 IonicContact OD2-NZ 3.18Å; D468-K472 PolarHBondContact OD2-NZ 3.32Å; R469-K472 PolarHBondContact O-N 2.95Å; K472-K474 VanDerWaalsContact C-N 3.29Å; K472-K474 PolarHBondContact O-N 2.88Å; K472-W476 PolarHBondContact O-N 2.99Å
473	E	68.8	Low	60.6	Low	106 Å²	106	128.2 Å²	128.2	50%	0.495	64%	0.638	S	S	.	*	H	α-helix	trans	-68	-27.6	173.9	-75.1	171.5	-174.6	0	0	112.6	R469 A471 S477	R469-E473 IonicContact NE-OE1 2.7Å; R469-E473 PolarHBondContact NE-OE1 2.93Å; R469-E473 PolarHBondContact O-N 2.92Å; A471-E473 PolarHBondContact O-N 3.24Å; E473-S477 PolarHBondContact O-OG 2.89Å
474	K	65.3	Low	59.4	Low	159 Å²	159	129.4 Å²	129.4	69%	0.691	64%	0.643	S	S	*	*	H	α-helix	trans	-79.6	-38	176.8	-146.8	178	-172.9	-172	0	112.8	K470 A471 K472 W476 S477	K470-K474 WeakPolarHBondContact O-CB 3.35Å; K470-K474 PolarHBondContact O-N 2.89Å; K470-K474 VanDerWaalsContact O-N 3.14Å; A471-K474 PolarHBondContact O-N 3.47Å; K472-K474 VanDerWaalsContact C-N 3.29Å; K472-K474 PolarHBondContact O-N 2.88Å; K474-W476 VanDerWaalsContact C-N 3.28Å; K474-W476 PolarHBondContact O-N 2.91Å; K474-S477 WeakPolarHBondContact CA-OG 3.32Å; K474-S477 PolarHBondContact O-N 3.06Å; K474-S477 PolarHBondContact O-OG 2.8Å
475	D	64.5	Low	58	Low	129 Å²	129	132.2 Å²	132.2	69%	0.69	66%	0.658	S	S	*	*	H	α-helix	trans	-69	-26.5	174.5	-68.8	-18	0	0	0	112.3	A471	A471-D475 PolarHBondContact O-N 2.89Å
476	W	56.7	Low	56.5	Low	240 Å²	240	132.9 Å²	132.9	91%	0.909	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-7.6	173.9	-90.8	21.7	0	0	0	115.2	K472 K474	K472-W476 PolarHBondContact O-N 2.99Å; K474-W476 VanDerWaalsContact C-N 3.28Å; K474-W476 PolarHBondContact O-N 2.91Å
477	S	55	Low	55.2	Low	93 Å²	93	134 Å²	134	65%	0.65	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	16.3	-178	43.7	0	0	0	0	114.3	E473 K474	E473-S477 PolarHBondContact O-OG 2.89Å; K474-S477 WeakPolarHBondContact CA-OG 3.32Å; K474-S477 PolarHBondContact O-N 3.06Å; K474-S477 PolarHBondContact O-OG 2.8Å
478	A	52	Low	53.7	Low	92 Å²	92	134.3 Å²	134.3	76%	0.76	69%	0.692	S	S	*	*	S	Bend	trans	-127.8	30.4	-178	0	0	0	0	0	113.4
479	G	39.9	Very low	52.3	Low	68 Å²	68	138.7 Å²	138.7	70%	0.701	71%	0.714	S	S	*	*			trans	-135	29.7	-160	0	0	0	0	0	118
480	E	41.9	Very low	50.8	Low	191 Å²	191	135.1 Å²	135.1	89%	0.893	71%	0.713	S	S	*	*			trans	-129.6	158.6	167.6	-67.2	-166.7	136.6	0	0	111
481	E	44.8	Very low	49.4	Very low	174 Å²	174	138.1 Å²	138.1	81%	0.813	73%	0.726	S	S	*	*			trans	62.2	91.3	-178.6	-56.7	-168.5	171.8	0	0	117.7
482	F	42.5	Very low	47.9	Very low	206 Å²	206	139.6 Å²	139.6	90%	0.904	75%	0.746	S	S	*	*				-169	161.3	99.7	-118.6	-94.7	0	0	0	112.9
483	E	40.4	Very low	46.6	Very low	140 Å²	140	141.3 Å²	141.3	65%	0.654	76%	0.757	S	S	*	*			trans	-105.8	153.3	-168.2	-109.8	-163.2	139.8	0	0	115.5
484	K	41.2	Very low	45.3	Very low	147 Å²	147	146.3 Å²	146.3	64%	0.639	77%	0.772	S	S	*	*			trans	78.9	126.6	145.8	-75.2	165.3	178.6	139.6	0	122.6
485	D	41.9	Very low	44.2	Very low	141 Å²	141	146.6 Å²	146.6	75%	0.754	77%	0.773	S	S	*	*			trans	64.5	105.6	136	-52.8	-24.2	0	0	0	122.3
486	V	38.8	Very low	43	Very low	139 Å²	139	146.7 Å²	146.7	84%	0.842	77%	0.774	S	S	*	*				173.8	138.5	107.1	155.1	0	0	0	0	110.3
487	P	40.7	Very low	42.1	Very low	115 Å²	115	138.5 Å²	138.5	75%	0.747	76%	0.764	S	S	*	*			trans	-110	-166.3	-168.6	49	-41	0	0	0	112.9
488	P	42.4	Very low	41.4	Very low	121 Å²	121	139.1 Å²	139.1	79%	0.786	77%	0.774	S	S	*	*				-123.8	169.4	-118	23.5	2.2	0	0	0	116.2
489	I	39.4	Very low	40.8	Very low	178 Å²	178	139.6 Å²	139.6	91%	0.913	77%	0.772	S	S	*	*			trans	-130.6	155.2	174.2	-65.1	-176.4	0	0	0	111.4
490	S	37.5	Very low	40.8	Very low	84 Å²	84	141.7 Å²	141.7	59%	0.587	78%	0.776	S	S	*	*			trans	-113.9	170.1	-160	66.2	0	0	0	0	116.3
491	K	42.2	Very low	40.4	Very low	210 Å²	210	136.2 Å²	136.2	91%	0.913	77%	0.77	S	S	*	*			trans	81.6	145.5	170.8	-52.7	156.2	-175.5	172.9	0	113.5
492	G	37.4	Very low	40	Very low	76 Å²	76	132.4 Å²	132.4	78%	0.784	77%	0.769	S	S	*	*			cis	-170.3	-174	-3.3	0	0	0	0	0	107.8
493	M	44.6	Very low	39.6	Very low	158 Å²	158	132.8 Å²	132.8	78%	0.778	77%	0.771	S	S	*	*			cis	159.5	147.8	-3.3	-178.2	-156	-167.1	0	0	104
494	R	41.9	Very low	39.1	Very low	212 Å²	212	134.9 Å²	134.9	80%	0.8	78%	0.78	S	S	*	*			trans	79	156.8	174.6	-52.7	-175.2	179.4	-161.7	-2.8	115.2
495	K	42.6	Very low	38.9	Very low	165 Å²	165	133.1 Å²	133.1	72%	0.717	79%	0.786	S	S	*	*			cis	-173	162.3	-18.2	-101.7	-144.8	164.8	-139.5	0	106.1
496	D	39.9	Very low	38.5	Very low	131 Å²	131	132.7 Å²	132.7	70%	0.701	79%	0.789	S	S	*	*			cis	-166.6	167.2	-15	-116.1	26.2	0	0	0	108.9
497	G	38.3	Very low	38.1	Very low	68 Å²	68	131.1 Å²	131.1	70%	0.701	78%	0.784	S	S	*	*			trans	123.1	112.5	167.5	0	0	0	0	0	112.8
498	A	38.9	Very low	38	Very low	105 Å²	105	130.9 Å²	130.9	87%	0.868	78%	0.782	S	S	*	*			cis	80.9	130.4	44.4	0	0	0	0	0	113.1
499	S	40.8	Very low	37.6	Very low	102 Å²	102	132.4 Å²	132.4	71%	0.713	78%	0.784	S	S	*	*			cis	-153.6	169.1	5.2	61.3	0	0	0	0	113.7
500	S	39.1	Very low	37.4	Very low	113 Å²	113	128.6 Å²	128.6	79%	0.79	78%	0.779	S	S	*	*			trans	50.4	123.2	148.8	56.8	0	0	0	0	119.5
501	G	34.2	Very low	37.3	Very low	75 Å²	75	129 Å²	129	77%	0.773	79%	0.788	S	S	*	*			cis	173.4	-174.3	2.4	0	0	0	0	0	108.5
502	A	35.6	Very low	36.9	Very low	94 Å²	94	129.6 Å²	129.6	78%	0.777	79%	0.79	S	S	*	*			cis	169.3	89.5	-15.4	0	0	0	0	0	105.7
503	F	33.6	Very low	36.7	Very low	215 Å²	215	129.3 Å²	129.3	94%	0.943	79%	0.787	S	S	*	*			trans	-139	123.9	154.2	-123.6	-86.6	0	0	0	107.9
504	Q	31.4	Very low	36.2	Very low	184 Å²	184	129 Å²	129	86%	0.86	78%	0.784	S	S	*	*			trans	-134.1	129.9	-173.5	-75.7	-175.5	-23.3	0	0	110.5
505	S	35	Very low	35.8	Very low	109 Å²	109	128 Å²	128	76%	0.762	78%	0.78	S	S	*	*			trans	-152.4	81	152.8	57.9	0	0	0	0	110.8
506	T	33.8	Very low	35.4	Very low	133 Å²	133	127.5 Å²	127.5	82%	0.816	79%	0.786	S	S	*	*				56	93.9	125.8	56.4	0	0	0	0	120.3
507	S	30.8	Very low	35.3	Very low	106 Å²	106	127.1 Å²	127.1	74%	0.741	79%	0.793	S	S	*	*				-28.8	169.4	127.4	-125.7	0	0	0	0	115.7
508	P	38.7	Very low	35.1	Very low	109 Å²	109	127.4 Å²	127.4	71%	0.708	79%	0.785	S	S	*	*			cis	-149.5	169.4	25.6	42.6	-21.6	0	0	0	120.9
509	N	33.7	Very low	35.2	Very low	153 Å²	153	128 Å²	128	82%	0.818	78%	0.779	S	S	*	*			trans	37.2	108.5	141.1	-60.6	-11.1	0	0	0	123.1
510	A	35	Very low	35.2	Very low	99 Å²	99	128.8 Å²	128.8	82%	0.818	78%	0.775	S	S	*	*				-165.1	131.8	125.3	0	0	0	0	0	108.1
511	A	35.7	Very low	35.2	Very low	93 Å²	93	129.4 Å²	129.4	77%	0.769	76%	0.764	S	S	*	*			cis	94	94.9	32.9	0	0	0	0	0	115
512	K	34.5	Very low	35.4	Very low	221 Å²	221	128.1 Å²	128.1	96%	0.961	75%	0.746	S	S	*	*			trans	73.5	151	166.1	-55.6	-178.9	179.4	-179.2	0	118.1
513	G	32.8	Very low	35.4	Very low	70 Å²	70	126.7 Å²	126.7	72%	0.722	73%	0.73	S	S	*	*			trans	112	100.2	-178.2	0	0	0	0	0	110.9
514	E	33.1	Very low	35.7	Very low	152 Å²	152	121 Å²	121	71%	0.71	72%	0.717	S	S	*	*				74	117.2	63.7	-71.6	-137.7	106.1	0	0	116.2
515	R	35.1	Very low	36.1	Very low	190 Å²	190	116.4 Å²	116.4	72%	0.717	70%	0.698	S	S	*	*			trans	69.3	120.8	144.1	-60.2	174.2	-158.4	-165.2	11.3	120.9
516	N	33.3	Very low	36.3	Very low	156 Å²	156	119.4 Å²	119.4	83%	0.834	70%	0.697	S	S	*	*				59.5	100.5	129.4	-56.1	0.7	0	0	0	120
517	S	37	Very low	36.4	Very low	122 Å²	122	119.2 Å²	119.2	85%	0.853	70%	0.696	S	S	*	*			trans	-152.1	137.9	149.2	62.9	0	0	0	0	110.9
518	S	35.8	Very low	36.7	Very low	75 Å²	75	118 Å²	118	52%	0.524	69%	0.693	S	S	.	*			cis	-160.7	142.9	-20	-177.2	0	0	0	0	108.7	L520	S518-L520 PolarHBondContact O-N 3.16Å
519	P	40.1	Very low	36.6	Very low	116 Å²	116	121.7 Å²	121.7	75%	0.753	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-8.8	179.5	-23.5	34.7	0	0	0	115.8	F521 A522	P519-F521 VanDerWaalsContact C-N 3.33Å; P519-F521 PolarHBondContact O-N 3.48Å; P519-A522 PolarHBondContact O-N 3.43Å
520	L	41.3	Very low	37.1	Very low	119 Å²	119	123.3 Å²	123.3	62%	0.623	70%	0.695	S	S	*	*	H	α-helix	trans	-69.2	-19.2	-168.5	-74.2	167.2	0	0	0	115.9	S518 S523 S524	S518-L520 PolarHBondContact O-N 3.16Å; L520-S523 WeakPolarHBondContact CA-OG 3.44Å; L520-S523 PolarHBondContact O-OG 3.21Å; L520-S524 PolarHBondContact O-N 2.6Å; L520-S524 PolarHBondContact O-OG 3.21Å
521	F	39.4	Very low	37.7	Very low	126 Å²	126	125.9 Å²	125.9	55%	0.553	69%	0.69	S	S	*	*	H	α-helix	trans	-69.6	-41.5	172.8	-119.9	-88.7	0	0	0	111	P519 S523 S524	P519-F521 VanDerWaalsContact C-N 3.33Å; P519-F521 PolarHBondContact O-N 3.48Å; F521-S523 VanDerWaalsContact C-N 3.3Å; F521-S523 PolarHBondContact O-N 3.44Å; F521-S524 PolarHBondContact O-N 2.95Å
522	A	37.4	Very low	38.2	Very low	48 Å²	48	126 Å²	126	40%	0.397	68%	0.678	S	S	.	*	H	α-helix	trans	-71.8	-19.4	179.3	0	0	0	0	0	113.7	P519 K526	P519-A522 PolarHBondContact O-N 3.43Å; A522-K526 WeakPolarHBondContact O-CB 3.43Å; A522-K526 WeakPolarHBondContact O-CD 3.24Å; A522-K526 VanDerWaalsContact O-CG 3.24Å; A522-K526 WeakPolarHBondContact O-CG 3.42Å
523	S	36.8	Very low	38.7	Very low	65 Å²	65	123 Å²	123	46%	0.455	67%	0.671	S	S	.	*	H	α-helix	trans	-79.9	-30.1	172.6	53.1	0	0	0	0	113.1	L520 F521	L520-S523 WeakPolarHBondContact CA-OG 3.44Å; L520-S523 PolarHBondContact O-OG 3.21Å; F521-S523 VanDerWaalsContact C-N 3.3Å; F521-S523 PolarHBondContact O-N 3.44Å
524	S	39.9	Very low	39	Very low	96 Å²	96	126.3 Å²	126.3	67%	0.671	68%	0.678	S	S	*	*	H	α-helix	trans	-80	-20.5	-174	-52.7	0	0	0	0	113.6	L520 F521	L520-S524 PolarHBondContact O-N 2.6Å; L520-S524 PolarHBondContact O-OG 3.21Å; F521-S524 PolarHBondContact O-N 2.95Å
525	L	38.5	Very low	39.2	Very low	86 Å²	86	120.7 Å²	120.7	45%	0.45	66%	0.661	S	S	.	*	S	Bend	trans	-97.6	-7.2	175.6	-76.3	161.1	0	0	0	113.5	T527 E575	L525-T527 PolarHBondContact O-N 3.02Å; L525-T527 VanDerWaalsContact O-N 3.07Å; L525-E575 HydrophobicContact CD1-CB 4.49Å; L525-E575 HydrophobicContact CD1-CG 4.27Å
526	K	39.4	Very low	39.4	Very low	173 Å²	173	116.4 Å²	116.4	75%	0.752	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	12.6	-167.1	-110.5	-179.4	-174.9	179.6	0	116.4	A522	A522-K526 WeakPolarHBondContact O-CB 3.43Å; A522-K526 WeakPolarHBondContact O-CD 3.24Å; A522-K526 VanDerWaalsContact O-CG 3.24Å; A522-K526 WeakPolarHBondContact O-CG 3.42Å
527	T	37.1	Very low	40	Very low	129 Å²	129	113.1 Å²	113.1	79%	0.791	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.1	-2.4	-177.5	48.6	0	0	0	0	114.5	L525 R529	L525-T527 PolarHBondContact O-N 3.02Å; L525-T527 VanDerWaalsContact O-N 3.07Å; T527-R529 PolarHBondContact O-N 3.31Å
528	A	36.7	Very low	40.5	Very low	81 Å²	81	112.2 Å²	112.2	67%	0.669	64%	0.641	S	S	*	*			trans	-80.2	111	174	0	0	0	0	0	111
529	R	36.7	Very low	41.2	Very low	186 Å²	186	111.3 Å²	111.3	70%	0.702	63%	0.63	S	S	*	*			trans	-80.2	155.6	161.1	-76.8	-176.8	173.2	179.9	-1.3	109.9	T527 E531 D532	T527-R529 PolarHBondContact O-N 3.31Å; R529-E531 IonicContact NH1-OE2 2.73Å; R529-E531 PolarHBondContact O-N 3.35Å; R529-D532 PolarHBondContact O-N 3.42Å
530	E	44	Very low	41.7	Very low	187 Å²	187	110.7 Å²	110.7	87%	0.874	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-58.6	-20.5	178.8	-66.2	169.7	108.5	0	0	113.8	D532	E530-D532 VanDerWaalsContact C-N 3.27Å; E530-D532 PolarHBondContact O-N 2.89Å
531	E	47.7	Very low	42.3	Very low	153 Å²	153	109.6 Å²	109.6	72%	0.715	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-71.3	-16.4	-179.9	-58.7	174.3	126.7	0	0	113.7	R529	R529-E531 IonicContact NH1-OE2 2.73Å; R529-E531 PolarHBondContact O-N 3.35Å
532	D	45.7	Very low	43.5	Very low	95 Å²	95	108.2 Å²	108.2	51%	0.508	63%	0.629	S	S	.	*	G	3₁₀ helix	trans	-100.2	9.2	-159.1	-143.3	38.8	0	0	0	115.2	R529 E530 T534 K538	R529-D532 PolarHBondContact O-N 3.42Å; E530-D532 VanDerWaalsContact C-N 3.27Å; E530-D532 PolarHBondContact O-N 2.89Å; D532-T534 PolarHBondContact O-N 3.3Å; D532-K538 PolarHBondContact O-NZ 3.33Å; D532-K538 VanDerWaalsContact O-NZ 3.09Å; D532-K538 IonicContact OD1-NZ 2.6Å; D532-K538 IonicContact OD2-NZ 2.73Å; D532-K538 PolarHBondContact OD2-NZ 3.45Å
533	L	44.8	Very low	45.2	Very low	157 Å²	157	109.7 Å²	109.7	82%	0.822	63%	0.63	S	S	*	*			trans	-81.3	-1.2	-173.5	-83.5	165.4	0	0	0	115.5	G535	L533-G535 PolarHBondContact O-N 3.06Å
534	T	40.2	Very low	47.5	Very low	141 Å²	141	110.5 Å²	110.5	87%	0.865	64%	0.641	S	S	*	*			trans	-94.6	73.9	-179.7	48.5	0	0	0	0	112.4	D532	D532-T534 PolarHBondContact O-N 3.3Å
535	G	36.1	Very low	49.8	Very low	34 Å²	34	110.3 Å²	110.3	35%	0.351	63%	0.632	S	S	.	*			trans	-166.5	82.1	-177.7	0	0	0	0	0	117.5	L533 A537 K538	L533-G535 PolarHBondContact O-N 3.06Å; G535-A537 PolarHBondContact O-N 3.48Å; G535-K538 PolarHBondContact O-N 2.97Å; G535-K538 VanDerWaalsContact O-N 3.09Å
536	A	40.5	Very low	52.2	Low	99 Å²	99	107.5 Å²	107.5	82%	0.818	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-16.9	169.8	0	0	0	0	0	114
537	A	45.1	Very low	54.6	Low	88 Å²	88	104.2 Å²	104.2	73%	0.727	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-18	176.1	0	0	0	0	0	114.7	G535	G535-A537 PolarHBondContact O-N 3.48Å
538	K	48.1	Very low	57.3	Low	103 Å²	103	104.1 Å²	104.1	45%	0.448	59%	0.59	S	S	.	*	G	3₁₀ helix	trans	-72.6	-28.2	-175.9	-80.6	178.7	178.1	167.6	0	114	D532 G535 A540 S541	D532-K538 PolarHBondContact O-NZ 3.33Å; D532-K538 VanDerWaalsContact O-NZ 3.09Å; D532-K538 IonicContact OD1-NZ 2.6Å; D532-K538 IonicContact OD2-NZ 2.73Å; D532-K538 PolarHBondContact OD2-NZ 3.45Å; G535-K538 PolarHBondContact O-N 2.97Å; G535-K538 VanDerWaalsContact O-N 3.09Å; K538-A540 PolarHBondContact O-N 3.38Å; K538-S541 WeakPolarHBondContact O-CB 3.07Å; K538-S541 PolarHBondContact O-N 3.25Å; K538-S541 PolarHBondContact O-OG 2.83Å
539	L	50.6	Low	59.8	Low	55 Å²	55	105.7 Å²	105.7	29%	0.288	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-64.2	-25.9	-176.8	-84.7	128	0	0	0	114	S541 Y542 E582 K585	L539-S541 PolarHBondContact O-N 3.19Å; L539-S541 VanDerWaalsContact O-N 3.16Å; L539-Y542 HydrophobicContact CD2-CD2 4.49Å; L539-Y542 HydrophobicContact CD2-CE2 4.03Å; L539-Y542 HydrophobicContact CG-CE2 4.29Å; L539-E582 HydrophobicContact CD2-CB 4.36Å; L539-K585 HydrophobicContact CD1-CD 3.55Å; L539-K585 HydrophobicContact CD2-CB 4Å; L539-K585 HydrophobicContact CD2-CD 3.87Å; L539-K585 HydrophobicContact CG-CD 4.37Å
540	A	49.6	Very low	62.5	Low	104 Å²	104	98.3 Å²	98.3	86%	0.86	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-71.2	-0.6	173.4	0	0	0	0	0	114.1	K538	K538-A540 PolarHBondContact O-N 3.38Å
541	S	55.2	Low	64.9	Low	95 Å²	95	90.9 Å²	90.9	66%	0.664	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-114.1	7.6	-175.4	71.9	0	0	0	0	115.6	K538 L539 D543	K538-S541 WeakPolarHBondContact O-CB 3.07Å; K538-S541 PolarHBondContact O-N 3.25Å; K538-S541 PolarHBondContact O-OG 2.83Å; L539-S541 PolarHBondContact O-N 3.19Å; L539-S541 VanDerWaalsContact O-N 3.16Å; S541-D543 PolarHBondContact O-N 3.37Å
542	Y	62.8	Low	67.1	Low	97 Å²	97	88.2 Å²	88.2	38%	0.38	51%	0.509	S	S	.	.			trans	-65.7	128.5	168.5	-77.3	-67.6	0	0	0	110.8	L539 T546 M550 E582	L539-Y542 HydrophobicContact CD2-CD2 4.49Å; L539-Y542 HydrophobicContact CD2-CE2 4.03Å; L539-Y542 HydrophobicContact CG-CE2 4.29Å; Y542-T546 HydrophobicContact CD1-CG2 3.61Å; Y542-T546 HydrophobicContact CE1-CG2 4.11Å; Y542-M550 HydrophobicContact CE1-CE 4.16Å; Y542-E582 HydrophobicContact CE2-CB 4.43Å; Y542-E582 HydrophobicContact CE2-CG 4.31Å; Y542-E582 VanDerWaalsContact CE2-OE2 3.23Å; Y542-E582 WeakPolarHBondContact CE2-OE2 3.32Å; Y542-E582 WeakPolarHBondContact OH-CG 3.35Å; Y542-E582 PolarHBondContact OH-OE2 3.15Å
543	D	74.8	Confident	69.3	Low	80 Å²	80	86.1 Å²	86.1	43%	0.428	50%	0.498	S	S	.	.			trans	-61.8	146.5	168.6	68.2	82.6	0	0	0	110.5	S541 D545 T546 R547 R549	S541-D543 PolarHBondContact O-N 3.37Å; D543-D545 PolarHBondContact O-N 3.49Å; D543-D545 VanDerWaalsContact O-N 3.14Å; D543-D545 WeakPolarHBondContact OD1-CA 3.42Å; D543-D545 WeakPolarHBondContact OD1-CB 3.49Å; D543-D545 PolarHBondContact OD1-N 3.47Å; D543-T546 VanDerWaalsContact CG-OG1 3.24Å; D543-T546 WeakPolarHBondContact O-CB 3.29Å; D543-T546 PolarHBondContact O-N 2.79Å; D543-T546 PolarHBondContact OD1-N 2.9Å; D543-T546 PolarHBondContact OD1-OG1 3.45Å; D543-T546 PolarHBondContact OD2-OG1 3.27Å; D543-R547 PolarHBondContact O-N 3.15Å; D543-R549 IonicContact OD1-NH2 2.67Å; D543-R549 PolarHBondContact OD1-NH2 3.07Å; D543-R549 IonicContact OD2-NH2 2.69Å
544	A	84.3	Confident	71.8	Confident	82 Å²	82	78.7 Å²	78.7	68%	0.678	46%	0.459	S	S	*	.	H	α-helix	trans	-60.6	-27.2	-175.5	0	0	0	0	0	112.5	K548	A544-K548 VanDerWaalsContact O-CB 3.23Å; A544-K548 WeakPolarHBondContact O-CB 3.41Å; A544-K548 PolarHBondContact O-N 2.89Å
545	D	87.4	Confident	74.3	Confident	92 Å²	92	74.8 Å²	74.8	49%	0.492	43%	0.433	S	S	.	.	H	α-helix	trans	-72.5	-31.7	174.3	-67.8	-39.1	0	0	0	112.1	D543 K548 R549	D543-D545 PolarHBondContact O-N 3.49Å; D543-D545 VanDerWaalsContact O-N 3.14Å; D543-D545 WeakPolarHBondContact OD1-CA 3.42Å; D543-D545 WeakPolarHBondContact OD1-CB 3.49Å; D543-D545 PolarHBondContact OD1-N 3.47Å; D545-K548 PolarHBondContact O-N 3.37Å; D545-R549 VanDerWaalsContact O-CB 3.31Å; D545-R549 WeakPolarHBondContact O-CB 3.44Å; D545-R549 WeakPolarHBondContact O-CG 3.46Å; D545-R549 PolarHBondContact O-N 3.07Å; D545-R549 PolarHBondContact O-NE 3.09Å
546	T	88.9	Confident	77.1	Confident	26 Å²	26	76 Å²	76	16%	0.16	44%	0.436	C	S	.	.	H	α-helix	trans	-67.4	-47.8	173.4	-66.7	0	0	0	0	110.6	Y542 D543 K548 R549 M550	Y542-T546 HydrophobicContact CD1-CG2 3.61Å; Y542-T546 HydrophobicContact CE1-CG2 4.11Å; D543-T546 VanDerWaalsContact CG-OG1 3.24Å; D543-T546 WeakPolarHBondContact O-CB 3.29Å; D543-T546 PolarHBondContact O-N 2.79Å; D543-T546 PolarHBondContact OD1-N 2.9Å; D543-T546 PolarHBondContact OD1-OG1 3.45Å; D543-T546 PolarHBondContact OD2-OG1 3.27Å; T546-K548 VanDerWaalsContact C-N 3.29Å; T546-K548 PolarHBondContact O-N 2.71Å; T546-R549 VanDerWaalsContact N-NH2 3.18Å; T546-R549 PolarHBondContact O-N 2.81Å; T546-R549 PolarHBondContact OG1-NH2 3.21Å; T546-M550 HydrophobicContact CG2-CE 3.9Å; T546-M550 HydrophobicContact CG2-SD 4.18Å; T546-M550 WeakPolarHBondContact O-CG 3.4Å; T546-M550 PolarHBondContact O-N 3.04Å
547	R	91.2	Very high	79.6	Confident	104 Å²	104	71.4 Å²	71.4	39%	0.392	40%	0.398	S	S	.	.	H	α-helix	trans	-56.2	-45	172.1	-175.1	179.7	179.6	-95.8	-3.1	111.1	D543 M550 I551 D586	D543-R547 PolarHBondContact O-N 3.15Å; R547-M550 PolarHBondContact O-N 3.13Å; R547-I551 HydrophobicContact CG-CD1 3.93Å; R547-I551 WeakPolarHBondContact O-CG1 3.23Å; R547-I551 PolarHBondContact O-N 3.17Å; R547-D586 IonicContact CZ-OD1 2.83Å; R547-D586 IonicContact CZ-OD2 2.7Å; R547-D586 VanDerWaalsContact CZ-OD2 3.31Å; R547-D586 IonicContact NE-OD1 2.68Å; R547-D586 IonicContact NE-OD2 2.66Å; R547-D586 PolarHBondContact NE-OD2 2.84Å; R547-D586 VanDerWaalsContact NH2-CG 3.3Å; R547-D586 IonicContact NH2-OD1 3.76Å; R547-D586 PolarHBondContact NH2-OD1 3.43Å; R547-D586 IonicContact NH2-OD2 2.62Å; R547-D586 PolarHBondContact NH2-OD2 2.92Å; R547-D586 VanDerWaalsContact NH2-OD2 3.13Å
548	K	92.1	Very high	81.8	Confident	127 Å²	127	68.1 Å²	68.1	55%	0.552	37%	0.369	S	S	*	.	H	α-helix	trans	-64.4	-40.5	177	-172.4	177.8	-179.7	-178.2	0	113.1	A544 D545 T546 I551 N552	A544-K548 VanDerWaalsContact O-CB 3.23Å; A544-K548 WeakPolarHBondContact O-CB 3.41Å; A544-K548 PolarHBondContact O-N 2.89Å; D545-K548 PolarHBondContact O-N 3.37Å; T546-K548 VanDerWaalsContact C-N 3.29Å; T546-K548 PolarHBondContact O-N 2.71Å; K548-I551 PolarHBondContact O-N 3.21Å; K548-N552 WeakPolarHBondContact O-CB 3.3Å; K548-N552 PolarHBondContact O-N 3Å; K548-N552 PolarHBondContact O-OD1 3.36Å
549	R	90.5	Very high	83.8	Confident	114 Å²	114	68.5 Å²	68.5	43%	0.43	37%	0.372	S	S	.	.	H	α-helix	trans	-61.2	-44.1	173.4	-79.4	179.6	-70.4	-98.8	1.4	111.1	D543 D545 T546 L553	D543-R549 IonicContact OD1-NH2 2.67Å; D543-R549 PolarHBondContact OD1-NH2 3.07Å; D543-R549 IonicContact OD2-NH2 2.69Å; D545-R549 VanDerWaalsContact O-CB 3.31Å; D545-R549 WeakPolarHBondContact O-CB 3.44Å; D545-R549 WeakPolarHBondContact O-CG 3.46Å; D545-R549 PolarHBondContact O-N 3.07Å; D545-R549 PolarHBondContact O-NE 3.09Å; T546-R549 VanDerWaalsContact N-NH2 3.18Å; T546-R549 PolarHBondContact O-N 2.81Å; T546-R549 PolarHBondContact OG1-NH2 3.21Å; R549-L553 WeakPolarHBondContact O-CB 3.5Å; R549-L553 PolarHBondContact O-N 3.07Å
550	M	93.5	Very high	85.6	Confident	32 Å²	32	70.9 Å²	70.9	16%	0.158	38%	0.38	C	S	.	.	H	α-helix	trans	-66.4	-41.9	177.7	-70.4	176.4	169.4	0	0	112.1	Y542 T546 R547 L553 L554 A579 L583	Y542-M550 HydrophobicContact CE1-CE 4.16Å; T546-M550 HydrophobicContact CG2-CE 3.9Å; T546-M550 HydrophobicContact CG2-SD 4.18Å; T546-M550 WeakPolarHBondContact O-CG 3.4Å; T546-M550 PolarHBondContact O-N 3.04Å; R547-M550 PolarHBondContact O-N 3.13Å; M550-L553 WeakPolarHBondContact O-CB 3.45Å; M550-L553 PolarHBondContact O-N 2.92Å; M550-L554 WeakPolarHBondContact O-CB 3.17Å; M550-L554 PolarHBondContact O-N 3.29Å; M550-A579 HydrophobicContact CG-CB 4.25Å; M550-L583 HydrophobicContact CB-CD1 3.97Å; M550-L583 HydrophobicContact CB-CD2 3.86Å; M550-L583 HydrophobicContact CB-CG 4.08Å
551	I	93.5	Very high	87.4	Confident	30 Å²	30	67.4 Å²	67.4	15%	0.154	35%	0.349	C	S	.	.	H	α-helix	trans	-66.3	-42.4	175.5	-68.4	169.6	0	0	0	111.5	R547 K548 L553 L554 D555 L583 V591	R547-I551 HydrophobicContact CG-CD1 3.93Å; R547-I551 WeakPolarHBondContact O-CG1 3.23Å; R547-I551 PolarHBondContact O-N 3.17Å; K548-I551 PolarHBondContact O-N 3.21Å; I551-L553 VanDerWaalsContact C-N 3.28Å; I551-L553 PolarHBondContact O-N 3.45Å; I551-L554 WeakPolarHBondContact O-CB 3.49Å; I551-L554 PolarHBondContact O-N 2.98Å; I551-L554 VanDerWaalsContact O-N 3.15Å; I551-D555 PolarHBondContact O-N 3.44Å; I551-L583 HydrophobicContact CG1-CD2 3.9Å; I551-V591 HydrophobicContact CD1-CG2 3.94Å; I551-V591 HydrophobicContact CG1-CG1 4.33Å; I551-V591 HydrophobicContact CG1-CG2 4.11Å
552	N	94.1	Very high	88.9	Confident	98 Å²	98	69.2 Å²	69.2	52%	0.524	35%	0.351	S	S	.	.	H	α-helix	trans	-61.2	-37	174.7	-71	-1	0	0	0	112.2	K548 S556	K548-N552 WeakPolarHBondContact O-CB 3.3Å; K548-N552 PolarHBondContact O-N 3Å; K548-N552 PolarHBondContact O-OD1 3.36Å; N552-S556 PolarHBondContact O-N 2.97Å; N552-S556 VanDerWaalsContact O-N 3.13Å
553	L	93.2	Very high	89.8	Confident	51 Å²	51	71 Å²	71	27%	0.267	36%	0.36	S	S	.	.	H	α-helix	trans	-65.7	-44.4	173.4	175.5	63.2	0	0	0	111.2	R549 M550 I551 S556 L557 Q576 A579	R549-L553 WeakPolarHBondContact O-CB 3.5Å; R549-L553 PolarHBondContact O-N 3.07Å; M550-L553 WeakPolarHBondContact O-CB 3.45Å; M550-L553 PolarHBondContact O-N 2.92Å; I551-L553 VanDerWaalsContact C-N 3.28Å; I551-L553 PolarHBondContact O-N 3.45Å; L553-S556 PolarHBondContact O-N 3.11Å; L553-L557 HydrophobicContact CD1-CD1 4.41Å; L553-L557 HydrophobicContact CD1-CG 4.49Å; L553-L557 HydrophobicContact CG-CD1 4.28Å; L553-L557 WeakPolarHBondContact O-CG 3.46Å; L553-L557 PolarHBondContact O-N 3.02Å; L553-Q576 HydrophobicContact CD1-CG 4.31Å; L553-Q576 HydrophobicContact CD2-CG 4.14Å; L553-A579 HydrophobicContact CD2-CB 4.33Å
554	L	95.3	Very high	89.6	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-59.1	-47.7	176.3	176.3	63.6	0	0	0	111.8	M550 I551 S556 L557 C558 M580 L583 V591 K594 V598	M550-L554 WeakPolarHBondContact O-CB 3.17Å; M550-L554 PolarHBondContact O-N 3.29Å; I551-L554 WeakPolarHBondContact O-CB 3.49Å; I551-L554 PolarHBondContact O-N 2.98Å; I551-L554 VanDerWaalsContact O-N 3.15Å; L554-S556 VanDerWaalsContact C-N 3.32Å; L554-S556 PolarHBondContact O-N 3.35Å; L554-L557 PolarHBondContact O-N 3.12Å; L554-L557 VanDerWaalsContact O-N 3.1Å; L554-C558 PolarHBondContact O-N 2.88Å; L554-C558 PolarHBondContact O-SG 3.21Å; L554-C558 VanDerWaalsContact O-SG 3.37Å; L554-M580 HydrophobicContact CB-CE 4.32Å; L554-M580 HydrophobicContact CD1-CE 4.05Å; L554-M580 HydrophobicContact CD1-SD 3.61Å; L554-L583 HydrophobicContact CB-CD1 4.07Å; L554-L583 HydrophobicContact CD2-CD1 4.24Å; L554-V591 HydrophobicContact CD2-CG1 4Å; L554-K594 HydrophobicContact CD1-CB 4.04Å; L554-K594 HydrophobicContact CD2-CB 3.57Å; L554-K594 HydrophobicContact CD2-CD 4.25Å; L554-K594 HydrophobicContact CG-CB 3.89Å; L554-V598 HydrophobicContact CD1-CB 4.39Å; L554-V598 HydrophobicContact CD1-CG2 3.89Å
555	D	94.5	Very high	88.3	Confident	59 Å²	59	70.1 Å²	70.1	32%	0.316	36%	0.356	S	S	.	.	H	α-helix	trans	-62.3	-38.8	177.9	-77.5	-28.9	0	0	0	112.1	I551 L557 C558 E559 K594	I551-D555 PolarHBondContact O-N 3.44Å; D555-L557 VanDerWaalsContact C-N 3.33Å; D555-L557 PolarHBondContact O-N 2.84Å; D555-C558 PolarHBondContact O-N 3.17Å; D555-E559 PolarHBondContact O-N 3.4Å; D555-K594 WeakPolarHBondContact OD1-CE 3.4Å; D555-K594 IonicContact OD1-NZ 2.59Å; D555-K594 PolarHBondContact OD1-NZ 2.86Å; D555-K594 IonicContact OD2-NZ 3.46Å
556	S	93.3	Very high	86.7	Confident	60 Å²	60	72 Å²	72	42%	0.42	37%	0.366	S	S	.	.	H	α-helix	trans	-65.1	-34.1	173.2	-173.5	0	0	0	0	113	N552 L553 L554 K560	N552-S556 PolarHBondContact O-N 2.97Å; N552-S556 VanDerWaalsContact O-N 3.13Å; L553-S556 PolarHBondContact O-N 3.11Å; L554-S556 VanDerWaalsContact C-N 3.32Å; L554-S556 PolarHBondContact O-N 3.35Å; S556-K560 WeakPolarHBondContact O-CG 3.31Å; S556-K560 PolarHBondContact O-N 3.03Å
557	L	93.2	Very high	85.2	Confident	3 Å²	3	78.6 Å²	78.6	2%	0.016	40%	0.401	C	S	.	.	H	α-helix	trans	-72.5	-41.9	173.7	-68.9	172.4	0	0	0	111.5	L553 L554 D555 E559 K560 V561 F570 Q576 M580 V598	L553-L557 HydrophobicContact CD1-CD1 4.41Å; L553-L557 HydrophobicContact CD1-CG 4.49Å; L553-L557 HydrophobicContact CG-CD1 4.28Å; L553-L557 WeakPolarHBondContact O-CG 3.46Å; L553-L557 PolarHBondContact O-N 3.02Å; L554-L557 PolarHBondContact O-N 3.12Å; L554-L557 VanDerWaalsContact O-N 3.1Å; D555-L557 VanDerWaalsContact C-N 3.33Å; D555-L557 PolarHBondContact O-N 2.84Å; L557-E559 VanDerWaalsContact C-N 3.32Å; L557-E559 PolarHBondContact O-N 2.92Å; L557-K560 HydrophobicContact CD2-CD 4.49Å; L557-K560 WeakPolarHBondContact O-CB 3.4Å; L557-K560 PolarHBondContact O-N 3.19Å; L557-K560 VanDerWaalsContact O-N 3.09Å; L557-V561 WeakPolarHBondContact O-CG2 3.28Å; L557-V561 PolarHBondContact O-N 3.18Å; L557-F570 HydrophobicContact CB-CZ 4.32Å; L557-F570 HydrophobicContact CD2-CE2 4.37Å; L557-F570 HydrophobicContact CD2-CZ 4.06Å; L557-Q576 HydrophobicContact CD1-CB 4.4Å; L557-Q576 HydrophobicContact CD1-CG 4.28Å; L557-M580 HydrophobicContact CD1-CE 4.1Å; L557-V598 HydrophobicContact CB-CG1 4.01Å; L557-V598 HydrophobicContact CB-CG2 3.95Å; L557-V598 HydrophobicContact CD1-CG1 4.09Å
558	C	91.6	Very high	83.9	Confident	18 Å²	18	79.6 Å²	79.6	12%	0.122	41%	0.409	C	S	.	.	H	α-helix	trans	-59	-40.9	172.4	-68.1	0	0	0	0	112.1	L554 D555 K560 V561 N562	L554-C558 PolarHBondContact O-N 2.88Å; L554-C558 PolarHBondContact O-SG 3.21Å; L554-C558 VanDerWaalsContact O-SG 3.37Å; D555-C558 PolarHBondContact O-N 3.17Å; C558-K560 VanDerWaalsContact C-N 3.32Å; C558-K560 PolarHBondContact O-N 3.03Å; C558-V561 PolarHBondContact O-N 2.97Å; C558-N562 WeakPolarHBondContact O-CB 3.46Å; C558-N562 VanDerWaalsContact O-CG 3.28Å; C558-N562 PolarHBondContact O-N 2.79Å; C558-N562 PolarHBondContact O-ND2 3.16Å
559	E	90.6	Very high	82.5	Confident	111 Å²	111	76.2 Å²	76.2	52%	0.519	40%	0.401	S	S	.	.	H	α-helix	trans	-60.5	-38.3	172.8	-89.9	-162.1	-142.2	0	0	113	D555 L557 K563	D555-E559 PolarHBondContact O-N 3.4Å; L557-E559 VanDerWaalsContact C-N 3.32Å; L557-E559 PolarHBondContact O-N 2.92Å; E559-K563 WeakPolarHBondContact O-CB 3.23Å; E559-K563 VanDerWaalsContact O-CD 3.32Å; E559-K563 WeakPolarHBondContact O-CD 3.35Å; E559-K563 WeakPolarHBondContact O-CG 3.36Å; E559-K563 PolarHBondContact O-N 3.43Å; E559-K563 VanDerWaalsContact O-N 3.17Å; E559-K563 IonicContact OE2-NZ 3.88Å; E559-K563 PolarHBondContact OE2-NZ 3Å
560	K	88.6	Confident	82.1	Confident	105 Å²	105	71.6 Å²	71.6	46%	0.457	38%	0.384	S	S	.	.	H	α-helix	trans	-68.6	-44.8	175.7	-72.8	177.5	-176.7	-178	0	111.8	S556 L557 C558 N562 K563 N564 F570	S556-K560 WeakPolarHBondContact O-CG 3.31Å; S556-K560 PolarHBondContact O-N 3.03Å; L557-K560 HydrophobicContact CD2-CD 4.49Å; L557-K560 WeakPolarHBondContact O-CB 3.4Å; L557-K560 PolarHBondContact O-N 3.19Å; L557-K560 VanDerWaalsContact O-N 3.09Å; C558-K560 VanDerWaalsContact C-N 3.32Å; C558-K560 PolarHBondContact O-N 3.03Å; K560-N562 VanDerWaalsContact C-N 3.27Å; K560-N562 PolarHBondContact O-N 2.86Å; K560-K563 PolarHBondContact O-N 3.03Å; K560-N564 WeakPolarHBondContact O-CB 3.35Å; K560-N564 PolarHBondContact O-N 3.22Å; K560-N564 PolarHBondContact O-OD1 3.48Å; K560-F570 HydrophobicContact CB-CD2 4.4Å; K560-F570 HydrophobicContact CB-CE2 3.89Å
561	V	87.3	Confident	81.5	Confident	32 Å²	32	73 Å²	73	19%	0.194	40%	0.397	C	S	.	.	H	α-helix	trans	-56.3	-43.9	175	173.3	0	0	0	0	110.8	L557 C558 K563 F570 V598 A601	L557-V561 WeakPolarHBondContact O-CG2 3.28Å; L557-V561 PolarHBondContact O-N 3.18Å; C558-V561 PolarHBondContact O-N 2.97Å; V561-K563 VanDerWaalsContact C-N 3.27Å; V561-K563 PolarHBondContact O-N 3.47Å; V561-F570 HydrophobicContact CG2-CD1 4.18Å; V561-F570 HydrophobicContact CG2-CD2 4.01Å; V561-F570 HydrophobicContact CG2-CE1 3.82Å; V561-F570 HydrophobicContact CG2-CE2 3.64Å; V561-F570 HydrophobicContact CG2-CG 4.27Å; V561-F570 HydrophobicContact CG2-CZ 3.54Å; V561-V598 HydrophobicContact CG2-CG2 4.46Å; V561-A601 HydrophobicContact CB-CB 4.37Å; V561-A601 HydrophobicContact CG1-CB 3.76Å; V561-A601 HydrophobicContact CG2-CB 3.61Å
562	N	85.3	Confident	81.2	Confident	132 Å²	132	72 Å²	72	71%	0.706	39%	0.392	S	S	*	.	H	α-helix	trans	-70.9	-16.7	177.8	-68.8	-20.6	0	0	0	114.4	C558 K560	C558-N562 WeakPolarHBondContact O-CB 3.46Å; C558-N562 VanDerWaalsContact O-CG 3.28Å; C558-N562 PolarHBondContact O-N 2.79Å; C558-N562 PolarHBondContact O-ND2 3.16Å; K560-N562 VanDerWaalsContact C-N 3.27Å; K560-N562 PolarHBondContact O-N 2.86Å
563	K	82.9	Confident	80.9	Confident	134 Å²	134	69.2 Å²	69.2	58%	0.583	38%	0.38	S	S	*	.	H	α-helix	trans	-98.8	-25.6	178.8	-72.2	167.5	-169	172.5	0	112.9	E559 K560 V561 A565	E559-K563 WeakPolarHBondContact O-CB 3.23Å; E559-K563 VanDerWaalsContact O-CD 3.32Å; E559-K563 WeakPolarHBondContact O-CD 3.35Å; E559-K563 WeakPolarHBondContact O-CG 3.36Å; E559-K563 PolarHBondContact O-N 3.43Å; E559-K563 VanDerWaalsContact O-N 3.17Å; E559-K563 IonicContact OE2-NZ 3.88Å; E559-K563 PolarHBondContact OE2-NZ 3Å; K560-K563 PolarHBondContact O-N 3.03Å; V561-K563 VanDerWaalsContact C-N 3.27Å; V561-K563 PolarHBondContact O-N 3.47Å; K563-A565 PolarHBondContact O-N 2.86Å
564	N	70.7	Confident	80.6	Confident	61 Å²	61	70.5 Å²	70.5	33%	0.326	39%	0.387	S	S	.	.			trans	-78.9	50.2	179.3	-77.2	22.7	0	0	0	112.5	K560 D566	K560-N564 WeakPolarHBondContact O-CB 3.35Å; K560-N564 PolarHBondContact O-N 3.22Å; K560-N564 PolarHBondContact O-OD1 3.48Å; N564-D566 PolarHBondContact O-N 3.03Å
565	A	56.6	Low	80.3	Confident	84 Å²	84	74.9 Å²	74.9	69%	0.694	41%	0.407	S	S	*	.			trans	-70.4	-17.8	176	0	0	0	0	0	113.3	K563 D567	K563-A565 PolarHBondContact O-N 2.86Å; A565-D567 VanDerWaalsContact C-N 3.31Å; A565-D567 PolarHBondContact O-N 3.23Å
566	D	54.9	Low	80.2	Confident	131 Å²	131	74 Å²	74	70%	0.701	40%	0.401	S	S	*	.	S	Bend	trans	-89.9	38.7	-170.8	-53.7	-34.7	0	0	0	113.9	N564 Q568	N564-D566 PolarHBondContact O-N 3.03Å; D566-Q568 PolarHBondContact O-N 3.23Å
567	D	57.3	Low	80.1	Confident	165 Å²	165	71.1 Å²	71.1	88%	0.882	38%	0.381	S	S	*	.			trans	51	21.1	-179.5	-67.4	-44.7	0	0	0	115.9	A565	A565-D567 VanDerWaalsContact C-N 3.31Å; A565-D567 PolarHBondContact O-N 3.23Å
568	Q	63.3	Low	80	Confident	124 Å²	124	74 Å²	74	58%	0.579	40%	0.396	S	S	*	.			trans	-70.1	133	177	-69.7	-69.7	-38.7	0	0	110.8	D566 F570	D566-Q568 PolarHBondContact O-N 3.23Å; Q568-F570 PolarHBondContact O-N 2.94Å; Q568-F570 VanDerWaalsContact O-N 3.11Å
569	P	63.5	Low	80	Confident	57 Å²	57	73.4 Å²	73.4	37%	0.37	39%	0.392	S	S	.	.			trans	-61.4	118.1	177.7	25	-33	0	0	0	110.8	T605 E607	P569-T605 HydrophobicContact CB-CG2 4.03Å; P569-E607 VanDerWaalsContact CB-OE2 3.28Å; P569-E607 WeakPolarHBondContact CB-OE2 3.35Å; P569-E607 WeakPolarHBondContact CG-OE2 3.46Å
570	F	80.6	Confident	80.2	Confident	16 Å²	16	68.1 Å²	68.1	7%	0.07	37%	0.368	C	S	.	.			trans	-92.3	111.4	172.4	178.6	-92.3	0	0	0	109.4	L557 K560 V561 Q568 I572 V598 A601 A602 T605	L557-F570 HydrophobicContact CB-CZ 4.32Å; L557-F570 HydrophobicContact CD2-CE2 4.37Å; L557-F570 HydrophobicContact CD2-CZ 4.06Å; K560-F570 HydrophobicContact CB-CD2 4.4Å; K560-F570 HydrophobicContact CB-CE2 3.89Å; V561-F570 HydrophobicContact CG2-CD1 4.18Å; V561-F570 HydrophobicContact CG2-CD2 4.01Å; V561-F570 HydrophobicContact CG2-CE1 3.82Å; V561-F570 HydrophobicContact CG2-CE2 3.64Å; V561-F570 HydrophobicContact CG2-CG 4.27Å; V561-F570 HydrophobicContact CG2-CZ 3.54Å; Q568-F570 PolarHBondContact O-N 2.94Å; Q568-F570 VanDerWaalsContact O-N 3.11Å; F570-I572 HydrophobicContact CE1-CG2 3.69Å; F570-I572 HydrophobicContact CZ-CG2 4.06Å; F570-V598 HydrophobicContact CE1-CG1 4Å; F570-V598 HydrophobicContact CZ-CG1 4.04Å; F570-A601 HydrophobicContact CD1-CB 3.95Å; F570-A601 HydrophobicContact CE1-CB 4.29Å; F570-A602 HydrophobicContact CD1-CB 4.15Å; F570-A602 HydrophobicContact CE1-CB 4.34Å; F570-A602 WeakPolarHBondContact O-CA 3.15Å; F570-T605 VanDerWaalsContact N-CG2 3.33Å; F570-T605 WeakPolarHBondContact O-CG2 3.33Å
571	S	82.1	Confident	80.4	Confident	63 Å²	63	63.7 Å²	63.7	44%	0.441	35%	0.349	S	S	.	.			trans	-112.3	160.6	173.7	59.1	0	0	0	0	112.1	D615	S571-D615 WeakPolarHBondContact CB-OD2 3.24Å
572	I	86.4	Confident	80.6	Confident	8 Å²	8	63.8 Å²	63.8	4%	0.041	35%	0.348	C	S	.	.			trans	-125.5	143.2	176.2	61.1	174.6	0	0	0	110.3	F570 Q576 V598 A602 L619 I624	F570-I572 HydrophobicContact CE1-CG2 3.69Å; F570-I572 HydrophobicContact CZ-CG2 4.06Å; I572-Q576 VanDerWaalsContact CA-OE1 3.31Å; I572-Q576 HydrophobicContact CB-CB 4.07Å; I572-V598 HydrophobicContact CG2-CG1 4.27Å; I572-A602 HydrophobicContact CD1-CB 4.39Å; I572-A602 HydrophobicContact CG1-CB 4.3Å; I572-A602 HydrophobicContact CG2-CB 4.41Å; I572-L619 HydrophobicContact CD1-CD2 3.99Å; I572-I624 HydrophobicContact CD1-CD1 4.2Å
573	S	88.5	Confident	81.1	Confident	40 Å²	40	57.7 Å²	57.7	28%	0.28	32%	0.315	S	S	.	.			trans	-73.5	167.3	175.8	83.9	0	0	0	0	112.1	E575 Q576 G577	S573-E575 VanDerWaalsContact C-N 3.32Å; S573-E575 VanDerWaalsContact CB-OE2 3.29Å; S573-E575 WeakPolarHBondContact CB-OE2 3.37Å; S573-E575 PolarHBondContact O-N 3.22Å; S573-E575 PolarHBondContact OG-N 3.18Å; S573-E575 PolarHBondContact OG-OE2 2.88Å; S573-Q576 WeakPolarHBondContact O-CB 3.41Å; S573-Q576 PolarHBondContact O-N 3.41Å; S573-Q576 WeakPolarHBondContact OG-CG 3.49Å; S573-Q576 PolarHBondContact OG-N 3.48Å; S573-G577 PolarHBondContact O-N 3.43Å
574	L	87.2	Confident	81.6	Confident	77 Å²	77	51.7 Å²	51.7	40%	0.403	29%	0.289	S	S	.	.	H	α-helix	trans	-60.8	-40.2	176.8	-173.4	66.2	0	0	0	112.2	Q576 G577 I578 I618 N621 C622	L574-Q576 VanDerWaalsContact C-N 3.34Å; L574-G577 PolarHBondContact O-N 3.46Å; L574-I578 HydrophobicContact CG-CD1 4.15Å; L574-I578 VanDerWaalsContact O-CG1 3.31Å; L574-I578 WeakPolarHBondContact O-CG1 3.44Å; L574-I578 PolarHBondContact O-N 3.48Å; L574-I618 HydrophobicContact CD1-CG2 4.41Å; L574-N621 HydrophobicContact CD1-CB 4.29Å; L574-C622 HydrophobicContact CD1-CB 4.09Å
575	E	87.6	Confident	82.7	Confident	93 Å²	93	52.7 Å²	52.7	44%	0.435	29%	0.291	S	S	.	.	H	α-helix	trans	-67.4	-35.2	176.2	-48.9	89.1	160.6	0	0	112	L525 S573 A579	L525-E575 HydrophobicContact CD1-CB 4.49Å; L525-E575 HydrophobicContact CD1-CG 4.27Å; S573-E575 VanDerWaalsContact C-N 3.32Å; S573-E575 VanDerWaalsContact CB-OE2 3.29Å; S573-E575 WeakPolarHBondContact CB-OE2 3.37Å; S573-E575 PolarHBondContact O-N 3.22Å; S573-E575 PolarHBondContact OG-N 3.18Å; S573-E575 PolarHBondContact OG-OE2 2.88Å; E575-A579 WeakPolarHBondContact O-CB 3.44Å; E575-A579 PolarHBondContact O-N 3.2Å
576	Q	92.4	Very high	84.4	Confident	40 Å²	40	50.2 Å²	50.2	19%	0.187	27%	0.266	C	S	.	.	H	α-helix	trans	-66.6	-43.8	173.4	-71.2	167.3	-3.6	0	0	110.8	L553 L557 I572 S573 L574 A579 M580	L553-Q576 HydrophobicContact CD1-CG 4.31Å; L553-Q576 HydrophobicContact CD2-CG 4.14Å; L557-Q576 HydrophobicContact CD1-CB 4.4Å; L557-Q576 HydrophobicContact CD1-CG 4.28Å; I572-Q576 VanDerWaalsContact CA-OE1 3.31Å; I572-Q576 HydrophobicContact CB-CB 4.07Å; S573-Q576 WeakPolarHBondContact O-CB 3.41Å; S573-Q576 PolarHBondContact O-N 3.41Å; S573-Q576 WeakPolarHBondContact OG-CG 3.49Å; S573-Q576 PolarHBondContact OG-N 3.48Å; L574-Q576 VanDerWaalsContact C-N 3.34Å; Q576-A579 PolarHBondContact O-N 2.96Å; Q576-M580 WeakPolarHBondContact O-CG 3.47Å; Q576-M580 PolarHBondContact O-N 2.97Å
577	G	91.5	Very high	86	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-57.7	-49	174.2	0	0	0	0	0	112.5	S573 L574 A579 M580 V581	S573-G577 PolarHBondContact O-N 3.43Å; L574-G577 PolarHBondContact O-N 3.46Å; G577-A579 PolarHBondContact O-N 2.68Å; G577-M580 WeakPolarHBondContact O-CB 3.48Å; G577-M580 PolarHBondContact O-N 2.76Å; G577-M580 VanDerWaalsContact O-N 3.13Å; G577-V581 PolarHBondContact O-N 3.45Å
578	I	91	Very high	87.7	Confident	63 Å²	63	47 Å²	47	32%	0.323	25%	0.248	S	C	.	.	H	α-helix	trans	-60.6	-43.9	176.3	-67	165.6	0	0	0	110.9	L574 M580 V581 E582 C622	L574-I578 HydrophobicContact CG-CD1 4.15Å; L574-I578 VanDerWaalsContact O-CG1 3.31Å; L574-I578 WeakPolarHBondContact O-CG1 3.44Å; L574-I578 PolarHBondContact O-N 3.48Å; I578-M580 VanDerWaalsContact C-N 3.31Å; I578-M580 PolarHBondContact O-N 2.81Å; I578-V581 WeakPolarHBondContact O-CB 3.44Å; I578-V581 PolarHBondContact O-N 3.21Å; I578-E582 PolarHBondContact O-N 3.39Å; I578-C622 HydrophobicContact CG1-CB 3.8Å
579	A	92.2	Very high	89	Confident	6 Å²	6	46.5 Å²	46.5	5%	0.05	25%	0.245	C	C	.	.	H	α-helix	trans	-61.3	-38.1	175.2	0	0	0	0	0	112.4	M550 L553 E575 Q576 G577 E582 L583	M550-A579 HydrophobicContact CG-CB 4.25Å; L553-A579 HydrophobicContact CD2-CB 4.33Å; E575-A579 WeakPolarHBondContact O-CB 3.44Å; E575-A579 PolarHBondContact O-N 3.2Å; Q576-A579 PolarHBondContact O-N 2.96Å; G577-A579 PolarHBondContact O-N 2.68Å; A579-E582 PolarHBondContact O-N 3.14Å; A579-L583 WeakPolarHBondContact O-CB 3.46Å; A579-L583 WeakPolarHBondContact O-CD1 3.18Å; A579-L583 WeakPolarHBondContact O-CG 3.41Å; A579-L583 PolarHBondContact O-N 3.23Å
