A0A087XDW1_POEFO Loading...

Interactor of little elongation complex ELL subunit 2

AlphaFold DB , UniProt , Accession A0A087XDW1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 909 aa.

						>A0A087XDW1_POEFO|A0A087XDW1
MELVWDDDAPPDGPFFTRDLYDKHSLAPPIKERWACLQSPAENTDVNQECEESAEDHSAPSRKNAAKFKGSQASAWESCDSDGSDSVEPKKSKRERTSCKKTETEMDVAYPEPRLPYPCLSSLSTKDQKTYVGYLMNTKSRCLPKNLILRINNEVVQFTKYLQDVAKICAEDYNFITQGAMQYTEEFFTACLESVKSLPQFYQIHEVTSLTGGTFNPGLALTFEKQLLAMGTVNITDHKMVPADAQLASDYHSVSSANPPAKKAEDKHARISSDGNAEKLCAYYEPHVCLTRDALVRLLDNHGPDFGDQWELPVLVKITPGKGSGKRKTVYIDSPLLKREVTIRERSHIYHEESLKLSIVTNGSKKVFHLLTELPASEQQLTQEASVRGCVSVENKGLDFEVDLTDLETFGETTTKMPRTKKTQSQQDEEGQSGGSSRTPAVTKPNNSKETLKATSFSQGGINSAPKNKKNIRTETSQLMVSEPELQKTESSGSDQKCDKEEGFTADSDDEKLIIDEAGSSVALPTNQSEPLTTTCSADSSVTSSVQSTPAKTVSSPPCKHTRSKRTTRQTKAPEDQLGEILRMQTAMFKSGSEPAPAVKSPSRCVGPQLNPHTTSLVKPCVSSYLERHQNEDAESPVVPEFASVNISPTERKKILSENLQACAEDEQDYEAPVEGNLLYKLYSLQDLLVMVRSSVSLTHTRKVGNNQNQHVPVHVLPKLEYQLSYGVERLTNSEACQLWTETSLHSSTAPYIAHINAHTSKVALLRKLPDDWMQNISCGFKPSKSLNILHHLLKKLTGLDEGQYLIVHKTGEAFVTLLKAGGEKVSRGAYNLQQNHGSVPQPPKLGIVPWIPIDPAVVLPFHQQHGRVPCTFPPNTFQKKVPVECIKVSRGVKRCNVLKRQHNKGLFE
					

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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	41.3	Very low	43.4	Very low	243 Å²	243	151.9 Å²	151.9	100%	1.197	81%	0.812	S	S	*	*				0	113.6	0	-64.3	172.8	-173.8	0	0	105.6
2	E	33.9	Very low	44	Very low	192 Å²	192	154.6 Å²	154.6	90%	0.897	83%	0.826	S	S	*	*			trans	-89.6	133.9	170.6	-68.8	168.9	136.3	0	0	106.9	V4	E2-V4 PolarHBondContact O-N 3.46Å
3	L	40.3	Very low	45.4	Very low	152 Å²	152	146.3 Å²	146.3	80%	0.796	80%	0.8	S	S	*	*			trans	-89.3	100.2	172.6	-82.3	162.9	0	0	0	107.3
4	V	39.1	Very low	45.9	Very low	113 Å²	113	143.1 Å²	143.1	69%	0.685	79%	0.79	S	S	*	*			trans	-64.4	131.1	164	-180	0	0	0	0	107.3	E2	E2-V4 PolarHBondContact O-N 3.46Å
5	W	43.2	Very low	46.4	Very low	214 Å²	214	145.3 Å²	145.3	81%	0.811	79%	0.789	S	S	*	*			trans	-101.7	111.9	164.4	-67.6	82.4	0	0	0	106.3	D7	W5-D7 PolarHBondContact O-N 3.38Å
6	D	40.8	Very low	46.8	Very low	144 Å²	144	146.5 Å²	146.5	77%	0.77	78%	0.784	S	S	*	*			trans	-78	93.8	169.2	-67.7	-49	0	0	0	107.7	D8	D6-D8 PolarHBondContact O-N 2.98Å
7	D	42	Very low	48.2	Very low	155 Å²	155	140.8 Å²	140.8	83%	0.829	76%	0.756	S	S	*	*			trans	-73.3	88.8	170.7	-82.8	-31.6	0	0	0	109.2	W5 A9	W5-D7 PolarHBondContact O-N 3.38Å; D7-A9 PolarHBondContact O-N 3.27Å
8	D	47.2	Very low	48.8	Very low	157 Å²	157	140.9 Å²	140.9	84%	0.84	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-58.2	134.4	165.4	-94.2	-37.7	0	0	0	110.1	D6	D6-D8 PolarHBondContact O-N 2.98Å
9	A	49.9	Very low	49.5	Very low	86 Å²	86	139.7 Å²	139.7	71%	0.711	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-63.7	138.4	-178.8	0	0	0	0	0	111.2	D7	D7-A9 PolarHBondContact O-N 3.27Å
10	P	47.9	Very low	50.5	Low	101 Å²	101	136.9 Å²	136.9	66%	0.656	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-63.9	137.1	-179.7	27	-34.5	0	0	0	110.5	D12	P10-D12 PolarHBondContact O-N 3.21Å
11	P	51.7	Low	51.3	Low	114 Å²	114	136.2 Å²	136.2	74%	0.74	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-68.8	132.1	177.3	28.1	-33.9	0	0	0	110.6	G13	P11-G13 PolarHBondContact O-N 2.83Å
12	D	50.8	Low	52.4	Low	184 Å²	184	127.9 Å²	127.9	98%	0.984	67%	0.672	S	S	*	*	S	Bend	trans	-66.7	91.4	175.1	-89.4	-43.2	0	0	0	110.8	P10	P10-D12 PolarHBondContact O-N 3.21Å
13	G	62	Low	53.8	Low	47 Å²	47	126.9 Å²	126.9	49%	0.485	67%	0.665	S	S	.	*	S	Bend	trans	-169.9	164.6	178.7	0	0	0	0	0	112.5	P11 F15	P11-G13 PolarHBondContact O-N 2.83Å; G13-F15 PolarHBondContact O-N 3.23Å
14	P	52.6	Low	54.9	Low	101 Å²	101	126.2 Å²	126.2	66%	0.656	66%	0.657	S	S	*	*			trans	-64.8	120.9	178.6	26.1	-33.2	0	0	0	110.8	F16 T17	P14-F16 PolarHBondContact O-N 3.06Å; P14-T17 HydrophobicContact CG-CG2 4.08Å
15	F	53.7	Low	56.1	Low	177 Å²	177	122.6 Å²	122.6	78%	0.776	64%	0.637	S	S	*	*	S	Bend	trans	-60.4	-6.8	-172.2	-133.5	-91.3	0	0	0	115.8	G13	G13-F15 PolarHBondContact O-N 3.23Å
16	F	52.1	Low	56.7	Low	164 Å²	164	121.2 Å²	121.2	72%	0.719	65%	0.645	S	S	*	*			trans	-139.9	103.6	173.3	-100.4	-98.6	0	0	0	109.1	P14 Y21	P14-F16 PolarHBondContact O-N 3.06Å; F16-Y21 HydrophobicContact CE1-CD2 4.31Å
17	T	70.6	Confident	57.4	Low	50 Å²	50	116.4 Å²	116.4	31%	0.307	63%	0.625	S	S	.	*			trans	-100	160.3	163.5	64.7	0	0	0	0	110.5	P14 D19 L20 Y21	P14-T17 HydrophobicContact CG-CG2 4.08Å; T17-D19 PolarHBondContact O-N 3.15Å; T17-L20 PolarHBondContact O-N 3.01Å; T17-L20 WeakPolarHBondContact OG1-CB 3.44Å; T17-L20 PolarHBondContact OG1-N 2.94Å; T17-Y21 PolarHBondContact O-N 3.28Å; T17-Y21 VanDerWaalsContact O-N 3.15Å
18	R	59.8	Low	58	Low	142 Å²	142	112.5 Å²	112.5	54%	0.536	61%	0.608	S	S	.	*	H	α-helix	trans	-55.5	-42.1	174.7	-176.7	71.3	-146	-177.6	11.7	111	Y21 D22	R18-Y21 WeakPolarHBondContact O-CB 3.44Å; R18-Y21 PolarHBondContact O-N 3.45Å; R18-D22 IonicContact CZ-OD1 2.66Å; R18-D22 IonicContact CZ-OD2 2.72Å; R18-D22 VanDerWaalsContact CZ-OD2 3.27Å; R18-D22 IonicContact NE-OD1 3.88Å; R18-D22 IonicContact NE-OD2 2.71Å; R18-D22 PolarHBondContact NE-OD2 3.36Å; R18-D22 VanDerWaalsContact NH2-CG 3.27Å; R18-D22 IonicContact NH2-OD1 2.99Å; R18-D22 PolarHBondContact NH2-OD1 2.71Å; R18-D22 IonicContact NH2-OD2 2.66Å; R18-D22 PolarHBondContact NH2-OD2 2.8Å; R18-D22 PolarHBondContact O-N 2.92Å
19	D	62.1	Low	58.8	Low	118 Å²	118	108.2 Å²	108.2	63%	0.631	59%	0.588	S	S	*	*	H	α-helix	trans	-73.2	-36.6	-173.6	-38.7	-77.5	0	0	0	111.8	T17 K23	T17-D19 PolarHBondContact O-N 3.15Å; D19-K23 WeakPolarHBondContact O-CB 3.42Å; D19-K23 PolarHBondContact O-N 3.39Å
20	L	69.1	Low	59.1	Low	84 Å²	84	109.1 Å²	109.1	44%	0.44	58%	0.58	S	S	.	*	H	α-helix	trans	-63.7	-41.5	170.3	-89.7	163.9	0	0	0	111.6	T17 H24	T17-L20 PolarHBondContact O-N 3.01Å; T17-L20 WeakPolarHBondContact OG1-CB 3.44Å; T17-L20 PolarHBondContact OG1-N 2.94Å; L20-H24 PolarHBondContact O-CD2 3.08Å; L20-H24 VanDerWaalsContact O-CD2 3.3Å; L20-H24 PolarHBondContact O-N 3.2Å
21	Y	66.6	Low	59.3	Low	123 Å²	123	112.9 Å²	112.9	48%	0.482	59%	0.586	S	S	.	*	H	α-helix	trans	-64.2	-52.2	177.7	179.9	-87.9	0	0	0	111.9	F16 T17 R18 K23 H24 S25	F16-Y21 HydrophobicContact CE1-CD2 4.31Å; T17-Y21 PolarHBondContact O-N 3.28Å; T17-Y21 VanDerWaalsContact O-N 3.15Å; R18-Y21 WeakPolarHBondContact O-CB 3.44Å; R18-Y21 PolarHBondContact O-N 3.45Å; Y21-K23 VanDerWaalsContact C-N 3.27Å; Y21-K23 PolarHBondContact O-N 3.04Å; Y21-H24 PolarHBondContact O-N 3.48Å; Y21-S25 WeakPolarHBondContact O-CB 3.36Å; Y21-S25 PolarHBondContact O-N 3.26Å
22	D	66.1	Low	59.7	Low	68 Å²	68	112.7 Å²	112.7	36%	0.364	58%	0.576	S	S	.	*	H	α-helix	trans	-69.2	-24.1	-177.6	-72.6	-32.5	0	0	0	112.7	R18	R18-D22 IonicContact CZ-OD1 2.66Å; R18-D22 IonicContact CZ-OD2 2.72Å; R18-D22 VanDerWaalsContact CZ-OD2 3.27Å; R18-D22 IonicContact NE-OD1 3.88Å; R18-D22 IonicContact NE-OD2 2.71Å; R18-D22 PolarHBondContact NE-OD2 3.36Å; R18-D22 VanDerWaalsContact NH2-CG 3.27Å; R18-D22 IonicContact NH2-OD1 2.99Å; R18-D22 PolarHBondContact NH2-OD1 2.71Å; R18-D22 IonicContact NH2-OD2 2.66Å; R18-D22 PolarHBondContact NH2-OD2 2.8Å; R18-D22 PolarHBondContact O-N 2.92Å
23	K	62.6	Low	59.7	Low	170 Å²	170	110.3 Å²	110.3	74%	0.739	55%	0.553	S	S	*	*	H	α-helix	trans	-80.5	-20.4	176.9	-169.1	176.7	-170.5	178.9	0	114.5	D19 Y21	D19-K23 WeakPolarHBondContact O-CB 3.42Å; D19-K23 PolarHBondContact O-N 3.39Å; Y21-K23 VanDerWaalsContact C-N 3.27Å; Y21-K23 PolarHBondContact O-N 3.04Å
24	H	63.6	Low	59	Low	139 Å²	139	115.7 Å²	115.7	64%	0.644	56%	0.558	S	S	*	*	H	α-helix	trans	-116.3	-1.3	178.7	-65.7	-67.2	0	0	0	113.9	L20 Y21	L20-H24 PolarHBondContact O-CD2 3.08Å; L20-H24 VanDerWaalsContact O-CD2 3.3Å; L20-H24 PolarHBondContact O-N 3.2Å; Y21-H24 PolarHBondContact O-N 3.48Å
25	S	64.1	Low	59.1	Low	37 Å²	37	113.7 Å²	113.7	26%	0.259	55%	0.55	S	S	.	*			trans	-73.6	122	172.4	171.9	0	0	0	0	111.8	Y21 A27	Y21-S25 WeakPolarHBondContact O-CB 3.36Å; Y21-S25 PolarHBondContact O-N 3.26Å; S25-A27 PolarHBondContact O-N 2.7Å; S25-A27 WeakPolarHBondContact OG-CB 3.36Å; S25-A27 PolarHBondContact OG-N 3.39Å; S25-A27 PolarHBondContact OG-O 2.77Å
26	L	55.8	Low	58.8	Low	185 Å²	185	109.9 Å²	109.9	97%	0.969	55%	0.545	S	S	*	.			trans	-78.8	5.5	167.1	-66.1	174.3	0	0	0	113.2
27	A	55	Low	58.6	Low	43 Å²	43	108.5 Å²	108.5	36%	0.355	54%	0.544	S	S	.	.	S	Bend	trans	-103.6	134.6	-179.8	0	0	0	0	0	110.9	S25	S25-A27 PolarHBondContact O-N 2.7Å; S25-A27 WeakPolarHBondContact OG-CB 3.36Å; S25-A27 PolarHBondContact OG-N 3.39Å; S25-A27 PolarHBondContact OG-O 2.77Å
28	P	54.2	Low	57.3	Low	73 Å²	73	113.6 Å²	113.6	47%	0.474	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-55.9	140.5	-176.4	-29.8	35.4	0	0	0	114.2	R33	P28-R33 PolarHBondContact O-NE 3.22Å
29	P	64	Low	56.5	Low	66 Å²	66	110.4 Å²	110.4	43%	0.429	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-48.6	146.5	176.8	-30.2	34.9	0	0	0	114.1	K31 E32 R33	P29-K31 PolarHBondContact O-N 2.58Å; P29-K31 VanDerWaalsContact O-N 3.16Å; P29-E32 HydrophobicContact CB-CG 4.46Å; P29-E32 WeakPolarHBondContact CD-OE2 3.38Å; P29-E32 PolarHBondContact O-N 2.89Å; P29-R33 PolarHBondContact O-N 2.75Å
30	I	55.9	Low	55.2	Low	105 Å²	105	110.7 Å²	110.7	54%	0.538	57%	0.573	S	S	.	*	H	α-helix	trans	-61.6	-31.6	-173.8	-122.2	167.4	0	0	0	112.5	E32 R33 W34	I30-E32 PolarHBondContact O-N 3.45Å; I30-R33 PolarHBondContact O-N 2.89Å; I30-W34 PolarHBondContact O-N 3.08Å; I30-W34 VanDerWaalsContact O-N 3.11Å
31	K	53.4	Low	53.4	Low	181 Å²	181	111 Å²	111	79%	0.787	59%	0.587	S	S	*	*	H	α-helix	trans	-62.5	-38.7	175.4	-71.8	-174.2	176.3	-179.3	0	112.8	P29 W34 A35	P29-K31 PolarHBondContact O-N 2.58Å; P29-K31 VanDerWaalsContact O-N 3.16Å; K31-W34 PolarHBondContact O-N 3.39Å; K31-A35 PolarHBondContact O-N 3.03Å
32	E	58.9	Low	51.7	Low	110 Å²	110	113.8 Å²	113.8	51%	0.514	60%	0.604	S	S	.	*	H	α-helix	trans	-68.7	-39.3	177.9	-63.5	178.1	178.4	0	0	111	P29 I30 W34 A35 C36	P29-E32 HydrophobicContact CB-CG 4.46Å; P29-E32 WeakPolarHBondContact CD-OE2 3.38Å; P29-E32 PolarHBondContact O-N 2.89Å; I30-E32 PolarHBondContact O-N 3.45Å; E32-W34 VanDerWaalsContact C-N 3.31Å; E32-W34 PolarHBondContact O-N 2.82Å; E32-A35 WeakPolarHBondContact O-CB 3.38Å; E32-A35 PolarHBondContact O-N 2.91Å; E32-A35 VanDerWaalsContact O-N 3.13Å; E32-C36 PolarHBondContact O-N 3.46Å; E32-C36 PolarHBondContact O-SG 2.88Å; E32-C36 VanDerWaalsContact O-SG 3.41Å
33	R	51.9	Low	50	Low	134 Å²	134	117.9 Å²	117.9	51%	0.506	63%	0.626	S	S	.	*	H	α-helix	trans	-61.7	-38.4	174.5	-62.3	-178.4	178.5	-149.4	-10.3	112.5	P28 P29 I30 L37	P28-R33 PolarHBondContact O-NE 3.22Å; P29-R33 PolarHBondContact O-N 2.75Å; I30-R33 PolarHBondContact O-N 2.89Å; R33-L37 WeakPolarHBondContact O-CG 3.44Å; R33-L37 PolarHBondContact O-N 2.81Å
34	W	47.1	Very low	48.5	Very low	159 Å²	159	116.2 Å²	116.2	60%	0.602	63%	0.631	S	S	*	*	H	α-helix	trans	-67.7	-37.3	172.9	-78	109.4	0	0	0	112.4	I30 K31 E32 L37 Q38	I30-W34 PolarHBondContact O-N 3.08Å; I30-W34 VanDerWaalsContact O-N 3.11Å; K31-W34 PolarHBondContact O-N 3.39Å; E32-W34 VanDerWaalsContact C-N 3.31Å; E32-W34 PolarHBondContact O-N 2.82Å; W34-L37 PolarHBondContact O-N 3.21Å; W34-Q38 PolarHBondContact O-N 3.19Å
35	A	55.6	Low	46.8	Very low	59 Å²	59	116.9 Å²	116.9	49%	0.488	64%	0.639	S	S	.	*	H	α-helix	trans	-64	-45.7	175.2	0	0	0	0	0	112.2	K31 E32 L37 Q38 S39	K31-A35 PolarHBondContact O-N 3.03Å; E32-A35 WeakPolarHBondContact O-CB 3.38Å; E32-A35 PolarHBondContact O-N 2.91Å; E32-A35 VanDerWaalsContact O-N 3.13Å; A35-L37 PolarHBondContact O-N 3.45Å; A35-Q38 PolarHBondContact O-N 3.19Å; A35-S39 PolarHBondContact O-N 2.53Å
36	C	47.2	Very low	45.2	Very low	98 Å²	98	121 Å²	121	66%	0.662	66%	0.662	S	S	*	*	H	α-helix	trans	-64	-18.5	175.4	-64.6	0	0	0	0	114.1	E32 S39	E32-C36 PolarHBondContact O-N 3.46Å; E32-C36 PolarHBondContact O-SG 2.88Å; E32-C36 VanDerWaalsContact O-SG 3.41Å; C36-S39 PolarHBondContact O-OG 2.87Å
37	L	48.1	Very low	43.8	Very low	135 Å²	135	120 Å²	120	71%	0.707	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-6.7	174.2	-81.2	165.4	0	0	0	113.6	R33 W34 A35	R33-L37 WeakPolarHBondContact O-CG 3.44Å; R33-L37 PolarHBondContact O-N 2.81Å; W34-L37 PolarHBondContact O-N 3.21Å; A35-L37 PolarHBondContact O-N 3.45Å
38	Q	43	Very low	42.4	Very low	156 Å²	156	125.3 Å²	125.3	73%	0.729	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	-10.4	-179.1	-69.9	-177	-8.4	0	0	113.8	W34 A35	W34-Q38 PolarHBondContact O-N 3.19Å; A35-Q38 PolarHBondContact O-N 3.19Å
39	S	41.2	Very low	41	Very low	75 Å²	75	129.8 Å²	129.8	52%	0.524	69%	0.69	S	S	.	*	S	Bend	trans	-72.6	133.3	167.8	48.6	0	0	0	0	111.6	A35 C36 A41	A35-S39 PolarHBondContact O-N 2.53Å; C36-S39 PolarHBondContact O-OG 2.87Å; S39-A41 PolarHBondContact O-N 2.98Å
40	P	35.9	Very low	39.1	Very low	125 Å²	125	133 Å²	133	81%	0.812	71%	0.713	S	S	*	*			trans	-59.4	133.5	172.4	-22.4	33.5	0	0	0	111.7	E42	P40-E42 PolarHBondContact O-N 3.45Å
41	A	31.8	Very low	37.6	Very low	91 Å²	91	136.7 Å²	136.7	75%	0.752	73%	0.727	S	S	*	*			trans	-78.5	104.6	178.8	0	0	0	0	0	111.1	S39	S39-A41 PolarHBondContact O-N 2.98Å
42	E	29.5	Very low	36.2	Very low	180 Å²	180	136.2 Å²	136.2	84%	0.841	73%	0.728	S	S	*	*			trans	-81.1	120.3	169.6	-170.5	164.4	-131.5	0	0	109.6	P40 T44	P40-E42 PolarHBondContact O-N 3.45Å; E42-T44 PolarHBondContact O-N 2.61Å
43	N	31.8	Very low	34.6	Very low	154 Å²	154	135.6 Å²	135.6	82%	0.824	74%	0.736	S	S	*	*			trans	-79.6	106.6	-175.8	-67.6	-64.8	0	0	0	110.7	D45	N43-D45 PolarHBondContact O-N 3.06Å
44	T	29.9	Very low	33.4	Very low	135 Å²	135	133.3 Å²	133.3	83%	0.828	75%	0.746	S	S	*	*			trans	-84.3	95.4	170.2	36	0	0	0	0	111.1	E42	E42-T44 PolarHBondContact O-N 2.61Å
45	D	28.7	Very low	32.4	Very low	153 Å²	153	134.5 Å²	134.5	82%	0.818	76%	0.758	S	S	*	*			trans	-97.2	131.4	166.6	-151.1	-9.8	0	0	0	109.3	N43	N43-D45 PolarHBondContact O-N 3.06Å
46	V	29.6	Very low	30.9	Very low	124 Å²	124	137.5 Å²	137.5	75%	0.752	77%	0.766	S	S	*	*			trans	-102	116.1	-168.7	176.8	0	0	0	0	110.8
47	N	26.8	Very low	29.9	Very low	163 Å²	163	140.4 Å²	140.4	87%	0.872	77%	0.769	S	S	*	*			trans	-142.5	162.4	161.3	-91.7	-67.5	0	0	0	110.9
48	Q	26.6	Very low	28.8	Very low	156 Å²	156	139.6 Å²	139.6	73%	0.729	78%	0.775	S	S	*	*			trans	-121.1	143.1	-152.5	177.5	174.2	-11.5	0	0	112.8
49	E	24.4	Very low	28.1	Very low	166 Å²	166	136.6 Å²	136.6	78%	0.776	78%	0.777	S	S	*	*			trans	60.4	111.7	164	-74.3	160.2	-145.4	0	0	119.7
50	C	23.1	Very low	27.8	Very low	134 Å²	134	138.7 Å²	138.7	91%	0.905	79%	0.789	S	S	*	*				-165.6	173.1	102.8	-150.3	0	0	0	0	111.2
51	E	24.5	Very low	27.3	Very low	182 Å²	182	137.4 Å²	137.4	85%	0.85	78%	0.783	S	S	*	*			trans	-97.7	179.7	-169.9	-62.7	-172.3	114.6	0	0	115.7
52	E	25	Very low	27.1	Very low	171 Å²	171	143.2 Å²	143.2	80%	0.799	79%	0.785	S	S	*	*			trans	88.6	98.6	158.4	-70.5	-129.1	70.7	0	0	121.9
53	S	25.4	Very low	26.9	Very low	97 Å²	97	142.7 Å²	142.7	68%	0.678	78%	0.78	S	S	*	*				88.4	138	109.1	-61.3	0	0	0	0	123.2
54	A	26.6	Very low	26.6	Very low	87 Å²	87	143 Å²	143	72%	0.719	78%	0.782	S	S	*	*			trans	76.8	96.1	153.9	0	0	0	0	0	121.7
55	E	25.8	Very low	26.4	Very low	183 Å²	183	140.8 Å²	140.8	86%	0.855	78%	0.777	S	S	*	*				62	146.6	115.6	-66.8	177	164.4	0	0	124.4
56	D	24.8	Very low	26.3	Very low	122 Å²	122	138.1 Å²	138.1	65%	0.652	78%	0.777	S	S	*	*			trans	79	105.3	146.9	-86.1	20.1	0	0	0	125.6
57	H	26.5	Very low	26.2	Very low	159 Å²	159	142.3 Å²	142.3	74%	0.736	79%	0.785	S	S	*	*				76.8	122.7	117.3	-74.2	-9.2	0	0	0	123
58	S	24.6	Very low	26.2	Very low	119 Å²	119	143.9 Å²	143.9	83%	0.832	78%	0.784	S	S	*	*			trans	84.2	140.2	137.2	78.9	0	0	0	0	120.6
59	A	27.8	Very low	26.2	Very low	93 Å²	93	146.7 Å²	146.7	77%	0.769	79%	0.794	S	S	*	*			trans	-96.1	158.2	163.7	0	0	0	0	0	109.9
60	P	35.8	Very low	26.2	Very low	118 Å²	118	141.9 Å²	141.9	77%	0.766	79%	0.789	S	S	*	*				-151.5	140.9	114.9	35.3	-17.7	0	0	0	117.7
61	S	24.9	Very low	26.2	Very low	98 Å²	98	141.2 Å²	141.2	69%	0.685	79%	0.786	S	S	*	*				48.3	115.6	119.5	-148.5	0	0	0	0	122.6
62	R	27.3	Very low	26.4	Very low	213 Å²	213	141.6 Å²	141.6	80%	0.804	79%	0.788	S	S	*	*			trans	75.7	126.7	130.8	-75.7	178.3	178.1	-176.2	0.1	123.3
63	K	26.1	Very low	26.4	Very low	169 Å²	169	137 Å²	137	74%	0.735	78%	0.779	S	S	*	*			trans	68.4	116.2	134.8	-68.6	-175.2	176.8	-170.9	0	120.5
64	N	25.6	Very low	26.5	Very low	160 Å²	160	138.1 Å²	138.1	86%	0.856	79%	0.787	S	S	*	*				159.5	160.6	123	-81.4	-28.3	0	0	0	109.2
65	A	25.3	Very low	26.5	Very low	89 Å²	89	137.5 Å²	137.5	74%	0.736	78%	0.782	S	S	*	*			cis	-172.8	-179.4	-29.3	0	0	0	0	0	107.8
66	A	26.6	Very low	26.5	Very low	97 Å²	97	139.5 Å²	139.5	80%	0.802	78%	0.782	S	S	*	*			trans	73.4	88.5	156.6	0	0	0	0	0	122.2
67	K	26.4	Very low	26.6	Very low	212 Å²	212	141.9 Å²	141.9	92%	0.922	79%	0.789	S	S	*	*				70.2	127.3	111.2	-138	166.3	-169.1	169.7	0	122.3
68	F	28.2	Very low	26.5	Very low	197 Å²	197	139.1 Å²	139.1	86%	0.864	79%	0.787	S	S	*	*			trans	-64.7	153.6	173	-90.6	-106.6	0	0	0	117.1
69	K	24.8	Very low	26.6	Very low	214 Å²	214	138.2 Å²	138.2	93%	0.93	78%	0.78	S	S	*	*			trans	-166.6	143.7	137.7	-101.8	176.8	-179.7	-177.3	0	108.2
70	G	24.6	Very low	26.5	Very low	66 Å²	66	140.4 Å²	140.4	68%	0.68	78%	0.779	S	S	*	*			cis	173.9	175.5	-6.4	0	0	0	0	0	112.2
71	S	24.8	Very low	26.3	Very low	119 Å²	119	140.2 Å²	140.2	83%	0.832	78%	0.781	S	S	*	*			trans	75.9	104	170.1	-59.6	0	0	0	0	120.8
72	Q	27	Very low	26.4	Very low	190 Å²	190	143.7 Å²	143.7	89%	0.888	79%	0.791	S	S	*	*				7.7	159.8	114.4	-70.8	-178	-40.6	0	0	120.6
73	A	26	Very low	26.3	Very low	75 Å²	75	137.5 Å²	137.5	62%	0.62	79%	0.793	S	S	*	*			cis	178.3	174.6	-18.6	0	0	0	0	0	110.1
74	S	27.8	Very low	26.3	Very low	120 Å²	120	134.6 Å²	134.6	84%	0.839	79%	0.794	S	S	*	*			trans	69	158.3	156.6	71.3	0	0	0	0	119.3
75	A	26.5	Very low	26.3	Very low	75 Å²	75	133.3 Å²	133.3	62%	0.62	79%	0.788	S	S	*	*			cis	-170.2	150.8	-30.5	0	0	0	0	0	111.7
76	W	25.8	Very low	26.3	Very low	225 Å²	225	133.8 Å²	133.8	85%	0.852	79%	0.785	S	S	*	*			trans	67	144.2	149.9	-58.7	-11.6	0	0	0	122.8
77	E	25.5	Very low	26.5	Very low	171 Å²	171	135.6 Å²	135.6	80%	0.799	79%	0.787	S	S	*	*			trans	64.4	152.9	140.4	-74.3	172.1	167.8	0	0	121.3
78	S	25.8	Very low	26.5	Very low	101 Å²	101	133.2 Å²	133.2	71%	0.706	78%	0.778	S	S	*	*			cis	-164.9	169.8	-21.3	-160.7	0	0	0	0	112.2
79	C	26.3	Very low	26.4	Very low	100 Å²	100	129.4 Å²	129.4	68%	0.676	77%	0.774	S	S	*	*			trans	43.1	121.2	156.3	-73.8	0	0	0	0	124.7
80	D	25.9	Very low	26.4	Very low	140 Å²	140	127.3 Å²	127.3	75%	0.749	77%	0.765	S	S	*	*				48	124.8	119.6	-46.7	-44.1	0	0	0	123.5
81	S	31.7	Very low	26.4	Very low	114 Å²	114	134.1 Å²	134.1	80%	0.797	78%	0.775	S	S	*	*				167.8	139.9	108.2	-70	0	0	0	0	115.9
82	D	26.5	Very low	26.3	Very low	171 Å²	171	134.1 Å²	134.1	91%	0.914	78%	0.775	S	S	*	*			trans	18.8	145.3	153.1	-62.2	-19.3	0	0	0	125
83	G	25.1	Very low	26.4	Very low	82 Å²	82	135 Å²	135	85%	0.845	78%	0.777	S	S	*	*			trans	179.5	69.1	170.3	0	0	0	0	0	119.2
84	S	26.7	Very low	26.4	Very low	108 Å²	108	142.9 Å²	142.9	76%	0.755	79%	0.79	S	S	*	*			trans	22	134	161.2	-114.3	0	0	0	0	125
85	D	25.2	Very low	26.4	Very low	133 Å²	133	146.6 Å²	146.6	71%	0.711	79%	0.794	S	S	*	*				91.8	119.1	129.2	-92.3	-65.7	0	0	0	126.3
86	S	25.7	Very low	26.3	Very low	99 Å²	99	154.5 Å²	154.5	69%	0.692	81%	0.808	S	S	*	*			trans	57.2	117.8	130.1	-69.6	0	0	0	0	123.3
87	V	29.2	Very low	26.3	Very low	136 Å²	136	150.4 Å²	150.4	82%	0.824	81%	0.808	S	S	*	*				171.5	131.8	111.6	154.3	0	0	0	0	111.3
88	E	27.1	Very low	26.2	Very low	161 Å²	161	147.3 Å²	147.3	75%	0.752	81%	0.805	S	S	*	*			trans	-84	149.6	165.2	-94.9	-147.9	152.2	0	0	111.5
89	P	25.8	Very low	26.2	Very low	118 Å²	118	148.4 Å²	148.4	77%	0.766	81%	0.811	S	S	*	*				-145.9	122.4	108.2	33.1	-16.1	0	0	0	116.8
90	K	25.4	Very low	26.1	Very low	169 Å²	169	152.5 Å²	152.5	74%	0.735	82%	0.818	S	S	*	*			trans	35.1	109	139.5	-65	174.5	-176.6	167.7	0	120.7
91	K	24.5	Very low	26.2	Very low	209 Å²	209	155.2 Å²	155.2	91%	0.909	82%	0.823	S	S	*	*			trans	54.8	115.6	132.4	-62.5	-176.5	179.3	179.8	0	120
92	S	23.8	Very low	25.9	Very low	119 Å²	119	155.3 Å²	155.3	83%	0.832	82%	0.819	S	S	*	*			trans	-136.8	149.1	130.7	62.8	0	0	0	0	110.5
93	K	28.7	Very low	26.1	Very low	210 Å²	210	155.8 Å²	155.8	91%	0.913	82%	0.815	S	S	*	*			trans	-79.7	130.5	172.6	-84	-175.4	173	-175.7	0	109.2
94	R	25.6	Very low	26.3	Very low	240 Å²	240	157.7 Å²	157.7	91%	0.906	81%	0.811	S	S	*	*			trans	-145	136.3	151.3	-110	176.5	179.6	170.1	-0.2	109.7
95	E	28	Very low	26.7	Very low	197 Å²	197	161.4 Å²	161.4	92%	0.921	82%	0.816	S	S	*	*			trans	-69.3	135.5	177	-68.3	150.4	129.5	0	0	109.6
96	R	24.4	Very low	27.4	Very low	242 Å²	242	162.6 Å²	162.6	91%	0.913	82%	0.819	S	S	*	*			trans	-113.7	107.7	162.3	-92.4	-178.7	163.8	161	-4.7	107.4	S98	R96-S98 PolarHBondContact O-N 3.12Å; R96-S98 VanDerWaalsContact O-N 3.07Å
97	T	25.8	Very low	28.3	Very low	138 Å²	138	164.4 Å²	164.4	85%	0.847	82%	0.821	S	S	*	*			trans	-53.6	110.2	159.5	26.5	0	0	0	0	108	C99	T97-C99 PolarHBondContact O-N 2.92Å
98	S	23.8	Very low	29.9	Very low	107 Å²	107	161.8 Å²	161.8	75%	0.748	81%	0.806	S	S	*	*			trans	-70.6	111.8	169.5	45	0	0	0	0	107.9	R96 K100	R96-S98 PolarHBondContact O-N 3.12Å; R96-S98 VanDerWaalsContact O-N 3.07Å; S98-K100 VanDerWaalsContact C-N 3.34Å; S98-K100 PolarHBondContact O-N 3.37Å
99	C	24.3	Very low	32.3	Very low	123 Å²	123	157.7 Å²	157.7	83%	0.831	80%	0.799	S	S	*	*			trans	-59.2	102.4	164.2	-64.1	0	0	0	0	107.3	T97 K101	T97-C99 PolarHBondContact O-N 2.92Å; C99-K101 PolarHBondContact O-N 2.88Å; C99-K101 VanDerWaalsContact O-N 3.09Å
100	K	25.9	Very low	34.8	Very low	186 Å²	186	154 Å²	154	81%	0.809	77%	0.771	S	S	*	*			trans	-56.5	118	164	-74.5	-175.6	175.3	-176.2	0	106.2	S98 T102	S98-K100 VanDerWaalsContact C-N 3.34Å; S98-K100 PolarHBondContact O-N 3.37Å; K100-T102 PolarHBondContact O-N 3.43Å
101	K	26.6	Very low	37.7	Very low	198 Å²	198	147.7 Å²	147.7	86%	0.861	75%	0.747	S	S	*	*			trans	-62.9	100	153.4	-70.8	-173.5	177.2	-174.4	0	105.2	C99 E103	C99-K101 PolarHBondContact O-N 2.88Å; C99-K101 VanDerWaalsContact O-N 3.09Å; K101-E103 VanDerWaalsContact C-N 3.25Å; K101-E103 PolarHBondContact O-N 2.92Å