580	M	93.4	Very high	90.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.3	-38.2	174.6	-64.9	-52.3	102.7	0	0	112	L554 L557 Q576 G577 I578 E582 L583 L584 V598 I599 I624	L554-M580 HydrophobicContact CB-CE 4.32Å; L554-M580 HydrophobicContact CD1-CE 4.05Å; L554-M580 HydrophobicContact CD1-SD 3.61Å; L557-M580 HydrophobicContact CD1-CE 4.1Å; Q576-M580 WeakPolarHBondContact O-CG 3.47Å; Q576-M580 PolarHBondContact O-N 2.97Å; G577-M580 WeakPolarHBondContact O-CB 3.48Å; G577-M580 PolarHBondContact O-N 2.76Å; G577-M580 VanDerWaalsContact O-N 3.13Å; I578-M580 VanDerWaalsContact C-N 3.31Å; I578-M580 PolarHBondContact O-N 2.81Å; M580-E582 VanDerWaalsContact C-N 3.3Å; M580-E582 PolarHBondContact O-N 3.01Å; M580-L583 HydrophobicContact CE-CD1 3.73Å; M580-L583 PolarHBondContact O-N 2.74Å; M580-L583 HydrophobicContact SD-CD1 4.47Å; M580-L584 WeakPolarHBondContact O-CB 3.23Å; M580-L584 VanDerWaalsContact O-CG 3.27Å; M580-L584 WeakPolarHBondContact O-CG 3.37Å; M580-L584 PolarHBondContact O-N 2.93Å; M580-V598 HydrophobicContact SD-CB 4.43Å; M580-V598 HydrophobicContact SD-CG1 4.21Å; M580-I599 HydrophobicContact CB-CD1 4.07Å; M580-I599 HydrophobicContact CB-CG1 4.26Å; M580-I599 HydrophobicContact CG-CG1 4.3Å; M580-I624 HydrophobicContact CB-CD1 4.37Å
581	V	93.5	Very high	91.1	Very high	12 Å²	12	48.3 Å²	48.3	7%	0.073	25%	0.252	C	S	.	.	H	α-helix	trans	-60.2	-39.7	177.3	172.7	0	0	0	0	112.3	G577 I578 K585 C622 I624 Q627	G577-V581 PolarHBondContact O-N 3.45Å; I578-V581 WeakPolarHBondContact O-CB 3.44Å; I578-V581 PolarHBondContact O-N 3.21Å; V581-K585 VanDerWaalsContact O-CE 3.3Å; V581-K585 WeakPolarHBondContact O-CE 3.45Å; V581-K585 WeakPolarHBondContact O-CG 3.4Å; V581-C622 WeakPolarHBondContact CG2-O 3.49Å; V581-I624 HydrophobicContact CG2-CB 4.23Å; V581-I624 HydrophobicContact CG2-CG1 3.53Å; V581-Q627 HydrophobicContact CG1-CB 4.23Å
582	E	92.5	Very high	91.6	Very high	34 Å²	34	45.5 Å²	45.5	16%	0.159	23%	0.232	C	C	.	.	H	α-helix	trans	-75.2	-39	178.4	-59.1	-65.1	80.8	0	0	111.3	L539 Y542 I578 A579 M580 L584 K585	L539-E582 HydrophobicContact CD2-CB 4.36Å; Y542-E582 HydrophobicContact CE2-CB 4.43Å; Y542-E582 HydrophobicContact CE2-CG 4.31Å; Y542-E582 VanDerWaalsContact CE2-OE2 3.23Å; Y542-E582 WeakPolarHBondContact CE2-OE2 3.32Å; Y542-E582 WeakPolarHBondContact OH-CG 3.35Å; Y542-E582 PolarHBondContact OH-OE2 3.15Å; I578-E582 PolarHBondContact O-N 3.39Å; A579-E582 PolarHBondContact O-N 3.14Å; M580-E582 VanDerWaalsContact C-N 3.3Å; M580-E582 PolarHBondContact O-N 3.01Å; E582-L584 VanDerWaalsContact C-N 3.3Å; E582-L584 PolarHBondContact O-N 2.72Å; E582-K585 WeakPolarHBondContact O-CB 3.49Å; E582-K585 PolarHBondContact O-N 2.94Å; E582-K585 IonicContact OE1-NZ 2.72Å; E582-K585 PolarHBondContact OE1-NZ 3.15Å
583	L	94.4	Very high	92	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.016	24%	0.239	C	C	.	.	H	α-helix	trans	-68.7	-23.8	174.9	-67.8	167.5	0	0	0	113.6	M550 I551 L554 A579 M580 K585 D586 V591 S595	M550-L583 HydrophobicContact CB-CD1 3.97Å; M550-L583 HydrophobicContact CB-CD2 3.86Å; M550-L583 HydrophobicContact CB-CG 4.08Å; I551-L583 HydrophobicContact CG1-CD2 3.9Å; L554-L583 HydrophobicContact CB-CD1 4.07Å; L554-L583 HydrophobicContact CD2-CD1 4.24Å; A579-L583 WeakPolarHBondContact O-CB 3.46Å; A579-L583 WeakPolarHBondContact O-CD1 3.18Å; A579-L583 WeakPolarHBondContact O-CG 3.41Å; A579-L583 PolarHBondContact O-N 3.23Å; M580-L583 HydrophobicContact CE-CD1 3.73Å; M580-L583 PolarHBondContact O-N 2.74Å; M580-L583 HydrophobicContact SD-CD1 4.47Å; L583-K585 PolarHBondContact O-N 3.2Å; L583-D586 WeakPolarHBondContact O-CB 3.29Å; L583-D586 PolarHBondContact O-N 2.76Å; L583-V591 HydrophobicContact CB-CG1 3.86Å; L583-V591 HydrophobicContact CD2-CG1 3.53Å; L583-V591 HydrophobicContact CG-CG1 4.22Å; L583-S595 WeakPolarHBondContact CB-OG 3.41Å
584	L	94.4	Very high	92.3	Very high	9 Å²	9	48.4 Å²	48.4	5%	0.047	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-9.2	169.5	-77.4	177.5	0	0	0	113.4	M580 E582 L596 I599 Q627 L628 M631	M580-L584 WeakPolarHBondContact O-CB 3.23Å; M580-L584 VanDerWaalsContact O-CG 3.27Å; M580-L584 WeakPolarHBondContact O-CG 3.37Å; M580-L584 PolarHBondContact O-N 2.93Å; E582-L584 VanDerWaalsContact C-N 3.3Å; E582-L584 PolarHBondContact O-N 2.72Å; L584-L596 HydrophobicContact CD2-CD2 3.63Å; L584-L596 HydrophobicContact CD2-CG 3.64Å; L584-I599 HydrophobicContact CD1-CD1 3.69Å; L584-I599 HydrophobicContact CD2-CD1 4.49Å; L584-I599 HydrophobicContact CG-CD1 4.28Å; L584-Q627 HydrophobicContact CB-CG 3.72Å; L584-Q627 HydrophobicContact CD1-CB 4.41Å; L584-Q627 HydrophobicContact CD1-CG 3.83Å; L584-Q627 HydrophobicContact CG-CG 4.46Å; L584-L628 HydrophobicContact CD1-CD2 4.01Å; L584-M631 HydrophobicContact CB-SD 4.2Å; L584-M631 HydrophobicContact CD1-SD 4.44Å; L584-M631 HydrophobicContact CD2-CE 4.27Å; L584-M631 HydrophobicContact CD2-SD 4.07Å; L584-M631 HydrophobicContact CG-SD 4.48Å
585	K	93.1	Very high	92.7	Very high	81 Å²	81	44.8 Å²	44.8	35%	0.352	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	4.5	177.3	-57.5	165.3	-166.4	168.7	0	112.3	L539 V581 E582 L583	L539-K585 HydrophobicContact CD1-CD 3.55Å; L539-K585 HydrophobicContact CD2-CB 4Å; L539-K585 HydrophobicContact CD2-CD 3.87Å; L539-K585 HydrophobicContact CG-CD 4.37Å; V581-K585 VanDerWaalsContact O-CE 3.3Å; V581-K585 WeakPolarHBondContact O-CE 3.45Å; V581-K585 WeakPolarHBondContact O-CG 3.4Å; E582-K585 WeakPolarHBondContact O-CB 3.49Å; E582-K585 PolarHBondContact O-N 2.94Å; E582-K585 IonicContact OE1-NZ 2.72Å; E582-K585 PolarHBondContact OE1-NZ 3.15Å; L583-K585 PolarHBondContact O-N 3.2Å
586	D	92.1	Very high	93	Very high	33 Å²	33	40.3 Å²	40.3	18%	0.176	20%	0.201	C	C	.	.			trans	-73.6	141.5	-178.1	-162.3	-68	0	0	0	112	R547 L583 D588 V591	R547-D586 IonicContact CZ-OD1 2.83Å; R547-D586 IonicContact CZ-OD2 2.7Å; R547-D586 VanDerWaalsContact CZ-OD2 3.31Å; R547-D586 IonicContact NE-OD1 2.68Å; R547-D586 IonicContact NE-OD2 2.66Å; R547-D586 PolarHBondContact NE-OD2 2.84Å; R547-D586 VanDerWaalsContact NH2-CG 3.3Å; R547-D586 IonicContact NH2-OD1 3.76Å; R547-D586 PolarHBondContact NH2-OD1 3.43Å; R547-D586 IonicContact NH2-OD2 2.62Å; R547-D586 PolarHBondContact NH2-OD2 2.92Å; R547-D586 VanDerWaalsContact NH2-OD2 3.13Å; L583-D586 WeakPolarHBondContact O-CB 3.29Å; L583-D586 PolarHBondContact O-N 2.76Å; D586-D588 PolarHBondContact O-N 2.93Å; D586-D588 WeakPolarHBondContact OD1-CB 3.31Å; D586-D588 PolarHBondContact OD1-N 3.46Å; D586-V591 HydrophobicContact CB-CB 4.31Å; D586-V591 HydrophobicContact CB-CG1 4Å
587	D	89.7	Confident	93	Very high	165 Å²	165	41 Å²	41	88%	0.882	21%	0.208	S	C	*	.	S	Bend	trans	-63.8	-27.2	177.6	-69	-53.5	0	0	0	112.9	K589	D587-K589 PolarHBondContact O-N 3.33Å; D587-K589 VanDerWaalsContact O-N 3.16Å
588	D	91.8	Very high	93	Very high	62 Å²	62	41 Å²	41	33%	0.332	21%	0.208	S	C	.	.			trans	-76.7	101.5	173.2	-174	-3.1	0	0	0	110.5	D586 N590 V591 A592	D586-D588 PolarHBondContact O-N 2.93Å; D586-D588 WeakPolarHBondContact OD1-CB 3.31Å; D586-D588 PolarHBondContact OD1-N 3.46Å; D588-N590 PolarHBondContact O-N 3.29Å; D588-N590 VanDerWaalsContact OD1-CB 3.3Å; D588-N590 WeakPolarHBondContact OD1-CB 3.46Å; D588-N590 PolarHBondContact OD1-N 2.91Å; D588-N590 PolarHBondContact OD1-ND2 2.91Å; D588-V591 HydrophobicContact CB-CB 4.3Å; D588-V591 HydrophobicContact CB-CG2 3.92Å; D588-V591 WeakPolarHBondContact O-CA 3.49Å; D588-V591 WeakPolarHBondContact O-CB 3.25Å; D588-V591 PolarHBondContact O-N 3.36Å; D588-A592 PolarHBondContact O-N 3.43Å
589	K	91.8	Very high	93	Very high	115 Å²	115	38 Å²	38	50%	0.5	19%	0.193	S	C	.	.	H	α-helix	trans	-50.5	-30.5	175.2	-62.5	-175	178.6	-174.5	0	113.4	D587 A592 I593	D587-K589 PolarHBondContact O-N 3.33Å; D587-K589 VanDerWaalsContact O-N 3.16Å; K589-A592 PolarHBondContact O-N 3.15Å; K589-I593 WeakPolarHBondContact O-CB 3.44Å; K589-I593 WeakPolarHBondContact O-CD1 3.43Å; K589-I593 WeakPolarHBondContact O-CG1 3.36Å; K589-I593 PolarHBondContact O-N 2.65Å
590	N	92.8	Very high	92.9	Very high	104 Å²	104	40 Å²	40	56%	0.556	20%	0.201	S	C	*	.	H	α-helix	trans	-69.6	-34.3	178.4	-55.8	-74.4	0	0	0	112.1	D588 K594	D588-N590 PolarHBondContact O-N 3.29Å; D588-N590 VanDerWaalsContact OD1-CB 3.3Å; D588-N590 WeakPolarHBondContact OD1-CB 3.46Å; D588-N590 PolarHBondContact OD1-N 2.91Å; D588-N590 PolarHBondContact OD1-ND2 2.91Å; N590-K594 WeakPolarHBondContact O-CB 3.5Å; N590-K594 WeakPolarHBondContact O-CG 3.43Å; N590-K594 PolarHBondContact O-N 3.42Å
591	V	94.3	Very high	92.6	Very high	6 Å²	6	41 Å²	41	4%	0.036	21%	0.209	C	C	.	.	H	α-helix	trans	-65	-50.5	172.5	173.2	0	0	0	0	109.3	I551 L554 L583 D586 D588 I593 K594 S595	I551-V591 HydrophobicContact CD1-CG2 3.94Å; I551-V591 HydrophobicContact CG1-CG1 4.33Å; I551-V591 HydrophobicContact CG1-CG2 4.11Å; L554-V591 HydrophobicContact CD2-CG1 4Å; L583-V591 HydrophobicContact CB-CG1 3.86Å; L583-V591 HydrophobicContact CD2-CG1 3.53Å; L583-V591 HydrophobicContact CG-CG1 4.22Å; D586-V591 HydrophobicContact CB-CB 4.31Å; D586-V591 HydrophobicContact CB-CG1 4Å; D588-V591 HydrophobicContact CB-CB 4.3Å; D588-V591 HydrophobicContact CB-CG2 3.92Å; D588-V591 WeakPolarHBondContact O-CA 3.49Å; D588-V591 WeakPolarHBondContact O-CB 3.25Å; D588-V591 PolarHBondContact O-N 3.36Å; V591-I593 VanDerWaalsContact C-N 3.35Å; V591-I593 PolarHBondContact O-N 3.29Å; V591-K594 PolarHBondContact O-N 2.9Å; V591-S595 PolarHBondContact O-N 3.33Å; V591-S595 PolarHBondContact O-OG 2.64Å
592	A	93.7	Very high	92.3	Very high	4 Å²	4	40.5 Å²	40.5	3%	0.033	21%	0.206	C	C	.	.	H	α-helix	trans	-60.2	-40.5	177.1	0	0	0	0	0	112.9	D588 K589 S595 L596 I641	D588-A592 PolarHBondContact O-N 3.43Å; K589-A592 PolarHBondContact O-N 3.15Å; A592-S595 PolarHBondContact O-N 3.27Å; A592-L596 WeakPolarHBondContact O-CG 3.45Å; A592-L596 PolarHBondContact O-N 2.91Å; A592-I641 HydrophobicContact CB-CD1 3.8Å
593	I	93.3	Very high	91.9	Very high	33 Å²	33	39.3 Å²	39.3	17%	0.169	20%	0.202	C	C	.	.	H	α-helix	trans	-63.4	-47	175.1	-69.3	156.8	0	0	0	111.3	K589 V591 S595 L596 V597 P640 I641	K589-I593 WeakPolarHBondContact O-CB 3.44Å; K589-I593 WeakPolarHBondContact O-CD1 3.43Å; K589-I593 WeakPolarHBondContact O-CG1 3.36Å; K589-I593 PolarHBondContact O-N 2.65Å; V591-I593 VanDerWaalsContact C-N 3.35Å; V591-I593 PolarHBondContact O-N 3.29Å; I593-S595 VanDerWaalsContact C-N 3.32Å; I593-S595 PolarHBondContact O-N 3.17Å; I593-L596 PolarHBondContact O-N 2.84Å; I593-V597 WeakPolarHBondContact O-CG2 3.39Å; I593-V597 PolarHBondContact O-N 3.37Å; I593-P640 HydrophobicContact CD1-CG 3.79Å; I593-I641 HydrophobicContact CD1-CB 4.31Å; I593-I641 HydrophobicContact CG1-CB 3.85Å; I593-I641 HydrophobicContact CG1-CG1 4.04Å
594	K	94.8	Very high	91	Very high	77 Å²	77	42 Å²	42	34%	0.335	22%	0.221	S	C	.	.	H	α-helix	trans	-58.9	-43.5	175.8	-80.2	177	-179.2	-179.5	0	111.3	L554 D555 N590 V591 V597 V598	L554-K594 HydrophobicContact CD1-CB 4.04Å; L554-K594 HydrophobicContact CD2-CB 3.57Å; L554-K594 HydrophobicContact CD2-CD 4.25Å; L554-K594 HydrophobicContact CG-CB 3.89Å; D555-K594 WeakPolarHBondContact OD1-CE 3.4Å; D555-K594 IonicContact OD1-NZ 2.59Å; D555-K594 PolarHBondContact OD1-NZ 2.86Å; D555-K594 IonicContact OD2-NZ 3.46Å; N590-K594 WeakPolarHBondContact O-CB 3.5Å; N590-K594 WeakPolarHBondContact O-CG 3.43Å; N590-K594 PolarHBondContact O-N 3.42Å; V591-K594 PolarHBondContact O-N 2.9Å; K594-V597 PolarHBondContact O-N 3.47Å; K594-V598 PolarHBondContact O-N 3.19Å
595	S	95.5	Very high	89.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-44.6	175.2	-64	0	0	0	0	111.8	L583 V591 A592 I593 V597 V598 I599	L583-S595 WeakPolarHBondContact CB-OG 3.41Å; V591-S595 PolarHBondContact O-N 3.33Å; V591-S595 PolarHBondContact O-OG 2.64Å; A592-S595 PolarHBondContact O-N 3.27Å; I593-S595 VanDerWaalsContact C-N 3.32Å; I593-S595 PolarHBondContact O-N 3.17Å; S595-V597 VanDerWaalsContact C-N 3.33Å; S595-V597 PolarHBondContact O-N 3.41Å; S595-V598 PolarHBondContact O-N 3.08Å; S595-I599 VanDerWaalsContact O-CG1 3.23Å; S595-I599 WeakPolarHBondContact O-CG1 3.37Å; S595-I599 PolarHBondContact O-N 2.95Å
596	L	94.5	Very high	87.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.7	-39.9	174.2	-70.2	171.3	0	0	0	112.5	L584 A592 I593 I599 Q600 L628 M631 I641 T644 L645	L584-L596 HydrophobicContact CD2-CD2 3.63Å; L584-L596 HydrophobicContact CD2-CG 3.64Å; A592-L596 WeakPolarHBondContact O-CG 3.45Å; A592-L596 PolarHBondContact O-N 2.91Å; I593-L596 PolarHBondContact O-N 2.84Å; L596-I599 PolarHBondContact O-N 3.35Å; L596-Q600 WeakPolarHBondContact O-CB 3.43Å; L596-Q600 PolarHBondContact O-N 3.03Å; L596-L628 HydrophobicContact CD2-CD2 3.36Å; L596-M631 HydrophobicContact CD1-CE 4.2Å; L596-I641 HydrophobicContact CD1-CG1 3.81Å; L596-T644 HydrophobicContact CB-CG2 3.68Å; L596-T644 HydrophobicContact CD1-CG2 4.37Å; L596-L645 HydrophobicContact CD1-CB 4.05Å; L596-L645 HydrophobicContact CD2-CD1 3.81Å
597	V	92.1	Very high	86	Confident	54 Å²	54	49 Å²	49	33%	0.327	26%	0.255	S	S	.	.	H	α-helix	trans	-64.6	-42.1	176.2	171	0	0	0	0	111.7	I593 K594 S595 Q600 A601 T644	I593-V597 WeakPolarHBondContact O-CG2 3.39Å; I593-V597 PolarHBondContact O-N 3.37Å; K594-V597 PolarHBondContact O-N 3.47Å; S595-V597 VanDerWaalsContact C-N 3.33Å; S595-V597 PolarHBondContact O-N 3.41Å; V597-Q600 PolarHBondContact O-N 2.86Å; V597-A601 WeakPolarHBondContact O-CB 3.36Å; V597-A601 PolarHBondContact O-N 3.18Å; V597-T644 HydrophobicContact CG2-CG2 3.91Å
598	V	92.4	Very high	84.1	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.7	-41	177	168.9	0	0	0	0	111.6	L554 L557 V561 F570 I572 M580 K594 S595 A601 A602	L554-V598 HydrophobicContact CD1-CB 4.39Å; L554-V598 HydrophobicContact CD1-CG2 3.89Å; L557-V598 HydrophobicContact CB-CG1 4.01Å; L557-V598 HydrophobicContact CB-CG2 3.95Å; L557-V598 HydrophobicContact CD1-CG1 4.09Å; V561-V598 HydrophobicContact CG2-CG2 4.46Å; F570-V598 HydrophobicContact CE1-CG1 4Å; F570-V598 HydrophobicContact CZ-CG1 4.04Å; I572-V598 HydrophobicContact CG2-CG1 4.27Å; M580-V598 HydrophobicContact SD-CB 4.43Å; M580-V598 HydrophobicContact SD-CG1 4.21Å; K594-V598 PolarHBondContact O-N 3.19Å; S595-V598 PolarHBondContact O-N 3.08Å; V598-A601 PolarHBondContact O-N 3.43Å; V598-A602 PolarHBondContact O-N 3.02Å; V598-A602 VanDerWaalsContact O-N 3.08Å
599	I	91.5	Very high	82.2	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-67.9	-41.4	175.2	-60.1	164.4	0	0	0	110.8	M580 L584 S595 L596 A601 A602 A603 L619 I624 L628 C648	M580-I599 HydrophobicContact CB-CD1 4.07Å; M580-I599 HydrophobicContact CB-CG1 4.26Å; M580-I599 HydrophobicContact CG-CG1 4.3Å; L584-I599 HydrophobicContact CD1-CD1 3.69Å; L584-I599 HydrophobicContact CD2-CD1 4.49Å; L584-I599 HydrophobicContact CG-CD1 4.28Å; S595-I599 VanDerWaalsContact O-CG1 3.23Å; S595-I599 WeakPolarHBondContact O-CG1 3.37Å; S595-I599 PolarHBondContact O-N 2.95Å; L596-I599 PolarHBondContact O-N 3.35Å; I599-A601 VanDerWaalsContact C-N 3.27Å; I599-A601 PolarHBondContact O-N 3.38Å; I599-A602 PolarHBondContact O-N 3.12Å; I599-A603 WeakPolarHBondContact O-CB 3.44Å; I599-A603 PolarHBondContact O-N 2.87Å; I599-L619 HydrophobicContact CG2-CD2 4.36Å; I599-I624 HydrophobicContact CD1-CD1 3.99Å; I599-I624 HydrophobicContact CD1-CG1 4.16Å; I599-I624 HydrophobicContact CD1-CG2 4.16Å; I599-I624 HydrophobicContact CG1-CD1 3.95Å; I599-I624 HydrophobicContact CG2-CD1 4.48Å; I599-I624 HydrophobicContact CG2-CG2 3.89Å; I599-L628 HydrophobicContact CG2-CD1 4.39Å; I599-C648 VanDerWaalsContact CG2-SG 3.6Å
600	Q	89.5	Confident	80.2	Confident	49 Å²	49	42.8 Å²	42.8	23%	0.229	22%	0.223	C	C	.	.	H	α-helix	trans	-60.7	-36.1	176.8	-179.4	-177.6	-23.2	0	0	112	L596 V597 C604 C648 N651	L596-Q600 WeakPolarHBondContact O-CB 3.43Å; L596-Q600 PolarHBondContact O-N 3.03Å; V597-Q600 PolarHBondContact O-N 2.86Å; Q600-C604 PolarHBondContact O-N 3.48Å; Q600-C648 HydrophobicContact CB-CB 4.02Å; Q600-N651 WeakPolarHBondContact CG-ND2 3.26Å; Q600-N651 PolarHBondContact O-ND2 3.39Å
601	A	87.8	Confident	77.8	Confident	19 Å²	19	41.3 Å²	41.3	16%	0.157	22%	0.218	C	C	.	.	H	α-helix	trans	-69.4	-43.7	173.8	0	0	0	0	0	112.1	V561 F570 V597 V598 I599 A603 C604	V561-A601 HydrophobicContact CB-CB 4.37Å; V561-A601 HydrophobicContact CG1-CB 3.76Å; V561-A601 HydrophobicContact CG2-CB 3.61Å; F570-A601 HydrophobicContact CD1-CB 3.95Å; F570-A601 HydrophobicContact CE1-CB 4.29Å; V597-A601 WeakPolarHBondContact O-CB 3.36Å; V597-A601 PolarHBondContact O-N 3.18Å; V598-A601 PolarHBondContact O-N 3.43Å; I599-A601 VanDerWaalsContact C-N 3.27Å; I599-A601 PolarHBondContact O-N 3.38Å; A601-A603 VanDerWaalsContact C-N 3.27Å; A601-A603 PolarHBondContact O-N 2.81Å; A601-C604 VanDerWaalsContact O-CB 3.23Å; A601-C604 WeakPolarHBondContact O-CB 3.49Å; A601-C604 PolarHBondContact O-N 2.98Å
602	A	86.6	Confident	75.6	Confident	2 Å²	2	47.5 Å²	47.5	2%	0.017	26%	0.257	C	S	.	.	H	α-helix	trans	-63.2	-32.7	175	0	0	0	0	0	112.9	F570 I572 V598 I599 C604 N608	F570-A602 HydrophobicContact CD1-CB 4.15Å; F570-A602 HydrophobicContact CE1-CB 4.34Å; F570-A602 WeakPolarHBondContact O-CA 3.15Å; I572-A602 HydrophobicContact CD1-CB 4.39Å; I572-A602 HydrophobicContact CG1-CB 4.3Å; I572-A602 HydrophobicContact CG2-CB 4.41Å; V598-A602 PolarHBondContact O-N 3.02Å; V598-A602 VanDerWaalsContact O-N 3.08Å; I599-A602 PolarHBondContact O-N 3.12Å; A602-C604 PolarHBondContact O-N 3.33Å; A602-N608 PolarHBondContact O-ND2 3.3Å
603	A	83.6	Confident	73.6	Confident	9 Å²	9	48.6 Å²	48.6	7%	0.074	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-3.4	173.3	0	0	0	0	0	114.3	I599 A601 N651 L652	I599-A603 WeakPolarHBondContact O-CB 3.44Å; I599-A603 PolarHBondContact O-N 2.87Å; A601-A603 VanDerWaalsContact C-N 3.27Å; A601-A603 PolarHBondContact O-N 2.81Å; A603-N651 HydrophobicContact CB-CB 3.9Å; A603-L652 HydrophobicContact CB-CD2 3.56Å; A603-L652 HydrophobicContact CB-CG 3.83Å
604	C	76.1	Confident	72	Confident	61 Å²	61	50.6 Å²	50.6	41%	0.412	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-17.5	-171	-130.1	0	0	0	0	114.1	Q600 A601 A602 N651	Q600-C604 PolarHBondContact O-N 3.48Å; A601-C604 VanDerWaalsContact O-CB 3.23Å; A601-C604 WeakPolarHBondContact O-CB 3.49Å; A601-C604 PolarHBondContact O-N 2.98Å; A602-C604 PolarHBondContact O-N 3.33Å; C604-N651 PolarHBondContact SG-ND2 3.24Å
605	T	64.8	Low	70.2	Confident	16 Å²	16	48.6 Å²	48.6	10%	0.098	27%	0.274	C	S	.	.			trans	-70.2	143.3	-171.6	68.1	0	0	0	0	112.7	P569 F570 E607 N608	P569-T605 HydrophobicContact CB-CG2 4.03Å; F570-T605 VanDerWaalsContact N-CG2 3.33Å; F570-T605 WeakPolarHBondContact O-CG2 3.33Å; T605-E607 VanDerWaalsContact C-N 3.33Å; T605-E607 PolarHBondContact O-N 2.75Å; T605-N608 PolarHBondContact O-N 3.32Å; T605-N608 WeakPolarHBondContact OG1-CB 3.42Å; T605-N608 VanDerWaalsContact OG1-CG 3.28Å; T605-N608 PolarHBondContact OG1-ND2 3.3Å; T605-N608 VanDerWaalsContact OG1-ND2 3.12Å
606	E	58.1	Low	68.7	Low	144 Å²	144	49 Å²	49	67%	0.673	28%	0.276	S	S	*	.	S	Bend	trans	-71.4	-27.3	179.2	-64.4	-149.4	124.8	0	0	113.4	N608 R609 V610	E606-N608 PolarHBondContact O-N 3.2Å; E606-R609 WeakPolarHBondContact O-CB 3.21Å; E606-R609 PolarHBondContact O-N 2.91Å; E606-V610 PolarHBondContact O-N 3.23Å
607	E	50.7	Low	67.3	Low	110 Å²	110	52.3 Å²	52.3	51%	0.514	30%	0.296	S	S	.	.	H	α-helix	trans	-59.3	-37.3	173.2	-65	-179.7	144.7	0	0	110.8	P569 T605 R609 T611	P569-E607 VanDerWaalsContact CB-OE2 3.28Å; P569-E607 WeakPolarHBondContact CB-OE2 3.35Å; P569-E607 WeakPolarHBondContact CG-OE2 3.46Å; T605-E607 VanDerWaalsContact C-N 3.33Å; T605-E607 PolarHBondContact O-N 2.75Å; E607-R609 PolarHBondContact O-N 3.26Å; E607-T611 PolarHBondContact O-N 2.85Å; E607-T611 PolarHBondContact O-OG1 3.48Å
608	N	50.5	Low	66.4	Low	10 Å²	10	51.3 Å²	51.3	5%	0.053	29%	0.288	C	S	.	.	H	α-helix	trans	-76.6	0.7	173.3	-72.3	-17.7	0	0	0	114.5	A602 T605 E606 I616 N655	A602-N608 PolarHBondContact O-ND2 3.3Å; T605-N608 PolarHBondContact O-N 3.32Å; T605-N608 WeakPolarHBondContact OG1-CB 3.42Å; T605-N608 VanDerWaalsContact OG1-CG 3.28Å; T605-N608 PolarHBondContact OG1-ND2 3.3Å; T605-N608 VanDerWaalsContact OG1-ND2 3.12Å; E606-N608 PolarHBondContact O-N 3.2Å; N608-I616 HydrophobicContact CB-CD1 4.44Å; N608-I616 HydrophobicContact CB-CG1 3.93Å; N608-I616 WeakPolarHBondContact O-CD1 3.21Å; N608-N655 PolarHBondContact O-ND2 3.41Å
609	R	52.6	Low	65.6	Low	89 Å²	89	51.6 Å²	51.6	34%	0.336	29%	0.29	S	S	.	.	H	α-helix	trans	-104.3	-31	174.3	-68.1	-177.2	180	152.7	5.3	114	E606 E607	E606-R609 WeakPolarHBondContact O-CB 3.21Å; E606-R609 PolarHBondContact O-N 2.91Å; E607-R609 PolarHBondContact O-N 3.26Å
610	V	50	Low	64.9	Low	111 Å²	111	53 Å²	53	67%	0.673	30%	0.299	S	S	*	.	H	α-helix	trans	-114	-18.5	-168.2	-174.2	0	0	0	0	113.2	E606	E606-V610 PolarHBondContact O-N 3.23Å
611	T	40.9	Very low	64.6	Low	73 Å²	73	56.2 Å²	56.2	45%	0.448	32%	0.318	S	S	.	.	S	Bend	trans	-120.3	152	-175.6	69.1	0	0	0	0	112.6	E607 S613 I616	E607-T611 PolarHBondContact O-N 2.85Å; E607-T611 PolarHBondContact O-OG1 3.48Å; T611-S613 PolarHBondContact O-N 3.33Å; T611-S613 WeakPolarHBondContact OG1-CB 3.35Å; T611-I616 WeakPolarHBondContact O-CD1 3.43Å
612	T	48.2	Very low	64.5	Low	137 Å²	137	56 Å²	56	84%	0.84	32%	0.315	S	S	*	.			trans	-73.4	44.5	168.6	45.2	0	0	0	0	111.6
613	S	52.6	Low	64.7	Low	26 Å²	26	56.7 Å²	56.7	18%	0.182	32%	0.323	C	S	.	.			trans	-62.5	147.8	-175.7	175.7	0	0	0	0	112.2	T611 D615 I616 T617	T611-S613 PolarHBondContact O-N 3.33Å; T611-S613 WeakPolarHBondContact OG1-CB 3.35Å; S613-D615 PolarHBondContact O-N 2.88Å; S613-D615 PolarHBondContact OG-N 3.43Å; S613-I616 PolarHBondContact O-N 2.85Å; S613-T617 PolarHBondContact O-OG1 2.82Å
614	S	58.2	Low	65.1	Low	75 Å²	75	56.4 Å²	56.4	52%	0.524	32%	0.32	S	S	.	.	H	α-helix	trans	-50.1	-26.9	172	42.5	0	0	0	0	114.1	T617 I618	S614-T617 CarbonylContact O-C 3.52Å; S614-T617 WeakPolarHBondContact O-CA 3.48Å; S614-T617 WeakPolarHBondContact O-CB 3.4Å; S614-T617 PolarHBondContact O-N 3.09Å; S614-T617 PolarHBondContact O-OG1 3.05Å; S614-I618 WeakPolarHBondContact O-CG1 3.38Å; S614-I618 PolarHBondContact O-N 2.83Å
615	D	57.2	Low	65.7	Low	35 Å²	35	54.2 Å²	54.2	19%	0.187	30%	0.304	C	S	.	.	H	α-helix	trans	-84.4	-28.2	-163.1	-63.5	14.9	0	0	0	111.6	S571 S613 T617 I618 L619	S571-D615 WeakPolarHBondContact CB-OD2 3.24Å; S613-D615 PolarHBondContact O-N 2.88Å; S613-D615 PolarHBondContact OG-N 3.43Å; D615-T617 VanDerWaalsContact C-N 3.32Å; D615-I618 WeakPolarHBondContact O-CB 3.28Å; D615-I618 PolarHBondContact O-N 2.84Å; D615-L619 PolarHBondContact O-N 3.4Å; D615-L619 VanDerWaalsContact O-N 3.15Å
616	I	64.2	Low	67	Low	8 Å²	8	58.5 Å²	58.5	4%	0.041	33%	0.326	C	S	.	.	H	α-helix	trans	-67.4	-38.5	165.2	-51	158.5	0	0	0	109.6	N608 T611 S613 I618 L619 C620 N655 L658	N608-I616 HydrophobicContact CB-CD1 4.44Å; N608-I616 HydrophobicContact CB-CG1 3.93Å; N608-I616 WeakPolarHBondContact O-CD1 3.21Å; T611-I616 WeakPolarHBondContact O-CD1 3.43Å; S613-I616 PolarHBondContact O-N 2.85Å; I616-I618 VanDerWaalsContact C-N 3.3Å; I616-I618 PolarHBondContact O-N 2.89Å; I616-L619 PolarHBondContact O-N 3.39Å; I616-C620 PolarHBondContact O-N 2.77Å; I616-N655 WeakPolarHBondContact CD1-ND2 3.31Å; I616-L658 HydrophobicContact CG2-CD1 4.08Å; I616-L658 HydrophobicContact CG2-CD2 4.35Å; I616-L658 HydrophobicContact CG2-CG 4.03Å
617	T	65.9	Low	68.7	Low	70 Å²	70	52.8 Å²	52.8	43%	0.429	30%	0.3	S	S	.	.	H	α-helix	trans	-63.3	-37.1	175	-32	0	0	0	0	110.9	S613 S614 D615 C620 N621	S613-T617 PolarHBondContact O-OG1 2.82Å; S614-T617 CarbonylContact O-C 3.52Å; S614-T617 WeakPolarHBondContact O-CA 3.48Å; S614-T617 WeakPolarHBondContact O-CB 3.4Å; S614-T617 PolarHBondContact O-N 3.09Å; S614-T617 PolarHBondContact O-OG1 3.05Å; D615-T617 VanDerWaalsContact C-N 3.32Å; T617-C620 PolarHBondContact O-N 2.97Å; T617-N621 WeakPolarHBondContact O-CB 3.37Å; T617-N621 PolarHBondContact O-N 3.5Å; T617-N621 PolarHBondContact O-OD1 3.47Å
618	I	72.8	Confident	70.8	Confident	33 Å²	33	47.5 Å²	47.5	17%	0.169	28%	0.275	C	S	.	.	H	α-helix	trans	-60.9	-49.4	171.4	-72.3	167.4	0	0	0	110.8	L574 S614 D615 I616 C620 N621 C622	L574-I618 HydrophobicContact CD1-CG2 4.41Å; S614-I618 WeakPolarHBondContact O-CG1 3.38Å; S614-I618 PolarHBondContact O-N 2.83Å; D615-I618 WeakPolarHBondContact O-CB 3.28Å; D615-I618 PolarHBondContact O-N 2.84Å; I616-I618 VanDerWaalsContact C-N 3.3Å; I616-I618 PolarHBondContact O-N 2.89Å; I618-C620 PolarHBondContact O-N 2.9Å; I618-N621 PolarHBondContact O-N 2.84Å; I618-N621 VanDerWaalsContact O-N 3.17Å; I618-C622 PolarHBondContact O-N 2.92Å; I618-C622 PolarHBondContact O-SG 3.06Å
619	L	76	Confident	72.8	Confident	7 Å²	7	48.5 Å²	48.5	4%	0.037	28%	0.282	C	S	.	.	H	α-helix	trans	-60.5	-31.6	179	-69.3	174.3	0	0	0	113.2	I572 I599 D615 I616 I624 L652	I572-L619 HydrophobicContact CD1-CD2 3.99Å; I599-L619 HydrophobicContact CG2-CD2 4.36Å; D615-L619 PolarHBondContact O-N 3.4Å; D615-L619 VanDerWaalsContact O-N 3.15Å; I616-L619 PolarHBondContact O-N 3.39Å; L619-I624 HydrophobicContact CD2-CD1 3.8Å; L619-L652 HydrophobicContact CD1-CD2 3.98Å
620	C	77.5	Confident	74.7	Confident	28 Å²	28	48.9 Å²	48.9	19%	0.189	29%	0.29	C	S	.	.	H	α-helix	trans	-72.6	-53.9	169.3	-69.1	0	0	0	0	111.9	I616 T617 I618 C622 G623 K661	I616-C620 PolarHBondContact O-N 2.77Å; T617-C620 PolarHBondContact O-N 2.97Å; I618-C620 PolarHBondContact O-N 2.9Å; C620-C622 VanDerWaalsContact C-N 3.33Å; C620-C622 PolarHBondContact O-N 3.48Å; C620-G623 PolarHBondContact O-N 2.73Å; C620-K661 PolarHBondContact SG-NZ 2.88Å
621	N	81.8	Confident	76.9	Confident	118 Å²	118	44.4 Å²	44.4	63%	0.631	26%	0.262	S	S	*	.	H	α-helix	trans	-73.6	-19	-165.2	-68.2	4.3	0	0	0	114.4	L574 T617 I618	L574-N621 HydrophobicContact CD1-CB 4.29Å; T617-N621 WeakPolarHBondContact O-CB 3.37Å; T617-N621 PolarHBondContact O-N 3.5Å; T617-N621 PolarHBondContact O-OD1 3.47Å; I618-N621 PolarHBondContact O-N 2.84Å; I618-N621 VanDerWaalsContact O-N 3.17Å
622	C	86.2	Confident	79.4	Confident	13 Å²	13	40.9 Å²	40.9	9%	0.088	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-8.7	174.6	62	0	0	0	0	114.5	L574 I578 V581 I618 C620 I624	L574-C622 HydrophobicContact CD1-CB 4.09Å; I578-C622 HydrophobicContact CG1-CB 3.8Å; V581-C622 WeakPolarHBondContact CG2-O 3.49Å; I618-C622 PolarHBondContact O-N 2.92Å; I618-C622 PolarHBondContact O-SG 3.06Å; C620-C622 VanDerWaalsContact C-N 3.33Å; C620-C622 PolarHBondContact O-N 3.48Å; C622-I624 VanDerWaalsContact SG-CD1 3.51Å; C622-I624 WeakPolarHBondContact SG-CG1 3.09Å
623	G	90.3	Very high	81.5	Confident	18 Å²	18	38.2 Å²	38.2	19%	0.186	22%	0.221	C	C	.	.	S	Bend	trans	84.4	10.2	-176.9	0	0	0	0	0	115.3	C620 L625 D626 Q627	C620-G623 PolarHBondContact O-N 2.73Å; G623-L625 VanDerWaalsContact C-N 3.26Å; G623-L625 PolarHBondContact O-N 2.91Å; G623-D626 PolarHBondContact O-N 3.12Å; G623-Q627 PolarHBondContact O-N 3.37Å; G623-Q627 VanDerWaalsContact O-N 3.15Å
624	I	91.6	Very high	83.3	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-54.2	-45.8	173.8	-82.4	171.4	0	0	0	110.5	I572 M580 V581 I599 L619 C622 D626 Q627 L628	I572-I624 HydrophobicContact CD1-CD1 4.2Å; M580-I624 HydrophobicContact CB-CD1 4.37Å; V581-I624 HydrophobicContact CG2-CB 4.23Å; V581-I624 HydrophobicContact CG2-CG1 3.53Å; I599-I624 HydrophobicContact CD1-CD1 3.99Å; I599-I624 HydrophobicContact CD1-CG1 4.16Å; I599-I624 HydrophobicContact CD1-CG2 4.16Å; I599-I624 HydrophobicContact CG1-CD1 3.95Å; I599-I624 HydrophobicContact CG2-CD1 4.48Å; I599-I624 HydrophobicContact CG2-CG2 3.89Å; L619-I624 HydrophobicContact CD2-CD1 3.8Å; C622-I624 VanDerWaalsContact SG-CD1 3.51Å; C622-I624 WeakPolarHBondContact SG-CG1 3.09Å; I624-D626 VanDerWaalsContact C-N 3.31Å; I624-D626 PolarHBondContact O-N 2.78Å; I624-Q627 PolarHBondContact O-N 3.02Å; I624-L628 HydrophobicContact CG2-CD1 3.56Å; I624-L628 HydrophobicContact CG2-CG 4.01Å; I624-L628 WeakPolarHBondContact O-CB 3.41Å; I624-L628 VanDerWaalsContact O-CG 3.26Å; I624-L628 WeakPolarHBondContact O-CG 3.47Å; I624-L628 PolarHBondContact O-N 2.76Å
625	L	90.4	Very high	84.9	Confident	15 Å²	15	40.2 Å²	40.2	8%	0.079	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-37.4	-175.5	-167.2	65.6	0	0	0	112.8	G623 T629 L658 K661 L662	G623-L625 VanDerWaalsContact C-N 3.26Å; G623-L625 PolarHBondContact O-N 2.91Å; L625-T629 WeakPolarHBondContact O-CB 3.26Å; L625-T629 PolarHBondContact O-N 3Å; L625-T629 PolarHBondContact O-OG1 3.21Å; L625-L658 HydrophobicContact CD1-CD2 4.48Å; L625-L658 HydrophobicContact CD2-CD2 4.2Å; L625-K661 HydrophobicContact CD2-CB 3.85Å; L625-K661 HydrophobicContact CD2-CD 3.39Å; L625-K661 HydrophobicContact CD2-CG 4.26Å; L625-L662 HydrophobicContact CD1-CD1 4.26Å; L625-L662 HydrophobicContact CD1-CD2 3.69Å; L625-L662 HydrophobicContact CD1-CG 3.94Å
626	D	91.7	Very high	86.5	Confident	106 Å²	106	41.5 Å²	41.5	57%	0.567	23%	0.23	S	C	*	.	H	α-helix	trans	-70.6	-41.6	177.5	-58.4	-48	0	0	0	111.3	G623 I624 T629 L630	G623-D626 PolarHBondContact O-N 3.12Å; I624-D626 VanDerWaalsContact C-N 3.31Å; I624-D626 PolarHBondContact O-N 2.78Å; D626-T629 WeakPolarHBondContact O-CB 3.24Å; D626-T629 PolarHBondContact O-N 2.89Å; D626-L630 WeakPolarHBondContact O-CG 3.46Å; D626-L630 PolarHBondContact O-N 3.37Å
627	Q	94	Very high	87.4	Confident	24 Å²	24	42.6 Å²	42.6	11%	0.112	24%	0.238	C	C	.	.	H	α-helix	trans	-66	-42.8	176.3	-177.4	58.6	26.7	0	0	111.9	V581 L584 G623 I624 T629 L630 M631	V581-Q627 HydrophobicContact CG1-CB 4.23Å; L584-Q627 HydrophobicContact CB-CG 3.72Å; L584-Q627 HydrophobicContact CD1-CB 4.41Å; L584-Q627 HydrophobicContact CD1-CG 3.83Å; L584-Q627 HydrophobicContact CG-CG 4.46Å; G623-Q627 PolarHBondContact O-N 3.37Å; G623-Q627 VanDerWaalsContact O-N 3.15Å; I624-Q627 PolarHBondContact O-N 3.02Å; Q627-T629 VanDerWaalsContact C-N 3.29Å; Q627-T629 PolarHBondContact O-N 3.42Å; Q627-L630 PolarHBondContact O-N 3.01Å; Q627-M631 HydrophobicContact CG-SD 4.36Å; Q627-M631 VanDerWaalsContact O-CG 3.31Å; Q627-M631 WeakPolarHBondContact O-CG 3.31Å; Q627-M631 PolarHBondContact O-N 3.34Å
628	L	94.2	Very high	87.9	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.6	-36.2	173.7	-65.8	178.2	0	0	0	111.7	L584 L596 I599 I624 M631 L632 L645 I649 L652	L584-L628 HydrophobicContact CD1-CD2 4.01Å; L596-L628 HydrophobicContact CD2-CD2 3.36Å; I599-L628 HydrophobicContact CG2-CD1 4.39Å; I624-L628 HydrophobicContact CG2-CD1 3.56Å; I624-L628 HydrophobicContact CG2-CG 4.01Å; I624-L628 WeakPolarHBondContact O-CB 3.41Å; I624-L628 VanDerWaalsContact O-CG 3.26Å; I624-L628 WeakPolarHBondContact O-CG 3.47Å; I624-L628 PolarHBondContact O-N 2.76Å; L628-M631 PolarHBondContact O-N 3.47Å; L628-L632 VanDerWaalsContact O-CB 3.31Å; L628-L632 WeakPolarHBondContact O-CB 3.47Å; L628-L632 PolarHBondContact O-N 3.36Å; L628-L645 HydrophobicContact CB-CD1 4.42Å; L628-L645 HydrophobicContact CD2-CD1 3.61Å; L628-I649 HydrophobicContact CB-CD1 4.25Å; L628-I649 HydrophobicContact CB-CG1 4.4Å; L628-L652 HydrophobicContact CD1-CD1 3.35Å
629	T	92.1	Very high	88.5	Confident	31 Å²	31	44.7 Å²	44.7	19%	0.19	26%	0.263	C	S	.	.	H	α-helix	trans	-63.1	-45.1	173.6	-70	0	0	0	0	111.9	L625 D626 Q627 M631 L632 N633 H665	L625-T629 WeakPolarHBondContact O-CB 3.26Å; L625-T629 PolarHBondContact O-N 3Å; L625-T629 PolarHBondContact O-OG1 3.21Å; D626-T629 WeakPolarHBondContact O-CB 3.24Å; D626-T629 PolarHBondContact O-N 2.89Å; Q627-T629 VanDerWaalsContact C-N 3.29Å; Q627-T629 PolarHBondContact O-N 3.42Å; T629-M631 PolarHBondContact O-N 3.43Å; T629-L632 PolarHBondContact O-N 3.1Å; T629-N633 PolarHBondContact O-N 2.86Å; T629-N633 PolarHBondContact O-ND2 2.9Å; T629-N633 VanDerWaalsContact O-ND2 3.1Å; T629-H665 WeakPolarHBondContact CG2-NE2 3.24Å
630	L	93.5	Very high	89.2	Confident	96 Å²	96	48 Å²	48	50%	0.503	29%	0.285	S	S	.	.	H	α-helix	trans	-59.9	-44.7	173.8	-71.6	169.5	0	0	0	111.4	D626 Q627 N633 Q634	D626-L630 WeakPolarHBondContact O-CG 3.46Å; D626-L630 PolarHBondContact O-N 3.37Å; Q627-L630 PolarHBondContact O-N 3.01Å; L630-N633 PolarHBondContact O-N 2.9Å; L630-Q634 WeakPolarHBondContact O-CG 3.21Å; L630-Q634 PolarHBondContact O-N 3.43Å
631	M	94.5	Very high	89.9	Confident	17 Å²	17	47.8 Å²	47.8	8%	0.084	28%	0.282	C	S	.	.	H	α-helix	trans	-67	-37.6	177	-64.4	172.5	76	0	0	112.6	L584 L596 Q627 L628 T629 N633 Q634 L635 I641 L645	L584-M631 HydrophobicContact CB-SD 4.2Å; L584-M631 HydrophobicContact CD1-SD 4.44Å; L584-M631 HydrophobicContact CD2-CE 4.27Å; L584-M631 HydrophobicContact CD2-SD 4.07Å; L584-M631 HydrophobicContact CG-SD 4.48Å; L596-M631 HydrophobicContact CD1-CE 4.2Å; Q627-M631 HydrophobicContact CG-SD 4.36Å; Q627-M631 VanDerWaalsContact O-CG 3.31Å; Q627-M631 WeakPolarHBondContact O-CG 3.31Å; Q627-M631 PolarHBondContact O-N 3.34Å; L628-M631 PolarHBondContact O-N 3.47Å; T629-M631 PolarHBondContact O-N 3.43Å; M631-N633 VanDerWaalsContact C-N 3.32Å; M631-N633 PolarHBondContact O-N 2.98Å; M631-Q634 WeakPolarHBondContact O-CB 3.34Å; M631-Q634 PolarHBondContact O-N 3.36Å; M631-Q634 VanDerWaalsContact O-N 3.11Å; M631-L635 PolarHBondContact O-N 3.43Å; M631-I641 HydrophobicContact CE-CD1 4.07Å; M631-I641 HydrophobicContact CE-CG1 4.33Å; M631-L645 HydrophobicContact CB-CD1 4.08Å; M631-L645 HydrophobicContact CB-CD2 3.62Å
632	L	93.8	Very high	90.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.2	-36.8	176.6	174.5	53.3	0	0	0	111.5	L628 T629 Q634 L635 L646 I649 H665 K668 L669	L628-L632 VanDerWaalsContact O-CB 3.31Å; L628-L632 WeakPolarHBondContact O-CB 3.47Å; L628-L632 PolarHBondContact O-N 3.36Å; T629-L632 PolarHBondContact O-N 3.1Å; L632-Q634 PolarHBondContact O-N 2.89Å; L632-L635 HydrophobicContact CD1-CD1 3.75Å; L632-L635 PolarHBondContact O-N 3.17Å; L632-L646 HydrophobicContact CD1-CD2 4.38Å; L632-I649 HydrophobicContact CB-CD1 3.82Å; L632-I649 HydrophobicContact CD2-CD1 3.78Å; L632-I649 HydrophobicContact CD2-CG2 4.33Å; L632-I649 HydrophobicContact CG-CD1 4.27Å; L632-H665 HydrophobicContact CD2-CB 3.42Å; L632-H665 VanDerWaalsContact CD2-CB 3.42Å; L632-H665 HydrophobicContact CG-CB 4.18Å; L632-K668 HydrophobicContact CD1-CG 4.27Å; L632-K668 WeakPolarHBondContact O-CE 3.39Å; L632-L669 HydrophobicContact CD1-CD2 4.04Å
633	N	92.3	Very high	90.7	Very high	80 Å²	80	42.3 Å²	42.3	43%	0.428	25%	0.252	S	S	.	.	H	α-helix	trans	-64.9	-29.1	173.6	-71.6	-36.7	0	0	0	112.5	T629 L630 M631 H665 K668	T629-N633 PolarHBondContact O-N 2.86Å; T629-N633 PolarHBondContact O-ND2 2.9Å; T629-N633 VanDerWaalsContact O-ND2 3.1Å; L630-N633 PolarHBondContact O-N 2.9Å; M631-N633 VanDerWaalsContact C-N 3.32Å; M631-N633 PolarHBondContact O-N 2.98Å; N633-H665 PolarHBondContact OD1-CE1 3.35Å; N633-H665 PolarHBondContact OD1-ND1 3.31Å; N633-K668 PolarHBondContact O-NZ 3.15Å
634	Q	91.8	Very high	90.8	Very high	139 Å²	139	42.4 Å²	42.4	65%	0.65	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-8.6	176.6	-65.4	170.1	9.8	0	0	114.8	L630 M631 L632	L630-Q634 WeakPolarHBondContact O-CG 3.21Å; L630-Q634 PolarHBondContact O-N 3.43Å; M631-Q634 WeakPolarHBondContact O-CB 3.34Å; M631-Q634 PolarHBondContact O-N 3.36Å; M631-Q634 VanDerWaalsContact O-N 3.11Å; L632-Q634 PolarHBondContact O-N 2.89Å
635	L	91.2	Very high	91	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.021	25%	0.249	C	C	.	.			trans	-66.3	148.6	177.1	-82.8	170	0	0	0	112.9	M631 L632 C637 L645 L646 K668 L672 L681	M631-L635 PolarHBondContact O-N 3.43Å; L632-L635 HydrophobicContact CD1-CD1 3.75Å; L632-L635 PolarHBondContact O-N 3.17Å; L635-C637 HydrophobicContact CD2-CB 4.48Å; L635-C637 VanDerWaalsContact CD2-SG 3.52Å; L635-L645 HydrophobicContact CD1-CD2 3.99Å; L635-L645 HydrophobicContact CG-CD2 4.25Å; L635-L646 HydrophobicContact CD1-CD1 4.38Å; L635-L646 HydrophobicContact CD1-CD2 3.81Å; L635-L646 HydrophobicContact CD1-CG 3.94Å; L635-K668 WeakPolarHBondContact O-CE 3.4Å; L635-K668 PolarHBondContact O-NZ 2.97Å; L635-L672 HydrophobicContact CB-CD1 4.16Å; L635-L672 HydrophobicContact CB-CD2 4.19Å; L635-L672 HydrophobicContact CD1-CD1 3.99Å; L635-L681 HydrophobicContact CD2-CD1 3.93Å; L635-L681 HydrophobicContact CD2-CD2 4.34Å
636	P	89.8	Confident	91.3	Very high	63 Å²	63	41.7 Å²	41.7	41%	0.409	25%	0.246	S	C	.	.	S	Bend	cis	-73.7	143.7	-2.4	31.8	-35.7	0	0	0	112.4	L672 L675 E678 L681	P636-L672 HydrophobicContact CB-CD2 4.46Å; P636-L675 HydrophobicContact CB-CD1 4.09Å; P636-L675 HydrophobicContact CG-CD1 4.22Å; P636-E678 WeakPolarHBondContact CB-OE2 3.39Å; P636-L681 HydrophobicContact CB-CD2 3.69Å
637	C	83.9	Confident	91.3	Very high	31 Å²	31	40.2 Å²	40.2	21%	0.209	23%	0.233	C	C	.	.			trans	-129.6	142.8	178.6	61.9	0	0	0	0	110.6	L635 G642	L635-C637 HydrophobicContact CD2-CB 4.48Å; L635-C637 VanDerWaalsContact CD2-SG 3.52Å; C637-G642 VanDerWaalsContact SG-CA 3.6Å
638	P	76.6	Confident	91.3	Very high	99 Å²	99	39 Å²	39	64%	0.643	23%	0.227	S	C	*	.	S	Bend	trans	-79.1	130.4	-166.9	29.5	-35.2	0	0	0	113.2
639	G	84.9	Confident	91.3	Very high	47 Å²	47	39 Å²	39	49%	0.485	23%	0.227	S	C	.	.	S	Bend	trans	103.1	-172.8	177.6	0	0	0	0	0	113.5	I641 P643	G639-I641 PolarHBondContact O-N 3.15Å; G639-P643 WeakPolarHBondContact O-CD 3.29Å
640	P	90.1	Very high	91.3	Very high	78 Å²	78	37.6 Å²	37.6	51%	0.506	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-13.5	-173.8	27.7	-35.5	0	0	0	114.3	I593 G642 P643 T644	I593-P640 HydrophobicContact CD1-CG 3.79Å; P640-G642 VanDerWaalsContact C-N 3.26Å; P640-G642 PolarHBondContact O-N 3.24Å; P640-P643 WeakPolarHBondContact O-CD 3.24Å; P640-T644 WeakPolarHBondContact O-CB 3.42Å; P640-T644 PolarHBondContact O-N 3Å; P640-T644 PolarHBondContact O-OG1 3.3Å
641	I	92.5	Very high	91.2	Very high	22 Å²	22	34.3 Å²	34.3	11%	0.113	20%	0.201	C	C	.	.	H	α-helix	trans	-60.7	-34.2	179.6	-163.4	171.2	0	0	0	112.4	A592 I593 L596 M631 G639 L645	A592-I641 HydrophobicContact CB-CD1 3.8Å; I593-I641 HydrophobicContact CD1-CB 4.31Å; I593-I641 HydrophobicContact CG1-CB 3.85Å; I593-I641 HydrophobicContact CG1-CG1 4.04Å; L596-I641 HydrophobicContact CD1-CG1 3.81Å; M631-I641 HydrophobicContact CE-CD1 4.07Å; M631-I641 HydrophobicContact CE-CG1 4.33Å; G639-I641 PolarHBondContact O-N 3.15Å; I641-L645 WeakPolarHBondContact O-CB 3.34Å; I641-L645 PolarHBondContact O-N 2.9Å
642	G	93	Very high	91	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-68	-54	176.4	0	0	0	0	0	113.5	C637 P640 T644 L645 L646	C637-G642 VanDerWaalsContact SG-CA 3.6Å; P640-G642 VanDerWaalsContact C-N 3.26Å; P640-G642 PolarHBondContact O-N 3.24Å; G642-T644 PolarHBondContact O-N 3.07Å; G642-L645 PolarHBondContact O-N 2.88Å; G642-L646 WeakPolarHBondContact O-CG 3.19Å; G642-L646 PolarHBondContact O-N 2.77Å
643	P	93	Very high	90.8	Very high	16 Å²	16	33.7 Å²	33.7	10%	0.104	20%	0.199	C	C	.	.	H	α-helix	trans	-54.8	-45.7	170.7	-30.4	37.1	0	0	0	113.7	G639 P640 L645 L646 Y647 Q680 L681 A684	G639-P643 WeakPolarHBondContact O-CD 3.29Å; P640-P643 WeakPolarHBondContact O-CD 3.24Å; P643-L645 VanDerWaalsContact C-N 3.35Å; P643-L645 PolarHBondContact O-N 3.46Å; P643-L646 PolarHBondContact O-N 2.99Å; P643-L646 VanDerWaalsContact O-N 3.15Å; P643-Y647 HydrophobicContact CB-CE2 4.26Å; P643-Y647 WeakPolarHBondContact O-CD2 3.33Å; P643-Y647 PolarHBondContact O-N 3.24Å; P643-Q680 HydrophobicContact CG-CB 4.36Å; P643-L681 HydrophobicContact CG-CD1 4.17Å; P643-A684 HydrophobicContact CB-CB 3.9Å
644	T	92.8	Very high	90.5	Very high	20 Å²	20	30.7 Å²	30.7	12%	0.123	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-41.7	179.7	-47	0	0	0	0	111.6	L596 V597 P640 G642 L646 Y647 C648	L596-T644 HydrophobicContact CB-CG2 3.68Å; L596-T644 HydrophobicContact CD1-CG2 4.37Å; V597-T644 HydrophobicContact CG2-CG2 3.91Å; P640-T644 WeakPolarHBondContact O-CB 3.42Å; P640-T644 PolarHBondContact O-N 3Å; P640-T644 PolarHBondContact O-OG1 3.3Å; G642-T644 PolarHBondContact O-N 3.07Å; T644-L646 VanDerWaalsContact C-N 3.34Å; T644-L646 PolarHBondContact O-N 3.01Å; T644-Y647 PolarHBondContact O-N 2.79Å; T644-C648 WeakPolarHBondContact O-CB 3.38Å; T644-C648 PolarHBondContact O-N 3.35Å
645	L	95.5	Very high	90.2	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-60.2	-42.8	174.1	177.8	66.4	0	0	0	111.9	L596 L628 M631 L635 I641 G642 P643 C648 I649	L596-L645 HydrophobicContact CD1-CB 4.05Å; L596-L645 HydrophobicContact CD2-CD1 3.81Å; L628-L645 HydrophobicContact CB-CD1 4.42Å; L628-L645 HydrophobicContact CD2-CD1 3.61Å; M631-L645 HydrophobicContact CB-CD1 4.08Å; M631-L645 HydrophobicContact CB-CD2 3.62Å; L635-L645 HydrophobicContact CD1-CD2 3.99Å; L635-L645 HydrophobicContact CG-CD2 4.25Å; I641-L645 WeakPolarHBondContact O-CB 3.34Å; I641-L645 PolarHBondContact O-N 2.9Å; G642-L645 PolarHBondContact O-N 2.88Å; P643-L645 VanDerWaalsContact C-N 3.35Å; P643-L645 PolarHBondContact O-N 3.46Å; L645-C648 PolarHBondContact O-N 3.16Å; L645-I649 HydrophobicContact CD1-CD1 3.76Å; L645-I649 HydrophobicContact CD1-CG1 4.24Å; L645-I649 HydrophobicContact CG-CD1 3.96Å; L645-I649 WeakPolarHBondContact O-CB 3.18Å; L645-I649 WeakPolarHBondContact O-CG1 3.39Å; L645-I649 PolarHBondContact O-N 3.43Å
646	L	95.5	Very high	89.8	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.9	-39.7	178.1	-71.4	171.7	0	0	0	112.5	L632 L635 G642 P643 T644 I649 G650 L669 L672 L681 A684 T685 A688	L632-L646 HydrophobicContact CD1-CD2 4.38Å; L635-L646 HydrophobicContact CD1-CD1 4.38Å; L635-L646 HydrophobicContact CD1-CD2 3.81Å; L635-L646 HydrophobicContact CD1-CG 3.94Å; G642-L646 WeakPolarHBondContact O-CG 3.19Å; G642-L646 PolarHBondContact O-N 2.77Å; P643-L646 PolarHBondContact O-N 2.99Å; P643-L646 VanDerWaalsContact O-N 3.15Å; T644-L646 VanDerWaalsContact C-N 3.34Å; T644-L646 PolarHBondContact O-N 3.01Å; L646-I649 PolarHBondContact O-N 3.2Å; L646-G650 PolarHBondContact O-N 3.23Å; L646-L669 HydrophobicContact CD2-CD2 3.45Å; L646-L669 VanDerWaalsContact CD2-CD2 3.45Å; L646-L672 HydrophobicContact CD1-CD1 4.27Å; L646-L672 HydrophobicContact CD2-CD1 4.22Å; L646-L681 HydrophobicContact CD1-CD1 3.53Å; L646-L681 HydrophobicContact CD1-CG 3.93Å; L646-A684 HydrophobicContact CB-CB 3.95Å; L646-A684 HydrophobicContact CD1-CB 4.07Å; L646-T685 WeakPolarHBondContact CD1-OG1 3.42Å; L646-A688 WeakPolarHBondContact O-CB 3.38Å
647	Y	93.4	Very high	89.5	Confident	75 Å²	75	31 Å²	31	29%	0.294	19%	0.188	S	C	.	.	H	α-helix	trans	-64.9	-42.1	173	-67.6	-62.2	0	0	0	112.1	P643 T644 G650 N651 A684 A687	P643-Y647 HydrophobicContact CB-CE2 4.26Å; P643-Y647 WeakPolarHBondContact O-CD2 3.33Å; P643-Y647 PolarHBondContact O-N 3.24Å; T644-Y647 PolarHBondContact O-N 2.79Å; Y647-G650 PolarHBondContact O-N 3.23Å; Y647-N651 PolarHBondContact O-N 3.2Å; Y647-A684 HydrophobicContact CD2-CB 4.29Å; Y647-A684 HydrophobicContact CE1-CB 4.24Å; Y647-A684 HydrophobicContact CE2-CB 3.8Å; Y647-A687 HydrophobicContact CD1-CB 4.08Å; Y647-A687 HydrophobicContact CE1-CB 3.58Å
648	C	92.7	Very high	89.7	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-58.8	-49.7	174.1	-174.7	0	0	0	0	111.9	I599 Q600 T644 L645 N651 L652	I599-C648 VanDerWaalsContact CG2-SG 3.6Å; Q600-C648 HydrophobicContact CB-CB 4.02Å; T644-C648 WeakPolarHBondContact O-CB 3.38Å; T644-C648 PolarHBondContact O-N 3.35Å; L645-C648 PolarHBondContact O-N 3.16Å; C648-N651 PolarHBondContact O-N 3.17Å; C648-L652 WeakPolarHBondContact O-CG 3.27Å; C648-L652 PolarHBondContact O-N 2.84Å
649	I	93.9	Very high	90.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-68.3	-35.4	179.8	-69.3	179.6	0	0	0	111.5	L628 L632 L645 L646 L652 A653 L662 F692	L628-I649 HydrophobicContact CB-CD1 4.25Å; L628-I649 HydrophobicContact CB-CG1 4.4Å; L632-I649 HydrophobicContact CB-CD1 3.82Å; L632-I649 HydrophobicContact CD2-CD1 3.78Å; L632-I649 HydrophobicContact CD2-CG2 4.33Å; L632-I649 HydrophobicContact CG-CD1 4.27Å; L645-I649 HydrophobicContact CD1-CD1 3.76Å; L645-I649 HydrophobicContact CD1-CG1 4.24Å; L645-I649 HydrophobicContact CG-CD1 3.96Å; L645-I649 WeakPolarHBondContact O-CB 3.18Å; L645-I649 WeakPolarHBondContact O-CG1 3.39Å; L645-I649 PolarHBondContact O-N 3.43Å; L646-I649 PolarHBondContact O-N 3.2Å; I649-L652 PolarHBondContact O-N 3.44Å; I649-A653 VanDerWaalsContact O-CB 3.28Å; I649-A653 WeakPolarHBondContact O-CB 3.38Å; I649-A653 PolarHBondContact O-N 3.08Å; I649-L662 HydrophobicContact CG2-CD1 4.23Å; I649-L662 HydrophobicContact CG2-CD2 4.09Å; I649-F692 HydrophobicContact CG2-CE2 4.2Å; I649-F692 HydrophobicContact CG2-CZ 4.15Å
650	G	92.8	Very high	90.4	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-61.1	-39.9	171.3	0	0	0	0	0	113	L646 Y647 N691	L646-G650 PolarHBondContact O-N 3.23Å; Y647-G650 PolarHBondContact O-N 3.23Å; G650-N691 WeakPolarHBondContact O-CB 3.48Å; G650-N691 PolarHBondContact O-ND2 3.21Å
651	N	90.4	Very high	90.4	Very high	26 Å²	26	27.4 Å²	27.4	14%	0.139	15%	0.146	C	C	.	.	H	α-helix	trans	-68.8	-44.1	175.4	-78.9	0.9	0	0	0	111.8	Q600 A603 C604 Y647 C648 A653 A654	Q600-N651 WeakPolarHBondContact CG-ND2 3.26Å; Q600-N651 PolarHBondContact O-ND2 3.39Å; A603-N651 HydrophobicContact CB-CB 3.9Å; C604-N651 PolarHBondContact SG-ND2 3.24Å; Y647-N651 PolarHBondContact O-N 3.2Å; C648-N651 PolarHBondContact O-N 3.17Å; N651-A653 VanDerWaalsContact C-N 3.35Å; N651-A653 PolarHBondContact O-N 3.18Å; N651-A654 WeakPolarHBondContact O-CB 3.27Å; N651-A654 PolarHBondContact O-N 2.94Å
652	L	90.5	Very high	90.4	Very high	5 Å²	5	26.4 Å²	26.4	3%	0.026	14%	0.141	C	C	.	.	H	α-helix	trans	-60.9	-41.9	176.2	-66.8	164.3	0	0	0	111.9	A603 L619 L628 C648 I649 A654 N655 L658 L662	A603-L652 HydrophobicContact CB-CD2 3.56Å; A603-L652 HydrophobicContact CB-CG 3.83Å; L619-L652 HydrophobicContact CD1-CD2 3.98Å; L628-L652 HydrophobicContact CD1-CD1 3.35Å; C648-L652 WeakPolarHBondContact O-CG 3.27Å; C648-L652 PolarHBondContact O-N 2.84Å; I649-L652 PolarHBondContact O-N 3.44Å; L652-A654 PolarHBondContact O-N 3Å; L652-A654 VanDerWaalsContact O-N 3.13Å; L652-N655 PolarHBondContact O-N 3.37Å; L652-N655 VanDerWaalsContact O-N 3.15Å; L652-L658 HydrophobicContact CB-CD1 4.1Å; L652-L658 HydrophobicContact CD2-CD1 3.64Å; L652-L658 HydrophobicContact CG-CD1 4.48Å; L652-L658 VanDerWaalsContact O-CB 3.32Å; L652-L658 WeakPolarHBondContact O-CB 3.45Å; L652-L662 HydrophobicContact CB-CD1 3.7Å
653	A	90.8	Very high	90.4	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	0.1	178.7	0	0	0	0	0	115	I649 N651 H659 L662 F692	I649-A653 VanDerWaalsContact O-CB 3.28Å; I649-A653 WeakPolarHBondContact O-CB 3.38Å; I649-A653 PolarHBondContact O-N 3.08Å; N651-A653 VanDerWaalsContact C-N 3.35Å; N651-A653 PolarHBondContact O-N 3.18Å; A653-H659 PolarHBondContact O-ND1 3.4Å; A653-L662 HydrophobicContact CB-CD1 4.03Å; A653-F692 HydrophobicContact CB-CD1 3.88Å; A653-F692 HydrophobicContact CB-CD2 3.82Å; A653-F692 HydrophobicContact CB-CE1 3.63Å; A653-F692 HydrophobicContact CB-CE2 3.56Å; A653-F692 HydrophobicContact CB-CG 3.97Å; A653-F692 HydrophobicContact CB-CZ 3.47Å; A653-F692 VanDerWaalsContact CB-CZ 3.47Å
654	A	86.5	Confident	90.4	Very high	16 Å²	16	31.6 Å²	31.6	13%	0.132	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-5.9	169.8	0	0	0	0	0	113.4	N651 L652 N691	N651-A654 WeakPolarHBondContact O-CB 3.27Å; N651-A654 PolarHBondContact O-N 2.94Å; L652-A654 PolarHBondContact O-N 3Å; L652-A654 VanDerWaalsContact O-N 3.13Å; A654-N691 HydrophobicContact CB-CB 4.2Å
655	N	83.8	Confident	90.4	Very high	12 Å²	12	31.6 Å²	31.6	6%	0.064	17%	0.171	C	C	.	.	S	Bend	trans	-99.3	136.5	168.6	167.5	-81.6	0	0	0	109.6	N608 I616 L652 D657 L658 H659	N608-N655 PolarHBondContact O-ND2 3.41Å; I616-N655 WeakPolarHBondContact CD1-ND2 3.31Å; L652-N655 PolarHBondContact O-N 3.37Å; L652-N655 VanDerWaalsContact O-N 3.15Å; N655-D657 PolarHBondContact O-N 3.5Å; N655-D657 PolarHBondContact OD1-N 3.44Å; N655-L658 HydrophobicContact CB-CB 4.39Å; N655-L658 HydrophobicContact CB-CD1 4.33Å; N655-L658 PolarHBondContact O-N 2.85Å; N655-L658 PolarHBondContact OD1-N 2.76Å; N655-L658 VanDerWaalsContact OD1-N 3.09Å; N655-H659 VanDerWaalsContact O-CB 3.23Å; N655-H659 WeakPolarHBondContact O-CB 3.45Å; N655-H659 PolarHBondContact O-N 2.92Å
656	N	83.1	Confident	90.3	Very high	111 Å²	111	31.6 Å²	31.6	59%	0.594	17%	0.171	S	C	*	.	H	α-helix	trans	-59.6	-45.7	-174.2	-68.4	-6.1	0	0	0	113.9	L658 H659 S660 I695	N656-L658 PolarHBondContact O-N 3.26Å; N656-H659 WeakPolarHBondContact O-CB 3.22Å; N656-H659 PolarHBondContact O-N 2.86Å; N656-S660 PolarHBondContact O-N 3.41Å; N656-S660 VanDerWaalsContact O-N 3.16Å; N656-I695 WeakPolarHBondContact OD1-CD1 3.43Å; N656-I695 WeakPolarHBondContact OD1-CG1 3.33Å
657	D	82.9	Confident	90.3	Very high	91 Å²	91	38.7 Å²	38.7	49%	0.487	20%	0.198	S	C	.	.	H	α-helix	trans	-66.5	-41.8	-175.7	-58.2	-37.4	0	0	0	111	N655 S660	N655-D657 PolarHBondContact O-N 3.5Å; N655-D657 PolarHBondContact OD1-N 3.44Å; D657-S660 PolarHBondContact O-OG 3.07Å
658	L	88.1	Confident	90.3	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.031	20%	0.195	C	C	.	.	H	α-helix	trans	-73	-34.8	175.9	-64.7	179.7	0	0	0	112.4	I616 L625 L652 N655 N656 S660 K661 L662	I616-L658 HydrophobicContact CG2-CD1 4.08Å; I616-L658 HydrophobicContact CG2-CD2 4.35Å; I616-L658 HydrophobicContact CG2-CG 4.03Å; L625-L658 HydrophobicContact CD1-CD2 4.48Å; L625-L658 HydrophobicContact CD2-CD2 4.2Å; L652-L658 HydrophobicContact CB-CD1 4.1Å; L652-L658 HydrophobicContact CD2-CD1 3.64Å; L652-L658 HydrophobicContact CG-CD1 4.48Å; L652-L658 VanDerWaalsContact O-CB 3.32Å; L652-L658 WeakPolarHBondContact O-CB 3.45Å; N655-L658 HydrophobicContact CB-CB 4.39Å; N655-L658 HydrophobicContact CB-CD1 4.33Å; N655-L658 PolarHBondContact O-N 2.85Å; N655-L658 PolarHBondContact OD1-N 2.76Å; N655-L658 VanDerWaalsContact OD1-N 3.09Å; N656-L658 PolarHBondContact O-N 3.26Å; L658-S660 VanDerWaalsContact C-N 3.34Å; L658-S660 PolarHBondContact O-N 2.94Å; L658-K661 PolarHBondContact O-N 2.87Å; L658-L662 WeakPolarHBondContact O-CB 3.44Å; L658-L662 WeakPolarHBondContact O-CG 3.35Å; L658-L662 PolarHBondContact O-N 3.03Å
659	H	90	Very high	90.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-56.2	-48.8	174.7	-173.2	103.6	0	0	0	111	A653 N655 N656 K661 L662 V663 F692 I695 E700	A653-H659 PolarHBondContact O-ND1 3.4Å; N655-H659 VanDerWaalsContact O-CB 3.23Å; N655-H659 WeakPolarHBondContact O-CB 3.45Å; N655-H659 PolarHBondContact O-N 2.92Å; N656-H659 WeakPolarHBondContact O-CB 3.22Å; N656-H659 PolarHBondContact O-N 2.86Å; H659-K661 PolarHBondContact O-N 3.33Å; H659-K661 VanDerWaalsContact O-N 3.12Å; H659-L662 PolarHBondContact O-N 3.4Å; H659-L662 VanDerWaalsContact O-N 3.08Å; H659-V663 WeakPolarHBondContact O-CB 3.34Å; H659-V663 PolarHBondContact O-N 3.18Å; H659-F692 AromaticContact CE1-CD1 3.62Å; H659-F692 PolarHBondContact CE1-O 2.71Å; H659-F692 AromaticContact ND1-CD1 3.99Å; H659-I695 HydrophobicContact CB-CD1 4.03Å; H659-I695 PolarHBondContact CE1-O 3.13Å; H659-I695 VanDerWaalsContact CE1-O 3.28Å; H659-I695 PolarHBondContact NE2-O 2.7Å; H659-E700 IonicContact CD2-OE1 3.86Å; H659-E700 IonicContact NE2-OE1 2.65Å; H659-E700 IonicContact NE2-OE2 3.79Å
660	S	87.9	Confident	90.4	Very high	72 Å²	72	37.8 Å²	37.8	50%	0.503	20%	0.195	S	C	.	.	H	α-helix	trans	-55.5	-32.5	-179.8	76.5	0	0	0	0	113.5	N656 D657 L658	N656-S660 PolarHBondContact O-N 3.41Å; N656-S660 VanDerWaalsContact O-N 3.16Å; D657-S660 PolarHBondContact O-OG 3.07Å; L658-S660 VanDerWaalsContact C-N 3.34Å; L658-S660 PolarHBondContact O-N 2.94Å
661	K	89.4	Confident	90.5	Very high	101 Å²	101	40.3 Å²	40.3	44%	0.439	21%	0.213	S	C	.	.	H	α-helix	trans	-83.5	-38.2	178	-59.7	178	-174.1	178.3	0	112.2	C620 L625 L658 H659 V664	C620-K661 PolarHBondContact SG-NZ 2.88Å; L625-K661 HydrophobicContact CD2-CB 3.85Å; L625-K661 HydrophobicContact CD2-CD 3.39Å; L625-K661 HydrophobicContact CD2-CG 4.26Å; L658-K661 PolarHBondContact O-N 2.87Å; H659-K661 PolarHBondContact O-N 3.33Å; H659-K661 VanDerWaalsContact O-N 3.12Å; K661-V664 WeakPolarHBondContact O-CG2 3.33Å
662	L	92.6	Very high	90.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-81	-26.7	-176	-72.7	170.4	0	0	0	113.9	L625 I649 L652 A653 L658 H659 V664 H665 F692	L625-L662 HydrophobicContact CD1-CD1 4.26Å; L625-L662 HydrophobicContact CD1-CD2 3.69Å; L625-L662 HydrophobicContact CD1-CG 3.94Å; I649-L662 HydrophobicContact CG2-CD1 4.23Å; I649-L662 HydrophobicContact CG2-CD2 4.09Å; L652-L662 HydrophobicContact CB-CD1 3.7Å; A653-L662 HydrophobicContact CB-CD1 4.03Å; L658-L662 WeakPolarHBondContact O-CB 3.44Å; L658-L662 WeakPolarHBondContact O-CG 3.35Å; L658-L662 PolarHBondContact O-N 3.03Å; H659-L662 PolarHBondContact O-N 3.4Å; H659-L662 VanDerWaalsContact O-N 3.08Å; L662-V664 PolarHBondContact O-N 3.17Å; L662-V664 VanDerWaalsContact O-N 3.13Å; L662-H665 WeakPolarHBondContact O-CB 3.4Å; L662-H665 PolarHBondContact O-N 3.29Å; L662-F692 HydrophobicContact CB-CE1 3.96Å; L662-F692 HydrophobicContact CB-CZ 3.95Å
663	V	92.4	Very high	90.8	Very high	20 Å²	20	39 Å²	39	12%	0.121	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-65.9	-17.3	-173.4	75.6	0	0	0	0	113.8	H659 H665 L666 F692 E700	H659-V663 WeakPolarHBondContact O-CB 3.34Å; H659-V663 PolarHBondContact O-N 3.18Å; V663-H665 PolarHBondContact O-N 3.4Å; V663-H665 VanDerWaalsContact O-N 3.11Å; V663-L666 HydrophobicContact CG2-CB 4.12Å; V663-L666 HydrophobicContact CG2-CD2 4.03Å; V663-L666 WeakPolarHBondContact O-CB 3.5Å; V663-L666 PolarHBondContact O-N 2.97Å; V663-F692 HydrophobicContact CB-CE1 4.46Å; V663-F692 HydrophobicContact CG2-CD1 4.46Å; V663-E700 HydrophobicContact CG1-CG 4.25Å; V663-E700 HydrophobicContact CG2-CG 3.71Å
664	V	92.4	Very high	90.8	Very high	106 Å²	106	44.3 Å²	44.3	64%	0.642	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-57.5	-25.2	169.5	-53.6	0	0	0	0	112.4	K661 L662	K661-V664 WeakPolarHBondContact O-CG2 3.33Å; L662-V664 PolarHBondContact O-N 3.17Å; L662-V664 VanDerWaalsContact O-N 3.13Å
665	H	94	Very high	90.8	Very high	20 Å²	20	46 Å²	46	9%	0.093	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-90.4	2.5	175.9	-56.9	-76.2	0	0	0	114.2	T629 L632 N633 L662 V663 R667 K668 L669	T629-H665 WeakPolarHBondContact CG2-NE2 3.24Å; L632-H665 HydrophobicContact CD2-CB 3.42Å; L632-H665 VanDerWaalsContact CD2-CB 3.42Å; L632-H665 HydrophobicContact CG-CB 4.18Å; N633-H665 PolarHBondContact OD1-CE1 3.35Å; N633-H665 PolarHBondContact OD1-ND1 3.31Å; L662-H665 WeakPolarHBondContact O-CB 3.4Å; L662-H665 PolarHBondContact O-N 3.29Å; V663-H665 PolarHBondContact O-N 3.4Å; V663-H665 VanDerWaalsContact O-N 3.11Å; H665-R667 PolarHBondContact O-N 3.21Å; H665-K668 HydrophobicContact CB-CB 4.4Å; H665-K668 WeakPolarHBondContact O-CA 3.48Å; H665-K668 VanDerWaalsContact O-CB 3.24Å; H665-K668 WeakPolarHBondContact O-CB 3.31Å; H665-K668 PolarHBondContact O-N 3.44Å; H665-L669 PolarHBondContact O-N 3.23Å
666	L	93.7	Very high	90.7	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-55.2	-37.6	179.5	-179.3	61.3	0	0	0	112.1	V663 K668 L669 I670 L689 V703 Y704	V663-L666 HydrophobicContact CG2-CB 4.12Å; V663-L666 HydrophobicContact CG2-CD2 4.03Å; V663-L666 WeakPolarHBondContact O-CB 3.5Å; V663-L666 PolarHBondContact O-N 2.97Å; L666-K668 PolarHBondContact O-N 3.37Å; L666-L669 PolarHBondContact O-N 3.13Å; L666-I670 HydrophobicContact CG-CD1 4.14Å; L666-I670 VanDerWaalsContact O-CG1 3.29Å; L666-I670 WeakPolarHBondContact O-CG1 3.33Å; L666-I670 PolarHBondContact O-N 2.9Å; L666-L689 HydrophobicContact CD1-CD2 3.42Å; L666-L689 VanDerWaalsContact CD1-CD2 3.42Å; L666-V703 HydrophobicContact CB-CG1 4.11Å; L666-V703 HydrophobicContact CD2-CB 4Å; L666-V703 HydrophobicContact CD2-CG1 3.63Å; L666-V703 HydrophobicContact CG-CG1 3.73Å; L666-Y704 HydrophobicContact CD1-CD1 4.42Å; L666-Y704 HydrophobicContact CD1-CE1 3.85Å; L666-Y704 HydrophobicContact CD2-CD1 3.77Å; L666-Y704 HydrophobicContact CD2-CD2 4.14Å; L666-Y704 HydrophobicContact CD2-CE1 3.5Å; L666-Y704 HydrophobicContact CD2-CE2 3.92Å; L666-Y704 HydrophobicContact CD2-CG 4.09Å; L666-Y704 HydrophobicContact CG-CE1 4.32Å
667	R	94.3	Very high	90.4	Very high	149 Å²	149	59.1 Å²	59.1	56%	0.562	29%	0.287	S	S	*	.	H	α-helix	trans	-63.7	-34.9	171.9	-76.1	-171	172	132.6	0.4	113.8	H665 S671 V703 E706	H665-R667 PolarHBondContact O-N 3.21Å; R667-S671 PolarHBondContact O-N 3.28Å; R667-V703 HydrophobicContact CG-CG1 3.63Å; R667-E706 IonicContact CZ-OE1 2.7Å; R667-E706 IonicContact NE-OE1 2.89Å; R667-E706 PolarHBondContact NE-OE1 2.92Å; R667-E706 IonicContact NE-OE2 3.2Å; R667-E706 PolarHBondContact NE-OE2 3.4Å; R667-E706 IonicContact NH2-OE1 3.34Å; R667-E706 PolarHBondContact NH2-OE1 3.28Å
668	K	94.2	Very high	90.3	Very high	54 Å²	54	58.6 Å²	58.6	24%	0.235	28%	0.281	C	S	.	.	H	α-helix	trans	-64.4	-45.7	173.1	-176.9	79.8	-177.7	-163.7	0	109.6	L632 N633 L635 H665 L666 I670 S671 L672	L632-K668 HydrophobicContact CD1-CG 4.27Å; L632-K668 WeakPolarHBondContact O-CE 3.39Å; N633-K668 PolarHBondContact O-NZ 3.15Å; L635-K668 WeakPolarHBondContact O-CE 3.4Å; L635-K668 PolarHBondContact O-NZ 2.97Å; H665-K668 HydrophobicContact CB-CB 4.4Å; H665-K668 WeakPolarHBondContact O-CA 3.48Å; H665-K668 VanDerWaalsContact O-CB 3.24Å; H665-K668 WeakPolarHBondContact O-CB 3.31Å; H665-K668 PolarHBondContact O-N 3.44Å; L666-K668 PolarHBondContact O-N 3.37Å; K668-I670 PolarHBondContact O-N 3.45Å; K668-S671 WeakPolarHBondContact O-CA 3.45Å; K668-S671 WeakPolarHBondContact O-CB 3.23Å; K668-S671 PolarHBondContact O-N 2.95Å; K668-S671 PolarHBondContact O-OG 2.98Å; K668-L672 PolarHBondContact O-N 3.22Å; K668-L672 VanDerWaalsContact O-N 3.15Å
669	L	95	Very high	90.1	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-60.5	-45.9	176	-59.4	179.9	0	0	0	112.1	L632 L646 H665 L666 S671 L672 L673 T685 L689 F692	L632-L669 HydrophobicContact CD1-CD2 4.04Å; L646-L669 HydrophobicContact CD2-CD2 3.45Å; L646-L669 VanDerWaalsContact CD2-CD2 3.45Å; H665-L669 PolarHBondContact O-N 3.23Å; L666-L669 PolarHBondContact O-N 3.13Å; L669-S671 PolarHBondContact O-N 3.06Å; L669-L672 HydrophobicContact CD2-CD1 4.44Å; L669-L672 PolarHBondContact O-N 3.25Å; L669-L673 PolarHBondContact O-N 3.01Å; L669-T685 HydrophobicContact CB-CG2 4.13Å; L669-T685 WeakPolarHBondContact O-CG2 3.45Å; L669-L689 HydrophobicContact CB-CD2 4.04Å; L669-L689 HydrophobicContact CB-CG 4.38Å; L669-L689 HydrophobicContact CD1-CD2 4.02Å; L669-L689 HydrophobicContact CD1-CG 4.49Å; L669-F692 HydrophobicContact CD1-CD2 3.77Å; L669-F692 HydrophobicContact CD1-CE2 3.38Å; L669-F692 HydrophobicContact CD1-CZ 3.86Å
670	I	94.3	Very high	90	Very high	2 Å²	2	68.9 Å²	68.9	1%	0.01	34%	0.335	C	S	.	.	H	α-helix	trans	-57.8	-33.4	173.6	-66.3	162.5	0	0	0	111.6	L666 K668 V703 E706 L707	L666-I670 HydrophobicContact CG-CD1 4.14Å; L666-I670 VanDerWaalsContact O-CG1 3.29Å; L666-I670 WeakPolarHBondContact O-CG1 3.33Å; L666-I670 PolarHBondContact O-N 2.9Å; K668-I670 PolarHBondContact O-N 3.45Å; I670-V703 HydrophobicContact CD1-CG1 3.74Å; I670-V703 WeakPolarHBondContact CD1-O 3.47Å; I670-E706 HydrophobicContact CD1-CB 4.27Å; I670-L707 HydrophobicContact CD1-CB 3.86Å; I670-L707 HydrophobicContact CG1-CB 3.88Å; I670-L707 HydrophobicContact CG1-CD1 3.93Å; I670-L707 HydrophobicContact CG1-CG 4.38Å
671	S	94	Very high	90.2	Very high	54 Å²	54	65.9 Å²	65.9	38%	0.378	31%	0.313	S	S	.	.	H	α-helix	trans	-70.9	-31.4	175.6	82	0	0	0	0	113.7	R667 K668 L669 K674	R667-S671 PolarHBondContact O-N 3.28Å; K668-S671 WeakPolarHBondContact O-CA 3.45Å; K668-S671 WeakPolarHBondContact O-CB 3.23Å; K668-S671 PolarHBondContact O-N 2.95Å; K668-S671 PolarHBondContact O-OG 2.98Å; L669-S671 PolarHBondContact O-N 3.06Å; S671-K674 WeakPolarHBondContact O-CB 3.5Å; S671-K674 PolarHBondContact O-N 3.4Å
672	L	93.9	Very high	90.4	Very high	3 Å²	3	63 Å²	63	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-69.9	-33.2	177.9	-61.7	177.6	0	0	0	112	L635 P636 L646 K668 L669 K674 L675 L681 T685	L635-L672 HydrophobicContact CB-CD1 4.16Å; L635-L672 HydrophobicContact CB-CD2 4.19Å; L635-L672 HydrophobicContact CD1-CD1 3.99Å; P636-L672 HydrophobicContact CB-CD2 4.46Å; L646-L672 HydrophobicContact CD1-CD1 4.27Å; L646-L672 HydrophobicContact CD2-CD1 4.22Å; K668-L672 PolarHBondContact O-N 3.22Å; K668-L672 VanDerWaalsContact O-N 3.15Å; L669-L672 HydrophobicContact CD2-CD1 4.44Å; L669-L672 PolarHBondContact O-N 3.25Å; L672-K674 PolarHBondContact O-N 3.2Å; L672-K674 VanDerWaalsContact O-N 3.16Å; L672-L675 HydrophobicContact CB-CD1 4.34Å; L672-L675 HydrophobicContact CD2-CD1 3.88Å; L672-L675 WeakPolarHBondContact O-CB 3.2Å; L672-L675 WeakPolarHBondContact O-CD1 3.39Å; L672-L675 VanDerWaalsContact O-CG 3.3Å; L672-L675 WeakPolarHBondContact O-CG 3.18Å; L672-L675 PolarHBondContact O-N 2.96Å; L672-L675 VanDerWaalsContact O-N 3.16Å; L672-L681 HydrophobicContact CD2-CD2 4.19Å; L672-T685 HydrophobicContact CB-CG2 4.16Å
673	L	93.1	Very high	90.3	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.6	173.6	-62.3	-174.6	0	0	0	113.5	L669 L675 K682 T685 L686 L689 L707 E710	L669-L673 PolarHBondContact O-N 3.01Å; L673-L675 VanDerWaalsContact C-N 3.32Å; L673-K682 VanDerWaalsContact O-CE 3.23Å; L673-K682 WeakPolarHBondContact O-CE 3.49Å; L673-K682 PolarHBondContact O-NZ 2.83Å; L673-T685 HydrophobicContact CD2-CG2 3.6Å; L673-T685 HydrophobicContact CG-CG2 3.95Å; L673-L686 HydrophobicContact CD1-CD2 3.97Å; L673-L686 HydrophobicContact CD2-CD2 3.62Å; L673-L686 HydrophobicContact CD2-CG 3.71Å; L673-L686 HydrophobicContact CG-CD2 4.47Å; L673-L689 HydrophobicContact CD1-CD1 3.76Å; L673-L689 HydrophobicContact CD2-CD1 4.46Å; L673-L689 HydrophobicContact CG-CD1 4.25Å; L673-L707 HydrophobicContact CD1-CD1 3.49Å; L673-L707 VanDerWaalsContact CD1-CD1 3.49Å; L673-E710 HydrophobicContact CB-CB 4.28Å; L673-E710 HydrophobicContact CD1-CB 4.18Å
674	K	91.1	Very high	90.4	Very high	112 Å²	112	64.2 Å²	64.2	49%	0.487	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-9	-178.8	-62	173.9	-175.7	178.5	0	113.3	S671 L672 E710	S671-K674 WeakPolarHBondContact O-CB 3.5Å; S671-K674 PolarHBondContact O-N 3.4Å; L672-K674 PolarHBondContact O-N 3.2Å; L672-K674 VanDerWaalsContact O-N 3.16Å; K674-E710 WeakPolarHBondContact CE-OE1 3.44Å; K674-E710 HydrophobicContact CG-CG 4.04Å
675	L	87.6	Confident	90.6	Very high	51 Å²	51	59.2 Å²	59.2	27%	0.267	28%	0.275	S	S	.	.			trans	-63.7	145	173.6	-62.3	170.3	0	0	0	110.4	P636 L672 L673 E678 L681 K682	P636-L675 HydrophobicContact CB-CD1 4.09Å; P636-L675 HydrophobicContact CG-CD1 4.22Å; L672-L675 HydrophobicContact CB-CD1 4.34Å; L672-L675 HydrophobicContact CD2-CD1 3.88Å; L672-L675 WeakPolarHBondContact O-CB 3.2Å; L672-L675 WeakPolarHBondContact O-CD1 3.39Å; L672-L675 VanDerWaalsContact O-CG 3.3Å; L672-L675 WeakPolarHBondContact O-CG 3.18Å; L672-L675 PolarHBondContact O-N 2.96Å; L672-L675 VanDerWaalsContact O-N 3.16Å; L673-L675 VanDerWaalsContact C-N 3.32Å; L675-E678 WeakPolarHBondContact CD1-OE2 3.39Å; L675-L681 HydrophobicContact CD1-CD2 4.04Å; L675-K682 WeakPolarHBondContact O-CE 3.37Å; L675-K682 PolarHBondContact O-NZ 3.45Å
676	K	80.3	Confident	90.6	Very high	205 Å²	205	58.2 Å²	58.2	89%	0.891	27%	0.271	S	S	*	.	S	Bend	trans	-98.4	-11	-173.1	-72.4	-167	176.7	-173.7	0	116.1
677	K	77.7	Confident	90.6	Very high	194 Å²	194	58.7 Å²	58.7	84%	0.843	28%	0.275	S	S	*	.	S	Bend	trans	-133.6	-1.3	-167	-69.2	-170.4	173.3	-173.3	0	116.3
678	E	79.8	Confident	90.6	Very high	79 Å²	79	51.6 Å²	51.6	37%	0.369	25%	0.248	S	C	.	.			trans	-111.9	69.5	-171	-63.3	-174.8	165.9	0	0	111.7	P636 L675 Q680 L681 K682	P636-E678 WeakPolarHBondContact CB-OE2 3.39Å; L675-E678 WeakPolarHBondContact CD1-OE2 3.39Å; E678-Q680 VanDerWaalsContact C-N 3.33Å; E678-Q680 PolarHBondContact O-N 3.09Å; E678-L681 HydrophobicContact CB-CB 3.91Å; E678-L681 PolarHBondContact O-N 3.22Å; E678-L681 VanDerWaalsContact OE2-CD2 3.25Å; E678-L681 WeakPolarHBondContact OE2-CD2 3.41Å; E678-K682 PolarHBondContact O-N 3.17Å
679	T	83.7	Confident	90.8	Very high	79 Å²	79	49 Å²	49	49%	0.485	24%	0.237	S	C	.	.	H	α-helix	trans	-53.6	-44.9	-175.3	-45.8	0	0	0	0	112.9	L681 K682 L683 D720	T679-L681 PolarHBondContact O-N 3.15Å; T679-K682 WeakPolarHBondContact O-CB 3.01Å; T679-K682 PolarHBondContact O-N 3.28Å; T679-L683 WeakPolarHBondContact O-CB 3.47Å; T679-L683 PolarHBondContact O-N 3.39Å; T679-D720 WeakPolarHBondContact CG2-OD2 3.02Å
680	Q	89	Confident	90.7	Very high	144 Å²	144	49.9 Å²	49.9	67%	0.673	24%	0.242	S	C	*	.	H	α-helix	trans	-65.5	-37.7	176.9	-72.4	-174.7	-15	0	0	113.1	P643 E678 L683 A684	P643-Q680 HydrophobicContact CG-CB 4.36Å; E678-Q680 VanDerWaalsContact C-N 3.33Å; E678-Q680 PolarHBondContact O-N 3.09Å; Q680-L683 PolarHBondContact O-N 3.06Å; Q680-A684 WeakPolarHBondContact O-CB 3.41Å; Q680-A684 PolarHBondContact O-N 3.32Å
681	L	92	Very high	90.6	Very high	9 Å²	9	50.6 Å²	50.6	5%	0.047	25%	0.246	C	C	.	.	H	α-helix	trans	-70.9	-37	177.5	-162.7	75.4	0	0	0	110.9	L635 P636 P643 L646 L672 L675 E678 T679 T685	L635-L681 HydrophobicContact CD2-CD1 3.93Å; L635-L681 HydrophobicContact CD2-CD2 4.34Å; P636-L681 HydrophobicContact CB-CD2 3.69Å; P643-L681 HydrophobicContact CG-CD1 4.17Å; L646-L681 HydrophobicContact CD1-CD1 3.53Å; L646-L681 HydrophobicContact CD1-CG 3.93Å; L672-L681 HydrophobicContact CD2-CD2 4.19Å; L675-L681 HydrophobicContact CD1-CD2 4.04Å; E678-L681 HydrophobicContact CB-CB 3.91Å; E678-L681 PolarHBondContact O-N 3.22Å; E678-L681 VanDerWaalsContact OE2-CD2 3.25Å; E678-L681 WeakPolarHBondContact OE2-CD2 3.41Å; T679-L681 PolarHBondContact O-N 3.15Å; L681-T685 VanDerWaalsContact O-CB 3.31Å; L681-T685 WeakPolarHBondContact O-CB 3.14Å; L681-T685 PolarHBondContact O-N 3.39Å; L681-T685 PolarHBondContact O-OG1 2.89Å
682	K	92.2	Very high	90.7	Very high	41 Å²	41	48 Å²	48	18%	0.178	23%	0.228	C	C	.	.	H	α-helix	trans	-59.9	-49	169.6	-74.2	-160.8	-178.3	-145.9	0	112.2	L673 L675 E678 T679 A684 T685 L686	L673-K682 VanDerWaalsContact O-CE 3.23Å; L673-K682 WeakPolarHBondContact O-CE 3.49Å; L673-K682 PolarHBondContact O-NZ 2.83Å; L675-K682 WeakPolarHBondContact O-CE 3.37Å; L675-K682 PolarHBondContact O-NZ 3.45Å; E678-K682 PolarHBondContact O-N 3.17Å; T679-K682 WeakPolarHBondContact O-CB 3.01Å; T679-K682 PolarHBondContact O-N 3.28Å; K682-A684 VanDerWaalsContact C-N 3.33Å; K682-A684 PolarHBondContact O-N 2.99Å; K682-T685 CarbonylContact O-C 3.5Å; K682-T685 WeakPolarHBondContact O-CA 3.5Å; K682-T685 WeakPolarHBondContact O-CB 3.33Å; K682-T685 PolarHBondContact O-N 2.83Å; K682-T685 VanDerWaalsContact O-N 3.09Å; K682-L686 WeakPolarHBondContact O-CG 3.29Å; K682-L686 PolarHBondContact O-N 3.37Å
683	L	92.1	Very high	90.7	Very high	45 Å²	45	48 Å²	48	24%	0.236	23%	0.228	C	C	.	.	H	α-helix	trans	-61.3	-43.7	-177.6	-167.7	72.3	0	0	0	110.9	T679 Q680 L686 A687 G722 Q723 Y726	T679-L683 WeakPolarHBondContact O-CB 3.47Å; T679-L683 PolarHBondContact O-N 3.39Å; Q680-L683 PolarHBondContact O-N 3.06Å; L683-L686 PolarHBondContact O-N 3.21Å; L683-A687 WeakPolarHBondContact O-CB 3.38Å; L683-A687 PolarHBondContact O-N 3.46Å; L683-G722 VanDerWaalsContact CD1-C 3.41Å; L683-Q723 HydrophobicContact CD1-CG 4.38Å; L683-Y726 HydrophobicContact CD1-CD2 3.72Å; L683-Y726 HydrophobicContact CD1-CE2 3.76Å; L683-Y726 HydrophobicContact CG-CD2 4.3Å; L683-Y726 HydrophobicContact CG-CE2 3.96Å
684	A	93.7	Very high	90.6	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67	-34.8	172.8	0	0	0	0	0	113.1	P643 L646 Y647 Q680 K682 A687 A688	P643-A684 HydrophobicContact CB-CB 3.9Å; L646-A684 HydrophobicContact CB-CB 3.95Å; L646-A684 HydrophobicContact CD1-CB 4.07Å; Y647-A684 HydrophobicContact CD2-CB 4.29Å; Y647-A684 HydrophobicContact CE1-CB 4.24Å; Y647-A684 HydrophobicContact CE2-CB 3.8Å; Q680-A684 WeakPolarHBondContact O-CB 3.41Å; Q680-A684 PolarHBondContact O-N 3.32Å; K682-A684 VanDerWaalsContact C-N 3.33Å; K682-A684 PolarHBondContact O-N 2.99Å; A684-A687 PolarHBondContact O-N 3.36Å; A684-A688 WeakPolarHBondContact O-CB 3.34Å; A684-A688 PolarHBondContact O-N 3.43Å
685	T	95.9	Very high	90.4	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-64.7	-44.6	174	-58	0	0	0	0	111	L646 L669 L672 L673 L681 K682 A688 L689	L646-T685 WeakPolarHBondContact CD1-OG1 3.42Å; L669-T685 HydrophobicContact CB-CG2 4.13Å; L669-T685 WeakPolarHBondContact O-CG2 3.45Å; L672-T685 HydrophobicContact CB-CG2 4.16Å; L673-T685 HydrophobicContact CD2-CG2 3.6Å; L673-T685 HydrophobicContact CG-CG2 3.95Å; L681-T685 VanDerWaalsContact O-CB 3.31Å; L681-T685 WeakPolarHBondContact O-CB 3.14Å; L681-T685 PolarHBondContact O-N 3.39Å; L681-T685 PolarHBondContact O-OG1 2.89Å; K682-T685 CarbonylContact O-C 3.5Å; K682-T685 WeakPolarHBondContact O-CA 3.5Å; K682-T685 WeakPolarHBondContact O-CB 3.33Å; K682-T685 PolarHBondContact O-N 2.83Å; K682-T685 VanDerWaalsContact O-N 3.09Å; T685-A688 PolarHBondContact O-N 3.37Å; T685-L689 HydrophobicContact CG2-CD1 3.98Å; T685-L689 WeakPolarHBondContact O-CB 3.09Å; T685-L689 VanDerWaalsContact O-CG 3.24Å; T685-L689 WeakPolarHBondContact O-CG 3.37Å; T685-L689 PolarHBondContact O-N 3.29Å
686	L	95.6	Very high	90.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.1	-43.6	176.1	-68.3	171.7	0	0	0	111.2	L673 K682 L683 A688 L689 V690 L711 C714 Q723 Y726 I730	L673-L686 HydrophobicContact CD1-CD2 3.97Å; L673-L686 HydrophobicContact CD2-CD2 3.62Å; L673-L686 HydrophobicContact CD2-CG 3.71Å; L673-L686 HydrophobicContact CG-CD2 4.47Å; K682-L686 WeakPolarHBondContact O-CG 3.29Å; K682-L686 PolarHBondContact O-N 3.37Å; L683-L686 PolarHBondContact O-N 3.21Å; L686-A688 VanDerWaalsContact C-N 3.3Å; L686-A688 PolarHBondContact O-N 3.02Å; L686-L689 CarbonylContact O-C 3.34Å; L686-L689 PolarHBondContact O-N 3.31Å; L686-L689 VanDerWaalsContact O-N 3.1Å; L686-V690 WeakPolarHBondContact O-CG2 3.25Å; L686-V690 PolarHBondContact O-N 2.92Å; L686-L711 HydrophobicContact CD2-CD2 4.03Å; L686-C714 HydrophobicContact CD1-CB 4.22Å; L686-Q723 HydrophobicContact CD1-CB 3.93Å; L686-Q723 HydrophobicContact CD1-CG 3.81Å; L686-Y726 HydrophobicContact CB-CD2 4.2Å; L686-Y726 HydrophobicContact CB-CG 4.3Å; L686-I730 HydrophobicContact CB-CD1 4.3Å; L686-I730 HydrophobicContact CD2-CD1 3.74Å
687	A	93.4	Very high	91.1	Very high	12 Å²	12	43.6 Å²	43.6	10%	0.099	21%	0.208	C	C	.	.	H	α-helix	trans	-58.7	-40.4	174.7	0	0	0	0	0	112.4	Y647 L683 A684 Y726	Y647-A687 HydrophobicContact CD1-CB 4.08Å; Y647-A687 HydrophobicContact CE1-CB 3.58Å; L683-A687 WeakPolarHBondContact O-CB 3.38Å; L683-A687 PolarHBondContact O-N 3.46Å; A684-A687 PolarHBondContact O-N 3.36Å; A687-Y726 HydrophobicContact CB-CD2 4.32Å; A687-Y726 HydrophobicContact CB-CE1 4.25Å; A687-Y726 HydrophobicContact CB-CE2 3.83Å
688	A	95	Very high	91.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-47.2	171.9	0	0	0	0	0	111.6	L646 A684 T685 L686 V690 N691 F692	L646-A688 WeakPolarHBondContact O-CB 3.38Å; A684-A688 WeakPolarHBondContact O-CB 3.34Å; A684-A688 PolarHBondContact O-N 3.43Å; T685-A688 PolarHBondContact O-N 3.37Å; L686-A688 VanDerWaalsContact C-N 3.3Å; L686-A688 PolarHBondContact O-N 3.02Å; A688-V690 VanDerWaalsContact C-N 3.27Å; A688-V690 PolarHBondContact O-N 3.01Å; A688-N691 PolarHBondContact O-N 2.74Å; A688-F692 WeakPolarHBondContact O-CD2 3.39Å; A688-F692 PolarHBondContact O-N 3.5Å
689	L	96.4	Very high	92.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.6	-26.2	179.7	-73.1	169.2	0	0	0	113.9	L666 L669 L673 T685 L686 N691 T693 L707 I730	L666-L689 HydrophobicContact CD1-CD2 3.42Å; L666-L689 VanDerWaalsContact CD1-CD2 3.42Å; L669-L689 HydrophobicContact CB-CD2 4.04Å; L669-L689 HydrophobicContact CB-CG 4.38Å; L669-L689 HydrophobicContact CD1-CD2 4.02Å; L669-L689 HydrophobicContact CD1-CG 4.49Å; L673-L689 HydrophobicContact CD1-CD1 3.76Å; L673-L689 HydrophobicContact CD2-CD1 4.46Å; L673-L689 HydrophobicContact CG-CD1 4.25Å; T685-L689 HydrophobicContact CG2-CD1 3.98Å; T685-L689 WeakPolarHBondContact O-CB 3.09Å; T685-L689 VanDerWaalsContact O-CG 3.24Å; T685-L689 WeakPolarHBondContact O-CG 3.37Å; T685-L689 PolarHBondContact O-N 3.29Å; L686-L689 CarbonylContact O-C 3.34Å; L686-L689 PolarHBondContact O-N 3.31Å; L686-L689 VanDerWaalsContact O-N 3.1Å; L689-N691 VanDerWaalsContact C-N 3.28Å; L689-N691 PolarHBondContact O-N 3.27Å; L689-T693 WeakPolarHBondContact O-CB 3.23Å; L689-T693 PolarHBondContact O-N 3.27Å; L689-T693 PolarHBondContact O-OG1 3.41Å; L689-L707 HydrophobicContact CD1-CD1 3.91Å; L689-L707 HydrophobicContact CD1-CD2 4.43Å; L689-L707 HydrophobicContact CD2-CD2 4.3Å; L689-I730 HydrophobicContact CB-CD1 3.68Å; L689-I730 HydrophobicContact CB-CG1 4.29Å
690	V	93.9	Very high	92.5	Very high	18 Å²	18	36 Å²	36	11%	0.109	18%	0.184	C	C	.	.	H	α-helix	trans	-60.3	-39.7	169.2	167.4	0	0	0	0	111	L686 A688 T693 R694 Y726 A729 I730 N733	L686-V690 WeakPolarHBondContact O-CG2 3.25Å; L686-V690 PolarHBondContact O-N 2.92Å; A688-V690 VanDerWaalsContact C-N 3.27Å; A688-V690 PolarHBondContact O-N 3.01Å; V690-T693 PolarHBondContact O-OG1 3.02Å; V690-R694 WeakPolarHBondContact O-CG 3.44Å; V690-Y726 HydrophobicContact CG2-CD1 3.87Å; V690-Y726 HydrophobicContact CG2-CG 4.36Å; V690-A729 HydrophobicContact CG2-CB 4.04Å; V690-I730 HydrophobicContact CB-CG1 4.41Å; V690-I730 HydrophobicContact CG2-CD1 4.23Å; V690-I730 HydrophobicContact CG2-CG1 3.62Å; V690-N733 PolarHBondContact O-ND2 2.77Å
691	N	92.9	Very high	92.7	Very high	16 Å²	16	29.8 Å²	29.8	9%	0.086	16%	0.155	C	C	.	.	H	α-helix	trans	-79	-40.2	178.1	-75.9	-5.5	0	0	0	112.4	G650 A654 A688 L689 T693 R694	G650-N691 WeakPolarHBondContact O-CB 3.48Å; G650-N691 PolarHBondContact O-ND2 3.21Å; A654-N691 HydrophobicContact CB-CB 4.2Å; A688-N691 PolarHBondContact O-N 2.74Å; L689-N691 VanDerWaalsContact C-N 3.28Å; L689-N691 PolarHBondContact O-N 3.27Å; N691-T693 PolarHBondContact O-N 3.34Å; N691-R694 WeakPolarHBondContact O-CB 3.35Å; N691-R694 PolarHBondContact O-N 3.1Å; N691-R694 PolarHBondContact OD1-NE 3.18Å; N691-R694 VanDerWaalsContact OD1-NE 3.07Å; N691-R694 PolarHBondContact OD1-NH2 3.47Å
692	F	94.5	Very high	92.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-53.5	-53.7	170.1	-82.4	-89.5	0	0	0	110.1	I649 A653 H659 L662 V663 L669 A688 R694 I695 Y704	I649-F692 HydrophobicContact CG2-CE2 4.2Å; I649-F692 HydrophobicContact CG2-CZ 4.15Å; A653-F692 HydrophobicContact CB-CD1 3.88Å; A653-F692 HydrophobicContact CB-CD2 3.82Å; A653-F692 HydrophobicContact CB-CE1 3.63Å; A653-F692 HydrophobicContact CB-CE2 3.56Å; A653-F692 HydrophobicContact CB-CG 3.97Å; A653-F692 HydrophobicContact CB-CZ 3.47Å; A653-F692 VanDerWaalsContact CB-CZ 3.47Å; H659-F692 AromaticContact CE1-CD1 3.62Å; H659-F692 PolarHBondContact CE1-O 2.71Å; H659-F692 AromaticContact ND1-CD1 3.99Å; L662-F692 HydrophobicContact CB-CE1 3.96Å; L662-F692 HydrophobicContact CB-CZ 3.95Å; V663-F692 HydrophobicContact CB-CE1 4.46Å; V663-F692 HydrophobicContact CG2-CD1 4.46Å; L669-F692 HydrophobicContact CD1-CD2 3.77Å; L669-F692 HydrophobicContact CD1-CE2 3.38Å; L669-F692 HydrophobicContact CD1-CZ 3.86Å; A688-F692 WeakPolarHBondContact O-CD2 3.39Å; A688-F692 PolarHBondContact O-N 3.5Å; F692-R694 PolarHBondContact O-N 2.89Å; F692-I695 CarbonylContact O-C 3.43Å; F692-I695 PolarHBondContact O-N 3.41Å; F692-Y704 PolarHBondContact O-OH 3.05Å
693	T	94.4	Very high	92.8	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.018	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-1.9	-177.5	52.5	0	0	0	0	116.2	L689 V690 N691 I695 I696 Y704 I730 N733 L734	L689-T693 WeakPolarHBondContact O-CB 3.23Å; L689-T693 PolarHBondContact O-N 3.27Å; L689-T693 PolarHBondContact O-OG1 3.41Å; V690-T693 PolarHBondContact O-OG1 3.02Å; N691-T693 PolarHBondContact O-N 3.34Å; T693-I695 PolarHBondContact O-N 3.19Å; T693-I696 WeakPolarHBondContact O-CD1 3.35Å; T693-Y704 HydrophobicContact CG2-CD1 3.94Å; T693-Y704 HydrophobicContact CG2-CE1 3.46Å; T693-Y704 VanDerWaalsContact CG2-CE1 3.46Å; T693-I730 HydrophobicContact CG2-CG2 3.74Å; T693-N733 WeakPolarHBondContact O-CB 3.23Å; T693-N733 PolarHBondContact OG1-ND2 2.9Å; T693-L734 HydrophobicContact CG2-CD2 3.83Å; T693-L734 HydrophobicContact CG2-CG 4.16Å
694	R	91	Very high	93	Very high	150 Å²	150	28.7 Å²	28.7	57%	0.566	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-25.8	166.4	-63.9	176.4	-172	-143.2	1.5	112.1	V690 N691 F692	V690-R694 WeakPolarHBondContact O-CG 3.44Å; N691-R694 WeakPolarHBondContact O-CB 3.35Å; N691-R694 PolarHBondContact O-N 3.1Å; N691-R694 PolarHBondContact OD1-NE 3.18Å; N691-R694 VanDerWaalsContact OD1-NE 3.07Å; N691-R694 PolarHBondContact OD1-NH2 3.47Å; F692-R694 PolarHBondContact O-N 2.89Å
695	I	88.2	Confident	93	Very high	24 Å²	24	33.3 Å²	33.3	12%	0.123	18%	0.183	C	C	.	.	S	Bend	trans	-125.1	118.4	-178.3	-58.4	154.1	0	0	0	106.6	N656 H659 F692 T693 Y704	N656-I695 WeakPolarHBondContact OD1-CD1 3.43Å; N656-I695 WeakPolarHBondContact OD1-CG1 3.33Å; H659-I695 HydrophobicContact CB-CD1 4.03Å; H659-I695 PolarHBondContact CE1-O 3.13Å; H659-I695 VanDerWaalsContact CE1-O 3.28Å; H659-I695 PolarHBondContact NE2-O 2.7Å; F692-I695 CarbonylContact O-C 3.43Å; F692-I695 PolarHBondContact O-N 3.41Å; T693-I695 PolarHBondContact O-N 3.19Å; I695-Y704 PolarHBondContact O-OH 3.48Å
696	I	91.2	Very high	92.9	Very high	33 Å²	33	36.9 Å²	36.9	17%	0.169	20%	0.199	C	C	.	.			trans	-134.6	102.1	-177.9	-60.6	168.5	0	0	0	108.1	T693 I701 Y704 L734 V737 L740	T693-I696 WeakPolarHBondContact O-CD1 3.35Å; I696-I701 HydrophobicContact CG2-CG1 4.21Å; I696-Y704 HydrophobicContact CB-CE2 4.17Å; I696-Y704 HydrophobicContact CG1-CD2 4.36Å; I696-Y704 HydrophobicContact CG1-CE2 3.88Å; I696-Y704 HydrophobicContact CG2-CD2 3.74Å; I696-Y704 HydrophobicContact CG2-CE2 3.81Å; I696-L734 HydrophobicContact CD1-CD2 4Å; I696-V737 HydrophobicContact CB-CG2 4.04Å; I696-V737 HydrophobicContact CD1-CG2 3.95Å; I696-V737 HydrophobicContact CG2-CG2 4Å; I696-L740 HydrophobicContact CD1-CD1 4.42Å; I696-L740 HydrophobicContact CG2-CD1 3.89Å
697	N	90	Very high	92.9	Very high	68 Å²	68	36.9 Å²	36.9	36%	0.364	20%	0.199	S	C	.	.			trans	-82.6	153.6	178.2	-57.1	-60.6	0	0	0	110.9	S699 E700	N697-S699 PolarHBondContact O-N 3.03Å; N697-S699 VanDerWaalsContact O-N 3.1Å; N697-E700 HydrophobicContact CB-CG 4.45Å; N697-E700 WeakPolarHBondContact CB-OE1 3.5Å; N697-E700 PolarHBondContact N-OE2 3.28Å; N697-E700 PolarHBondContact ND2-OE1 3.41Å; N697-E700 PolarHBondContact O-N 2.66Å