102	T	26	Very low	40.6	Very low	115 Å²	115	146.3 Å²	146.3	71%	0.706	74%	0.743	S	S	*	*			trans	-67.4	96.6	160.1	43.9	0	0	0	0	105.8	K100 T104	K100-T102 PolarHBondContact O-N 3.43Å; T102-T104 PolarHBondContact O-N 3.15Å; T102-T104 VanDerWaalsContact O-N 3.15Å
103	E	29.9	Very low	43.6	Very low	181 Å²	181	142.6 Å²	142.6	85%	0.846	72%	0.717	S	S	*	*			trans	-56.4	114.5	153.3	-68.8	176	160.7	0	0	105.5	K101 E105	K101-E103 VanDerWaalsContact C-N 3.25Å; K101-E103 PolarHBondContact O-N 2.92Å; E103-E105 PolarHBondContact O-N 2.63Å
104	T	29.9	Very low	46.4	Very low	122 Å²	122	139.7 Å²	139.7	75%	0.748	70%	0.7	S	S	*	*			trans	-71.4	97.3	179.4	-48.5	0	0	0	0	107.1	T102 M106	T102-T104 PolarHBondContact O-N 3.15Å; T102-T104 VanDerWaalsContact O-N 3.15Å; T104-M106 PolarHBondContact O-N 3.48Å
105	E	34.8	Very low	49.4	Very low	187 Å²	187	130.6 Å²	130.6	87%	0.874	67%	0.669	S	S	*	*			trans	-54.8	105.8	162.6	-76.9	-174.9	119.6	0	0	106.9	E103 D107	E103-E105 PolarHBondContact O-N 2.63Å; E105-D107 PolarHBondContact O-N 2.74Å; E105-D107 VanDerWaalsContact O-N 3.13Å
106	M	39.5	Very low	52.3	Low	157 Å²	157	126.5 Å²	126.5	77%	0.773	66%	0.659	S	S	*	*			trans	-65.2	112	167.1	-71.8	-179.8	65.7	0	0	106.3	T104 V108	T104-M106 PolarHBondContact O-N 3.48Å; M106-V108 WeakPolarHBondContact O-CG2 3.15Å; M106-V108 PolarHBondContact O-N 3.25Å
107	D	46.3	Very low	55.5	Low	137 Å²	137	117.4 Å²	117.4	73%	0.733	63%	0.625	S	S	*	*			trans	-71.7	80.4	175.6	-165.2	25.5	0	0	0	108.3	E105 A109 Q865	E105-D107 PolarHBondContact O-N 2.74Å; E105-D107 VanDerWaalsContact O-N 3.13Å; D107-A109 PolarHBondContact O-N 3.5Å; D107-Q865 PolarHBondContact OD1-NE2 3.13Å
108	V	61.7	Low	58.6	Low	82 Å²	82	115 Å²	115	50%	0.497	61%	0.612	S	S	.	*			trans	-59.8	107.7	179.3	-173.5	0	0	0	0	107.8	M106 Q865 H866	M106-V108 WeakPolarHBondContact O-CG2 3.15Å; M106-V108 PolarHBondContact O-N 3.25Å; V108-Q865 PolarHBondContact O-NE2 3.48Å; V108-Q865 PolarHBondContact O-OE1 3.04Å; V108-H866 PolarHBondContact O-CE1 3.02Å
109	A	76.9	Confident	61.8	Low	75 Å²	75	112.5 Å²	112.5	62%	0.62	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-59.3	150.3	-179.3	0	0	0	0	0	111.4	D107	D107-A109 PolarHBondContact O-N 3.5Å
110	Y	79.4	Confident	65.1	Low	41 Å²	41	111.2 Å²	111.2	16%	0.161	58%	0.578	C	S	.	*	P	Polyproline II helix	trans	-63.6	128.7	172.6	-158.4	-73.7	0	0	0	108.8	E112 F862 H863 H866 R868	Y110-E112 PolarHBondContact O-N 2.97Å; Y110-F862 HydrophobicContact CD2-CD2 4.06Å; Y110-F862 HydrophobicContact CE1-CD2 4.15Å; Y110-F862 AromaticContact CE1-CE2 3.99Å; Y110-F862 HydrophobicContact CE1-CE2 3.99Å; Y110-F862 AromaticContact CE2-CD2 3.66Å; Y110-F862 HydrophobicContact CE2-CD2 3.66Å; Y110-F862 HydrophobicContact CE2-CE2 4.06Å; Y110-F862 HydrophobicContact CG-CD2 4.48Å; Y110-F862 AromaticContact CZ-CD2 3.71Å; Y110-F862 AromaticContact CZ-CE2 3.62Å; Y110-H863 PolarHBondContact OH-CD2 3.29Å; Y110-H863 PolarHBondContact OH-NE2 3.34Å; Y110-H866 HydrophobicContact CD2-CB 4.15Å; Y110-H866 AromaticContact CD2-CG 3.79Å; Y110-H866 AromaticContact CD2-ND1 3.7Å; Y110-H866 PolarHBondContact N-CE1 3.42Å; Y110-H866 PolarHBondContact N-NE2 3.19Å; Y110-R868 HydrophobicContact CE2-CB 4.08Å; Y110-R868 HydrophobicContact CE2-CG 4.19Å
111	P	85.3	Confident	68.2	Low	36 Å²	36	102.7 Å²	102.7	23%	0.234	54%	0.542	C	S	.	.	P	Polyproline II helix	trans	-52.9	133	-178	-29.5	35.9	0	0	0	113.2	F862	P111-F862 HydrophobicContact CG-CD1 3.84Å; P111-F862 HydrophobicContact CG-CD2 4.22Å; P111-F862 HydrophobicContact CG-CE1 3.86Å; P111-F862 HydrophobicContact CG-CE2 4.25Å; P111-F862 HydrophobicContact CG-CG 4.02Å; P111-F862 HydrophobicContact CG-CZ 4.06Å
112	E	85.4	Confident	71.1	Confident	179 Å²	179	97.1 Å²	97.1	84%	0.836	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-64.2	135.5	176.2	-64.6	-166.5	158.5	0	0	110.3	Y110	Y110-E112 PolarHBondContact O-N 2.97Å
113	P	87.1	Confident	74.1	Confident	42 Å²	42	91.8 Å²	91.8	27%	0.273	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-78.8	143.9	-178	36.8	-38.7	0	0	0	110.4	L115 Y117 Y726	P113-L115 VanDerWaalsContact CB-O 3.26Å; P113-L115 WeakPolarHBondContact CB-O 3.49Å; P113-L115 WeakPolarHBondContact CG-O 3.45Å; P113-L115 PolarHBondContact O-N 3.41Å; P113-Y117 HydrophobicContact CB-CD2 4.4Å; P113-Y117 HydrophobicContact CB-CE1 4.22Å; P113-Y117 HydrophobicContact CB-CE2 3.84Å; P113-Y117 HydrophobicContact CG-CD2 3.95Å; P113-Y117 HydrophobicContact CG-CE2 3.57Å; P113-Y726 HydrophobicContact CB-CE1 3.66Å
114	R	87.2	Confident	77	Confident	149 Å²	149	85.8 Å²	85.8	56%	0.562	47%	0.473	S	S	*	.	S	Bend	trans	-60.3	-28.7	-179.3	-169.5	64.2	162	138.9	-4.2	112.9	V165 C169 D172 Y726	R114-V165 HydrophobicContact CB-CG1 4.28Å; R114-C169 HydrophobicContact CG-CB 4.48Å; R114-D172 IonicContact CZ-OD1 2.85Å; R114-D172 IonicContact CZ-OD2 2.72Å; R114-D172 IonicContact NE-OD1 3.38Å; R114-D172 IonicContact NE-OD2 3.86Å; R114-D172 PolarHBondContact NE-OD2 3.17Å; R114-D172 IonicContact NH2-OD1 3.74Å; R114-D172 PolarHBondContact NH2-OD1 3.13Å; R114-D172 IonicContact NH2-OD2 3.61Å; R114-D172 PolarHBondContact NH2-OD2 3.04Å; R114-Y726 PolarHBondContact N-OH 2.89Å
115	L	88.9	Confident	79.8	Confident	49 Å²	49	82.7 Å²	82.7	26%	0.257	45%	0.454	S	S	.	.	S	Bend	trans	-132.3	156	171.6	-64	-178.8	0	0	0	108.8	P113 Y161 V165 I168	P113-L115 VanDerWaalsContact CB-O 3.26Å; P113-L115 WeakPolarHBondContact CB-O 3.49Å; P113-L115 WeakPolarHBondContact CG-O 3.45Å; P113-L115 PolarHBondContact O-N 3.41Å; L115-Y161 PolarHBondContact O-OH 3.45Å; L115-V165 HydrophobicContact CB-CG2 4.31Å; L115-V165 HydrophobicContact CD1-CB 4.38Å; L115-V165 HydrophobicContact CD1-CG2 3.93Å; L115-V165 HydrophobicContact CG-CG2 4.33Å; L115-I168 HydrophobicContact CD1-CB 4.12Å; L115-I168 HydrophobicContact CD1-CD1 3.75Å; L115-I168 HydrophobicContact CD1-CG2 3.97Å; L115-I168 HydrophobicContact CD2-CG2 4.44Å
116	P	89.4	Confident	82.3	Confident	111 Å²	111	81.8 Å²	81.8	72%	0.721	45%	0.447	S	S	*	.			trans	-60.1	145.5	175.1	25.8	-35.1	0	0	0	112.1
117	Y	90.8	Very high	84.7	Confident	50 Å²	50	76.1 Å²	76.1	20%	0.196	42%	0.42	C	S	.	.			trans	-67.7	133.7	174.8	-64.7	-74.5	0	0	0	110.5	P113 C119 F158 Y161 Y726 R868 F873 P874	P113-Y117 HydrophobicContact CB-CD2 4.4Å; P113-Y117 HydrophobicContact CB-CE1 4.22Å; P113-Y117 HydrophobicContact CB-CE2 3.84Å; P113-Y117 HydrophobicContact CG-CD2 3.95Å; P113-Y117 HydrophobicContact CG-CE2 3.57Å; Y117-C119 VanDerWaalsContact C-N 3.28Å; Y117-C119 PolarHBondContact O-N 2.72Å; Y117-F158 HydrophobicContact CD1-CE2 4.04Å; Y117-F158 AromaticContact CE1-CE2 3.73Å; Y117-F158 HydrophobicContact CE1-CE2 3.73Å; Y117-F158 AromaticContact CE1-CZ 3.92Å; Y117-F158 HydrophobicContact CE1-CZ 3.92Å; Y117-Y161 HydrophobicContact CD1-CE1 4.15Å; Y117-Y161 HydrophobicContact CE1-CE1 4.4Å; Y117-Y726 HydrophobicContact CE1-CD1 4.37Å; Y117-Y726 HydrophobicContact CE1-CE1 4.05Å; Y117-R868 VanDerWaalsContact CE1-NH2 3.29Å; Y117-R868 VanDerWaalsContact CZ-NH2 3.3Å; Y117-R868 PolarHBondContact OH-NH1 3.23Å; Y117-R868 VanDerWaalsContact OH-NH1 3.11Å; Y117-R868 PolarHBondContact OH-NH2 2.87Å; Y117-R868 VanDerWaalsContact OH-NH2 3.15Å; Y117-F873 HydrophobicContact CD1-CD1 4.09Å; Y117-P874 HydrophobicContact CD1-CG 4.38Å; Y117-P874 HydrophobicContact CD2-CG 3.35Å; Y117-P874 HydrophobicContact CE2-CG 3.56Å; Y117-P874 HydrophobicContact CG-CG 3.79Å
118	P	91.9	Very high	86.7	Confident	88 Å²	88	69.6 Å²	69.6	57%	0.571	39%	0.386	S	S	*	.	S	Bend	trans	-71.6	-20	-176.2	28.7	-36.8	0	0	0	113.7	Y161 F873	P118-Y161 VanDerWaalsContact CD-CD2 3.48Å; P118-Y161 HydrophobicContact CG-CD2 3.88Å; P118-Y161 HydrophobicContact CG-CG 4.24Å; P118-F873 HydrophobicContact CG-CE1 3.74Å; P118-F873 HydrophobicContact CG-CZ 4.11Å
119	C	90.8	Very high	88	Confident	54 Å²	54	70.5 Å²	70.5	37%	0.365	38%	0.383	S	S	.	.	S	Bend	trans	-156.5	170.3	179.1	60.4	0	0	0	0	111.9	Y117 F873	Y117-C119 VanDerWaalsContact C-N 3.28Å; Y117-C119 PolarHBondContact O-N 2.72Å; C119-F873 VanDerWaalsContact SG-CD2 3.53Å; C119-F873 VanDerWaalsContact SG-CE2 3.56Å
120	L	92.6	Very high	88.6	Confident	96 Å²	96	69.3 Å²	69.3	50%	0.503	37%	0.368	S	S	.	.			trans	-91.9	155	167.1	-62.8	175.5	0	0	0	110.3	P874 N876	L120-P874 HydrophobicContact CD2-CB 4.22Å; L120-N876 HydrophobicContact CB-CB 4.28Å; L120-N876 HydrophobicContact CD1-CB 4.36Å
121	S	91.6	Very high	89.1	Confident	8 Å²	8	68.8 Å²	68.8	6%	0.056	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-61	142.5	-179.2	-168	0	0	0	0	113	L123 Q128 E154 P874	S121-L123 PolarHBondContact O-N 3.17Å; S121-L123 WeakPolarHBondContact OG-CB 3.46Å; S121-L123 PolarHBondContact OG-N 3.24Å; S121-L123 VanDerWaalsContact OG-N 3.11Å; S121-Q128 PolarHBondContact OG-NE2 3.46Å; S121-E154 WeakPolarHBondContact CA-OE1 3.44Å; S121-E154 WeakPolarHBondContact CB-OE1 3.2Å; S121-E154 PolarHBondContact OG-OE1 3.35Å; S121-E154 PolarHBondContact OG-OE2 3.45Å; S121-P874 WeakPolarHBondContact CB-O 3.19Å; S121-P874 PolarHBondContact N-O 2.78Å
122	S	88.1	Confident	89.2	Confident	80 Å²	80	67.5 Å²	67.5	56%	0.559	36%	0.357	S	S	*	.	S	Bend	trans	-74.1	-12.3	167.3	69.6	0	0	0	0	113.1	E154	S122-E154 WeakPolarHBondContact CB-OE2 3.38Å; S122-E154 PolarHBondContact N-OE2 2.87Å; S122-E154 PolarHBondContact OG-OE2 3.49Å
123	L	89.4	Confident	89.3	Confident	4 Å²	4	59.2 Å²	59.2	2%	0.021	32%	0.32	C	S	.	.	S	Bend	trans	-94.1	140	-174.6	-53.5	166	0	0	0	110.6	S121 D127 Q128 L147 R150 I151 T872	S121-L123 PolarHBondContact O-N 3.17Å; S121-L123 WeakPolarHBondContact OG-CB 3.46Å; S121-L123 PolarHBondContact OG-N 3.24Å; S121-L123 VanDerWaalsContact OG-N 3.11Å; L123-D127 HydrophobicContact CB-CB 4.47Å; L123-Q128 HydrophobicContact CB-CG 3.85Å; L123-Q128 HydrophobicContact CD1-CG 4.14Å; L123-L147 HydrophobicContact CD2-CD1 4.02Å; L123-R150 HydrophobicContact CD2-CB 3.86Å; L123-I151 HydrophobicContact CD1-CG1 3.67Å; L123-I151 HydrophobicContact CD2-CG1 3.79Å; L123-I151 HydrophobicContact CG-CG1 4.39Å; L123-T872 HydrophobicContact CD1-CG2 3.95Å
124	S	89.1	Confident	89.3	Confident	54 Å²	54	62.4 Å²	62.4	38%	0.378	33%	0.327	S	S	.	.			trans	-71.6	153.1	170.9	74	0	0	0	0	110.9	K126 D127 Q128	S124-K126 PolarHBondContact O-N 2.93Å; S124-D127 WeakPolarHBondContact CB-OD2 3.44Å; S124-D127 PolarHBondContact N-OD2 3.44Å; S124-D127 WeakPolarHBondContact O-CA 3.2Å; S124-D127 WeakPolarHBondContact O-CB 3.45Å; S124-D127 PolarHBondContact O-N 3.04Å; S124-D127 PolarHBondContact OG-N 3.33Å; S124-D127 VanDerWaalsContact OG-N 3.1Å; S124-D127 PolarHBondContact OG-OD2 2.76Å; S124-Q128 PolarHBondContact O-N 2.86Å
125	T	88.7	Confident	89.2	Confident	57 Å²	57	57.4 Å²	57.4	35%	0.35	31%	0.312	S	S	.	.	H	α-helix	trans	-56.8	-26.7	173.8	-37.4	0	0	0	0	112.3	K129	T125-K129 HydrophobicContact CG2-CD 4.39Å; T125-K129 VanDerWaalsContact O-CB 3.26Å; T125-K129 WeakPolarHBondContact O-CB 3.42Å; T125-K129 WeakPolarHBondContact O-CG 3.49Å; T125-K129 PolarHBondContact O-N 3.31Å
126	K	88.3	Confident	88.9	Confident	168 Å²	168	58.6 Å²	58.6	73%	0.73	32%	0.317	S	S	*	.	H	α-helix	trans	-73.1	-39.5	174.3	-176.8	-177.4	176.1	-175.1	0	112.2	S124 T130	S124-K126 PolarHBondContact O-N 2.93Å; K126-T130 WeakPolarHBondContact O-CB 3.4Å; K126-T130 PolarHBondContact O-N 3.2Å; K126-T130 PolarHBondContact O-OG1 3.38Å
127	D	89.3	Confident	88.2	Confident	38 Å²	38	59.6 Å²	59.6	20%	0.203	32%	0.316	C	S	.	.	H	α-helix	trans	-64.4	-50	174.9	-68.5	-44	0	0	0	110.3	L123 S124 K129 T130 Y131 L147 R150	L123-D127 HydrophobicContact CB-CB 4.47Å; S124-D127 WeakPolarHBondContact CB-OD2 3.44Å; S124-D127 PolarHBondContact N-OD2 3.44Å; S124-D127 WeakPolarHBondContact O-CA 3.2Å; S124-D127 WeakPolarHBondContact O-CB 3.45Å; S124-D127 PolarHBondContact O-N 3.04Å; S124-D127 PolarHBondContact OG-N 3.33Å; S124-D127 VanDerWaalsContact OG-N 3.1Å; S124-D127 PolarHBondContact OG-OD2 2.76Å; D127-K129 PolarHBondContact O-N 3.3Å; D127-T130 WeakPolarHBondContact O-CB 3.46Å; D127-T130 PolarHBondContact O-N 3.15Å; D127-Y131 PolarHBondContact O-N 2.9Å; D127-L147 HydrophobicContact CB-CD1 3.69Å; D127-L147 HydrophobicContact CB-CD2 4.37Å; D127-R150 IonicContact OD2-NH1 2.7Å
128	Q	89.9	Confident	86.8	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-57.1	-49.9	176.1	-65.3	-171.2	-4.8	0	0	111.4	S121 L123 S124 T130 Y131 V132 G867 V869 F873	S121-Q128 PolarHBondContact OG-NE2 3.46Å; L123-Q128 HydrophobicContact CB-CG 3.85Å; L123-Q128 HydrophobicContact CD1-CG 4.14Å; S124-Q128 PolarHBondContact O-N 2.86Å; Q128-T130 PolarHBondContact O-N 2.91Å; Q128-T130 VanDerWaalsContact O-N 3.16Å; Q128-Y131 PolarHBondContact O-N 2.84Å; Q128-Y131 VanDerWaalsContact O-N 3.11Å; Q128-V132 WeakPolarHBondContact O-CG2 3.5Å; Q128-V132 PolarHBondContact O-N 2.89Å; Q128-G867 CarbonylContact C-O 3.57Å; Q128-G867 VanDerWaalsContact C-O 3.3Å; Q128-G867 WeakPolarHBondContact CB-O 3.26Å; Q128-V869 HydrophobicContact CB-CG2 4.01Å; Q128-V869 HydrophobicContact CG-CG2 4.29Å; Q128-F873 PolarHBondContact NE2-O 2.72Å
129	K	88.9	Confident	85	Confident	100 Å²	100	62.2 Å²	62.2	44%	0.435	33%	0.328	S	S	.	.	H	α-helix	trans	-64.9	-16.9	176.1	-78	-178.2	178.6	-165.6	0	114.9	T125 D127 K139 H866 G867	T125-K129 HydrophobicContact CG2-CD 4.39Å; T125-K129 VanDerWaalsContact O-CB 3.26Å; T125-K129 WeakPolarHBondContact O-CB 3.42Å; T125-K129 WeakPolarHBondContact O-CG 3.49Å; T125-K129 PolarHBondContact O-N 3.31Å; D127-K129 PolarHBondContact O-N 3.3Å; K129-K139 PolarHBondContact O-NZ 3.03Å; K129-H866 WeakPolarHBondContact CE-O 3.31Å; K129-H866 PolarHBondContact NZ-O 3.11Å; K129-G867 PolarHBondContact N-O 3.42Å
130	T	88.7	Confident	83.2	Confident	51 Å²	51	65.3 Å²	65.3	31%	0.313	35%	0.35	S	S	.	.	H	α-helix	trans	-82.7	-44.1	172.6	-63.1	0	0	0	0	110.2	K126 D127 Q128 G133 Y134 L143	K126-T130 WeakPolarHBondContact O-CB 3.4Å; K126-T130 PolarHBondContact O-N 3.2Å; K126-T130 PolarHBondContact O-OG1 3.38Å; D127-T130 WeakPolarHBondContact O-CB 3.46Å; D127-T130 PolarHBondContact O-N 3.15Å; Q128-T130 PolarHBondContact O-N 2.91Å; Q128-T130 VanDerWaalsContact O-N 3.16Å; T130-G133 PolarHBondContact O-N 3.29Å; T130-Y134 PolarHBondContact O-N 3.27Å; T130-Y134 VanDerWaalsContact O-N 3.13Å; T130-L143 HydrophobicContact CG2-CD2 4.03Å
131	Y	88.7	Confident	81.6	Confident	30 Å²	30	70.8 Å²	70.8	12%	0.118	36%	0.364	C	S	.	.	H	α-helix	trans	-70.8	-41.8	179.7	-165.8	-95	0	0	0	113.6	D127 Q128 G133 Y134 L135 L143 I151 V869	D127-Y131 PolarHBondContact O-N 2.9Å; Q128-Y131 PolarHBondContact O-N 2.84Å; Q128-Y131 VanDerWaalsContact O-N 3.11Å; Y131-G133 PolarHBondContact O-N 2.87Å; Y131-Y134 WeakPolarHBondContact O-CA 3.46Å; Y131-Y134 WeakPolarHBondContact O-CB 3.46Å; Y131-Y134 PolarHBondContact O-N 2.83Å; Y131-L135 HydrophobicContact CD1-CD1 3.94Å; Y131-L135 HydrophobicContact CD1-CG 3.99Å; Y131-L135 HydrophobicContact CE1-CD1 3.76Å; Y131-L135 HydrophobicContact CE1-CD2 3.94Å; Y131-L135 HydrophobicContact CE1-CG 3.79Å; Y131-L135 PolarHBondContact O-N 3.28Å; Y131-L143 HydrophobicContact CD2-CD1 3.38Å; Y131-L143 HydrophobicContact CE2-CD1 3.55Å; Y131-L143 HydrophobicContact CG-CD1 4.49Å; Y131-I151 HydrophobicContact CD1-CD1 3.96Å; Y131-I151 HydrophobicContact CD2-CD1 3.24Å; Y131-I151 HydrophobicContact CE1-CD1 4.41Å; Y131-I151 HydrophobicContact CE1-CG2 4.17Å; Y131-I151 HydrophobicContact CE2-CD1 3.79Å; Y131-I151 HydrophobicContact CG-CD1 3.34Å; Y131-V869 HydrophobicContact CD1-CB 4.35Å; Y131-V869 HydrophobicContact CD1-CG1 3.51Å; Y131-V869 HydrophobicContact CD1-CG2 3.79Å; Y131-V869 HydrophobicContact CE1-CG1 3.8Å; Y131-V869 HydrophobicContact CG-CG2 4.22Å
132	V	89.3	Confident	80.4	Confident	8 Å²	8	76.4 Å²	76.4	5%	0.048	40%	0.402	C	S	.	.	H	α-helix	trans	-57.3	-39.8	171.9	175.1	0	0	0	0	110.9	Q128 Y134 L135 M136 V859 R868 V869	Q128-V132 WeakPolarHBondContact O-CG2 3.5Å; Q128-V132 PolarHBondContact O-N 2.89Å; V132-Y134 VanDerWaalsContact C-N 3.28Å; V132-Y134 PolarHBondContact O-N 3.07Å; V132-L135 PolarHBondContact O-N 3.01Å; V132-M136 WeakPolarHBondContact O-CG 3.3Å; V132-M136 PolarHBondContact O-N 2.81Å; V132-V859 HydrophobicContact CG1-CG1 4.07Å; V132-R868 WeakPolarHBondContact CG2-O 3.46Å; V132-V869 HydrophobicContact CG2-CB 4.46Å; V132-V869 HydrophobicContact CG2-CG2 3.88Å
133	G	85.9	Confident	79.9	Confident	6 Å²	6	73.2 Å²	73.2	6%	0.062	38%	0.379	C	S	.	.	H	α-helix	trans	-69.6	-21.5	176	0	0	0	0	0	114.6	T130 Y131 T138 K139	T130-G133 PolarHBondContact O-N 3.29Å; Y131-G133 PolarHBondContact O-N 2.87Å; G133-T138 VanDerWaalsContact CA-OG1 3.27Å; G133-T138 WeakPolarHBondContact CA-OG1 3.42Å; G133-T138 PolarHBondContact O-N 3.33Å; G133-T138 PolarHBondContact O-OG1 2.79Å; G133-K139 PolarHBondContact O-N 3.11Å
134	Y	86.9	Confident	79.6	Confident	108 Å²	108	76.8 Å²	76.8	42%	0.424	40%	0.402	S	S	.	.	H	α-helix	trans	-79	-46.3	171.3	168.4	-89.7	0	0	0	111.1	T130 Y131 V132 M136 N137 L143	T130-Y134 PolarHBondContact O-N 3.27Å; T130-Y134 VanDerWaalsContact O-N 3.13Å; Y131-Y134 WeakPolarHBondContact O-CA 3.46Å; Y131-Y134 WeakPolarHBondContact O-CB 3.46Å; Y131-Y134 PolarHBondContact O-N 2.83Å; V132-Y134 VanDerWaalsContact C-N 3.28Å; V132-Y134 PolarHBondContact O-N 3.07Å; Y134-M136 VanDerWaalsContact C-N 3.29Å; Y134-M136 PolarHBondContact O-N 2.91Å; Y134-N137 WeakPolarHBondContact O-CA 3.12Å; Y134-N137 PolarHBondContact O-N 3.03Å; Y134-L143 HydrophobicContact CD1-CD1 3.43Å; Y134-L143 VanDerWaalsContact CD1-CD1 3.43Å; Y134-L143 HydrophobicContact CD1-CG 4.35Å; Y134-L143 HydrophobicContact CD2-CD1 3.71Å; Y134-L143 HydrophobicContact CD2-CG 3.73Å; Y134-L143 HydrophobicContact CE1-CD1 3.8Å; Y134-L143 HydrophobicContact CE2-CD1 4.04Å; Y134-L143 HydrophobicContact CE2-CG 4.17Å; Y134-L143 HydrophobicContact CG-CD1 3.39Å; Y134-L143 HydrophobicContact CG-CD2 4.41Å; Y134-L143 HydrophobicContact CG-CG 3.82Å
135	L	85.6	Confident	79.4	Confident	45 Å²	45	83 Å²	83	24%	0.236	42%	0.423	C	S	.	.	H	α-helix	trans	-57.1	-42.4	175.7	-69.3	179.6	0	0	0	111.9	Y131 V132 N137 V859	Y131-L135 HydrophobicContact CD1-CD1 3.94Å; Y131-L135 HydrophobicContact CD1-CG 3.99Å; Y131-L135 HydrophobicContact CE1-CD1 3.76Å; Y131-L135 HydrophobicContact CE1-CD2 3.94Å; Y131-L135 HydrophobicContact CE1-CG 3.79Å; Y131-L135 PolarHBondContact O-N 3.28Å; V132-L135 PolarHBondContact O-N 3.01Å; L135-N137 PolarHBondContact O-N 2.8Å; L135-V859 HydrophobicContact CB-CG2 3.77Å; L135-V859 HydrophobicContact CD1-CG2 3.55Å; L135-V859 HydrophobicContact CG-CG2 4.34Å
136	M	83.4	Confident	79.4	Confident	73 Å²	73	85 Å²	85	36%	0.36	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	9.2	175.6	-61.2	-55.9	-134.3	0	0	114.1	V132 Y134 T138 V859 Q864	V132-M136 WeakPolarHBondContact O-CG 3.3Å; V132-M136 PolarHBondContact O-N 2.81Å; Y134-M136 VanDerWaalsContact C-N 3.29Å; Y134-M136 PolarHBondContact O-N 2.91Å; M136-T138 HydrophobicContact CB-CG2 3.94Å; M136-T138 WeakPolarHBondContact O-CG2 3.43Å; M136-T138 PolarHBondContact O-N 3.21Å; M136-V859 HydrophobicContact CE-CB 3.71Å; M136-V859 HydrophobicContact CE-CG1 3.69Å; M136-V859 HydrophobicContact CG-CG1 4.49Å; M136-V859 HydrophobicContact SD-CB 3.82Å; M136-V859 HydrophobicContact SD-CG1 4.21Å; M136-V859 HydrophobicContact SD-CG2 4.17Å; M136-Q864 HydrophobicContact CE-CB 4.42Å; M136-Q864 VanDerWaalsContact CE-OE1 3.26Å
137	N	74.7	Confident	79.4	Confident	133 Å²	133	77.2 Å²	77.2	71%	0.711	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	16.2	-176.7	-156.7	10.6	0	0	0	115.7	Y134 L135 K139	Y134-N137 WeakPolarHBondContact O-CA 3.12Å; Y134-N137 PolarHBondContact O-N 3.03Å; L135-N137 PolarHBondContact O-N 2.8Å; N137-K139 PolarHBondContact O-N 2.83Å
138	T	60.4	Low	79.4	Confident	98 Å²	98	78 Å²	78	60%	0.601	40%	0.401	S	S	*	.	S	Bend	trans	-73.8	-13.7	179.9	64.8	0	0	0	0	113.4	G133 M136	G133-T138 VanDerWaalsContact CA-OG1 3.27Å; G133-T138 WeakPolarHBondContact CA-OG1 3.42Å; G133-T138 PolarHBondContact O-N 3.33Å; G133-T138 PolarHBondContact O-OG1 2.79Å; M136-T138 HydrophobicContact CB-CG2 3.94Å; M136-T138 WeakPolarHBondContact O-CG2 3.43Å; M136-T138 PolarHBondContact O-N 3.21Å
139	K	55.1	Low	79.4	Confident	94 Å²	94	82.6 Å²	82.6	41%	0.409	43%	0.425	S	S	.	.			trans	-139.2	88.2	-173.3	-63.6	170.7	-162.1	170.4	0	109.6	K129 G133 N137 R141	K129-K139 PolarHBondContact O-NZ 3.03Å; G133-K139 PolarHBondContact O-N 3.11Å; N137-K139 PolarHBondContact O-N 2.83Å; K139-R141 PolarHBondContact O-N 3.43Å
140	S	53.5	Low	79.6	Confident	119 Å²	119	81.6 Å²	81.6	83%	0.832	42%	0.419	S	S	*	.			trans	-68.3	31.2	-178.8	55.4	0	0	0	0	115.6
141	R	59.1	Low	79.7	Confident	211 Å²	211	79.2 Å²	79.2	80%	0.796	40%	0.404	S	S	*	.	S	Bend	trans	-95.8	131.8	177.5	-66.5	-174.1	178.4	-169.9	-1.2	110	K139 L143	K139-R141 PolarHBondContact O-N 3.43Å; R141-L143 PolarHBondContact O-N 3.4Å
142	C	64.5	Low	79.8	Confident	127 Å²	127	81.7 Å²	81.7	86%	0.858	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-54.8	122.5	170	-173.3	0	0	0	0	109.9
143	L	78.4	Confident	80.1	Confident	12 Å²	12	85.7 Å²	85.7	6%	0.063	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-71.2	144.5	-179.8	-74.9	171.6	0	0	0	111.2	T130 Y131 Y134 R141 K145 L147 I148	T130-L143 HydrophobicContact CG2-CD2 4.03Å; Y131-L143 HydrophobicContact CD2-CD1 3.38Å; Y131-L143 HydrophobicContact CE2-CD1 3.55Å; Y131-L143 HydrophobicContact CG-CD1 4.49Å; Y134-L143 HydrophobicContact CD1-CD1 3.43Å; Y134-L143 VanDerWaalsContact CD1-CD1 3.43Å; Y134-L143 HydrophobicContact CD1-CG 4.35Å; Y134-L143 HydrophobicContact CD2-CD1 3.71Å; Y134-L143 HydrophobicContact CD2-CG 3.73Å; Y134-L143 HydrophobicContact CE1-CD1 3.8Å; Y134-L143 HydrophobicContact CE2-CD1 4.04Å; Y134-L143 HydrophobicContact CE2-CG 4.17Å; Y134-L143 HydrophobicContact CG-CD1 3.39Å; Y134-L143 HydrophobicContact CG-CD2 4.41Å; Y134-L143 HydrophobicContact CG-CG 3.82Å; R141-L143 PolarHBondContact O-N 3.4Å; L143-K145 PolarHBondContact O-N 2.83Å; L143-L147 HydrophobicContact CD2-CD2 4.36Å; L143-I148 HydrophobicContact CB-CD1 3.99Å; L143-I148 HydrophobicContact CB-CG1 3.95Å; L143-I148 HydrophobicContact CD1-CG1 4.22Å
144	P	83.3	Confident	80.5	Confident	80 Å²	80	85.6 Å²	85.6	52%	0.519	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-59	125.5	171.4	-22.1	33.1	0	0	0	110.9	N146 L147 I148	P144-N146 PolarHBondContact O-N 3.45Å; P144-N146 VanDerWaalsContact O-N 3.1Å; P144-L147 HydrophobicContact CB-CB 4.24Å; P144-L147 WeakPolarHBondContact O-CA 3.39Å; P144-L147 WeakPolarHBondContact O-CB 3.48Å; P144-L147 PolarHBondContact O-N 3.44Å; P144-I148 PolarHBondContact O-N 3.26Å