698	N	88.2	Confident	92.9	Very high	81 Å²	81	36.5 Å²	36.5	43%	0.433	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-29.1	-178.3	-90.2	-67.2	0	0	0	113.4	E700 K739	N698-E700 VanDerWaalsContact C-N 3.35Å; N698-K739 PolarHBondContact OD1-NZ 3.09Å
699	S	91.2	Very high	92.9	Very high	99 Å²	99	39.7 Å²	39.7	69%	0.692	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-31.8	174.7	45.7	0	0	0	0	113.9	N697	N697-S699 PolarHBondContact O-N 3.03Å; N697-S699 VanDerWaalsContact O-N 3.1Å
700	E	92	Very high	92.7	Very high	14 Å²	14	40.7 Å²	40.7	7%	0.065	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-15.1	-170.5	-63.4	147.3	-164.1	0	0	112.9	H659 V663 N697 N698 G702 V703 Y704	H659-E700 IonicContact CD2-OE1 3.86Å; H659-E700 IonicContact NE2-OE1 2.65Å; H659-E700 IonicContact NE2-OE2 3.79Å; V663-E700 HydrophobicContact CG1-CG 4.25Å; V663-E700 HydrophobicContact CG2-CG 3.71Å; N697-E700 HydrophobicContact CB-CG 4.45Å; N697-E700 WeakPolarHBondContact CB-OE1 3.5Å; N697-E700 PolarHBondContact N-OE2 3.28Å; N697-E700 PolarHBondContact ND2-OE1 3.41Å; N697-E700 PolarHBondContact O-N 2.66Å; N698-E700 VanDerWaalsContact C-N 3.35Å; E700-G702 PolarHBondContact O-N 3.17Å; E700-V703 WeakPolarHBondContact O-CA 2.98Å; E700-V703 PolarHBondContact O-N 3.22Å; E700-Y704 HydrophobicContact CB-CD2 3.71Å; E700-Y704 HydrophobicContact CB-CE2 3.58Å; E700-Y704 HydrophobicContact CG-CE2 4.45Å; E700-Y704 WeakPolarHBondContact O-CD2 3.4Å; E700-Y704 PolarHBondContact O-N 3.28Å
701	I	92.8	Very high	92.7	Very high	13 Å²	13	39.8 Å²	39.8	7%	0.067	22%	0.216	C	C	.	.	H	α-helix	trans	-52.8	-31.9	-177.4	-68.4	178.4	0	0	0	112.3	I696 K705 V737 K739 L740	I696-I701 HydrophobicContact CG2-CG1 4.21Å; I701-K705 WeakPolarHBondContact O-CG 3.27Å; I701-K705 PolarHBondContact O-N 3.46Å; I701-V737 HydrophobicContact CD1-CG1 3.81Å; I701-V737 HydrophobicContact CG1-CG1 4.33Å; I701-K739 HydrophobicContact CD1-CB 4.25Å; I701-K739 HydrophobicContact CD1-CD 3.77Å; I701-K739 HydrophobicContact CG2-CB 3.92Å; I701-K739 HydrophobicContact CG2-CD 4.49Å; I701-L740 HydrophobicContact CG1-CD1 4.27Å; I701-L740 HydrophobicContact CG2-CD2 4.41Å; I701-L740 HydrophobicContact CG2-CG 4.18Å
702	G	92.6	Very high	92.7	Very high	46 Å²	46	39.3 Å²	39.3	47%	0.474	21%	0.213	S	C	.	.	H	α-helix	trans	-64.2	-43.1	173.3	0	0	0	0	0	113.1	E700 K705	E700-G702 PolarHBondContact O-N 3.17Å; G702-K705 PolarHBondContact O-N 2.77Å
703	V	93.6	Very high	92.6	Very high	25 Å²	25	44.6 Å²	44.6	15%	0.152	24%	0.236	C	C	.	.	H	α-helix	trans	-75.4	-38.5	-179.9	-174.9	0	0	0	0	111.1	L666 R667 I670 E700 K705 E706 L707	L666-V703 HydrophobicContact CB-CG1 4.11Å; L666-V703 HydrophobicContact CD2-CB 4Å; L666-V703 HydrophobicContact CD2-CG1 3.63Å; L666-V703 HydrophobicContact CG-CG1 3.73Å; R667-V703 HydrophobicContact CG-CG1 3.63Å; I670-V703 HydrophobicContact CD1-CG1 3.74Å; I670-V703 WeakPolarHBondContact CD1-O 3.47Å; E700-V703 WeakPolarHBondContact O-CA 2.98Å; E700-V703 PolarHBondContact O-N 3.22Å; V703-K705 PolarHBondContact O-N 2.98Å; V703-E706 WeakPolarHBondContact O-CA 3.24Å; V703-E706 VanDerWaalsContact O-CB 3.27Å; V703-E706 WeakPolarHBondContact O-CB 3.35Å; V703-E706 PolarHBondContact O-N 2.82Å; V703-L707 PolarHBondContact O-N 3.24Å
704	Y	95.8	Very high	92.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.9	-22.5	174.4	-75.3	-61.9	0	0	0	113.2	L666 F692 T693 I695 I696 E700 L707 L734	L666-Y704 HydrophobicContact CD1-CD1 4.42Å; L666-Y704 HydrophobicContact CD1-CE1 3.85Å; L666-Y704 HydrophobicContact CD2-CD1 3.77Å; L666-Y704 HydrophobicContact CD2-CD2 4.14Å; L666-Y704 HydrophobicContact CD2-CE1 3.5Å; L666-Y704 HydrophobicContact CD2-CE2 3.92Å; L666-Y704 HydrophobicContact CD2-CG 4.09Å; L666-Y704 HydrophobicContact CG-CE1 4.32Å; F692-Y704 PolarHBondContact O-OH 3.05Å; T693-Y704 HydrophobicContact CG2-CD1 3.94Å; T693-Y704 HydrophobicContact CG2-CE1 3.46Å; T693-Y704 VanDerWaalsContact CG2-CE1 3.46Å; I695-Y704 PolarHBondContact O-OH 3.48Å; I696-Y704 HydrophobicContact CB-CE2 4.17Å; I696-Y704 HydrophobicContact CG1-CD2 4.36Å; I696-Y704 HydrophobicContact CG1-CE2 3.88Å; I696-Y704 HydrophobicContact CG2-CD2 3.74Å; I696-Y704 HydrophobicContact CG2-CE2 3.81Å; E700-Y704 HydrophobicContact CB-CD2 3.71Å; E700-Y704 HydrophobicContact CB-CE2 3.58Å; E700-Y704 HydrophobicContact CG-CE2 4.45Å; E700-Y704 WeakPolarHBondContact O-CD2 3.4Å; E700-Y704 PolarHBondContact O-N 3.28Å; Y704-L707 HydrophobicContact CD1-CD2 4.13Å; Y704-L707 WeakPolarHBondContact O-CB 3.33Å; Y704-L707 PolarHBondContact O-N 2.86Å; Y704-L734 HydrophobicContact CD1-CD2 3.83Å; Y704-L734 HydrophobicContact CG-CD2 3.95Å
705	K	94.1	Very high	92.3	Very high	98 Å²	98	37.5 Å²	37.5	43%	0.426	21%	0.21	S	C	.	.	H	α-helix	trans	-70.9	-28.7	168.3	-73.2	175.1	-177.7	-174.8	0	113.4	I701 G702 V703 L707 P709 K739 L740 A743	I701-K705 WeakPolarHBondContact O-CG 3.27Å; I701-K705 PolarHBondContact O-N 3.46Å; G702-K705 PolarHBondContact O-N 2.77Å; V703-K705 PolarHBondContact O-N 2.98Å; K705-L707 PolarHBondContact O-N 2.98Å; K705-P709 WeakPolarHBondContact O-CD 3.41Å; K705-K739 WeakPolarHBondContact CE-O 3.42Å; K705-K739 PolarHBondContact NZ-O 2.81Å; K705-L740 HydrophobicContact CG-CD2 3.72Å; K705-A743 HydrophobicContact CD-CB 4.47Å; K705-A743 HydrophobicContact CG-CB 4.18Å
706	E	94.1	Very high	92.3	Very high	74 Å²	74	38.4 Å²	38.4	35%	0.346	22%	0.215	S	C	.	.	H	α-helix	trans	-69.1	-20.8	173.2	-56.5	173.7	-141.6	0	0	112.4	R667 I670 V703	R667-E706 IonicContact CZ-OE1 2.7Å; R667-E706 IonicContact NE-OE1 2.89Å; R667-E706 PolarHBondContact NE-OE1 2.92Å; R667-E706 IonicContact NE-OE2 3.2Å; R667-E706 PolarHBondContact NE-OE2 3.4Å; R667-E706 IonicContact NH2-OE1 3.34Å; R667-E706 PolarHBondContact NH2-OE1 3.28Å; I670-E706 HydrophobicContact CD1-CB 4.27Å; V703-E706 WeakPolarHBondContact O-CA 3.24Å; V703-E706 VanDerWaalsContact O-CB 3.27Å; V703-E706 WeakPolarHBondContact O-CB 3.35Å; V703-E706 PolarHBondContact O-N 2.82Å
707	L	95	Very high	91.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-81.7	-36.8	-179.5	175.6	58.5	0	0	0	113.1	I670 L673 L689 V703 Y704 K705 E710 L711 I730	I670-L707 HydrophobicContact CD1-CB 3.86Å; I670-L707 HydrophobicContact CG1-CB 3.88Å; I670-L707 HydrophobicContact CG1-CD1 3.93Å; I670-L707 HydrophobicContact CG1-CG 4.38Å; L673-L707 HydrophobicContact CD1-CD1 3.49Å; L673-L707 VanDerWaalsContact CD1-CD1 3.49Å; L689-L707 HydrophobicContact CD1-CD1 3.91Å; L689-L707 HydrophobicContact CD1-CD2 4.43Å; L689-L707 HydrophobicContact CD2-CD2 4.3Å; V703-L707 PolarHBondContact O-N 3.24Å; Y704-L707 HydrophobicContact CD1-CD2 4.13Å; Y704-L707 WeakPolarHBondContact O-CB 3.33Å; Y704-L707 PolarHBondContact O-N 2.86Å; K705-L707 PolarHBondContact O-N 2.98Å; L707-E710 PolarHBondContact O-N 3.42Å; L707-L711 HydrophobicContact CD1-CD1 4.43Å; L707-L711 HydrophobicContact CD1-CD2 4.02Å; L707-L711 HydrophobicContact CD1-CG 3.92Å; L707-L711 HydrophobicContact CD2-CD1 4.12Å; L707-L711 HydrophobicContact CD2-CG 4.47Å; L707-L711 HydrophobicContact CG-CD1 3.78Å; L707-L711 HydrophobicContact CG-CD2 4.25Å; L707-L711 HydrophobicContact CG-CG 3.79Å; L707-L711 PolarHBondContact O-N 2.86Å; L707-L711 VanDerWaalsContact O-N 3.09Å; L707-I730 HydrophobicContact CD2-CG2 4.11Å
708	I	94.9	Very high	91.5	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-50.4	-46.8	-174.2	-69.9	169.3	0	0	0	113.5	E710 L711 L712 L734 L740 A743 L744 S747	I708-E710 PolarHBondContact O-N 2.69Å; I708-L711 PolarHBondContact O-N 3.49Å; I708-L712 HydrophobicContact CG2-CD1 4.48Å; I708-L712 PolarHBondContact O-N 3.37Å; I708-L734 HydrophobicContact CG1-CD1 4.16Å; I708-L740 HydrophobicContact CD1-CD2 4.27Å; I708-A743 HydrophobicContact CD1-CB 3.7Å; I708-L744 HydrophobicContact CD1-CD2 4.17Å; I708-L744 HydrophobicContact CD1-CG 4.08Å; I708-L744 HydrophobicContact CG1-CD2 3.95Å; I708-L744 HydrophobicContact CG1-CG 4.39Å; I708-L744 HydrophobicContact CG2-CD2 3.98Å; I708-S747 VanDerWaalsContact CG2-OG 3.24Å; I708-S747 WeakPolarHBondContact CG2-OG 3.37Å
709	P	93.2	Very high	91.1	Very high	66 Å²	66	47.7 Å²	47.7	43%	0.429	26%	0.261	S	S	.	.	H	α-helix	trans	-65.1	-21.7	-179.9	-23.1	35.4	0	0	0	114.6	K705 K713	K705-P709 WeakPolarHBondContact O-CD 3.41Å; P709-K713 VanDerWaalsContact O-CE 3.24Å; P709-K713 WeakPolarHBondContact O-CE 3.46Å; P709-K713 WeakPolarHBondContact O-CG 3.47Å
710	E	94	Very high	90.8	Very high	21 Å²	21	44.3 Å²	44.3	10%	0.098	24%	0.236	C	C	.	.	H	α-helix	trans	-87.3	-35.1	174.7	-56	-54.3	146.8	0	0	111.7	L673 K674 L707 I708 L712 K713 C714	L673-E710 HydrophobicContact CB-CB 4.28Å; L673-E710 HydrophobicContact CD1-CB 4.18Å; K674-E710 WeakPolarHBondContact CE-OE1 3.44Å; K674-E710 HydrophobicContact CG-CG 4.04Å; L707-E710 PolarHBondContact O-N 3.42Å; I708-E710 PolarHBondContact O-N 2.69Å; E710-L712 PolarHBondContact O-N 2.94Å; E710-K713 WeakPolarHBondContact O-CB 3.22Å; E710-K713 PolarHBondContact O-N 3.11Å; E710-K713 VanDerWaalsContact O-N 3.07Å; E710-K713 IonicContact OE1-NZ 3.31Å; E710-K713 PolarHBondContact OE1-NZ 3.15Å; E710-K713 WeakPolarHBondContact OE2-CD 3.25Å; E710-K713 WeakPolarHBondContact OE2-CE 3.25Å; E710-K713 IonicContact OE2-NZ 3.59Å; E710-K713 PolarHBondContact OE2-NZ 3.22Å; E710-C714 PolarHBondContact O-N 3.04Å; E710-C714 VanDerWaalsContact O-N 3.08Å; E710-C714 PolarHBondContact O-SG 2.8Å
711	L	93.9	Very high	90.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.2	-44.7	172.3	-65.4	175.6	0	0	0	111.5	L686 L707 I708 K713 C714 A715 A727 I730 M731 L734	L686-L711 HydrophobicContact CD2-CD2 4.03Å; L707-L711 HydrophobicContact CD1-CD1 4.43Å; L707-L711 HydrophobicContact CD1-CD2 4.02Å; L707-L711 HydrophobicContact CD1-CG 3.92Å; L707-L711 HydrophobicContact CD2-CD1 4.12Å; L707-L711 HydrophobicContact CD2-CG 4.47Å; L707-L711 HydrophobicContact CG-CD1 3.78Å; L707-L711 HydrophobicContact CG-CD2 4.25Å; L707-L711 HydrophobicContact CG-CG 3.79Å; L707-L711 PolarHBondContact O-N 2.86Å; L707-L711 VanDerWaalsContact O-N 3.09Å; I708-L711 PolarHBondContact O-N 3.49Å; L711-K713 PolarHBondContact O-N 2.91Å; L711-C714 PolarHBondContact O-N 3.16Å; L711-A715 WeakPolarHBondContact O-CB 3.31Å; L711-A715 PolarHBondContact O-N 2.96Å; L711-A727 HydrophobicContact CD2-CB 4.44Å; L711-I730 HydrophobicContact CD1-CB 4.15Å; L711-I730 HydrophobicContact CD1-CG2 3.48Å; L711-I730 VanDerWaalsContact CD1-CG2 3.48Å; L711-I730 HydrophobicContact CD2-CB 4.01Å; L711-I730 HydrophobicContact CD2-CD1 3.68Å; L711-I730 HydrophobicContact CD2-CG1 4.47Å; L711-I730 HydrophobicContact CD2-CG2 3.87Å; L711-I730 HydrophobicContact CG-CG2 4.33Å; L711-M731 HydrophobicContact CB-CG 4.05Å; L711-M731 HydrophobicContact CB-SD 4.07Å; L711-M731 HydrophobicContact CD1-CG 3.81Å; L711-L734 HydrophobicContact CD1-CD1 3.48Å; L711-L734 VanDerWaalsContact CD1-CD1 3.48Å
712	L	92.2	Very high	90.1	Very high	6 Å²	6	49.7 Å²	49.7	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-62.6	-20.7	175.1	-72.8	-180	0	0	0	113.3	I708 E710 N716 M731 S747 E748	I708-L712 HydrophobicContact CG2-CD1 4.48Å; I708-L712 PolarHBondContact O-N 3.37Å; E710-L712 PolarHBondContact O-N 2.94Å; L712-N716 PolarHBondContact O-ND2 3.39Å; L712-M731 HydrophobicContact CD2-SD 4Å; L712-S747 WeakPolarHBondContact CD1-OG 3.33Å; L712-E748 HydrophobicContact CD2-CG 4.3Å
713	K	91.8	Very high	90	Very high	110 Å²	110	48.1 Å²	48.1	48%	0.478	25%	0.251	S	S	.	.	H	α-helix	trans	-80.4	-37.4	170.4	-63.1	171.3	-154.7	165	0	111.6	P709 E710 L711 C717	P709-K713 VanDerWaalsContact O-CE 3.24Å; P709-K713 WeakPolarHBondContact O-CE 3.46Å; P709-K713 WeakPolarHBondContact O-CG 3.47Å; E710-K713 WeakPolarHBondContact O-CB 3.22Å; E710-K713 PolarHBondContact O-N 3.11Å; E710-K713 VanDerWaalsContact O-N 3.07Å; E710-K713 IonicContact OE1-NZ 3.31Å; E710-K713 PolarHBondContact OE1-NZ 3.15Å; E710-K713 WeakPolarHBondContact OE2-CD 3.25Å; E710-K713 WeakPolarHBondContact OE2-CE 3.25Å; E710-K713 IonicContact OE2-NZ 3.59Å; E710-K713 PolarHBondContact OE2-NZ 3.22Å; L711-K713 PolarHBondContact O-N 2.91Å; K713-C717 PolarHBondContact O-N 3.34Å
714	C	91.4	Very high	89.8	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.02	25%	0.248	C	C	.	.	H	α-helix	trans	-71.3	-39	178.9	-57.9	0	0	0	0	111.9	L686 E710 L711 N716 C717 A727	L686-C714 HydrophobicContact CD1-CB 4.22Å; E710-C714 PolarHBondContact O-N 3.04Å; E710-C714 VanDerWaalsContact O-N 3.08Å; E710-C714 PolarHBondContact O-SG 2.8Å; L711-C714 PolarHBondContact O-N 3.16Å; C714-N716 VanDerWaalsContact C-N 3.29Å; C714-N716 PolarHBondContact O-N 3.19Å; C714-C717 WeakPolarHBondContact O-CB 3.28Å; C714-C717 PolarHBondContact O-N 3.44Å; C714-C717 VanDerWaalsContact O-N 3.17Å; C714-A727 HydrophobicContact CB-CB 3.8Å
715	A	88.9	Confident	89.4	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.008	27%	0.272	C	S	.	.	H	α-helix	trans	-67.3	-25.2	175.8	0	0	0	0	0	113.7	L711 A727 F728 M731	L711-A715 WeakPolarHBondContact O-CB 3.31Å; L711-A715 PolarHBondContact O-N 2.96Å; A715-A727 HydrophobicContact CB-CB 4.1Å; A715-F728 HydrophobicContact CB-CD1 4.43Å; A715-F728 HydrophobicContact CB-CE1 3.88Å; A715-F728 HydrophobicContact CB-CE2 4.33Å; A715-F728 HydrophobicContact CB-CZ 3.82Å; A715-M731 HydrophobicContact CB-CE 3.71Å
716	N	87.2	Confident	89.3	Confident	44 Å²	44	50.3 Å²	50.3	24%	0.235	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	17.7	173.4	-70	-78.7	0	0	0	112.7	L712 C714 E718 S754 V755	L712-N716 PolarHBondContact O-ND2 3.39Å; C714-N716 VanDerWaalsContact C-N 3.29Å; C714-N716 PolarHBondContact O-N 3.19Å; N716-E718 PolarHBondContact O-N 2.92Å; N716-S754 VanDerWaalsContact OD1-CB 3.3Å; N716-S754 WeakPolarHBondContact OD1-CB 3.32Å; N716-S754 PolarHBondContact OD1-OG 3.37Å; N716-V755 WeakPolarHBondContact ND2-CG2 3.44Å
717	C	83.4	Confident	89.3	Confident	35 Å²	35	46.8 Å²	46.8	24%	0.236	25%	0.25	C	C	.	.			trans	-86.7	88.4	-179.6	-172.5	0	0	0	0	110.3	K713 C714 D719 D720 Q724	K713-C717 PolarHBondContact O-N 3.34Å; C714-C717 WeakPolarHBondContact O-CB 3.28Å; C714-C717 PolarHBondContact O-N 3.44Å; C714-C717 VanDerWaalsContact O-N 3.17Å; C717-D719 PolarHBondContact O-N 3.26Å; C717-D719 VanDerWaalsContact O-N 3.08Å; C717-D720 PolarHBondContact O-N 3.17Å; C717-Q724 PolarHBondContact O-NE2 3.12Å
718	E	80.3	Confident	89	Confident	177 Å²	177	47.3 Å²	47.3	83%	0.827	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-35.4	-170.2	-62.2	-175.8	168.6	0	0	114.3	N716	N716-E718 PolarHBondContact O-N 2.92Å
719	D	81.4	Confident	88.7	Confident	164 Å²	164	48.4 Å²	48.4	88%	0.877	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-10.5	-174.6	-57.8	-55.9	0	0	0	115.7	C717	C717-D719 PolarHBondContact O-N 3.26Å; C717-D719 VanDerWaalsContact O-N 3.08Å
720	D	83.9	Confident	88.8	Confident	28 Å²	28	45.3 Å²	45.3	15%	0.15	24%	0.242	C	C	.	.			trans	-136.1	92.1	-171.7	-168.8	-26.2	0	0	0	113.2	T679 C717 G722 Q723 Q724	T679-D720 WeakPolarHBondContact CG2-OD2 3.02Å; C717-D720 PolarHBondContact O-N 3.17Å; D720-G722 PolarHBondContact O-N 3.28Å; D720-G722 WeakPolarHBondContact OD1-CA 3.4Å; D720-G722 PolarHBondContact OD1-N 3.36Å; D720-Q723 HydrophobicContact CB-CB 4.06Å; D720-Q723 HydrophobicContact CB-CG 4.25Å; D720-Q723 PolarHBondContact O-N 3.37Å; D720-Q723 PolarHBondContact OD1-N 3.27Å; D720-Q723 WeakPolarHBondContact OD2-CG 3.38Å; D720-Q723 PolarHBondContact OD2-NE2 3.48Å; D720-Q724 WeakPolarHBondContact O-CG 3.22Å; D720-Q724 PolarHBondContact O-N 2.9Å
721	L	85.6	Confident	88.8	Confident	115 Å²	115	44.3 Å²	44.3	60%	0.602	24%	0.237	S	C	*	.	H	α-helix	trans	-60.3	-26.1	176.2	-168.8	67.7	0	0	0	113.1	S725 N762	L721-S725 VanDerWaalsContact O-CB 3.25Å; L721-S725 WeakPolarHBondContact O-CB 3.23Å; L721-S725 PolarHBondContact O-N 3.39Å; L721-N762 WeakPolarHBondContact CD1-OD1 3.49Å
722	G	85.6	Confident	88.6	Confident	26 Å²	26	48.2 Å²	48.2	27%	0.268	26%	0.255	S	S	.	.	H	α-helix	trans	-72.7	-44.7	176.3	0	0	0	0	0	112.1	L683 D720 Q724 S725 Y726	L683-G722 VanDerWaalsContact CD1-C 3.41Å; D720-G722 PolarHBondContact O-N 3.28Å; D720-G722 WeakPolarHBondContact OD1-CA 3.4Å; D720-G722 PolarHBondContact OD1-N 3.36Å; G722-Q724 VanDerWaalsContact C-N 3.33Å; G722-S725 PolarHBondContact O-N 2.63Å; G722-Y726 WeakPolarHBondContact O-CD2 3.49Å; G722-Y726 PolarHBondContact O-N 3.34Å; G722-Y726 VanDerWaalsContact O-N 3.1Å
723	Q	90.3	Very high	88.6	Confident	12 Å²	12	48.8 Å²	48.8	6%	0.056	26%	0.258	C	S	.	.	H	α-helix	trans	-61.9	-41.2	171.1	-77.9	-178	80.1	0	0	111.5	L683 L686 D720 A727	L683-Q723 HydrophobicContact CD1-CG 4.38Å; L686-Q723 HydrophobicContact CD1-CB 3.93Å; L686-Q723 HydrophobicContact CD1-CG 3.81Å; D720-Q723 HydrophobicContact CB-CB 4.06Å; D720-Q723 HydrophobicContact CB-CG 4.25Å; D720-Q723 PolarHBondContact O-N 3.37Å; D720-Q723 PolarHBondContact OD1-N 3.27Å; D720-Q723 WeakPolarHBondContact OD2-CG 3.38Å; D720-Q723 PolarHBondContact OD2-NE2 3.48Å; Q723-A727 WeakPolarHBondContact O-CB 3.49Å; Q723-A727 PolarHBondContact O-N 3.43Å
724	Q	88.9	Confident	88.7	Confident	18 Å²	18	43.6 Å²	43.6	8%	0.084	24%	0.236	C	C	.	.	H	α-helix	trans	-60.1	-54.9	174.4	-69	176.2	30	0	0	111.4	C717 D720 G722 Y726 A727 F728 N762	C717-Q724 PolarHBondContact O-NE2 3.12Å; D720-Q724 WeakPolarHBondContact O-CG 3.22Å; D720-Q724 PolarHBondContact O-N 2.9Å; G722-Q724 VanDerWaalsContact C-N 3.33Å; Q724-Y726 PolarHBondContact O-N 2.94Å; Q724-A727 PolarHBondContact O-N 2.87Å; Q724-A727 VanDerWaalsContact O-N 3.1Å; Q724-F728 HydrophobicContact CB-CD2 4.36Å; Q724-F728 HydrophobicContact CB-CE2 4.07Å; Q724-F728 WeakPolarHBondContact O-CD2 3.41Å; Q724-F728 PolarHBondContact O-N 3.15Å; Q724-N762 PolarHBondContact OE1-ND2 2.85Å
725	S	86.7	Confident	88.7	Confident	73 Å²	73	45 Å²	45	51%	0.51	25%	0.246	S	C	.	.	H	α-helix	trans	-56.4	-49.5	-176.7	-178.3	0	0	0	0	112.4	L721 G722 F728 A729	L721-S725 VanDerWaalsContact O-CB 3.25Å; L721-S725 WeakPolarHBondContact O-CB 3.23Å; L721-S725 PolarHBondContact O-N 3.39Å; G722-S725 PolarHBondContact O-N 2.63Å; S725-F728 PolarHBondContact O-N 3.45Å; S725-A729 WeakPolarHBondContact O-CB 3.12Å; S725-A729 PolarHBondContact O-N 2.92Å
726	Y	93	Very high	88.8	Confident	79 Å²	79	51 Å²	51	31%	0.31	27%	0.272	S	S	.	.	H	α-helix	trans	-67.2	-36.9	176.2	-67.1	-46.6	0	0	0	112.5	L683 L686 A687 V690 G722 Q724 F728 A729 I730	L683-Y726 HydrophobicContact CD1-CD2 3.72Å; L683-Y726 HydrophobicContact CD1-CE2 3.76Å; L683-Y726 HydrophobicContact CG-CD2 4.3Å; L683-Y726 HydrophobicContact CG-CE2 3.96Å; L686-Y726 HydrophobicContact CB-CD2 4.2Å; L686-Y726 HydrophobicContact CB-CG 4.3Å; A687-Y726 HydrophobicContact CB-CD2 4.32Å; A687-Y726 HydrophobicContact CB-CE1 4.25Å; A687-Y726 HydrophobicContact CB-CE2 3.83Å; V690-Y726 HydrophobicContact CG2-CD1 3.87Å; V690-Y726 HydrophobicContact CG2-CG 4.36Å; G722-Y726 WeakPolarHBondContact O-CD2 3.49Å; G722-Y726 PolarHBondContact O-N 3.34Å; G722-Y726 VanDerWaalsContact O-N 3.1Å; Q724-Y726 PolarHBondContact O-N 2.94Å; Y726-F728 PolarHBondContact O-N 2.86Å; Y726-A729 PolarHBondContact O-N 3.41Å; Y726-I730 WeakPolarHBondContact O-CD1 3.3Å; Y726-I730 WeakPolarHBondContact O-CG1 3.46Å; Y726-I730 PolarHBondContact O-N 2.86Å
727	A	93.1	Very high	88.9	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.5	-44.2	176	0	0	0	0	0	112	L711 C714 A715 Q723 Q724 I730 M731	L711-A727 HydrophobicContact CD2-CB 4.44Å; C714-A727 HydrophobicContact CB-CB 3.8Å; A715-A727 HydrophobicContact CB-CB 4.1Å; Q723-A727 WeakPolarHBondContact O-CB 3.49Å; Q723-A727 PolarHBondContact O-N 3.43Å; Q724-A727 PolarHBondContact O-N 2.87Å; Q724-A727 VanDerWaalsContact O-N 3.1Å; A727-I730 PolarHBondContact O-N 3.02Å; A727-M731 WeakPolarHBondContact O-CG 3.47Å; A727-M731 PolarHBondContact O-N 2.94Å
728	F	89.1	Confident	89.1	Confident	10 Å²	10	53.3 Å²	53.3	4%	0.044	29%	0.288	C	S	.	.	H	α-helix	trans	-65.2	-39.8	175	-67.8	-62.4	0	0	0	112.4	A715 Q724 S725 Y726 I730 M731 H732 A758 C759 M764	A715-F728 HydrophobicContact CB-CD1 4.43Å; A715-F728 HydrophobicContact CB-CE1 3.88Å; A715-F728 HydrophobicContact CB-CE2 4.33Å; A715-F728 HydrophobicContact CB-CZ 3.82Å; Q724-F728 HydrophobicContact CB-CD2 4.36Å; Q724-F728 HydrophobicContact CB-CE2 4.07Å; Q724-F728 WeakPolarHBondContact O-CD2 3.41Å; Q724-F728 PolarHBondContact O-N 3.15Å; S725-F728 PolarHBondContact O-N 3.45Å; Y726-F728 PolarHBondContact O-N 2.86Å; F728-I730 VanDerWaalsContact C-N 3.34Å; F728-I730 PolarHBondContact O-N 2.88Å; F728-M731 HydrophobicContact CD1-CE 3.42Å; F728-M731 VanDerWaalsContact CD1-CE 3.42Å; F728-M731 HydrophobicContact CE1-CE 3.78Å; F728-M731 HydrophobicContact CG-CE 4.27Å; F728-M731 PolarHBondContact O-N 3.23Å; F728-H732 WeakPolarHBondContact O-CB 3.32Å; F728-H732 PolarHBondContact O-N 3.38Å; F728-A758 HydrophobicContact CZ-CB 4.39Å; F728-C759 WeakPolarHBondContact CE1-SG 3.45Å; F728-M764 HydrophobicContact CB-CE 3.64Å; F728-M764 HydrophobicContact CB-CG 4.07Å; F728-M764 HydrophobicContact CD2-CG 4.35Å; F728-M764 HydrophobicContact CG-CB 4.46Å; F728-M764 HydrophobicContact CG-CG 4.2Å
729	A	89.6	Confident	89.6	Confident	29 Å²	29	50.1 Å²	50.1	24%	0.24	27%	0.272	C	S	.	.	H	α-helix	trans	-61.3	-40.5	175	0	0	0	0	0	112.5	V690 S725 Y726 N733	V690-A729 HydrophobicContact CG2-CB 4.04Å; S725-A729 WeakPolarHBondContact O-CB 3.12Å; S725-A729 PolarHBondContact O-N 2.92Å; Y726-A729 PolarHBondContact O-N 3.41Å; A729-N733 PolarHBondContact O-N 3.22Å; A729-N733 VanDerWaalsContact O-N 3.14Å
730	I	94.4	Very high	90.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.6	-46.4	174	-62.6	161.2	0	0	0	110.4	L686 L689 V690 T693 L707 L711 Y726 A727 F728 H732 N733 L734	L686-I730 HydrophobicContact CB-CD1 4.3Å; L686-I730 HydrophobicContact CD2-CD1 3.74Å; L689-I730 HydrophobicContact CB-CD1 3.68Å; L689-I730 HydrophobicContact CB-CG1 4.29Å; V690-I730 HydrophobicContact CB-CG1 4.41Å; V690-I730 HydrophobicContact CG2-CD1 4.23Å; V690-I730 HydrophobicContact CG2-CG1 3.62Å; T693-I730 HydrophobicContact CG2-CG2 3.74Å; L707-I730 HydrophobicContact CD2-CG2 4.11Å; L711-I730 HydrophobicContact CD1-CB 4.15Å; L711-I730 HydrophobicContact CD1-CG2 3.48Å; L711-I730 VanDerWaalsContact CD1-CG2 3.48Å; L711-I730 HydrophobicContact CD2-CB 4.01Å; L711-I730 HydrophobicContact CD2-CD1 3.68Å; L711-I730 HydrophobicContact CD2-CG1 4.47Å; L711-I730 HydrophobicContact CD2-CG2 3.87Å; L711-I730 HydrophobicContact CG-CG2 4.33Å; Y726-I730 WeakPolarHBondContact O-CD1 3.3Å; Y726-I730 WeakPolarHBondContact O-CG1 3.46Å; Y726-I730 PolarHBondContact O-N 2.86Å; A727-I730 PolarHBondContact O-N 3.02Å; F728-I730 VanDerWaalsContact C-N 3.34Å; F728-I730 PolarHBondContact O-N 2.88Å; I730-H732 VanDerWaalsContact C-N 3.35Å; I730-H732 PolarHBondContact O-N 3.2Å; I730-N733 WeakPolarHBondContact O-CB 3.44Å; I730-N733 PolarHBondContact O-N 2.88Å; I730-N733 VanDerWaalsContact O-N 3.09Å; I730-L734 HydrophobicContact CG2-CD1 4.02Å; I730-L734 HydrophobicContact CG2-CG 4.28Å; I730-L734 WeakPolarHBondContact O-CG 3.4Å; I730-L734 PolarHBondContact O-N 3.44Å
731	M	94.1	Very high	90.5	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-63.3	-38.4	179.9	-68.4	-173.9	-57.6	0	0	112.4	L711 L712 A715 A727 F728 N733 L734 S735 L744 F767	L711-M731 HydrophobicContact CB-CG 4.05Å; L711-M731 HydrophobicContact CB-SD 4.07Å; L711-M731 HydrophobicContact CD1-CG 3.81Å; L712-M731 HydrophobicContact CD2-SD 4Å; A715-M731 HydrophobicContact CB-CE 3.71Å; A727-M731 WeakPolarHBondContact O-CG 3.47Å; A727-M731 PolarHBondContact O-N 2.94Å; F728-M731 HydrophobicContact CD1-CE 3.42Å; F728-M731 VanDerWaalsContact CD1-CE 3.42Å; F728-M731 HydrophobicContact CE1-CE 3.78Å; F728-M731 HydrophobicContact CG-CE 4.27Å; F728-M731 PolarHBondContact O-N 3.23Å; M731-N733 VanDerWaalsContact C-N 3.32Å; M731-N733 PolarHBondContact O-N 2.63Å; M731-L734 PolarHBondContact O-N 3.26Å; M731-S735 WeakPolarHBondContact O-CB 3.22Å; M731-S735 PolarHBondContact O-N 2.77Å; M731-S735 PolarHBondContact O-OG 3.5Å; M731-L744 HydrophobicContact CB-CD2 4.22Å; M731-L744 HydrophobicContact CG-CD2 3.89Å; M731-L744 HydrophobicContact SD-CD2 4.11Å; M731-F767 HydrophobicContact CB-CE2 4.12Å; M731-F767 HydrophobicContact CB-CZ 4.16Å
732	H	90	Very high	90.6	Very high	81 Å²	81	40 Å²	40	38%	0.375	23%	0.227	S	C	.	.	H	α-helix	trans	-64.5	-31.2	172	165.7	-120.9	0	0	0	113.3	F728 I730 S735 K736	F728-H732 WeakPolarHBondContact O-CB 3.32Å; F728-H732 PolarHBondContact O-N 3.38Å; I730-H732 VanDerWaalsContact C-N 3.35Å; I730-H732 PolarHBondContact O-N 3.2Å; H732-S735 WeakPolarHBondContact CA-OG 3.34Å; H732-S735 PolarHBondContact O-OG 2.7Å; H732-K736 WeakPolarHBondContact NE2-CE 3.27Å; H732-K736 WeakPolarHBondContact O-CE 3.47Å
733	N	91.3	Very high	90.9	Very high	19 Å²	19	39.8 Å²	39.8	10%	0.102	22%	0.223	C	C	.	.	H	α-helix	trans	-72.1	-46	171.4	-80	-15.2	0	0	0	111.6	V690 T693 A729 I730 M731 S735 K736	V690-N733 PolarHBondContact O-ND2 2.77Å; T693-N733 WeakPolarHBondContact O-CB 3.23Å; T693-N733 PolarHBondContact OG1-ND2 2.9Å; A729-N733 PolarHBondContact O-N 3.22Å; A729-N733 VanDerWaalsContact O-N 3.14Å; I730-N733 WeakPolarHBondContact O-CB 3.44Å; I730-N733 PolarHBondContact O-N 2.88Å; I730-N733 VanDerWaalsContact O-N 3.09Å; M731-N733 VanDerWaalsContact C-N 3.32Å; M731-N733 PolarHBondContact O-N 2.63Å; N733-S735 VanDerWaalsContact C-N 3.29Å; N733-S735 PolarHBondContact O-N 3.31Å; N733-K736 WeakPolarHBondContact O-CB 3.39Å; N733-K736 PolarHBondContact O-N 2.88Å; N733-K736 PolarHBondContact OD1-NZ 3.4Å
734	L	94.6	Very high	90.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.5	-35.7	176.7	-66.9	173.4	0	0	0	112.4	T693 I696 Y704 I708 L711 I730 M731 K736 V737 L740 L744	T693-L734 HydrophobicContact CG2-CD2 3.83Å; T693-L734 HydrophobicContact CG2-CG 4.16Å; I696-L734 HydrophobicContact CD1-CD2 4Å; Y704-L734 HydrophobicContact CD1-CD2 3.83Å; Y704-L734 HydrophobicContact CG-CD2 3.95Å; I708-L734 HydrophobicContact CG1-CD1 4.16Å; L711-L734 HydrophobicContact CD1-CD1 3.48Å; L711-L734 VanDerWaalsContact CD1-CD1 3.48Å; I730-L734 HydrophobicContact CG2-CD1 4.02Å; I730-L734 HydrophobicContact CG2-CG 4.28Å; I730-L734 WeakPolarHBondContact O-CG 3.4Å; I730-L734 PolarHBondContact O-N 3.44Å; M731-L734 PolarHBondContact O-N 3.26Å; L734-K736 PolarHBondContact O-N 2.98Å; L734-V737 PolarHBondContact O-N 3.32Å; L734-V737 VanDerWaalsContact O-N 3.16Å; L734-L740 HydrophobicContact CB-CB 4.43Å; L734-L740 HydrophobicContact CD2-CD1 3.87Å; L734-L740 WeakPolarHBondContact O-CB 3.26Å; L734-L744 HydrophobicContact CB-CD1 4.02Å
735	S	91.6	Very high	90.7	Very high	33 Å²	33	39.6 Å²	39.6	23%	0.231	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-13.2	-180	68	0	0	0	0	114.3	M731 H732 N733 V737 F767	M731-S735 WeakPolarHBondContact O-CB 3.22Å; M731-S735 PolarHBondContact O-N 2.77Å; M731-S735 PolarHBondContact O-OG 3.5Å; H732-S735 WeakPolarHBondContact CA-OG 3.34Å; H732-S735 PolarHBondContact O-OG 2.7Å; N733-S735 VanDerWaalsContact C-N 3.29Å; N733-S735 PolarHBondContact O-N 3.31Å; S735-V737 PolarHBondContact O-N 3.49Å; S735-F767 VanDerWaalsContact CB-CE1 3.46Å
736	K	89.9	Confident	90.7	Very high	127 Å²	127	43.5 Å²	43.5	55%	0.552	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-16.7	172.5	-63.7	163.1	-170.9	167	0	112.6	H732 N733 L734	H732-K736 WeakPolarHBondContact NE2-CE 3.27Å; H732-K736 WeakPolarHBondContact O-CE 3.47Å; N733-K736 WeakPolarHBondContact O-CB 3.39Å; N733-K736 PolarHBondContact O-N 2.88Å; N733-K736 PolarHBondContact OD1-NZ 3.4Å; L734-K736 PolarHBondContact O-N 2.98Å
737	V	89.5	Confident	90.2	Very high	29 Å²	29	40.8 Å²	40.8	18%	0.176	23%	0.227	C	C	.	.	S	Bend	trans	-102.7	112.8	178.2	178.5	0	0	0	0	108.9	I696 I701 L734 S735 K739 L740 A741	I696-V737 HydrophobicContact CB-CG2 4.04Å; I696-V737 HydrophobicContact CD1-CG2 3.95Å; I696-V737 HydrophobicContact CG2-CG2 4Å; I701-V737 HydrophobicContact CD1-CG1 3.81Å; I701-V737 HydrophobicContact CG1-CG1 4.33Å; L734-V737 PolarHBondContact O-N 3.32Å; L734-V737 VanDerWaalsContact O-N 3.16Å; S735-V737 PolarHBondContact O-N 3.49Å; V737-K739 VanDerWaalsContact C-N 3.3Å; V737-K739 PolarHBondContact O-N 3.2Å; V737-K739 VanDerWaalsContact O-N 3.13Å; V737-L740 HydrophobicContact CB-CB 4.28Å; V737-L740 HydrophobicContact CB-CD1 4Å; V737-L740 HydrophobicContact CG1-CD1 4.01Å; V737-L740 HydrophobicContact CG1-CG 4.39Å; V737-L740 WeakPolarHBondContact O-CA 3.34Å; V737-L740 WeakPolarHBondContact O-CB 3.36Å; V737-L740 PolarHBondContact O-N 3.17Å; V737-A741 PolarHBondContact O-N 3.16Å
738	P	88.9	Confident	89	Confident	99 Å²	99	42.3 Å²	42.3	64%	0.643	23%	0.234	S	C	*	.	H	α-helix	trans	-54.7	-40.3	-171.3	-30.6	36	0	0	0	114.6	L740 A741 S742	P738-L740 PolarHBondContact O-N 3.3Å; P738-L740 VanDerWaalsContact O-N 3.13Å; P738-A741 PolarHBondContact O-N 3.19Å; P738-S742 PolarHBondContact O-N 3Å; P738-S742 PolarHBondContact O-OG 3.43Å
739	K	91.1	Very high	87.6	Confident	110 Å²	110	45.1 Å²	45.1	48%	0.478	25%	0.252	S	S	.	.	H	α-helix	trans	-63.3	-16.7	177.8	-64.7	171.7	-175.9	165.7	0	113.9	N698 I701 K705 V737	N698-K739 PolarHBondContact OD1-NZ 3.09Å; I701-K739 HydrophobicContact CD1-CB 4.25Å; I701-K739 HydrophobicContact CD1-CD 3.77Å; I701-K739 HydrophobicContact CG2-CB 3.92Å; I701-K739 HydrophobicContact CG2-CD 4.49Å; K705-K739 WeakPolarHBondContact CE-O 3.42Å; K705-K739 PolarHBondContact NZ-O 2.81Å; V737-K739 VanDerWaalsContact C-N 3.3Å; V737-K739 PolarHBondContact O-N 3.2Å; V737-K739 VanDerWaalsContact O-N 3.13Å
740	L	93.9	Very high	86.1	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-105.5	-36.4	177.1	-73.5	162.6	0	0	0	111.7	I696 I701 K705 I708 L734 V737 P738 S742 A743 L744	I696-L740 HydrophobicContact CD1-CD1 4.42Å; I696-L740 HydrophobicContact CG2-CD1 3.89Å; I701-L740 HydrophobicContact CG1-CD1 4.27Å; I701-L740 HydrophobicContact CG2-CD2 4.41Å; I701-L740 HydrophobicContact CG2-CG 4.18Å; K705-L740 HydrophobicContact CG-CD2 3.72Å; I708-L740 HydrophobicContact CD1-CD2 4.27Å; L734-L740 HydrophobicContact CB-CB 4.43Å; L734-L740 HydrophobicContact CD2-CD1 3.87Å; L734-L740 WeakPolarHBondContact O-CB 3.26Å; V737-L740 HydrophobicContact CB-CB 4.28Å; V737-L740 HydrophobicContact CB-CD1 4Å; V737-L740 HydrophobicContact CG1-CD1 4.01Å; V737-L740 HydrophobicContact CG1-CG 4.39Å; V737-L740 WeakPolarHBondContact O-CA 3.34Å; V737-L740 WeakPolarHBondContact O-CB 3.36Å; V737-L740 PolarHBondContact O-N 3.17Å; P738-L740 PolarHBondContact O-N 3.3Å; P738-L740 VanDerWaalsContact O-N 3.13Å; L740-S742 VanDerWaalsContact C-N 3.33Å; L740-S742 PolarHBondContact O-N 3.45Å; L740-A743 CarbonylContact O-C 3.59Å; L740-A743 WeakPolarHBondContact O-CA 3.32Å; L740-A743 WeakPolarHBondContact O-CB 3.23Å; L740-A743 PolarHBondContact O-N 3.06Å; L740-L744 PolarHBondContact O-N 3.17Å
741	A	89.9	Confident	84.5	Confident	31 Å²	31	56.7 Å²	56.7	26%	0.256	30%	0.299	S	S	.	.	H	α-helix	trans	-53.7	-48	168.7	0	0	0	0	0	111.9	V737 P738 A743 L744 A745	V737-A741 PolarHBondContact O-N 3.16Å; P738-A741 PolarHBondContact O-N 3.19Å; A741-A743 PolarHBondContact O-N 2.97Å; A741-A743 VanDerWaalsContact O-N 3.17Å; A741-L744 PolarHBondContact O-N 2.89Å; A741-A745 PolarHBondContact O-N 2.87Å; A741-A745 VanDerWaalsContact O-N 3.1Å
742	S	87.4	Confident	82.3	Confident	62 Å²	62	62 Å²	62	43%	0.434	32%	0.324	S	S	.	.	H	α-helix	trans	-68	-10.2	174.6	-49.8	0	0	0	0	114.4	P738 L740 K746	P738-S742 PolarHBondContact O-N 3Å; P738-S742 PolarHBondContact O-OG 3.43Å; L740-S742 VanDerWaalsContact C-N 3.33Å; L740-S742 PolarHBondContact O-N 3.45Å; S742-K746 WeakPolarHBondContact O-CD 3.18Å; S742-K746 VanDerWaalsContact O-CG 3.27Å; S742-K746 WeakPolarHBondContact O-CG 3.02Å
743	A	91.4	Very high	80.5	Confident	22 Å²	22	69.5 Å²	69.5	18%	0.182	35%	0.349	C	S	.	.	H	α-helix	trans	-92.9	-38.8	173.6	0	0	0	0	0	111.5	K705 I708 L740 A741 K746 S747	K705-A743 HydrophobicContact CD-CB 4.47Å; K705-A743 HydrophobicContact CG-CB 4.18Å; I708-A743 HydrophobicContact CD1-CB 3.7Å; L740-A743 CarbonylContact O-C 3.59Å; L740-A743 WeakPolarHBondContact O-CA 3.32Å; L740-A743 WeakPolarHBondContact O-CB 3.23Å; L740-A743 PolarHBondContact O-N 3.06Å; A741-A743 PolarHBondContact O-N 2.97Å; A741-A743 VanDerWaalsContact O-N 3.17Å; A743-K746 PolarHBondContact O-N 3.16Å; A743-S747 PolarHBondContact O-N 3.47Å; A743-S747 PolarHBondContact O-OG 3Å
744	L	90.6	Very high	78.6	Confident	2 Å²	2	71.3 Å²	71.3	1%	0.01	36%	0.363	C	S	.	.	H	α-helix	trans	-56.4	-57.1	170.4	-73.5	165.5	0	0	0	110.4	I708 M731 L734 L740 A741 K746 S747 E748 F767	I708-L744 HydrophobicContact CD1-CD2 4.17Å; I708-L744 HydrophobicContact CD1-CG 4.08Å; I708-L744 HydrophobicContact CG1-CD2 3.95Å; I708-L744 HydrophobicContact CG1-CG 4.39Å; I708-L744 HydrophobicContact CG2-CD2 3.98Å; M731-L744 HydrophobicContact CB-CD2 4.22Å; M731-L744 HydrophobicContact CG-CD2 3.89Å; M731-L744 HydrophobicContact SD-CD2 4.11Å; L734-L744 HydrophobicContact CB-CD1 4.02Å; L740-L744 PolarHBondContact O-N 3.17Å; A741-L744 PolarHBondContact O-N 2.89Å; L744-K746 VanDerWaalsContact C-N 3.27Å; L744-K746 PolarHBondContact O-N 3.21Å; L744-S747 WeakPolarHBondContact O-CA 3.26Å; L744-S747 PolarHBondContact O-N 2.82Å; L744-S747 PolarHBondContact O-OG 2.67Å; L744-E748 PolarHBondContact O-N 3.23Å; L744-E748 VanDerWaalsContact O-N 3.12Å; L744-F767 HydrophobicContact CD1-CZ 4.44Å
745	A	85	Confident	76.5	Confident	25 Å²	25	72 Å²	72	21%	0.207	37%	0.368	C	S	.	.	H	α-helix	trans	-56.3	-37.9	-178.4	0	0	0	0	0	113.3	A741 S747 E748 T749	A741-A745 PolarHBondContact O-N 2.87Å; A741-A745 VanDerWaalsContact O-N 3.1Å; A745-S747 VanDerWaalsContact C-N 3.32Å; A745-S747 PolarHBondContact O-N 3.16Å; A745-E748 PolarHBondContact O-N 2.63Å; A745-T749 PolarHBondContact O-N 2.8Å; A745-T749 PolarHBondContact O-OG1 2.92Å
746	K	86.8	Confident	74.5	Confident	154 Å²	154	76.2 Å²	76.2	67%	0.67	38%	0.384	S	S	*	.	H	α-helix	trans	-70.2	-25.5	176	-74.8	-178.2	-179.8	-171.2	0	113.9	S742 A743 L744 T749	S742-K746 WeakPolarHBondContact O-CD 3.18Å; S742-K746 VanDerWaalsContact O-CG 3.27Å; S742-K746 WeakPolarHBondContact O-CG 3.02Å; A743-K746 PolarHBondContact O-N 3.16Å; L744-K746 VanDerWaalsContact C-N 3.27Å; L744-K746 PolarHBondContact O-N 3.21Å; K746-T749 PolarHBondContact O-OG1 3.14Å
747	S	82.6	Confident	72.4	Confident	22 Å²	22	77.1 Å²	77.1	15%	0.154	39%	0.389	C	S	.	.	H	α-helix	trans	-87.2	-18.2	177.9	63.6	0	0	0	0	113.8	I708 L712 A743 L744 A745	I708-S747 VanDerWaalsContact CG2-OG 3.24Å; I708-S747 WeakPolarHBondContact CG2-OG 3.37Å; L712-S747 WeakPolarHBondContact CD1-OG 3.33Å; A743-S747 PolarHBondContact O-N 3.47Å; A743-S747 PolarHBondContact O-OG 3Å; L744-S747 WeakPolarHBondContact O-CA 3.26Å; L744-S747 PolarHBondContact O-N 2.82Å; L744-S747 PolarHBondContact O-OG 2.67Å; A745-S747 VanDerWaalsContact C-N 3.32Å; A745-S747 PolarHBondContact O-N 3.16Å
748	E	67.3	Low	70.5	Confident	32 Å²	32	76.6 Å²	76.6	15%	0.15	39%	0.388	C	S	.	.	H	α-helix	trans	-80.5	-35.5	173.4	-69.4	178	132.3	0	0	112.1	L712 L744 A745 E750 K751 E752	L712-E748 HydrophobicContact CD2-CG 4.3Å; L744-E748 PolarHBondContact O-N 3.23Å; L744-E748 VanDerWaalsContact O-N 3.12Å; A745-E748 PolarHBondContact O-N 2.63Å; E748-E750 PolarHBondContact O-N 2.6Å; E748-K751 CarbonylContact O-C 3.57Å; E748-K751 PolarHBondContact O-N 3.18Å; E748-E752 PolarHBondContact O-N 3.06Å
749	T	59.5	Low	68.5	Low	70 Å²	70	72 Å²	72	43%	0.429	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-12.7	177.1	44.9	0	0	0	0	114.8	A745 K746	A745-T749 PolarHBondContact O-N 2.8Å; A745-T749 PolarHBondContact O-OG1 2.92Å; K746-T749 PolarHBondContact O-OG1 3.14Å
750	E	59.2	Low	66.5	Low	167 Å²	167	71.2 Å²	71.2	78%	0.78	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-4.3	173.6	-62.5	-173.3	158.5	0	0	113.3	E748	E748-E750 PolarHBondContact O-N 2.6Å
751	K	59.4	Low	64.3	Low	105 Å²	105	79.5 Å²	79.5	46%	0.457	40%	0.399	S	S	.	.			trans	-145.6	30.8	-170.3	-65.4	-173.3	178.7	176.8	0	114.9	E748 R753	E748-K751 CarbonylContact O-C 3.57Å; E748-K751 PolarHBondContact O-N 3.18Å; K751-R753 PolarHBondContact O-N 2.89Å
752	E	48.4	Very low	62.3	Low	113 Å²	113	80.5 Å²	80.5	53%	0.528	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	44.4	-169.3	-57.6	-174.9	136.5	0	0	117.3	E748 K769	E748-E752 PolarHBondContact O-N 3.06Å; E752-K769 IonicContact OE1-NZ 2.7Å; E752-K769 PolarHBondContact OE1-NZ 3.16Å
753	R	51.6	Low	60	Low	237 Å²	237	78.6 Å²	78.6	89%	0.894	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.5	-18.1	172.7	-70.5	-165.2	-179.7	174.9	1.7	118.1	K751	K751-R753 PolarHBondContact O-N 2.89Å
754	S	51.3	Low	57.6	Low	57 Å²	57	80.1 Å²	80.1	40%	0.399	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-36.7	-179	64.5	0	0	0	0	114	N716 H757 A758	N716-S754 VanDerWaalsContact OD1-CB 3.3Å; N716-S754 WeakPolarHBondContact OD1-CB 3.32Å; N716-S754 PolarHBondContact OD1-OG 3.37Å; S754-H757 PolarHBondContact O-N 3.24Å; S754-A758 PolarHBondContact O-N 2.88Å
755	V	51.4	Low	55.3	Low	15 Å²	15	82.2 Å²	82.2	9%	0.091	41%	0.408	C	S	.	.	H	α-helix	trans	-66.8	-47.4	-170.3	178.1	0	0	0	0	112.3	N716 H757 A758 C759	N716-V755 WeakPolarHBondContact ND2-CG2 3.44Å; V755-H757 VanDerWaalsContact C-N 3.29Å; V755-H757 PolarHBondContact O-N 3.01Å; V755-A758 PolarHBondContact O-N 3.33Å; V755-A758 VanDerWaalsContact O-N 3.09Å; V755-C759 PolarHBondContact O-N 3.04Å; V755-C759 PolarHBondContact O-SG 3.39Å; V755-C759 VanDerWaalsContact O-SG 3.35Å
756	E	49.1	Very low	53.6	Low	121 Å²	121	82.5 Å²	82.5	57%	0.565	41%	0.407	S	S	*	.	H	α-helix	trans	-55.7	-44.1	-179.8	-66.2	-175.1	125.4	0	0	112.1	A758 C759 V760 V766	E756-A758 VanDerWaalsContact C-N 3.29Å; E756-A758 PolarHBondContact O-N 3.37Å; E756-C759 PolarHBondContact O-N 3.3Å; E756-V760 WeakPolarHBondContact O-CB 3.46Å; E756-V760 VanDerWaalsContact O-CG2 3.28Å; E756-V760 WeakPolarHBondContact O-CG2 3.49Å; E756-V760 PolarHBondContact O-N 2.67Å; E756-V766 HydrophobicContact CG-CG1 4.34Å
757	H	45.8	Very low	51.8	Low	146 Å²	146	77.8 Å²	77.8	68%	0.676	39%	0.387	S	S	*	.	H	α-helix	trans	-68.2	-28.7	-178.1	-154.8	-34.7	0	0	0	112.4	S754 V755 K761	S754-H757 PolarHBondContact O-N 3.24Å; V755-H757 VanDerWaalsContact C-N 3.29Å; V755-H757 PolarHBondContact O-N 3.01Å; H757-K761 WeakPolarHBondContact O-CB 3.41Å; H757-K761 PolarHBondContact O-N 2.89Å
758	A	49.2	Very low	49.7	Very low	18 Å²	18	79 Å²	79	15%	0.149	40%	0.402	C	S	.	.	H	α-helix	trans	-77.4	-44	172.8	0	0	0	0	0	112.3	F728 S754 V755 E756 K761 N762	F728-A758 HydrophobicContact CZ-CB 4.39Å; S754-A758 PolarHBondContact O-N 2.88Å; V755-A758 PolarHBondContact O-N 3.33Å; V755-A758 VanDerWaalsContact O-N 3.09Å; E756-A758 VanDerWaalsContact C-N 3.29Å; E756-A758 PolarHBondContact O-N 3.37Å; A758-K761 PolarHBondContact O-N 3.34Å; A758-N762 WeakPolarHBondContact O-CB 3.48Å; A758-N762 PolarHBondContact O-N 2.87Å; A758-N762 PolarHBondContact O-ND2 3.15Å
759	C	47.3	Very low	48.2	Very low	4 Å²	4	84.3 Å²	84.3	3%	0.027	43%	0.425	C	S	.	.	H	α-helix	trans	-59.2	-48.6	176.5	-68	0	0	0	0	111.8	F728 V755 E756 K761 N762 G763 M764 V766	F728-C759 WeakPolarHBondContact CE1-SG 3.45Å; V755-C759 PolarHBondContact O-N 3.04Å; V755-C759 PolarHBondContact O-SG 3.39Å; V755-C759 VanDerWaalsContact O-SG 3.35Å; E756-C759 PolarHBondContact O-N 3.3Å; C759-K761 PolarHBondContact O-N 3.4Å; C759-N762 PolarHBondContact O-N 3.44Å; C759-G763 PolarHBondContact O-N 3.31Å; C759-M764 PolarHBondContact O-N 3.36Å; C759-V766 HydrophobicContact CB-CG2 3.8Å
760	V	50.2	Low	47	Very low	93 Å²	93	86 Å²	86	56%	0.564	43%	0.434	S	S	*	.	H	α-helix	trans	-63	-41.4	178.7	171.1	0	0	0	0	111.4	E756 N762 V766	E756-V760 WeakPolarHBondContact O-CB 3.46Å; E756-V760 VanDerWaalsContact O-CG2 3.28Å; E756-V760 WeakPolarHBondContact O-CG2 3.49Å; E756-V760 PolarHBondContact O-N 2.67Å; V760-N762 VanDerWaalsContact C-N 3.31Å; V760-N762 PolarHBondContact O-N 2.95Å; V760-V766 HydrophobicContact CG2-CG2 4.26Å
761	K	47.6	Very low	45.7	Very low	173 Å²	173	83.5 Å²	83.5	75%	0.752	43%	0.431	S	S	*	.	H	α-helix	trans	-67.1	-29.3	178.5	-174.5	176.8	-179.7	-177.1	0	113.4	H757 A758 C759	H757-K761 WeakPolarHBondContact O-CB 3.41Å; H757-K761 PolarHBondContact O-N 2.89Å; A758-K761 PolarHBondContact O-N 3.34Å; C759-K761 PolarHBondContact O-N 3.4Å
762	N	48.2	Very low	44.4	Very low	52 Å²	52	85.3 Å²	85.3	28%	0.278	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	5.8	-176	-69.3	-31.1	0	0	0	114.4	L721 Q724 A758 C759 V760 M764	L721-N762 WeakPolarHBondContact CD1-OD1 3.49Å; Q724-N762 PolarHBondContact OE1-ND2 2.85Å; A758-N762 WeakPolarHBondContact O-CB 3.48Å; A758-N762 PolarHBondContact O-N 2.87Å; A758-N762 PolarHBondContact O-ND2 3.15Å; C759-N762 PolarHBondContact O-N 3.44Å; V760-N762 VanDerWaalsContact C-N 3.31Å; V760-N762 PolarHBondContact O-N 2.95Å; N762-M764 VanDerWaalsContact C-N 3.31Å; N762-M764 PolarHBondContact O-N 3.23Å
763	G	37.5	Very low	43.4	Very low	22 Å²	22	87.9 Å²	87.9	23%	0.227	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	23.5	178.7	0	0	0	0	0	114.7	C759 G795	C759-G763 PolarHBondContact O-N 3.31Å; G763-G795 VanDerWaalsContact O-CA 3.29Å; G763-G795 WeakPolarHBondContact O-CA 3.36Å
764	M	42.3	Very low	42.4	Very low	54 Å²	54	81.3 Å²	81.3	27%	0.266	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-102.9	147.9	-178.2	-70.1	-60.8	-76.7	0	0	112.2	F728 C759 N762 V766	F728-M764 HydrophobicContact CB-CE 3.64Å; F728-M764 HydrophobicContact CB-CG 4.07Å; F728-M764 HydrophobicContact CD2-CG 4.35Å; F728-M764 HydrophobicContact CG-CB 4.46Å; F728-M764 HydrophobicContact CG-CG 4.2Å; C759-M764 PolarHBondContact O-N 3.36Å; N762-M764 VanDerWaalsContact C-N 3.31Å; N762-M764 PolarHBondContact O-N 3.23Å; M764-V766 PolarHBondContact O-N 3.24Å
765	P	42.3	Very low	41.3	Very low	46 Å²	46	83.1 Å²	83.1	30%	0.299	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-64.7	128	-179.5	27.3	-35.7	0	0	0	111.6	A798	P765-A798 HydrophobicContact CB-CB 3.56Å
766	V	49.6	Very low	40.3	Very low	32 Å²	32	87.8 Å²	87.8	19%	0.194	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-75	134.8	169.7	-176.8	0	0	0	0	108.9	E756 C759 V760 M764 G768 I799	E756-V766 HydrophobicContact CG-CG1 4.34Å; C759-V766 HydrophobicContact CB-CG2 3.8Å; V760-V766 HydrophobicContact CG2-CG2 4.26Å; M764-V766 PolarHBondContact O-N 3.24Å; V766-G768 PolarHBondContact O-N 3.34Å; V766-I799 HydrophobicContact CB-CD1 3.96Å; V766-I799 HydrophobicContact CB-CG1 4.39Å; V766-I799 HydrophobicContact CG2-CD1 4.04Å
767	F	48.1	Very low	39.2	Very low	55 Å²	55	88.6 Å²	88.6	24%	0.241	52%	0.522	C	S	.	.	P	Polyproline II helix	trans	-73.4	117.1	180	-67.9	-64.2	0	0	0	111.5	M731 S735 L744	M731-F767 HydrophobicContact CB-CE2 4.12Å; M731-F767 HydrophobicContact CB-CZ 4.16Å; S735-F767 VanDerWaalsContact CB-CE1 3.46Å; L744-F767 HydrophobicContact CD1-CZ 4.44Å
768	G	38.1	Very low	38.3	Very low	46 Å²	46	85.1 Å²	85.1	47%	0.474	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-63.8	141.5	177.8	0	0	0	0	0	113.1	V766 V770	V766-G768 PolarHBondContact O-N 3.34Å; G768-V770 PolarHBondContact O-N 2.87Å; G768-V770 VanDerWaalsContact O-N 3.16Å
769	K	35.3	Very low	37.2	Very low	144 Å²	144	89.1 Å²	89.1	63%	0.626	56%	0.559	S	S	*	*			trans	-71.5	105.4	-174	-157	164.8	-159.5	148.6	0	111.2	E752 T771	E752-K769 IonicContact OE1-NZ 2.7Å; E752-K769 PolarHBondContact OE1-NZ 3.16Å; K769-T771 HydrophobicContact CG-CG2 4.45Å; K769-T771 PolarHBondContact O-N 3.46Å; K769-T771 VanDerWaalsContact O-N 3.11Å
770	V	34.1	Very low	36.3	Very low	105 Å²	105	96.9 Å²	96.9	64%	0.636	60%	0.598	S	S	*	*			trans	-76	96.9	177.1	-176.6	0	0	0	0	110.2	G768	G768-V770 PolarHBondContact O-N 2.87Å; G768-V770 VanDerWaalsContact O-N 3.16Å
771	T	33.3	Very low	35.2	Very low	115 Å²	115	100.6 Å²	100.6	71%	0.706	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-96.7	120.9	174.3	51.1	0	0	0	0	111.2	K769	K769-T771 HydrophobicContact CG-CG2 4.45Å; K769-T771 PolarHBondContact O-N 3.46Å; K769-T771 VanDerWaalsContact O-N 3.11Å
772	N	32	Very low	34.2	Very low	144 Å²	144	98 Å²	98	77%	0.77	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-75.8	158.8	164.8	-71.8	11.6	0	0	0	110.5	A774	N772-A774 PolarHBondContact O-N 2.95Å
773	D	27.6	Very low	33.2	Very low	167 Å²	167	100.4 Å²	100.4	89%	0.893	64%	0.64	S	S	*	*	S	Bend	trans	-58.5	116.4	-165.1	-52.6	-85.2	0	0	0	116.3
774	A	30.9	Very low	32.7	Very low	98 Å²	98	104.7 Å²	104.7	81%	0.81	67%	0.667	S	S	*	*			trans	-161.9	123.7	146.3	0	0	0	0	0	110.7	N772	N772-A774 PolarHBondContact O-N 2.95Å
775	A	26.9	Very low	32	Very low	95 Å²	95	109.1 Å²	109.1	79%	0.785	70%	0.696	S	S	*	*			trans	-72.5	164.3	166.4	0	0	0	0	0	110.7
776	P	31.3	Very low	31.4	Very low	114 Å²	114	114.2 Å²	114.2	74%	0.74	72%	0.721	S	S	*	*			cis	-139.6	172.1	18.6	43.6	-26	0	0	0	117.8
777	T	26.3	Very low	30.4	Very low	138 Å²	138	124.4 Å²	124.4	85%	0.847	76%	0.756	S	S	*	*			trans	2.5	123	154.1	58.7	0	0	0	0	119.8
778	G	26	Very low	29.4	Very low	73 Å²	73	126.1 Å²	126.1	75%	0.753	78%	0.78	S	S	*	*			trans	156.7	121.4	153	0	0	0	0	0	115.9
779	A	26.9	Very low	29.2	Very low	102 Å²	102	133.2 Å²	133.2	84%	0.843	80%	0.801	S	S	*	*			trans	64.5	158.5	-179.2	0	0	0	0	0	113.5
780	I	28.4	Very low	28.8	Very low	166 Å²	166	132.3 Å²	132.3	85%	0.851	81%	0.807	S	S	*	*			cis	-129.7	141.8	25.4	-70.4	163.3	0	0	0	111.7
781	Q	27.4	Very low	28.7	Very low	172 Å²	172	134.6 Å²	134.6	80%	0.804	82%	0.816	S	S	*	*			trans	-90.2	147.9	168.6	-66.6	176.6	-50.6	0	0	111.4
782	S	25.4	Very low	28.7	Very low	117 Å²	117	136 Å²	136	82%	0.818	82%	0.824	S	S	*	*			trans	46.2	107.1	150	61.4	0	0	0	0	119.2
783	A	27.4	Very low	28.7	Very low	103 Å²	103	133.7 Å²	133.7	85%	0.851	82%	0.817	S	S	*	*			trans	-120.5	127.7	151.8	0	0	0	0	0	109.2
784	S	26.1	Very low	29	Very low	113 Å²	113	133.7 Å²	133.7	79%	0.79	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-87.1	131.8	-172.8	55.5	0	0	0	0	113
785	V	28.4	Very low	29.1	Very low	146 Å²	146	129.8 Å²	129.8	89%	0.885	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-91.5	126.2	167.9	-178	0	0	0	0	109.5
786	N	30.9	Very low	29.3	Very low	153 Å²	153	128.4 Å²	128.4	82%	0.818	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-85.6	150	177.8	-102	-37.8	0	0	0	112.1	A788	N786-A788 PolarHBondContact O-N 3.39Å
787	R	26.6	Very low	29.4	Very low	247 Å²	247	126.2 Å²	126.2	93%	0.932	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-70.4	122.4	175.8	-69.1	170.9	167.5	160.4	-6.1	111.6
788	A	28.8	Very low	29.8	Very low	91 Å²	91	121.5 Å²	121.5	75%	0.752	72%	0.723	S	S	*	*			trans	-173.7	159.4	132.6	0	0	0	0	0	111.9	N786	N786-A788 PolarHBondContact O-N 3.39Å
789	E	33.1	Very low	30.2	Very low	195 Å²	195	122 Å²	122	91%	0.911	71%	0.708	S	S	*	*			trans	68.8	122.8	163.6	-49.7	-161.1	160.7	0	0	119.2
790	T	27.8	Very low	30.4	Very low	124 Å²	124	122.5 Å²	122.5	76%	0.761	70%	0.695	S	S	*	*			trans	-98.1	134.3	-178.9	49.5	0	0	0	0	111.2
791	N	31.5	Very low	30.6	Very low	153 Å²	153	116.2 Å²	116.2	82%	0.818	67%	0.672	S	S	*	*			trans	165.4	141.3	134.8	-86.3	-32.8	0	0	0	113.5
792	V	32.6	Very low	30.9	Very low	144 Å²	144	111.5 Å²	111.5	87%	0.873	66%	0.658	S	S	*	*			trans	72.4	146.9	161.8	176	0	0	0	0	116.9
793	P	33.1	Very low	30.9	Very low	97 Å²	97	111 Å²	111	63%	0.63	65%	0.645	S	S	*	*			trans	-127	-170.8	-152.1	36.6	-16.9	0	0	0	117.6
794	Q	34.1	Very low	30.9	Very low	167 Å²	167	111.8 Å²	111.8	78%	0.78	64%	0.644	S	S	*	*			trans	102.2	-6.7	160	-60.6	-174.3	-10.4	0	0	121.4
795	G	32.7	Very low	31.1	Very low	16 Å²	16	111.7 Å²	111.7	17%	0.165	63%	0.634	C	S	.	*			trans	-78.8	-31.3	-171.6	0	0	0	0	0	119.6	G763 T797	G763-G795 VanDerWaalsContact O-CA 3.29Å; G763-G795 WeakPolarHBondContact O-CA 3.36Å; G795-T797 PolarHBondContact O-N 3.46Å
796	T	31.6	Very low	31	Very low	65 Å²	65	110.8 Å²	110.8	40%	0.399	63%	0.629	S	S	.	*	G	3₁₀ helix	trans	-79.7	-16.6	-163.3	40.8	0	0	0	0	115.8	A798 I799	T796-A798 PolarHBondContact O-N 3.36Å; T796-A798 VanDerWaalsContact O-N 3.1Å; T796-I799 PolarHBondContact O-N 3.39Å
797	T	32.8	Very low	31.2	Very low	68 Å²	68	108.6 Å²	108.6	42%	0.417	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-69.4	-9.5	-169.3	43.3	0	0	0	0	115.8	G795 N835	G795-T797 PolarHBondContact O-N 3.46Å; T797-N835 HydrophobicContact CG2-CB 4.31Å
798	A	33.7	Very low	31.8	Very low	40 Å²	40	100.4 Å²	100.4	33%	0.331	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-83.1	-33.9	180	0	0	0	0	0	113.8	P765 T796 L800 G801 S802	P765-A798 HydrophobicContact CB-CB 3.56Å; T796-A798 PolarHBondContact O-N 3.36Å; T796-A798 VanDerWaalsContact O-N 3.1Å; A798-L800 PolarHBondContact O-N 2.9Å; A798-G801 PolarHBondContact O-N 3.49Å; A798-S802 PolarHBondContact O-N 2.97Å; A798-S802 PolarHBondContact O-OG 3.33Å
799	I	34.3	Very low	32.7	Very low	84 Å²	84	100.7 Å²	100.7	43%	0.431	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.5	-35.2	-162.9	-59.4	173.8	0	0	0	112.1	V766 T796 S802	V766-I799 HydrophobicContact CB-CD1 3.96Å; V766-I799 HydrophobicContact CB-CG1 4.39Å; V766-I799 HydrophobicContact CG2-CD1 4.04Å; T796-I799 PolarHBondContact O-N 3.39Å; I799-S802 PolarHBondContact O-OG 2.9Å; I799-S802 VanDerWaalsContact O-OG 3.06Å
800	L	32.2	Very low	33.4	Very low	112 Å²	112	97.9 Å²	97.9	59%	0.586	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-24.9	174.3	-71.6	168	0	0	0	113	A798 S802	A798-L800 PolarHBondContact O-N 2.9Å; L800-S802 VanDerWaalsContact C-N 3.28Å; L800-S802 PolarHBondContact O-N 3.45Å
801	G	32.7	Very low	34.4	Very low	34 Å²	34	99.6 Å²	99.6	35%	0.351	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.1	-17.4	179.4	0	0	0	0	0	114.4	A798	A798-G801 PolarHBondContact O-N 3.49Å
802	S	32.2	Very low	35.4	Very low	73 Å²	73	94.4 Å²	94.4	51%	0.51	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.8	6.4	-172.6	50.3	0	0	0	0	115.8	A798 I799 L800 S804	A798-S802 PolarHBondContact O-N 2.97Å; A798-S802 PolarHBondContact O-OG 3.33Å; I799-S802 PolarHBondContact O-OG 2.9Å; I799-S802 VanDerWaalsContact O-OG 3.06Å; L800-S802 VanDerWaalsContact C-N 3.28Å; L800-S802 PolarHBondContact O-N 3.45Å; S802-S804 PolarHBondContact O-N 3.41Å
803	L	27.5	Very low	36.2	Very low	107 Å²	107	89.2 Å²	89.2	56%	0.56	52%	0.524	S	S	*	.			trans	-70.5	124.7	169.4	-75.1	170.6	0	0	0	110	L805	L803-L805 PolarHBondContact O-N 3.05Å
804	S	27.3	Very low	37.1	Very low	118 Å²	118	87 Å²	87	83%	0.825	51%	0.514	S	S	*	.			trans	-89.1	87.8	-179.5	175.8	0	0	0	0	110.3	S802	S802-S804 PolarHBondContact O-N 3.41Å
805	L	28.7	Very low	38.1	Very low	112 Å²	112	82.8 Å²	82.8	59%	0.586	50%	0.5	S	S	*	.			trans	-112.6	123.3	169.6	-71.4	173.9	0	0	0	110.3	L803 E812	L803-L805 PolarHBondContact O-N 3.05Å; L805-E812 HydrophobicContact CD1-CG 4.26Å
806	T	27.7	Very low	39	Very low	127 Å²	127	82.5 Å²	82.5	78%	0.779	49%	0.494	S	S	*	.	S	Bend	trans	-84	136.2	163.9	49.7	0	0	0	0	108.5
807	T	34.4	Very low	40	Very low	107 Å²	107	82.3 Å²	82.3	66%	0.656	49%	0.491	S	S	*	.	S	Bend	trans	65.6	140.5	-163.7	63.4	0	0	0	0	114.3	D809	T807-D809 WeakPolarHBondContact CB-OD1 3.46Å; T807-D809 PolarHBondContact O-N 3.19Å; T807-D809 PolarHBondContact OG1-OD1 3.15Å
808	A	38.8	Very low	41.1	Very low	75 Å²	75	85.2 Å²	85.2	62%	0.62	50%	0.5	S	S	*	.			trans	-96	87.1	178.3	0	0	0	0	0	107.3
809	D	47.9	Very low	42	Very low	96 Å²	96	86.8 Å²	86.8	51%	0.513	50%	0.502	S	S	.	.			trans	-84.4	153.5	-173.9	-63.3	6.9	0	0	0	110.3	T807 E811 E812	T807-D809 WeakPolarHBondContact CB-OD1 3.46Å; T807-D809 PolarHBondContact O-N 3.19Å; T807-D809 PolarHBondContact OG1-OD1 3.15Å; D809-E811 PolarHBondContact O-N 3.25Å; D809-E812 PolarHBondContact O-N 3.13Å; D809-E812 VanDerWaalsContact O-N 3.08Å
810	D	48.1	Very low	42.9	Very low	137 Å²	137	85.2 Å²	85.2	73%	0.733	50%	0.496	S	S	*	.	H	α-helix	trans	-54.9	-18	-175.1	-67	-53.5	0	0	0	114.3	L813 A814	D810-L813 PolarHBondContact O-N 3.09Å; D810-A814 PolarHBondContact O-N 3.02Å
811	E	48.3	Very low	43.8	Very low	160 Å²	160	82.9 Å²	82.9	75%	0.748	50%	0.5	S	S	*	.	H	α-helix	trans	-70.2	-30.7	179.2	-163	164.8	-142.7	0	0	113.5	D809 T815	D809-E811 PolarHBondContact O-N 3.25Å; E811-T815 WeakPolarHBondContact O-CB 3.36Å; E811-T815 PolarHBondContact O-N 3.22Å; E811-T815 VanDerWaalsContact O-N 3.07Å; E811-T815 PolarHBondContact O-OG1 2.9Å
812	E	53	Low	44.6	Very low	44 Å²	44	87.6 Å²	87.6	21%	0.206	52%	0.517	C	S	.	.	H	α-helix	trans	-65.2	-42.2	171.3	-76.8	-160	146.6	0	0	110.5	L805 D809 T815 L816 R843	L805-E812 HydrophobicContact CD1-CG 4.26Å; D809-E812 PolarHBondContact O-N 3.13Å; D809-E812 VanDerWaalsContact O-N 3.08Å; E812-T815 PolarHBondContact O-N 3.07Å; E812-L816 WeakPolarHBondContact O-CG 3.27Å; E812-L816 PolarHBondContact O-N 3.44Å; E812-L816 VanDerWaalsContact O-N 3.12Å; E812-R843 IonicContact OE1-NH1 3.01Å; E812-R843 IonicContact OE2-NH1 3.68Å; E812-R843 PolarHBondContact OE2-NH1 3.27Å
813	L	49.3	Very low	45.1	Very low	35 Å²	35	86.6 Å²	86.6	18%	0.183	51%	0.51	C	S	.	.	H	α-helix	trans	-65.6	-45.5	177	-84.4	162.8	0	0	0	112.1	D810 T815 L816 D817	D810-L813 PolarHBondContact O-N 3.09Å; L813-T815 PolarHBondContact O-N 3.49Å; L813-L816 PolarHBondContact O-N 3.45Å; L813-L816 VanDerWaalsContact O-N 3.14Å; L813-D817 PolarHBondContact O-N 2.94Å; L813-D817 VanDerWaalsContact O-N 3.16Å
814	A	52.9	Low	46.1	Very low	50 Å²	50	86.5 Å²	86.5	41%	0.413	52%	0.524	S	S	.	.	H	α-helix	trans	-62.7	-27.7	176.4	0	0	0	0	0	113.1	D810 Q818	D810-A814 PolarHBondContact O-N 3.02Å; A814-Q818 WeakPolarHBondContact O-CG 3.14Å; A814-Q818 PolarHBondContact O-NE2 2.95Å
815	T	55.2	Low	47.7	Very low	78 Å²	78	86.6 Å²	86.6	48%	0.479	52%	0.516	S	S	.	.	H	α-helix	trans	-76.2	-35.4	175	-57.1	0	0	0	0	111.8	E811 E812 L813 Q818 L819	E811-T815 WeakPolarHBondContact O-CB 3.36Å; E811-T815 PolarHBondContact O-N 3.22Å; E811-T815 VanDerWaalsContact O-N 3.07Å; E811-T815 PolarHBondContact O-OG1 2.9Å; E812-T815 PolarHBondContact O-N 3.07Å; L813-T815 PolarHBondContact O-N 3.49Å; T815-Q818 PolarHBondContact O-N 2.96Å; T815-L819 PolarHBondContact O-N 3.03Å
816	L	50.5	Low	49.5	Very low	11 Å²	11	84.5 Å²	84.5	6%	0.058	51%	0.51	C	S	.	.	H	α-helix	trans	-67	-42.7	176.2	-72.2	166.1	0	0	0	112.5	E812 L813 Q818 L819 V833 M840	E812-L816 WeakPolarHBondContact O-CG 3.27Å; E812-L816 PolarHBondContact O-N 3.44Å; E812-L816 VanDerWaalsContact O-N 3.12Å; L813-L816 PolarHBondContact O-N 3.45Å; L813-L816 VanDerWaalsContact O-N 3.14Å; L816-Q818 VanDerWaalsContact C-N 3.26Å; L816-Q818 PolarHBondContact O-N 2.95Å; L816-L819 HydrophobicContact CD2-CD1 4.5Å; L816-L819 WeakPolarHBondContact O-CB 3.24Å; L816-L819 PolarHBondContact O-N 2.84Å; L816-L819 VanDerWaalsContact O-N 3.12Å; L816-V833 HydrophobicContact CD2-CB 4.46Å; L816-V833 HydrophobicContact CD2-CG1 4.4Å; L816-V833 HydrophobicContact CD2-CG2 4Å; L816-M840 HydrophobicContact CD1-CE 3.97Å
817	D	52.4	Low	51.7	Low	60 Å²	60	83.8 Å²	83.8	32%	0.321	50%	0.497	S	S	.	.	H	α-helix	trans	-61.9	-33.5	177	-77.7	-2.7	0	0	0	112	L813 L819 V820 G821 T853 Q856	L813-D817 PolarHBondContact O-N 2.94Å; L813-D817 VanDerWaalsContact O-N 3.16Å; D817-L819 VanDerWaalsContact C-N 3.33Å; D817-L819 PolarHBondContact O-N 3.23Å; D817-V820 PolarHBondContact O-N 2.87Å; D817-G821 PolarHBondContact O-N 2.93Å; D817-T853 PolarHBondContact OD1-OG1 3.46Å; D817-T853 WeakPolarHBondContact OD2-CG2 3.45Å; D817-Q856 PolarHBondContact OD1-NE2 2.94Å
818	Q	56.7	Low	53.6	Low	130 Å²	130	83.9 Å²	83.9	61%	0.607	49%	0.488	S	S	*	.	H	α-helix	trans	-68.4	-26.5	175.5	-74	-178.6	53.6	0	0	113.9	A814 T815 L816 N822	A814-Q818 WeakPolarHBondContact O-CG 3.14Å; A814-Q818 PolarHBondContact O-NE2 2.95Å; T815-Q818 PolarHBondContact O-N 2.96Å; L816-Q818 VanDerWaalsContact C-N 3.26Å; L816-Q818 PolarHBondContact O-N 2.95Å; Q818-N822 PolarHBondContact O-ND2 3.49Å
819	L	51.1	Low	55.2	Low	72 Å²	72	80.6 Å²	80.6	38%	0.377	46%	0.461	S	S	.	.	H	α-helix	trans	-70.6	-37.2	176.4	-79.8	162.1	0	0	0	111.9	T815 L816 D817 V833	T815-L819 PolarHBondContact O-N 3.03Å; L816-L819 HydrophobicContact CD2-CD1 4.5Å; L816-L819 WeakPolarHBondContact O-CB 3.24Å; L816-L819 PolarHBondContact O-N 2.84Å; L816-L819 VanDerWaalsContact O-N 3.12Å; D817-L819 VanDerWaalsContact C-N 3.33Å; D817-L819 PolarHBondContact O-N 3.23Å; L819-V833 HydrophobicContact CB-CG2 4.23Å
820	V	54.7	Low	56.6	Low	51 Å²	51	78.2 Å²	78.2	31%	0.309	45%	0.446	S	S	.	.	H	α-helix	trans	-65.1	-40.6	177.7	-172.9	0	0	0	0	111.1	D817 N822 V833 M859	D817-V820 PolarHBondContact O-N 2.87Å; V820-N822 PolarHBondContact O-N 3.03Å; V820-V833 HydrophobicContact CG2-CG2 4.11Å; V820-M859 HydrophobicContact CG1-CE 4.3Å; V820-M859 HydrophobicContact CG2-CE 3.42Å; V820-M859 VanDerWaalsContact CG2-CE 3.42Å
821	G	49.8	Very low	58.1	Low	64 Å²	64	74.9 Å²	74.9	66%	0.66	43%	0.429	S	S	*	.	H	α-helix	trans	-75.3	-13	-174.8	0	0	0	0	0	116.8	D817	D817-G821 PolarHBondContact O-N 2.93Å
822	N	50	Low	59.4	Low	132 Å²	132	69.2 Å²	69.2	71%	0.706	40%	0.403	S	S	*	.	H	α-helix	trans	-125.7	-1.2	-164.8	-70.4	-70.4	0	0	0	116.1	Q818 V820	Q818-N822 PolarHBondContact O-ND2 3.49Å; V820-N822 PolarHBondContact O-N 3.03Å
823	S	42.6	Very low	60.7	Low	52 Å²	52	67.1 Å²	67.1	36%	0.364	39%	0.393	S	S	.	.			trans	-86.2	137.3	-176.9	-170.1	0	0	0	0	113.7	D825 A829	S823-D825 VanDerWaalsContact OG-C 3.25Å; S823-D825 PolarHBondContact OG-N 2.86Å; S823-D825 PolarHBondContact OG-O 2.98Å; S823-A829 VanDerWaalsContact CB-CB 3.47Å
824	A	49.5	Very low	62.4	Low	105 Å²	105	65.4 Å²	65.4	87%	0.868	39%	0.385	S	S	*	.	S	Bend	trans	-79.8	-23	168.8	0	0	0	0	0	113.2
825	D	60.3	Low	63.9	Low	120 Å²	120	64.2 Å²	64.2	64%	0.642	37%	0.371	S	S	*	.	S	Bend	trans	-105.2	88.2	166.7	-79.1	-48.9	0	0	0	107.5	S823 K827 K828 A829	S823-D825 VanDerWaalsContact OG-C 3.25Å; S823-D825 PolarHBondContact OG-N 2.86Å; S823-D825 PolarHBondContact OG-O 2.98Å; D825-K827 PolarHBondContact O-N 3.37Å; D825-K828 HydrophobicContact CB-CB 4.01Å; D825-K828 PolarHBondContact O-N 3.27Å; D825-A829 PolarHBondContact O-N 3.29Å
826	S	67.6	Low	65.1	Low	68 Å²	68	62.1 Å²	62.1	48%	0.476	36%	0.36	S	S	.	.	H	α-helix	trans	-58.7	-51	-173.5	81.9	0	0	0	0	110.9	K828 A829 E830	S826-K828 PolarHBondContact O-N 2.91Å; S826-A829 PolarHBondContact O-N 3.46Å; S826-E830 VanDerWaalsContact C-CD 3.4Å; S826-E830 WeakPolarHBondContact CB-OE1 3.38Å; S826-E830 VanDerWaalsContact O-CG 3.24Å; S826-E830 WeakPolarHBondContact O-CG 3.28Å; S826-E830 PolarHBondContact O-N 3.26Å; S826-E830 PolarHBondContact OG-OE1 3.33Å
827	K	72.4	Confident	66.8	Low	113 Å²	113	61.6 Å²	61.6	49%	0.491	36%	0.357	S	S	.	.	H	α-helix	trans	-57.3	-25.2	179.9	-166.2	166.9	-172	171.6	0	114.7	D825 E830 L831 D866	D825-K827 PolarHBondContact O-N 3.37Å; K827-E830 WeakPolarHBondContact CA-OE2 3.39Å; K827-E830 PolarHBondContact N-OE1 3.03Å; K827-L831 VanDerWaalsContact O-CB 3.23Å; K827-L831 WeakPolarHBondContact O-CB 3.43Å; K827-L831 PolarHBondContact O-N 2.94Å; K827-L831 VanDerWaalsContact O-N 3.16Å; K827-D866 VanDerWaalsContact CE-OD2 3.26Å; K827-D866 WeakPolarHBondContact CE-OD2 3.22Å; K827-D866 IonicContact NZ-OD1 3.51Å; K827-D866 IonicContact NZ-OD2 2.8Å; K827-D866 PolarHBondContact NZ-OD2 2.82Å
828	K	73.8	Confident	68.2	Low	108 Å²	108	59.5 Å²	59.5	47%	0.47	35%	0.347	S	S	.	.	H	α-helix	trans	-74.3	-48.8	172.3	-174.8	-177.4	172.8	-173.8	0	111.2	D825 S826 L831 D832	D825-K828 HydrophobicContact CB-CB 4.01Å; D825-K828 PolarHBondContact O-N 3.27Å; S826-K828 PolarHBondContact O-N 2.91Å; K828-L831 PolarHBondContact O-N 3.46Å; K828-D832 PolarHBondContact O-N 3.21Å
829	A	72.7	Confident	69.2	Low	7 Å²	7	55.7 Å²	55.7	6%	0.058	33%	0.331	C	S	.	.	H	α-helix	trans	-65.5	-39.9	178.9	0	0	0	0	0	111.9	S823 D825 S826 L831 D832 V833	S823-A829 VanDerWaalsContact CB-CB 3.47Å; D825-A829 PolarHBondContact O-N 3.29Å; S826-A829 PolarHBondContact O-N 3.46Å; A829-L831 VanDerWaalsContact C-N 3.32Å; A829-L831 PolarHBondContact O-N 3.36Å; A829-D832 PolarHBondContact O-N 2.82Å; A829-V833 WeakPolarHBondContact O-CG2 3.19Å; A829-V833 PolarHBondContact O-N 3.27Å
830	E	77.7	Confident	70.5	Confident	45 Å²	45	53 Å²	53	21%	0.21	32%	0.316	C	S	.	.	H	α-helix	trans	-56.8	-44.5	170.9	-63	154.9	-151.9	0	0	111	S826 K827 V833 L834 M859 F863	S826-E830 VanDerWaalsContact C-CD 3.4Å; S826-E830 WeakPolarHBondContact CB-OE1 3.38Å; S826-E830 VanDerWaalsContact O-CG 3.24Å; S826-E830 WeakPolarHBondContact O-CG 3.28Å; S826-E830 PolarHBondContact O-N 3.26Å; S826-E830 PolarHBondContact OG-OE1 3.33Å; K827-E830 WeakPolarHBondContact CA-OE2 3.39Å; K827-E830 PolarHBondContact N-OE1 3.03Å; E830-V833 PolarHBondContact O-N 2.82Å; E830-L834 WeakPolarHBondContact O-CB 3.3Å; E830-L834 PolarHBondContact O-N 3.46Å; E830-M859 HydrophobicContact CB-CE 4.27Å; E830-M859 HydrophobicContact CB-CG 4.02Å; E830-M859 HydrophobicContact CB-SD 4.02Å; E830-M859 HydrophobicContact CG-CE 4.27Å; E830-M859 HydrophobicContact CG-CG 4.18Å; E830-F863 HydrophobicContact CB-CE1 4.23Å; E830-F863 HydrophobicContact CB-CE2 3.94Å; E830-F863 HydrophobicContact CB-CZ 3.4Å; E830-F863 VanDerWaalsContact CB-CZ 3.4Å
831	L	80.3	Confident	71.7	Confident	68 Å²	68	51.7 Å²	51.7	36%	0.356	31%	0.308	S	S	.	.	H	α-helix	trans	-68.1	-39.3	177.7	179.6	63.9	0	0	0	112.5	K827 K828 A829 L834 N835 L871	K827-L831 VanDerWaalsContact O-CB 3.23Å; K827-L831 WeakPolarHBondContact O-CB 3.43Å; K827-L831 PolarHBondContact O-N 2.94Å; K827-L831 VanDerWaalsContact O-N 3.16Å; K828-L831 PolarHBondContact O-N 3.46Å; A829-L831 VanDerWaalsContact C-N 3.32Å; A829-L831 PolarHBondContact O-N 3.36Å; L831-L834 HydrophobicContact CD1-CD2 4.44Å; L831-L834 PolarHBondContact O-N 3.02Å; L831-N835 PolarHBondContact O-N 2.89Å; L831-N835 PolarHBondContact O-ND2 3.28Å; L831-L871 HydrophobicContact CD1-CD1 3.57Å
832	D	75.6	Confident	72.9	Confident	40 Å²	40	55.6 Å²	55.6	21%	0.214	31%	0.307	C	S	.	.	H	α-helix	trans	-64.9	-39.4	175.5	-74.1	-35.6	0	0	0	110.7	K828 A829 N835 S836	K828-D832 PolarHBondContact O-N 3.21Å; A829-D832 PolarHBondContact O-N 2.82Å; D832-N835 PolarHBondContact O-N 3.3Å; D832-S836 PolarHBondContact O-N 2.65Å
833	V	79.5	Confident	73.7	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.8	-43	171.4	172.3	0	0	0	0	111.8	L816 L819 V820 A829 E830 N835 S836 L837 M859	L816-V833 HydrophobicContact CD2-CB 4.46Å; L816-V833 HydrophobicContact CD2-CG1 4.4Å; L816-V833 HydrophobicContact CD2-CG2 4Å; L819-V833 HydrophobicContact CB-CG2 4.23Å; V820-V833 HydrophobicContact CG2-CG2 4.11Å; A829-V833 WeakPolarHBondContact O-CG2 3.19Å; A829-V833 PolarHBondContact O-N 3.27Å; E830-V833 PolarHBondContact O-N 2.82Å; V833-N835 VanDerWaalsContact C-N 3.3Å; V833-N835 PolarHBondContact O-N 3.05Å; V833-S836 WeakPolarHBondContact O-CB 3.26Å; V833-S836 PolarHBondContact O-N 3.08Å; V833-S836 VanDerWaalsContact O-N 3.08Å; V833-L837 HydrophobicContact CG1-CD1 3.92Å; V833-L837 HydrophobicContact CG1-CG 4.45Å; V833-L837 PolarHBondContact O-N 2.72Å; V833-M859 HydrophobicContact CB-CE 3.89Å; V833-M859 HydrophobicContact CB-SD 4.06Å; V833-M859 HydrophobicContact CG1-CE 3.73Å; V833-M859 HydrophobicContact CG1-SD 3.89Å; V833-M859 HydrophobicContact CG2-CE 4.34Å
834	L	85.9	Confident	74.9	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-39.1	175.7	-169.1	75.2	0	0	0	112.1	E830 L831 C838 L860 F863 L871 R874 I878	E830-L834 WeakPolarHBondContact O-CB 3.3Å; E830-L834 PolarHBondContact O-N 3.46Å; L831-L834 HydrophobicContact CD1-CD2 4.44Å; L831-L834 PolarHBondContact O-N 3.02Å; L834-C838 WeakPolarHBondContact O-CB 3.49Å; L834-C838 PolarHBondContact O-N 3.19Å; L834-C838 PolarHBondContact O-SG 3.36Å; L834-L860 HydrophobicContact CD1-CD2 3.72Å; L834-F863 HydrophobicContact CB-CE2 3.89Å; L834-F863 HydrophobicContact CD1-CD2 3.88Å; L834-F863 HydrophobicContact CD1-CE2 4.1Å; L834-F863 HydrophobicContact CD2-CD2 4.08Å; L834-F863 HydrophobicContact CD2-CE2 4.02Å; L834-F863 HydrophobicContact CG-CD2 4.39Å; L834-F863 HydrophobicContact CG-CE2 4.23Å; L834-L871 HydrophobicContact CD2-CD1 3.42Å; L834-L871 VanDerWaalsContact CD2-CD1 3.42Å; L834-L871 HydrophobicContact CD2-CG 4.08Å; L834-R874 HydrophobicContact CD2-CB 4.14Å; L834-I878 HydrophobicContact CD1-CD1 3.45Å; L834-I878 VanDerWaalsContact CD1-CD1 3.45Å; L834-I878 HydrophobicContact CG-CD1 4.05Å
835	N	83.9	Confident	75.3	Confident	24 Å²	24	53.1 Å²	53.1	13%	0.128	28%	0.278	C	S	.	.	H	α-helix	trans	-68.5	-34.7	174.9	-73.7	-59.5	0	0	0	112	T797 L831 D832 V833 C838 N839 R874	T797-N835 HydrophobicContact CG2-CB 4.31Å; L831-N835 PolarHBondContact O-N 2.89Å; L831-N835 PolarHBondContact O-ND2 3.28Å; D832-N835 PolarHBondContact O-N 3.3Å; V833-N835 VanDerWaalsContact C-N 3.3Å; V833-N835 PolarHBondContact O-N 3.05Å; N835-C838 WeakPolarHBondContact O-CB 3.47Å; N835-N839 VanDerWaalsContact O-CG 3.28Å; N835-N839 PolarHBondContact O-N 2.91Å; N835-N839 VanDerWaalsContact O-N 3.12Å; N835-N839 PolarHBondContact O-ND2 3.46Å; N835-R874 PolarHBondContact OD1-NH1 3.1Å
836	S	81.1	Confident	74.8	Confident	35 Å²	35	54.6 Å²	54.6	25%	0.245	29%	0.286	C	S	.	.	H	α-helix	trans	-65.3	-49	172.2	-164.1	0	0	0	0	111.7	D832 V833 C838 N839 M840	D832-S836 PolarHBondContact O-N 2.65Å; V833-S836 WeakPolarHBondContact O-CB 3.26Å; V833-S836 PolarHBondContact O-N 3.08Å; V833-S836 VanDerWaalsContact O-N 3.08Å; S836-C838 VanDerWaalsContact C-N 3.33Å; S836-C838 PolarHBondContact O-N 2.75Å; S836-N839 CarbonylContact O-C 3.59Å; S836-N839 WeakPolarHBondContact O-CA 3.43Å; S836-N839 WeakPolarHBondContact O-CB 3.45Å; S836-N839 PolarHBondContact O-N 2.88Å; S836-M840 PolarHBondContact O-N 2.9Å
837	L	84.7	Confident	74.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-55.4	-45.1	173.4	-74.2	161	0	0	0	111.6	V833 N839 M840 V841 F850 I878	V833-L837 HydrophobicContact CG1-CD1 3.92Å; V833-L837 HydrophobicContact CG1-CG 4.45Å; V833-L837 PolarHBondContact O-N 2.72Å; L837-N839 PolarHBondContact O-N 3.38Å; L837-M840 HydrophobicContact CD2-CE 3.68Å; L837-M840 HydrophobicContact CG-CE 4.3Å; L837-M840 PolarHBondContact O-N 3.2Å; L837-V841 WeakPolarHBondContact O-CG2 3.47Å; L837-V841 PolarHBondContact O-N 3.44Å; L837-F850 HydrophobicContact CD2-CE2 4.07Å; L837-I878 HydrophobicContact CB-CD1 3.56Å; L837-I878 HydrophobicContact CB-CG1 4.04Å; L837-I878 HydrophobicContact CB-CG2 4.09Å; L837-I878 HydrophobicContact CD1-CG2 4.45Å; L837-I878 HydrophobicContact CD2-CG2 4.32Å
838	C	83.1	Confident	73.5	Confident	15 Å²	15	54.8 Å²	54.8	10%	0.101	30%	0.298	C	S	.	.	H	α-helix	trans	-57.3	-34.4	173.3	-74.7	0	0	0	0	113.1	L834 N835 S836 K842	L834-C838 WeakPolarHBondContact O-CB 3.49Å; L834-C838 PolarHBondContact O-N 3.19Å; L834-C838 PolarHBondContact O-SG 3.36Å; N835-C838 WeakPolarHBondContact O-CB 3.47Å; S836-C838 VanDerWaalsContact C-N 3.33Å; S836-C838 PolarHBondContact O-N 2.75Å; C838-K842 WeakPolarHBondContact O-CD 3.46Å; C838-K842 VanDerWaalsContact O-CG 3.27Å; C838-K842 WeakPolarHBondContact O-CG 3.33Å; C838-K842 PolarHBondContact O-N 3.26Å
839	N	77	Confident	73.2	Confident	50 Å²	50	53.9 Å²	53.9	27%	0.267	30%	0.303	S	S	.	.	H	α-helix	trans	-80.1	-35.8	178.9	-69.8	-23.5	0	0	0	111.8	N835 S836 L837 K842 R843	N835-N839 VanDerWaalsContact O-CG 3.28Å; N835-N839 PolarHBondContact O-N 2.91Å; N835-N839 VanDerWaalsContact O-N 3.12Å; N835-N839 PolarHBondContact O-ND2 3.46Å; S836-N839 CarbonylContact O-C 3.59Å; S836-N839 WeakPolarHBondContact O-CA 3.43Å; S836-N839 WeakPolarHBondContact O-CB 3.45Å; S836-N839 PolarHBondContact O-N 2.88Å; L837-N839 PolarHBondContact O-N 3.38Å; N839-K842 PolarHBondContact O-N 3.16Å; N839-K842 PolarHBondContact OD1-NZ 3.32Å; N839-R843 WeakPolarHBondContact O-CG 3.28Å; N839-R843 PolarHBondContact O-N 3.4Å
840	M	79.2	Confident	73.5	Confident	15 Å²	15	54.3 Å²	54.3	7%	0.074	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-44.6	170.6	-66.1	-164.6	-65.2	0	0	111.4	L816 S836 L837 K842 R843 N844	L816-M840 HydrophobicContact CD1-CE 3.97Å; S836-M840 PolarHBondContact O-N 2.9Å; L837-M840 HydrophobicContact CD2-CE 3.68Å; L837-M840 HydrophobicContact CG-CE 4.3Å; L837-M840 PolarHBondContact O-N 3.2Å; M840-K842 VanDerWaalsContact C-N 3.3Å; M840-K842 PolarHBondContact O-N 3.12Å; M840-R843 PolarHBondContact O-N 3.14Å; M840-N844 WeakPolarHBondContact O-CB 3.45Å; M840-N844 PolarHBondContact O-N 3.42Å
841	V	78.8	Confident	73.8	Confident	24 Å²	24	55 Å²	55	15%	0.145	31%	0.309	C	S	.	.	H	α-helix	trans	-58.2	-40.2	174.4	172.5	0	0	0	0	112.1	L837 N844 A845 F850 I877 I878 A881	L837-V841 WeakPolarHBondContact O-CG2 3.47Å; L837-V841 PolarHBondContact O-N 3.44Å; V841-N844 PolarHBondContact O-N 2.88Å; V841-A845 PolarHBondContact O-N 3.36Å; V841-F850 HydrophobicContact CG2-CE1 3.69Å; V841-F850 HydrophobicContact CG2-CZ 3.58Å; V841-I877 HydrophobicContact CG1-CG2 4.27Å; V841-I878 HydrophobicContact CG2-CG1 4.16Å; V841-A881 HydrophobicContact CB-CB 4.37Å; V841-A881 HydrophobicContact CG1-CB 3.68Å; V841-A881 HydrophobicContact CG2-CB 3.76Å
842	K	75.3	Confident	74.2	Confident	146 Å²	146	52.1 Å²	52.1	64%	0.635	29%	0.293	S	S	*	.	H	α-helix	trans	-69.7	-40.1	175.7	-70.5	167	-167.3	165.8	0	113.2	C838 N839 M840 N844	C838-K842 WeakPolarHBondContact O-CD 3.46Å; C838-K842 VanDerWaalsContact O-CG 3.27Å; C838-K842 WeakPolarHBondContact O-CG 3.33Å; C838-K842 PolarHBondContact O-N 3.26Å; N839-K842 PolarHBondContact O-N 3.16Å; N839-K842 PolarHBondContact OD1-NZ 3.32Å; M840-K842 VanDerWaalsContact C-N 3.3Å; M840-K842 PolarHBondContact O-N 3.12Å; K842-N844 VanDerWaalsContact C-N 3.28Å
843	R	67.3	Low	74.9	Confident	116 Å²	116	51.8 Å²	51.8	44%	0.438	29%	0.293	S	S	.	.	H	α-helix	trans	-62.6	-38.3	174.8	-72.6	172.5	-179.3	179.6	-0.9	110.5	E812 N839 M840 A845	E812-R843 IonicContact OE1-NH1 3.01Å; E812-R843 IonicContact OE2-NH1 3.68Å; E812-R843 PolarHBondContact OE2-NH1 3.27Å; N839-R843 WeakPolarHBondContact O-CG 3.28Å; N839-R843 PolarHBondContact O-N 3.4Å; M840-R843 PolarHBondContact O-N 3.14Å; R843-A845 VanDerWaalsContact C-N 3.35Å; R843-A845 PolarHBondContact O-N 3.09Å
844	N	67.7	Low	75.4	Confident	39 Å²	39	55 Å²	55	21%	0.209	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	21.9	-175.9	-67.1	2.5	0	0	0	114.2	M840 V841 K842 D846 G847 H848	M840-N844 WeakPolarHBondContact O-CB 3.45Å; M840-N844 PolarHBondContact O-N 3.42Å; V841-N844 PolarHBondContact O-N 2.88Å; K842-N844 VanDerWaalsContact C-N 3.28Å; N844-D846 PolarHBondContact O-N 2.85Å; N844-G847 PolarHBondContact O-N 3.31Å; N844-H848 HydrophobicContact CB-CB 4.12Å; N844-H848 WeakPolarHBondContact CB-O 3.43Å; N844-H848 PolarHBondContact ND2-O 3.03Å; N844-H848 PolarHBondContact O-N 2.83Å
845	A	56.9	Low	75.5	Confident	83 Å²	83	58.8 Å²	58.8	69%	0.686	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-19.6	-179.2	0	0	0	0	0	114.3	V841 R843 G847	V841-A845 PolarHBondContact O-N 3.36Å; R843-A845 VanDerWaalsContact C-N 3.35Å; R843-A845 PolarHBondContact O-N 3.09Å; A845-G847 PolarHBondContact O-N 3.35Å; A845-G847 VanDerWaalsContact O-N 3.15Å
846	D	50.2	Low	75.8	Confident	151 Å²	151	57.7 Å²	57.7	81%	0.807	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	4.5	170.9	-68.8	-28.2	0	0	0	114.1	N844	N844-D846 PolarHBondContact O-N 2.85Å
847	G	53.1	Low	76.4	Confident	62 Å²	62	56 Å²	56	64%	0.639	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	19.9	179.4	0	0	0	0	0	114	N844 A845	N844-G847 PolarHBondContact O-N 3.31Å; A845-G847 PolarHBondContact O-N 3.35Å; A845-G847 VanDerWaalsContact O-N 3.15Å
848	H	60	Low	76.7	Confident	123 Å²	123	61.2 Å²	61.2	57%	0.569	33%	0.331	S	S	*	.			trans	-71.7	124.9	175.5	-89.5	-81	0	0	0	110.7	N844 F850	N844-H848 HydrophobicContact CB-CB 4.12Å; N844-H848 WeakPolarHBondContact CB-O 3.43Å; N844-H848 PolarHBondContact ND2-O 3.03Å; N844-H848 PolarHBondContact O-N 2.83Å; H848-F850 PolarHBondContact O-N 2.94Å
849	P	66.5	Low	77.1	Confident	88 Å²	88	61.1 Å²	61.1	57%	0.571	33%	0.329	S	S	*	.			trans	-62.9	138.9	176	-13.6	24.3	0	0	0	111.7	T885	P849-T885 HydrophobicContact CB-CG2 3.56Å; P849-T885 HydrophobicContact CG-CG2 4.16Å
850	F	80.3	Confident	77.9	Confident	17 Å²	17	58.7 Å²	58.7	8%	0.075	32%	0.316	C	S	.	.			trans	-116.5	145	158.6	64.7	-76.5	0	0	0	107.8	L837 V841 H848 I852 I878 A881 A882 N888	L837-F850 HydrophobicContact CD2-CE2 4.07Å; V841-F850 HydrophobicContact CG2-CE1 3.69Å; V841-F850 HydrophobicContact CG2-CZ 3.58Å; H848-F850 PolarHBondContact O-N 2.94Å; F850-I852 HydrophobicContact CD2-CG1 4.12Å; F850-I852 HydrophobicContact CE2-CD1 3.87Å; F850-I852 HydrophobicContact CE2-CG1 3.66Å; F850-I852 HydrophobicContact CZ-CD1 4.46Å; F850-I878 HydrophobicContact CE2-CG2 4.48Å; F850-I878 HydrophobicContact CZ-CG2 4.37Å; F850-A881 HydrophobicContact CE1-CB 3.96Å; F850-A881 HydrophobicContact CZ-CB 4.33Å; F850-A882 HydrophobicContact CE1-CB 4.47Å; F850-A882 HydrophobicContact CE2-CB 4.17Å; F850-A882 HydrophobicContact CZ-CB 3.81Å; F850-N888 PolarHBondContact O-ND2 3.09Å
851	D	83.7	Confident	78.6	Confident	60 Å²	60	58.1 Å²	58.1	32%	0.321	31%	0.314	S	S	.	.			trans	-84.9	145.7	174.6	-79.8	-43.8	0	0	0	111	K887	D851-K887 VanDerWaalsContact OD1-CD 3.25Å; D851-K887 WeakPolarHBondContact OD1-CD 3.35Å; D851-K887 VanDerWaalsContact OD1-CE 3.25Å; D851-K887 WeakPolarHBondContact OD1-CE 3.48Å; D851-K887 IonicContact OD1-NZ 2.88Å; D851-K887 PolarHBondContact OD1-NZ 3.03Å; D851-K887 IonicContact OD2-NZ 3.26Å; D851-K887 PolarHBondContact OD2-NZ 3.09Å
852	I	87.6	Confident	79.3	Confident	6 Å²	6	62.3 Å²	62.3	3%	0.031	33%	0.332	C	S	.	.			trans	-108	137.7	171.4	-75.2	-166	0	0	0	109.9	F850 Q856 L860 I878 A882 N888 V891	F850-I852 HydrophobicContact CD2-CG1 4.12Å; F850-I852 HydrophobicContact CE2-CD1 3.87Å; F850-I852 HydrophobicContact CE2-CG1 3.66Å; F850-I852 HydrophobicContact CZ-CD1 4.46Å; I852-Q856 HydrophobicContact CG2-CB 3.94Å; I852-L860 HydrophobicContact CD1-CD1 3.72Å; I852-I878 HydrophobicContact CD1-CG2 3.98Å; I852-A882 HydrophobicContact CD1-CB 3.35Å; I852-A882 HydrophobicContact CG1-CB 3.89Å; I852-N888 PolarHBondContact N-OD1 3.45Å; I852-V891 HydrophobicContact CG2-CG1 4.16Å
853	T	90.5	Very high	80.1	Confident	34 Å²	34	55.6 Å²	55.6	21%	0.209	30%	0.303	C	S	.	.			trans	-85.5	160.3	176	75.3	0	0	0	0	111.6	D817 D855 Q856 G857	D817-T853 PolarHBondContact OD1-OG1 3.46Å; D817-T853 WeakPolarHBondContact OD2-CG2 3.45Å; T853-D855 PolarHBondContact O-N 3.36Å; T853-Q856 PolarHBondContact O-N 2.96Å; T853-Q856 VanDerWaalsContact OG1-CG 3.22Å; T853-Q856 WeakPolarHBondContact OG1-CG 3.36Å; T853-Q856 PolarHBondContact OG1-N 2.72Å; T853-Q856 PolarHBondContact OG1-NE2 3.44Å; T853-G857 PolarHBondContact O-N 3.27Å
854	M	90.6	Very high	81.3	Confident	68 Å²	68	50.6 Å²	50.6	34%	0.335	28%	0.284	S	S	.	.	H	α-helix	trans	-61.7	-27.6	-178.5	-72.8	-69.8	-58.8	0	0	113.1	R858 V891 N894 C895	M854-R858 WeakPolarHBondContact O-CG 3.3Å; M854-R858 PolarHBondContact O-N 2.95Å; M854-R858 VanDerWaalsContact O-N 3.1Å; M854-R858 PolarHBondContact O-NE 3Å; M854-V891 HydrophobicContact SD-CB 4.4Å; M854-V891 HydrophobicContact SD-CG1 3.91Å; M854-V891 HydrophobicContact SD-CG2 4.39Å; M854-N894 HydrophobicContact CE-CB 3.9Å; M854-N894 HydrophobicContact SD-CB 4.29Å; M854-C895 VanDerWaalsContact CE-SG 3.56Å; M854-C895 PolarHBondContact O-SG 2.85Å
855	D	87.7	Confident	82.5	Confident	79 Å²	79	53.5 Å²	53.5	42%	0.422	30%	0.295	S	S	.	.	H	α-helix	trans	-84.2	-34	178.2	-69.1	-63.2	0	0	0	112.3	T853 G857 R858 M859	T853-D855 PolarHBondContact O-N 3.36Å; D855-G857 VanDerWaalsContact C-N 3.33Å; D855-R858 PolarHBondContact O-N 2.83Å; D855-R858 IonicContact OD1-CZ 3.83Å; D855-R858 IonicContact OD1-NE 3.98Å; D855-R858 PolarHBondContact OD1-NE 3.29Å; D855-R858 IonicContact OD1-NH2 3.16Å; D855-R858 PolarHBondContact OD1-NH2 3.19Å; D855-R858 IonicContact OD2-NH2 2.64Å; D855-R858 PolarHBondContact OD2-NH2 3.32Å; D855-M859 WeakPolarHBondContact O-CB 3.46Å; D855-M859 PolarHBondContact O-N 2.89Å
856	Q	90.6	Very high	84.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.8	-39.6	166.6	-66	164	19.4	0	0	111.4	D817 I852 T853 M859 L860	D817-Q856 PolarHBondContact OD1-NE2 2.94Å; I852-Q856 HydrophobicContact CG2-CB 3.94Å; T853-Q856 PolarHBondContact O-N 2.96Å; T853-Q856 VanDerWaalsContact OG1-CG 3.22Å; T853-Q856 WeakPolarHBondContact OG1-CG 3.36Å; T853-Q856 PolarHBondContact OG1-N 2.72Å; T853-Q856 PolarHBondContact OG1-NE2 3.44Å; Q856-M859 PolarHBondContact O-N 2.75Å; Q856-L860 VanDerWaalsContact O-CG 3.31Å; Q856-L860 WeakPolarHBondContact O-CG 3.4Å; Q856-L860 PolarHBondContact O-N 3.43Å
857	G	92.8	Very high	85.7	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63	-42.6	173.7	0	0	0	0	0	113.1	T853 D855 L860 A861 C895 V897	T853-G857 PolarHBondContact O-N 3.27Å; D855-G857 VanDerWaalsContact C-N 3.33Å; G857-L860 PolarHBondContact O-N 3.06Å; G857-A861 PolarHBondContact O-N 3.35Å; G857-A861 VanDerWaalsContact O-N 3.13Å; G857-C895 VanDerWaalsContact C-CB 3.46Å; G857-V897 WeakPolarHBondContact O-CG2 3.38Å
858	R	92.4	Very high	87.3	Confident	110 Å²	110	49.7 Å²	49.7	42%	0.415	26%	0.263	S	S	.	.	H	α-helix	trans	-63.9	-44.1	173.4	-79.8	-177.1	-83.1	-91.4	7	112.5	M854 D855 L860 A861 E862 C895	M854-R858 WeakPolarHBondContact O-CG 3.3Å; M854-R858 PolarHBondContact O-N 2.95Å; M854-R858 VanDerWaalsContact O-N 3.1Å; M854-R858 PolarHBondContact O-NE 3Å; D855-R858 PolarHBondContact O-N 2.83Å; D855-R858 IonicContact OD1-CZ 3.83Å; D855-R858 IonicContact OD1-NE 3.98Å; D855-R858 PolarHBondContact OD1-NE 3.29Å; D855-R858 IonicContact OD1-NH2 3.16Å; D855-R858 PolarHBondContact OD1-NH2 3.19Å; D855-R858 IonicContact OD2-NH2 2.64Å; D855-R858 PolarHBondContact OD2-NH2 3.32Å; R858-L860 VanDerWaalsContact C-N 3.32Å; R858-L860 PolarHBondContact O-N 3.37Å; R858-A861 WeakPolarHBondContact O-CB 3.19Å; R858-A861 PolarHBondContact O-N 3.41Å; R858-A861 VanDerWaalsContact O-N 3.17Å; R858-E862 PolarHBondContact O-N 2.85Å; R858-C895 HydrophobicContact CG-CB 4.25Å