145	K	85.9	Confident	80.8	Confident	185 Å²	185	81 Å²	81	80%	0.804	42%	0.422	S	S	*	.	H	α-helix	trans	-53.2	-35.8	179.9	-65.5	-174.6	176.9	-175	0	113	L143 L147 I148 L149	L143-K145 PolarHBondContact O-N 2.83Å; K145-L147 VanDerWaalsContact C-N 3.34Å; K145-L147 PolarHBondContact O-N 3.3Å; K145-I148 PolarHBondContact O-N 3.38Å; K145-L149 WeakPolarHBondContact O-CB 3.36Å; K145-L149 PolarHBondContact O-N 3.42Å
146	N	88.4	Confident	81.2	Confident	98 Å²	98	83.8 Å²	83.8	52%	0.524	44%	0.44	S	S	.	.	H	α-helix	trans	-63.8	-32.9	174.5	172.1	-88.4	0	0	0	113.7	P144 R150	P144-N146 PolarHBondContact O-N 3.45Å; P144-N146 VanDerWaalsContact O-N 3.1Å; N146-R150 PolarHBondContact O-N 2.7Å; N146-R150 VanDerWaalsContact O-N 3.09Å; N146-R150 PolarHBondContact OD1-NE 3.19Å; N146-R150 PolarHBondContact OD1-NH2 3.22Å
147	L	87.9	Confident	81.8	Confident	4 Å²	4	86 Å²	86	2%	0.021	45%	0.449	C	S	.	.	H	α-helix	trans	-72.2	-45.1	175.9	174.8	56.3	0	0	0	110.6	L123 D127 L143 P144 K145 L149 R150 I151	L123-L147 HydrophobicContact CD2-CD1 4.02Å; D127-L147 HydrophobicContact CB-CD1 3.69Å; D127-L147 HydrophobicContact CB-CD2 4.37Å; L143-L147 HydrophobicContact CD2-CD2 4.36Å; P144-L147 HydrophobicContact CB-CB 4.24Å; P144-L147 WeakPolarHBondContact O-CA 3.39Å; P144-L147 WeakPolarHBondContact O-CB 3.48Å; P144-L147 PolarHBondContact O-N 3.44Å; K145-L147 VanDerWaalsContact C-N 3.34Å; K145-L147 PolarHBondContact O-N 3.3Å; L147-L149 VanDerWaalsContact C-N 3.29Å; L147-L149 PolarHBondContact O-N 2.96Å; L147-R150 PolarHBondContact O-N 2.84Å; L147-I151 HydrophobicContact CD1-CD1 3.73Å; L147-I151 HydrophobicContact CD1-CG1 4.02Å; L147-I151 HydrophobicContact CG-CD1 3.87Å; L147-I151 WeakPolarHBondContact O-CG1 3.18Å; L147-I151 PolarHBondContact O-N 3.17Å
148	I	88.7	Confident	82.7	Confident	54 Å²	54	79.7 Å²	79.7	28%	0.277	42%	0.416	S	S	.	.	H	α-helix	trans	-56.7	-46.1	174.7	-55.7	172.7	0	0	0	110.1	L143 P144 K145 R150 I151 N152	L143-I148 HydrophobicContact CB-CD1 3.99Å; L143-I148 HydrophobicContact CB-CG1 3.95Å; L143-I148 HydrophobicContact CD1-CG1 4.22Å; P144-I148 PolarHBondContact O-N 3.26Å; K145-I148 PolarHBondContact O-N 3.38Å; I148-R150 PolarHBondContact O-N 3.48Å; I148-I151 PolarHBondContact O-N 3.13Å; I148-N152 WeakPolarHBondContact O-CB 3.39Å; I148-N152 VanDerWaalsContact O-CG 3.26Å; I148-N152 PolarHBondContact O-N 2.76Å; I148-N152 PolarHBondContact O-OD1 2.82Å
149	L	91.1	Very high	84.4	Confident	99 Å²	99	76.2 Å²	76.2	52%	0.518	40%	0.395	S	S	.	.	H	α-helix	trans	-62.6	-42.8	178.5	-174.4	148.9	0	0	0	112.7	K145 L147 N152 N153	K145-L149 WeakPolarHBondContact O-CB 3.36Å; K145-L149 PolarHBondContact O-N 3.42Å; L147-L149 VanDerWaalsContact C-N 3.29Å; L147-L149 PolarHBondContact O-N 2.96Å; L149-N152 PolarHBondContact O-N 3.33Å; L149-N153 PolarHBondContact O-N 3.09Å; L149-N153 PolarHBondContact O-OD1 3.33Å
150	R	91.8	Very high	86.3	Confident	79 Å²	79	78.2 Å²	78.2	30%	0.298	40%	0.403	S	S	.	.	H	α-helix	trans	-63	-42.1	174.8	-79.8	-173.4	-78.2	136.6	-3.7	112.2	L123 D127 N146 L147 I148 N153 E154	L123-R150 HydrophobicContact CD2-CB 3.86Å; D127-R150 IonicContact OD2-NH1 2.7Å; N146-R150 PolarHBondContact O-N 2.7Å; N146-R150 VanDerWaalsContact O-N 3.09Å; N146-R150 PolarHBondContact OD1-NE 3.19Å; N146-R150 PolarHBondContact OD1-NH2 3.22Å; L147-R150 PolarHBondContact O-N 2.84Å; I148-R150 PolarHBondContact O-N 3.48Å; R150-N153 PolarHBondContact O-N 3.48Å; R150-E154 PolarHBondContact O-N 3.27Å; R150-E154 VanDerWaalsContact O-N 3.1Å
151	I	91.1	Very high	88.3	Confident	1 Å²	1	73.6 Å²	73.6	1%	0.005	37%	0.368	C	S	.	.	H	α-helix	trans	-63.1	-48.7	176.6	-70.2	170.6	0	0	0	110.5	L123 Y131 L147 I148 N153 E154 V155 V869	L123-I151 HydrophobicContact CD1-CG1 3.67Å; L123-I151 HydrophobicContact CD2-CG1 3.79Å; L123-I151 HydrophobicContact CG-CG1 4.39Å; Y131-I151 HydrophobicContact CD1-CD1 3.96Å; Y131-I151 HydrophobicContact CD2-CD1 3.24Å; Y131-I151 HydrophobicContact CE1-CD1 4.41Å; Y131-I151 HydrophobicContact CE1-CG2 4.17Å; Y131-I151 HydrophobicContact CE2-CD1 3.79Å; Y131-I151 HydrophobicContact CG-CD1 3.34Å; L147-I151 HydrophobicContact CD1-CD1 3.73Å; L147-I151 HydrophobicContact CD1-CG1 4.02Å; L147-I151 HydrophobicContact CG-CD1 3.87Å; L147-I151 WeakPolarHBondContact O-CG1 3.18Å; L147-I151 PolarHBondContact O-N 3.17Å; I148-I151 PolarHBondContact O-N 3.13Å; I151-N153 VanDerWaalsContact C-N 3.31Å; I151-N153 PolarHBondContact O-N 3.3Å; I151-E154 PolarHBondContact O-N 3.28Å; I151-E154 VanDerWaalsContact O-N 3.12Å; I151-V155 HydrophobicContact CG2-CG2 4.06Å; I151-V155 WeakPolarHBondContact O-CB 3.14Å; I151-V155 VanDerWaalsContact O-CG2 3.29Å; I151-V155 WeakPolarHBondContact O-CG2 3.26Å; I151-V155 PolarHBondContact O-N 2.86Å; I151-V869 HydrophobicContact CG2-CG1 4.35Å
152	N	92.1	Very high	90	Very high	81 Å²	81	63.6 Å²	63.6	43%	0.433	33%	0.33	S	S	.	.	H	α-helix	trans	-60.1	-40.8	179.9	-70.4	0.7	0	0	0	112.1	I148 L149 V155 V156	I148-N152 WeakPolarHBondContact O-CB 3.39Å; I148-N152 VanDerWaalsContact O-CG 3.26Å; I148-N152 PolarHBondContact O-N 2.76Å; I148-N152 PolarHBondContact O-OD1 2.82Å; L149-N152 PolarHBondContact O-N 3.33Å; N152-V155 PolarHBondContact O-N 2.82Å; N152-V156 WeakPolarHBondContact O-CG2 3.47Å; N152-V156 PolarHBondContact O-N 3.12Å
153	N	93.6	Very high	91.4	Very high	93 Å²	93	61.2 Å²	61.2	50%	0.497	31%	0.306	S	S	.	.	H	α-helix	trans	-62	-43	175.2	-70.4	-1	0	0	0	112	L149 R150 I151 V156 Q157	L149-N153 PolarHBondContact O-N 3.09Å; L149-N153 PolarHBondContact O-OD1 3.33Å; R150-N153 PolarHBondContact O-N 3.48Å; I151-N153 VanDerWaalsContact C-N 3.31Å; I151-N153 PolarHBondContact O-N 3.3Å; N153-V156 PolarHBondContact O-N 3.31Å; N153-Q157 WeakPolarHBondContact O-CG 3.49Å; N153-Q157 PolarHBondContact O-N 2.59Å
154	E	94.6	Very high	92.2	Very high	3 Å²	3	63.2 Å²	63.2	1%	0.014	32%	0.317	C	S	.	.	H	α-helix	trans	-70.8	-37	178.2	-162.9	170.3	124.4	0	0	112.1	S121 S122 R150 I151 V156 Q157 F158 T872 F873	S121-E154 WeakPolarHBondContact CA-OE1 3.44Å; S121-E154 WeakPolarHBondContact CB-OE1 3.2Å; S121-E154 PolarHBondContact OG-OE1 3.35Å; S121-E154 PolarHBondContact OG-OE2 3.45Å; S122-E154 WeakPolarHBondContact CB-OE2 3.38Å; S122-E154 PolarHBondContact N-OE2 2.87Å; S122-E154 PolarHBondContact OG-OE2 3.49Å; R150-E154 PolarHBondContact O-N 3.27Å; R150-E154 VanDerWaalsContact O-N 3.1Å; I151-E154 PolarHBondContact O-N 3.28Å; I151-E154 VanDerWaalsContact O-N 3.12Å; E154-V156 VanDerWaalsContact C-N 3.31Å; E154-V156 PolarHBondContact O-N 3.31Å; E154-Q157 PolarHBondContact O-N 2.92Å; E154-F158 WeakPolarHBondContact O-CB 3.36Å; E154-F158 PolarHBondContact O-N 3.06Å; E154-T872 WeakPolarHBondContact OE1-CB 3.29Å; E154-F873 HydrophobicContact CG-CD2 3.64Å; E154-F873 HydrophobicContact CG-CE2 4.12Å; E154-F873 PolarHBondContact OE1-N 3.33Å
155	V	94.1	Very high	92.7	Very high	13 Å²	13	59.6 Å²	59.6	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-37.9	173.3	168	0	0	0	0	111.5	I151 N152 T159 P856 C871 T872	I151-V155 HydrophobicContact CG2-CG2 4.06Å; I151-V155 WeakPolarHBondContact O-CB 3.14Å; I151-V155 VanDerWaalsContact O-CG2 3.29Å; I151-V155 WeakPolarHBondContact O-CG2 3.26Å; I151-V155 PolarHBondContact O-N 2.86Å; N152-V155 PolarHBondContact O-N 2.82Å; V155-T159 WeakPolarHBondContact O-CB 3.3Å; V155-T159 PolarHBondContact O-N 3.39Å; V155-T159 PolarHBondContact O-OG1 3.44Å; V155-P856 HydrophobicContact CG1-CB 3.99Å; V155-P856 HydrophobicContact CG1-CG 4.19Å; V155-P856 HydrophobicContact CG2-CB 4.3Å; V155-C871 WeakPolarHBondContact CA-O 3.22Å; V155-C871 HydrophobicContact CB-CB 4.41Å; V155-C871 HydrophobicContact CG1-CB 3.99Å; V155-C871 HydrophobicContact CG2-CB 4.08Å; V155-C871 WeakPolarHBondContact CG2-O 3.35Å; V155-T872 HydrophobicContact CG2-CG2 4.22Å
156	V	94.2	Very high	93.1	Very high	103 Å²	103	50.9 Å²	50.9	62%	0.624	26%	0.256	S	S	*	.	H	α-helix	trans	-65.3	-44.6	173.7	169	0	0	0	0	111.3	N152 N153 E154 T159 K160	N152-V156 WeakPolarHBondContact O-CG2 3.47Å; N152-V156 PolarHBondContact O-N 3.12Å; N153-V156 PolarHBondContact O-N 3.31Å; E154-V156 VanDerWaalsContact C-N 3.31Å; E154-V156 PolarHBondContact O-N 3.31Å; V156-T159 PolarHBondContact O-N 3.45Å; V156-K160 PolarHBondContact O-N 3.47Å
157	Q	94.7	Very high	93.3	Very high	118 Å²	118	51.4 Å²	51.4	55%	0.551	25%	0.254	S	S	*	.	H	α-helix	trans	-63	-43.8	176.5	-68.5	175.1	2.8	0	0	111.9	N153 E154 K160 Y161 F873	N153-Q157 WeakPolarHBondContact O-CG 3.49Å; N153-Q157 PolarHBondContact O-N 2.59Å; E154-Q157 PolarHBondContact O-N 2.92Å; Q157-K160 PolarHBondContact O-N 3.32Å; Q157-Y161 PolarHBondContact O-N 2.9Å; Q157-F873 HydrophobicContact CB-CE2 3.95Å; Q157-F873 HydrophobicContact CB-CZ 4.4Å
158	F	95.3	Very high	93.5	Very high	1 Å²	1	56.9 Å²	56.9	0%	0.004	28%	0.282	C	S	.	.	H	α-helix	trans	-65.7	-40.3	176.9	-161.6	-84.2	0	0	0	111.9	Y117 E154 K160 Y161 L162 Y726 C871 T872 F873	Y117-F158 HydrophobicContact CD1-CE2 4.04Å; Y117-F158 AromaticContact CE1-CE2 3.73Å; Y117-F158 HydrophobicContact CE1-CE2 3.73Å; Y117-F158 AromaticContact CE1-CZ 3.92Å; Y117-F158 HydrophobicContact CE1-CZ 3.92Å; E154-F158 WeakPolarHBondContact O-CB 3.36Å; E154-F158 PolarHBondContact O-N 3.06Å; F158-K160 VanDerWaalsContact C-N 3.31Å; F158-K160 PolarHBondContact O-N 3.34Å; F158-Y161 WeakPolarHBondContact O-CB 3.49Å; F158-Y161 PolarHBondContact O-N 3.22Å; F158-L162 HydrophobicContact CD1-CD1 3.81Å; F158-L162 HydrophobicContact CD1-CD2 4.38Å; F158-L162 HydrophobicContact CD1-CG 3.8Å; F158-L162 HydrophobicContact CE1-CD1 3.77Å; F158-L162 HydrophobicContact CE1-CD2 3.84Å; F158-L162 HydrophobicContact CE1-CG 3.75Å; F158-L162 WeakPolarHBondContact O-CG 3.44Å; F158-L162 PolarHBondContact O-N 2.79Å; F158-Y726 HydrophobicContact CE1-CD1 4.26Å; F158-Y726 AromaticContact CZ-CD1 3.91Å; F158-Y726 HydrophobicContact CZ-CD1 3.91Å; F158-C871 WeakPolarHBondContact CB-O 3.02Å; F158-C871 VanDerWaalsContact CD1-CA 3.46Å; F158-C871 HydrophobicContact CD1-CB 3.95Å; F158-C871 HydrophobicContact CG-CB 4.46Å; F158-C871 WeakPolarHBondContact CG-O 3.46Å; F158-T872 VanDerWaalsContact CD2-C 3.48Å; F158-T872 VanDerWaalsContact CE2-O 3.24Å; F158-T872 WeakPolarHBondContact CE2-O 3.31Å; F158-F873 HydrophobicContact CB-CE2 4.22Å; F158-F873 HydrophobicContact CB-CZ 4.07Å; F158-F873 AromaticContact CD2-CD1 3.5Å; F158-F873 HydrophobicContact CD2-CD1 3.5Å; F158-F873 VanDerWaalsContact CD2-CD1 3.5Å; F158-F873 HydrophobicContact CD2-CD2 4.24Å; F158-F873 AromaticContact CD2-CE1 3.46Å; F158-F873 HydrophobicContact CD2-CE1 3.46Å; F158-F873 VanDerWaalsContact CD2-CE1 3.46Å; F158-F873 HydrophobicContact CD2-CE2 4.22Å; F158-F873 AromaticContact CD2-CG 3.89Å; F158-F873 HydrophobicContact CD2-CG 3.89Å; F158-F873 AromaticContact CD2-CZ 3.85Å; F158-F873 HydrophobicContact CD2-CZ 3.85Å; F158-F873 AromaticContact CE2-CD1 3.82Å; F158-F873 HydrophobicContact CE2-CD1 3.82Å; F158-F873 HydrophobicContact CE2-CE1 4.02Å; F158-F873 HydrophobicContact CE2-CG 4.41Å; F158-F873 HydrophobicContact CG-CE1 4.31Å; F158-F873 HydrophobicContact CG-CZ 4.36Å
159	T	94.9	Very high	93.7	Very high	26 Å²	26	55.3 Å²	55.3	16%	0.16	28%	0.275	C	S	.	.	H	α-helix	trans	-61.5	-38.6	175.6	-60.7	0	0	0	0	111.4	V155 V156 L162 Q163 W851 P853	V155-T159 WeakPolarHBondContact O-CB 3.3Å; V155-T159 PolarHBondContact O-N 3.39Å; V155-T159 PolarHBondContact O-OG1 3.44Å; V156-T159 PolarHBondContact O-N 3.45Å; T159-L162 PolarHBondContact O-N 2.84Å; T159-Q163 PolarHBondContact O-N 2.99Å; T159-W851 HydrophobicContact CG2-CH2 3.8Å; T159-W851 HydrophobicContact CG2-CZ2 4.4Å; T159-P853 HydrophobicContact CG2-CB 4.18Å
160	K	95.2	Very high	93.7	Very high	135 Å²	135	51.9 Å²	51.9	59%	0.587	26%	0.261	S	S	*	.	H	α-helix	trans	-64.3	-47.8	172.2	-174.8	-178.8	175.8	-175.6	0	111.6	V156 Q157 F158 L162 Q163 D164	V156-K160 PolarHBondContact O-N 3.47Å; Q157-K160 PolarHBondContact O-N 3.32Å; F158-K160 VanDerWaalsContact C-N 3.31Å; F158-K160 PolarHBondContact O-N 3.34Å; K160-L162 VanDerWaalsContact C-N 3.28Å; K160-L162 PolarHBondContact O-N 3.39Å; K160-Q163 WeakPolarHBondContact O-CB 3.29Å; K160-Q163 PolarHBondContact O-N 3.44Å; K160-D164 WeakPolarHBondContact CE-OD2 3.39Å; K160-D164 PolarHBondContact O-N 2.64Å
161	Y	95.4	Very high	93.6	Very high	23 Å²	23	54.5 Å²	54.5	9%	0.09	28%	0.277	C	S	.	.	H	α-helix	trans	-54.4	-43.9	175.3	160	-100.1	0	0	0	111.9	L115 Y117 P118 Q157 F158 Q163 D164 V165 Y726 F873	L115-Y161 PolarHBondContact O-OH 3.45Å; Y117-Y161 HydrophobicContact CD1-CE1 4.15Å; Y117-Y161 HydrophobicContact CE1-CE1 4.4Å; P118-Y161 VanDerWaalsContact CD-CD2 3.48Å; P118-Y161 HydrophobicContact CG-CD2 3.88Å; P118-Y161 HydrophobicContact CG-CG 4.24Å; Q157-Y161 PolarHBondContact O-N 2.9Å; F158-Y161 WeakPolarHBondContact O-CB 3.49Å; F158-Y161 PolarHBondContact O-N 3.22Å; Y161-Q163 VanDerWaalsContact C-N 3.35Å; Y161-Q163 PolarHBondContact O-N 3.08Å; Y161-D164 PolarHBondContact O-N 3.36Å; Y161-V165 HydrophobicContact CD1-CG2 4.38Å; Y161-V165 HydrophobicContact CD2-CG2 4.1Å; Y161-V165 HydrophobicContact CE1-CG2 3.92Å; Y161-V165 HydrophobicContact CE2-CG2 3.63Å; Y161-V165 HydrophobicContact CG-CG2 4.47Å; Y161-V165 VanDerWaalsContact O-CG2 3.29Å; Y161-V165 WeakPolarHBondContact O-CG2 3.43Å; Y161-V165 PolarHBondContact O-N 3.21Å; Y161-Y726 HydrophobicContact CE1-CE1 4.01Å; Y161-Y726 PolarHBondContact OH-OH 3.44Å; Y161-F873 HydrophobicContact CD1-CE1 4.41Å; Y161-F873 HydrophobicContact CG-CE1 4.42Å
162	L	95.3	Very high	93.6	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.3	-36.9	175.4	-70.3	-176.1	0	0	0	113.6	F158 T159 K160 D164 V165 A166 Q723 Y726 W851 I854	F158-L162 HydrophobicContact CD1-CD1 3.81Å; F158-L162 HydrophobicContact CD1-CD2 4.38Å; F158-L162 HydrophobicContact CD1-CG 3.8Å; F158-L162 HydrophobicContact CE1-CD1 3.77Å; F158-L162 HydrophobicContact CE1-CD2 3.84Å; F158-L162 HydrophobicContact CE1-CG 3.75Å; F158-L162 WeakPolarHBondContact O-CG 3.44Å; F158-L162 PolarHBondContact O-N 2.79Å; T159-L162 PolarHBondContact O-N 2.84Å; K160-L162 VanDerWaalsContact C-N 3.28Å; K160-L162 PolarHBondContact O-N 3.39Å; L162-D164 VanDerWaalsContact C-N 3.33Å; L162-V165 PolarHBondContact O-N 2.98Å; L162-A166 PolarHBondContact O-N 2.79Å; L162-Q723 PolarHBondContact O-NE2 2.85Å; L162-Y726 HydrophobicContact CD2-CD1 3.93Å; L162-Y726 HydrophobicContact CD2-CD2 3.36Å; L162-Y726 HydrophobicContact CD2-CE1 4.23Å; L162-Y726 HydrophobicContact CD2-CE2 3.7Å; L162-Y726 HydrophobicContact CD2-CG 3.46Å; L162-Y726 VanDerWaalsContact CD2-CG 3.46Å; L162-W851 HydrophobicContact CB-CZ2 3.99Å; L162-I854 HydrophobicContact CD1-CB 3.89Å; L162-I854 HydrophobicContact CD1-CG1 3.51Å
163	Q	94.8	Very high	93.5	Very high	77 Å²	77	52.5 Å²	52.5	36%	0.36	27%	0.265	S	S	.	.	H	α-helix	trans	-65.3	-38.8	174	-160.9	-167.1	45.7	0	0	111.4	T159 K160 Y161 A166 K167 W851	T159-Q163 PolarHBondContact O-N 2.99Å; K160-Q163 WeakPolarHBondContact O-CB 3.29Å; K160-Q163 PolarHBondContact O-N 3.44Å; Y161-Q163 VanDerWaalsContact C-N 3.35Å; Y161-Q163 PolarHBondContact O-N 3.08Å; Q163-A166 PolarHBondContact O-N 2.92Å; Q163-K167 WeakPolarHBondContact O-CG 3.42Å; Q163-K167 PolarHBondContact O-N 3.09Å; Q163-K167 VanDerWaalsContact O-N 3.13Å; Q163-W851 HydrophobicContact CB-CD2 4.38Å; Q163-W851 HydrophobicContact CB-CE3 4.24Å; Q163-W851 HydrophobicContact CB-CH2 3.63Å; Q163-W851 HydrophobicContact CB-CZ2 3.84Å; Q163-W851 HydrophobicContact CB-CZ3 3.86Å; Q163-W851 HydrophobicContact CG-CD2 4.1Å; Q163-W851 HydrophobicContact CG-CE3 3.7Å; Q163-W851 HydrophobicContact CG-CH2 3.96Å; Q163-W851 HydrophobicContact CG-CZ2 4.38Å; Q163-W851 HydrophobicContact CG-CZ3 3.61Å
164	D	94	Very high	93.3	Very high	54 Å²	54	52.1 Å²	52.1	29%	0.289	26%	0.263	S	S	.	.	H	α-helix	trans	-73.5	-35.9	178.7	-64.1	-28	0	0	0	111.3	K160 Y161 L162 A166 K167 I168	K160-D164 WeakPolarHBondContact CE-OD2 3.39Å; K160-D164 PolarHBondContact O-N 2.64Å; Y161-D164 PolarHBondContact O-N 3.36Å; L162-D164 VanDerWaalsContact C-N 3.33Å; D164-A166 VanDerWaalsContact C-N 3.33Å; D164-A166 PolarHBondContact O-N 2.85Å; D164-K167 PolarHBondContact O-N 3.17Å; D164-K167 IonicContact OD1-NZ 3.27Å; D164-K167 PolarHBondContact OD1-NZ 2.98Å; D164-I168 WeakPolarHBondContact O-CD1 3.48Å; D164-I168 VanDerWaalsContact O-CG1 3.28Å; D164-I168 WeakPolarHBondContact O-CG1 3.39Å; D164-I168 PolarHBondContact O-N 2.84Å
165	V	94.1	Very high	93.2	Very high	4 Å²	4	55.5 Å²	55.5	2%	0.024	28%	0.278	C	S	.	.	H	α-helix	trans	-56.3	-45.2	166.3	172.2	0	0	0	0	111	R114 L115 Y161 L162 K167 I168 C169 Y726	R114-V165 HydrophobicContact CB-CG1 4.28Å; L115-V165 HydrophobicContact CB-CG2 4.31Å; L115-V165 HydrophobicContact CD1-CB 4.38Å; L115-V165 HydrophobicContact CD1-CG2 3.93Å; L115-V165 HydrophobicContact CG-CG2 4.33Å; Y161-V165 HydrophobicContact CD1-CG2 4.38Å; Y161-V165 HydrophobicContact CD2-CG2 4.1Å; Y161-V165 HydrophobicContact CE1-CG2 3.92Å; Y161-V165 HydrophobicContact CE2-CG2 3.63Å; Y161-V165 HydrophobicContact CG-CG2 4.47Å; Y161-V165 VanDerWaalsContact O-CG2 3.29Å; Y161-V165 WeakPolarHBondContact O-CG2 3.43Å; Y161-V165 PolarHBondContact O-N 3.21Å; L162-V165 PolarHBondContact O-N 2.98Å; V165-K167 VanDerWaalsContact C-N 3.33Å; V165-K167 PolarHBondContact O-N 2.91Å; V165-I168 PolarHBondContact O-N 3.13Å; V165-C169 WeakPolarHBondContact O-CB 3.36Å; V165-C169 PolarHBondContact O-N 3.17Å; V165-Y726 HydrophobicContact CG1-CE2 4.49Å
166	A	93.9	Very high	93.1	Very high	2 Å²	2	56.4 Å²	56.4	2%	0.017	28%	0.282	C	S	.	.	H	α-helix	trans	-67.1	-31.4	-179.1	0	0	0	0	0	113.5	L162 Q163 D164 C169 A170 Y173 V849 W851	L162-A166 PolarHBondContact O-N 2.79Å; Q163-A166 PolarHBondContact O-N 2.92Å; D164-A166 VanDerWaalsContact C-N 3.33Å; D164-A166 PolarHBondContact O-N 2.85Å; A166-C169 CarbonylContact O-C 3.59Å; A166-A170 WeakPolarHBondContact O-CA 3.44Å; A166-A170 PolarHBondContact O-N 2.81Å; A166-Y173 HydrophobicContact CB-CE2 3.92Å; A166-V849 HydrophobicContact CB-CG1 4.35Å; A166-W851 HydrophobicContact CB-CB 4.07Å; A166-W851 HydrophobicContact CB-CG 3.75Å
167	K	92.6	Very high	93	Very high	110 Å²	110	53 Å²	53	48%	0.478	26%	0.261	S	S	.	.	H	α-helix	trans	-71.2	-43.3	172.9	-65.7	163.6	-161.4	155.6	0	111.8	Q163 D164 V165	Q163-K167 WeakPolarHBondContact O-CG 3.42Å; Q163-K167 PolarHBondContact O-N 3.09Å; Q163-K167 VanDerWaalsContact O-N 3.13Å; D164-K167 PolarHBondContact O-N 3.17Å; D164-K167 IonicContact OD1-NZ 3.27Å; D164-K167 PolarHBondContact OD1-NZ 2.98Å; V165-K167 VanDerWaalsContact C-N 3.33Å; V165-K167 PolarHBondContact O-N 2.91Å
168	I	93.2	Very high	92.9	Very high	119 Å²	119	54.5 Å²	54.5	61%	0.61	27%	0.269	S	S	*	.	H	α-helix	trans	-71	-35.8	-178.5	-66.8	164.4	0	0	0	111.1	L115 D164 V165	L115-I168 HydrophobicContact CD1-CB 4.12Å; L115-I168 HydrophobicContact CD1-CD1 3.75Å; L115-I168 HydrophobicContact CD1-CG2 3.97Å; L115-I168 HydrophobicContact CD2-CG2 4.44Å; D164-I168 WeakPolarHBondContact O-CD1 3.48Å; D164-I168 VanDerWaalsContact O-CG1 3.28Å; D164-I168 WeakPolarHBondContact O-CG1 3.39Å; D164-I168 PolarHBondContact O-N 2.84Å; V165-I168 PolarHBondContact O-N 3.13Å
169	C	92.1	Very high	92.7	Very high	20 Å²	20	55 Å²	55	14%	0.135	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	43.2	178.3	-56.8	0	0	0	0	111.5	R114 V165 A166 E171 D172	R114-C169 HydrophobicContact CG-CB 4.48Å; V165-C169 WeakPolarHBondContact O-CB 3.36Å; V165-C169 PolarHBondContact O-N 3.17Å; A166-C169 CarbonylContact O-C 3.59Å; C169-E171 PolarHBondContact O-N 2.99Å; C169-D172 WeakPolarHBondContact O-CB 3.37Å; C169-D172 PolarHBondContact O-N 3.16Å; C169-D172 VanDerWaalsContact O-N 3.09Å
170	A	90.7	Very high	92.7	Very high	27 Å²	27	53.8 Å²	53.8	22%	0.223	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-55.2	-37.2	-177.2	0	0	0	0	0	113.1	A166 D172 Y173 V849	A166-A170 WeakPolarHBondContact O-CA 3.44Å; A166-A170 PolarHBondContact O-N 2.81Å; A170-D172 PolarHBondContact O-N 2.53Å; A170-Y173 WeakPolarHBondContact O-CB 3.29Å; A170-Y173 PolarHBondContact O-N 2.78Å; A170-V849 HydrophobicContact CB-CG2 3.65Å
171	E	89.9	Confident	92.6	Very high	135 Å²	135	49.2 Å²	49.2	63%	0.631	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-64.3	-22.3	179.8	-55.6	-50.5	146.7	0	0	114.2	C169 Y173 N174 F175	C169-E171 PolarHBondContact O-N 2.99Å; E171-Y173 PolarHBondContact O-N 2.94Å; E171-N174 PolarHBondContact O-N 2.63Å; E171-N174 PolarHBondContact OE2-ND2 2.7Å; E171-F175 PolarHBondContact O-N 3.01Å
172	D	90.4	Very high	92.6	Very high	32 Å²	32	51.6 Å²	51.6	17%	0.171	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-61.4	-25.5	172.8	-67.4	-3	0	0	0	110.4	R114 C169 A170 Y722 H759	R114-D172 IonicContact CZ-OD1 2.85Å; R114-D172 IonicContact CZ-OD2 2.72Å; R114-D172 IonicContact NE-OD1 3.38Å; R114-D172 IonicContact NE-OD2 3.86Å; R114-D172 PolarHBondContact NE-OD2 3.17Å; R114-D172 IonicContact NH2-OD1 3.74Å; R114-D172 PolarHBondContact NH2-OD1 3.13Å; R114-D172 IonicContact NH2-OD2 3.61Å; R114-D172 PolarHBondContact NH2-OD2 3.04Å; C169-D172 WeakPolarHBondContact O-CB 3.37Å; C169-D172 PolarHBondContact O-N 3.16Å; C169-D172 VanDerWaalsContact O-N 3.09Å; A170-D172 PolarHBondContact O-N 2.53Å; D172-Y722 VanDerWaalsContact O-CD1 3.22Å; D172-Y722 WeakPolarHBondContact O-CD1 3.46Å; D172-Y722 VanDerWaalsContact O-CE1 3.26Å; D172-Y722 WeakPolarHBondContact O-CE1 3.45Å; D172-H759 PolarHBondContact O-NE2 2.91Å; D172-H759 VanDerWaalsContact O-NE2 3.17Å
173	Y	90.7	Very high	92.7	Very high	7 Å²	7	51.6 Å²	51.6	3%	0.027	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-84	-17.3	174.4	-69.2	-93	0	0	0	114.2	A166 A170 E171 F175 Y722 V849 P850	A166-Y173 HydrophobicContact CB-CE2 3.92Å; A170-Y173 WeakPolarHBondContact O-CB 3.29Å; A170-Y173 PolarHBondContact O-N 2.78Å; E171-Y173 PolarHBondContact O-N 2.94Å; Y173-F175 VanDerWaalsContact C-N 3.32Å; Y173-Y722 AromaticContact CD1-CD1 3.83Å; Y173-Y722 HydrophobicContact CD1-CD1 3.83Å; Y173-Y722 AromaticContact CD1-CD2 3.93Å; Y173-Y722 HydrophobicContact CD1-CD2 3.93Å; Y173-Y722 HydrophobicContact CD1-CE1 4.21Å; Y173-Y722 HydrophobicContact CD1-CE2 4.31Å; Y173-Y722 AromaticContact CD1-CG 3.67Å; Y173-Y722 HydrophobicContact CD1-CG 3.67Å; Y173-Y722 VanDerWaalsContact CE1-CB 3.45Å; Y173-Y722 HydrophobicContact CE1-CD1 4.07Å; Y173-Y722 AromaticContact CE1-CD2 3.75Å; Y173-Y722 HydrophobicContact CE1-CD2 3.75Å; Y173-Y722 AromaticContact CE1-CG 3.48Å; Y173-Y722 HydrophobicContact CE1-CG 3.48Å; Y173-Y722 VanDerWaalsContact CE1-CG 3.48Å; Y173-Y722 HydrophobicContact CG-CD1 4.17Å; Y173-Y722 HydrophobicContact CG-CG 4.4Å; Y173-V849 HydrophobicContact CD1-CG1 4.09Å; Y173-V849 HydrophobicContact CD2-CG1 3.36Å; Y173-V849 HydrophobicContact CE1-CG1 4.41Å; Y173-V849 HydrophobicContact CE2-CG1 3.74Å; Y173-V849 HydrophobicContact CG-CG1 3.57Å; Y173-P850 HydrophobicContact CD1-CG 4.18Å
174	N	90.2	Very high	92.8	Very high	85 Å²	85	47.9 Å²	47.9	46%	0.455	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-88.3	-0.2	174	-66.1	-28.4	0	0	0	112.4	E171 I176	E171-N174 PolarHBondContact O-N 2.63Å; E171-N174 PolarHBondContact OE2-ND2 2.7Å; N174-I176 PolarHBondContact O-N 2.94Å
175	F	91.3	Very high	92.8	Very high	75 Å²	75	49.5 Å²	49.5	33%	0.329	25%	0.248	S	C	.	.			trans	-68.2	129.6	177.7	-178.5	-92	0	0	0	112.8	E171 Y173 T177 A758 H759	E171-F175 PolarHBondContact O-N 3.01Å; Y173-F175 VanDerWaalsContact C-N 3.32Å; F175-T177 HydrophobicContact CE1-CG2 4.19Å; F175-T177 HydrophobicContact CZ-CG2 4.21Å; F175-A758 WeakPolarHBondContact CD1-O 3.34Å; F175-H759 AromaticContact CD1-CD2 3.98Å; F175-H759 AromaticContact CG-CD2 3.78Å
176	I	92.3	Very high	92.9	Very high	32 Å²	32	52.5 Å²	52.5	16%	0.164	26%	0.262	C	S	.	.			trans	-153.3	147	170.5	-173.3	160.9	0	0	0	109.8	N174 A180 M181 I343 R346	N174-I176 PolarHBondContact O-N 2.94Å; I176-A180 HydrophobicContact CD1-CB 4.03Å; I176-A180 HydrophobicContact CG1-CB 3.69Å; I176-M181 HydrophobicContact CB-CG 4.48Å; I176-M181 HydrophobicContact CD1-CG 4.13Å; I176-M181 HydrophobicContact CD1-SD 3.88Å; I176-M181 HydrophobicContact CG1-CG 4.1Å; I176-M181 HydrophobicContact CG1-SD 4.43Å; I176-M181 HydrophobicContact CG2-CG 3.61Å; I176-M181 HydrophobicContact CG2-SD 3.8Å; I176-I343 HydrophobicContact CB-CG2 3.64Å; I176-I343 HydrophobicContact CD1-CG2 4.27Å; I176-I343 HydrophobicContact CG2-CG2 3.61Å; I176-R346 HydrophobicContact CD1-CB 3.7Å
177	T	91.9	Very high	93.1	Very high	30 Å²	30	52.4 Å²	52.4	18%	0.184	26%	0.261	C	S	.	.			trans	-80.9	152.1	178.2	65.7	0	0	0	0	111.4	F175 G179 A180 M181	F175-T177 HydrophobicContact CE1-CG2 4.19Å; F175-T177 HydrophobicContact CZ-CG2 4.21Å; T177-G179 PolarHBondContact O-N 2.96Å; T177-A180 PolarHBondContact O-N 2.83Å; T177-A180 WeakPolarHBondContact OG1-CB 3.16Å; T177-A180 PolarHBondContact OG1-N 3.03Å; T177-M181 PolarHBondContact O-N 2.92Å
178	Q	91.9	Very high	93.3	Very high	151 Å²	151	47.2 Å²	47.2	71%	0.706	24%	0.238	S	C	*	.	H	α-helix	trans	-57.5	-37.9	178.7	-173.5	60.5	29.4	0	0	112.5	M181 Q182	Q178-M181 PolarHBondContact O-N 3.16Å; Q178-Q182 PolarHBondContact O-N 3.15Å
179	G	92.3	Very high	93.4	Very high	11 Å²	11	44.8 Å²	44.8	11%	0.113	23%	0.229	C	C	.	.	H	α-helix	trans	-66.2	-36.6	176.6	0	0	0	0	0	113.5	T177 Y183	T177-G179 PolarHBondContact O-N 2.96Å; G179-Y183 VanDerWaalsContact O-CB 3.25Å; G179-Y183 WeakPolarHBondContact O-CB 3.48Å; G179-Y183 PolarHBondContact O-N 2.87Å
180	A	93.8	Very high	93.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-71	-36.8	174	0	0	0	0	0	112.3	I176 T177 T184 Y350	I176-A180 HydrophobicContact CD1-CB 4.03Å; I176-A180 HydrophobicContact CG1-CB 3.69Å; T177-A180 PolarHBondContact O-N 2.83Å; T177-A180 WeakPolarHBondContact OG1-CB 3.16Å; T177-A180 PolarHBondContact OG1-N 3.03Å; A180-T184 WeakPolarHBondContact O-CB 3.44Å; A180-T184 VanDerWaalsContact O-CG2 3.25Å; A180-T184 WeakPolarHBondContact O-CG2 3.3Å; A180-T184 PolarHBondContact O-N 3.08Å; A180-T184 PolarHBondContact O-OG1 3.48Å; A180-Y350 HydrophobicContact CB-CD1 3.56Å; A180-Y350 HydrophobicContact CB-CD2 4.16Å; A180-Y350 HydrophobicContact CB-CE1 4.16Å; A180-Y350 HydrophobicContact CB-CG 3.55Å
181	M	94.3	Very high	93.8	Very high	39 Å²	39	43.6 Å²	43.6	19%	0.192	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-56	171.7	-81.7	-60.9	-65.7	0	0	111.1	I176 T177 Q178 Y183 T184 E185	I176-M181 HydrophobicContact CB-CG 4.48Å; I176-M181 HydrophobicContact CD1-CG 4.13Å; I176-M181 HydrophobicContact CD1-SD 3.88Å; I176-M181 HydrophobicContact CG1-CG 4.1Å; I176-M181 HydrophobicContact CG1-SD 4.43Å; I176-M181 HydrophobicContact CG2-CG 3.61Å; I176-M181 HydrophobicContact CG2-SD 3.8Å; T177-M181 PolarHBondContact O-N 2.92Å; Q178-M181 PolarHBondContact O-N 3.16Å; M181-Y183 PolarHBondContact O-N 2.81Å; M181-T184 PolarHBondContact O-N 2.87Å; M181-T184 VanDerWaalsContact O-N 3.15Å; M181-T184 PolarHBondContact O-OG1 2.96Å; M181-E185 WeakPolarHBondContact CE-OE1 3.38Å; M181-E185 WeakPolarHBondContact O-CG 3.41Å; M181-E185 PolarHBondContact O-N 3.26Å
182	Q	95.4	Very high	94	Very high	73 Å²	73	38.1 Å²	38.1	34%	0.341	20%	0.196	S	C	.	.	H	α-helix	trans	-56.7	-49.3	179.2	-177.5	-176.4	-12.3	0	0	112.1	Q178 T184 E185 E186 Y251	Q178-Q182 PolarHBondContact O-N 3.15Å; Q182-T184 VanDerWaalsContact C-N 3.27Å; Q182-T184 PolarHBondContact O-N 2.88Å; Q182-E185 PolarHBondContact O-N 2.88Å; Q182-E186 VanDerWaalsContact CG-OE1 3.25Å; Q182-E186 WeakPolarHBondContact CG-OE1 3.3Å; Q182-E186 PolarHBondContact NE2-OE1 3.35Å; Q182-E186 PolarHBondContact O-N 3.45Å; Q182-Y251 HydrophobicContact CB-CD2 4.06Å; Q182-Y251 HydrophobicContact CB-CE2 4.49Å; Q182-Y251 HydrophobicContact CG-CD2 3.82Å; Q182-Y251 HydrophobicContact CG-CE2 3.83Å
183	Y	96.8	Very high	94	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.1	-40	179.4	-173.4	-80.7	0	0	0	111.9	G179 M181 F187 Y251 V254 N258 P260 K263 Y350 E353	G179-Y183 VanDerWaalsContact O-CB 3.25Å; G179-Y183 WeakPolarHBondContact O-CB 3.48Å; G179-Y183 PolarHBondContact O-N 2.87Å; M181-Y183 PolarHBondContact O-N 2.81Å; Y183-F187 WeakPolarHBondContact O-CB 3.43Å; Y183-F187 PolarHBondContact O-N 2.86Å; Y183-Y251 HydrophobicContact CD2-CE2 4.48Å; Y183-V254 HydrophobicContact CD2-CG1 4.06Å; Y183-V254 HydrophobicContact CE2-CG1 3.81Å; Y183-N258 WeakPolarHBondContact CE2-O 3.39Å; Y183-N258 PolarHBondContact OH-O 3.11Å; Y183-P260 HydrophobicContact CD2-CG 3.64Å; Y183-P260 HydrophobicContact CE1-CG 4.47Å; Y183-P260 HydrophobicContact CE2-CG 3.61Å; Y183-P260 HydrophobicContact CG-CG 4.08Å; Y183-K263 HydrophobicContact CE1-CD 4.25Å; Y183-Y350 HydrophobicContact CD1-CD2 4.13Å; Y183-Y350 HydrophobicContact CD2-CD2 4.34Å; Y183-Y350 AromaticContact CG-CD2 3.8Å; Y183-Y350 HydrophobicContact CG-CD2 3.8Å; Y183-Y350 HydrophobicContact CG-CE2 4.41Å; Y183-E353 HydrophobicContact CE1-CG 4.42Å
184	T	95.9	Very high	93.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-74.3	-33	178.8	56.4	0	0	0	0	113.4	A180 M181 Q182 F188 R346 I349	A180-T184 WeakPolarHBondContact O-CB 3.44Å; A180-T184 VanDerWaalsContact O-CG2 3.25Å; A180-T184 WeakPolarHBondContact O-CG2 3.3Å; A180-T184 PolarHBondContact O-N 3.08Å; A180-T184 PolarHBondContact O-OG1 3.48Å; M181-T184 PolarHBondContact O-N 2.87Å; M181-T184 VanDerWaalsContact O-N 3.15Å; M181-T184 PolarHBondContact O-OG1 2.96Å; Q182-T184 VanDerWaalsContact C-N 3.27Å; Q182-T184 PolarHBondContact O-N 2.88Å; T184-F188 VanDerWaalsContact O-CB 3.29Å; T184-F188 WeakPolarHBondContact O-CB 3.5Å; T184-F188 WeakPolarHBondContact O-CD2 3.48Å; T184-F188 WeakPolarHBondContact O-CG 3.36Å; T184-F188 PolarHBondContact O-N 2.91Å; T184-R346 HydrophobicContact CG2-CB 4.09Å; T184-R346 VanDerWaalsContact CG2-O 3.23Å; T184-R346 WeakPolarHBondContact CG2-O 3.47Å; T184-R346 PolarHBondContact OG1-NE 3.35Å; T184-R346 PolarHBondContact OG1-NH2 3.11Å; T184-I349 HydrophobicContact CG2-CB 4.25Å; T184-I349 HydrophobicContact CG2-CG2 4.22Å
185	E	95.6	Very high	94	Very high	87 Å²	87	39.3 Å²	39.3	41%	0.407	20%	0.202	S	C	.	.	H	α-helix	trans	-67.1	-44.7	175.4	-70.7	179.6	170.2	0	0	112	M181 Q182 T189 R346	M181-E185 WeakPolarHBondContact CE-OE1 3.38Å; M181-E185 WeakPolarHBondContact O-CG 3.41Å; M181-E185 PolarHBondContact O-N 3.26Å; Q182-E185 PolarHBondContact O-N 2.88Å; E185-T189 WeakPolarHBondContact O-CB 3.38Å; E185-T189 PolarHBondContact O-N 2.93Å; E185-T189 PolarHBondContact O-OG1 2.87Å; E185-R346 IonicContact OE1-NH2 2.69Å
186	E	96.6	Very high	93.9	Very high	68 Å²	68	41.8 Å²	41.8	32%	0.318	21%	0.212	S	C	.	.	H	α-helix	trans	-63.8	-44.3	174.5	-68.5	174.1	-161.8	0	0	111.2	Q182 T189 A190 Y251 P260	Q182-E186 VanDerWaalsContact CG-OE1 3.25Å; Q182-E186 WeakPolarHBondContact CG-OE1 3.3Å; Q182-E186 PolarHBondContact NE2-OE1 3.35Å; Q182-E186 PolarHBondContact O-N 3.45Å; E186-T189 PolarHBondContact O-N 3.07Å; E186-A190 PolarHBondContact O-N 3.38Å; E186-Y251 PolarHBondContact OE1-OH 2.64Å; E186-Y251 WeakPolarHBondContact OE2-CE2 3.46Å; E186-Y251 VanDerWaalsContact OE2-CZ 3.31Å; E186-Y251 PolarHBondContact OE2-OH 2.95Å; E186-P260 HydrophobicContact CB-CB 3.7Å; E186-P260 HydrophobicContact CB-CG 3.91Å
187	F	96.9	Very high	93.9	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62	-46.5	177.6	167.8	-108	0	0	0	111.7	Y183 A190 C191 P260 K263 A264 K267 I349	Y183-F187 WeakPolarHBondContact O-CB 3.43Å; Y183-F187 PolarHBondContact O-N 2.86Å; F187-A190 PolarHBondContact O-N 2.81Å; F187-C191 VanDerWaalsContact CE2-SG 3.6Å; F187-C191 VanDerWaalsContact CZ-SG 3.58Å; F187-C191 PolarHBondContact O-N 2.98Å; F187-C191 PolarHBondContact O-SG 2.89Å; F187-P260 HydrophobicContact CB-CB 3.95Å; F187-K263 HydrophobicContact CD2-CB 4.06Å; F187-K263 HydrophobicContact CD2-CD 4.25Å; F187-K263 HydrophobicContact CD2-CG 4.01Å; F187-K263 HydrophobicContact CE2-CB 4.16Å; F187-K263 HydrophobicContact CE2-CD 4.15Å; F187-K263 HydrophobicContact CE2-CG 3.72Å; F187-A264 HydrophobicContact CD2-CB 4.05Å; F187-A264 HydrophobicContact CE2-CB 4.12Å; F187-K267 HydrophobicContact CE2-CD 4.39Å; F187-K267 HydrophobicContact CZ-CD 3.83Å; F187-I349 HydrophobicContact CD1-CG2 3.85Å; F187-I349 HydrophobicContact CE1-CD1 4.2Å; F187-I349 HydrophobicContact CE1-CG2 3.9Å; F187-I349 HydrophobicContact CG-CG2 4.5Å
188	F	96.4	Very high	93.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.3	-42.3	176.5	-66.4	-26.2	0	0	0	111.4	T184 A190 C191 L192 L337 V341 R346 I349 V840	T184-F188 VanDerWaalsContact O-CB 3.29Å; T184-F188 WeakPolarHBondContact O-CB 3.5Å; T184-F188 WeakPolarHBondContact O-CD2 3.48Å; T184-F188 WeakPolarHBondContact O-CG 3.36Å; T184-F188 PolarHBondContact O-N 2.91Å; F188-A190 VanDerWaalsContact C-N 3.33Å; F188-A190 PolarHBondContact O-N 2.86Å; F188-C191 WeakPolarHBondContact O-CB 3.24Å; F188-C191 PolarHBondContact O-N 3.21Å; F188-C191 VanDerWaalsContact O-N 3.13Å; F188-L192 WeakPolarHBondContact O-CG 3.32Å; F188-L192 PolarHBondContact O-N 3.04Å; F188-L337 HydrophobicContact CB-CD2 3.84Å; F188-L337 HydrophobicContact CD1-CD1 3.53Å; F188-L337 HydrophobicContact CD1-CD2 3.69Å; F188-L337 HydrophobicContact CD1-CG 4.26Å; F188-L337 HydrophobicContact CE1-CD1 3.62Å; F188-L337 HydrophobicContact CG-CD1 4.47Å; F188-L337 HydrophobicContact CG-CD2 3.94Å; F188-V341 HydrophobicContact CE2-CG1 4.49Å; F188-V341 HydrophobicContact CZ-CB 4.44Å; F188-V341 HydrophobicContact CZ-CG1 3.96Å; F188-V341 HydrophobicContact CZ-CG2 4.39Å; F188-R346 HydrophobicContact CE2-CG 4.01Å; F188-R346 HydrophobicContact CZ-CG 4.2Å; F188-I349 HydrophobicContact CE1-CD1 3.69Å; F188-I349 HydrophobicContact CZ-CD1 3.81Å; F188-V840 HydrophobicContact CB-CG1 4Å; F188-V840 HydrophobicContact CD2-CG1 3.89Å; F188-V840 HydrophobicContact CG-CG1 4.45Å
189	T	95.6	Very high	93.9	Very high	69 Å²	69	37.4 Å²	37.4	42%	0.423	20%	0.2	S	C	.	.	H	α-helix	trans	-57	-47.2	176.2	-58	0	0	0	0	111.1	E185 E186 C191 L192 E193	E185-T189 WeakPolarHBondContact O-CB 3.38Å; E185-T189 PolarHBondContact O-N 2.93Å; E185-T189 PolarHBondContact O-OG1 2.87Å; E186-T189 PolarHBondContact O-N 3.07Å; T189-C191 PolarHBondContact O-N 3.48Å; T189-L192 PolarHBondContact O-N 3.17Å; T189-E193 VanDerWaalsContact O-CG 3.25Å; T189-E193 WeakPolarHBondContact O-CG 3.35Å; T189-E193 PolarHBondContact O-N 3.08Å; T189-E193 VanDerWaalsContact O-N 3.1Å
190	A	95.9	Very high	93.9	Very high	21 Å²	21	41.1 Å²	41.1	17%	0.174	21%	0.214	C	C	.	.	H	α-helix	trans	-63.1	-38.8	175.3	0	0	0	0	0	113.2	E186 F187 F188 L192 E193 S194 A261 A264	E186-A190 PolarHBondContact O-N 3.38Å; F187-A190 PolarHBondContact O-N 2.81Å; F188-A190 VanDerWaalsContact C-N 3.33Å; F188-A190 PolarHBondContact O-N 2.86Å; A190-L192 VanDerWaalsContact C-N 3.35Å; A190-L192 PolarHBondContact O-N 3.4Å; A190-E193 WeakPolarHBondContact O-CB 3.48Å; A190-E193 PolarHBondContact O-N 2.93Å; A190-E193 VanDerWaalsContact O-N 3.17Å; A190-S194 PolarHBondContact O-N 3.03Å; A190-A261 HydrophobicContact CB-CB 4.33Å; A190-A264 HydrophobicContact CB-CB 3.53Å
191	C	94.9	Very high	93.8	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.8	-43.2	173.6	-65.7	0	0	0	0	111.5	F187 F188 T189 E193 S194 V195 L337	F187-C191 VanDerWaalsContact CE2-SG 3.6Å; F187-C191 VanDerWaalsContact CZ-SG 3.58Å; F187-C191 PolarHBondContact O-N 2.98Å; F187-C191 PolarHBondContact O-SG 2.89Å; F188-C191 WeakPolarHBondContact O-CB 3.24Å; F188-C191 PolarHBondContact O-N 3.21Å; F188-C191 VanDerWaalsContact O-N 3.13Å; T189-C191 PolarHBondContact O-N 3.48Å; C191-E193 PolarHBondContact O-N 3.19Å; C191-S194 WeakPolarHBondContact O-CB 3.17Å; C191-S194 PolarHBondContact O-N 2.89Å; C191-S194 VanDerWaalsContact O-N 3.13Å; C191-S194 PolarHBondContact O-OG 2.96Å; C191-V195 PolarHBondContact O-N 3.27Å; C191-L337 HydrophobicContact CB-CB 4.47Å; C191-L337 HydrophobicContact CB-CD2 4.04Å
192	L	94	Very high	93.9	Very high	21 Å²	21	42.3 Å²	42.3	11%	0.11	22%	0.219	C	C	.	.	H	α-helix	trans	-65	-27.7	176.7	-62.3	179.1	0	0	0	112.2	F188 T189 A190 V195 L337 H837 S839 V840	F188-L192 WeakPolarHBondContact O-CG 3.32Å; F188-L192 PolarHBondContact O-N 3.04Å; T189-L192 PolarHBondContact O-N 3.17Å; A190-L192 VanDerWaalsContact C-N 3.35Å; A190-L192 PolarHBondContact O-N 3.4Å; L192-V195 WeakPolarHBondContact O-CB 3.46Å; L192-V195 PolarHBondContact O-N 3.28Å; L192-L337 HydrophobicContact CD2-CD2 4.11Å; L192-L337 HydrophobicContact CG-CD2 4.38Å; L192-H837 HydrophobicContact CD2-CB 3.95Å; L192-S839 VanDerWaalsContact CD1-C 3.47Å; L192-S839 WeakPolarHBondContact CD1-O 3.4Å; L192-V840 HydrophobicContact CD1-CG2 4.45Å
193	E	92.3	Very high	93.8	Very high	111 Å²	111	42.4 Å²	42.4	52%	0.519	22%	0.219	S	C	.	.	H	α-helix	trans	-65.4	-39.3	171.6	-54.2	-134	99.7	0	0	112.3	T189 A190 C191 V195 K196	T189-E193 VanDerWaalsContact O-CG 3.25Å; T189-E193 WeakPolarHBondContact O-CG 3.35Å; T189-E193 PolarHBondContact O-N 3.08Å; T189-E193 VanDerWaalsContact O-N 3.1Å; A190-E193 WeakPolarHBondContact O-CB 3.48Å; A190-E193 PolarHBondContact O-N 2.93Å; A190-E193 VanDerWaalsContact O-N 3.17Å; C191-E193 PolarHBondContact O-N 3.19Å; E193-V195 VanDerWaalsContact C-N 3.25Å; E193-V195 PolarHBondContact O-N 2.99Å; E193-K196 VanDerWaalsContact O-CB 3.25Å; E193-K196 WeakPolarHBondContact O-CB 3.49Å; E193-K196 PolarHBondContact O-N 3.3Å; E193-K196 VanDerWaalsContact O-N 3.11Å; E193-K196 IonicContact OE1-NZ 3.78Å; E193-K196 PolarHBondContact OE1-NZ 3.29Å
194	S	88.1	Confident	93.7	Very high	36 Å²	36	48.4 Å²	48.4	25%	0.252	25%	0.25	S	C	.	.	H	α-helix	trans	-62.7	-32.1	174.8	78.6	0	0	0	0	112.9	A190 C191 K196 S197	A190-S194 PolarHBondContact O-N 3.03Å; C191-S194 WeakPolarHBondContact O-CB 3.17Å; C191-S194 PolarHBondContact O-N 2.89Å; C191-S194 VanDerWaalsContact O-N 3.13Å; C191-S194 PolarHBondContact O-OG 2.96Å; S194-K196 PolarHBondContact O-N 3.15Å; S194-S197 WeakPolarHBondContact O-CB 3.38Å; S194-S197 PolarHBondContact O-N 3.32Å; S194-S197 VanDerWaalsContact O-N 3.08Å; S194-S197 PolarHBondContact O-OG 3.26Å
195	V	91.6	Very high	93.6	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.012	27%	0.269	C	S	.	.	H	α-helix	trans	-63.9	-30.1	177	-177.8	0	0	0	0	111	C191 L192 E193 S197 L198 L336 L833 H837	C191-V195 PolarHBondContact O-N 3.27Å; L192-V195 WeakPolarHBondContact O-CB 3.46Å; L192-V195 PolarHBondContact O-N 3.28Å; E193-V195 VanDerWaalsContact C-N 3.25Å; E193-V195 PolarHBondContact O-N 2.99Å; V195-S197 PolarHBondContact O-N 3.14Å; V195-S197 VanDerWaalsContact O-N 3.09Å; V195-L198 WeakPolarHBondContact O-CB 3.34Å; V195-L198 PolarHBondContact O-N 3.09Å; V195-L198 VanDerWaalsContact O-N 3.09Å; V195-L336 HydrophobicContact CG2-CD2 4.36Å; V195-L833 HydrophobicContact CG1-CD2 3.84Å; V195-L833 HydrophobicContact CG1-CG 3.81Å; V195-H837 HydrophobicContact CG1-CB 4.06Å
196	K	90.1	Very high	93.5	Very high	126 Å²	126	51.6 Å²	51.6	55%	0.548	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.6	175.7	-55.2	171.7	-171.6	174.5	0	112.7	E193 S194 L198	E193-K196 VanDerWaalsContact O-CB 3.25Å; E193-K196 WeakPolarHBondContact O-CB 3.49Å; E193-K196 PolarHBondContact O-N 3.3Å; E193-K196 VanDerWaalsContact O-N 3.11Å; E193-K196 IonicContact OE1-NZ 3.78Å; E193-K196 PolarHBondContact OE1-NZ 3.29Å; S194-K196 PolarHBondContact O-N 3.15Å; K196-L198 VanDerWaalsContact C-N 3.31Å; K196-L198 PolarHBondContact O-N 2.87Å
197	S	90.8	Very high	93.5	Very high	67 Å²	67	52.2 Å²	52.2	47%	0.469	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	2.3	178.4	79.8	0	0	0	0	115	S194 V195 R270	S194-S197 WeakPolarHBondContact O-CB 3.38Å; S194-S197 PolarHBondContact O-N 3.32Å; S194-S197 VanDerWaalsContact O-N 3.08Å; S194-S197 PolarHBondContact O-OG 3.26Å; V195-S197 PolarHBondContact O-N 3.14Å; V195-S197 VanDerWaalsContact O-N 3.09Å; S197-R270 PolarHBondContact O-NH1 2.86Å; S197-R270 PolarHBondContact OG-NH1 3.3Å
198	L	92	Very high	93.3	Very high	24 Å²	24	52.4 Å²	52.4	13%	0.126	27%	0.274	C	S	.	.	S	Bend	trans	-105.9	156.9	178.1	-61.5	176	0	0	0	111.2	V195 K196 P313 L336 L833 Q834	V195-L198 WeakPolarHBondContact O-CB 3.34Å; V195-L198 PolarHBondContact O-N 3.09Å; V195-L198 VanDerWaalsContact O-N 3.09Å; K196-L198 VanDerWaalsContact C-N 3.31Å; K196-L198 PolarHBondContact O-N 2.87Å; L198-P313 HydrophobicContact CD1-CB 4.32Å; L198-P313 HydrophobicContact CD1-CG 3.91Å; L198-P313 HydrophobicContact CD2-CB 4.45Å; L198-L336 HydrophobicContact CD1-CD1 4.4Å; L198-L336 HydrophobicContact CD1-CD2 3.95Å; L198-L833 HydrophobicContact CB-CD2 3.84Å; L198-L833 HydrophobicContact CD1-CD2 3.95Å; L198-Q834 PolarHBondContact O-NE2 2.87Å
199	P	93	Very high	93.2	Very high	31 Å²	31	54.6 Å²	54.6	20%	0.201	29%	0.289	C	S	.	.			trans	-50.1	139.6	174.9	-28.8	34.2	0	0	0	113.5	Y202 Q804 A821	P199-Y202 HydrophobicContact CB-CE2 4.16Å; P199-Y202 WeakPolarHBondContact O-CE2 3.16Å; P199-Q804 VanDerWaalsContact CD-OE1 3.25Å; P199-Q804 HydrophobicContact CG-CB 4.41Å; P199-A821 HydrophobicContact CB-CB 3.86Å; P199-A821 HydrophobicContact CG-CB 3.85Å
200	Q	91.9	Very high	93	Very high	88 Å²	88	51.3 Å²	51.3	41%	0.411	27%	0.269	S	S	.	.	S	Bend	trans	-73.3	-40.6	-178.5	-172.7	172.1	13.3	0	0	113.5	N832 L833 Q834	Q200-N832 VanDerWaalsContact CG-OD1 3.31Å; Q200-N832 WeakPolarHBondContact CG-OD1 3.38Å; Q200-N832 PolarHBondContact NE2-OD1 2.8Å; Q200-N832 WeakPolarHBondContact O-CA 3.3Å; Q200-L833 PolarHBondContact O-N 3.2Å; Q200-Q834 HydrophobicContact CG-CB 4.44Å
201	F	92.8	Very high	92.6	Very high	62 Å²	62	54.5 Å²	54.5	27%	0.272	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	122.3	-170.3	-59.2	-73.1	0	0	0	111.8	G822 V826 A830 Y831 N832	F201-G822 PolarHBondContact O-N 2.88Å; F201-V826 HydrophobicContact CB-CG2 4.47Å; F201-V826 HydrophobicContact CD1-CG1 4.09Å; F201-V826 HydrophobicContact CD1-CG2 4.34Å; F201-V826 HydrophobicContact CD2-CG2 3.64Å; F201-V826 HydrophobicContact CE1-CG1 4.32Å; F201-V826 HydrophobicContact CE2-CG2 3.89Å; F201-V826 HydrophobicContact CG-CG1 4.34Å; F201-V826 HydrophobicContact CG-CG2 3.89Å; F201-V826 HydrophobicContact CZ-CG2 4.34Å; F201-A830 HydrophobicContact CB-CB 4.38Å; F201-A830 HydrophobicContact CD1-CB 4.41Å; F201-Y831 WeakPolarHBondContact CA-O 3.45Å; F201-N832 HydrophobicContact CD1-CB 4.19Å; F201-N832 HydrophobicContact CE1-CB 4.01Å
202	Y	94.4	Very high	91.9	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.008	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	152.9	171.3	-58.9	-108.6	0	0	0	111.1	P199 L806 L819 K820 A821 A830 Y831 L833	P199-Y202 HydrophobicContact CB-CE2 4.16Å; P199-Y202 WeakPolarHBondContact O-CE2 3.16Å; Y202-L806 HydrophobicContact CD1-CB 3.94Å; Y202-L806 HydrophobicContact CE1-CB 3.72Å; Y202-L806 HydrophobicContact CG-CB 4.49Å; Y202-L819 HydrophobicContact CD1-CB 4.25Å; Y202-L819 HydrophobicContact CG-CB 4.28Å; Y202-K820 CarbonylContact C-O 3.51Å; Y202-K820 VanDerWaalsContact CA-O 3.3Å; Y202-K820 WeakPolarHBondContact CA-O 3.5Å; Y202-A821 HydrophobicContact CD1-CB 4.03Å; Y202-A821 HydrophobicContact CE1-CB 3.98Å; Y202-A830 CarbonylContact O-C 3.5Å; Y202-A830 WeakPolarHBondContact O-CA 3.36Å; Y202-Y831 PolarHBondContact N-O 2.93Å; Y202-Y831 PolarHBondContact O-N 3.15Å; Y202-L833 HydrophobicContact CD2-CB 4.4Å; Y202-L833 HydrophobicContact CE2-CB 4.08Å; Y202-L833 HydrophobicContact CE2-CD2 3.93Å
203	Q	93.9	Very high	91.2	Very high	75 Å²	75	57.4 Å²	57.4	35%	0.35	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	148.9	175.3	-61.1	178.2	18.2	0	0	109.3	H205 L819 K820 S827 A830	Q203-H205 PolarHBondContact O-N 3.34Å; Q203-L819 CarbonylContact O-C 3.57Å; Q203-L819 VanDerWaalsContact O-CA 3.26Å; Q203-L819 WeakPolarHBondContact O-CA 3.41Å; Q203-K820 PolarHBondContact N-O 2.97Å; Q203-K820 PolarHBondContact O-N 2.91Å; Q203-S827 PolarHBondContact NE2-OG 3.07Å; Q203-A830 HydrophobicContact CG-CB 4.46Å
204	I	94.2	Very high	90.9	Very high	126 Å²	126	58.2 Å²	58.2	65%	0.646	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.7	125.7	178.9	-59.4	172.4	0	0	0	109.2	T817 L819	I204-T817 HydrophobicContact CG1-CG2 4.18Å; I204-T817 HydrophobicContact CG2-CG2 3.96Å; I204-L819 HydrophobicContact CB-CD2 4.24Å; I204-L819 HydrophobicContact CG1-CD2 3.66Å
205	H	93.9	Very high	91	Very high	86 Å²	86	62.2 Å²	62.2	40%	0.398	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-49.4	178.2	-179.6	59.8	0	0	0	111.4	Q203 L800 L818 K820	Q203-H205 PolarHBondContact O-N 3.34Å; H205-L800 VanDerWaalsContact CD2-CD2 3.5Å; H205-L800 WeakPolarHBondContact CD2-CD2 3.46Å; H205-L800 WeakPolarHBondContact NE2-CD2 3.47Å; H205-L818 WeakPolarHBondContact CB-O 3.3Å; H205-L818 PolarHBondContact N-O 2.94Å; H205-K820 HydrophobicContact CB-CB 4.09Å