859	M	92	Very high	88.6	Confident	12 Å²	12	46.6 Å²	46.6	6%	0.059	26%	0.255	C	S	.	.	H	α-helix	trans	-57.5	-44.3	175.3	179.1	-163.4	-57.7	0	0	111.7	V820 E830 V833 D855 Q856 A861 E862 F863	V820-M859 HydrophobicContact CG1-CE 4.3Å; V820-M859 HydrophobicContact CG2-CE 3.42Å; V820-M859 VanDerWaalsContact CG2-CE 3.42Å; E830-M859 HydrophobicContact CB-CE 4.27Å; E830-M859 HydrophobicContact CB-CG 4.02Å; E830-M859 HydrophobicContact CB-SD 4.02Å; E830-M859 HydrophobicContact CG-CE 4.27Å; E830-M859 HydrophobicContact CG-CG 4.18Å; V833-M859 HydrophobicContact CB-CE 3.89Å; V833-M859 HydrophobicContact CB-SD 4.06Å; V833-M859 HydrophobicContact CG1-CE 3.73Å; V833-M859 HydrophobicContact CG1-SD 3.89Å; V833-M859 HydrophobicContact CG2-CE 4.34Å; D855-M859 WeakPolarHBondContact O-CB 3.46Å; D855-M859 PolarHBondContact O-N 2.89Å; Q856-M859 PolarHBondContact O-N 2.75Å; M859-A861 VanDerWaalsContact C-N 3.34Å; M859-A861 PolarHBondContact O-N 2.96Å; M859-E862 PolarHBondContact O-N 3.15Å; M859-F863 HydrophobicContact CG-CD2 3.8Å; M859-F863 HydrophobicContact CG-CE2 3.53Å; M859-F863 HydrophobicContact CG-CZ 4.34Å; M859-F863 WeakPolarHBondContact O-CD2 3.31Å; M859-F863 PolarHBondContact O-N 3.49Å; M859-F863 HydrophobicContact SD-CD2 4.46Å; M859-F863 HydrophobicContact SD-CE2 3.82Å
860	L	93.8	Very high	89.5	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.1	-38.6	176.7	-73.3	165.5	0	0	0	112	L834 I852 Q856 G857 R858 F863 L864 I878 I879 L892	L834-L860 HydrophobicContact CD1-CD2 3.72Å; I852-L860 HydrophobicContact CD1-CD1 3.72Å; Q856-L860 VanDerWaalsContact O-CG 3.31Å; Q856-L860 WeakPolarHBondContact O-CG 3.4Å; Q856-L860 PolarHBondContact O-N 3.43Å; G857-L860 PolarHBondContact O-N 3.06Å; R858-L860 VanDerWaalsContact C-N 3.32Å; R858-L860 PolarHBondContact O-N 3.37Å; L860-F863 PolarHBondContact O-N 2.93Å; L860-L864 WeakPolarHBondContact O-CG 3.42Å; L860-L864 PolarHBondContact O-N 3.08Å; L860-I878 HydrophobicContact CD1-CG2 3.81Å; L860-I878 HydrophobicContact CD2-CB 4.13Å; L860-I878 HydrophobicContact CD2-CD1 4.32Å; L860-I878 HydrophobicContact CD2-CG2 4.01Å; L860-I879 HydrophobicContact CB-CD1 4.22Å; L860-I879 HydrophobicContact CB-CG1 4.11Å; L860-I879 HydrophobicContact CD1-CG1 4.11Å; L860-I879 HydrophobicContact CD2-CG1 4.36Å; L860-I879 HydrophobicContact CG-CG1 4.43Å; L860-L892 HydrophobicContact CD1-CD2 4.49Å
861	A	93.4	Very high	89.8	Confident	3 Å²	3	46.5 Å²	46.5	3%	0.025	25%	0.251	C	S	.	.	H	α-helix	trans	-63	-44.7	174.5	0	0	0	0	0	112.3	G857 R858 M859 F863 L864 V897 E900	G857-A861 PolarHBondContact O-N 3.35Å; G857-A861 VanDerWaalsContact O-N 3.13Å; R858-A861 WeakPolarHBondContact O-CB 3.19Å; R858-A861 PolarHBondContact O-N 3.41Å; R858-A861 VanDerWaalsContact O-N 3.17Å; M859-A861 VanDerWaalsContact C-N 3.34Å; M859-A861 PolarHBondContact O-N 2.96Å; A861-F863 VanDerWaalsContact C-N 3.35Å; A861-F863 PolarHBondContact O-N 3.44Å; A861-L864 PolarHBondContact O-N 2.98Å; A861-V897 HydrophobicContact CB-CG2 3.85Å; A861-E900 HydrophobicContact CB-CG 4.2Å
862	E	92.1	Very high	90.2	Very high	112 Å²	112	44 Å²	44	52%	0.523	24%	0.238	S	C	.	.	H	α-helix	trans	-65.1	-37	175.7	-68.5	-56.5	122.7	0	0	112.3	R858 M859 L864 K865	R858-E862 PolarHBondContact O-N 2.85Å; M859-E862 PolarHBondContact O-N 3.15Å; E862-L864 VanDerWaalsContact C-N 3.28Å; E862-L864 PolarHBondContact O-N 3.09Å; E862-K865 VanDerWaalsContact O-CB 3.3Å; E862-K865 WeakPolarHBondContact O-CB 3.31Å; E862-K865 PolarHBondContact O-N 2.96Å; E862-K865 IonicContact OE1-NZ 3.89Å; E862-K865 PolarHBondContact OE1-NZ 2.88Å; E862-K865 IonicContact OE2-NZ 2.64Å
863	F	92.7	Very high	90.3	Very high	5 Å²	5	45.5 Å²	45.5	2%	0.022	25%	0.245	C	C	.	.	H	α-helix	trans	-69.8	-17.3	175.6	-75.4	-38.3	0	0	0	115	E830 L834 M859 L860 A861 K865 D866 L871 S875	E830-F863 HydrophobicContact CB-CE1 4.23Å; E830-F863 HydrophobicContact CB-CE2 3.94Å; E830-F863 HydrophobicContact CB-CZ 3.4Å; E830-F863 VanDerWaalsContact CB-CZ 3.4Å; L834-F863 HydrophobicContact CB-CE2 3.89Å; L834-F863 HydrophobicContact CD1-CD2 3.88Å; L834-F863 HydrophobicContact CD1-CE2 4.1Å; L834-F863 HydrophobicContact CD2-CD2 4.08Å; L834-F863 HydrophobicContact CD2-CE2 4.02Å; L834-F863 HydrophobicContact CG-CD2 4.39Å; L834-F863 HydrophobicContact CG-CE2 4.23Å; M859-F863 HydrophobicContact CG-CD2 3.8Å; M859-F863 HydrophobicContact CG-CE2 3.53Å; M859-F863 HydrophobicContact CG-CZ 4.34Å; M859-F863 WeakPolarHBondContact O-CD2 3.31Å; M859-F863 PolarHBondContact O-N 3.49Å; M859-F863 HydrophobicContact SD-CD2 4.46Å; M859-F863 HydrophobicContact SD-CE2 3.82Å; L860-F863 PolarHBondContact O-N 2.93Å; A861-F863 VanDerWaalsContact C-N 3.35Å; A861-F863 PolarHBondContact O-N 3.44Å; F863-K865 PolarHBondContact O-N 2.82Å; F863-D866 PolarHBondContact O-N 3.12Å; F863-L871 HydrophobicContact CB-CG 4.48Å; F863-L871 HydrophobicContact CD1-CD1 4.48Å; F863-L871 HydrophobicContact CD1-CD2 3.36Å; F863-L871 HydrophobicContact CD1-CG 3.9Å; F863-L871 HydrophobicContact CE1-CD1 4.38Å; F863-L871 HydrophobicContact CE1-CD2 3.64Å; F863-L871 HydrophobicContact CE1-CG 4.26Å; F863-L871 HydrophobicContact CG-CD2 4.15Å; F863-L871 HydrophobicContact CG-CG 4.23Å; F863-S875 WeakPolarHBondContact CB-OG 3.4Å
864	L	93.6	Very high	90.3	Very high	10 Å²	10	48.9 Å²	48.9	5%	0.052	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-17	169.3	-68.2	-177.7	0	0	0	112.6	L860 A861 E862 V872 L876 I879 V897 E900 L901 M904	L860-L864 WeakPolarHBondContact O-CG 3.42Å; L860-L864 PolarHBondContact O-N 3.08Å; A861-L864 PolarHBondContact O-N 2.98Å; E862-L864 VanDerWaalsContact C-N 3.28Å; E862-L864 PolarHBondContact O-N 3.09Å; L864-V872 HydrophobicContact CD2-CG1 4.29Å; L864-L876 HydrophobicContact CD2-CD2 3.64Å; L864-L876 HydrophobicContact CD2-CG 3.74Å; L864-I879 HydrophobicContact CD1-CD1 3.88Å; L864-I879 HydrophobicContact CD2-CD1 4.02Å; L864-I879 HydrophobicContact CG-CD1 4.1Å; L864-V897 HydrophobicContact CD1-CG1 4.17Å; L864-E900 HydrophobicContact CB-CB 4.2Å; L864-E900 HydrophobicContact CD1-CB 4.01Å; L864-L901 HydrophobicContact CD1-CD2 3.91Å; L864-L901 HydrophobicContact CD1-CG 4.03Å; L864-M904 HydrophobicContact CB-SD 3.94Å; L864-M904 HydrophobicContact CD1-SD 4.22Å; L864-M904 HydrophobicContact CD2-SD 3.93Å; L864-M904 HydrophobicContact CG-SD 4.24Å
865	K	92.1	Very high	90.4	Very high	100 Å²	100	45.6 Å²	45.6	44%	0.435	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-6.6	178.6	-54	169.7	-176.1	177.2	0	113.4	E862 F863 E900	E862-K865 VanDerWaalsContact O-CB 3.3Å; E862-K865 WeakPolarHBondContact O-CB 3.31Å; E862-K865 PolarHBondContact O-N 2.96Å; E862-K865 IonicContact OE1-NZ 3.89Å; E862-K865 PolarHBondContact OE1-NZ 2.88Å; E862-K865 IonicContact OE2-NZ 2.64Å; F863-K865 PolarHBondContact O-N 2.82Å; K865-E900 WeakPolarHBondContact CE-OE1 3.47Å; K865-E900 WeakPolarHBondContact CE-OE2 3.4Å; K865-E900 IonicContact NZ-OE1 3.31Å; K865-E900 PolarHBondContact NZ-OE1 3.19Å; K865-E900 IonicContact NZ-OE2 2.63Å
866	D	89.7	Confident	90.7	Very high	41 Å²	41	41.9 Å²	41.9	22%	0.219	22%	0.218	C	C	.	.			trans	-72.7	150.9	-173.4	-152	-65.4	0	0	0	112.3	K827 F863 D868 L871 V872	K827-D866 VanDerWaalsContact CE-OD2 3.26Å; K827-D866 WeakPolarHBondContact CE-OD2 3.22Å; K827-D866 IonicContact NZ-OD1 3.51Å; K827-D866 IonicContact NZ-OD2 2.8Å; K827-D866 PolarHBondContact NZ-OD2 2.82Å; F863-D866 PolarHBondContact O-N 3.12Å; D866-D868 PolarHBondContact OD1-N 3.21Å; D866-L871 HydrophobicContact CB-CD2 3.71Å; D866-L871 VanDerWaalsContact CG-CD2 3.49Å; D866-L871 WeakPolarHBondContact OD2-CD2 3.03Å; D866-V872 WeakPolarHBondContact O-CG2 3.35Å
867	A	84.9	Confident	90.7	Very high	104 Å²	104	45.5 Å²	45.5	86%	0.86	24%	0.237	S	C	*	.	S	Bend	trans	-77.3	-21.1	175.8	0	0	0	0	0	112.7	S869	A867-S869 PolarHBondContact O-N 3.31Å
868	D	87.4	Confident	90.6	Very high	71 Å²	71	45.5 Å²	45.5	38%	0.38	24%	0.237	S	C	.	.			trans	-77.4	103.2	172.6	-176.7	9.6	0	0	0	111.3	D866 N870 L871 V872	D866-D868 PolarHBondContact OD1-N 3.21Å; D868-N870 PolarHBondContact O-N 2.99Å; D868-N870 WeakPolarHBondContact OD1-CB 3.42Å; D868-N870 PolarHBondContact OD1-N 2.76Å; D868-N870 PolarHBondContact OD1-ND2 3.41Å; D868-L871 HydrophobicContact CB-CB 4.11Å; D868-L871 WeakPolarHBondContact O-CA 3.43Å; D868-L871 VanDerWaalsContact O-CB 3.26Å; D868-L871 WeakPolarHBondContact O-CB 3.32Å; D868-L871 PolarHBondContact O-N 2.9Å; D868-V872 PolarHBondContact O-N 3.45Å; D868-V872 VanDerWaalsContact O-N 3.16Å
869	S	86.3	Confident	90.6	Very high	58 Å²	58	40.3 Å²	40.3	41%	0.406	22%	0.217	S	C	.	.	H	α-helix	trans	-51.6	-28.8	173.5	63.3	0	0	0	0	114.3	A867 L871 I873	A867-S869 PolarHBondContact O-N 3.31Å; S869-L871 VanDerWaalsContact C-N 3.35Å; S869-I873 WeakPolarHBondContact O-CB 3.42Å; S869-I873 VanDerWaalsContact O-CD1 3.26Å; S869-I873 WeakPolarHBondContact O-CD1 3.43Å; S869-I873 WeakPolarHBondContact O-CG1 3.41Å; S869-I873 PolarHBondContact O-N 3.16Å
870	N	84.5	Confident	90.5	Very high	92 Å²	92	42.1 Å²	42.1	49%	0.492	23%	0.226	S	C	.	.	H	α-helix	trans	-69.9	-34.2	176.7	-60.1	-85.9	0	0	0	112	D868 R874	D868-N870 PolarHBondContact O-N 2.99Å; D868-N870 WeakPolarHBondContact OD1-CB 3.42Å; D868-N870 PolarHBondContact OD1-N 2.76Å; D868-N870 PolarHBondContact OD1-ND2 3.41Å; N870-R874 WeakPolarHBondContact O-CG 3.28Å; N870-R874 PolarHBondContact O-N 3.25Å; N870-R874 VanDerWaalsContact O-N 3.12Å
871	L	88.5	Confident	90.3	Very high	12 Å²	12	43.6 Å²	43.6	6%	0.063	24%	0.237	C	C	.	.	H	α-helix	trans	-69.6	-48.5	176.3	-158.2	71	0	0	0	109.6	L831 L834 F863 D866 D868 S869 I873 R874 S875	L831-L871 HydrophobicContact CD1-CD1 3.57Å; L834-L871 HydrophobicContact CD2-CD1 3.42Å; L834-L871 VanDerWaalsContact CD2-CD1 3.42Å; L834-L871 HydrophobicContact CD2-CG 4.08Å; F863-L871 HydrophobicContact CB-CG 4.48Å; F863-L871 HydrophobicContact CD1-CD1 4.48Å; F863-L871 HydrophobicContact CD1-CD2 3.36Å; F863-L871 HydrophobicContact CD1-CG 3.9Å; F863-L871 HydrophobicContact CE1-CD1 4.38Å; F863-L871 HydrophobicContact CE1-CD2 3.64Å; F863-L871 HydrophobicContact CE1-CG 4.26Å; F863-L871 HydrophobicContact CG-CD2 4.15Å; F863-L871 HydrophobicContact CG-CG 4.23Å; D866-L871 HydrophobicContact CB-CD2 3.71Å; D866-L871 VanDerWaalsContact CG-CD2 3.49Å; D866-L871 WeakPolarHBondContact OD2-CD2 3.03Å; D868-L871 HydrophobicContact CB-CB 4.11Å; D868-L871 WeakPolarHBondContact O-CA 3.43Å; D868-L871 VanDerWaalsContact O-CB 3.26Å; D868-L871 WeakPolarHBondContact O-CB 3.32Å; D868-L871 PolarHBondContact O-N 2.9Å; S869-L871 VanDerWaalsContact C-N 3.35Å; L871-I873 PolarHBondContact O-N 3.48Å; L871-R874 PolarHBondContact O-N 2.88Å; L871-S875 PolarHBondContact O-N 2.91Å; L871-S875 PolarHBondContact O-OG 3.43Å
872	V	91.4	Very high	90.1	Very high	8 Å²	8	43.4 Å²	43.4	5%	0.048	24%	0.236	C	C	.	.	H	α-helix	trans	-56.2	-48	174.4	177.2	0	0	0	0	111.5	L864 D866 D868 R874 S875 L876 M904 V914	L864-V872 HydrophobicContact CD2-CG1 4.29Å; D866-V872 WeakPolarHBondContact O-CG2 3.35Å; D868-V872 PolarHBondContact O-N 3.45Å; D868-V872 VanDerWaalsContact O-N 3.16Å; V872-R874 PolarHBondContact O-N 3.29Å; V872-S875 PolarHBondContact O-N 2.97Å; V872-L876 HydrophobicContact CG1-CD1 4.01Å; V872-L876 HydrophobicContact CG1-CG 4.45Å; V872-L876 VanDerWaalsContact O-CG 3.3Å; V872-L876 WeakPolarHBondContact O-CG 3.37Å; V872-L876 PolarHBondContact O-N 3.37Å; V872-M904 HydrophobicContact CG1-CE 3.38Å; V872-M904 HydrophobicContact CG1-SD 4.46Å; V872-V914 HydrophobicContact CG1-CG1 4.2Å
873	I	89.2	Confident	89.9	Confident	36 Å²	36	38.1 Å²	38.1	19%	0.185	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-42.5	178	-70.9	159.7	0	0	0	111.6	S869 L871 L876 I877 P913 V914	S869-I873 WeakPolarHBondContact O-CB 3.42Å; S869-I873 VanDerWaalsContact O-CD1 3.26Å; S869-I873 WeakPolarHBondContact O-CD1 3.43Å; S869-I873 WeakPolarHBondContact O-CG1 3.41Å; S869-I873 PolarHBondContact O-N 3.16Å; L871-I873 PolarHBondContact O-N 3.48Å; I873-L876 PolarHBondContact O-N 3.4Å; I873-I877 HydrophobicContact CG2-CD1 3.8Å; I873-I877 VanDerWaalsContact O-CG1 3.29Å; I873-I877 WeakPolarHBondContact O-CG1 3.38Å; I873-I877 PolarHBondContact O-N 3.45Å; I873-P913 HydrophobicContact CD1-CB 3.78Å; I873-V914 HydrophobicContact CD1-CG2 3.97Å; I873-V914 HydrophobicContact CG1-CG2 3.87Å
874	R	90.6	Very high	89.4	Confident	105 Å²	105	41.9 Å²	41.9	40%	0.396	24%	0.237	S	C	.	.	H	α-helix	trans	-62.7	-45.3	176.7	-74.7	170.7	-165.7	-148.7	6.6	111.4	L834 N835 N870 L871 V872 I877 I878	L834-R874 HydrophobicContact CD2-CB 4.14Å; N835-R874 PolarHBondContact OD1-NH1 3.1Å; N870-R874 WeakPolarHBondContact O-CG 3.28Å; N870-R874 PolarHBondContact O-N 3.25Å; N870-R874 VanDerWaalsContact O-N 3.12Å; L871-R874 PolarHBondContact O-N 2.88Å; V872-R874 PolarHBondContact O-N 3.29Å; R874-I877 PolarHBondContact O-N 3.28Å; R874-I878 WeakPolarHBondContact O-CG1 3.44Å; R874-I878 PolarHBondContact O-N 2.89Å
875	S	93.6	Very high	89	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.3	-47.6	175.9	-63.2	0	0	0	0	111.5	F863 L871 V872 I877 I878 I879	F863-S875 WeakPolarHBondContact CB-OG 3.4Å; L871-S875 PolarHBondContact O-N 2.91Å; L871-S875 PolarHBondContact O-OG 3.43Å; V872-S875 PolarHBondContact O-N 2.97Å; S875-I877 VanDerWaalsContact C-N 3.32Å; S875-I877 PolarHBondContact O-N 3.15Å; S875-I878 PolarHBondContact O-N 2.93Å; S875-I878 VanDerWaalsContact O-N 3.15Å; S875-I879 WeakPolarHBondContact O-CB 3.36Å; S875-I879 WeakPolarHBondContact O-CD1 3.38Å; S875-I879 WeakPolarHBondContact O-CG1 3.37Å; S875-I879 PolarHBondContact O-N 3.02Å
876	L	93.6	Very high	88.7	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-57.5	-41.3	176.2	-71.4	170.4	0	0	0	112.8	L864 V872 I873 I879 Q880 L901 M904 V914 A917 L918 C921	L864-L876 HydrophobicContact CD2-CD2 3.64Å; L864-L876 HydrophobicContact CD2-CG 3.74Å; V872-L876 HydrophobicContact CG1-CD1 4.01Å; V872-L876 HydrophobicContact CG1-CG 4.45Å; V872-L876 VanDerWaalsContact O-CG 3.3Å; V872-L876 WeakPolarHBondContact O-CG 3.37Å; V872-L876 PolarHBondContact O-N 3.37Å; I873-L876 PolarHBondContact O-N 3.4Å; L876-I879 PolarHBondContact O-N 3.18Å; L876-Q880 WeakPolarHBondContact O-CB 3.47Å; L876-Q880 PolarHBondContact O-N 2.83Å; L876-L901 HydrophobicContact CD2-CD2 3.52Å; L876-M904 HydrophobicContact CD1-CE 4.25Å; L876-V914 HydrophobicContact CD1-CG1 4.35Å; L876-A917 HydrophobicContact CB-CB 3.91Å; L876-A917 HydrophobicContact CD1-CB 3.96Å; L876-L918 HydrophobicContact CD1-CB 4.03Å; L876-L918 HydrophobicContact CD2-CB 4.41Å; L876-L918 HydrophobicContact CD2-CD1 3.99Å; L876-C921 HydrophobicContact CD2-CB 4.32Å
877	I	89.4	Confident	88.7	Confident	77 Å²	77	47.2 Å²	47.2	40%	0.395	26%	0.262	S	S	.	.	H	α-helix	trans	-65.8	-40.9	176.6	-69.7	165.6	0	0	0	111.5	V841 I873 R874 S875 A881	V841-I877 HydrophobicContact CG1-CG2 4.27Å; I873-I877 HydrophobicContact CG2-CD1 3.8Å; I873-I877 VanDerWaalsContact O-CG1 3.29Å; I873-I877 WeakPolarHBondContact O-CG1 3.38Å; I873-I877 PolarHBondContact O-N 3.45Å; R874-I877 PolarHBondContact O-N 3.28Å; S875-I877 VanDerWaalsContact C-N 3.32Å; S875-I877 PolarHBondContact O-N 3.15Å; I877-A881 WeakPolarHBondContact O-CB 3.45Å; I877-A881 PolarHBondContact O-N 2.89Å
878	I	91	Very high	89	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.5	-45.1	176	-68.1	158.7	0	0	0	111	L834 L837 V841 F850 I852 L860 R874 S875 Q880 A881 A882	L834-I878 HydrophobicContact CD1-CD1 3.45Å; L834-I878 VanDerWaalsContact CD1-CD1 3.45Å; L834-I878 HydrophobicContact CG-CD1 4.05Å; L837-I878 HydrophobicContact CB-CD1 3.56Å; L837-I878 HydrophobicContact CB-CG1 4.04Å; L837-I878 HydrophobicContact CB-CG2 4.09Å; L837-I878 HydrophobicContact CD1-CG2 4.45Å; L837-I878 HydrophobicContact CD2-CG2 4.32Å; V841-I878 HydrophobicContact CG2-CG1 4.16Å; F850-I878 HydrophobicContact CE2-CG2 4.48Å; F850-I878 HydrophobicContact CZ-CG2 4.37Å; I852-I878 HydrophobicContact CD1-CG2 3.98Å; L860-I878 HydrophobicContact CD1-CG2 3.81Å; L860-I878 HydrophobicContact CD2-CB 4.13Å; L860-I878 HydrophobicContact CD2-CD1 4.32Å; L860-I878 HydrophobicContact CD2-CG2 4.01Å; R874-I878 WeakPolarHBondContact O-CG1 3.44Å; R874-I878 PolarHBondContact O-N 2.89Å; S875-I878 PolarHBondContact O-N 2.93Å; S875-I878 VanDerWaalsContact O-N 3.15Å; I878-Q880 PolarHBondContact O-N 3.01Å; I878-A881 PolarHBondContact O-N 3.24Å; I878-A882 VanDerWaalsContact O-CB 3.28Å; I878-A882 WeakPolarHBondContact O-CB 3.33Å; I878-A882 PolarHBondContact O-N 3.03Å
879	I	92.9	Very high	89.1	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61	-45.3	177.9	-63.3	158	0	0	0	109.8	L860 L864 S875 L876 A882 A883 L892 V897 C921	L860-I879 HydrophobicContact CB-CD1 4.22Å; L860-I879 HydrophobicContact CB-CG1 4.11Å; L860-I879 HydrophobicContact CD1-CG1 4.11Å; L860-I879 HydrophobicContact CD2-CG1 4.36Å; L860-I879 HydrophobicContact CG-CG1 4.43Å; L864-I879 HydrophobicContact CD1-CD1 3.88Å; L864-I879 HydrophobicContact CD2-CD1 4.02Å; L864-I879 HydrophobicContact CG-CD1 4.1Å; S875-I879 WeakPolarHBondContact O-CB 3.36Å; S875-I879 WeakPolarHBondContact O-CD1 3.38Å; S875-I879 WeakPolarHBondContact O-CG1 3.37Å; S875-I879 PolarHBondContact O-N 3.02Å; L876-I879 PolarHBondContact O-N 3.18Å; I879-A882 PolarHBondContact O-N 2.89Å; I879-A883 WeakPolarHBondContact O-CB 3.25Å; I879-A883 PolarHBondContact O-N 3.3Å; I879-L892 HydrophobicContact CG1-CD2 4.31Å; I879-L892 HydrophobicContact CG2-CD1 3.98Å; I879-L892 HydrophobicContact CG2-CD2 4.19Å; I879-V897 HydrophobicContact CD1-CG1 3.63Å; I879-V897 HydrophobicContact CG1-CG1 4.04Å; I879-V897 HydrophobicContact CG2-CG1 3.84Å; I879-C921 WeakPolarHBondContact CG2-SG 3.34Å
880	Q	90.8	Very high	89.3	Confident	51 Å²	51	41 Å²	41	24%	0.238	21%	0.21	C	C	.	.	H	α-helix	trans	-59.9	-51	176	-171.1	-165.9	-5.2	0	0	111.6	L876 I878 A882 A883 C921 D924	L876-Q880 WeakPolarHBondContact O-CB 3.47Å; L876-Q880 PolarHBondContact O-N 2.83Å; I878-Q880 PolarHBondContact O-N 3.01Å; Q880-A882 VanDerWaalsContact C-N 3.3Å; Q880-A882 PolarHBondContact O-N 3.24Å; Q880-A883 PolarHBondContact O-N 3.47Å; Q880-A883 VanDerWaalsContact O-N 3.15Å; Q880-C921 HydrophobicContact CB-CB 4.22Å; Q880-D924 HydrophobicContact CG-CB 4.31Å; Q880-D924 VanDerWaalsContact CG-OD2 3.25Å; Q880-D924 WeakPolarHBondContact CG-OD2 3.39Å; Q880-D924 PolarHBondContact NE2-OD2 3.21Å
881	A	87.9	Confident	89.6	Confident	30 Å²	30	37.6 Å²	37.6	25%	0.248	19%	0.193	C	C	.	.	H	α-helix	trans	-63.6	-35.7	-178.4	0	0	0	0	0	112.5	V841 F850 I877 I878 C884	V841-A881 HydrophobicContact CB-CB 4.37Å; V841-A881 HydrophobicContact CG1-CB 3.68Å; V841-A881 HydrophobicContact CG2-CB 3.76Å; F850-A881 HydrophobicContact CE1-CB 3.96Å; F850-A881 HydrophobicContact CZ-CB 4.33Å; I877-A881 WeakPolarHBondContact O-CB 3.45Å; I877-A881 PolarHBondContact O-N 2.89Å; I878-A881 PolarHBondContact O-N 3.24Å; A881-C884 PolarHBondContact O-SG 2.92Å
882	A	89.2	Confident	89.8	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-69.8	-40.8	173	0	0	0	0	0	112.1	F850 I852 I878 I879 Q880 C884 T885 N888 L892	F850-A882 HydrophobicContact CE1-CB 4.47Å; F850-A882 HydrophobicContact CE2-CB 4.17Å; F850-A882 HydrophobicContact CZ-CB 3.81Å; I852-A882 HydrophobicContact CD1-CB 3.35Å; I852-A882 HydrophobicContact CG1-CB 3.89Å; I878-A882 VanDerWaalsContact O-CB 3.28Å; I878-A882 WeakPolarHBondContact O-CB 3.33Å; I878-A882 PolarHBondContact O-N 3.03Å; I879-A882 PolarHBondContact O-N 2.89Å; Q880-A882 VanDerWaalsContact C-N 3.3Å; Q880-A882 PolarHBondContact O-N 3.24Å; A882-C884 PolarHBondContact O-N 2.78Å; A882-T885 PolarHBondContact O-N 3.1Å; A882-T885 VanDerWaalsContact O-N 3.15Å; A882-N888 HydrophobicContact CB-CB 4.17Å; A882-N888 WeakPolarHBondContact O-CB 3.33Å; A882-N888 PolarHBondContact O-ND2 3.49Å; A882-L892 HydrophobicContact CB-CD1 4.29Å
883	A	88.7	Confident	89.8	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-4.4	-179.4	0	0	0	0	0	114.4	I879 Q880 T885 R889 L892 D924 M925	I879-A883 WeakPolarHBondContact O-CB 3.25Å; I879-A883 PolarHBondContact O-N 3.3Å; Q880-A883 PolarHBondContact O-N 3.47Å; Q880-A883 VanDerWaalsContact O-N 3.15Å; A883-T885 VanDerWaalsContact C-N 3.26Å; A883-T885 PolarHBondContact O-N 2.94Å; A883-R889 HydrophobicContact CB-CG 4.02Å; A883-R889 VanDerWaalsContact O-CD 3.28Å; A883-R889 WeakPolarHBondContact O-CD 3.19Å; A883-R889 VanDerWaalsContact O-CG 3.26Å; A883-R889 WeakPolarHBondContact O-CG 3.43Å; A883-R889 PolarHBondContact O-NH1 3.41Å; A883-L892 HydrophobicContact CB-CD1 4.32Å; A883-D924 HydrophobicContact CB-CB 4.49Å; A883-M925 HydrophobicContact CB-CG 4.08Å; A883-M925 HydrophobicContact CB-SD 3.72Å
884	C	83.1	Confident	89.8	Confident	84 Å²	84	40.7 Å²	40.7	57%	0.568	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-36.1	165.3	-67	0	0	0	0	113.1	A881 A882 R889	A881-C884 PolarHBondContact O-SG 2.92Å; A882-C884 PolarHBondContact O-N 2.78Å; C884-R889 VanDerWaalsContact C-NH1 3.33Å; C884-R889 PolarHBondContact O-NH1 3.38Å
885	T	85.2	Confident	89.9	Confident	27 Å²	27	36.4 Å²	36.4	17%	0.166	20%	0.197	C	C	.	.	S	Bend	trans	-98	149.8	179.2	79.3	0	0	0	0	113.8	P849 A882 A883 N888 R889	P849-T885 HydrophobicContact CB-CG2 3.56Å; P849-T885 HydrophobicContact CG-CG2 4.16Å; A882-T885 PolarHBondContact O-N 3.1Å; A882-T885 VanDerWaalsContact O-N 3.15Å; A883-T885 VanDerWaalsContact C-N 3.26Å; A883-T885 PolarHBondContact O-N 2.94Å; T885-N888 PolarHBondContact O-N 2.93Å; T885-N888 VanDerWaalsContact OG1-CB 3.26Å; T885-N888 WeakPolarHBondContact OG1-CB 3.48Å; T885-N888 PolarHBondContact OG1-N 3.37Å; T885-N888 PolarHBondContact OG1-ND2 3.46Å; T885-N888 VanDerWaalsContact OG1-ND2 3.15Å; T885-R889 WeakPolarHBondContact O-CG 3.38Å; T885-R889 PolarHBondContact O-N 2.98Å
886	E	85.5	Confident	89.8	Confident	114 Å²	114	37.2 Å²	37.2	53%	0.533	21%	0.205	S	C	.	.	H	α-helix	trans	-67.4	-35.8	174.6	-175.1	147.4	-116.6	0	0	113	R889 T890 N928	E886-R889 PolarHBondContact O-N 3.32Å; E886-T890 WeakPolarHBondContact O-CB 3.47Å; E886-T890 PolarHBondContact O-N 3Å; E886-T890 PolarHBondContact O-OG1 3.23Å; E886-N928 PolarHBondContact OE1-ND2 3.49Å
887	K	89.1	Confident	89.8	Confident	123 Å²	123	37.2 Å²	37.2	54%	0.535	21%	0.205	S	C	.	.	H	α-helix	trans	-57.7	-50.6	173.1	177.7	174	165	-171.1	0	110.9	D851 T890 V891	D851-K887 VanDerWaalsContact OD1-CD 3.25Å; D851-K887 WeakPolarHBondContact OD1-CD 3.35Å; D851-K887 VanDerWaalsContact OD1-CE 3.25Å; D851-K887 WeakPolarHBondContact OD1-CE 3.48Å; D851-K887 IonicContact OD1-NZ 2.88Å; D851-K887 PolarHBondContact OD1-NZ 3.03Å; D851-K887 IonicContact OD2-NZ 3.26Å; D851-K887 PolarHBondContact OD2-NZ 3.09Å; K887-T890 WeakPolarHBondContact O-CB 3.44Å; K887-T890 PolarHBondContact O-N 2.94Å; K887-V891 WeakPolarHBondContact O-CG2 3.45Å; K887-V891 PolarHBondContact O-N 3.01Å
888	N	91.4	Very high	89.7	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-67.5	-43.5	178	-71.2	-23.1	0	0	0	112.5	F850 I852 A882 T885 T890 V891 L892	F850-N888 PolarHBondContact O-ND2 3.09Å; I852-N888 PolarHBondContact N-OD1 3.45Å; A882-N888 HydrophobicContact CB-CB 4.17Å; A882-N888 WeakPolarHBondContact O-CB 3.33Å; A882-N888 PolarHBondContact O-ND2 3.49Å; T885-N888 PolarHBondContact O-N 2.93Å; T885-N888 VanDerWaalsContact OG1-CB 3.26Å; T885-N888 WeakPolarHBondContact OG1-CB 3.48Å; T885-N888 PolarHBondContact OG1-N 3.37Å; T885-N888 PolarHBondContact OG1-ND2 3.46Å; T885-N888 VanDerWaalsContact OG1-ND2 3.15Å; N888-T890 PolarHBondContact O-N 2.78Å; N888-V891 PolarHBondContact O-N 3.25Å; N888-L892 HydrophobicContact CB-CD1 4.49Å; N888-L892 WeakPolarHBondContact O-CB 3.49Å; N888-L892 WeakPolarHBondContact O-CD1 3.45Å; N888-L892 WeakPolarHBondContact O-CG 3.43Å; N888-L892 PolarHBondContact O-N 3.45Å
889	R	90.1	Very high	89.6	Confident	31 Å²	31	38 Å²	38	12%	0.117	21%	0.21	C	C	.	.	H	α-helix	trans	-53.8	-38.9	174.2	-74.6	-173.5	-60.5	-100.1	6.5	111.4	A883 C884 T885 E886 S893 M925 L931	A883-R889 HydrophobicContact CB-CG 4.02Å; A883-R889 VanDerWaalsContact O-CD 3.28Å; A883-R889 WeakPolarHBondContact O-CD 3.19Å; A883-R889 VanDerWaalsContact O-CG 3.26Å; A883-R889 WeakPolarHBondContact O-CG 3.43Å; A883-R889 PolarHBondContact O-NH1 3.41Å; C884-R889 VanDerWaalsContact C-NH1 3.33Å; C884-R889 PolarHBondContact O-NH1 3.38Å; T885-R889 WeakPolarHBondContact O-CG 3.38Å; T885-R889 PolarHBondContact O-N 2.98Å; E886-R889 PolarHBondContact O-N 3.32Å; R889-S893 VanDerWaalsContact O-CB 3.25Å; R889-S893 WeakPolarHBondContact O-CB 3.5Å; R889-S893 PolarHBondContact O-N 3.43Å; R889-M925 HydrophobicContact CB-SD 4.44Å; R889-M925 HydrophobicContact CG-SD 3.97Å; R889-L931 HydrophobicContact CB-CD1 3.9Å; R889-L931 HydrophobicContact CG-CD1 4.35Å
890	T	89	Confident	89.6	Confident	69 Å²	69	40.2 Å²	40.2	42%	0.423	22%	0.22	S	C	.	.	H	α-helix	trans	-68.6	-45.3	174.8	-54	0	0	0	0	112.5	E886 K887 N888 N894	E886-T890 WeakPolarHBondContact O-CB 3.47Å; E886-T890 PolarHBondContact O-N 3Å; E886-T890 PolarHBondContact O-OG1 3.23Å; K887-T890 WeakPolarHBondContact O-CB 3.44Å; K887-T890 PolarHBondContact O-N 2.94Å; N888-T890 PolarHBondContact O-N 2.78Å; T890-N894 WeakPolarHBondContact O-CB 3.5Å; T890-N894 VanDerWaalsContact O-CG 3.26Å; T890-N894 PolarHBondContact O-N 3.36Å; T890-N894 PolarHBondContact O-ND2 2.86Å
891	V	91.7	Very high	89.6	Confident	22 Å²	22	37.8 Å²	37.8	13%	0.133	21%	0.209	C	C	.	.	H	α-helix	trans	-59.7	-52.7	175.3	169.4	0	0	0	0	111.1	I852 M854 K887 N888 S893 N894 C895	I852-V891 HydrophobicContact CG2-CG1 4.16Å; M854-V891 HydrophobicContact SD-CB 4.4Å; M854-V891 HydrophobicContact SD-CG1 3.91Å; M854-V891 HydrophobicContact SD-CG2 4.39Å; K887-V891 WeakPolarHBondContact O-CG2 3.45Å; K887-V891 PolarHBondContact O-N 3.01Å; N888-V891 PolarHBondContact O-N 3.25Å; V891-S893 VanDerWaalsContact C-N 3.32Å; V891-S893 PolarHBondContact O-N 3.14Å; V891-N894 CarbonylContact O-C 3.45Å; V891-N894 PolarHBondContact O-N 2.91Å; V891-N894 VanDerWaalsContact O-N 3.09Å; V891-C895 PolarHBondContact O-N 2.8Å; V891-C895 PolarHBondContact O-SG 3.27Å
892	L	92.9	Very high	89.5	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-57.4	-44.2	-179.7	-66.3	164.2	0	0	0	111.4	L860 I879 A882 A883 N888 C895 V897 M925	L860-L892 HydrophobicContact CD1-CD2 4.49Å; I879-L892 HydrophobicContact CG1-CD2 4.31Å; I879-L892 HydrophobicContact CG2-CD1 3.98Å; I879-L892 HydrophobicContact CG2-CD2 4.19Å; A882-L892 HydrophobicContact CB-CD1 4.29Å; A883-L892 HydrophobicContact CB-CD1 4.32Å; N888-L892 HydrophobicContact CB-CD1 4.49Å; N888-L892 WeakPolarHBondContact O-CB 3.49Å; N888-L892 WeakPolarHBondContact O-CD1 3.45Å; N888-L892 WeakPolarHBondContact O-CG 3.43Å; N888-L892 PolarHBondContact O-N 3.45Å; L892-C895 PolarHBondContact O-N 2.8Å; L892-V897 HydrophobicContact CB-CB 4.28Å; L892-V897 HydrophobicContact CB-CG2 4.41Å; L892-V897 HydrophobicContact CD2-CB 4.48Å; L892-V897 HydrophobicContact CD2-CG1 4.43Å; L892-V897 HydrophobicContact CD2-CG2 3.98Å; L892-V897 WeakPolarHBondContact O-CB 3.11Å; L892-V897 PolarHBondContact O-N 2.78Å; L892-M925 HydrophobicContact CB-CE 4.03Å; L892-M925 HydrophobicContact CD1-SD 4.09Å
893	S	90.1	Very high	89.5	Confident	15 Å²	15	40.7 Å²	40.7	11%	0.105	23%	0.225	C	C	.	.	H	α-helix	trans	-57.9	-47.6	173.4	-170.1	0	0	0	0	112.4	R889 V891 C895 G896	R889-S893 VanDerWaalsContact O-CB 3.25Å; R889-S893 WeakPolarHBondContact O-CB 3.5Å; R889-S893 PolarHBondContact O-N 3.43Å; V891-S893 VanDerWaalsContact C-N 3.32Å; V891-S893 PolarHBondContact O-N 3.14Å; S893-C895 PolarHBondContact O-N 3.45Å; S893-G896 PolarHBondContact O-N 3.09Å
894	N	91.1	Very high	89.6	Confident	106 Å²	106	42.2 Å²	42.2	57%	0.567	23%	0.232	S	C	*	.	H	α-helix	trans	-74.5	-6.8	179.9	-67.1	-27.9	0	0	0	114	M854 T890 V891	M854-N894 HydrophobicContact CE-CB 3.9Å; M854-N894 HydrophobicContact SD-CB 4.29Å; T890-N894 WeakPolarHBondContact O-CB 3.5Å; T890-N894 VanDerWaalsContact O-CG 3.26Å; T890-N894 PolarHBondContact O-N 3.36Å; T890-N894 PolarHBondContact O-ND2 2.86Å; V891-N894 CarbonylContact O-C 3.45Å; V891-N894 PolarHBondContact O-N 2.91Å; V891-N894 VanDerWaalsContact O-N 3.09Å
895	C	92.1	Very high	89.8	Confident	14 Å²	14	38.3 Å²	38.3	10%	0.095	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	1.1	176.9	-66.7	0	0	0	0	114	M854 G857 R858 V891 L892 S893 V897	M854-C895 VanDerWaalsContact CE-SG 3.56Å; M854-C895 PolarHBondContact O-SG 2.85Å; G857-C895 VanDerWaalsContact C-CB 3.46Å; R858-C895 HydrophobicContact CG-CB 4.25Å; V891-C895 PolarHBondContact O-N 2.8Å; V891-C895 PolarHBondContact O-SG 3.27Å; L892-C895 PolarHBondContact O-N 2.8Å; S893-C895 PolarHBondContact O-N 3.45Å; C895-V897 VanDerWaalsContact C-N 3.28Å; C895-V897 HydrophobicContact CB-CG2 4.23Å; C895-V897 PolarHBondContact O-N 2.62Å
896	G	91.3	Very high	89.7	Confident	18 Å²	18	42 Å²	42	19%	0.186	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	-1.4	-176.5	0	0	0	0	0	114.5	S893 F898 D899 E900	S893-G896 PolarHBondContact O-N 3.09Å; G896-F898 PolarHBondContact O-N 2.92Å; G896-F898 VanDerWaalsContact O-N 3.14Å; G896-D899 PolarHBondContact O-N 3.29Å; G896-E900 PolarHBondContact O-N 3.43Å; G896-E900 VanDerWaalsContact O-N 3.16Å
897	V	92.5	Very high	89.6	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-54.9	-36.1	176	-179	0	0	0	0	110.7	G857 A861 L864 I879 L892 C895 D899 E900 L901	G857-V897 WeakPolarHBondContact O-CG2 3.38Å; A861-V897 HydrophobicContact CB-CG2 3.85Å; L864-V897 HydrophobicContact CD1-CG1 4.17Å; I879-V897 HydrophobicContact CD1-CG1 3.63Å; I879-V897 HydrophobicContact CG1-CG1 4.04Å; I879-V897 HydrophobicContact CG2-CG1 3.84Å; L892-V897 HydrophobicContact CB-CB 4.28Å; L892-V897 HydrophobicContact CB-CG2 4.41Å; L892-V897 HydrophobicContact CD2-CB 4.48Å; L892-V897 HydrophobicContact CD2-CG1 4.43Å; L892-V897 HydrophobicContact CD2-CG2 3.98Å; L892-V897 WeakPolarHBondContact O-CB 3.11Å; L892-V897 PolarHBondContact O-N 2.78Å; C895-V897 VanDerWaalsContact C-N 3.28Å; C895-V897 HydrophobicContact CB-CG2 4.23Å; C895-V897 PolarHBondContact O-N 2.62Å; V897-D899 VanDerWaalsContact C-N 3.34Å; V897-D899 PolarHBondContact O-N 3.06Å; V897-E900 PolarHBondContact O-N 3.29Å; V897-L901 HydrophobicContact CG1-CD1 4.03Å; V897-L901 HydrophobicContact CG1-CG 4.28Å; V897-L901 WeakPolarHBondContact O-CB 3.21Å; V897-L901 WeakPolarHBondContact O-CG 3.29Å; V897-L901 PolarHBondContact O-N 3.49Å
898	F	88.8	Confident	89.1	Confident	7 Å²	7	38.5 Å²	38.5	3%	0.031	21%	0.211	C	C	.	.	H	α-helix	trans	-58	-44	175	-173	-87.3	0	0	0	113.3	G896 L901 A902 L931 R934 M935 Y938	G896-F898 PolarHBondContact O-N 2.92Å; G896-F898 VanDerWaalsContact O-N 3.14Å; F898-L901 PolarHBondContact O-N 3.01Å; F898-A902 PolarHBondContact O-N 2.79Å; F898-L931 HydrophobicContact CD2-CD2 3.72Å; F898-L931 HydrophobicContact CE2-CD2 3.96Å; F898-R934 HydrophobicContact CE1-CB 3.8Å; F898-R934 HydrophobicContact CE2-CB 4.09Å; F898-R934 HydrophobicContact CZ-CB 3.32Å; F898-R934 HydrophobicContact CZ-CG 4.38Å; F898-M935 HydrophobicContact CD2-CE 4.32Å; F898-M935 HydrophobicContact CE2-CE 3.81Å; F898-M935 HydrophobicContact CE2-CG 3.38Å; F898-M935 HydrophobicContact CE2-SD 4.06Å; F898-M935 HydrophobicContact CZ-CG 3.63Å; F898-Y938 HydrophobicContact CZ-CE2 4.19Å
899	D	88.8	Confident	88.1	Confident	87 Å²	87	41.1 Å²	41.1	47%	0.465	23%	0.228	S	C	.	.	H	α-helix	trans	-75.4	-32.8	-174.2	-53.8	-51.6	0	0	0	110.8	G896 V897 A902 V903	G896-D899 PolarHBondContact O-N 3.29Å; V897-D899 VanDerWaalsContact C-N 3.34Å; V897-D899 PolarHBondContact O-N 3.06Å; D899-A902 VanDerWaalsContact O-CB 3.28Å; D899-A902 WeakPolarHBondContact O-CB 3.42Å; D899-A902 PolarHBondContact O-N 2.73Å; D899-V903 WeakPolarHBondContact O-CG2 3.19Å; D899-V903 PolarHBondContact O-N 3.43Å; D899-V903 VanDerWaalsContact O-N 3.14Å
900	E	92.4	Very high	87.1	Confident	45 Å²	45	44.5 Å²	44.5	21%	0.21	26%	0.256	C	S	.	.	H	α-helix	trans	-71.2	-41.6	171.9	-54.2	-54	160.7	0	0	111.8	A861 L864 K865 G896 V897 A902 V903 M904	A861-E900 HydrophobicContact CB-CG 4.2Å; L864-E900 HydrophobicContact CB-CB 4.2Å; L864-E900 HydrophobicContact CD1-CB 4.01Å; K865-E900 WeakPolarHBondContact CE-OE1 3.47Å; K865-E900 WeakPolarHBondContact CE-OE2 3.4Å; K865-E900 IonicContact NZ-OE1 3.31Å; K865-E900 PolarHBondContact NZ-OE1 3.19Å; K865-E900 IonicContact NZ-OE2 2.63Å; G896-E900 PolarHBondContact O-N 3.43Å; G896-E900 VanDerWaalsContact O-N 3.16Å; V897-E900 PolarHBondContact O-N 3.29Å; E900-A902 PolarHBondContact O-N 3.39Å; E900-V903 PolarHBondContact O-N 3.07Å; E900-M904 WeakPolarHBondContact O-CG 3.47Å; E900-M904 PolarHBondContact O-N 3.39Å
901	L	91.1	Very high	86.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-57.5	-37.1	171	-70	170.7	0	0	0	111.2	L864 L876 V897 F898 M904 I905 L918 M925	L864-L901 HydrophobicContact CD1-CD2 3.91Å; L864-L901 HydrophobicContact CD1-CG 4.03Å; L876-L901 HydrophobicContact CD2-CD2 3.52Å; V897-L901 HydrophobicContact CG1-CD1 4.03Å; V897-L901 HydrophobicContact CG1-CG 4.28Å; V897-L901 WeakPolarHBondContact O-CB 3.21Å; V897-L901 WeakPolarHBondContact O-CG 3.29Å; V897-L901 PolarHBondContact O-N 3.49Å; F898-L901 PolarHBondContact O-N 3.01Å; L901-M904 PolarHBondContact O-N 2.96Å; L901-I905 WeakPolarHBondContact O-CD1 3.29Å; L901-I905 VanDerWaalsContact O-CG1 3.24Å; L901-I905 WeakPolarHBondContact O-CG1 3.23Å; L901-I905 PolarHBondContact O-N 3.17Å; L901-I905 VanDerWaalsContact O-N 3.08Å; L901-L918 HydrophobicContact CD2-CD1 3.41Å; L901-L918 VanDerWaalsContact CD2-CD1 3.41Å; L901-M925 HydrophobicContact CD1-CG 4.49Å
902	A	85.6	Confident	85.8	Confident	15 Å²	15	43.5 Å²	43.5	12%	0.124	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-52.2	174	0	0	0	0	0	112.2	F898 D899 E900 M904 I905 D906 Y938	F898-A902 PolarHBondContact O-N 2.79Å; D899-A902 VanDerWaalsContact O-CB 3.28Å; D899-A902 WeakPolarHBondContact O-CB 3.42Å; D899-A902 PolarHBondContact O-N 2.73Å; E900-A902 PolarHBondContact O-N 3.39Å; A902-M904 PolarHBondContact O-N 3.08Å; A902-I905 WeakPolarHBondContact O-CB 3.43Å; A902-I905 PolarHBondContact O-N 3.18Å; A902-D906 PolarHBondContact O-N 2.89Å; A902-Y938 HydrophobicContact CB-CE1 4.06Å; A902-Y938 WeakPolarHBondContact CB-OH 2.91Å
903	V	88.9	Confident	85.4	Confident	77 Å²	77	47.5 Å²	47.5	47%	0.467	28%	0.281	S	S	.	.	H	α-helix	trans	-58	-39.3	177.8	172.9	0	0	0	0	111	D899 E900 I905 H907	D899-V903 WeakPolarHBondContact O-CG2 3.19Å; D899-V903 PolarHBondContact O-N 3.43Å; D899-V903 VanDerWaalsContact O-N 3.14Å; E900-V903 PolarHBondContact O-N 3.07Å; V903-I905 PolarHBondContact O-N 3.02Å; V903-H907 PolarHBondContact O-N 2.98Å; V903-H907 PolarHBondContact O-ND1 3.44Å
904	M	90.9	Very high	85.3	Confident	31 Å²	31	48 Å²	48	15%	0.153	28%	0.284	C	S	.	.	H	α-helix	trans	-69	-27.8	176.7	-64.5	-177.7	79.4	0	0	114	L864 V872 L876 E900 L901 A902 H907 L908 V914 L918	L864-M904 HydrophobicContact CB-SD 3.94Å; L864-M904 HydrophobicContact CD1-SD 4.22Å; L864-M904 HydrophobicContact CD2-SD 3.93Å; L864-M904 HydrophobicContact CG-SD 4.24Å; V872-M904 HydrophobicContact CG1-CE 3.38Å; V872-M904 HydrophobicContact CG1-SD 4.46Å; L876-M904 HydrophobicContact CD1-CE 4.25Å; E900-M904 WeakPolarHBondContact O-CG 3.47Å; E900-M904 PolarHBondContact O-N 3.39Å; L901-M904 PolarHBondContact O-N 2.96Å; A902-M904 PolarHBondContact O-N 3.08Å; M904-H907 CarbonylContact O-C 3.59Å; M904-L908 VanDerWaalsContact O-CA 3.22Å; M904-L908 WeakPolarHBondContact O-CA 3.42Å; M904-L908 PolarHBondContact O-N 3.16Å; M904-V914 HydrophobicContact CE-CG1 3.93Å; M904-L918 HydrophobicContact CB-CD1 4.32Å; M904-L918 HydrophobicContact CB-CD2 3.5Å; M904-L918 HydrophobicContact CE-CD2 4.26Å
905	I	86.4	Confident	85.2	Confident	3 Å²	3	43 Å²	43	2%	0.015	26%	0.257	C	S	.	.	H	α-helix	trans	-70.6	-42.1	176.1	-69.6	161.1	0	0	0	111.2	L901 A902 V903 H907 L908 I922 Y938 K941	L901-I905 WeakPolarHBondContact O-CD1 3.29Å; L901-I905 VanDerWaalsContact O-CG1 3.24Å; L901-I905 WeakPolarHBondContact O-CG1 3.23Å; L901-I905 PolarHBondContact O-N 3.17Å; L901-I905 VanDerWaalsContact O-N 3.08Å; A902-I905 WeakPolarHBondContact O-CB 3.43Å; A902-I905 PolarHBondContact O-N 3.18Å; V903-I905 PolarHBondContact O-N 3.02Å; I905-H907 PolarHBondContact O-N 3.21Å; I905-L908 VanDerWaalsContact O-CB 3.22Å; I905-L908 WeakPolarHBondContact O-CB 3.34Å; I905-L908 PolarHBondContact O-N 3.49Å; I905-I922 HydrophobicContact CD1-CD1 3.38Å; I905-I922 HydrophobicContact CD1-CG1 3.89Å; I905-I922 HydrophobicContact CG1-CD1 3.32Å; I905-I922 HydrophobicContact CG1-CG1 4.3Å; I905-Y938 HydrophobicContact CB-CD1 4.32Å; I905-Y938 HydrophobicContact CD1-CD1 3.87Å; I905-Y938 HydrophobicContact CD1-CD2 3.46Å; I905-Y938 VanDerWaalsContact CD1-CD2 3.46Å; I905-Y938 HydrophobicContact CD1-CE1 4.22Å; I905-Y938 HydrophobicContact CD1-CE2 3.82Å; I905-Y938 HydrophobicContact CD1-CG 3.52Å; I905-Y938 HydrophobicContact CG2-CD1 3.9Å; I905-Y938 HydrophobicContact CG2-CG 4.1Å; I905-K941 HydrophobicContact CG2-CB 4.3Å; I905-K941 HydrophobicContact CG2-CG 3.98Å; I905-K941 WeakPolarHBondContact O-CE 3.34Å; I905-K941 PolarHBondContact O-NZ 3Å; I905-K941 VanDerWaalsContact O-NZ 3.16Å
906	D	84	Confident	85	Confident	104 Å²	104	44.1 Å²	44.1	56%	0.556	26%	0.259	S	S	*	.	H	α-helix	trans	-62.3	-38.6	177.4	-76.9	-26.6	0	0	0	110.8	A902 K941	A902-D906 PolarHBondContact O-N 2.89Å; D906-K941 PolarHBondContact O-NZ 3.43Å
907	H	84.1	Confident	84.9	Confident	145 Å²	145	44 Å²	44	67%	0.671	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	13.6	177.2	-57.7	87.7	0	0	0	114.4	V903 M904 I905 P909	V903-H907 PolarHBondContact O-N 2.98Å; V903-H907 PolarHBondContact O-ND1 3.44Å; M904-H907 CarbonylContact O-C 3.59Å; I905-H907 PolarHBondContact O-N 3.21Å; H907-P909 WeakPolarHBondContact O-CD 3.36Å; H907-P909 VanDerWaalsContact O-N 3.14Å
908	L	78.2	Confident	84.9	Confident	19 Å²	19	44 Å²	44	10%	0.099	26%	0.256	C	S	.	.			trans	-50.5	118.7	-171.5	-179.3	74.2	0	0	0	111.4	M904 I905 A915 L918 L945	M904-L908 VanDerWaalsContact O-CA 3.22Å; M904-L908 WeakPolarHBondContact O-CA 3.42Å; M904-L908 PolarHBondContact O-N 3.16Å; I905-L908 VanDerWaalsContact O-CB 3.22Å; I905-L908 WeakPolarHBondContact O-CB 3.34Å; I905-L908 PolarHBondContact O-N 3.49Å; L908-A915 HydrophobicContact CD1-CB 3.83Å; L908-A915 HydrophobicContact CG-CB 4.36Å; L908-L918 HydrophobicContact CD1-CD2 3.66Å; L908-L918 HydrophobicContact CD1-CG 4.26Å; L908-L945 HydrophobicContact CD2-CD1 3.39Å; L908-L945 HydrophobicContact CD2-CD2 3.92Å; L908-L945 HydrophobicContact CD2-CG 4.24Å
909	P	71.2	Confident	85	Confident	56 Å²	56	43.7 Å²	43.7	36%	0.364	26%	0.255	S	S	.	.			trans	-61.1	140.8	177.4	21.8	-30.8	0	0	0	110.4	H907 S911 V914 A915	H907-P909 WeakPolarHBondContact O-CD 3.36Å; H907-P909 VanDerWaalsContact O-N 3.14Å; P909-S911 PolarHBondContact O-N 3.47Å; P909-V914 HydrophobicContact CG-CB 4.26Å; P909-V914 HydrophobicContact CG-CG1 4.39Å; P909-A915 HydrophobicContact CG-CB 4.29Å; P909-A915 WeakPolarHBondContact O-CB 3.4Å
910	S	67.6	Low	85.1	Confident	101 Å²	101	42.3 Å²	42.3	71%	0.706	25%	0.245	S	C	*	.	S	Bend	trans	-65.4	-2.8	-172.1	57	0	0	0	0	115.5
911	S	71.4	Confident	85	Confident	56 Å²	56	40.1 Å²	40.1	39%	0.392	24%	0.235	S	C	.	.	S	Bend	trans	-170.7	155.8	-171.5	48	0	0	0	0	111.9	P909 E952	P909-S911 PolarHBondContact O-N 3.47Å; S911-E952 WeakPolarHBondContact CA-OE2 3.47Å; S911-E952 VanDerWaalsContact CB-CD 3.46Å; S911-E952 WeakPolarHBondContact CB-OE1 3.5Å; S911-E952 WeakPolarHBondContact CB-OE2 3.41Å