206	E	94.7	Very high	91	Very high	69 Å²	69	64.7 Å²	64.7	32%	0.322	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	154.2	176.7	179.1	169.8	-159.3	0	0	110.5	K796 L818	E206-K796 VanDerWaalsContact CD-NZ 3.3Å; E206-K796 IonicContact OE1-NZ 2.59Å; E206-K796 PolarHBondContact OE1-NZ 2.88Å; E206-K796 IonicContact OE2-NZ 3.31Å; E206-K796 PolarHBondContact OE2-NZ 3.33Å; E206-L818 HydrophobicContact CB-CB 4.43Å; E206-L818 HydrophobicContact CB-CD1 4.4Å; E206-L818 PolarHBondContact N-O 3.43Å; E206-L818 PolarHBondContact O-N 3.34Å
207	V	95.6	Very high	91	Very high	81 Å²	81	63.3 Å²	63.3	49%	0.491	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.7	162.8	179.6	0	0	0	0	108.2	F815 V816 T817	V207-F815 HydrophobicContact CG1-CB 4.2Å; V207-F815 HydrophobicContact CG1-CD2 3.56Å; V207-F815 HydrophobicContact CG1-CE2 4.21Å; V207-F815 HydrophobicContact CG1-CG 4.06Å; V207-V816 WeakPolarHBondContact CA-O 3.22Å; V207-T817 HydrophobicContact CG2-CG2 4.19Å
208	T	94.2	Very high	90.9	Very high	4 Å²	4	62.8 Å²	62.8	3%	0.025	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.3	-173.1	-79.2	0	0	0	0	110	L793 K796 F815 V816	T208-L793 HydrophobicContact CG2-CD2 4.35Å; T208-K796 HydrophobicContact CG2-CD 4.17Å; T208-K796 HydrophobicContact CG2-CG 3.95Å; T208-F815 CarbonylContact O-C 3.51Å; T208-F815 VanDerWaalsContact O-CA 3.29Å; T208-F815 WeakPolarHBondContact O-CA 3.35Å; T208-F815 WeakPolarHBondContact O-CB 3.25Å; T208-V816 PolarHBondContact N-O 3Å; T208-V816 PolarHBondContact O-N 2.76Å
209	S	93.8	Very high	91	Very high	46 Å²	46	62.2 Å²	62.2	32%	0.322	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	139.6	175.2	178.5	0	0	0	0	111.4	T211 G212 H792 A814	S209-T211 PolarHBondContact O-N 3.12Å; S209-T211 PolarHBondContact OG-N 3.2Å; S209-G212 PolarHBondContact O-N 2.91Å; S209-H792 PolarHBondContact O-CD2 3.07Å; S209-H792 PolarHBondContact O-NE2 2.95Å; S209-A814 WeakPolarHBondContact CA-O 3.4Å; S209-A814 PolarHBondContact OG-O 3.08Å; S209-A814 VanDerWaalsContact OG-O 3.05Å
210	L	91.9	Very high	91	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-36.5	172.5	-75	171.7	0	0	0	111.6	F306 W310 I789 L793 A814 V816	L210-F306 HydrophobicContact CB-CE1 4.39Å; L210-F306 HydrophobicContact CD1-CD1 3.48Å; L210-F306 VanDerWaalsContact CD1-CD1 3.48Å; L210-F306 HydrophobicContact CD1-CE1 3.57Å; L210-F306 HydrophobicContact CD1-CG 4.23Å; L210-F306 HydrophobicContact CD1-CZ 4.38Å; L210-W310 HydrophobicContact CD2-CZ2 4.24Å; L210-I789 HydrophobicContact CB-CG2 4.31Å; L210-I789 HydrophobicContact CD2-CG2 3.95Å; L210-L793 HydrophobicContact CD2-CD1 4Å; L210-A814 PolarHBondContact N-O 3.49Å; L210-V816 HydrophobicContact CD2-CG1 3.52Å; L210-V816 HydrophobicContact CG-CG1 4.07Å
211	T	87.8	Confident	91.1	Very high	87 Å²	87	59.7 Å²	59.7	53%	0.534	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	23.4	-176.6	59.7	0	0	0	0	113	S209 G213 F306 I789	S209-T211 PolarHBondContact O-N 3.12Å; S209-T211 PolarHBondContact OG-N 3.2Å; T211-G213 PolarHBondContact O-N 3.17Å; T211-F306 HydrophobicContact CG2-CZ 4.41Å; T211-I789 HydrophobicContact CG2-CD1 4.38Å; T211-I789 HydrophobicContact CG2-CG1 4.31Å
212	G	79.7	Confident	91.1	Very high	48 Å²	48	59 Å²	59	50%	0.495	36%	0.36	S	S	.	.			trans	-74.6	6	-177.9	0	0	0	0	0	115.9	S209 H792	S209-G212 PolarHBondContact O-N 2.91Å; G212-H792 PolarHBondContact O-CE1 2.86Å; G212-H792 VanDerWaalsContact O-CE1 3.22Å
213	G	79.6	Confident	91.1	Very high	34 Å²	34	62.5 Å²	62.5	35%	0.351	38%	0.376	S	S	.	.	S	Bend	trans	-96.9	156.8	-177.8	0	0	0	0	0	113.7	T211 F215 H792	T211-G213 PolarHBondContact O-N 3.17Å; G213-F215 PolarHBondContact O-N 3.26Å; G213-H792 WeakPolarHBondContact CA-ND1 3.41Å; G213-H792 PolarHBondContact N-ND1 2.87Å
214	T	85.3	Confident	91	Very high	129 Å²	129	60.1 Å²	60.1	79%	0.791	37%	0.365	S	S	*	.			trans	-65.6	111.8	169.1	49.3	0	0	0	0	110	N216 N788	T214-N216 PolarHBondContact O-N 2.75Å; T214-N216 VanDerWaalsContact O-N 3.12Å; T214-N788 PolarHBondContact O-OD1 3.04Å
215	F	90.4	Very high	90.9	Very high	120 Å²	120	55.1 Å²	55.1	53%	0.526	34%	0.338	S	S	.	.			trans	-66.3	111.3	-176.8	-177.5	-99.4	0	0	0	112.2	G213 P217 N788	G213-F215 PolarHBondContact O-N 3.26Å; F215-P217 HydrophobicContact CE1-CB 3.95Å; F215-N788 WeakPolarHBondContact CA-OD1 3.36Å; F215-N788 HydrophobicContact CD2-CB 3.98Å; F215-N788 HydrophobicContact CE2-CB 4.36Å
216	N	91.3	Very high	90.9	Very high	53 Å²	53	53.8 Å²	53.8	28%	0.283	33%	0.332	S	S	.	.			trans	-103.9	108.9	174.1	178.4	1.8	0	0	0	110	T214 G218 L219 Q686 N788	T214-N216 PolarHBondContact O-N 2.75Å; T214-N216 VanDerWaalsContact O-N 3.12Å; N216-G218 VanDerWaalsContact C-N 3.26Å; N216-G218 PolarHBondContact O-N 3.18Å; N216-G218 WeakPolarHBondContact OD1-CA 3.38Å; N216-G218 PolarHBondContact OD1-N 3.49Å; N216-L219 HydrophobicContact CB-CB 4.15Å; N216-L219 VanDerWaalsContact O-CB 3.29Å; N216-L219 WeakPolarHBondContact O-CB 3.42Å; N216-L219 PolarHBondContact O-N 2.91Å; N216-L219 PolarHBondContact OD1-N 3.32Å; N216-Q686 PolarHBondContact ND2-OE1 3.2Å; N216-Q686 VanDerWaalsContact ND2-OE1 3.15Å; N216-N788 PolarHBondContact N-OD1 3.04Å; N216-N788 PolarHBondContact O-ND2 2.71Å
217	P	89.4	Confident	90.8	Very high	98 Å²	98	51 Å²	51	64%	0.636	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-19.6	178.6	28.8	-34.7	0	0	0	113.6	F215 L219	F215-P217 HydrophobicContact CE1-CB 3.95Å; P217-L219 VanDerWaalsContact C-N 3.34Å
218	G	89.9	Confident	90.8	Very high	56 Å²	56	47.6 Å²	47.6	58%	0.577	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	4.8	176.6	0	0	0	0	0	114.3	N216 A220	N216-G218 VanDerWaalsContact C-N 3.26Å; N216-G218 PolarHBondContact O-N 3.18Å; N216-G218 WeakPolarHBondContact OD1-CA 3.38Å; N216-G218 PolarHBondContact OD1-N 3.49Å; G218-A220 PolarHBondContact O-N 3.29Å
219	L	92.8	Very high	90.7	Very high	11 Å²	11	47.8 Å²	47.8	6%	0.058	30%	0.3	C	S	.	.			trans	-66.4	128.4	176.7	-176.3	64.3	0	0	0	110.6	N216 P217 L685 Q686 L787 N788 H791	N216-L219 HydrophobicContact CB-CB 4.15Å; N216-L219 VanDerWaalsContact O-CB 3.29Å; N216-L219 WeakPolarHBondContact O-CB 3.42Å; N216-L219 PolarHBondContact O-N 2.91Å; N216-L219 PolarHBondContact OD1-N 3.32Å; P217-L219 VanDerWaalsContact C-N 3.34Å; L219-L685 HydrophobicContact CD1-CD1 3.74Å; L219-L685 HydrophobicContact CD1-CG 4.24Å; L219-L685 HydrophobicContact CD2-CD1 4.37Å; L219-L685 HydrophobicContact CG-CD1 3.96Å; L219-Q686 HydrophobicContact CD1-CB 3.72Å; L219-L787 HydrophobicContact CD2-CB 3.98Å; L219-L787 VanDerWaalsContact CD2-O 3.29Å; L219-L787 WeakPolarHBondContact CD2-O 3.36Å; L219-L787 HydrophobicContact CG-CB 4.21Å; L219-L787 WeakPolarHBondContact O-CD1 3.32Å; L219-N788 HydrophobicContact CD2-CB 4.41Å; L219-H791 HydrophobicContact CD2-CB 3.76Å
220	A	93.4	Very high	90.8	Very high	40 Å²	40	45.7 Å²	45.7	33%	0.331	29%	0.286	S	S	.	.			trans	-135.5	149.8	178.3	0	0	0	0	0	110.2	G218	G218-A220 PolarHBondContact O-N 3.29Å
221	L	94.3	Very high	90.8	Very high	27 Å²	27	46 Å²	46	14%	0.141	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	102.1	164.9	-175.1	70.1	0	0	0	107.5	L295 Y683 L685 L787	L221-L295 HydrophobicContact CD2-CD2 4.4Å; L221-Y683 HydrophobicContact CD1-CD1 4.4Å; L221-Y683 HydrophobicContact CD1-CG 4.07Å; L221-Y683 HydrophobicContact CD2-CD1 4.21Å; L221-Y683 HydrophobicContact CD2-CG 4.42Å; L221-Y683 HydrophobicContact CG-CD1 3.88Å; L221-Y683 HydrophobicContact CG-CG 4.06Å; L221-L685 HydrophobicContact CD1-CB 4.32Å; L221-L685 HydrophobicContact CD1-CD1 4.48Å; L221-L787 HydrophobicContact CB-CD2 3.95Å
222	T	93.3	Very high	91.2	Very high	46 Å²	46	44.4 Å²	44.4	28%	0.282	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	122.4	-176.8	23.2	0	0	0	0	111.1	E224 Y683 S684	T222-E224 PolarHBondContact O-N 2.87Å; T222-Y683 CarbonylContact O-C 3.48Å; T222-Y683 WeakPolarHBondContact O-CA 3.38Å; T222-Y683 WeakPolarHBondContact O-CB 3.38Å; T222-S684 PolarHBondContact N-O 3.16Å; T222-S684 PolarHBondContact O-N 2.97Å; T222-S684 PolarHBondContact O-OG 2.93Å; T222-S684 PolarHBondContact OG1-O 3.06Å; T222-S684 PolarHBondContact OG1-OG 3.11Å
223	F	93.6	Very high	91.9	Very high	77 Å²	77	42.2 Å²	42.2	34%	0.338	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	123.5	172.5	172.8	-96.5	0	0	0	110.5	K225 Q226 E373 K681 Y683	F223-K225 VanDerWaalsContact CE2-C 3.45Å; F223-K225 VanDerWaalsContact CZ-C 3.45Å; F223-Q226 HydrophobicContact CE2-CB 4.15Å; F223-Q226 HydrophobicContact CZ-CB 3.96Å; F223-Q226 VanDerWaalsContact CZ-N 3.25Å; F223-E373 HydrophobicContact CD1-CG 4.04Å; F223-E373 HydrophobicContact CD2-CG 4.46Å; F223-E373 HydrophobicContact CE1-CG 3.83Å; F223-E373 HydrophobicContact CE2-CG 4.27Å; F223-E373 HydrophobicContact CG-CG 4.34Å; F223-E373 HydrophobicContact CZ-CG 3.93Å; F223-K681 HydrophobicContact CD2-CD 4.2Å; F223-K681 HydrophobicContact CE2-CB 4.34Å; F223-K681 HydrophobicContact CE2-CD 3.81Å; F223-K681 HydrophobicContact CE2-CG 4.02Å; F223-Y683 HydrophobicContact CB-CD1 4.05Å; F223-Y683 HydrophobicContact CB-CE1 3.99Å; F223-Y683 AromaticContact CD2-CE1 3.98Å; F223-Y683 HydrophobicContact CD2-CE1 3.98Å
224	E	92.1	Very high	92.6	Very high	25 Å²	25	44.1 Å²	44.1	12%	0.117	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-50.8	175	-64	-74.5	179	0	0	110.3	T222 Q661 L682 S684	T222-E224 PolarHBondContact O-N 2.87Å; E224-Q661 PolarHBondContact O-NE2 2.97Å; E224-L682 PolarHBondContact N-O 2.88Å; E224-S684 WeakPolarHBondContact OE1-CB 3.46Å; E224-S684 PolarHBondContact OE1-OG 2.98Å
225	K	92.4	Very high	92.9	Very high	20 Å²	20	39.3 Å²	39.3	9%	0.087	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	143.3	-171.8	-164.3	180	175.9	-168.2	0	113.2	F223 L227 Y284 L656 L660 C663 L682	F223-K225 VanDerWaalsContact CE2-C 3.45Å; F223-K225 VanDerWaalsContact CZ-C 3.45Å; K225-L227 HydrophobicContact CB-CD2 3.97Å; K225-L227 HydrophobicContact CD-CD2 3.68Å; K225-L227 HydrophobicContact CG-CD2 3.88Å; K225-Y284 HydrophobicContact CD-CE1 4.28Å; K225-Y284 PolarHBondContact NZ-OH 3.32Å; K225-L656 HydrophobicContact CD-CD2 4.24Å; K225-L660 PolarHBondContact NZ-O 3.25Å; K225-C663 WeakPolarHBondContact CE-O 3.4Å; K225-C663 PolarHBondContact NZ-O 3.12Å; K225-L682 HydrophobicContact CB-CB 4.48Å; K225-L682 PolarHBondContact N-O 2.81Å; K225-L682 PolarHBondContact O-N 2.79Å
226	Q	93.8	Very high	92.9	Very high	58 Å²	58	33.7 Å²	33.7	27%	0.271	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	119.6	161	-175.3	173.9	-78.8	0	0	107.4	F223 T372 K681	F223-Q226 HydrophobicContact CE2-CB 4.15Å; F223-Q226 HydrophobicContact CZ-CB 3.96Å; F223-Q226 VanDerWaalsContact CZ-N 3.25Å; Q226-T372 PolarHBondContact OE1-OG1 3.23Å; Q226-K681 HydrophobicContact CB-CG 4.2Å; Q226-K681 HydrophobicContact CG-CG 4.06Å
227	L	93.3	Very high	92.7	Very high	12 Å²	12	35.4 Å²	35.4	6%	0.063	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-47.6	-172.1	-51	-176.3	0	0	0	111.4	K225 L280 Y284 E665 Y680 L682 M691	K225-L227 HydrophobicContact CB-CD2 3.97Å; K225-L227 HydrophobicContact CD-CD2 3.68Å; K225-L227 HydrophobicContact CG-CD2 3.88Å; L227-L280 HydrophobicContact CB-CD2 4.03Å; L227-L280 HydrophobicContact CD1-CD2 4.28Å; L227-Y284 HydrophobicContact CD1-CD2 3.87Å; L227-Y284 HydrophobicContact CD1-CE2 4.22Å; L227-Y284 HydrophobicContact CD1-CG 4.15Å; L227-Y284 HydrophobicContact CD2-CD1 4.04Å; L227-Y284 HydrophobicContact CD2-CD2 4.29Å; L227-Y284 HydrophobicContact CD2-CE1 3.8Å; L227-Y284 HydrophobicContact CD2-CE2 4.06Å; L227-Y284 HydrophobicContact CD2-CG 4.3Å; L227-E665 VanDerWaalsContact O-CG 3.26Å; L227-E665 WeakPolarHBondContact O-CG 3.11Å; L227-Y680 PolarHBondContact N-O 2.7Å; L227-L682 HydrophobicContact CD1-CB 4.25Å; L227-L682 HydrophobicContact CD1-CD1 4.49Å; L227-L682 HydrophobicContact CD2-CB 4.04Å; L227-L682 HydrophobicContact CD2-CD2 4.27Å; L227-L682 HydrophobicContact CG-CB 4.2Å; L227-M691 HydrophobicContact CD1-CG 4.28Å; L227-M691 HydrophobicContact CD1-SD 3.55Å; L227-M691 VanDerWaalsContact CD1-SD 3.55Å
228	L	93.9	Very high	92.1	Very high	9 Å²	9	35.9 Å²	35.9	5%	0.047	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	141	-172	-179.4	64.4	0	0	0	109.5	M230 L280 E667 Y670 L679 Y680	L228-M230 HydrophobicContact CD1-CG 3.8Å; L228-M230 HydrophobicContact CD1-SD 4.02Å; L228-M230 HydrophobicContact CD2-CE 3.69Å; L228-M230 HydrophobicContact CD2-CG 4.43Å; L228-M230 HydrophobicContact CD2-SD 4.02Å; L228-M230 HydrophobicContact CG-CE 4.19Å; L228-M230 HydrophobicContact CG-CG 3.94Å; L228-M230 HydrophobicContact CG-SD 4.16Å; L228-L280 HydrophobicContact CB-CD1 4.27Å; L228-L280 HydrophobicContact CD2-CD1 4.21Å; L228-E667 HydrophobicContact CD1-CG 4.35Å; L228-Y670 HydrophobicContact CD1-CD2 4Å; L228-Y670 HydrophobicContact CD1-CG 4.24Å; L228-Y670 HydrophobicContact CD2-CD1 3.54Å; L228-Y670 HydrophobicContact CD2-CD2 3.93Å; L228-Y670 HydrophobicContact CD2-CE1 4.07Å; L228-Y670 HydrophobicContact CD2-CE2 4.43Å; L228-Y670 HydrophobicContact CD2-CG 3.46Å; L228-Y670 VanDerWaalsContact CD2-CG 3.46Å; L228-L679 WeakPolarHBondContact O-CA 3.47Å; L228-Y680 HydrophobicContact CB-CD2 3.93Å; L228-Y680 HydrophobicContact CB-CG 4.5Å; L228-Y680 HydrophobicContact CD2-CD2 3.93Å; L228-Y680 HydrophobicContact CD2-CE2 4.07Å; L228-Y680 HydrophobicContact CG-CD2 4.14Å; L228-Y680 PolarHBondContact O-N 3.4Å
229	A	93.8	Very high	91.6	Very high	7 Å²	7	42 Å²	42	6%	0.058	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	91.6	-177.3	0	0	0	0	0	111.8	V367 L678 L679	A229-V367 HydrophobicContact CB-CG1 4.41Å; A229-L678 CarbonylContact C-O 3.51Å; A229-L678 WeakPolarHBondContact CA-O 3.36Å; A229-L679 HydrophobicContact CB-CD2 4.2Å; A229-L679 HydrophobicContact CB-CG 4.25Å
230	M	94.3	Very high	91.2	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	161.5	-170.2	-62	-175.3	-62.1	0	0	113.1	L228 E671 A672 N677 L678 Y680	L228-M230 HydrophobicContact CD1-CG 3.8Å; L228-M230 HydrophobicContact CD1-SD 4.02Å; L228-M230 HydrophobicContact CD2-CE 3.69Å; L228-M230 HydrophobicContact CD2-CG 4.43Å; L228-M230 HydrophobicContact CD2-SD 4.02Å; L228-M230 HydrophobicContact CG-CE 4.19Å; L228-M230 HydrophobicContact CG-CG 3.94Å; L228-M230 HydrophobicContact CG-SD 4.16Å; M230-E671 VanDerWaalsContact CE-O 3.24Å; M230-E671 WeakPolarHBondContact CE-O 3.25Å; M230-A672 HydrophobicContact CB-CB 4.35Å; M230-A672 HydrophobicContact SD-CB 4.22Å; M230-N677 VanDerWaalsContact O-CA 3.23Å; M230-N677 WeakPolarHBondContact O-CA 3.45Å; M230-N677 WeakPolarHBondContact O-CB 3.48Å; M230-L678 PolarHBondContact N-O 2.96Å; M230-L678 PolarHBondContact O-N 3.34Å; M230-Y680 HydrophobicContact CE-CE2 4.45Å
231	G	93.8	Very high	90.7	Very high	7 Å²	7	40 Å²	40	7%	0.072	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	86.7	-159.9	176.4	0	0	0	0	0	114.1	K366 V367 G676	G231-K366 WeakPolarHBondContact O-CA 3.29Å; G231-K366 WeakPolarHBondContact O-CD 3.41Å; G231-V367 PolarHBondContact O-N 2.85Å; G231-G676 CarbonylContact C-O 3.59Å; G231-G676 WeakPolarHBondContact CA-O 3.36Å
232	T	94.5	Very high	89.9	Confident	53 Å²	53	42.4 Å²	42.4	33%	0.325	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	155.1	-175.8	49.1	0	0	0	0	113.3	K365 K366 G676 N677	T232-K365 CarbonylContact C-O 3.59Å; T232-K365 WeakPolarHBondContact CA-O 3.42Å; T232-K365 WeakPolarHBondContact CB-O 3.28Å; T232-K366 HydrophobicContact CG2-CD 4.04Å; T232-G676 PolarHBondContact N-O 3.49Å; T232-G676 CarbonylContact O-C 3.58Å; T232-N677 WeakPolarHBondContact O-CB 3.3Å; T232-N677 PolarHBondContact O-ND2 3.24Å
233	V	94.6	Very high	89	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	143.6	177.2	58.5	0	0	0	0	109.5	S364 K365 V367 L370 V696 T699	V233-S364 CarbonylContact O-C 3.33Å; V233-S364 WeakPolarHBondContact O-CA 3.3Å; V233-S364 VanDerWaalsContact O-CB 3.29Å; V233-S364 WeakPolarHBondContact O-CB 3.38Å; V233-K365 PolarHBondContact N-O 2.7Å; V233-K365 PolarHBondContact O-N 3.29Å; V233-V367 HydrophobicContact CB-CG2 3.84Å; V233-V367 HydrophobicContact CG1-CG2 3.9Å; V233-L370 HydrophobicContact CG1-CD1 4.13Å; V233-L370 HydrophobicContact CG1-CD2 4.01Å; V233-L370 HydrophobicContact CG1-CG 4.21Å; V233-V696 HydrophobicContact CG2-CG1 4.06Å; V233-V696 WeakPolarHBondContact CG2-O 3.45Å; V233-T699 HydrophobicContact CG1-CG2 3.8Å; V233-T699 HydrophobicContact CG2-CG2 4.01Å
234	N	94	Very high	88.4	Confident	74 Å²	74	45.6 Å²	45.6	40%	0.396	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	133.5	178.7	-69.2	-22.5	0	0	0	111.2	T361 L698 T699	N234-T361 HydrophobicContact CB-CG2 3.8Å; N234-L698 HydrophobicContact CB-CD2 4.26Å; N234-L698 WeakPolarHBondContact O-CA 3.29Å; N234-T699 PolarHBondContact O-N 3.21Å
235	I	92.6	Very high	88.2	Confident	29 Å²	29	45.2 Å²	45.2	15%	0.149	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	137.8	176.8	-55	170.2	0	0	0	108.2	T361 N362 G363 K365 T699	I235-T361 CarbonylContact O-C 3.56Å; I235-T361 VanDerWaalsContact O-CA 3.28Å; I235-T361 WeakPolarHBondContact O-CA 3.34Å; I235-N362 HydrophobicContact CG2-CB 4.41Å; I235-N362 PolarHBondContact O-N 2.73Å; I235-G363 PolarHBondContact N-O 2.84Å; I235-K365 HydrophobicContact CD1-CB 4.24Å; I235-K365 HydrophobicContact CG1-CB 4.33Å; I235-T699 CarbonylContact C-O 3.52Å; I235-T699 WeakPolarHBondContact CA-O 3.05Å; I235-T699 HydrophobicContact CB-CG2 4.48Å; I235-T699 HydrophobicContact CG1-CG2 4.06Å
236	T	90.9	Very high	88.3	Confident	1 Å²	1	49 Å²	49	1%	0.006	27%	0.266	C	S	.	.			trans	-144.9	168.2	173.4	-168.6	0	0	0	0	110.9	M240 V360 L698 T699 H700	T236-M240 HydrophobicContact CG2-CB 4.03Å; T236-M240 HydrophobicContact CG2-CE 3.66Å; T236-M240 HydrophobicContact CG2-SD 4.31Å; T236-M240 WeakPolarHBondContact OG1-CB 3.17Å; T236-V360 WeakPolarHBondContact CB-O 3.39Å; T236-V360 PolarHBondContact OG1-O 3Å; T236-L698 HydrophobicContact CG2-CB 4.32Å; T236-L698 HydrophobicContact CG2-CD2 4.25Å; T236-T699 PolarHBondContact N-O 2.73Å; T236-H700 WeakPolarHBondContact O-CA 3.31Å; T236-H700 WeakPolarHBondContact O-CB 3.31Å
237	D	85.5	Confident	88.2	Confident	90 Å²	90	46.3 Å²	46.3	48%	0.481	25%	0.253	S	S	.	.			trans	-100.5	168.5	-179.1	-68.8	-29.6	0	0	0	111.9	K239 M240 N362	D237-K239 PolarHBondContact O-N 3.19Å; D237-M240 WeakPolarHBondContact O-CB 3.45Å; D237-M240 WeakPolarHBondContact O-CE 3.48Å; D237-M240 PolarHBondContact O-N 2.68Å; D237-N362 PolarHBondContact OD1-ND2 2.93Å; D237-N362 VanDerWaalsContact OD1-ND2 3.15Å; D237-N362 PolarHBondContact OD2-ND2 3.23Å
238	H	77.9	Confident	88	Confident	108 Å²	108	46.8 Å²	46.8	50%	0.5	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-7.9	173.7	-57.9	-57.6	0	0	0	114.7	H700 Y752	H238-H700 AromaticContact CE1-CD2 3.44Å; H238-H700 PolarHBondContact CE1-CD2 3.19Å; H238-H700 VanDerWaalsContact CE1-CD2 3.44Å; H238-H700 AromaticContact CE1-CE1 3.7Å; H238-H700 AromaticContact CE1-CG 3.79Å; H238-H700 AromaticContact CE1-ND1 3.94Å; H238-H700 AromaticContact CE1-NE2 3.36Å; H238-H700 PolarHBondContact CE1-NE2 2.61Å; H238-H700 AromaticContact ND1-CD2 3.16Å; H238-H700 PolarHBondContact ND1-CD2 3.4Å; H238-H700 AromaticContact ND1-CG 3.88Å; H238-H700 AromaticContact ND1-NE2 3.32Å; H238-H700 PolarHBondContact ND1-NE2 2.93Å; H238-Y752 PolarHBondContact ND1-OH 2.74Å
239	K	79.3	Confident	87.5	Confident	185 Å²	185	49.3 Å²	49.3	80%	0.804	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	35.1	173.4	-63.1	-171.1	178.2	-174.8	0	112.2	D237 V241	D237-K239 PolarHBondContact O-N 3.19Å; K239-V241 PolarHBondContact O-N 2.82Å
240	M	84.2	Confident	87.3	Confident	1 Å²	1	52 Å²	52	1%	0.005	29%	0.291	C	S	.	.	S	Bend	trans	-48.9	-30	-175.1	54.2	-174.3	72.4	0	0	116.4	T236 D237 I359 V360 V714 V716 Y752 L766	T236-M240 HydrophobicContact CG2-CB 4.03Å; T236-M240 HydrophobicContact CG2-CE 3.66Å; T236-M240 HydrophobicContact CG2-SD 4.31Å; T236-M240 WeakPolarHBondContact OG1-CB 3.17Å; D237-M240 WeakPolarHBondContact O-CB 3.45Å; D237-M240 WeakPolarHBondContact O-CE 3.48Å; D237-M240 PolarHBondContact O-N 2.68Å; M240-I359 HydrophobicContact CB-CG2 4.2Å; M240-I359 WeakPolarHBondContact O-CA 3.43Å; M240-V360 PolarHBondContact O-N 2.6Å; M240-V714 HydrophobicContact CE-CB 4.46Å; M240-V714 HydrophobicContact CE-CG1 3.6Å; M240-V714 HydrophobicContact CE-CG2 4.47Å; M240-V714 HydrophobicContact SD-CG1 4.27Å; M240-V716 HydrophobicContact SD-CG2 3.58Å; M240-V716 VanDerWaalsContact SD-CG2 3.58Å; M240-Y752 HydrophobicContact CE-CD2 4.49Å; M240-Y752 HydrophobicContact CE-CE2 4.18Å; M240-L766 HydrophobicContact CG-CD2 3.47Å; M240-L766 VanDerWaalsContact CG-CD2 3.47Å; M240-L766 HydrophobicContact SD-CD2 4.42Å
241	V	83.6	Confident	87.2	Confident	7 Å²	7	53.7 Å²	53.7	4%	0.042	30%	0.297	C	S	.	.	S	Bend	trans	-132.1	132	171.1	-169.7	0	0	0	0	108.8	K239 A245 L355 I359 V763 L766	K239-V241 PolarHBondContact O-N 2.82Å; V241-A245 HydrophobicContact CG1-CB 3.72Å; V241-L355 HydrophobicContact CG2-CD1 4.06Å; V241-I359 HydrophobicContact CG2-CB 4.47Å; V241-I359 HydrophobicContact CG2-CD1 4.44Å; V241-I359 HydrophobicContact CG2-CG1 3.46Å; V241-I359 VanDerWaalsContact CG2-CG1 3.46Å; V241-V763 HydrophobicContact CG1-CB 4.26Å; V241-V763 HydrophobicContact CG1-CG1 4.31Å; V241-V763 HydrophobicContact CG1-CG2 3.9Å; V241-L766 HydrophobicContact CB-CD2 4.38Å
242	P	77.7	Confident	87.2	Confident	77 Å²	77	60 Å²	60	50%	0.5	33%	0.325	S	S	.	.			trans	-62.3	153.4	171.9	-22	33.1	0	0	0	112.9	A245	P242-A245 HydrophobicContact CB-CB 4.23Å; P242-A245 VanDerWaalsContact O-CB 3.26Å; P242-A245 WeakPolarHBondContact O-CB 3.33Å; P242-A245 PolarHBondContact O-N 2.81Å
243	A	72.8	Confident	87.2	Confident	74 Å²	74	60.2 Å²	60.2	61%	0.612	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	146.4	162.7	0	0	0	0	0	109.9	A245	A243-A245 PolarHBondContact O-N 2.72Å; A243-A245 VanDerWaalsContact O-N 3.13Å
244	D	82.2	Confident	87.2	Confident	116 Å²	116	60.2 Å²	60.2	62%	0.62	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	15.1	-174.2	-61.1	-60.7	0	0	0	115	Q246 V763	D244-Q246 PolarHBondContact O-N 2.73Å; D244-V763 WeakPolarHBondContact CA-O 3.36Å; D244-V763 PolarHBondContact N-O 3.2Å