912	G	82.2	Confident	85	Confident	14 Å²	14	40.2 Å²	40.2	14%	0.144	24%	0.235	C	C	.	.	S	Bend	trans	90.4	-177.1	163.4	0	0	0	0	0	117.7	V914 A915 Y916 E952	G912-V914 PolarHBondContact O-N 3.49Å; G912-A915 WeakPolarHBondContact O-CB 3.5Å; G912-A915 PolarHBondContact O-N 2.88Å; G912-Y916 PolarHBondContact O-N 3.42Å; G912-E952 PolarHBondContact N-OE2 3.1Å
913	P	84.5	Confident	85.2	Confident	84 Å²	84	39.6 Å²	39.6	55%	0.545	23%	0.231	S	C	.	.	H	α-helix	trans	-62.6	-34.6	-157.9	-27.8	36.5	0	0	0	116.3	I873 A915 Y916 A917	I873-P913 HydrophobicContact CD1-CB 3.78Å; P913-A915 VanDerWaalsContact C-N 3.34Å; P913-Y916 PolarHBondContact O-N 3.29Å; P913-A917 WeakPolarHBondContact O-CB 3.2Å; P913-A917 PolarHBondContact O-N 3.23Å
914	V	88.5	Confident	85.2	Confident	27 Å²	27	38.2 Å²	38.2	16%	0.164	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-44.1	175.6	-178.9	0	0	0	0	110.3	V872 I873 L876 M904 P909 G912 Y916 L918	V872-V914 HydrophobicContact CG1-CG1 4.2Å; I873-V914 HydrophobicContact CD1-CG2 3.97Å; I873-V914 HydrophobicContact CG1-CG2 3.87Å; L876-V914 HydrophobicContact CD1-CG1 4.35Å; M904-V914 HydrophobicContact CE-CG1 3.93Å; P909-V914 HydrophobicContact CG-CB 4.26Å; P909-V914 HydrophobicContact CG-CG1 4.39Å; G912-V914 PolarHBondContact O-N 3.49Å; V914-Y916 PolarHBondContact O-N 3Å; V914-L918 WeakPolarHBondContact O-CB 3.4Å; V914-L918 PolarHBondContact O-N 3.48Å
915	A	87.9	Confident	85.1	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.2	-42.1	179.3	0	0	0	0	0	111.7	L908 P909 G912 P913 L918 L919 L955	L908-A915 HydrophobicContact CD1-CB 3.83Å; L908-A915 HydrophobicContact CG-CB 4.36Å; P909-A915 HydrophobicContact CG-CB 4.29Å; P909-A915 WeakPolarHBondContact O-CB 3.4Å; G912-A915 WeakPolarHBondContact O-CB 3.5Å; G912-A915 PolarHBondContact O-N 2.88Å; P913-A915 VanDerWaalsContact C-N 3.34Å; A915-L918 PolarHBondContact O-N 3.09Å; A915-L919 WeakPolarHBondContact O-CB 3.42Å; A915-L919 WeakPolarHBondContact O-CD1 3.25Å; A915-L919 WeakPolarHBondContact O-CG 3.4Å; A915-L919 PolarHBondContact O-N 3.12Å; A915-L955 HydrophobicContact CB-CD1 3.93Å
916	Y	88.6	Confident	85.1	Confident	38 Å²	38	36.6 Å²	36.6	15%	0.149	21%	0.213	C	C	.	.	H	α-helix	trans	-64.9	-49.9	179	-50.4	-26.4	0	0	0	111.9	G912 P913 V914 L918 L919 H920 E952 Q954 L955	G912-Y916 PolarHBondContact O-N 3.42Å; P913-Y916 PolarHBondContact O-N 3.29Å; V914-Y916 PolarHBondContact O-N 3Å; Y916-L918 VanDerWaalsContact C-N 3.29Å; Y916-L918 PolarHBondContact O-N 3.43Å; Y916-L919 PolarHBondContact O-N 2.74Å; Y916-H920 PolarHBondContact O-CD2 3.46Å; Y916-H920 VanDerWaalsContact O-CD2 3.22Å; Y916-H920 PolarHBondContact O-N 3.38Å; Y916-E952 VanDerWaalsContact OH-CD 3.23Å; Y916-E952 PolarHBondContact OH-OE1 3.31Å; Y916-E952 PolarHBondContact OH-OE2 3.35Å; Y916-E952 VanDerWaalsContact OH-OE2 3.07Å; Y916-Q954 HydrophobicContact CE1-CB 3.98Å; Y916-Q954 HydrophobicContact CE2-CB 3.97Å; Y916-Q954 VanDerWaalsContact CE2-OE1 3.28Å; Y916-Q954 PolarHBondContact OH-OE1 2.82Å; Y916-L955 HydrophobicContact CD1-CD1 4.04Å; Y916-L955 HydrophobicContact CE1-CB 3.96Å; Y916-L955 HydrophobicContact CE1-CD1 3.98Å
917	A	89.9	Confident	85.2	Confident	14 Å²	14	33.2 Å²	33.2	12%	0.116	20%	0.199	C	C	.	.	H	α-helix	trans	-62.2	-38.7	179.1	0	0	0	0	0	111.7	L876 P913 C921	L876-A917 HydrophobicContact CB-CB 3.91Å; L876-A917 HydrophobicContact CD1-CB 3.96Å; P913-A917 WeakPolarHBondContact O-CB 3.2Å; P913-A917 PolarHBondContact O-N 3.23Å; A917-C921 VanDerWaalsContact O-CB 3.24Å; A917-C921 WeakPolarHBondContact O-CB 3.32Å; A917-C921 PolarHBondContact O-N 3.46Å
918	L	92.2	Very high	85.1	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.6	-49.4	176.6	178.6	53.2	0	0	0	111.8	L876 L901 M904 L908 V914 A915 Y916 H920 C921 I922	L876-L918 HydrophobicContact CD1-CB 4.03Å; L876-L918 HydrophobicContact CD2-CB 4.41Å; L876-L918 HydrophobicContact CD2-CD1 3.99Å; L901-L918 HydrophobicContact CD2-CD1 3.41Å; L901-L918 VanDerWaalsContact CD2-CD1 3.41Å; M904-L918 HydrophobicContact CB-CD1 4.32Å; M904-L918 HydrophobicContact CB-CD2 3.5Å; M904-L918 HydrophobicContact CE-CD2 4.26Å; L908-L918 HydrophobicContact CD1-CD2 3.66Å; L908-L918 HydrophobicContact CD1-CG 4.26Å; V914-L918 WeakPolarHBondContact O-CB 3.4Å; V914-L918 PolarHBondContact O-N 3.48Å; A915-L918 PolarHBondContact O-N 3.09Å; Y916-L918 VanDerWaalsContact C-N 3.29Å; Y916-L918 PolarHBondContact O-N 3.43Å; L918-H920 VanDerWaalsContact C-N 3.33Å; L918-H920 PolarHBondContact O-N 3.08Å; L918-C921 PolarHBondContact O-N 3.49Å; L918-I922 HydrophobicContact CD1-CD1 3.61Å; L918-I922 HydrophobicContact CD1-CG1 3.98Å; L918-I922 HydrophobicContact CG-CD1 3.67Å; L918-I922 HydrophobicContact CG-CG1 4.5Å; L918-I922 WeakPolarHBondContact O-CB 3.49Å; L918-I922 VanDerWaalsContact O-CD1 3.27Å; L918-I922 WeakPolarHBondContact O-CD1 3.21Å; L918-I922 WeakPolarHBondContact O-CG1 3.43Å; L918-I922 PolarHBondContact O-N 3.49Å
919	L	91.5	Very high	85.3	Confident	1 Å²	1	31 Å²	31	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-58	-43.7	177.5	-74.1	166.9	0	0	0	112.3	A915 Y916 I922 G923 L942 L945 L955 A958 T959 A962	A915-L919 WeakPolarHBondContact O-CB 3.42Å; A915-L919 WeakPolarHBondContact O-CD1 3.25Å; A915-L919 WeakPolarHBondContact O-CG 3.4Å; A915-L919 PolarHBondContact O-N 3.12Å; Y916-L919 PolarHBondContact O-N 2.74Å; L919-I922 PolarHBondContact O-N 3.33Å; L919-G923 PolarHBondContact O-N 3.07Å; L919-L942 HydrophobicContact CD2-CD2 3.41Å; L919-L942 VanDerWaalsContact CD2-CD2 3.41Å; L919-L945 HydrophobicContact CD2-CD1 4Å; L919-L955 HydrophobicContact CD1-CD1 3.71Å; L919-A958 HydrophobicContact CB-CB 4.06Å; L919-A958 HydrophobicContact CD1-CB 3.98Å; L919-T959 WeakPolarHBondContact CD1-OG1 3.48Å; L919-A962 WeakPolarHBondContact O-CB 3.36Å
920	H	89.9	Confident	85.8	Confident	58 Å²	58	34.1 Å²	34.1	27%	0.269	21%	0.206	S	C	.	.	H	α-helix	trans	-64.3	-46.6	175.2	-81	-66.2	0	0	0	112.5	Y916 L918 I922 G923 D924	Y916-H920 PolarHBondContact O-CD2 3.46Å; Y916-H920 VanDerWaalsContact O-CD2 3.22Å; Y916-H920 PolarHBondContact O-N 3.38Å; L918-H920 VanDerWaalsContact C-N 3.33Å; L918-H920 PolarHBondContact O-N 3.08Å; H920-I922 VanDerWaalsContact C-N 3.3Å; H920-I922 PolarHBondContact O-N 2.99Å; H920-G923 PolarHBondContact O-N 2.95Å; H920-G923 VanDerWaalsContact O-N 3.14Å; H920-D924 PolarHBondContact O-N 2.87Å
921	C	90.9	Very high	86.5	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57.6	-41	175.4	-176.4	0	0	0	0	112.6	L876 I879 Q880 A917 L918 M925	L876-C921 HydrophobicContact CD2-CB 4.32Å; I879-C921 WeakPolarHBondContact CG2-SG 3.34Å; Q880-C921 HydrophobicContact CB-CB 4.22Å; A917-C921 VanDerWaalsContact O-CB 3.24Å; A917-C921 WeakPolarHBondContact O-CB 3.32Å; A917-C921 PolarHBondContact O-N 3.46Å; L918-C921 PolarHBondContact O-N 3.49Å; C921-M925 WeakPolarHBondContact O-CB 3.38Å; C921-M925 VanDerWaalsContact O-CG 3.25Å; C921-M925 WeakPolarHBondContact O-CG 3.36Å; C921-M925 PolarHBondContact O-N 3.34Å
922	I	90.9	Very high	87.2	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-65.4	-44	175.8	-68.2	157.1	0	0	0	110.7	I905 L918 L919 H920 D924 M925 A926 M935 F966	I905-I922 HydrophobicContact CD1-CD1 3.38Å; I905-I922 HydrophobicContact CD1-CG1 3.89Å; I905-I922 HydrophobicContact CG1-CD1 3.32Å; I905-I922 HydrophobicContact CG1-CG1 4.3Å; L918-I922 HydrophobicContact CD1-CD1 3.61Å; L918-I922 HydrophobicContact CD1-CG1 3.98Å; L918-I922 HydrophobicContact CG-CD1 3.67Å; L918-I922 HydrophobicContact CG-CG1 4.5Å; L918-I922 WeakPolarHBondContact O-CB 3.49Å; L918-I922 VanDerWaalsContact O-CD1 3.27Å; L918-I922 WeakPolarHBondContact O-CD1 3.21Å; L918-I922 WeakPolarHBondContact O-CG1 3.43Å; L918-I922 PolarHBondContact O-N 3.49Å; L919-I922 PolarHBondContact O-N 3.33Å; H920-I922 VanDerWaalsContact C-N 3.3Å; H920-I922 PolarHBondContact O-N 2.99Å; I922-D924 PolarHBondContact O-N 2.79Å; I922-M925 PolarHBondContact O-N 3.44Å; I922-A926 VanDerWaalsContact O-CB 3.31Å; I922-A926 WeakPolarHBondContact O-CB 3.31Å; I922-A926 PolarHBondContact O-N 3.47Å; I922-M935 HydrophobicContact CB-CE 4.25Å; I922-M935 HydrophobicContact CG1-CE 4.26Å; I922-M935 HydrophobicContact CG2-CE 3.85Å; I922-M935 HydrophobicContact CG2-SD 4.24Å; I922-F966 HydrophobicContact CG2-CE2 3.88Å; I922-F966 HydrophobicContact CG2-CZ 3.99Å
923	G	90.1	Very high	87.3	Confident	2 Å²	2	30.9 Å²	30.9	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-55	-48.6	176.3	0	0	0	0	0	112.6	L919 H920 A926 N965	L919-G923 PolarHBondContact O-N 3.07Å; H920-G923 PolarHBondContact O-N 2.95Å; H920-G923 VanDerWaalsContact O-N 3.14Å; G923-A926 PolarHBondContact O-N 3.39Å; G923-N965 VanDerWaalsContact C-ND2 3.34Å; G923-N965 WeakPolarHBondContact O-CB 3.5Å; G923-N965 PolarHBondContact O-ND2 2.88Å
924	D	88.6	Confident	87.3	Confident	48 Å²	48	33.1 Å²	33.1	26%	0.257	17%	0.174	S	C	.	.	H	α-helix	trans	-76.4	-28.5	-177.5	-67.1	-36.7	0	0	0	113	Q880 A883 H920 I922 A927 N965	Q880-D924 HydrophobicContact CG-CB 4.31Å; Q880-D924 VanDerWaalsContact CG-OD2 3.25Å; Q880-D924 WeakPolarHBondContact CG-OD2 3.39Å; Q880-D924 PolarHBondContact NE2-OD2 3.21Å; A883-D924 HydrophobicContact CB-CB 4.49Å; H920-D924 PolarHBondContact O-N 2.87Å; I922-D924 PolarHBondContact O-N 2.79Å; D924-A927 WeakPolarHBondContact O-CB 3.49Å; D924-A927 PolarHBondContact O-N 3.24Å; D924-N965 PolarHBondContact OD1-ND2 2.69Å
925	M	88.5	Confident	87.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67.3	-38.8	168.5	-73.5	-71.7	-82.7	0	0	112.4	A883 R889 L892 L901 C921 I922 A927 N928 L931 M935	A883-M925 HydrophobicContact CB-CG 4.08Å; A883-M925 HydrophobicContact CB-SD 3.72Å; R889-M925 HydrophobicContact CB-SD 4.44Å; R889-M925 HydrophobicContact CG-SD 3.97Å; L892-M925 HydrophobicContact CB-CE 4.03Å; L892-M925 HydrophobicContact CD1-SD 4.09Å; L901-M925 HydrophobicContact CD1-CG 4.49Å; C921-M925 WeakPolarHBondContact O-CB 3.38Å; C921-M925 VanDerWaalsContact O-CG 3.25Å; C921-M925 WeakPolarHBondContact O-CG 3.36Å; C921-M925 PolarHBondContact O-N 3.34Å; I922-M925 PolarHBondContact O-N 3.44Å; M925-A927 PolarHBondContact O-N 3.27Å; M925-N928 PolarHBondContact O-N 3.11Å; M925-L931 HydrophobicContact CB-CD1 4.37Å; M925-L931 HydrophobicContact CE-CD1 3.76Å; M925-L931 WeakPolarHBondContact O-CB 3.4Å; M925-L931 WeakPolarHBondContact O-CD1 3.5Å; M925-L931 HydrophobicContact SD-CD1 4.06Å; M925-M935 HydrophobicContact CB-CE 3.92Å; M925-M935 HydrophobicContact CB-SD 3.93Å
926	A	87.7	Confident	87.1	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-1.1	178.1	0	0	0	0	0	114.3	I922 G923 M935 F966	I922-A926 VanDerWaalsContact O-CB 3.31Å; I922-A926 WeakPolarHBondContact O-CB 3.31Å; I922-A926 PolarHBondContact O-N 3.47Å; G923-A926 PolarHBondContact O-N 3.39Å; A926-M935 HydrophobicContact CB-SD 3.79Å; A926-F966 HydrophobicContact CB-CD2 3.95Å; A926-F966 HydrophobicContact CB-CE1 4.38Å; A926-F966 HydrophobicContact CB-CE2 3.73Å; A926-F966 HydrophobicContact CB-CG 4.37Å; A926-F966 HydrophobicContact CB-CZ 3.97Å
927	A	84.3	Confident	87	Confident	34 Å²	34	34.6 Å²	34.6	28%	0.281	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-3.9	177.5	0	0	0	0	0	114.7	D924 M925	D924-A927 WeakPolarHBondContact O-CB 3.49Å; D924-A927 PolarHBondContact O-N 3.24Å; M925-A927 PolarHBondContact O-N 3.27Å
928	N	83	Confident	86.9	Confident	12 Å²	12	35.2 Å²	35.2	6%	0.064	19%	0.194	C	C	.	.	S	Bend	trans	-104.1	141.1	167.9	158.1	-81.1	0	0	0	110.3	E886 M925 D930 L931 H932	E886-N928 PolarHBondContact OE1-ND2 3.49Å; M925-N928 PolarHBondContact O-N 3.11Å; N928-D930 PolarHBondContact O-N 3.03Å; N928-D930 PolarHBondContact OD1-N 3.33Å; N928-D930 VanDerWaalsContact OD1-N 3.09Å; N928-L931 HydrophobicContact CB-CD1 4.49Å; N928-L931 PolarHBondContact O-N 3.33Å; N928-L931 PolarHBondContact OD1-N 3.1Å; N928-H932 WeakPolarHBondContact O-CB 3.34Å; N928-H932 PolarHBondContact O-N 2.91Å
929	N	82	Confident	86.7	Confident	104 Å²	104	35.2 Å²	35.2	56%	0.556	19%	0.194	S	C	*	.	H	α-helix	trans	-61.3	-43.7	-171.6	-59.8	5.1	0	0	0	113.5	L931 H932 V933 I969	N929-L931 VanDerWaalsContact C-N 3.35Å; N929-H932 PolarHBondContact O-N 3.49Å; N929-V933 WeakPolarHBondContact O-CG2 3.37Å; N929-V933 PolarHBondContact O-N 2.98Å; N929-I969 HydrophobicContact CB-CD1 4.31Å; N929-I969 VanDerWaalsContact OD1-CD1 3.28Å; N929-I969 WeakPolarHBondContact OD1-CD1 3.33Å
930	D	81.9	Confident	86.6	Confident	122 Å²	122	38.5 Å²	38.5	65%	0.652	22%	0.215	S	C	*	.	H	α-helix	trans	-70.4	-34.4	-177.1	-59.9	-36.2	0	0	0	111.6	N928	N928-D930 PolarHBondContact O-N 3.03Å; N928-D930 PolarHBondContact OD1-N 3.33Å; N928-D930 VanDerWaalsContact OD1-N 3.09Å
931	L	82.4	Confident	86.5	Confident	5 Å²	5	38.7 Å²	38.7	3%	0.026	22%	0.216	C	C	.	.	H	α-helix	trans	-71	-44.4	171.8	-69	-176.1	0	0	0	111.8	R889 F898 M925 N928 N929 V933 R934 M935	R889-L931 HydrophobicContact CB-CD1 3.9Å; R889-L931 HydrophobicContact CG-CD1 4.35Å; F898-L931 HydrophobicContact CD2-CD2 3.72Å; F898-L931 HydrophobicContact CE2-CD2 3.96Å; M925-L931 HydrophobicContact CB-CD1 4.37Å; M925-L931 HydrophobicContact CE-CD1 3.76Å; M925-L931 WeakPolarHBondContact O-CB 3.4Å; M925-L931 WeakPolarHBondContact O-CD1 3.5Å; M925-L931 HydrophobicContact SD-CD1 4.06Å; N928-L931 HydrophobicContact CB-CD1 4.49Å; N928-L931 PolarHBondContact O-N 3.33Å; N928-L931 PolarHBondContact OD1-N 3.1Å; N929-L931 VanDerWaalsContact C-N 3.35Å; L931-V933 VanDerWaalsContact C-N 3.3Å; L931-V933 PolarHBondContact O-N 2.9Å; L931-R934 CarbonylContact O-C 3.58Å; L931-R934 WeakPolarHBondContact O-CA 3.37Å; L931-R934 WeakPolarHBondContact O-CB 3.44Å; L931-R934 PolarHBondContact O-N 3.36Å; L931-M935 WeakPolarHBondContact O-CG 3.24Å; L931-M935 PolarHBondContact O-N 3.35Å
932	H	85.1	Confident	86.4	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-52	-48.1	177.8	172.7	95.4	0	0	0	111.7	N928 N929 R934 M935 V936 F966 I969 E974	N928-H932 WeakPolarHBondContact O-CB 3.34Å; N928-H932 PolarHBondContact O-N 2.91Å; N929-H932 PolarHBondContact O-N 3.49Å; H932-R934 PolarHBondContact O-N 3.05Å; H932-M935 PolarHBondContact O-N 3.3Å; H932-V936 WeakPolarHBondContact O-CG2 3.43Å; H932-V936 PolarHBondContact O-N 2.82Å; H932-F966 PolarHBondContact CE1-O 2.66Å; H932-I969 HydrophobicContact CB-CD1 3.96Å; H932-I969 PolarHBondContact CE1-O 3.13Å; H932-I969 VanDerWaalsContact CE1-O 3.23Å; H932-E974 IonicContact CE1-OE2 3.37Å; H932-E974 IonicContact NE2-OE1 2.94Å; H932-E974 IonicContact NE2-OE2 2.69Å
933	V	85.2	Confident	86.4	Confident	98 Å²	98	39 Å²	39	59%	0.594	22%	0.217	S	C	*	.	H	α-helix	trans	-58.6	-33.6	178.4	172.2	0	0	0	0	112.5	N929 L931	N929-V933 WeakPolarHBondContact O-CG2 3.37Å; N929-V933 PolarHBondContact O-N 2.98Å; L931-V933 VanDerWaalsContact C-N 3.3Å; L931-V933 PolarHBondContact O-N 2.9Å
934	R	84	Confident	86.2	Confident	132 Å²	132	41.3 Å²	41.3	50%	0.498	23%	0.233	S	C	.	.	H	α-helix	trans	-76.8	-39.4	172.8	-59.2	-178.4	-172.1	-166.1	4.3	112.1	F898 L931 H932 V936	F898-R934 HydrophobicContact CE1-CB 3.8Å; F898-R934 HydrophobicContact CE2-CB 4.09Å; F898-R934 HydrophobicContact CZ-CB 3.32Å; F898-R934 HydrophobicContact CZ-CG 4.38Å; L931-R934 CarbonylContact O-C 3.58Å; L931-R934 WeakPolarHBondContact O-CA 3.37Å; L931-R934 WeakPolarHBondContact O-CB 3.44Å; L931-R934 PolarHBondContact O-N 3.36Å; H932-R934 PolarHBondContact O-N 3.05Å; R934-V936 VanDerWaalsContact C-N 3.34Å; R934-V936 PolarHBondContact O-N 2.96Å
935	M	86	Confident	86.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-74.8	-19.4	-175.9	-65.9	-166.5	124.6	0	0	114.2	F898 I922 M925 A926 L931 H932 A937 Y938 F966	F898-M935 HydrophobicContact CD2-CE 4.32Å; F898-M935 HydrophobicContact CE2-CE 3.81Å; F898-M935 HydrophobicContact CE2-CG 3.38Å; F898-M935 HydrophobicContact CE2-SD 4.06Å; F898-M935 HydrophobicContact CZ-CG 3.63Å; I922-M935 HydrophobicContact CB-CE 4.25Å; I922-M935 HydrophobicContact CG1-CE 4.26Å; I922-M935 HydrophobicContact CG2-CE 3.85Å; I922-M935 HydrophobicContact CG2-SD 4.24Å; M925-M935 HydrophobicContact CB-CE 3.92Å; M925-M935 HydrophobicContact CB-SD 3.93Å; A926-M935 HydrophobicContact CB-SD 3.79Å; L931-M935 WeakPolarHBondContact O-CG 3.24Å; L931-M935 PolarHBondContact O-N 3.35Å; H932-M935 PolarHBondContact O-N 3.3Å; M935-A937 PolarHBondContact O-N 2.74Å; M935-Y938 HydrophobicContact CB-CD2 3.99Å; M935-Y938 HydrophobicContact CB-CE2 4.21Å; M935-Y938 HydrophobicContact CG-CD2 4.27Å; M935-Y938 HydrophobicContact CG-CE2 4.11Å; M935-Y938 WeakPolarHBondContact O-CB 3.41Å; M935-Y938 WeakPolarHBondContact O-CD2 3.17Å; M935-Y938 PolarHBondContact O-N 3.08Å; M935-F966 HydrophobicContact CB-CE1 3.76Å; M935-F966 HydrophobicContact CB-CZ 3.78Å; M935-F966 WeakPolarHBondContact O-CE1 3.24Å
936	V	86.6	Confident	86	Confident	21 Å²	21	39.7 Å²	39.7	13%	0.127	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-53.4	-26.1	175.5	153.6	0	0	0	0	112.9	H932 R934 Y938 L939 E974 M977	H932-V936 WeakPolarHBondContact O-CG2 3.43Å; H932-V936 PolarHBondContact O-N 2.82Å; R934-V936 VanDerWaalsContact C-N 3.34Å; R934-V936 PolarHBondContact O-N 2.96Å; V936-Y938 PolarHBondContact O-N 3.5Å; V936-L939 VanDerWaalsContact O-CB 3.29Å; V936-L939 WeakPolarHBondContact O-CB 3.18Å; V936-L939 PolarHBondContact O-N 2.75Å; V936-L939 VanDerWaalsContact O-N 3.1Å; V936-E974 HydrophobicContact CG1-CG 3.78Å; V936-E974 HydrophobicContact CG2-CG 3.95Å; V936-M977 HydrophobicContact CG1-CE 4.12Å
937	A	86.6	Confident	85.8	Confident	74 Å²	74	44.1 Å²	44.1	61%	0.612	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-57.3	-27.3	171.2	0	0	0	0	0	114	M935 P940	M935-A937 PolarHBondContact O-N 2.74Å; A937-P940 WeakPolarHBondContact O-CD 3.41Å
938	Y	86.8	Confident	85.3	Confident	27 Å²	27	48.5 Å²	48.5	11%	0.106	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-88.7	-10.8	179.4	-45.9	-49.5	0	0	0	113.4	F898 A902 I905 M935 V936 P940 K941 L942	F898-Y938 HydrophobicContact CZ-CE2 4.19Å; A902-Y938 HydrophobicContact CB-CE1 4.06Å; A902-Y938 WeakPolarHBondContact CB-OH 2.91Å; I905-Y938 HydrophobicContact CB-CD1 4.32Å; I905-Y938 HydrophobicContact CD1-CD1 3.87Å; I905-Y938 HydrophobicContact CD1-CD2 3.46Å; I905-Y938 VanDerWaalsContact CD1-CD2 3.46Å; I905-Y938 HydrophobicContact CD1-CE1 4.22Å; I905-Y938 HydrophobicContact CD1-CE2 3.82Å; I905-Y938 HydrophobicContact CD1-CG 3.52Å; I905-Y938 HydrophobicContact CG2-CD1 3.9Å; I905-Y938 HydrophobicContact CG2-CG 4.1Å; M935-Y938 HydrophobicContact CB-CD2 3.99Å; M935-Y938 HydrophobicContact CB-CE2 4.21Å; M935-Y938 HydrophobicContact CG-CD2 4.27Å; M935-Y938 HydrophobicContact CG-CE2 4.11Å; M935-Y938 WeakPolarHBondContact O-CB 3.41Å; M935-Y938 WeakPolarHBondContact O-CD2 3.17Å; M935-Y938 PolarHBondContact O-N 3.08Å; V936-Y938 PolarHBondContact O-N 3.5Å; Y938-P940 VanDerWaalsContact C-CD 3.5Å; Y938-K941 WeakPolarHBondContact O-CA 3.33Å; Y938-K941 VanDerWaalsContact O-CB 3.32Å; Y938-K941 WeakPolarHBondContact O-CB 3.43Å; Y938-K941 PolarHBondContact O-N 3.18Å; Y938-L942 PolarHBondContact O-N 3.4Å
939	L	89.5	Confident	84.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-55.7	-40.9	-179	-178.3	60.5	0	0	0	113.1	V936 K941 L942 I943 L963 E974 M977 Y978	V936-L939 VanDerWaalsContact O-CB 3.29Å; V936-L939 WeakPolarHBondContact O-CB 3.18Å; V936-L939 PolarHBondContact O-N 2.75Å; V936-L939 VanDerWaalsContact O-N 3.1Å; L939-K941 VanDerWaalsContact C-N 3.31Å; L939-K941 PolarHBondContact O-N 2.79Å; L939-L942 PolarHBondContact O-N 3.01Å; L939-I943 HydrophobicContact CD1-CD1 3.99Å; L939-I943 HydrophobicContact CD1-CG1 4.15Å; L939-I943 HydrophobicContact CG-CD1 3.81Å; L939-I943 HydrophobicContact CG-CG1 4.42Å; L939-I943 WeakPolarHBondContact O-CB 3.05Å; L939-I943 VanDerWaalsContact O-CG1 3.23Å; L939-I943 WeakPolarHBondContact O-CG1 3.05Å; L939-I943 PolarHBondContact O-N 2.82Å; L939-L963 HydrophobicContact CD1-CD2 3.52Å; L939-E974 HydrophobicContact CD2-CB 4.3Å; L939-E974 HydrophobicContact CD2-CG 4.31Å; L939-M977 HydrophobicContact CB-SD 4.49Å; L939-M977 HydrophobicContact CD2-CB 4.01Å; L939-M977 HydrophobicContact CD2-CE 4.05Å; L939-M977 HydrophobicContact CD2-SD 4.35Å; L939-M977 HydrophobicContact CG-CB 4.43Å; L939-Y978 HydrophobicContact CD1-CD1 4.4Å; L939-Y978 HydrophobicContact CD1-CE1 3.73Å; L939-Y978 HydrophobicContact CD2-CD1 4.12Å; L939-Y978 HydrophobicContact CD2-CE1 3.54Å; L939-Y978 HydrophobicContact CD2-CE2 4.11Å; L939-Y978 HydrophobicContact CG-CE1 4.27Å
940	P	89.5	Confident	83	Confident	70 Å²	70	55 Å²	55	46%	0.455	29%	0.288	S	S	.	.	H	α-helix	trans	-57.5	-38.2	170.9	-25.1	34.7	0	0	0	114.1	A937 Y938 I943 S944 M977	A937-P940 WeakPolarHBondContact O-CD 3.41Å; Y938-P940 VanDerWaalsContact C-CD 3.5Å; P940-I943 PolarHBondContact O-N 2.97Å; P940-S944 PolarHBondContact O-N 2.64Å; P940-M977 HydrophobicContact CG-SD 3.65Å
941	K	87.9	Confident	81.8	Confident	63 Å²	63	58.1 Å²	58.1	27%	0.274	30%	0.296	S	S	.	.	H	α-helix	trans	-67.1	-47.1	177	-171.8	89	174.8	-149.8	0	110.1	I905 D906 Y938 L939 I943 S944 L945	I905-K941 HydrophobicContact CG2-CB 4.3Å; I905-K941 HydrophobicContact CG2-CG 3.98Å; I905-K941 WeakPolarHBondContact O-CE 3.34Å; I905-K941 PolarHBondContact O-NZ 3Å; I905-K941 VanDerWaalsContact O-NZ 3.16Å; D906-K941 PolarHBondContact O-NZ 3.43Å; Y938-K941 WeakPolarHBondContact O-CA 3.33Å; Y938-K941 VanDerWaalsContact O-CB 3.32Å; Y938-K941 WeakPolarHBondContact O-CB 3.43Å; Y938-K941 PolarHBondContact O-N 3.18Å; L939-K941 VanDerWaalsContact C-N 3.31Å; L939-K941 PolarHBondContact O-N 2.79Å; K941-I943 VanDerWaalsContact C-N 3.32Å; K941-I943 PolarHBondContact O-N 3.1Å; K941-S944 WeakPolarHBondContact O-CA 3.47Å; K941-S944 WeakPolarHBondContact O-CB 3.43Å; K941-S944 PolarHBondContact O-N 3.22Å; K941-S944 PolarHBondContact O-OG 2.95Å; K941-L945 WeakPolarHBondContact O-CG 3.4Å; K941-L945 PolarHBondContact O-N 3.42Å
942	L	89.1	Confident	81.5	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.016	31%	0.308	C	S	.	.	H	α-helix	trans	-59.1	-42.2	175.9	-61.4	178.4	0	0	0	111.9	L919 Y938 L939 S944 L945 M946 T959 L963 F966	L919-L942 HydrophobicContact CD2-CD2 3.41Å; L919-L942 VanDerWaalsContact CD2-CD2 3.41Å; Y938-L942 PolarHBondContact O-N 3.4Å; L939-L942 PolarHBondContact O-N 3.01Å; L942-S944 VanDerWaalsContact C-N 3.31Å; L942-S944 PolarHBondContact O-N 3.17Å; L942-L945 HydrophobicContact CD2-CD1 4.32Å; L942-L945 PolarHBondContact O-N 3.41Å; L942-M946 PolarHBondContact O-N 3.1Å; L942-M946 VanDerWaalsContact O-N 3.11Å; L942-T959 HydrophobicContact CB-CG2 4.32Å; L942-T959 HydrophobicContact CD2-CG2 4.41Å; L942-T959 WeakPolarHBondContact O-CG2 3.34Å; L942-L963 HydrophobicContact CB-CD2 3.95Å; L942-L963 HydrophobicContact CB-CG 4.35Å; L942-L963 HydrophobicContact CD1-CD2 4.05Å; L942-L963 HydrophobicContact CD1-CG 4.48Å; L942-F966 HydrophobicContact CD1-CD2 3.92Å; L942-F966 HydrophobicContact CD1-CE1 4.42Å; L942-F966 HydrophobicContact CD1-CE2 3.48Å; L942-F966 VanDerWaalsContact CD1-CE2 3.48Å; L942-F966 HydrophobicContact CD1-CZ 3.76Å
943	I	88.9	Confident	81.3	Confident	5 Å²	5	63.5 Å²	63.5	3%	0.026	33%	0.33	C	S	.	.	H	α-helix	trans	-65.1	-34.2	174.6	-65.8	167.4	0	0	0	111.4	L939 P940 K941 M946 K947 M977 L981	L939-I943 HydrophobicContact CD1-CD1 3.99Å; L939-I943 HydrophobicContact CD1-CG1 4.15Å; L939-I943 HydrophobicContact CG-CD1 3.81Å; L939-I943 HydrophobicContact CG-CG1 4.42Å; L939-I943 WeakPolarHBondContact O-CB 3.05Å; L939-I943 VanDerWaalsContact O-CG1 3.23Å; L939-I943 WeakPolarHBondContact O-CG1 3.05Å; L939-I943 PolarHBondContact O-N 2.82Å; P940-I943 PolarHBondContact O-N 2.97Å; K941-I943 VanDerWaalsContact C-N 3.32Å; K941-I943 PolarHBondContact O-N 3.1Å; I943-M946 PolarHBondContact O-N 3.3Å; I943-K947 HydrophobicContact CG2-CD 4.37Å; I943-K947 WeakPolarHBondContact O-CG 3.43Å; I943-K947 PolarHBondContact O-N 2.9Å; I943-M977 HydrophobicContact CD1-CB 3.92Å; I943-M977 WeakPolarHBondContact CD1-O 3.44Å; I943-L981 HydrophobicContact CD1-CB 4.28Å; I943-L981 HydrophobicContact CG1-CB 4.08Å; I943-L981 HydrophobicContact CG1-CD1 4.2Å; I943-L981 HydrophobicContact CG1-CD2 4.27Å; I943-L981 HydrophobicContact CG1-CG 4.38Å
944	S	87.5	Confident	81.2	Confident	49 Å²	49	64.8 Å²	64.8	34%	0.343	33%	0.33	S	S	.	.	H	α-helix	trans	-67.4	-37.7	174.6	79.2	0	0	0	0	112.7	P940 K941 L942 K947 L948	P940-S944 PolarHBondContact O-N 2.64Å; K941-S944 WeakPolarHBondContact O-CA 3.47Å; K941-S944 WeakPolarHBondContact O-CB 3.43Å; K941-S944 PolarHBondContact O-N 3.22Å; K941-S944 PolarHBondContact O-OG 2.95Å; L942-S944 VanDerWaalsContact C-N 3.31Å; L942-S944 PolarHBondContact O-N 3.17Å; S944-K947 PolarHBondContact O-N 2.93Å; S944-K947 VanDerWaalsContact O-N 3.12Å; S944-L948 PolarHBondContact O-N 3.16Å
945	L	86.2	Confident	81.3	Confident	15 Å²	15	59.2 Å²	59.2	8%	0.079	31%	0.31	C	S	.	.	H	α-helix	trans	-63.9	-42.2	174.5	-62.6	167.7	0	0	0	111.3	L908 L919 K941 L942 K947 L948 T959	L908-L945 HydrophobicContact CD2-CD1 3.39Å; L908-L945 HydrophobicContact CD2-CD2 3.92Å; L908-L945 HydrophobicContact CD2-CG 4.24Å; L919-L945 HydrophobicContact CD2-CD1 4Å; K941-L945 WeakPolarHBondContact O-CG 3.4Å; K941-L945 PolarHBondContact O-N 3.42Å; L942-L945 HydrophobicContact CD2-CD1 4.32Å; L942-L945 PolarHBondContact O-N 3.41Å; L945-K947 PolarHBondContact O-N 2.87Å; L945-K947 VanDerWaalsContact O-N 3.1Å; L945-L948 HydrophobicContact CD2-CD1 4.43Å; L945-L948 PolarHBondContact O-N 3.22Å; L945-T959 HydrophobicContact CB-CG2 4.06Å; L945-T959 HydrophobicContact CD1-CG2 4.46Å
946	M	86.4	Confident	81.5	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.4	-18.3	174.1	-72.4	-57.1	-54.2	0	0	114.3	L942 I943 Q949 T956 T959 L960 L963 L981 E984	L942-M946 PolarHBondContact O-N 3.1Å; L942-M946 VanDerWaalsContact O-N 3.11Å; I943-M946 PolarHBondContact O-N 3.3Å; M946-Q949 WeakPolarHBondContact O-CG 3.17Å; M946-Q949 PolarHBondContact O-NE2 3.36Å; M946-T956 HydrophobicContact CE-CG2 3.87Å; M946-T956 HydrophobicContact SD-CG2 4.12Å; M946-T959 HydrophobicContact CG-CG2 3.71Å; M946-T959 HydrophobicContact SD-CG2 3.76Å; M946-L960 HydrophobicContact CE-CD1 4.3Å; M946-L960 HydrophobicContact CE-CD2 3.56Å; M946-L960 HydrophobicContact CE-CG 3.79Å; M946-L960 HydrophobicContact SD-CD2 3.94Å; M946-L960 HydrophobicContact SD-CG 3.81Å; M946-L963 HydrophobicContact CG-CD1 3.67Å; M946-L963 HydrophobicContact SD-CD1 4.25Å; M946-L981 HydrophobicContact CB-CD1 3.96Å; M946-L981 HydrophobicContact CG-CD1 3.88Å; M946-E984 HydrophobicContact CB-CB 4.4Å
947	K	83	Confident	81.6	Confident	93 Å²	93	61.1 Å²	61.1	40%	0.404	32%	0.319	S	S	.	.	H	α-helix	trans	-93.4	-10.9	176.7	-67.8	168.2	-178.9	175.5	0	113.1	I943 S944 L945 Q949 E980 E984	I943-K947 HydrophobicContact CG2-CD 4.37Å; I943-K947 WeakPolarHBondContact O-CG 3.43Å; I943-K947 PolarHBondContact O-N 2.9Å; S944-K947 PolarHBondContact O-N 2.93Å; S944-K947 VanDerWaalsContact O-N 3.12Å; L945-K947 PolarHBondContact O-N 2.87Å; L945-K947 VanDerWaalsContact O-N 3.1Å; K947-Q949 VanDerWaalsContact C-N 3.29Å; K947-Q949 PolarHBondContact O-N 3.26Å; K947-E980 WeakPolarHBondContact CE-O 3.42Å; K947-E980 IonicContact NZ-OE2 3.63Å; K947-E980 PolarHBondContact NZ-OE2 2.84Å; K947-E984 HydrophobicContact CG-CG 3.81Å
948	L	73.7	Confident	81.7	Confident	125 Å²	125	57.7 Å²	57.7	65%	0.654	29%	0.291	S	S	*	.			trans	-89.5	37.3	-179.2	-69.1	170.8	0	0	0	113.3	S944 L945 E950	S944-L948 PolarHBondContact O-N 3.16Å; L945-L948 HydrophobicContact CD2-CD1 4.43Å; L945-L948 PolarHBondContact O-N 3.22Å; L948-E950 PolarHBondContact O-N 3.04Å
949	Q	58.3	Low	82	Confident	69 Å²	69	56.4 Å²	56.4	32%	0.322	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-6.1	-159.8	-60.1	-164.7	-18.4	0	0	117.6	M946 K947 K951 E984	M946-Q949 WeakPolarHBondContact O-CG 3.17Å; M946-Q949 PolarHBondContact O-NE2 3.36Å; K947-Q949 VanDerWaalsContact C-N 3.29Å; K947-Q949 PolarHBondContact O-N 3.26Å; Q949-K951 PolarHBondContact O-N 3.47Å; Q949-E984 PolarHBondContact NE2-OE2 3.08Å
950	E	59	Low	82.1	Confident	183 Å²	183	56.4 Å²	56.4	86%	0.855	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-16.5	-164.6	-68.4	-160.4	145	0	0	116.4	L948	L948-E950 PolarHBondContact O-N 3.04Å
951	K	55.8	Low	82.2	Confident	188 Å²	188	53.7 Å²	53.7	82%	0.817	27%	0.269	S	S	*	.	S	Bend	trans	-137.4	-22.4	-166.6	-67.1	-173.2	-178.3	169.5	0	120.7	Q949	Q949-K951 PolarHBondContact O-N 3.47Å
952	E	76.3	Confident	82.4	Confident	63 Å²	63	50.7 Å²	50.7	29%	0.294	26%	0.256	S	S	.	.			trans	-134.8	101.1	179.4	-76.7	-164.3	155.7	0	0	114.7	S911 G912 Y916 Q954 L955 T956	S911-E952 WeakPolarHBondContact CA-OE2 3.47Å; S911-E952 VanDerWaalsContact CB-CD 3.46Å; S911-E952 WeakPolarHBondContact CB-OE1 3.5Å; S911-E952 WeakPolarHBondContact CB-OE2 3.41Å; G912-E952 PolarHBondContact N-OE2 3.1Å; Y916-E952 VanDerWaalsContact OH-CD 3.23Å; Y916-E952 PolarHBondContact OH-OE1 3.31Å; Y916-E952 PolarHBondContact OH-OE2 3.35Å; Y916-E952 VanDerWaalsContact OH-OE2 3.07Å; E952-Q954 VanDerWaalsContact C-N 3.25Å; E952-Q954 PolarHBondContact O-N 3.36Å; E952-L955 HydrophobicContact CB-CB 3.83Å; E952-L955 PolarHBondContact O-N 3.36Å; E952-L955 VanDerWaalsContact O-N 3.17Å; E952-T956 PolarHBondContact O-N 3.09Å; E952-T956 PolarHBondContact O-OG1 3.36Å
953	A	81.7	Confident	82.6	Confident	56 Å²	56	50.5 Å²	50.5	46%	0.463	26%	0.256	S	S	.	.	H	α-helix	trans	-57.7	-34.7	172.4	0	0	0	0	0	113.4	T956 L957 Q997	A953-T956 PolarHBondContact O-N 2.81Å; A953-L957 WeakPolarHBondContact O-CB 3.39Å; A953-L957 PolarHBondContact O-N 3.28Å; A953-Q997 PolarHBondContact O-NE2 2.92Å
954	Q	83.3	Confident	82.7	Confident	124 Å²	124	51.1 Å²	51.1	58%	0.579	26%	0.259	S	S	*	.	H	α-helix	trans	-67.2	-37.1	177.1	-72.2	-179.2	-16.7	0	0	112.4	Y916 E952 L957 A958	Y916-Q954 HydrophobicContact CE1-CB 3.98Å; Y916-Q954 HydrophobicContact CE2-CB 3.97Å; Y916-Q954 VanDerWaalsContact CE2-OE1 3.28Å; Y916-Q954 PolarHBondContact OH-OE1 2.82Å; E952-Q954 VanDerWaalsContact C-N 3.25Å; E952-Q954 PolarHBondContact O-N 3.36Å; Q954-L957 PolarHBondContact O-N 2.94Å; Q954-A958 WeakPolarHBondContact O-CB 3.28Å; Q954-A958 PolarHBondContact O-N 2.89Å
955	L	86.3	Confident	82.8	Confident	16 Å²	16	49.2 Å²	49.2	8%	0.084	25%	0.245	C	C	.	.	H	α-helix	trans	-67.1	-42.8	175.5	-167.1	66.7	0	0	0	110.9	A915 Y916 L919 E952 A958 T959	A915-L955 HydrophobicContact CB-CD1 3.93Å; Y916-L955 HydrophobicContact CD1-CD1 4.04Å; Y916-L955 HydrophobicContact CE1-CB 3.96Å; Y916-L955 HydrophobicContact CE1-CD1 3.98Å; L919-L955 HydrophobicContact CD1-CD1 3.71Å; E952-L955 HydrophobicContact CB-CB 3.83Å; E952-L955 PolarHBondContact O-N 3.36Å; E952-L955 VanDerWaalsContact O-N 3.17Å; L955-A958 PolarHBondContact O-N 3.33Å; L955-T959 WeakPolarHBondContact O-CB 3.43Å; L955-T959 PolarHBondContact O-N 3.48Å; L955-T959 PolarHBondContact O-OG1 2.92Å
956	T	88.5	Confident	83	Confident	11 Å²	11	48.5 Å²	48.5	7%	0.067	24%	0.242	C	C	.	.	H	α-helix	trans	-60.1	-45.1	173	-52.1	0	0	0	0	111.3	M946 E952 A953 T959 L960 Q997	M946-T956 HydrophobicContact CE-CG2 3.87Å; M946-T956 HydrophobicContact SD-CG2 4.12Å; E952-T956 PolarHBondContact O-N 3.09Å; E952-T956 PolarHBondContact O-OG1 3.36Å; A953-T956 PolarHBondContact O-N 2.81Å; T956-T959 PolarHBondContact O-N 2.85Å; T956-L960 HydrophobicContact CG2-CD1 4.07Å; T956-L960 HydrophobicContact CG2-CG 4.49Å; T956-L960 WeakPolarHBondContact O-CB 3.48Å; T956-L960 VanDerWaalsContact O-CG 3.3Å; T956-L960 WeakPolarHBondContact O-CG 3.42Å; T956-L960 PolarHBondContact O-N 2.78Å; T956-Q997 HydrophobicContact CG2-CG 4.37Å
957	L	89.3	Confident	83.3	Confident	49 Å²	49	48.7 Å²	48.7	26%	0.257	24%	0.243	S	C	.	.	H	α-helix	trans	-62.5	-46.1	178.9	-174.1	71	0	0	0	112.3	A953 Q954 L960 A961 Q997 Y1000	A953-L957 WeakPolarHBondContact O-CB 3.39Å; A953-L957 PolarHBondContact O-N 3.28Å; Q954-L957 PolarHBondContact O-N 2.94Å; L957-L960 PolarHBondContact O-N 3.38Å; L957-A961 WeakPolarHBondContact O-CB 3.48Å; L957-A961 PolarHBondContact O-N 2.94Å; L957-Q997 HydrophobicContact CB-CG 4.27Å; L957-Q997 HydrophobicContact CD1-CG 4.07Å; L957-Y1000 HydrophobicContact CD1-CD2 3.79Å; L957-Y1000 HydrophobicContact CD1-CE2 3.94Å; L957-Y1000 HydrophobicContact CG-CE2 4.41Å
958	A	89.8	Confident	83.5	Confident	2 Å²	2	52 Å²	52	2%	0.017	25%	0.253	C	S	.	.	H	α-helix	trans	-65.9	-38.3	176.9	0	0	0	0	0	112.2	L919 Q954 L955 A961 A962	L919-A958 HydrophobicContact CB-CB 4.06Å; L919-A958 HydrophobicContact CD1-CB 3.98Å; Q954-A958 WeakPolarHBondContact O-CB 3.28Å; Q954-A958 PolarHBondContact O-N 2.89Å; L955-A958 PolarHBondContact O-N 3.33Å; A958-A961 PolarHBondContact O-N 3.32Å; A958-A962 PolarHBondContact O-N 3.08Å
959	T	91.6	Very high	84.1	Confident	1 Å²	1	48 Å²	48	1%	0.006	23%	0.232	C	C	.	.	H	α-helix	trans	-66	-43.2	176.2	-53.6	0	0	0	0	111.3	L919 L942 L945 M946 L955 T956 A962 L963	L919-T959 WeakPolarHBondContact CD1-OG1 3.48Å; L942-T959 HydrophobicContact CB-CG2 4.32Å; L942-T959 HydrophobicContact CD2-CG2 4.41Å; L942-T959 WeakPolarHBondContact O-CG2 3.34Å; L945-T959 HydrophobicContact CB-CG2 4.06Å; L945-T959 HydrophobicContact CD1-CG2 4.46Å; M946-T959 HydrophobicContact CG-CG2 3.71Å; M946-T959 HydrophobicContact SD-CG2 3.76Å; L955-T959 WeakPolarHBondContact O-CB 3.43Å; L955-T959 PolarHBondContact O-N 3.48Å; L955-T959 PolarHBondContact O-OG1 2.92Å; T956-T959 PolarHBondContact O-N 2.85Å; T959-A962 PolarHBondContact O-N 3.11Å; T959-L963 HydrophobicContact CG2-CD1 4Å; T959-L963 WeakPolarHBondContact O-CB 3.1Å; T959-L963 VanDerWaalsContact O-CG 3.28Å; T959-L963 WeakPolarHBondContact O-CG 3.5Å; T959-L963 PolarHBondContact O-N 3.06Å
960	L	92.5	Very high	85.5	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-45.5	172.9	-74.2	169.2	0	0	0	111.5	M946 T956 L957 A962 L963 V964 L985 C988 Q997 Y1000 A1001 I1004	M946-L960 HydrophobicContact CE-CD1 4.3Å; M946-L960 HydrophobicContact CE-CD2 3.56Å; M946-L960 HydrophobicContact CE-CG 3.79Å; M946-L960 HydrophobicContact SD-CD2 3.94Å; M946-L960 HydrophobicContact SD-CG 3.81Å; T956-L960 HydrophobicContact CG2-CD1 4.07Å; T956-L960 HydrophobicContact CG2-CG 4.49Å; T956-L960 WeakPolarHBondContact O-CB 3.48Å; T956-L960 VanDerWaalsContact O-CG 3.3Å; T956-L960 WeakPolarHBondContact O-CG 3.42Å; T956-L960 PolarHBondContact O-N 2.78Å; L957-L960 PolarHBondContact O-N 3.38Å; L960-A962 VanDerWaalsContact C-N 3.27Å; L960-A962 PolarHBondContact O-N 3.45Å; L960-L963 PolarHBondContact O-N 3.42Å; L960-L963 VanDerWaalsContact O-N 3.15Å; L960-V964 WeakPolarHBondContact O-CG2 3.42Å; L960-V964 PolarHBondContact O-N 3.15Å; L960-L985 HydrophobicContact CD2-CD2 3.69Å; L960-C988 HydrophobicContact CD1-CB 4.16Å; L960-Q997 HydrophobicContact CD1-CB 3.83Å; L960-Q997 HydrophobicContact CD1-CG 3.95Å; L960-Y1000 HydrophobicContact CB-CD2 4.41Å; L960-A1001 HydrophobicContact CD2-CB 4.4Å; L960-I1004 HydrophobicContact CB-CD1 4.45Å; L960-I1004 HydrophobicContact CD2-CD1 3.65Å
961	A	91	Very high	86.9	Confident	12 Å²	12	40.8 Å²	40.8	10%	0.099	20%	0.201	C	C	.	.	H	α-helix	trans	-57	-40.7	177.3	0	0	0	0	0	112.1	L957 A958 Y1000	L957-A961 WeakPolarHBondContact O-CB 3.48Å; L957-A961 PolarHBondContact O-N 2.94Å; A958-A961 PolarHBondContact O-N 3.32Å; A961-Y1000 HydrophobicContact CB-CD2 4.1Å; A961-Y1000 HydrophobicContact CB-CE1 4.44Å; A961-Y1000 HydrophobicContact CB-CE2 3.65Å
962	A	91.8	Very high	88.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.9	-51.4	173.1	0	0	0	0	0	111.9	L919 A958 T959 L960 V964 N965 F966	L919-A962 WeakPolarHBondContact O-CB 3.36Å; A958-A962 PolarHBondContact O-N 3.08Å; T959-A962 PolarHBondContact O-N 3.11Å; L960-A962 VanDerWaalsContact C-N 3.27Å; L960-A962 PolarHBondContact O-N 3.45Å; A962-V964 PolarHBondContact O-N 3.3Å; A962-V964 VanDerWaalsContact O-N 3.14Å; A962-N965 PolarHBondContact O-N 3.31Å; A962-F966 WeakPolarHBondContact O-CD2 3.49Å; A962-F966 PolarHBondContact O-N 2.99Å
963	L	93.6	Very high	89	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.1	-24.1	-177.8	-73.4	166.5	0	0	0	114	L939 L942 M946 T959 L960 N965 T967 L981 I1004	L939-L963 HydrophobicContact CD1-CD2 3.52Å; L942-L963 HydrophobicContact CB-CD2 3.95Å; L942-L963 HydrophobicContact CB-CG 4.35Å; L942-L963 HydrophobicContact CD1-CD2 4.05Å; L942-L963 HydrophobicContact CD1-CG 4.48Å; M946-L963 HydrophobicContact CG-CD1 3.67Å; M946-L963 HydrophobicContact SD-CD1 4.25Å; T959-L963 HydrophobicContact CG2-CD1 4Å; T959-L963 WeakPolarHBondContact O-CB 3.1Å; T959-L963 VanDerWaalsContact O-CG 3.28Å; T959-L963 WeakPolarHBondContact O-CG 3.5Å; T959-L963 PolarHBondContact O-N 3.06Å; L960-L963 PolarHBondContact O-N 3.42Å; L960-L963 VanDerWaalsContact O-N 3.15Å; L963-N965 VanDerWaalsContact C-N 3.32Å; L963-N965 PolarHBondContact O-N 3.31Å; L963-T967 PolarHBondContact O-N 2.97Å; L963-T967 PolarHBondContact O-OG1 2.71Å; L963-L981 HydrophobicContact CD1-CD1 4.24Å; L963-L981 HydrophobicContact CD1-CD2 4.06Å; L963-L981 HydrophobicContact CD2-CD2 4.16Å; L963-I1004 HydrophobicContact CB-CD1 3.67Å; L963-I1004 HydrophobicContact CB-CG1 4.39Å
964	V	92.1	Very high	89.5	Confident	17 Å²	17	37.3 Å²	37.3	10%	0.103	19%	0.192	C	C	.	.	H	α-helix	trans	-61.8	-37.8	171.9	170.2	0	0	0	0	112.2	L960 A962 T967 R968 Y1000 A1003 I1004 N1007	L960-V964 WeakPolarHBondContact O-CG2 3.42Å; L960-V964 PolarHBondContact O-N 3.15Å; A962-V964 PolarHBondContact O-N 3.3Å; A962-V964 VanDerWaalsContact O-N 3.14Å; V964-T967 PolarHBondContact O-OG1 3.37Å; V964-R968 WeakPolarHBondContact O-CG 2.82Å; V964-Y1000 HydrophobicContact CG2-CD1 3.71Å; V964-Y1000 HydrophobicContact CG2-CG 4.11Å; V964-A1003 HydrophobicContact CG1-CB 4.49Å; V964-A1003 HydrophobicContact CG2-CB 4.24Å; V964-I1004 HydrophobicContact CB-CG1 4.4Å; V964-I1004 HydrophobicContact CG2-CD1 4.05Å; V964-I1004 HydrophobicContact CG2-CG1 3.64Å; V964-N1007 PolarHBondContact O-ND2 2.98Å
965	N	89.2	Confident	89.9	Confident	10 Å²	10	32.4 Å²	32.4	5%	0.053	17%	0.17	C	C	.	.	H	α-helix	trans	-81.4	-37.7	178.9	-74.9	-7.8	0	0	0	111.7	G923 D924 A962 L963 R968	G923-N965 VanDerWaalsContact C-ND2 3.34Å; G923-N965 WeakPolarHBondContact O-CB 3.5Å; G923-N965 PolarHBondContact O-ND2 2.88Å; D924-N965 PolarHBondContact OD1-ND2 2.69Å; A962-N965 PolarHBondContact O-N 3.31Å; L963-N965 VanDerWaalsContact C-N 3.32Å; L963-N965 PolarHBondContact O-N 3.31Å; N965-R968 WeakPolarHBondContact O-CB 3.3Å; N965-R968 PolarHBondContact O-N 2.66Å; N965-R968 PolarHBondContact OD1-NE 3.4Å; N965-R968 VanDerWaalsContact OD1-NE 3.13Å; N965-R968 PolarHBondContact OD1-NH2 3.47Å
966	F	90.6	Very high	90.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-53.1	-56.7	169.5	-81.3	-96.8	0	0	0	110.7	I922 A926 H932 M935 L942 A962 R968 I969	I922-F966 HydrophobicContact CG2-CE2 3.88Å; I922-F966 HydrophobicContact CG2-CZ 3.99Å; A926-F966 HydrophobicContact CB-CD2 3.95Å; A926-F966 HydrophobicContact CB-CE1 4.38Å; A926-F966 HydrophobicContact CB-CE2 3.73Å; A926-F966 HydrophobicContact CB-CG 4.37Å; A926-F966 HydrophobicContact CB-CZ 3.97Å; H932-F966 PolarHBondContact CE1-O 2.66Å; M935-F966 HydrophobicContact CB-CE1 3.76Å; M935-F966 HydrophobicContact CB-CZ 3.78Å; M935-F966 WeakPolarHBondContact O-CE1 3.24Å; L942-F966 HydrophobicContact CD1-CD2 3.92Å; L942-F966 HydrophobicContact CD1-CE1 4.42Å; L942-F966 HydrophobicContact CD1-CE2 3.48Å; L942-F966 VanDerWaalsContact CD1-CE2 3.48Å; L942-F966 HydrophobicContact CD1-CZ 3.76Å; A962-F966 WeakPolarHBondContact O-CD2 3.49Å; A962-F966 PolarHBondContact O-N 2.99Å; F966-R968 PolarHBondContact O-N 3.17Å; F966-I969 PolarHBondContact O-N 2.89Å; F966-I969 VanDerWaalsContact O-N 3.11Å