245	A	87.6	Confident	87.2	Confident	18 Å²	18	57.4 Å²	57.4	15%	0.149	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	124.1	172.4	0	0	0	0	0	110.4	V241 P242 A243 L247 K762 V763	V241-A245 HydrophobicContact CG1-CB 3.72Å; P242-A245 HydrophobicContact CB-CB 4.23Å; P242-A245 VanDerWaalsContact O-CB 3.26Å; P242-A245 WeakPolarHBondContact O-CB 3.33Å; P242-A245 PolarHBondContact O-N 2.81Å; A243-A245 PolarHBondContact O-N 2.72Å; A243-A245 VanDerWaalsContact O-N 3.13Å; A245-L247 PolarHBondContact O-N 2.92Å; A245-K762 WeakPolarHBondContact O-CA 3.42Å; A245-V763 HydrophobicContact CB-CB 4.43Å; A245-V763 HydrophobicContact CB-CG2 4.46Å; A245-V763 PolarHBondContact O-N 2.95Å
246	Q	93.8	Very high	87.3	Confident	99 Å²	99	61 Å²	61	46%	0.463	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	113.3	172.5	-176.8	61.7	63.4	0	0	108.7	D244 T760 S761 K762	D244-Q246 PolarHBondContact O-N 2.73Å; Q246-T760 PolarHBondContact NE2-O 3.04Å; Q246-T760 PolarHBondContact OE1-O 3.09Å; Q246-S761 PolarHBondContact NE2-O 3.35Å; Q246-K762 VanDerWaalsContact OE1-CG 3.32Å
247	L	92.5	Very high	87.3	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	36%	0.362	C	S	.	.			trans	-71.1	151.5	169.6	-54.3	179.6	0	0	0	109.2	A245 S249 S354 L355 S358 I756 S761 V763	A245-L247 PolarHBondContact O-N 2.92Å; L247-S249 PolarHBondContact O-N 3.35Å; L247-S354 WeakPolarHBondContact CB-OG 3.43Å; L247-L355 HydrophobicContact CD2-CD1 4.08Å; L247-S358 VanDerWaalsContact CD2-CB 3.48Å; L247-S358 WeakPolarHBondContact CD2-OG 3.39Å; L247-I756 HydrophobicContact CD1-CD1 3.76Å; L247-I756 HydrophobicContact CD1-CG1 3.98Å; L247-I756 HydrophobicContact CD1-CG2 3.78Å; L247-S761 WeakPolarHBondContact CB-O 3.4Å; L247-S761 VanDerWaalsContact CG-O 3.23Å; L247-S761 WeakPolarHBondContact CG-O 3.46Å; L247-S761 PolarHBondContact N-O 2.82Å; L247-V763 HydrophobicContact CD1-CG2 4.09Å; L247-V763 HydrophobicContact CD2-CG2 3.52Å; L247-V763 HydrophobicContact CG-CG2 3.83Å
248	A	88.1	Confident	87.7	Confident	23 Å²	23	60.1 Å²	60.1	19%	0.19	35%	0.345	C	S	.	.			trans	-59.6	127.6	174.9	0	0	0	0	0	110.6	V254 Y350 S354	A248-V254 HydrophobicContact CB-CG2 4Å; A248-Y350 PolarHBondContact O-OH 3Å; A248-S354 WeakPolarHBondContact CA-OG 3.16Å; A248-S354 PolarHBondContact N-OG 2.95Å; A248-S354 PolarHBondContact O-OG 3.27Å
249	S	83.8	Confident	88.6	Confident	62 Å²	62	57.5 Å²	57.5	43%	0.434	34%	0.337	S	S	.	.			trans	-112.7	-4.6	-177.4	55.4	0	0	0	0	113.3	L247 Y350	L247-S249 PolarHBondContact O-N 3.35Å; S249-Y350 WeakPolarHBondContact CA-OH 3.12Å; S249-Y350 PolarHBondContact O-OH 2.78Å
250	D	89	Confident	89.4	Confident	63 Å²	63	49 Å²	49	34%	0.337	30%	0.301	S	S	.	.	S	Bend	trans	-89	147.3	173.2	66.4	-67.1	0	0	0	111.8	H252 S253 Y350	D250-H252 VanDerWaalsContact C-N 3.35Å; D250-S253 VanDerWaalsContact CG-OG 3.28Å; D250-S253 PolarHBondContact OD1-OG 3.12Å; D250-S253 VanDerWaalsContact OD2-CB 3.25Å; D250-S253 WeakPolarHBondContact OD2-CB 3.47Å; D250-S253 PolarHBondContact OD2-N 3.35Å; D250-S253 PolarHBondContact OD2-OG 3.36Å; D250-Y350 VanDerWaalsContact C-OH 3.28Å; D250-Y350 PolarHBondContact N-OH 2.97Å; D250-Y350 PolarHBondContact O-OH 2.84Å
251	Y	93.4	Very high	90	Very high	37 Å²	37	51.9 Å²	51.9	15%	0.145	33%	0.325	C	S	.	.	H	α-helix	trans	-63.3	-40.9	176.9	166.4	-86.8	0	0	0	111.8	Q182 Y183 E186 V254 S255	Q182-Y251 HydrophobicContact CB-CD2 4.06Å; Q182-Y251 HydrophobicContact CB-CE2 4.49Å; Q182-Y251 HydrophobicContact CG-CD2 3.82Å; Q182-Y251 HydrophobicContact CG-CE2 3.83Å; Y183-Y251 HydrophobicContact CD2-CE2 4.48Å; E186-Y251 PolarHBondContact OE1-OH 2.64Å; E186-Y251 WeakPolarHBondContact OE2-CE2 3.46Å; E186-Y251 VanDerWaalsContact OE2-CZ 3.31Å; E186-Y251 PolarHBondContact OE2-OH 2.95Å; Y251-V254 PolarHBondContact O-N 2.83Å; Y251-S255 VanDerWaalsContact CZ-CB 3.49Å; Y251-S255 VanDerWaalsContact CZ-OG 3.29Å; Y251-S255 WeakPolarHBondContact O-CB 3.43Å; Y251-S255 PolarHBondContact O-N 2.86Å; Y251-S255 PolarHBondContact OH-OG 2.84Å
252	H	94.1	Very high	90.5	Very high	139 Å²	139	53.8 Å²	53.8	64%	0.644	33%	0.333	S	S	*	.	H	α-helix	trans	-65.3	-47.3	-168.7	-67.4	-63.7	0	0	0	113.2	D250 V254 S255 S256	D250-H252 VanDerWaalsContact C-N 3.35Å; H252-V254 VanDerWaalsContact C-N 3.33Å; H252-V254 PolarHBondContact O-N 2.81Å; H252-S255 PolarHBondContact O-N 2.87Å; H252-S256 WeakPolarHBondContact O-CB 3.36Å; H252-S256 PolarHBondContact O-N 3.45Å; H252-S256 PolarHBondContact O-OG 3.36Å
253	S	93.2	Very high	91.3	Very high	59 Å²	59	50.9 Å²	50.9	41%	0.413	31%	0.312	S	S	.	.	H	α-helix	trans	-61.4	-42.6	179.8	-56.1	0	0	0	0	111.7	D250 A257 L357	D250-S253 VanDerWaalsContact CG-OG 3.28Å; D250-S253 PolarHBondContact OD1-OG 3.12Å; D250-S253 VanDerWaalsContact OD2-CB 3.25Å; D250-S253 WeakPolarHBondContact OD2-CB 3.47Å; D250-S253 PolarHBondContact OD2-N 3.35Å; D250-S253 PolarHBondContact OD2-OG 3.36Å; S253-A257 PolarHBondContact O-N 3.36Å; S253-L357 WeakPolarHBondContact O-CD1 3.33Å
254	V	94.2	Very high	92.4	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	28%	0.284	C	S	.	.	H	α-helix	trans	-70.7	-47.4	179.6	-175.9	0	0	0	0	111.2	Y183 A248 Y251 H252 S256 A257 N258 Y350 E353 L357	Y183-V254 HydrophobicContact CD2-CG1 4.06Å; Y183-V254 HydrophobicContact CE2-CG1 3.81Å; A248-V254 HydrophobicContact CB-CG2 4Å; Y251-V254 PolarHBondContact O-N 2.83Å; H252-V254 VanDerWaalsContact C-N 3.33Å; H252-V254 PolarHBondContact O-N 2.81Å; V254-S256 PolarHBondContact O-N 3.02Å; V254-A257 PolarHBondContact O-N 3.35Å; V254-N258 PolarHBondContact O-N 3.31Å; V254-Y350 HydrophobicContact CB-CD2 4.5Å; V254-Y350 HydrophobicContact CB-CE2 3.78Å; V254-Y350 HydrophobicContact CG1-CD2 4.15Å; V254-Y350 HydrophobicContact CG1-CE2 3.92Å; V254-Y350 HydrophobicContact CG2-CE2 3.66Å; V254-Y350 WeakPolarHBondContact CG2-OH 3.48Å; V254-E353 HydrophobicContact CG1-CB 3.64Å; V254-L357 HydrophobicContact CB-CD1 4.46Å; V254-L357 HydrophobicContact CG2-CD1 4.2Å
255	S	95.1	Very high	93	Very high	15 Å²	15	49 Å²	49	11%	0.105	29%	0.288	C	S	.	.	H	α-helix	trans	-66.5	-34.9	179.9	-170.7	0	0	0	0	112.8	Y251 H252 A257 N258 P259 P260	Y251-S255 VanDerWaalsContact CZ-CB 3.49Å; Y251-S255 VanDerWaalsContact CZ-OG 3.29Å; Y251-S255 WeakPolarHBondContact O-CB 3.43Å; Y251-S255 PolarHBondContact O-N 2.86Å; Y251-S255 PolarHBondContact OH-OG 2.84Å; H252-S255 PolarHBondContact O-N 2.87Å; S255-A257 VanDerWaalsContact C-N 3.3Å; S255-A257 PolarHBondContact O-N 3.32Å; S255-N258 CarbonylContact O-C 3.3Å; S255-P259 VanDerWaalsContact O-CA 3.25Å; S255-P259 WeakPolarHBondContact O-CA 3.48Å; S255-P259 WeakPolarHBondContact O-CD 3.24Å; S255-P259 VanDerWaalsContact O-CG 3.3Å; S255-P259 WeakPolarHBondContact O-CG 3.48Å; S255-P259 VanDerWaalsContact O-N 3.11Å; S255-P260 WeakPolarHBondContact OG-CD 3.28Å
256	S	94.1	Very high	93.2	Very high	105 Å²	105	52.8 Å²	52.8	73%	0.734	31%	0.306	S	S	*	.	H	α-helix	trans	-67.9	-25.5	175.8	-71.2	0	0	0	0	114.1	H252 V254	H252-S256 WeakPolarHBondContact O-CB 3.36Å; H252-S256 PolarHBondContact O-N 3.45Å; H252-S256 PolarHBondContact O-OG 3.36Å; V254-S256 PolarHBondContact O-N 3.02Å
257	A	91.9	Very high	93.1	Very high	50 Å²	50	51.3 Å²	51.3	41%	0.413	30%	0.298	S	S	.	.	H	α-helix	trans	-94.1	-39.7	-179.7	0	0	0	0	0	113	S253 V254 S255 L357	S253-A257 PolarHBondContact O-N 3.36Å; V254-A257 PolarHBondContact O-N 3.35Å; S255-A257 VanDerWaalsContact C-N 3.3Å; S255-A257 PolarHBondContact O-N 3.32Å; A257-L357 HydrophobicContact CB-CD1 3.95Å; A257-L357 HydrophobicContact CB-CD2 3.54Å; A257-L357 HydrophobicContact CB-CG 3.91Å
258	N	93.8	Very high	93	Very high	23 Å²	23	52.2 Å²	52.2	12%	0.123	30%	0.302	C	S	.	.	S	Bend	trans	-138.6	92.6	169.5	-166.7	9	0	0	0	110.6	Y183 V254 S255 E353	Y183-N258 WeakPolarHBondContact CE2-O 3.39Å; Y183-N258 PolarHBondContact OH-O 3.11Å; V254-N258 PolarHBondContact O-N 3.31Å; S255-N258 CarbonylContact O-C 3.3Å; N258-E353 PolarHBondContact ND2-OE2 3.09Å
259	P	96.1	Very high	93.2	Very high	52 Å²	52	53 Å²	53	34%	0.338	31%	0.309	S	S	.	.			trans	-56.4	141.4	-179.5	-26.6	33.4	0	0	0	112.2	S255 A261 K262 K263	S255-P259 VanDerWaalsContact O-CA 3.25Å; S255-P259 WeakPolarHBondContact O-CA 3.48Å; S255-P259 WeakPolarHBondContact O-CD 3.24Å; S255-P259 VanDerWaalsContact O-CG 3.3Å; S255-P259 WeakPolarHBondContact O-CG 3.48Å; S255-P259 VanDerWaalsContact O-N 3.11Å; P259-A261 PolarHBondContact O-N 3.33Å; P259-A261 VanDerWaalsContact O-N 3.12Å; P259-K262 HydrophobicContact CB-CB 4.35Å; P259-K262 WeakPolarHBondContact O-CB 3.44Å; P259-K262 PolarHBondContact O-N 3.05Å; P259-K263 PolarHBondContact O-N 2.96Å
260	P	96.7	Very high	93.6	Very high	6 Å²	6	54 Å²	54	4%	0.039	30%	0.303	C	S	.	.	H	α-helix	trans	-51.8	-37.8	179.6	-30.4	36	0	0	0	114.5	Y183 E186 F187 S255 A264	Y183-P260 HydrophobicContact CD2-CG 3.64Å; Y183-P260 HydrophobicContact CE1-CG 4.47Å; Y183-P260 HydrophobicContact CE2-CG 3.61Å; Y183-P260 HydrophobicContact CG-CG 4.08Å; E186-P260 HydrophobicContact CB-CB 3.7Å; E186-P260 HydrophobicContact CB-CG 3.91Å; F187-P260 HydrophobicContact CB-CB 3.95Å; S255-P260 WeakPolarHBondContact OG-CD 3.28Å; P260-A264 WeakPolarHBondContact O-CB 3.49Å; P260-A264 PolarHBondContact O-N 2.78Å
261	A	96.1	Very high	93.9	Very high	63 Å²	63	51 Å²	51	52%	0.521	29%	0.287	S	S	.	.	H	α-helix	trans	-65.7	-43.2	176.2	0	0	0	0	0	112.8	A190 P259 A264 E265	A190-A261 HydrophobicContact CB-CB 4.33Å; P259-A261 PolarHBondContact O-N 3.33Å; P259-A261 VanDerWaalsContact O-N 3.12Å; A261-A264 WeakPolarHBondContact O-CB 3.46Å; A261-A264 PolarHBondContact O-N 3.01Å; A261-E265 PolarHBondContact O-N 3.24Å
262	K	94.9	Very high	93.9	Very high	47 Å²	47	49.8 Å²	49.8	20%	0.204	28%	0.284	C	S	.	.	H	α-helix	trans	-63.5	-46.5	175.1	177.2	-175.3	163.4	-171.8	0	110.8	P259 A264 E265 D266 E675	P259-K262 HydrophobicContact CB-CB 4.35Å; P259-K262 WeakPolarHBondContact O-CB 3.44Å; P259-K262 PolarHBondContact O-N 3.05Å; K262-A264 PolarHBondContact O-N 3.27Å; K262-E265 PolarHBondContact O-N 2.91Å; K262-E265 VanDerWaalsContact O-N 3.1Å; K262-D266 WeakPolarHBondContact CE-OD2 3.44Å; K262-D266 PolarHBondContact O-N 2.66Å; K262-E675 IonicContact NZ-OE1 2.69Å; K262-E675 PolarHBondContact NZ-OE1 3.29Å; K262-E675 IonicContact NZ-OE2 3.63Å; K262-E675 PolarHBondContact NZ-OE2 2.93Å
263	K	94.9	Very high	93.8	Very high	15 Å²	15	46.8 Å²	46.8	7%	0.065	28%	0.278	C	S	.	.	H	α-helix	trans	-58.7	-34.3	176	-174	175.3	174	157.7	0	112.2	Y183 F187 P259 K267 I349 E352 E353	Y183-K263 HydrophobicContact CE1-CD 4.25Å; F187-K263 HydrophobicContact CD2-CB 4.06Å; F187-K263 HydrophobicContact CD2-CD 4.25Å; F187-K263 HydrophobicContact CD2-CG 4.01Å; F187-K263 HydrophobicContact CE2-CB 4.16Å; F187-K263 HydrophobicContact CE2-CD 4.15Å; F187-K263 HydrophobicContact CE2-CG 3.72Å; P259-K263 PolarHBondContact O-N 2.96Å; K263-K267 VanDerWaalsContact O-CB 3.24Å; K263-K267 WeakPolarHBondContact O-CB 3.34Å; K263-K267 PolarHBondContact O-N 2.95Å; K263-I349 PolarHBondContact NZ-O 2.89Å; K263-E352 IonicContact NZ-OE2 3.68Å; K263-E352 PolarHBondContact NZ-OE2 2.86Å; K263-E353 HydrophobicContact CD-CG 3.77Å; K263-E353 WeakPolarHBondContact CE-OE1 3.34Å; K263-E353 IonicContact NZ-OE1 3.44Å; K263-E353 PolarHBondContact NZ-OE1 3.5Å
264	A	95.4	Very high	93.9	Very high	3 Å²	3	44.8 Å²	44.8	3%	0.025	26%	0.263	C	S	.	.	H	α-helix	trans	-71	-43.5	174.2	0	0	0	0	0	112.4	F187 A190 P260 A261 K262 K267 H268	F187-A264 HydrophobicContact CD2-CB 4.05Å; F187-A264 HydrophobicContact CE2-CB 4.12Å; A190-A264 HydrophobicContact CB-CB 3.53Å; P260-A264 WeakPolarHBondContact O-CB 3.49Å; P260-A264 PolarHBondContact O-N 2.78Å; A261-A264 WeakPolarHBondContact O-CB 3.46Å; A261-A264 PolarHBondContact O-N 3.01Å; K262-A264 PolarHBondContact O-N 3.27Å; A264-K267 PolarHBondContact O-N 2.94Å; A264-H268 WeakPolarHBondContact O-CB 3.12Å; A264-H268 PolarHBondContact O-CD2 3.13Å; A264-H268 PolarHBondContact O-N 2.93Å
265	E	93.4	Very high	93.9	Very high	147 Å²	147	46.7 Å²	46.7	69%	0.687	28%	0.283	S	S	*	.	H	α-helix	trans	-60.9	-51.7	175.5	-175.4	171	-160.3	0	0	111.8	A261 K262 K267 H268 A269	A261-E265 PolarHBondContact O-N 3.24Å; K262-E265 PolarHBondContact O-N 2.91Å; K262-E265 VanDerWaalsContact O-N 3.1Å; E265-K267 VanDerWaalsContact C-N 3.27Å; E265-K267 PolarHBondContact O-N 2.97Å; E265-H268 CarbonylContact O-C 3.54Å; E265-H268 PolarHBondContact O-N 2.79Å; E265-A269 WeakPolarHBondContact O-CA 3.48Å; E265-A269 WeakPolarHBondContact O-CB 3.41Å; E265-A269 PolarHBondContact O-N 2.88Å
266	D	92.2	Very high	93.9	Very high	99 Å²	99	46.6 Å²	46.6	53%	0.529	28%	0.281	S	S	.	.	H	α-helix	trans	-55.7	-41.4	177.7	-75.5	-30.7	0	0	0	112	K262 A269	K262-D266 WeakPolarHBondContact CE-OD2 3.44Å; K262-D266 PolarHBondContact O-N 2.66Å; D266-A269 WeakPolarHBondContact O-CB 3.43Å
267	K	91.6	Very high	93.9	Very high	68 Å²	68	41.6 Å²	41.6	30%	0.296	25%	0.246	S	C	.	.	H	α-helix	trans	-72.8	-41.3	-179	-175.1	178.2	-175.9	176.5	0	113	F187 K263 A264 E265 S334	F187-K267 HydrophobicContact CE2-CD 4.39Å; F187-K267 HydrophobicContact CZ-CD 3.83Å; K263-K267 VanDerWaalsContact O-CB 3.24Å; K263-K267 WeakPolarHBondContact O-CB 3.34Å; K263-K267 PolarHBondContact O-N 2.95Å; A264-K267 PolarHBondContact O-N 2.94Å; E265-K267 VanDerWaalsContact C-N 3.27Å; E265-K267 PolarHBondContact O-N 2.97Å; K267-S334 WeakPolarHBondContact O-CB 3.35Å; K267-S334 PolarHBondContact O-OG 3.49Å
268	H	91.4	Very high	94	Very high	20 Å²	20	43.2 Å²	43.2	9%	0.093	25%	0.245	C	C	.	.	H	α-helix	trans	-95.6	8	-178.4	-67.1	-69.4	0	0	0	113.6	A264 E265 R270 P335	A264-H268 WeakPolarHBondContact O-CB 3.12Å; A264-H268 PolarHBondContact O-CD2 3.13Å; A264-H268 PolarHBondContact O-N 2.93Å; E265-H268 CarbonylContact O-C 3.54Å; E265-H268 PolarHBondContact O-N 2.79Å; H268-R270 PolarHBondContact O-N 2.8Å; H268-P335 PolarHBondContact CE1-O 3.27Å; H268-P335 VanDerWaalsContact CE1-O 3.24Å
269	A	92.3	Very high	93.9	Very high	40 Å²	40	46.8 Å²	46.8	33%	0.331	26%	0.259	S	S	.	.			trans	-52.5	104.7	170.3	0	0	0	0	0	110	E265 D266 R693	E265-A269 WeakPolarHBondContact O-CA 3.48Å; E265-A269 WeakPolarHBondContact O-CB 3.41Å; E265-A269 PolarHBondContact O-N 2.88Å; D266-A269 WeakPolarHBondContact O-CB 3.43Å; A269-R693 PolarHBondContact O-NH2 2.88Å
270	R	92.3	Very high	93.8	Very high	83 Å²	83	44.3 Å²	44.3	31%	0.313	24%	0.243	S	C	.	.			trans	-66.2	149.2	-175.7	-68.7	-170.5	-63.2	-146.2	-5	111.4	S197 H268 D333 R693	S197-R270 PolarHBondContact O-NH1 2.86Å; S197-R270 PolarHBondContact OG-NH1 3.3Å; H268-R270 PolarHBondContact O-N 2.8Å; R270-D333 WeakPolarHBondContact CA-OD1 3.24Å; R270-D333 VanDerWaalsContact CB-OD1 3.32Å; R270-D333 WeakPolarHBondContact CB-OD1 3.42Å; R270-D333 WeakPolarHBondContact CD-OD2 3.43Å; R270-D333 HydrophobicContact CG-CB 4.29Å; R270-R693 PolarHBondContact O-NH1 2.74Å
271	I	95.1	Very high	93.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.242	C	C	.	.	S	Bend	trans	-96	-21.6	167.2	-159	170.4	0	0	0	110.9	S273 D274 A277 C289 L290 T291 Y331 I332 D333 R693	I271-S273 PolarHBondContact O-N 2.83Å; I271-D274 HydrophobicContact CG1-CB 4.45Å; I271-D274 PolarHBondContact O-N 3.08Å; I271-A277 HydrophobicContact CD1-CB 4.47Å; I271-A277 HydrophobicContact CG1-CB 3.76Å; I271-C289 WeakPolarHBondContact CD1-SG 3.36Å; I271-L290 WeakPolarHBondContact CD1-O 3.32Å; I271-T291 HydrophobicContact CB-CG2 3.93Å; I271-T291 HydrophobicContact CG2-CG2 4.09Å; I271-Y331 WeakPolarHBondContact O-CD1 3.48Å; I271-I332 WeakPolarHBondContact CG2-O 3.29Å; I271-D333 PolarHBondContact N-OD1 2.65Å; I271-R693 HydrophobicContact CD1-CB 3.56Å; I271-R693 HydrophobicContact CG1-CB 4.45Å
272	S	93.3	Very high	93.3	Very high	11 Å²	11	44.2 Å²	44.2	8%	0.077	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-24	173.9	63.2	0	0	0	0	114.3	K317 D333	S272-K317 PolarHBondContact O-NZ 3.02Å; S272-D333 VanDerWaalsContact CB-OD2 3.29Å; S272-D333 WeakPolarHBondContact CB-OD2 3.34Å; S272-D333 PolarHBondContact N-OD1 2.79Å; S272-D333 VanDerWaalsContact OG-CG 3.29Å; S272-D333 PolarHBondContact OG-OD1 3.48Å; S272-D333 PolarHBondContact OG-OD2 2.94Å
273	S	92.5	Very high	93.1	Very high	75 Å²	75	46.2 Å²	46.2	52%	0.524	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	20.2	176	65.6	0	0	0	0	113.6	I271	I271-S273 PolarHBondContact O-N 2.83Å
274	D	94.2	Very high	92.9	Very high	18 Å²	18	45.6 Å²	45.6	10%	0.096	25%	0.247	C	C	.	.			trans	-89.9	113.8	-180	-179.9	-30.5	0	0	0	110.2	I271 N276 A277 E278 Y680 R693	I271-D274 HydrophobicContact CG1-CB 4.45Å; I271-D274 PolarHBondContact O-N 3.08Å; D274-N276 VanDerWaalsContact C-N 3.27Å; D274-N276 PolarHBondContact O-N 2.79Å; D274-N276 WeakPolarHBondContact OD1-CA 3.28Å; D274-N276 WeakPolarHBondContact OD1-CB 3.49Å; D274-N276 PolarHBondContact OD1-N 3.25Å; D274-A277 HydrophobicContact CB-CB 3.74Å; D274-A277 PolarHBondContact O-N 2.86Å; D274-A277 PolarHBondContact OD1-N 2.84Å; D274-E278 PolarHBondContact O-N 3.12Å; D274-Y680 PolarHBondContact OD1-OH 3.01Å; D274-Y680 PolarHBondContact OD2-OH 2.88Å; D274-R693 WeakPolarHBondContact OD2-CD 3.27Å; D274-R693 IonicContact OD2-CZ 2.79Å; D274-R693 IonicContact OD2-NE 3.67Å; D274-R693 IonicContact OD2-NH1 3.68Å; D274-R693 PolarHBondContact OD2-NH1 3.39Å
275	G	93.9	Very high	92.7	Very high	41 Å²	41	48.8 Å²	48.8	42%	0.423	26%	0.261	S	S	.	.	H	α-helix	trans	-67.4	-24.1	-176.5	0	0	0	0	0	114.2	K279	G275-K279 VanDerWaalsContact O-CG 3.3Å; G275-K279 WeakPolarHBondContact O-CG 3.28Å; G275-K279 PolarHBondContact O-N 3.34Å
276	N	95.1	Very high	92.7	Very high	12 Å²	12	41.8 Å²	41.8	6%	0.064	23%	0.229	C	C	.	.	H	α-helix	trans	-78.2	-42.9	173.7	-62.5	-46.4	0	0	0	110.1	D274 E278 K279 L280 Y670 E671 Y680	D274-N276 VanDerWaalsContact C-N 3.27Å; D274-N276 PolarHBondContact O-N 2.79Å; D274-N276 WeakPolarHBondContact OD1-CA 3.28Å; D274-N276 WeakPolarHBondContact OD1-CB 3.49Å; D274-N276 PolarHBondContact OD1-N 3.25Å; N276-E278 VanDerWaalsContact C-N 3.32Å; N276-E278 PolarHBondContact O-N 3.06Å; N276-K279 PolarHBondContact O-N 3.43Å; N276-L280 WeakPolarHBondContact O-CG 3.46Å; N276-L280 PolarHBondContact O-N 3.03Å; N276-Y670 HydrophobicContact CB-CD1 3.94Å; N276-Y670 WeakPolarHBondContact OD1-CB 3.31Å; N276-Y670 WeakPolarHBondContact OD1-CD1 3.48Å; N276-E671 PolarHBondContact ND2-O 2.68Å; N276-E671 PolarHBondContact OD1-N 3.46Å; N276-Y680 HydrophobicContact CB-CE2 4.39Å
277	A	94.8	Very high	92.9	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.2	-39.5	173.5	0	0	0	0	0	112	I271 D274 L280 C281 Y680 M691	I271-A277 HydrophobicContact CD1-CB 4.47Å; I271-A277 HydrophobicContact CG1-CB 3.76Å; D274-A277 HydrophobicContact CB-CB 3.74Å; D274-A277 PolarHBondContact O-N 2.86Å; D274-A277 PolarHBondContact OD1-N 2.84Å; A277-L280 PolarHBondContact O-N 3.42Å; A277-C281 VanDerWaalsContact O-CB 3.29Å; A277-C281 WeakPolarHBondContact O-CB 3.37Å; A277-C281 PolarHBondContact O-N 2.93Å; A277-C281 PolarHBondContact O-SG 2.84Å; A277-Y680 HydrophobicContact CB-CE1 4.09Å; A277-M691 HydrophobicContact CB-CE 4.19Å
278	E	93.7	Very high	93.2	Very high	85 Å²	85	37.2 Å²	37.2	40%	0.397	21%	0.205	S	C	.	.	H	α-helix	trans	-66.1	-43.1	178.6	-176.3	153.4	-113.2	0	0	112.6	D274 N276 C281 A282 K317	D274-E278 PolarHBondContact O-N 3.12Å; N276-E278 VanDerWaalsContact C-N 3.32Å; N276-E278 PolarHBondContact O-N 3.06Å; E278-C281 PolarHBondContact O-N 2.88Å; E278-A282 WeakPolarHBondContact O-CB 3.43Å; E278-A282 PolarHBondContact O-N 3.46Å; E278-K317 IonicContact OE1-NZ 2.64Å; E278-K317 PolarHBondContact OE1-NZ 3.21Å; E278-K317 IonicContact OE2-NZ 3.89Å
279	K	93	Very high	93.5	Very high	98 Å²	98	36.3 Å²	36.3	43%	0.426	20%	0.201	S	C	.	.	H	α-helix	trans	-57.1	-51.5	171.1	-74.9	168.7	-177.3	174.4	0	111.6	G275 N276 C281 A282 Y283 D669 Y670	G275-K279 VanDerWaalsContact O-CG 3.3Å; G275-K279 WeakPolarHBondContact O-CG 3.28Å; G275-K279 PolarHBondContact O-N 3.34Å; N276-K279 PolarHBondContact O-N 3.43Å; K279-C281 PolarHBondContact O-N 3.23Å; K279-A282 PolarHBondContact O-N 3.07Å; K279-Y283 PolarHBondContact O-N 3.01Å; K279-D669 PolarHBondContact NZ-O 2.92Å; K279-Y670 HydrophobicContact CB-CE1 3.72Å; K279-Y670 HydrophobicContact CD-CD1 3.98Å; K279-Y670 HydrophobicContact CD-CE1 3.86Å; K279-Y670 HydrophobicContact CG-CE1 4.47Å
280	L	93.3	Very high	93.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.1	-41.5	179.4	-71.6	170.5	0	0	0	111.8	L227 L228 N276 A277 A282 Y283 Y284 E665 Y670 Y680 M691	L227-L280 HydrophobicContact CB-CD2 4.03Å; L227-L280 HydrophobicContact CD1-CD2 4.28Å; L228-L280 HydrophobicContact CB-CD1 4.27Å; L228-L280 HydrophobicContact CD2-CD1 4.21Å; N276-L280 WeakPolarHBondContact O-CG 3.46Å; N276-L280 PolarHBondContact O-N 3.03Å; A277-L280 PolarHBondContact O-N 3.42Å; L280-A282 VanDerWaalsContact C-N 3.34Å; L280-A282 PolarHBondContact O-N 2.93Å; L280-Y283 PolarHBondContact O-N 2.88Å; L280-Y284 HydrophobicContact CD2-CD2 4.06Å; L280-Y284 HydrophobicContact CD2-CE2 3.86Å; L280-Y284 WeakPolarHBondContact O-CB 3.45Å; L280-Y284 WeakPolarHBondContact O-CD2 3.32Å; L280-Y284 PolarHBondContact O-N 3.12Å; L280-E665 HydrophobicContact CD2-CG 4.12Å; L280-Y670 HydrophobicContact CD2-CE1 4.14Å; L280-Y670 WeakPolarHBondContact CD2-OH 3.41Å; L280-Y670 HydrophobicContact CG-CE1 3.89Å; L280-Y680 HydrophobicContact CD1-CD1 3.69Å; L280-Y680 HydrophobicContact CD1-CD2 4.01Å; L280-Y680 HydrophobicContact CD1-CE1 4.36Å; L280-Y680 HydrophobicContact CD1-CG 3.49Å; L280-Y680 VanDerWaalsContact CD1-CG 3.49Å; L280-M691 HydrophobicContact CB-CE 3.93Å; L280-M691 HydrophobicContact CB-SD 3.79Å; L280-M691 HydrophobicContact CD1-SD 4.15Å
281	C	92.6	Very high	94	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.02	17%	0.171	C	C	.	.	H	α-helix	trans	-61.9	-39.4	175	-76.7	0	0	0	0	112.7	A277 E278 K279 Y283 E285 P286 Y331 M691	A277-C281 VanDerWaalsContact O-CB 3.29Å; A277-C281 WeakPolarHBondContact O-CB 3.37Å; A277-C281 PolarHBondContact O-N 2.93Å; A277-C281 PolarHBondContact O-SG 2.84Å; E278-C281 PolarHBondContact O-N 2.88Å; K279-C281 PolarHBondContact O-N 3.23Å; C281-Y283 VanDerWaalsContact C-N 3.25Å; C281-Y283 PolarHBondContact O-N 2.88Å; C281-E285 WeakPolarHBondContact O-CA 3.24Å; C281-E285 PolarHBondContact O-N 2.99Å; C281-E285 VanDerWaalsContact O-N 3.08Å; C281-P286 HydrophobicContact CB-CG 4.25Å; C281-P286 WeakPolarHBondContact O-CD 3.37Å; C281-Y331 WeakPolarHBondContact CB-OH 3.38Å; C281-Y331 PolarHBondContact SG-OH 3.5Å; C281-Y331 VanDerWaalsContact SG-OH 3.33Å; C281-M691 VanDerWaalsContact SG-CE 3.52Å
282	A	90.1	Very high	94.1	Very high	63 Å²	63	32.6 Å²	32.6	52%	0.521	18%	0.178	S	C	.	.	H	α-helix	trans	-70	-19.7	177.9	0	0	0	0	0	113.7	E278 K279 L280	E278-A282 WeakPolarHBondContact O-CB 3.43Å; E278-A282 PolarHBondContact O-N 3.46Å; K279-A282 PolarHBondContact O-N 3.07Å; L280-A282 VanDerWaalsContact C-N 3.34Å; L280-A282 PolarHBondContact O-N 2.93Å
283	Y	89.3	Confident	94.2	Very high	89 Å²	89	34.1 Å²	34.1	35%	0.349	19%	0.186	S	C	.	.	H	α-helix	trans	-97.5	-44.7	178.3	-169.3	-87.5	0	0	0	113.3	K279 L280 C281 L660 C663	K279-Y283 PolarHBondContact O-N 3.01Å; L280-Y283 PolarHBondContact O-N 2.88Å; C281-Y283 VanDerWaalsContact C-N 3.25Å; C281-Y283 PolarHBondContact O-N 2.88Å; Y283-L660 HydrophobicContact CD1-CD2 3.73Å; Y283-L660 HydrophobicContact CE1-CD2 3.28Å; Y283-C663 PolarHBondContact OH-SG 3Å; Y283-C663 VanDerWaalsContact OH-SG 3.39Å
284	Y	90.9	Very high	94.5	Very high	3 Å²	3	30.6 Å²	30.6	1%	0.012	16%	0.161	C	C	.	.	H	α-helix	trans	-93.5	-7.8	-174.6	-71.4	-80.5	0	0	0	114.7	K225 L227 L280 P286 L656 L660 E665 L682	K225-Y284 HydrophobicContact CD-CE1 4.28Å; K225-Y284 PolarHBondContact NZ-OH 3.32Å; L227-Y284 HydrophobicContact CD1-CD2 3.87Å; L227-Y284 HydrophobicContact CD1-CE2 4.22Å; L227-Y284 HydrophobicContact CD1-CG 4.15Å; L227-Y284 HydrophobicContact CD2-CD1 4.04Å; L227-Y284 HydrophobicContact CD2-CD2 4.29Å; L227-Y284 HydrophobicContact CD2-CE1 3.8Å; L227-Y284 HydrophobicContact CD2-CE2 4.06Å; L227-Y284 HydrophobicContact CD2-CG 4.3Å; L280-Y284 HydrophobicContact CD2-CD2 4.06Å; L280-Y284 HydrophobicContact CD2-CE2 3.86Å; L280-Y284 WeakPolarHBondContact O-CB 3.45Å; L280-Y284 WeakPolarHBondContact O-CD2 3.32Å; L280-Y284 PolarHBondContact O-N 3.12Å; Y284-P286 VanDerWaalsContact C-CD 3.46Å; Y284-L656 HydrophobicContact CD1-CD1 4.07Å; Y284-L656 HydrophobicContact CD1-CD2 4.44Å; Y284-L660 HydrophobicContact CD1-CB 4.34Å; Y284-L660 HydrophobicContact CE1-CB 4.22Å; Y284-L660 HydrophobicContact CE1-CD2 4.46Å; Y284-E665 HydrophobicContact CE2-CG 4.45Å; Y284-E665 WeakPolarHBondContact CE2-OE1 3.42Å; Y284-E665 VanDerWaalsContact CZ-OE1 3.24Å; Y284-E665 PolarHBondContact OH-OE1 3.02Å; Y284-L682 HydrophobicContact CD1-CD2 4.35Å
285	E	91.3	Very high	94.7	Very high	69 Å²	69	29.8 Å²	29.8	32%	0.322	16%	0.157	S	C	.	.			trans	45.8	48	-179.1	-55.8	-168.7	146.9	0	0	115.2	C281 R327	C281-E285 WeakPolarHBondContact O-CA 3.24Å; C281-E285 PolarHBondContact O-N 2.99Å; C281-E285 VanDerWaalsContact O-N 3.08Å; E285-R327 HydrophobicContact CG-CG 4.46Å; E285-R327 WeakPolarHBondContact OE1-CG 3.11Å; E285-R327 IonicContact OE1-NE 3.2Å; E285-R327 PolarHBondContact OE1-NE 3.39Å; E285-R327 IonicContact OE2-CZ 3.16Å; E285-R327 IonicContact OE2-NE 2.8Å; E285-R327 PolarHBondContact OE2-NE 2.67Å; E285-R327 IonicContact OE2-NH2 2.71Å; E285-R327 PolarHBondContact OE2-NH2 3.25Å
286	P	94.6	Very high	94.8	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.006	14%	0.14	C	C	.	.			trans	-66.7	148	178	31.6	-35.1	0	0	0	111.5	C281 Y284 T329 L682 M691	C281-P286 HydrophobicContact CB-CG 4.25Å; C281-P286 WeakPolarHBondContact O-CD 3.37Å; Y284-P286 VanDerWaalsContact C-CD 3.46Å; P286-T329 HydrophobicContact CG-CG2 4.34Å; P286-T329 WeakPolarHBondContact O-CG2 3.31Å; P286-T329 PolarHBondContact O-OG1 3.49Å; P286-L682 HydrophobicContact CB-CD1 4.23Å; P286-M691 HydrophobicContact CB-CB 4.21Å; P286-M691 HydrophobicContact CG-CB 4.3Å
287	H	95.8	Very high	94.9	Very high	71 Å²	71	29.8 Å²	29.8	33%	0.329	15%	0.145	S	C	.	.	S	Bend	trans	-73.5	-37.7	177.3	-63.3	72.8	0	0	0	110.8	V330 L689 T798	H287-V330 PolarHBondContact O-N 2.99Å; H287-L689 PolarHBondContact N-O 2.81Å; H287-L689 WeakPolarHBondContact ND1-CB 3.27Å; H287-L689 PolarHBondContact ND1-N 3.33Å; H287-T798 HydrophobicContact CB-CG2 4.12Å
288	V	97.7	Very high	95	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	141.3	179.8	-173.2	0	0	0	0	109.9	L290 V330 I332 L689 V690 M691 L794 T798	V288-L290 HydrophobicContact CG1-CD2 3.94Å; V288-L290 HydrophobicContact CG1-CG 4.37Å; V288-V330 CarbonylContact C-O 3.47Å; V288-V330 WeakPolarHBondContact CA-O 3.39Å; V288-V330 HydrophobicContact CG1-CB 4.45Å; V288-V330 HydrophobicContact CG2-CB 4.32Å; V288-I332 HydrophobicContact CG1-CD1 3.87Å; V288-I332 HydrophobicContact CG1-CG1 4.16Å; V288-L689 PolarHBondContact N-O 2.96Å; V288-V690 HydrophobicContact CB-CG1 4.35Å; V288-V690 HydrophobicContact CB-CG2 4.41Å; V288-V690 CarbonylContact O-C 3.49Å; V288-V690 WeakPolarHBondContact O-CA 3.49Å; V288-M691 PolarHBondContact O-N 3.18Å; V288-L794 HydrophobicContact CG1-CD1 4.46Å; V288-L794 HydrophobicContact CG1-CD2 3.95Å; V288-L794 HydrophobicContact CG2-CB 4.3Å; V288-L794 HydrophobicContact CG2-CD1 4.31Å; V288-L794 HydrophobicContact CG2-CD2 4.3Å; V288-T798 HydrophobicContact CG2-CG2 3.89Å
289	C	97.7	Very high	95.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	122.6	175	-177.1	0	0	0	0	108.1	I271 T329 V330 Y331 I332 M691	I271-C289 WeakPolarHBondContact CD1-SG 3.36Å; C289-T329 HydrophobicContact CB-CG2 4.08Å; C289-V330 PolarHBondContact N-O 3.13Å; C289-Y331 HydrophobicContact CB-CD1 3.86Å; C289-Y331 HydrophobicContact CB-CE1 4.05Å; C289-Y331 HydrophobicContact CB-CG 4.38Å; C289-Y331 CarbonylContact O-C 3.51Å; C289-Y331 VanDerWaalsContact O-CA 3.25Å; C289-Y331 WeakPolarHBondContact O-CA 3.41Å; C289-I332 PolarHBondContact O-N 3.07Å; C289-M691 CarbonylContact C-O 3.56Å; C289-M691 WeakPolarHBondContact CA-O 3.42Å; C289-M691 HydrophobicContact CB-CE 4.43Å; C289-M691 WeakPolarHBondContact SG-CE 3.37Å
290	L	98.1	Very high	95.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	158.9	-172.1	57.5	73.2	0	0	0	114.3	I271 V288 A294 L295 L298 I332 V690 M691 V692 R693 L794	I271-L290 WeakPolarHBondContact CD1-O 3.32Å; V288-L290 HydrophobicContact CG1-CD2 3.94Å; V288-L290 HydrophobicContact CG1-CG 4.37Å; L290-A294 HydrophobicContact CB-CB 4.31Å; L290-L295 HydrophobicContact CD1-CB 3.7Å; L290-L295 HydrophobicContact CD1-CD1 4.32Å; L290-L295 HydrophobicContact CD1-CG 4.43Å; L290-L298 HydrophobicContact CD2-CD1 4.44Å; L290-I332 WeakPolarHBondContact CA-O 3.36Å; L290-I332 HydrophobicContact CB-CB 3.84Å; L290-I332 HydrophobicContact CB-CG1 4.35Å; L290-I332 HydrophobicContact CD2-CD1 4.19Å; L290-V690 HydrophobicContact CD2-CG1 4.05Å; L290-V690 HydrophobicContact CG-CG1 4.11Å; L290-M691 PolarHBondContact N-O 2.86Å; L290-V692 HydrophobicContact CD1-CB 4.29Å; L290-V692 HydrophobicContact CD1-CG1 4.02Å; L290-V692 HydrophobicContact CD1-CG2 3.82Å; L290-V692 WeakPolarHBondContact O-CA 3.19Å; L290-R693 PolarHBondContact O-N 2.8Å; L290-L794 HydrophobicContact CD2-CD2 4.33Å
291	T	97.5	Very high	95.2	Very high	4 Å²	4	22.5 Å²	22.5	3%	0.025	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	156.1	173.6	71.9	0	0	0	0	111.5	I271 D293 A294 L295 I332 S334	I271-T291 HydrophobicContact CB-CG2 3.93Å; I271-T291 HydrophobicContact CG2-CG2 4.09Å; T291-D293 PolarHBondContact O-N 3.06Å; T291-A294 WeakPolarHBondContact O-CB 3.29Å; T291-A294 PolarHBondContact O-N 2.96Å; T291-A294 VanDerWaalsContact O-N 3.13Å; T291-A294 PolarHBondContact OG1-N 2.8Å; T291-L295 PolarHBondContact O-N 3.17Å; T291-I332 PolarHBondContact N-O 3.4Å; T291-S334 WeakPolarHBondContact OG1-CA 3.26Å; T291-S334 PolarHBondContact OG1-OG 3.02Å
292	R	96.2	Very high	95	Very high	41 Å²	41	24.5 Å²	24.5	16%	0.155	12%	0.122	C	C	.	.	H	α-helix	trans	-49.4	-41.3	170.9	172.6	-86	-174.8	-156.6	0.7	112.3	L295 V296 R693 H715 E742 L745	R292-L295 WeakPolarHBondContact O-CB 3.47Å; R292-L295 PolarHBondContact O-N 3.5Å; R292-V296 WeakPolarHBondContact O-CG2 3.26Å; R292-V296 PolarHBondContact O-N 2.76Å; R292-R693 PolarHBondContact N-O 2.77Å; R292-H715 PolarHBondContact NH2-CE1 2.92Å; R292-H715 VanDerWaalsContact NH2-CE1 3.35Å; R292-E742 IonicContact CZ-OE1 2.7Å; R292-E742 IonicContact NE-OE1 3.22Å; R292-E742 PolarHBondContact NE-OE1 3.21Å; R292-E742 IonicContact NH2-OE1 2.7Å; R292-E742 PolarHBondContact NH2-OE1 3.19Å; R292-L745 HydrophobicContact CB-CD1 4.4Å; R292-L745 HydrophobicContact CG-CD1 3.94Å
293	D	96.6	Very high	94.7	Very high	44 Å²	44	23 Å²	23	24%	0.235	11%	0.112	C	C	.	.	H	α-helix	trans	-72.7	-35	-178.9	-70.8	-12.9	0	0	0	112.7	T291 L295 R297 P335	T291-D293 PolarHBondContact O-N 3.06Å; D293-L295 VanDerWaalsContact C-N 3.33Å; D293-R297 WeakPolarHBondContact O-CB 3.32Å; D293-R297 PolarHBondContact O-N 3.31Å; D293-P335 HydrophobicContact CB-CG 4.32Å
294	A	97.7	Very high	94.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.2	-40	169.6	0	0	0	0	0	111.5	L290 T291 R297 L298 L312 I332	L290-A294 HydrophobicContact CB-CB 4.31Å; T291-A294 WeakPolarHBondContact O-CB 3.29Å; T291-A294 PolarHBondContact O-N 2.96Å; T291-A294 VanDerWaalsContact O-N 3.13Å; T291-A294 PolarHBondContact OG1-N 2.8Å; A294-R297 PolarHBondContact O-N 3.35Å; A294-L298 WeakPolarHBondContact O-CB 3.37Å; A294-L298 VanDerWaalsContact O-CG 3.28Å; A294-L298 WeakPolarHBondContact O-CG 3.22Å; A294-L298 PolarHBondContact O-N 2.95Å; A294-L312 HydrophobicContact CB-CD2 3.95Å; A294-I332 HydrophobicContact CB-CB 4.4Å; A294-I332 HydrophobicContact CB-CG2 3.89Å
295	L	98	Very high	94.1	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-50.9	175.9	-173.1	60.2	0	0	0	112	L221 L290 T291 R292 D293 R297 L298 L299 V692 T741 L745 L790	L221-L295 HydrophobicContact CD2-CD2 4.4Å; L290-L295 HydrophobicContact CD1-CB 3.7Å; L290-L295 HydrophobicContact CD1-CD1 4.32Å; L290-L295 HydrophobicContact CD1-CG 4.43Å; T291-L295 PolarHBondContact O-N 3.17Å; R292-L295 WeakPolarHBondContact O-CB 3.47Å; R292-L295 PolarHBondContact O-N 3.5Å; D293-L295 VanDerWaalsContact C-N 3.33Å; L295-R297 VanDerWaalsContact C-N 3.33Å; L295-R297 PolarHBondContact O-N 2.66Å; L295-L298 PolarHBondContact O-N 2.98Å; L295-L299 HydrophobicContact CD1-CD1 3.96Å; L295-L299 HydrophobicContact CD1-CG 4.41Å; L295-L299 HydrophobicContact CD2-CD1 4.49Å; L295-L299 HydrophobicContact CG-CD1 3.76Å; L295-L299 WeakPolarHBondContact O-CG 2.99Å; L295-L299 PolarHBondContact O-N 3.44Å; L295-V692 HydrophobicContact CD2-CG1 4.36Å; L295-V692 HydrophobicContact CD2-CG2 4.2Å; L295-T741 HydrophobicContact CD2-CG2 3.97Å; L295-T741 HydrophobicContact CG-CG2 4.18Å; L295-L745 HydrophobicContact CD2-CD1 4.21Å; L295-L745 HydrophobicContact CD2-CD2 3.68Å; L295-L745 HydrophobicContact CD2-CG 4.15Å; L295-L790 HydrophobicContact CD1-CD1 4.06Å; L295-L790 HydrophobicContact CD1-CD2 3.67Å
296	V	97.1	Very high	94	Very high	13 Å²	13	27.4 Å²	27.4	8%	0.079	15%	0.149	C	C	.	.	H	α-helix	trans	-57.6	-47.1	178.1	172.8	0	0	0	0	110.1	R292 L298 L299 D300 Q738 T741	R292-V296 WeakPolarHBondContact O-CG2 3.26Å; R292-V296 PolarHBondContact O-N 2.76Å; V296-L298 VanDerWaalsContact C-N 3.31Å; V296-L298 PolarHBondContact O-N 3.36Å; V296-L299 PolarHBondContact O-N 3.24Å; V296-L299 VanDerWaalsContact O-N 3.12Å; V296-D300 WeakPolarHBondContact O-CB 3.44Å; V296-D300 PolarHBondContact O-N 3.16Å; V296-Q738 HydrophobicContact CG1-CB 4.45Å; V296-T741 HydrophobicContact CG2-CG2 3.73Å
297	R	96.9	Very high	93.6	Very high	41 Å²	41	29.4 Å²	29.4	16%	0.155	17%	0.17	C	C	.	.	H	α-helix	trans	-65.5	-28.8	-179.6	-176.4	59.4	69.8	71.3	-10.2	113.9	D293 A294 L295 N301 W310 L312 P335	D293-R297 WeakPolarHBondContact O-CB 3.32Å; D293-R297 PolarHBondContact O-N 3.31Å; A294-R297 PolarHBondContact O-N 3.35Å; L295-R297 VanDerWaalsContact C-N 3.33Å; L295-R297 PolarHBondContact O-N 2.66Å; R297-N301 PolarHBondContact O-ND2 2.9Å; R297-W310 HydrophobicContact CG-CB 4.07Å; R297-W310 HydrophobicContact CG-CD2 4.1Å; R297-W310 HydrophobicContact CG-CE3 4.44Å; R297-W310 HydrophobicContact CG-CG 4Å; R297-L312 HydrophobicContact CB-CD1 4.47Å; R297-L312 HydrophobicContact CG-CD1 4.18Å; R297-L312 HydrophobicContact CG-CG 4.44Å; R297-P335 HydrophobicContact CB-CB 4.41Å; R297-P335 HydrophobicContact CB-CG 4.19Å; R297-P335 HydrophobicContact CG-CB 4.16Å; R297-P335 HydrophobicContact CG-CG 4.45Å
298	L	96.8	Very high	93.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-77.9	-27.5	173.6	-70.8	169.1	0	0	0	112.7	L290 A294 L295 V296 N301 W310 L312 I332 L790 L793 L794	L290-L298 HydrophobicContact CD2-CD1 4.44Å; A294-L298 WeakPolarHBondContact O-CB 3.37Å; A294-L298 VanDerWaalsContact O-CG 3.28Å; A294-L298 WeakPolarHBondContact O-CG 3.22Å; A294-L298 PolarHBondContact O-N 2.95Å; L295-L298 PolarHBondContact O-N 2.98Å; V296-L298 VanDerWaalsContact C-N 3.31Å; V296-L298 PolarHBondContact O-N 3.36Å; L298-N301 PolarHBondContact O-ND2 2.79Å; L298-W310 HydrophobicContact CD2-CH2 4.04Å; L298-L312 HydrophobicContact CD1-CD1 4.44Å; L298-L312 HydrophobicContact CD2-CD1 3.67Å; L298-L312 HydrophobicContact CG-CD1 3.75Å; L298-I332 HydrophobicContact CD1-CD1 4.01Å; L298-L790 HydrophobicContact CB-CD1 3.59Å; L298-L790 HydrophobicContact CD1-CD1 3.87Å; L298-L790 HydrophobicContact CG-CD1 4.35Å; L298-L793 HydrophobicContact CD2-CD1 3.74Å; L298-L794 HydrophobicContact CD1-CD2 4.09Å
299	L	96.4	Very high	93.1	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-83.2	-32.8	176.2	-68.2	164.7	0	0	0	112.8	L295 V296 N301 C737 W740 T741 S786 L787 L790	L295-L299 HydrophobicContact CD1-CD1 3.96Å; L295-L299 HydrophobicContact CD1-CG 4.41Å; L295-L299 HydrophobicContact CD2-CD1 4.49Å; L295-L299 HydrophobicContact CG-CD1 3.76Å; L295-L299 WeakPolarHBondContact O-CG 2.99Å; L295-L299 PolarHBondContact O-N 3.44Å; V296-L299 PolarHBondContact O-N 3.24Å; V296-L299 VanDerWaalsContact O-N 3.12Å; L299-N301 PolarHBondContact O-N 3.32Å; L299-C737 VanDerWaalsContact C-SG 3.5Å; L299-C737 VanDerWaalsContact CB-SG 3.56Å; L299-W740 HydrophobicContact CD1-CH2 4.42Å; L299-W740 HydrophobicContact CD1-CZ3 3.84Å; L299-W740 HydrophobicContact CD2-CH2 4.22Å; L299-W740 HydrophobicContact CD2-CZ3 3.96Å; L299-W740 HydrophobicContact CG-CZ3 4.33Å; L299-T741 HydrophobicContact CD1-CG2 3.91Å; L299-T741 WeakPolarHBondContact CD1-OG1 3.45Å; L299-S786 WeakPolarHBondContact O-CB 3.15Å; L299-S786 PolarHBondContact O-OG 3.05Å; L299-L787 HydrophobicContact CD2-CD2 4.18Å; L299-L790 HydrophobicContact CD2-CB 3.95Å; L299-L790 HydrophobicContact CD2-CD2 3.79Å; L299-L790 HydrophobicContact CD2-CG 4.42Å; L299-L790 HydrophobicContact CG-CD2 4.27Å
300	D	95.3	Very high	93	Very high	22 Å²	22	30.8 Å²	30.8	12%	0.118	18%	0.178	C	C	.	.			trans	-77.9	62.8	179.1	-169.8	13.8	0	0	0	111.9	V296 H302 S734	V296-D300 WeakPolarHBondContact O-CB 3.44Å; V296-D300 PolarHBondContact O-N 3.16Å; D300-H302 IonicContact OD1-CD2 2.73Å; D300-H302 PolarHBondContact OD1-CD2 3.38Å; D300-H302 IonicContact OD1-NE2 3.64Å; D300-H302 PolarHBondContact OD1-NE2 2.82Å; D300-S734 WeakPolarHBondContact OD1-CA 3.33Å; D300-S734 WeakPolarHBondContact OD1-CB 3.39Å; D300-S734 PolarHBondContact OD1-OG 2.91Å; D300-S734 VanDerWaalsContact OD2-CB 3.28Å; D300-S734 WeakPolarHBondContact OD2-CB 3.49Å; D300-S734 PolarHBondContact OD2-OG 2.62Å
301	N	93.4	Very high	92.9	Very high	7 Å²	7	31.1 Å²	31.1	4%	0.037	18%	0.18	C	C	.	.			trans	-128.5	83.5	-179.8	-78.2	-76.5	0	0	0	110.1	R297 L298 L299 W310 I789	R297-N301 PolarHBondContact O-ND2 2.9Å; L298-N301 PolarHBondContact O-ND2 2.79Å; L299-N301 PolarHBondContact O-N 3.32Å; N301-W310 WeakPolarHBondContact OD1-CZ2 3.49Å; N301-W310 PolarHBondContact OD1-NE1 2.92Å; N301-I789 HydrophobicContact CB-CD1 3.9Å; N301-I789 HydrophobicContact CB-CG2 4.04Å; N301-I789 VanDerWaalsContact O-CD1 3.24Å; N301-I789 WeakPolarHBondContact O-CD1 3.26Å
302	H	88.5	Confident	92.9	Very high	45 Å²	45	30.9 Å²	30.9	21%	0.208	18%	0.179	C	C	.	.			trans	-102.4	97.9	-166.6	-60.6	-40.6	0	0	0	112.8	D300 F306 N733 F781	D300-H302 IonicContact OD1-CD2 2.73Å; D300-H302 PolarHBondContact OD1-CD2 3.38Å; D300-H302 IonicContact OD1-NE2 3.64Å; D300-H302 PolarHBondContact OD1-NE2 2.82Å; H302-F306 PolarHBondContact O-N 3.05Å; H302-F306 VanDerWaalsContact O-N 3.13Å; H302-N733 HydrophobicContact CB-CB 4.41Å; H302-N733 WeakPolarHBondContact CD2-CB 3.46Å; H302-N733 PolarHBondContact NE2-O 2.92Å; H302-F781 AromaticContact CE1-CD2 3.65Å; H302-F781 AromaticContact CE1-CE2 3.68Å
303	G	83.5	Confident	93	Very high	30 Å²	30	29.3 Å²	29.3	31%	0.309	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	156.4	170.3	0	0	0	0	0	113.4	F306	G303-F306 VanDerWaalsContact CA-CZ 3.49Å
304	P	83.2	Confident	93	Very high	108 Å²	108	27.3 Å²	27.3	70%	0.701	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	cis	-83.4	-20.2	17.8	32.5	-35.8	0	0	0	115.1	F306	P304-F306 WeakPolarHBondContact O-CD2 3.18Å
305	D	84.1	Confident	93	Very high	126 Å²	126	28.7 Å²	28.7	67%	0.674	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-23.3	-165.1	-47.8	-61.8	0	0	0	114.2	G307 G812	D305-G307 VanDerWaalsContact C-N 3.27Å; D305-G307 PolarHBondContact O-N 3.15Å; D305-G307 VanDerWaalsContact O-N 3.16Å; D305-G812 WeakPolarHBondContact O-CA 3.43Å
306	F	89.6	Confident	92.9	Very high	20 Å²	20	28.7 Å²	28.7	9%	0.088	17%	0.17	C	C	.	.			trans	44.2	49.2	177.5	-60.1	-75.5	0	0	0	113.2	L210 T211 H302 G303 P304 D308 T811 G812 A814	L210-F306 HydrophobicContact CB-CE1 4.39Å; L210-F306 HydrophobicContact CD1-CD1 3.48Å; L210-F306 VanDerWaalsContact CD1-CD1 3.48Å; L210-F306 HydrophobicContact CD1-CE1 3.57Å; L210-F306 HydrophobicContact CD1-CG 4.23Å; L210-F306 HydrophobicContact CD1-CZ 4.38Å; T211-F306 HydrophobicContact CG2-CZ 4.41Å; H302-F306 PolarHBondContact O-N 3.05Å; H302-F306 VanDerWaalsContact O-N 3.13Å; G303-F306 VanDerWaalsContact CA-CZ 3.49Å; P304-F306 WeakPolarHBondContact O-CD2 3.18Å; F306-D308 PolarHBondContact O-N 2.84Å; F306-T811 WeakPolarHBondContact O-CA 3.36Å; F306-G812 PolarHBondContact O-N 3.11Å; F306-A814 HydrophobicContact CD2-CB 4.03Å; F306-A814 HydrophobicContact CE2-CB 3.61Å; F306-A814 HydrophobicContact CZ-CB 4.29Å
307	G	86.4	Confident	92.8	Very high	44 Å²	44	30.2 Å²	30.2	45%	0.454	18%	0.176	S	C	.	.			trans	-67.2	-27.8	-163.8	0	0	0	0	0	116.4	D305 T811	D305-G307 VanDerWaalsContact C-N 3.27Å; D305-G307 PolarHBondContact O-N 3.15Å; D305-G307 VanDerWaalsContact O-N 3.16Å; G307-T811 WeakPolarHBondContact O-CB 3.25Å; G307-T811 WeakPolarHBondContact O-CG2 3.47Å; G307-T811 PolarHBondContact O-OG1 3.2Å
308	D	88.7	Confident	92.5	Very high	52 Å²	52	31 Å²	31	28%	0.278	18%	0.182	S	C	.	.			trans	-85.1	119.8	-175.5	-77.2	-88.7	0	0	0	113	F306 K338 H809	F306-D308 PolarHBondContact O-N 2.84Å; D308-K338 VanDerWaalsContact OD1-CE 3.29Å; D308-K338 WeakPolarHBondContact OD1-CE 3.31Å; D308-K338 IonicContact OD1-NZ 2.76Å; D308-K338 PolarHBondContact OD1-NZ 3.29Å; D308-H809 PolarHBondContact O-CE1 3.48Å; D308-H809 VanDerWaalsContact O-CE1 3.29Å; D308-H809 PolarHBondContact O-ND1 3.4Å
309	Q	93.1	Very high	91.9	Very high	43 Å²	43	32.7 Å²	32.7	20%	0.201	19%	0.193	C	C	.	.			trans	-70.6	139.8	165.5	-176.9	-175.2	25.2	0	0	110.8	H809 T811	Q309-H809 WeakPolarHBondContact CG-O 3.41Å; Q309-T811 PolarHBondContact N-OG1 3.11Å
310	W	95.6	Very high	90.8	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.015	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	155	173.1	55	-96.1	0	0	0	116.3	L210 R297 L298 N301 L312 L793 I807 H809 V816	L210-W310 HydrophobicContact CD2-CZ2 4.24Å; R297-W310 HydrophobicContact CG-CB 4.07Å; R297-W310 HydrophobicContact CG-CD2 4.1Å; R297-W310 HydrophobicContact CG-CE3 4.44Å; R297-W310 HydrophobicContact CG-CG 4Å; L298-W310 HydrophobicContact CD2-CH2 4.04Å; N301-W310 WeakPolarHBondContact OD1-CZ2 3.49Å; N301-W310 PolarHBondContact OD1-NE1 2.92Å; W310-L312 HydrophobicContact CE3-CB 4.42Å; W310-L312 HydrophobicContact CE3-CD1 3.92Å; W310-L312 HydrophobicContact CE3-CG 4.09Å; W310-L312 HydrophobicContact CH2-CD1 4.36Å; W310-L312 HydrophobicContact CZ3-CB 4.28Å; W310-L312 HydrophobicContact CZ3-CD1 3.65Å; W310-L312 HydrophobicContact CZ3-CG 4.16Å; W310-L793 HydrophobicContact CH2-CD1 4.38Å; W310-I807 HydrophobicContact CH2-CG2 3.82Å; W310-I807 HydrophobicContact CZ3-CB 3.94Å; W310-I807 HydrophobicContact CZ3-CG2 3.51Å; W310-H809 AromaticContact CD1-CG 3.86Å; W310-H809 AromaticContact CD1-ND1 3.45Å; W310-H809 HydrophobicContact CD2-CB 3.52Å; W310-H809 VanDerWaalsContact CE2-CB 3.41Å; W310-H809 AromaticContact CE2-CG 3.76Å; W310-H809 HydrophobicContact CE3-CB 4.03Å; W310-H809 HydrophobicContact CG-CB 3.85Å; W310-H809 HydrophobicContact CH2-CB 4.34Å; W310-H809 HydrophobicContact CZ2-CB 3.87Å; W310-H809 HydrophobicContact CZ3-CB 4.39Å; W310-H809 PolarHBondContact N-O 3.3Å; W310-H809 AromaticContact NE1-CG 3.48Å; W310-H809 AromaticContact NE1-ND1 3.39Å; W310-H809 PolarHBondContact NE1-ND1 2.77Å; W310-H809 PolarHBondContact O-N 3.3Å; W310-V816 HydrophobicContact CH2-CG1 3.89Å; W310-V816 HydrophobicContact CZ2-CG1 4.02Å
311	E	96.8	Very high	89.3	Confident	7 Å²	7	38.3 Å²	38.3	3%	0.033	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	135	173	-56.5	-175.7	177.3	0	0	110.1	P335 L336 L806 I807 V808 Y831 L833 H837	E311-P335 WeakPolarHBondContact O-CA 3.33Å; E311-L336 HydrophobicContact CB-CB 4.23Å; E311-L336 HydrophobicContact CB-CD1 4.14Å; E311-L336 HydrophobicContact CB-CG 4.3Å; E311-L336 PolarHBondContact O-N 3.39Å; E311-L806 HydrophobicContact CB-CD1 4.32Å; E311-I807 CarbonylContact C-O 3.56Å; E311-I807 VanDerWaalsContact CA-O 3.26Å; E311-I807 WeakPolarHBondContact CA-O 3.14Å; E311-V808 HydrophobicContact CG-CG1 4.21Å; E311-V808 HydrophobicContact CG-CG2 4.11Å; E311-Y831 PolarHBondContact OE1-OH 3.34Å; E311-L833 WeakPolarHBondContact OE2-CD1 3.29Å; E311-H837 IonicContact OE1-NE2 3.22Å; E311-H837 IonicContact OE2-CD2 3.61Å; E311-H837 IonicContact OE2-CE1 2.62Å; E311-H837 IonicContact OE2-NE2 2.73Å; E311-H837 PolarHBondContact OE2-NE2 2.79Å
312	L	97.3	Very high	87.7	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	117.9	-179.2	-85.2	169.3	0	0	0	110.8	A294 R297 L298 W310 I332 D333 P335 I807	A294-L312 HydrophobicContact CB-CD2 3.95Å; R297-L312 HydrophobicContact CB-CD1 4.47Å; R297-L312 HydrophobicContact CG-CD1 4.18Å; R297-L312 HydrophobicContact CG-CG 4.44Å; L298-L312 HydrophobicContact CD1-CD1 4.44Å; L298-L312 HydrophobicContact CD2-CD1 3.67Å; L298-L312 HydrophobicContact CG-CD1 3.75Å; W310-L312 HydrophobicContact CE3-CB 4.42Å; W310-L312 HydrophobicContact CE3-CD1 3.92Å; W310-L312 HydrophobicContact CE3-CG 4.09Å; W310-L312 HydrophobicContact CH2-CD1 4.36Å; W310-L312 HydrophobicContact CZ3-CB 4.28Å; W310-L312 HydrophobicContact CZ3-CD1 3.65Å; W310-L312 HydrophobicContact CZ3-CG 4.16Å; L312-I332 HydrophobicContact CB-CG2 4.45Å; L312-I332 HydrophobicContact CD2-CG2 4.19Å; L312-D333 VanDerWaalsContact CD2-O 3.31Å; L312-D333 WeakPolarHBondContact CD2-O 3.14Å; L312-P335 HydrophobicContact CD2-CB 3.79Å; L312-P335 HydrophobicContact CD2-CG 4.39Å; L312-P335 HydrophobicContact CG-CB 4.34Å; L312-I807 HydrophobicContact CB-CB 4.27Å; L312-I807 HydrophobicContact CB-CD1 4.25Å; L312-I807 HydrophobicContact CB-CG1 4.45Å; L312-I807 PolarHBondContact N-O 3.44Å; L312-I807 PolarHBondContact O-N 3.49Å