967	T	91.8	Very high	90.4	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.018	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-0	-175.4	53.2	0	0	0	0	116.1	L963 V964 I969 Y978 I1004 N1007 L1008	L963-T967 PolarHBondContact O-N 2.97Å; L963-T967 PolarHBondContact O-OG1 2.71Å; V964-T967 PolarHBondContact O-OG1 3.37Å; T967-I969 PolarHBondContact O-N 3.17Å; T967-Y978 HydrophobicContact CG2-CD1 3.9Å; T967-Y978 HydrophobicContact CG2-CE1 3.41Å; T967-Y978 VanDerWaalsContact CG2-CE1 3.41Å; T967-I1004 HydrophobicContact CG2-CG2 3.91Å; T967-N1007 WeakPolarHBondContact O-CB 3.38Å; T967-N1007 PolarHBondContact OG1-ND2 2.78Å; T967-N1007 VanDerWaalsContact OG1-ND2 3.1Å; T967-L1008 HydrophobicContact CG2-CD2 3.71Å; T967-L1008 HydrophobicContact CG2-CG 4.29Å
968	R	87.5	Confident	90.6	Very high	163 Å²	163	38.4 Å²	38.4	62%	0.615	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-26.4	168.5	-64.2	-179.4	-174.1	-167.8	5.4	112.3	V964 N965 F966	V964-R968 WeakPolarHBondContact O-CG 2.82Å; N965-R968 WeakPolarHBondContact O-CB 3.3Å; N965-R968 PolarHBondContact O-N 2.66Å; N965-R968 PolarHBondContact OD1-NE 3.4Å; N965-R968 VanDerWaalsContact OD1-NE 3.13Å; N965-R968 PolarHBondContact OD1-NH2 3.47Å; F966-R968 PolarHBondContact O-N 3.17Å
969	I	85.3	Confident	90.8	Very high	41 Å²	41	42.3 Å²	42.3	21%	0.21	21%	0.21	C	C	.	.	S	Bend	trans	-124.9	130.2	178	-54.5	166.2	0	0	0	105.6	N929 H932 F966 T967	N929-I969 HydrophobicContact CB-CD1 4.31Å; N929-I969 VanDerWaalsContact OD1-CD1 3.28Å; N929-I969 WeakPolarHBondContact OD1-CD1 3.33Å; H932-I969 HydrophobicContact CB-CD1 3.96Å; H932-I969 PolarHBondContact CE1-O 3.13Å; H932-I969 VanDerWaalsContact CE1-O 3.23Å; F966-I969 PolarHBondContact O-N 2.89Å; F966-I969 VanDerWaalsContact O-N 3.11Å; T967-I969 PolarHBondContact O-N 3.17Å
970	I	88.3	Confident	90.8	Very high	35 Å²	35	47 Å²	47	18%	0.179	23%	0.232	C	C	.	.			trans	-138.1	110.5	-179.3	-61.2	170.2	0	0	0	106.6	I975 Y978 L1008 V1011 L1014	I970-I975 HydrophobicContact CG2-CG1 4.26Å; I970-Y978 HydrophobicContact CB-CE2 4.24Å; I970-Y978 HydrophobicContact CG1-CD2 4.38Å; I970-Y978 HydrophobicContact CG1-CE2 3.85Å; I970-Y978 HydrophobicContact CG2-CD2 3.91Å; I970-Y978 HydrophobicContact CG2-CE2 3.81Å; I970-L1008 HydrophobicContact CD1-CD2 3.87Å; I970-V1011 HydrophobicContact CB-CG2 4.09Å; I970-V1011 HydrophobicContact CD1-CG2 3.93Å; I970-V1011 HydrophobicContact CG2-CG2 4Å; I970-L1014 HydrophobicContact CD1-CD1 4.31Å; I970-L1014 HydrophobicContact CG2-CD1 3.98Å
971	N	88.3	Confident	90.9	Very high	65 Å²	65	47 Å²	47	35%	0.348	23%	0.232	S	C	.	.			trans	-92.7	157.1	173.6	-53.4	-81.9	0	0	0	110.4	S973 E974	N971-S973 PolarHBondContact O-N 3.27Å; N971-E974 WeakPolarHBondContact CB-OE1 3.48Å; N971-E974 PolarHBondContact N-OE1 3.24Å; N971-E974 PolarHBondContact ND2-OE1 3.38Å; N971-E974 WeakPolarHBondContact O-CB 3.4Å; N971-E974 PolarHBondContact O-N 3.16Å
972	D	87.9	Confident	91.1	Very high	144 Å²	144	46.4 Å²	46.4	77%	0.77	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-32.9	-176.7	-62.1	-22.4	0	0	0	113.6	E974 I975	D972-E974 VanDerWaalsContact C-N 3.25Å; D972-E974 PolarHBondContact O-N 3.16Å; D972-I975 PolarHBondContact O-N 3.03Å
973	S	89.5	Confident	91.1	Very high	89 Å²	89	48.8 Å²	48.8	62%	0.622	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-25	176.8	64.8	0	0	0	0	114.1	N971	N971-S973 PolarHBondContact O-N 3.27Å
974	E	91.2	Very high	91	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-18.3	-178.4	-61.4	153.4	-119.1	0	0	113.3	H932 V936 L939 N971 D972 K976 M977 Y978	H932-E974 IonicContact CE1-OE2 3.37Å; H932-E974 IonicContact NE2-OE1 2.94Å; H932-E974 IonicContact NE2-OE2 2.69Å; V936-E974 HydrophobicContact CG1-CG 3.78Å; V936-E974 HydrophobicContact CG2-CG 3.95Å; L939-E974 HydrophobicContact CD2-CB 4.3Å; L939-E974 HydrophobicContact CD2-CG 4.31Å; N971-E974 WeakPolarHBondContact CB-OE1 3.48Å; N971-E974 PolarHBondContact N-OE1 3.24Å; N971-E974 PolarHBondContact ND2-OE1 3.38Å; N971-E974 WeakPolarHBondContact O-CB 3.4Å; N971-E974 PolarHBondContact O-N 3.16Å; D972-E974 VanDerWaalsContact C-N 3.25Å; D972-E974 PolarHBondContact O-N 3.16Å; E974-K976 PolarHBondContact O-N 3.15Å; E974-K976 VanDerWaalsContact O-N 3.1Å; E974-M977 HydrophobicContact CB-CE 4.16Å; E974-M977 HydrophobicContact CG-CE 3.93Å; E974-M977 WeakPolarHBondContact O-CA 3.37Å; E974-M977 WeakPolarHBondContact O-CB 3.29Å; E974-M977 PolarHBondContact O-N 3.22Å; E974-Y978 HydrophobicContact CB-CD2 3.79Å; E974-Y978 HydrophobicContact CB-CE2 3.43Å; E974-Y978 VanDerWaalsContact CB-CE2 3.43Å; E974-Y978 HydrophobicContact CG-CE2 4.24Å; E974-Y978 WeakPolarHBondContact O-CD2 3.12Å; E974-Y978 PolarHBondContact O-N 3.49Å; E974-Y978 WeakPolarHBondContact OE2-CE2 3.23Å; E974-Y978 PolarHBondContact OE2-OH 2.94Å
975	I	91.5	Very high	91	Very high	22 Å²	22	49 Å²	49	11%	0.113	24%	0.242	C	C	.	.	H	α-helix	trans	-51.7	-39.9	-177.5	-68.7	177.9	0	0	0	111.1	I970 D972 K979 V1011 E1013 L1014	I970-I975 HydrophobicContact CG2-CG1 4.26Å; D972-I975 PolarHBondContact O-N 3.03Å; I975-K979 WeakPolarHBondContact O-CG 3.49Å; I975-K979 PolarHBondContact O-N 3.25Å; I975-K979 VanDerWaalsContact O-N 3.17Å; I975-V1011 HydrophobicContact CD1-CG1 3.81Å; I975-V1011 HydrophobicContact CG1-CG1 4.22Å; I975-E1013 HydrophobicContact CD1-CB 4.49Å; I975-E1013 HydrophobicContact CG2-CB 3.81Å; I975-E1013 HydrophobicContact CG2-CG 4.5Å; I975-L1014 HydrophobicContact CG1-CD1 4.26Å; I975-L1014 HydrophobicContact CG2-CD2 4.39Å; I975-L1014 HydrophobicContact CG2-CG 4.18Å
976	K	93	Very high	91.2	Very high	159 Å²	159	50.2 Å²	50.2	69%	0.691	25%	0.248	S	C	*	.	H	α-helix	trans	-62	-43.9	175.3	-173.7	-172.1	171.5	-167.5	0	112.3	E974 K979	E974-K976 PolarHBondContact O-N 3.15Å; E974-K976 VanDerWaalsContact O-N 3.1Å; K976-K979 PolarHBondContact O-N 2.62Å
977	M	93	Very high	91.2	Very high	42 Å²	42	55.2 Å²	55.2	21%	0.207	27%	0.27	C	S	.	.	H	α-helix	trans	-67.7	-45.6	-178.2	-63.3	-172.3	-81.9	0	0	111	V936 L939 P940 I943 E974 K979 E980 L981	V936-M977 HydrophobicContact CG1-CE 4.12Å; L939-M977 HydrophobicContact CB-SD 4.49Å; L939-M977 HydrophobicContact CD2-CB 4.01Å; L939-M977 HydrophobicContact CD2-CE 4.05Å; L939-M977 HydrophobicContact CD2-SD 4.35Å; L939-M977 HydrophobicContact CG-CB 4.43Å; P940-M977 HydrophobicContact CG-SD 3.65Å; I943-M977 HydrophobicContact CD1-CB 3.92Å; I943-M977 WeakPolarHBondContact CD1-O 3.44Å; E974-M977 HydrophobicContact CB-CE 4.16Å; E974-M977 HydrophobicContact CG-CE 3.93Å; E974-M977 WeakPolarHBondContact O-CA 3.37Å; E974-M977 WeakPolarHBondContact O-CB 3.29Å; E974-M977 PolarHBondContact O-N 3.22Å; M977-K979 VanDerWaalsContact C-N 3.26Å; M977-K979 PolarHBondContact O-N 3.06Å; M977-E980 WeakPolarHBondContact O-CB 3.46Å; M977-E980 PolarHBondContact O-N 3.02Å; M977-L981 PolarHBondContact O-N 3.17Å
978	Y	93.9	Very high	91.1	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.2	-28.7	177.2	-65.4	-56.7	0	0	0	113.2	L939 T967 I970 E974 E980 L981 I982 L1008 L1014	L939-Y978 HydrophobicContact CD1-CD1 4.4Å; L939-Y978 HydrophobicContact CD1-CE1 3.73Å; L939-Y978 HydrophobicContact CD2-CD1 4.12Å; L939-Y978 HydrophobicContact CD2-CE1 3.54Å; L939-Y978 HydrophobicContact CD2-CE2 4.11Å; L939-Y978 HydrophobicContact CG-CE1 4.27Å; T967-Y978 HydrophobicContact CG2-CD1 3.9Å; T967-Y978 HydrophobicContact CG2-CE1 3.41Å; T967-Y978 VanDerWaalsContact CG2-CE1 3.41Å; I970-Y978 HydrophobicContact CB-CE2 4.24Å; I970-Y978 HydrophobicContact CG1-CD2 4.38Å; I970-Y978 HydrophobicContact CG1-CE2 3.85Å; I970-Y978 HydrophobicContact CG2-CD2 3.91Å; I970-Y978 HydrophobicContact CG2-CE2 3.81Å; E974-Y978 HydrophobicContact CB-CD2 3.79Å; E974-Y978 HydrophobicContact CB-CE2 3.43Å; E974-Y978 VanDerWaalsContact CB-CE2 3.43Å; E974-Y978 HydrophobicContact CG-CE2 4.24Å; E974-Y978 WeakPolarHBondContact O-CD2 3.12Å; E974-Y978 PolarHBondContact O-N 3.49Å; E974-Y978 WeakPolarHBondContact OE2-CE2 3.23Å; E974-Y978 PolarHBondContact OE2-OH 2.94Å; Y978-E980 VanDerWaalsContact C-N 3.28Å; Y978-E980 PolarHBondContact O-N 3.47Å; Y978-L981 HydrophobicContact CD1-CD2 4.22Å; Y978-L981 WeakPolarHBondContact O-CB 3.44Å; Y978-L981 PolarHBondContact O-N 2.93Å; Y978-L981 VanDerWaalsContact O-N 3.09Å; Y978-I982 PolarHBondContact O-N 2.82Å; Y978-L1008 HydrophobicContact CD1-CD2 3.86Å; Y978-L1008 HydrophobicContact CD2-CD2 4.08Å; Y978-L1008 HydrophobicContact CG-CD2 3.61Å; Y978-L1014 HydrophobicContact CD2-CD1 4.27Å
979	K	93.2	Very high	91.2	Very high	85 Å²	85	47.7 Å²	47.7	37%	0.37	24%	0.243	S	C	.	.	H	α-helix	trans	-62.1	-32.6	171	-74.5	-171.6	-178.2	-152.2	0	113.2	I975 K976 M977 L981 E1013 L1014 A1017	I975-K979 WeakPolarHBondContact O-CG 3.49Å; I975-K979 PolarHBondContact O-N 3.25Å; I975-K979 VanDerWaalsContact O-N 3.17Å; K976-K979 PolarHBondContact O-N 2.62Å; M977-K979 VanDerWaalsContact C-N 3.26Å; M977-K979 PolarHBondContact O-N 3.06Å; K979-L981 VanDerWaalsContact C-N 3.26Å; K979-L981 PolarHBondContact O-N 3.11Å; K979-E1013 WeakPolarHBondContact CE-O 3.42Å; K979-E1013 PolarHBondContact NZ-O 3.06Å; K979-L1014 HydrophobicContact CG-CD2 3.68Å; K979-A1017 HydrophobicContact CD-CB 3.95Å; K979-A1017 HydrophobicContact CG-CB 3.88Å
980	E	92.6	Very high	91.3	Very high	98 Å²	98	51.9 Å²	51.9	46%	0.458	27%	0.266	S	S	.	.	H	α-helix	trans	-75.4	-13.1	174.5	-64.5	-171.2	-149.6	0	0	114.1	K947 M977 Y978	K947-E980 WeakPolarHBondContact CE-O 3.42Å; K947-E980 IonicContact NZ-OE2 3.63Å; K947-E980 PolarHBondContact NZ-OE2 2.84Å; M977-E980 WeakPolarHBondContact O-CB 3.46Å; M977-E980 PolarHBondContact O-N 3.02Å; Y978-E980 VanDerWaalsContact C-N 3.28Å; Y978-E980 PolarHBondContact O-N 3.47Å
981	L	93.3	Very high	90.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-92.7	-27	-179.4	179.6	59.9	0	0	0	112.3	I943 M946 L963 M977 Y978 K979 E984 L985	I943-L981 HydrophobicContact CD1-CB 4.28Å; I943-L981 HydrophobicContact CG1-CB 4.08Å; I943-L981 HydrophobicContact CG1-CD1 4.2Å; I943-L981 HydrophobicContact CG1-CD2 4.27Å; I943-L981 HydrophobicContact CG1-CG 4.38Å; M946-L981 HydrophobicContact CB-CD1 3.96Å; M946-L981 HydrophobicContact CG-CD1 3.88Å; L963-L981 HydrophobicContact CD1-CD1 4.24Å; L963-L981 HydrophobicContact CD1-CD2 4.06Å; L963-L981 HydrophobicContact CD2-CD2 4.16Å; M977-L981 PolarHBondContact O-N 3.17Å; Y978-L981 HydrophobicContact CD1-CD2 4.22Å; Y978-L981 WeakPolarHBondContact O-CB 3.44Å; Y978-L981 PolarHBondContact O-N 2.93Å; Y978-L981 VanDerWaalsContact O-N 3.09Å; K979-L981 VanDerWaalsContact C-N 3.26Å; K979-L981 PolarHBondContact O-N 3.11Å; L981-E984 PolarHBondContact O-N 3.35Å; L981-E984 VanDerWaalsContact O-N 3.12Å; L981-L985 HydrophobicContact CD1-CG 4.22Å; L981-L985 HydrophobicContact CD2-CD1 4.05Å; L981-L985 HydrophobicContact CD2-CG 4.42Å; L981-L985 HydrophobicContact CG-CD1 3.74Å; L981-L985 HydrophobicContact CG-CD2 4.42Å; L981-L985 HydrophobicContact CG-CG 3.83Å; L981-L985 PolarHBondContact O-N 3.17Å
982	I	94.6	Very high	90.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-48.5	-48.3	-178.5	-75.7	169.7	0	0	0	113.7	Y978 E984 L985 L986 L1008 L1014 A1017 L1018 N1021	Y978-I982 PolarHBondContact O-N 2.82Å; I982-E984 VanDerWaalsContact C-N 3.32Å; I982-E984 PolarHBondContact O-N 2.83Å; I982-L985 PolarHBondContact O-N 3.07Å; I982-L986 HydrophobicContact CG2-CD1 3.83Å; I982-L986 HydrophobicContact CG2-CG 4.4Å; I982-L986 WeakPolarHBondContact O-CG 3.48Å; I982-L986 PolarHBondContact O-N 3.22Å; I982-L1008 HydrophobicContact CG1-CD1 4.25Å; I982-L1014 HydrophobicContact CD1-CD2 4.36Å; I982-A1017 HydrophobicContact CD1-CB 3.71Å; I982-L1018 HydrophobicContact CD1-CD2 4.14Å; I982-L1018 HydrophobicContact CD1-CG 3.93Å; I982-L1018 HydrophobicContact CG1-CD2 3.9Å; I982-L1018 HydrophobicContact CG1-CG 4.24Å; I982-L1018 HydrophobicContact CG2-CD2 3.99Å; I982-N1021 HydrophobicContact CG2-CB 3.79Å
983	P	92.1	Very high	89.5	Confident	50 Å²	50	54 Å²	54	33%	0.325	29%	0.289	S	S	.	.	H	α-helix	trans	-62.1	-36.4	-178.8	-25	36	0	0	0	113.6	K987	P983-K987 WeakPolarHBondContact O-CG 3.3Å; P983-K987 PolarHBondContact O-N 3.25Å
984	E	91.8	Very high	89.1	Confident	23 Å²	23	51.6 Å²	51.6	11%	0.107	27%	0.269	C	S	.	.	H	α-helix	trans	-75.2	-36	178.6	-54.6	-50.9	133.9	0	0	111.7	M946 K947 Q949 L981 I982 L986 K987 C988	M946-E984 HydrophobicContact CB-CB 4.4Å; K947-E984 HydrophobicContact CG-CG 3.81Å; Q949-E984 PolarHBondContact NE2-OE2 3.08Å; L981-E984 PolarHBondContact O-N 3.35Å; L981-E984 VanDerWaalsContact O-N 3.12Å; I982-E984 VanDerWaalsContact C-N 3.32Å; I982-E984 PolarHBondContact O-N 2.83Å; E984-L986 VanDerWaalsContact C-N 3.35Å; E984-K987 WeakPolarHBondContact O-CB 3.47Å; E984-K987 PolarHBondContact O-N 3Å; E984-K987 IonicContact OE1-NZ 2.71Å; E984-K987 PolarHBondContact OE1-NZ 3.49Å; E984-K987 WeakPolarHBondContact OE2-CD 3.43Å; E984-K987 WeakPolarHBondContact OE2-CE 3.5Å; E984-K987 IonicContact OE2-NZ 3.73Å; E984-K987 PolarHBondContact OE2-NZ 3.2Å; E984-C988 PolarHBondContact O-N 3.06Å; E984-C988 PolarHBondContact O-SG 3.35Å
985	L	93.1	Very high	88.7	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.6	-41.1	172.1	-68.2	169.1	0	0	0	111.9	L960 L981 I982 K987 C988 A989 A1001 I1004 I1005 L1008	L960-L985 HydrophobicContact CD2-CD2 3.69Å; L981-L985 HydrophobicContact CD1-CG 4.22Å; L981-L985 HydrophobicContact CD2-CD1 4.05Å; L981-L985 HydrophobicContact CD2-CG 4.42Å; L981-L985 HydrophobicContact CG-CD1 3.74Å; L981-L985 HydrophobicContact CG-CD2 4.42Å; L981-L985 HydrophobicContact CG-CG 3.83Å; L981-L985 PolarHBondContact O-N 3.17Å; I982-L985 PolarHBondContact O-N 3.07Å; L985-K987 VanDerWaalsContact C-N 3.33Å; L985-C988 PolarHBondContact O-N 2.98Å; L985-A989 VanDerWaalsContact O-CB 3.3Å; L985-A989 WeakPolarHBondContact O-CB 3.46Å; L985-A989 PolarHBondContact O-N 2.96Å; L985-A1001 HydrophobicContact CD2-CB 4.41Å; L985-I1004 HydrophobicContact CD1-CB 4.35Å; L985-I1004 HydrophobicContact CD1-CG2 3.46Å; L985-I1004 VanDerWaalsContact CD1-CG2 3.46Å; L985-I1004 HydrophobicContact CD2-CB 3.99Å; L985-I1004 HydrophobicContact CD2-CD1 3.71Å; L985-I1004 HydrophobicContact CD2-CG1 4.48Å; L985-I1004 HydrophobicContact CD2-CG2 3.79Å; L985-I1004 HydrophobicContact CG-CG2 4.29Å; L985-I1005 HydrophobicContact CB-CD1 4.16Å; L985-I1005 HydrophobicContact CB-CG1 4.09Å; L985-I1005 HydrophobicContact CD1-CG1 4.41Å; L985-L1008 HydrophobicContact CD1-CD1 3.6Å
986	L	92.5	Very high	88.4	Confident	34 Å²	34	58.5 Å²	58.5	18%	0.178	31%	0.305	C	S	.	.	H	α-helix	trans	-67.2	-32.8	177.2	-69.9	172.1	0	0	0	111.9	I982 E984 N990 I1005 N1021	I982-L986 HydrophobicContact CG2-CD1 3.83Å; I982-L986 HydrophobicContact CG2-CG 4.4Å; I982-L986 WeakPolarHBondContact O-CG 3.48Å; I982-L986 PolarHBondContact O-N 3.22Å; E984-L986 VanDerWaalsContact C-N 3.35Å; L986-N990 WeakPolarHBondContact O-CB 3.41Å; L986-N990 PolarHBondContact O-N 2.93Å; L986-N990 PolarHBondContact O-ND2 3.47Å; L986-I1005 HydrophobicContact CD2-CD1 4.12Å; L986-N1021 HydrophobicContact CD1-CB 3.67Å; L986-N1021 WeakPolarHBondContact CD1-O 3.49Å
987	K	90.4	Very high	88.2	Confident	105 Å²	105	51.8 Å²	51.8	46%	0.457	28%	0.276	S	S	.	.	H	α-helix	trans	-63.1	-49.6	168	-66.8	173.1	-160.6	167.2	0	111.5	P983 E984 L985 A989 N990 S991	P983-K987 WeakPolarHBondContact O-CG 3.3Å; P983-K987 PolarHBondContact O-N 3.25Å; E984-K987 WeakPolarHBondContact O-CB 3.47Å; E984-K987 PolarHBondContact O-N 3Å; E984-K987 IonicContact OE1-NZ 2.71Å; E984-K987 PolarHBondContact OE1-NZ 3.49Å; E984-K987 WeakPolarHBondContact OE2-CD 3.43Å; E984-K987 WeakPolarHBondContact OE2-CE 3.5Å; E984-K987 IonicContact OE2-NZ 3.73Å; E984-K987 PolarHBondContact OE2-NZ 3.2Å; L985-K987 VanDerWaalsContact C-N 3.33Å; K987-A989 PolarHBondContact O-N 3.2Å; K987-N990 CarbonylContact O-C 3.52Å; K987-N990 PolarHBondContact O-N 3.09Å; K987-S991 PolarHBondContact O-N 2.83Å
988	C	90.3	Very high	88	Confident	3 Å²	3	52 Å²	52	2%	0.02	28%	0.277	C	S	.	.	H	α-helix	trans	-64.7	-39.9	-178.9	-68.9	0	0	0	0	112.9	L960 E984 L985 N990 S991 A1001	L960-C988 HydrophobicContact CD1-CB 4.16Å; E984-C988 PolarHBondContact O-N 3.06Å; E984-C988 PolarHBondContact O-SG 3.35Å; L985-C988 PolarHBondContact O-N 2.98Å; C988-N990 VanDerWaalsContact C-N 3.27Å; C988-N990 PolarHBondContact O-N 3.23Å; C988-S991 VanDerWaalsContact O-CB 3.3Å; C988-S991 WeakPolarHBondContact O-CB 3.39Å; C988-S991 PolarHBondContact O-N 3.04Å; C988-S991 VanDerWaalsContact O-N 3.13Å; C988-A1001 HydrophobicContact CB-CB 3.81Å
989	A	89.8	Confident	87.7	Confident	6 Å²	6	54.4 Å²	54.4	5%	0.05	29%	0.294	C	S	.	.	H	α-helix	trans	-64.4	-30	175.6	0	0	0	0	0	113	L985 K987 A1001 F1002 I1005	L985-A989 VanDerWaalsContact O-CB 3.3Å; L985-A989 WeakPolarHBondContact O-CB 3.46Å; L985-A989 PolarHBondContact O-N 2.96Å; K987-A989 PolarHBondContact O-N 3.2Å; A989-A1001 HydrophobicContact CB-CB 4.08Å; A989-F1002 HydrophobicContact CB-CD1 4.3Å; A989-F1002 HydrophobicContact CB-CE1 3.94Å; A989-F1002 HydrophobicContact CB-CE2 4.22Å; A989-F1002 HydrophobicContact CB-CZ 3.89Å; A989-I1005 HydrophobicContact CB-CD1 3.89Å
990	N	87.5	Confident	87.7	Confident	128 Å²	128	54.7 Å²	54.7	68%	0.684	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	2.4	174.3	-70.4	-66.8	0	0	0	113.6	L986 K987 C988 A992	L986-N990 WeakPolarHBondContact O-CB 3.41Å; L986-N990 PolarHBondContact O-N 2.93Å; L986-N990 PolarHBondContact O-ND2 3.47Å; K987-N990 CarbonylContact O-C 3.52Å; K987-N990 PolarHBondContact O-N 3.09Å; C988-N990 VanDerWaalsContact C-N 3.27Å; C988-N990 PolarHBondContact O-N 3.23Å; N990-A992 PolarHBondContact O-N 2.76Å
991	S	80.5	Confident	87.7	Confident	36 Å²	36	50 Å²	50	25%	0.252	27%	0.271	S	S	.	.			trans	-73.7	108.2	-176.5	-177.6	0	0	0	0	111	K987 C988 E993 Q998	K987-S991 PolarHBondContact O-N 2.83Å; C988-S991 VanDerWaalsContact O-CB 3.3Å; C988-S991 WeakPolarHBondContact O-CB 3.39Å; C988-S991 PolarHBondContact O-N 3.04Å; C988-S991 VanDerWaalsContact O-N 3.13Å; S991-E993 PolarHBondContact O-N 2.96Å; S991-Q998 PolarHBondContact O-NE2 2.67Å
992	A	75.1	Confident	87.6	Confident	98 Å²	98	55.4 Å²	55.4	81%	0.81	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-4.4	-177.3	0	0	0	0	0	114.8	N990	N990-A992 PolarHBondContact O-N 2.76Å
993	E	70.6	Confident	87.4	Confident	154 Å²	154	57 Å²	57	72%	0.72	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-13.2	-173.2	-60.2	-161	142.6	0	0	114.7	S991	S991-E993 PolarHBondContact O-N 2.96Å
994	D	80.4	Confident	87.5	Confident	39 Å²	39	54.7 Å²	54.7	21%	0.209	29%	0.293	C	S	.	.			trans	-145.9	110.3	-178.7	-171.8	-29.2	0	0	0	113.5	G996 Q997 Q998	D994-G996 PolarHBondContact O-N 3.48Å; D994-G996 WeakPolarHBondContact OD1-CA 3.43Å; D994-G996 PolarHBondContact OD1-N 3.1Å; D994-Q997 HydrophobicContact CB-CB 4.07Å; D994-Q997 HydrophobicContact CB-CG 3.99Å; D994-Q997 PolarHBondContact O-N 3.28Å; D994-Q997 PolarHBondContact OD1-N 3.29Å; D994-Q997 WeakPolarHBondContact OD2-CG 3.41Å; D994-Q997 PolarHBondContact OD2-NE2 3.42Å; D994-Q998 WeakPolarHBondContact O-CG 3.29Å; D994-Q998 PolarHBondContact O-N 2.92Å; D994-Q998 VanDerWaalsContact O-N 3.15Å
995	F	84.6	Confident	87.6	Confident	146 Å²	146	55 Å²	55	64%	0.64	30%	0.295	S	S	*	.	H	α-helix	trans	-70.3	-26.2	179.1	-179.5	-100.2	0	0	0	114	S999	F995-S999 WeakPolarHBondContact CE1-OG 3.34Å; F995-S999 VanDerWaalsContact O-CB 3.31Å; F995-S999 WeakPolarHBondContact O-CB 3.18Å; F995-S999 PolarHBondContact O-N 3.04Å; F995-S999 PolarHBondContact O-OG 3.17Å
996	G	83.9	Confident	87.5	Confident	23 Å²	23	59.5 Å²	59.5	24%	0.237	32%	0.316	C	S	.	.	H	α-helix	trans	-69.8	-43.8	175	0	0	0	0	0	111.1	D994 S999 Y1000	D994-G996 PolarHBondContact O-N 3.48Å; D994-G996 WeakPolarHBondContact OD1-CA 3.43Å; D994-G996 PolarHBondContact OD1-N 3.1Å; G996-S999 PolarHBondContact O-N 3.13Å; G996-Y1000 WeakPolarHBondContact O-CD2 3.44Å; G996-Y1000 PolarHBondContact O-N 3.13Å
997	Q	88.2	Confident	87.5	Confident	17 Å²	17	58.9 Å²	58.9	8%	0.079	31%	0.313	C	S	.	.	H	α-helix	trans	-62.3	-44.9	174.1	-69.6	177.8	50.9	0	0	111.5	A953 T956 L957 L960 D994 S999 A1001	A953-Q997 PolarHBondContact O-NE2 2.92Å; T956-Q997 HydrophobicContact CG2-CG 4.37Å; L957-Q997 HydrophobicContact CB-CG 4.27Å; L957-Q997 HydrophobicContact CD1-CG 4.07Å; L960-Q997 HydrophobicContact CD1-CB 3.83Å; L960-Q997 HydrophobicContact CD1-CG 3.95Å; D994-Q997 HydrophobicContact CB-CB 4.07Å; D994-Q997 HydrophobicContact CB-CG 3.99Å; D994-Q997 PolarHBondContact O-N 3.28Å; D994-Q997 PolarHBondContact OD1-N 3.29Å; D994-Q997 WeakPolarHBondContact OD2-CG 3.41Å; D994-Q997 PolarHBondContact OD2-NE2 3.42Å; Q997-S999 PolarHBondContact O-N 3.33Å; Q997-A1001 WeakPolarHBondContact O-CB 3.44Å; Q997-A1001 PolarHBondContact O-N 3.16Å
998	Q	89.5	Confident	87.7	Confident	48 Å²	48	53.9 Å²	53.9	22%	0.224	29%	0.291	C	S	.	.	H	α-helix	trans	-54.9	-51.6	172.1	-70.5	178.5	7	0	0	111.4	S991 D994 Y1000 A1001 F1002	S991-Q998 PolarHBondContact O-NE2 2.67Å; D994-Q998 WeakPolarHBondContact O-CG 3.29Å; D994-Q998 PolarHBondContact O-N 2.92Å; D994-Q998 VanDerWaalsContact O-N 3.15Å; Q998-Y1000 PolarHBondContact O-N 2.91Å; Q998-A1001 PolarHBondContact O-N 3.07Å; Q998-F1002 HydrophobicContact CB-CD2 4.35Å; Q998-F1002 HydrophobicContact CB-CE2 4.28Å; Q998-F1002 WeakPolarHBondContact O-CD2 3.4Å; Q998-F1002 PolarHBondContact O-N 3.37Å
999	S	87.7	Confident	87.8	Confident	50 Å²	50	56.4 Å²	56.4	35%	0.35	31%	0.309	S	S	.	.	H	α-helix	trans	-60.3	-45.9	-174.4	-64.4	0	0	0	0	112.6	F995 G996 Q997 A1003	F995-S999 WeakPolarHBondContact CE1-OG 3.34Å; F995-S999 VanDerWaalsContact O-CB 3.31Å; F995-S999 WeakPolarHBondContact O-CB 3.18Å; F995-S999 PolarHBondContact O-N 3.04Å; F995-S999 PolarHBondContact O-OG 3.17Å; G996-S999 PolarHBondContact O-N 3.13Å; Q997-S999 PolarHBondContact O-N 3.33Å; S999-A1003 PolarHBondContact O-N 2.87Å; S999-A1003 VanDerWaalsContact O-N 3.09Å
1000	Y	92.8	Very high	87.9	Confident	91 Å²	91	64.4 Å²	64.4	36%	0.357	34%	0.338	S	S	.	.	H	α-helix	trans	-71.8	-38.2	176.2	-68.1	-46.5	0	0	0	112.4	L957 L960 A961 V964 G996 Q998 F1002 A1003 I1004	L957-Y1000 HydrophobicContact CD1-CD2 3.79Å; L957-Y1000 HydrophobicContact CD1-CE2 3.94Å; L957-Y1000 HydrophobicContact CG-CE2 4.41Å; L960-Y1000 HydrophobicContact CB-CD2 4.41Å; A961-Y1000 HydrophobicContact CB-CD2 4.1Å; A961-Y1000 HydrophobicContact CB-CE1 4.44Å; A961-Y1000 HydrophobicContact CB-CE2 3.65Å; V964-Y1000 HydrophobicContact CG2-CD1 3.71Å; V964-Y1000 HydrophobicContact CG2-CG 4.11Å; G996-Y1000 WeakPolarHBondContact O-CD2 3.44Å; G996-Y1000 PolarHBondContact O-N 3.13Å; Q998-Y1000 PolarHBondContact O-N 2.91Å; Y1000-F1002 PolarHBondContact O-N 3.16Å; Y1000-A1003 PolarHBondContact O-N 2.86Å; Y1000-I1004 VanDerWaalsContact O-CG1 3.27Å; Y1000-I1004 WeakPolarHBondContact O-CG1 3.22Å; Y1000-I1004 PolarHBondContact O-N 3.11Å
1001	A	93	Very high	88.1	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.5	-43.6	175	0	0	0	0	0	111.9	L960 L985 C988 A989 Q997 Q998 I1004 I1005	L960-A1001 HydrophobicContact CD2-CB 4.4Å; L985-A1001 HydrophobicContact CD2-CB 4.41Å; C988-A1001 HydrophobicContact CB-CB 3.81Å; A989-A1001 HydrophobicContact CB-CB 4.08Å; Q997-A1001 WeakPolarHBondContact O-CB 3.44Å; Q997-A1001 PolarHBondContact O-N 3.16Å; Q998-A1001 PolarHBondContact O-N 3.07Å; A1001-I1004 PolarHBondContact O-N 3.45Å; A1001-I1005 WeakPolarHBondContact O-CB 3.27Å; A1001-I1005 WeakPolarHBondContact O-CD1 3.24Å; A1001-I1005 VanDerWaalsContact O-CG1 3.24Å; A1001-I1005 WeakPolarHBondContact O-CG1 3.43Å; A1001-I1005 PolarHBondContact O-N 2.87Å
1002	F	91.1	Very high	88.6	Confident	113 Å²	113	61.6 Å²	61.6	50%	0.496	33%	0.325	S	S	.	.	H	α-helix	trans	-64.4	-38.9	173.9	-77.1	-59.9	0	0	0	112.9	A989 Q998 Y1000 I1005 H1006	A989-F1002 HydrophobicContact CB-CD1 4.3Å; A989-F1002 HydrophobicContact CB-CE1 3.94Å; A989-F1002 HydrophobicContact CB-CE2 4.22Å; A989-F1002 HydrophobicContact CB-CZ 3.89Å; Q998-F1002 HydrophobicContact CB-CD2 4.35Å; Q998-F1002 HydrophobicContact CB-CE2 4.28Å; Q998-F1002 WeakPolarHBondContact O-CD2 3.4Å; Q998-F1002 PolarHBondContact O-N 3.37Å; Y1000-F1002 PolarHBondContact O-N 3.16Å; F1002-I1005 PolarHBondContact O-N 3.04Å; F1002-H1006 WeakPolarHBondContact O-CB 3.4Å; F1002-H1006 PolarHBondContact O-N 3.14Å
1003	A	90.4	Very high	89.4	Confident	34 Å²	34	61.4 Å²	61.4	28%	0.281	31%	0.307	S	S	.	.	H	α-helix	trans	-62.4	-42.9	175.2	0	0	0	0	0	112	V964 S999 Y1000 N1007	V964-A1003 HydrophobicContact CG1-CB 4.49Å; V964-A1003 HydrophobicContact CG2-CB 4.24Å; S999-A1003 PolarHBondContact O-N 2.87Å; S999-A1003 VanDerWaalsContact O-N 3.09Å; Y1000-A1003 PolarHBondContact O-N 2.86Å; A1003-N1007 VanDerWaalsContact O-CG 3.25Å; A1003-N1007 PolarHBondContact O-N 2.72Å; A1003-N1007 PolarHBondContact O-OD1 2.92Å
1004	I	93.6	Very high	90.6	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.8	-49.9	174.5	-64.5	162.5	0	0	0	110.5	L960 L963 V964 T967 L985 Y1000 A1001 H1006 N1007 L1008	L960-I1004 HydrophobicContact CB-CD1 4.45Å; L960-I1004 HydrophobicContact CD2-CD1 3.65Å; L963-I1004 HydrophobicContact CB-CD1 3.67Å; L963-I1004 HydrophobicContact CB-CG1 4.39Å; V964-I1004 HydrophobicContact CB-CG1 4.4Å; V964-I1004 HydrophobicContact CG2-CD1 4.05Å; V964-I1004 HydrophobicContact CG2-CG1 3.64Å; T967-I1004 HydrophobicContact CG2-CG2 3.91Å; L985-I1004 HydrophobicContact CD1-CB 4.35Å; L985-I1004 HydrophobicContact CD1-CG2 3.46Å; L985-I1004 VanDerWaalsContact CD1-CG2 3.46Å; L985-I1004 HydrophobicContact CD2-CB 3.99Å; L985-I1004 HydrophobicContact CD2-CD1 3.71Å; L985-I1004 HydrophobicContact CD2-CG1 4.48Å; L985-I1004 HydrophobicContact CD2-CG2 3.79Å; L985-I1004 HydrophobicContact CG-CG2 4.29Å; Y1000-I1004 VanDerWaalsContact O-CG1 3.27Å; Y1000-I1004 WeakPolarHBondContact O-CG1 3.22Å; Y1000-I1004 PolarHBondContact O-N 3.11Å; A1001-I1004 PolarHBondContact O-N 3.45Å; I1004-H1006 VanDerWaalsContact C-N 3.3Å; I1004-H1006 PolarHBondContact O-N 3.16Å; I1004-N1007 WeakPolarHBondContact O-CA 3.47Å; I1004-N1007 WeakPolarHBondContact O-CB 3.35Å; I1004-N1007 PolarHBondContact O-N 2.7Å; I1004-L1008 HydrophobicContact CG2-CD1 3.98Å; I1004-L1008 HydrophobicContact CG2-CG 4.12Å; I1004-L1008 WeakPolarHBondContact O-CG 3.37Å; I1004-L1008 PolarHBondContact O-N 3.39Å
1005	I	94.7	Very high	91.1	Very high	29 Å²	29	53.8 Å²	53.8	15%	0.149	28%	0.276	C	S	.	.	H	α-helix	trans	-56.5	-44.2	178.4	-72.6	163.8	0	0	0	111.1	L985 L986 A989 A1001 F1002 N1007 L1008 S1009 L1018	L985-I1005 HydrophobicContact CB-CD1 4.16Å; L985-I1005 HydrophobicContact CB-CG1 4.09Å; L985-I1005 HydrophobicContact CD1-CG1 4.41Å; L986-I1005 HydrophobicContact CD2-CD1 4.12Å; A989-I1005 HydrophobicContact CB-CD1 3.89Å; A1001-I1005 WeakPolarHBondContact O-CB 3.27Å; A1001-I1005 WeakPolarHBondContact O-CD1 3.24Å; A1001-I1005 VanDerWaalsContact O-CG1 3.24Å; A1001-I1005 WeakPolarHBondContact O-CG1 3.43Å; A1001-I1005 PolarHBondContact O-N 2.87Å; F1002-I1005 PolarHBondContact O-N 3.04Å; I1005-N1007 PolarHBondContact O-N 2.87Å; I1005-L1008 PolarHBondContact O-N 2.79Å; I1005-S1009 WeakPolarHBondContact O-CB 3.46Å; I1005-S1009 PolarHBondContact O-N 3.27Å; I1005-S1009 PolarHBondContact O-OG 3.26Å; I1005-L1018 HydrophobicContact CG1-CD2 4.23Å; I1005-L1018 HydrophobicContact CG2-CD1 4.15Å; I1005-L1018 HydrophobicContact CG2-CD2 4.01Å
1006	H	91.3	Very high	91.5	Very high	96 Å²	96	49.5 Å²	49.5	44%	0.444	26%	0.264	S	S	.	.	H	α-helix	trans	-63.5	-37.6	175.4	155.7	-95.8	0	0	0	112.6	F1002 I1004 S1009 R1010	F1002-H1006 WeakPolarHBondContact O-CB 3.4Å; F1002-H1006 PolarHBondContact O-N 3.14Å; I1004-H1006 VanDerWaalsContact C-N 3.3Å; I1004-H1006 PolarHBondContact O-N 3.16Å; H1006-S1009 PolarHBondContact O-OG 3.27Å; H1006-R1010 PolarHBondContact CE1-NH2 2.88Å; H1006-R1010 PolarHBondContact NE2-NH2 2.73Å; H1006-R1010 VanDerWaalsContact NE2-NH2 3.18Å
1007	N	91.2	Very high	91.9	Very high	20 Å²	20	48.5 Å²	48.5	11%	0.107	25%	0.254	C	S	.	.	H	α-helix	trans	-65.1	-51.4	173.3	-71.4	-10.8	0	0	0	111.3	V964 T967 A1003 I1004 I1005 S1009 R1010	V964-N1007 PolarHBondContact O-ND2 2.98Å; T967-N1007 WeakPolarHBondContact O-CB 3.38Å; T967-N1007 PolarHBondContact OG1-ND2 2.78Å; T967-N1007 VanDerWaalsContact OG1-ND2 3.1Å; A1003-N1007 VanDerWaalsContact O-CG 3.25Å; A1003-N1007 PolarHBondContact O-N 2.72Å; A1003-N1007 PolarHBondContact O-OD1 2.92Å; I1004-N1007 WeakPolarHBondContact O-CA 3.47Å; I1004-N1007 WeakPolarHBondContact O-CB 3.35Å; I1004-N1007 PolarHBondContact O-N 2.7Å; I1005-N1007 PolarHBondContact O-N 2.87Å; N1007-S1009 VanDerWaalsContact C-N 3.26Å; N1007-S1009 PolarHBondContact O-N 2.7Å; N1007-R1010 WeakPolarHBondContact O-CB 3.24Å; N1007-R1010 PolarHBondContact O-N 3.25Å; N1007-R1010 VanDerWaalsContact O-N 3.13Å
1008	L	94.8	Very high	92.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-57.8	-37.2	178	-64.9	-179.1	0	0	0	112.2	T967 I970 Y978 I982 L985 I1004 I1005 R1010 V1011 L1014 L1018	T967-L1008 HydrophobicContact CG2-CD2 3.71Å; T967-L1008 HydrophobicContact CG2-CG 4.29Å; I970-L1008 HydrophobicContact CD1-CD2 3.87Å; Y978-L1008 HydrophobicContact CD1-CD2 3.86Å; Y978-L1008 HydrophobicContact CD2-CD2 4.08Å; Y978-L1008 HydrophobicContact CG-CD2 3.61Å; I982-L1008 HydrophobicContact CG1-CD1 4.25Å; L985-L1008 HydrophobicContact CD1-CD1 3.6Å; I1004-L1008 HydrophobicContact CG2-CD1 3.98Å; I1004-L1008 HydrophobicContact CG2-CG 4.12Å; I1004-L1008 WeakPolarHBondContact O-CG 3.37Å; I1004-L1008 PolarHBondContact O-N 3.39Å; I1005-L1008 PolarHBondContact O-N 2.79Å; L1008-R1010 PolarHBondContact O-N 3.44Å; L1008-V1011 PolarHBondContact O-N 2.71Å; L1008-V1011 VanDerWaalsContact O-N 3.14Å; L1008-L1014 HydrophobicContact CB-CB 4.39Å; L1008-L1014 HydrophobicContact CD2-CD1 4.02Å; L1008-L1014 VanDerWaalsContact O-CB 3.32Å; L1008-L1014 WeakPolarHBondContact O-CB 3.04Å; L1008-L1018 HydrophobicContact CB-CD1 4.09Å
1009	S	93	Very high	92.1	Very high	56 Å²	56	50.1 Å²	50.1	39%	0.392	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-6.7	179.4	75.1	0	0	0	0	115.1	I1005 H1006 N1007 A1015	I1005-S1009 WeakPolarHBondContact O-CB 3.46Å; I1005-S1009 PolarHBondContact O-N 3.27Å; I1005-S1009 PolarHBondContact O-OG 3.26Å; H1006-S1009 PolarHBondContact O-OG 3.27Å; N1007-S1009 VanDerWaalsContact C-N 3.26Å; N1007-S1009 PolarHBondContact O-N 2.7Å; S1009-A1015 WeakPolarHBondContact O-CB 3.38Å
1010	R	91	Very high	92.2	Very high	175 Å²	175	54.6 Å²	54.6	66%	0.66	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-21	174.8	-63.4	169.3	174.3	-152	-10.8	112.9	H1006 N1007 L1008	H1006-R1010 PolarHBondContact CE1-NH2 2.88Å; H1006-R1010 PolarHBondContact NE2-NH2 2.73Å; H1006-R1010 VanDerWaalsContact NE2-NH2 3.18Å; N1007-R1010 WeakPolarHBondContact O-CB 3.24Å; N1007-R1010 PolarHBondContact O-N 3.25Å; N1007-R1010 VanDerWaalsContact O-N 3.13Å; L1008-R1010 PolarHBondContact O-N 3.44Å
1011	V	92.1	Very high	91.9	Very high	27 Å²	27	54.2 Å²	54.2	16%	0.164	29%	0.291	C	S	.	.	S	Bend	trans	-97	121.8	178.9	177.8	0	0	0	0	108.8	I970 I975 L1008 E1013 L1014 A1015	I970-V1011 HydrophobicContact CB-CG2 4.09Å; I970-V1011 HydrophobicContact CD1-CG2 3.93Å; I970-V1011 HydrophobicContact CG2-CG2 4Å; I975-V1011 HydrophobicContact CD1-CG1 3.81Å; I975-V1011 HydrophobicContact CG1-CG1 4.22Å; L1008-V1011 PolarHBondContact O-N 2.71Å; L1008-V1011 VanDerWaalsContact O-N 3.14Å; V1011-E1013 VanDerWaalsContact C-N 3.31Å; V1011-E1013 PolarHBondContact O-N 3.42Å; V1011-L1014 HydrophobicContact CB-CB 4.22Å; V1011-L1014 HydrophobicContact CB-CD1 3.93Å; V1011-L1014 HydrophobicContact CB-CG 4.42Å; V1011-L1014 HydrophobicContact CG1-CD1 4.05Å; V1011-L1014 HydrophobicContact CG1-CG 4.37Å; V1011-L1014 HydrophobicContact CG2-CD1 4.38Å; V1011-L1014 PolarHBondContact O-N 3.02Å; V1011-A1015 PolarHBondContact O-N 3.47Å
1012	P	91.3	Very high	91	Very high	77 Å²	77	60.6 Å²	60.6	50%	0.5	34%	0.335	S	S	.	.	H	α-helix	trans	-55.1	-39.7	-170.5	-28.7	36.1	0	0	0	115.1	L1014 S1016	P1012-L1014 VanDerWaalsContact C-N 3.28Å; P1012-L1014 PolarHBondContact O-N 2.91Å; P1012-S1016 WeakPolarHBondContact O-CB 3.27Å; P1012-S1016 PolarHBondContact O-N 3.12Å; P1012-S1016 PolarHBondContact O-OG 3.47Å
1013	E	93.3	Very high	91	Very high	94 Å²	94	58 Å²	58	44%	0.439	33%	0.327	S	S	.	.	H	α-helix	trans	-67.3	-30.6	-179.1	-67.7	63	-141.8	0	0	112	I975 K979 V1011 A1017	I975-E1013 HydrophobicContact CD1-CB 4.49Å; I975-E1013 HydrophobicContact CG2-CB 3.81Å; I975-E1013 HydrophobicContact CG2-CG 4.5Å; K979-E1013 WeakPolarHBondContact CE-O 3.42Å; K979-E1013 PolarHBondContact NZ-O 3.06Å; V1011-E1013 VanDerWaalsContact C-N 3.31Å; V1011-E1013 PolarHBondContact O-N 3.42Å; E1013-A1017 PolarHBondContact O-N 3.17Å
1014	L	94.2	Very high	91	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-89.9	-37.3	-179.8	-71.3	165.7	0	0	0	111.5	I970 I975 Y978 K979 I982 L1008 V1011 P1012 S1016 A1017 L1018	I970-L1014 HydrophobicContact CD1-CD1 4.31Å; I970-L1014 HydrophobicContact CG2-CD1 3.98Å; I975-L1014 HydrophobicContact CG1-CD1 4.26Å; I975-L1014 HydrophobicContact CG2-CD2 4.39Å; I975-L1014 HydrophobicContact CG2-CG 4.18Å; Y978-L1014 HydrophobicContact CD2-CD1 4.27Å; K979-L1014 HydrophobicContact CG-CD2 3.68Å; I982-L1014 HydrophobicContact CD1-CD2 4.36Å; L1008-L1014 HydrophobicContact CB-CB 4.39Å; L1008-L1014 HydrophobicContact CD2-CD1 4.02Å; L1008-L1014 VanDerWaalsContact O-CB 3.32Å; L1008-L1014 WeakPolarHBondContact O-CB 3.04Å; V1011-L1014 HydrophobicContact CB-CB 4.22Å; V1011-L1014 HydrophobicContact CB-CD1 3.93Å; V1011-L1014 HydrophobicContact CB-CG 4.42Å; V1011-L1014 HydrophobicContact CG1-CD1 4.05Å; V1011-L1014 HydrophobicContact CG1-CG 4.37Å; V1011-L1014 HydrophobicContact CG2-CD1 4.38Å; V1011-L1014 PolarHBondContact O-N 3.02Å; P1012-L1014 VanDerWaalsContact C-N 3.28Å; P1012-L1014 PolarHBondContact O-N 2.91Å; L1014-S1016 VanDerWaalsContact C-N 3.26Å; L1014-S1016 PolarHBondContact O-N 3.46Å; L1014-A1017 PolarHBondContact O-N 3.47Å; L1014-L1018 WeakPolarHBondContact O-CB 3.47Å; L1014-L1018 WeakPolarHBondContact O-CG 3.38Å; L1014-L1018 PolarHBondContact O-N 3.48Å
1015	A	91.7	Very high	90.9	Very high	34 Å²	34	62.5 Å²	62.5	28%	0.281	35%	0.348	S	S	.	.	H	α-helix	trans	-57	-41.3	167.3	0	0	0	0	0	111.7	S1009 V1011 L1018 S1019	S1009-A1015 WeakPolarHBondContact O-CB 3.38Å; V1011-A1015 PolarHBondContact O-N 3.47Å; A1015-L1018 PolarHBondContact O-N 2.7Å; A1015-S1019 PolarHBondContact O-N 3.23Å; A1015-S1019 VanDerWaalsContact O-N 3.11Å; A1015-S1019 PolarHBondContact O-OG 3.31Å
1016	S	92.2	Very high	90.7	Very high	55 Å²	55	64.5 Å²	64.5	39%	0.385	36%	0.359	S	S	.	.	H	α-helix	trans	-63.7	-50.2	175	-54.4	0	0	0	0	111.1	P1012 L1014 L1018 S1019 E1020	P1012-S1016 WeakPolarHBondContact O-CB 3.27Å; P1012-S1016 PolarHBondContact O-N 3.12Å; P1012-S1016 PolarHBondContact O-OG 3.47Å; L1014-S1016 VanDerWaalsContact C-N 3.26Å; L1014-S1016 PolarHBondContact O-N 3.46Å; S1016-L1018 VanDerWaalsContact C-N 3.31Å; S1016-L1018 PolarHBondContact O-N 2.88Å; S1016-S1019 CarbonylContact O-C 3.57Å; S1016-S1019 PolarHBondContact O-N 3.18Å; S1016-S1019 VanDerWaalsContact O-N 3.09Å; S1016-S1019 PolarHBondContact O-OG 2.82Å; S1016-E1020 WeakPolarHBondContact O-CG 3.23Å; S1016-E1020 PolarHBondContact O-N 3.41Å
1017	A	93.1	Very high	90.6	Very high	3 Å²	3	62.5 Å²	62.5	3%	0.025	35%	0.354	C	S	.	.	H	α-helix	trans	-63.5	-32.5	178.2	0	0	0	0	0	113.5	K979 I982 E1013 L1014 E1020 N1021	K979-A1017 HydrophobicContact CD-CB 3.95Å; K979-A1017 HydrophobicContact CG-CB 3.88Å; I982-A1017 HydrophobicContact CD1-CB 3.71Å; E1013-A1017 PolarHBondContact O-N 3.17Å; L1014-A1017 PolarHBondContact O-N 3.47Å; A1017-E1020 PolarHBondContact O-N 2.7Å; A1017-N1021 PolarHBondContact O-N 2.66Å; A1017-N1021 PolarHBondContact O-ND2 3.02Å
1018	L	92.4	Very high	90.6	Very high	15 Å²	15	65.3 Å²	65.3	8%	0.079	37%	0.37	C	S	.	.	H	α-helix	trans	-61.2	-49.3	170.7	-79.2	166	0	0	0	110.3	I982 I1005 L1008 L1014 A1015 S1016 E1020 N1021 S1022	I982-L1018 HydrophobicContact CD1-CD2 4.14Å; I982-L1018 HydrophobicContact CD1-CG 3.93Å; I982-L1018 HydrophobicContact CG1-CD2 3.9Å; I982-L1018 HydrophobicContact CG1-CG 4.24Å; I982-L1018 HydrophobicContact CG2-CD2 3.99Å; I1005-L1018 HydrophobicContact CG1-CD2 4.23Å; I1005-L1018 HydrophobicContact CG2-CD1 4.15Å; I1005-L1018 HydrophobicContact CG2-CD2 4.01Å; L1008-L1018 HydrophobicContact CB-CD1 4.09Å; L1014-L1018 WeakPolarHBondContact O-CB 3.47Å; L1014-L1018 WeakPolarHBondContact O-CG 3.38Å; L1014-L1018 PolarHBondContact O-N 3.48Å; A1015-L1018 PolarHBondContact O-N 2.7Å; S1016-L1018 VanDerWaalsContact C-N 3.31Å; S1016-L1018 PolarHBondContact O-N 2.88Å; L1018-E1020 PolarHBondContact O-N 2.89Å; L1018-N1021 PolarHBondContact O-N 3.13Å; L1018-N1021 VanDerWaalsContact O-N 3.09Å; L1018-S1022 WeakPolarHBondContact O-CB 3.37Å; L1018-S1022 PolarHBondContact O-N 2.95Å; L1018-S1022 PolarHBondContact O-OG 3.32Å
1019	S	89.2	Confident	90.3	Very high	83 Å²	83	70 Å²	70	58%	0.58	40%	0.397	S	S	*	.	H	α-helix	trans	-68.9	-13.4	177.8	65.9	0	0	0	0	115.3	A1015 S1016	A1015-S1019 PolarHBondContact O-N 3.23Å; A1015-S1019 VanDerWaalsContact O-N 3.11Å; A1015-S1019 PolarHBondContact O-OG 3.31Å; S1016-S1019 CarbonylContact O-C 3.57Å; S1016-S1019 PolarHBondContact O-N 3.18Å; S1016-S1019 VanDerWaalsContact O-N 3.09Å; S1016-S1019 PolarHBondContact O-OG 2.82Å
1020	E	90	Very high	90.1	Very high	145 Å²	145	71.1 Å²	71.1	68%	0.678	40%	0.397	S	S	*	.	H	α-helix	trans	-87.5	-14.7	172.5	-71.8	165.5	178	0	0	112.7	S1016 A1017 L1018	S1016-E1020 WeakPolarHBondContact O-CG 3.23Å; S1016-E1020 PolarHBondContact O-N 3.41Å; A1017-E1020 PolarHBondContact O-N 2.7Å; L1018-E1020 PolarHBondContact O-N 2.89Å
1021	N	86.1	Confident	90	Very high	83 Å²	83	62.4 Å²	62.4	44%	0.444	38%	0.375	S	S	.	.	H	α-helix	trans	-116.5	-7.8	-176.9	-74.1	-99.9	0	0	0	113.8	I982 L986 A1017 L1018	I982-N1021 HydrophobicContact CG2-CB 3.79Å; L986-N1021 HydrophobicContact CD1-CB 3.67Å; L986-N1021 WeakPolarHBondContact CD1-O 3.49Å; A1017-N1021 PolarHBondContact O-N 2.66Å; A1017-N1021 PolarHBondContact O-ND2 3.02Å; L1018-N1021 PolarHBondContact O-N 3.13Å; L1018-N1021 VanDerWaalsContact O-N 3.09Å
1022	S	74.4	Confident	89.8	Confident	133 Å²	133	65.6 Å²	65.6	93%	0.93	40%	0.395	S	S	*	.			trans	-94.9	0	-179.8	66.5	0	0	0	0	113.4	L1018	L1018-S1022 WeakPolarHBondContact O-CB 3.37Å; L1018-S1022 PolarHBondContact O-N 2.95Å; L1018-S1022 PolarHBondContact O-OG 3.32Å

Retrieved 1,022 of 1,022 residues in 304.7 ms (Link to these results)

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