313	P	97.4	Very high	86.2	Confident	7 Å²	7	48.4 Å²	48.4	5%	0.045	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	139.2	174	-14.4	30	0	0	0	111.6	L198 D333 L336 L806	L198-P313 HydrophobicContact CD1-CB 4.32Å; L198-P313 HydrophobicContact CD1-CG 3.91Å; L198-P313 HydrophobicContact CD2-CB 4.45Å; P313-D333 HydrophobicContact CB-CB 4.29Å; P313-D333 HydrophobicContact CG-CB 4.47Å; P313-D333 PolarHBondContact O-N 3.47Å; P313-L336 HydrophobicContact CG-CD2 3.63Å; P313-L336 HydrophobicContact CG-CG 4.01Å; P313-L806 HydrophobicContact CB-CD1 4.47Å; P313-L806 HydrophobicContact CG-CD1 4.31Å
314	V	97.8	Very high	84.6	Confident	3 Å²	3	53.3 Å²	53.3	2%	0.018	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	131.3	-179.8	176.5	0	0	0	0	110.4	V316 V330 Y331 I332 L797 Y805 I807	V314-V316 HydrophobicContact CG1-CG2 4.29Å; V314-V330 HydrophobicContact CG1-CG1 3.58Å; V314-Y331 CarbonylContact C-O 3.2Å; V314-Y331 WeakPolarHBondContact CA-O 3.49Å; V314-I332 HydrophobicContact CG2-CG1 4.25Å; V314-I332 HydrophobicContact CG2-CG2 4.17Å; V314-L797 HydrophobicContact CG2-CD2 4.42Å; V314-Y805 PolarHBondContact N-O 2.75Å; V314-Y805 PolarHBondContact O-N 3.25Å; V314-I807 HydrophobicContact CG2-CD1 3.83Å; V314-I807 HydrophobicContact CG2-CG1 3.82Å
315	L	97	Very high	83.7	Confident	29 Å²	29	49.9 Å²	49.9	15%	0.152	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	118.1	171.1	174	67.4	0	0	0	109.7	K317 Y331 Q804	L315-K317 HydrophobicContact CD2-CD 4.24Å; L315-K317 VanDerWaalsContact CD2-CE 3.47Å; L315-K317 HydrophobicContact CD2-CG 3.89Å; L315-K317 HydrophobicContact CG-CG 4Å; L315-Y331 PolarHBondContact N-O 2.78Å; L315-Y331 WeakPolarHBondContact O-CB 3.23Å; L315-Y331 PolarHBondContact O-N 3.13Å; L315-Q804 HydrophobicContact CD1-CG 3.46Å; L315-Q804 VanDerWaalsContact CD1-CG 3.46Å
316	V	96.7	Very high	83.4	Confident	1 Å²	1	52 Å²	52	1%	0.006	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	110.1	171.9	-175.7	0	0	0	0	107.9	V314 K328 V330 L800 G803 Y805	V314-V316 HydrophobicContact CG1-CG2 4.29Å; V316-K328 HydrophobicContact CG1-CD 3.7Å; V316-K328 HydrophobicContact CG1-CG 3.59Å; V316-V330 HydrophobicContact CG2-CG2 4.43Å; V316-L800 HydrophobicContact CG2-CB 4.18Å; V316-G803 PolarHBondContact N-O 3.36Å; V316-G803 PolarHBondContact O-N 2.92Å; V316-G803 VanDerWaalsContact O-N 3.13Å; V316-Y805 HydrophobicContact CB-CE2 4.23Å; V316-Y805 HydrophobicContact CG2-CD2 3.96Å; V316-Y805 HydrophobicContact CG2-CE2 3.74Å
317	K	93.9	Very high	83.1	Confident	45 Å²	45	56.8 Å²	56.8	20%	0.196	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	142.5	172.8	-68.5	-176.6	178.2	169.6	0	110.2	S272 E278 L315 K328 T329 Y331	S272-K317 PolarHBondContact O-NZ 3.02Å; E278-K317 IonicContact OE1-NZ 2.64Å; E278-K317 PolarHBondContact OE1-NZ 3.21Å; E278-K317 IonicContact OE2-NZ 3.89Å; L315-K317 HydrophobicContact CD2-CD 4.24Å; L315-K317 VanDerWaalsContact CD2-CE 3.47Å; L315-K317 HydrophobicContact CD2-CG 3.89Å; L315-K317 HydrophobicContact CG-CG 4Å; K317-K328 WeakPolarHBondContact O-CA 3.47Å; K317-T329 PolarHBondContact N-O 3.39Å; K317-T329 VanDerWaalsContact N-O 3.17Å; K317-T329 PolarHBondContact O-N 3.12Å; K317-T329 VanDerWaalsContact O-N 3.07Å; K317-Y331 HydrophobicContact CB-CD2 4.48Å; K317-Y331 HydrophobicContact CB-CE2 4.1Å; K317-Y331 HydrophobicContact CD-CD2 4.28Å; K317-Y331 HydrophobicContact CD-CE2 3.79Å; K317-Y331 HydrophobicContact CG-CD2 4.27Å; K317-Y331 HydrophobicContact CG-CE2 4.09Å
318	I	91.6	Very high	83.4	Confident	56 Å²	56	58.1 Å²	58.1	29%	0.287	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	111.1	167.5	-64.5	-178.7	0	0	0	110	K326 R327 K328 E802	I318-K326 HydrophobicContact CG2-CB 3.79Å; I318-K326 HydrophobicContact CG2-CD 4.05Å; I318-K326 HydrophobicContact CG2-CG 4.24Å; I318-R327 CarbonylContact C-O 3.42Å; I318-R327 WeakPolarHBondContact CA-O 3.38Å; I318-R327 WeakPolarHBondContact CG2-O 3.4Å; I318-K328 HydrophobicContact CD1-CD 4.46Å; I318-K328 HydrophobicContact CG1-CB 4.19Å; I318-K328 HydrophobicContact CG1-CD 4.32Å; I318-K328 HydrophobicContact CG1-CG 3.97Å; I318-E802 WeakPolarHBondContact CB-OE1 3.46Å; I318-E802 HydrophobicContact CD1-CB 3.84Å; I318-E802 HydrophobicContact CG1-CB 4.04Å; I318-E802 HydrophobicContact CG1-CG 4.44Å; I318-E802 PolarHBondContact N-OE1 3.37Å
319	T	83.1	Confident	83.7	Confident	37 Å²	37	55.9 Å²	55.9	23%	0.227	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	144	175.4	49.9	0	0	0	0	111.3	G321 R327	T319-G321 PolarHBondContact O-N 3.25Å; T319-R327 PolarHBondContact N-O 3.15Å; T319-R327 PolarHBondContact O-N 3.25Å
320	P	74.5	Confident	84	Confident	123 Å²	123	53.9 Å²	53.9	80%	0.799	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	112.4	166.9	29.5	-31.4	0	0	0	108.8
321	G	63.6	Low	84.1	Confident	18 Å²	18	53.8 Å²	53.8	19%	0.186	30%	0.302	C	S	.	.			trans	-72.8	175.4	177	0	0	0	0	0	112.6	T319 G323 G325	T319-G321 PolarHBondContact O-N 3.25Å; G321-G323 PolarHBondContact O-N 3.04Å; G321-G325 WeakPolarHBondContact CA-O 3.2Å; G321-G325 PolarHBondContact N-O 2.9Å; G321-G325 VanDerWaalsContact N-O 3.08Å
322	K	58.5	Low	84.2	Confident	200 Å²	200	53.5 Å²	53.5	87%	0.87	30%	0.3	S	S	*	.	S	Bend	trans	-73.1	74.9	174	-72.5	174.9	179.3	167	0	111
323	G	57.5	Low	84.2	Confident	63 Å²	63	53.9 Å²	53.9	65%	0.649	30%	0.302	S	S	*	.	S	Bend	trans	148.9	-156	179.4	0	0	0	0	0	112.2	G321 G325	G321-G323 PolarHBondContact O-N 3.04Å; G323-G325 PolarHBondContact O-N 3.32Å
324	S	50.5	Low	84.1	Confident	133 Å²	133	53.9 Å²	53.9	93%	0.93	30%	0.303	S	S	*	.	S	Bend	trans	-78	-7.2	172.5	52.5	0	0	0	0	113.9	K326	S324-K326 PolarHBondContact O-N 2.95Å
325	G	64.1	Low	84	Confident	37 Å²	37	54.2 Å²	54.2	38%	0.381	31%	0.305	S	S	.	.			trans	-79.1	113.8	-179.7	0	0	0	0	0	112.7	G321 G323	G321-G325 WeakPolarHBondContact CA-O 3.2Å; G321-G325 PolarHBondContact N-O 2.9Å; G321-G325 VanDerWaalsContact N-O 3.08Å; G323-G325 PolarHBondContact O-N 3.32Å
326	K	77.6	Confident	84	Confident	171 Å²	171	53.2 Å²	53.2	74%	0.743	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	132	161.6	-68.1	-173.8	176.1	-168.3	0	109.3	I318 S324	I318-K326 HydrophobicContact CG2-CB 3.79Å; I318-K326 HydrophobicContact CG2-CD 4.05Å; I318-K326 HydrophobicContact CG2-CG 4.24Å; S324-K326 PolarHBondContact O-N 2.95Å
327	R	83.9	Confident	83.7	Confident	119 Å²	119	53.9 Å²	53.9	45%	0.449	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	150.1	173.4	-66.7	-53.4	-158.7	-168.7	13.2	110.1	E285 I318 T319	E285-R327 HydrophobicContact CG-CG 4.46Å; E285-R327 WeakPolarHBondContact OE1-CG 3.11Å; E285-R327 IonicContact OE1-NE 3.2Å; E285-R327 PolarHBondContact OE1-NE 3.39Å; E285-R327 IonicContact OE2-CZ 3.16Å; E285-R327 IonicContact OE2-NE 2.8Å; E285-R327 PolarHBondContact OE2-NE 2.67Å; E285-R327 IonicContact OE2-NH2 2.71Å; E285-R327 PolarHBondContact OE2-NH2 3.25Å; I318-R327 CarbonylContact C-O 3.42Å; I318-R327 WeakPolarHBondContact CA-O 3.38Å; I318-R327 WeakPolarHBondContact CG2-O 3.4Å; T319-R327 PolarHBondContact N-O 3.15Å; T319-R327 PolarHBondContact O-N 3.25Å
328	K	92.5	Very high	83.6	Confident	73 Å²	73	53.5 Å²	53.5	32%	0.317	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	120.7	-176.1	-172.9	175.9	71.4	172.5	0	109	V316 K317 I318 T798 G799 L800	V316-K328 HydrophobicContact CG1-CD 3.7Å; V316-K328 HydrophobicContact CG1-CG 3.59Å; K317-K328 WeakPolarHBondContact O-CA 3.47Å; I318-K328 HydrophobicContact CD1-CD 4.46Å; I318-K328 HydrophobicContact CG1-CB 4.19Å; I318-K328 HydrophobicContact CG1-CD 4.32Å; I318-K328 HydrophobicContact CG1-CG 3.97Å; K328-T798 WeakPolarHBondContact CE-O 3.38Å; K328-T798 PolarHBondContact NZ-O 3.19Å; K328-G799 PolarHBondContact NZ-O 3.13Å; K328-L800 WeakPolarHBondContact CD-O 3.48Å; K328-L800 WeakPolarHBondContact CE-O 3.24Å; K328-L800 PolarHBondContact NZ-O 3.2Å
329	T	95.5	Very high	83.5	Confident	5 Å²	5	55.6 Å²	55.6	3%	0.031	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.4	179	-60.9	0	0	0	0	109.1	P286 C289 K317 Y331	P286-T329 HydrophobicContact CG-CG2 4.34Å; P286-T329 WeakPolarHBondContact O-CG2 3.31Å; P286-T329 PolarHBondContact O-OG1 3.49Å; C289-T329 HydrophobicContact CB-CG2 4.08Å; K317-T329 PolarHBondContact N-O 3.39Å; K317-T329 VanDerWaalsContact N-O 3.17Å; K317-T329 PolarHBondContact O-N 3.12Å; K317-T329 VanDerWaalsContact O-N 3.07Å; T329-Y331 HydrophobicContact CG2-CD2 4.21Å; T329-Y331 HydrophobicContact CG2-CE2 3.78Å
330	V	97.9	Very high	83.8	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.006	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	115.8	176	-177.1	0	0	0	0	108.7	H287 V288 C289 V314 V316 I332 L797 T798	H287-V330 PolarHBondContact O-N 2.99Å; V288-V330 CarbonylContact C-O 3.47Å; V288-V330 WeakPolarHBondContact CA-O 3.39Å; V288-V330 HydrophobicContact CG1-CB 4.45Å; V288-V330 HydrophobicContact CG2-CB 4.32Å; C289-V330 PolarHBondContact N-O 3.13Å; V314-V330 HydrophobicContact CG1-CG1 3.58Å; V316-V330 HydrophobicContact CG2-CG2 4.43Å; V330-I332 HydrophobicContact CG1-CG1 4.03Å; V330-L797 HydrophobicContact CG1-CB 4Å; V330-L797 HydrophobicContact CG1-CD1 4.48Å; V330-L797 HydrophobicContact CG2-CB 4.42Å; V330-T798 HydrophobicContact CG2-CG2 4.14Å
331	Y	98.1	Very high	84.6	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.008	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	128.9	170.6	-64.8	-101.9	0	0	0	109.2	I271 C281 C289 V314 L315 K317 T329	I271-Y331 WeakPolarHBondContact O-CD1 3.48Å; C281-Y331 WeakPolarHBondContact CB-OH 3.38Å; C281-Y331 PolarHBondContact SG-OH 3.5Å; C281-Y331 VanDerWaalsContact SG-OH 3.33Å; C289-Y331 HydrophobicContact CB-CD1 3.86Å; C289-Y331 HydrophobicContact CB-CE1 4.05Å; C289-Y331 HydrophobicContact CB-CG 4.38Å; C289-Y331 CarbonylContact O-C 3.51Å; C289-Y331 VanDerWaalsContact O-CA 3.25Å; C289-Y331 WeakPolarHBondContact O-CA 3.41Å; V314-Y331 CarbonylContact C-O 3.2Å; V314-Y331 WeakPolarHBondContact CA-O 3.49Å; L315-Y331 PolarHBondContact N-O 2.78Å; L315-Y331 WeakPolarHBondContact O-CB 3.23Å; L315-Y331 PolarHBondContact O-N 3.13Å; K317-Y331 HydrophobicContact CB-CD2 4.48Å; K317-Y331 HydrophobicContact CB-CE2 4.1Å; K317-Y331 HydrophobicContact CD-CD2 4.28Å; K317-Y331 HydrophobicContact CD-CE2 3.79Å; K317-Y331 HydrophobicContact CG-CD2 4.27Å; K317-Y331 HydrophobicContact CG-CE2 4.09Å; T329-Y331 HydrophobicContact CG2-CD2 4.21Å; T329-Y331 HydrophobicContact CG2-CE2 3.78Å
332	I	98.3	Very high	85.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	112.5	176.2	-45.4	-178.9	0	0	0	108.5	I271 V288 C289 L290 T291 A294 L298 L312 V314 V330 L794 L797	I271-I332 WeakPolarHBondContact CG2-O 3.29Å; V288-I332 HydrophobicContact CG1-CD1 3.87Å; V288-I332 HydrophobicContact CG1-CG1 4.16Å; C289-I332 PolarHBondContact O-N 3.07Å; L290-I332 WeakPolarHBondContact CA-O 3.36Å; L290-I332 HydrophobicContact CB-CB 3.84Å; L290-I332 HydrophobicContact CB-CG1 4.35Å; L290-I332 HydrophobicContact CD2-CD1 4.19Å; T291-I332 PolarHBondContact N-O 3.4Å; A294-I332 HydrophobicContact CB-CB 4.4Å; A294-I332 HydrophobicContact CB-CG2 3.89Å; L298-I332 HydrophobicContact CD1-CD1 4.01Å; L312-I332 HydrophobicContact CB-CG2 4.45Å; L312-I332 HydrophobicContact CD2-CG2 4.19Å; V314-I332 HydrophobicContact CG2-CG1 4.25Å; V314-I332 HydrophobicContact CG2-CG2 4.17Å; V330-I332 HydrophobicContact CG1-CG1 4.03Å; I332-L794 HydrophobicContact CD1-CD2 3.59Å; I332-L797 HydrophobicContact CD1-CD1 3.6Å; I332-L797 HydrophobicContact CG1-CD1 4.43Å
333	D	97.4	Very high	87.6	Confident	8 Å²	8	45.5 Å²	45.5	4%	0.043	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-80.8	164.7	179.9	-68.9	-43	0	0	0	111.5	R270 I271 S272 L312 P313	R270-D333 WeakPolarHBondContact CA-OD1 3.24Å; R270-D333 VanDerWaalsContact CB-OD1 3.32Å; R270-D333 WeakPolarHBondContact CB-OD1 3.42Å; R270-D333 WeakPolarHBondContact CD-OD2 3.43Å; R270-D333 HydrophobicContact CG-CB 4.29Å; I271-D333 PolarHBondContact N-OD1 2.65Å; S272-D333 VanDerWaalsContact CB-OD2 3.29Å; S272-D333 WeakPolarHBondContact CB-OD2 3.34Å; S272-D333 PolarHBondContact N-OD1 2.79Å; S272-D333 VanDerWaalsContact OG-CG 3.29Å; S272-D333 PolarHBondContact OG-OD1 3.48Å; S272-D333 PolarHBondContact OG-OD2 2.94Å; L312-D333 VanDerWaalsContact CD2-O 3.31Å; L312-D333 WeakPolarHBondContact CD2-O 3.14Å; P313-D333 HydrophobicContact CB-CB 4.29Å; P313-D333 HydrophobicContact CG-CB 4.47Å; P313-D333 PolarHBondContact O-N 3.47Å
334	S	96.4	Very high	89.2	Confident	8 Å²	8	44 Å²	44	6%	0.056	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-54.6	144.9	177.7	-64.7	0	0	0	0	112.2	K267 T291	K267-S334 WeakPolarHBondContact O-CB 3.35Å; K267-S334 PolarHBondContact O-OG 3.49Å; T291-S334 WeakPolarHBondContact OG1-CA 3.26Å; T291-S334 PolarHBondContact OG1-OG 3.02Å
335	P	96.1	Very high	91.2	Very high	10 Å²	10	40.3 Å²	40.3	7%	0.065	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-59.5	144.7	-177.1	22.9	-33	0	0	0	112.9	H268 D293 R297 E311 L312	H268-P335 PolarHBondContact CE1-O 3.27Å; H268-P335 VanDerWaalsContact CE1-O 3.24Å; D293-P335 HydrophobicContact CB-CG 4.32Å; R297-P335 HydrophobicContact CB-CB 4.41Å; R297-P335 HydrophobicContact CB-CG 4.19Å; R297-P335 HydrophobicContact CG-CB 4.16Å; R297-P335 HydrophobicContact CG-CG 4.45Å; E311-P335 WeakPolarHBondContact O-CA 3.33Å; L312-P335 HydrophobicContact CD2-CB 3.79Å; L312-P335 HydrophobicContact CD2-CG 4.39Å; L312-P335 HydrophobicContact CG-CB 4.34Å
336	L	95.4	Very high	92.7	Very high	8 Å²	8	38.9 Å²	38.9	4%	0.042	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-67.4	160.7	172.9	-55.4	-171.7	0	0	0	111.1	V195 L198 E311 P313 L806 L833	V195-L336 HydrophobicContact CG2-CD2 4.36Å; L198-L336 HydrophobicContact CD1-CD1 4.4Å; L198-L336 HydrophobicContact CD1-CD2 3.95Å; E311-L336 HydrophobicContact CB-CB 4.23Å; E311-L336 HydrophobicContact CB-CD1 4.14Å; E311-L336 HydrophobicContact CB-CG 4.3Å; E311-L336 PolarHBondContact O-N 3.39Å; P313-L336 HydrophobicContact CG-CD2 3.63Å; P313-L336 HydrophobicContact CG-CG 4.01Å; L336-L806 HydrophobicContact CD1-CD1 4.07Å; L336-L833 HydrophobicContact CD1-CD1 3.82Å; L336-L833 HydrophobicContact CD1-CD2 4.33Å
337	L	92.3	Very high	93.5	Very high	14 Å²	14	30.8 Å²	30.8	7%	0.073	14%	0.138	C	C	.	.	P	Polyproline II helix	trans	-58.8	138.4	174.7	-176.3	57.8	0	0	0	110.3	F188 C191 L192 H837 P841	F188-L337 HydrophobicContact CB-CD2 3.84Å; F188-L337 HydrophobicContact CD1-CD1 3.53Å; F188-L337 HydrophobicContact CD1-CD2 3.69Å; F188-L337 HydrophobicContact CD1-CG 4.26Å; F188-L337 HydrophobicContact CE1-CD1 3.62Å; F188-L337 HydrophobicContact CG-CD1 4.47Å; F188-L337 HydrophobicContact CG-CD2 3.94Å; C191-L337 HydrophobicContact CB-CB 4.47Å; C191-L337 HydrophobicContact CB-CD2 4.04Å; L192-L337 HydrophobicContact CD2-CD2 4.11Å; L192-L337 HydrophobicContact CG-CD2 4.38Å; L337-H837 PolarHBondContact O-CE1 3.18Å; L337-P841 HydrophobicContact CD1-CG 4.37Å; L337-P841 HydrophobicContact CD2-CG 3.56Å; L337-P841 HydrophobicContact CG-CG 3.73Å
338	K	91.3	Very high	94	Very high	37 Å²	37	27.7 Å²	27.7	16%	0.161	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-64.9	142.9	173	-70	-176.8	172.3	-178.5	0	109.4	D308 E340 V341 E345 P841	D308-K338 VanDerWaalsContact OD1-CE 3.29Å; D308-K338 WeakPolarHBondContact OD1-CE 3.31Å; D308-K338 IonicContact OD1-NZ 2.76Å; D308-K338 PolarHBondContact OD1-NZ 3.29Å; K338-E340 VanDerWaalsContact CB-O 3.27Å; K338-E340 WeakPolarHBondContact CB-O 3.32Å; K338-V341 HydrophobicContact CB-CG2 3.92Å; K338-E345 IonicContact NZ-OE1 3.31Å; K338-E345 PolarHBondContact NZ-OE1 3.39Å; K338-P841 WeakPolarHBondContact O-CB 3.26Å; K338-P841 WeakPolarHBondContact O-CG 3.22Å
339	R	89.3	Confident	94.2	Very high	101 Å²	101	25.3 Å²	25.3	38%	0.381	12%	0.119	S	C	.	.	S	Bend	trans	-74.4	-28.2	178.1	-71.1	174.4	53.5	179.4	-3.1	113.4	N836	R339-N836 PolarHBondContact NE-O 2.94Å; R339-N836 PolarHBondContact NH1-ND2 3.22Å
340	E	90.1	Very high	94.2	Very high	94 Å²	94	25 Å²	25	44%	0.439	12%	0.117	S	C	.	.	B	Isolated β-bridge	trans	-118.1	135.9	168.8	-57.5	-171.4	168.6	0	0	109	K338 Q842 P844	K338-E340 VanDerWaalsContact CB-O 3.27Å; K338-E340 WeakPolarHBondContact CB-O 3.32Å; E340-Q842 CarbonylContact C-O 3.59Å; E340-Q842 VanDerWaalsContact CA-O 3.26Å; E340-Q842 WeakPolarHBondContact CA-O 3.22Å; E340-P844 HydrophobicContact CB-CG 4.04Å; E340-P844 WeakPolarHBondContact OE2-CA 3.45Å; E340-P844 WeakPolarHBondContact OE2-CB 3.34Å
341	V	91.1	Very high	94.1	Very high	6 Å²	6	25.1 Å²	25.1	4%	0.036	12%	0.117	C	C	.	.			trans	-140.5	119.5	-177.8	-178.6	0	0	0	0	109.4	F188 K338 E345 R346 P841 Q842 P843	F188-V341 HydrophobicContact CE2-CG1 4.49Å; F188-V341 HydrophobicContact CZ-CB 4.44Å; F188-V341 HydrophobicContact CZ-CG1 3.96Å; F188-V341 HydrophobicContact CZ-CG2 4.39Å; K338-V341 HydrophobicContact CB-CG2 3.92Å; V341-E345 HydrophobicContact CG1-CB 3.55Å; V341-R346 HydrophobicContact CG1-CG 3.89Å; V341-P841 HydrophobicContact CB-CB 4.09Å; V341-P841 HydrophobicContact CG2-CB 3.62Å; V341-P841 HydrophobicContact CG2-CG 4.16Å; V341-Q842 PolarHBondContact N-O 3.18Å; V341-P843 WeakPolarHBondContact O-CA 3.5Å
342	T	91.1	Very high	93.9	Very high	36 Å²	36	27.8 Å²	27.8	22%	0.221	13%	0.13	C	C	.	.			trans	-66.6	154.6	-179.9	61.4	0	0	0	0	112.2	R344 E345 R346 P844	T342-R344 PolarHBondContact O-N 3.02Å; T342-E345 WeakPolarHBondContact CB-OE2 3.48Å; T342-E345 WeakPolarHBondContact CG2-OE2 3.21Å; T342-E345 PolarHBondContact N-OE2 2.92Å; T342-E345 PolarHBondContact O-N 2.97Å; T342-E345 WeakPolarHBondContact OG1-CG 3.3Å; T342-E345 PolarHBondContact OG1-N 2.91Å; T342-E345 PolarHBondContact OG1-OE2 3.21Å; T342-R346 WeakPolarHBondContact O-CG 3.27Å; T342-R346 PolarHBondContact O-N 2.84Å; T342-P844 HydrophobicContact CG2-CG 4Å
343	I	92.3	Very high	93.8	Very high	30 Å²	30	28.2 Å²	28.2	15%	0.154	13%	0.132	C	C	.	.	H	α-helix	trans	-57.2	-34.3	174.9	-55.6	-57.2	0	0	0	111.6	I176 R346 S347	I176-I343 HydrophobicContact CB-CG2 3.64Å; I176-I343 HydrophobicContact CD1-CG2 4.27Å; I176-I343 HydrophobicContact CG2-CG2 3.61Å; I343-R346 PolarHBondContact O-N 3.01Å; I343-S347 WeakPolarHBondContact O-CB 3.26Å; I343-S347 PolarHBondContact O-N 3.35Å
344	R	92.4	Very high	93.7	Very high	30 Å²	30	27.8 Å²	27.8	11%	0.113	13%	0.13	C	C	.	.	H	α-helix	trans	-58.9	-46.1	172.1	-176.8	169.5	-172.7	159.6	11.4	112.8	T342 H348 L720 Y722 E729 P850	T342-R344 PolarHBondContact O-N 3.02Å; R344-H348 WeakPolarHBondContact O-CB 3.1Å; R344-H348 PolarHBondContact O-N 3.19Å; R344-L720 PolarHBondContact NH2-O 3.33Å; R344-Y722 HydrophobicContact CG-CE2 3.86Å; R344-E729 IonicContact CZ-OE2 2.71Å; R344-E729 IonicContact NH1-OE2 2.98Å; R344-E729 PolarHBondContact NH1-OE2 3.39Å; R344-E729 IonicContact NH2-OE1 3.18Å; R344-E729 IonicContact NH2-OE2 2.73Å; R344-E729 PolarHBondContact NH2-OE2 3.03Å; R344-P850 HydrophobicContact CB-CG 4.39Å; R344-P850 PolarHBondContact NH1-O 2.87Å
345	E	93.1	Very high	93.6	Very high	57 Å²	57	27.7 Å²	27.7	27%	0.266	13%	0.128	S	C	.	.	H	α-helix	trans	-67.3	-38	175.9	-73.4	163.7	112.5	0	0	112.4	K338 V341 T342 H348 I349	K338-E345 IonicContact NZ-OE1 3.31Å; K338-E345 PolarHBondContact NZ-OE1 3.39Å; V341-E345 HydrophobicContact CG1-CB 3.55Å; T342-E345 WeakPolarHBondContact CB-OE2 3.48Å; T342-E345 WeakPolarHBondContact CG2-OE2 3.21Å; T342-E345 PolarHBondContact N-OE2 2.92Å; T342-E345 PolarHBondContact O-N 2.97Å; T342-E345 WeakPolarHBondContact OG1-CG 3.3Å; T342-E345 PolarHBondContact OG1-N 2.91Å; T342-E345 PolarHBondContact OG1-OE2 3.21Å; E345-H348 WeakPolarHBondContact O-CB 3.44Å; E345-H348 PolarHBondContact O-N 3.36Å; E345-I349 WeakPolarHBondContact O-CD1 3.47Å; E345-I349 WeakPolarHBondContact O-CG1 3.31Å; E345-I349 PolarHBondContact O-N 2.94Å; E345-I349 VanDerWaalsContact O-N 3.11Å
346	R	94.3	Very high	93.4	Very high	6 Å²	6	31.3 Å²	31.3	2%	0.023	14%	0.143	C	C	.	.	H	α-helix	trans	-60.9	-51.6	173.6	-60.4	-175.9	79.6	125.1	-6.5	110.9	I176 T184 E185 F188 V341 T342 I343 H348 I349 Y350 P841	I176-R346 HydrophobicContact CD1-CB 3.7Å; T184-R346 HydrophobicContact CG2-CB 4.09Å; T184-R346 VanDerWaalsContact CG2-O 3.23Å; T184-R346 WeakPolarHBondContact CG2-O 3.47Å; T184-R346 PolarHBondContact OG1-NE 3.35Å; T184-R346 PolarHBondContact OG1-NH2 3.11Å; E185-R346 IonicContact OE1-NH2 2.69Å; F188-R346 HydrophobicContact CE2-CG 4.01Å; F188-R346 HydrophobicContact CZ-CG 4.2Å; V341-R346 HydrophobicContact CG1-CG 3.89Å; T342-R346 WeakPolarHBondContact O-CG 3.27Å; T342-R346 PolarHBondContact O-N 2.84Å; I343-R346 PolarHBondContact O-N 3.01Å; R346-H348 PolarHBondContact O-N 2.86Å; R346-I349 PolarHBondContact O-N 2.97Å; R346-Y350 PolarHBondContact O-N 3.35Å; R346-P841 PolarHBondContact NH1-O 2.9Å
347	S	94.6	Very high	93.3	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.007	16%	0.162	C	C	.	.	H	α-helix	trans	-58.4	-38	177.7	-171.6	0	0	0	0	111.4	I343 Y350 H351 L720	I343-S347 WeakPolarHBondContact O-CB 3.26Å; I343-S347 PolarHBondContact O-N 3.35Å; S347-Y350 PolarHBondContact O-N 3.44Å; S347-H351 WeakPolarHBondContact O-CB 3.45Å; S347-H351 PolarHBondContact O-N 2.99Å; S347-H351 PolarHBondContact O-ND1 2.84Å; S347-H351 PolarHBondContact OG-CE1 2.67Å; S347-H351 VanDerWaalsContact OG-CE1 3.29Å; S347-H351 PolarHBondContact OG-ND1 2.64Å; S347-H351 VanDerWaalsContact OG-ND1 3.17Å; S347-L720 WeakPolarHBondContact OG-CD1 3.25Å
348	H	95.2	Very high	93.2	Very high	55 Å²	55	35.7 Å²	35.7	26%	0.255	17%	0.169	S	C	.	.	H	α-helix	trans	-62.1	-46.4	176.9	-174.7	-93.5	0	0	0	112.7	R344 E345 R346 Y350 H351 E352 P718 L720	R344-H348 WeakPolarHBondContact O-CB 3.1Å; R344-H348 PolarHBondContact O-N 3.19Å; E345-H348 WeakPolarHBondContact O-CB 3.44Å; E345-H348 PolarHBondContact O-N 3.36Å; R346-H348 PolarHBondContact O-N 2.86Å; H348-Y350 VanDerWaalsContact C-N 3.26Å; H348-Y350 PolarHBondContact O-N 3.4Å; H348-H351 PolarHBondContact O-N 2.94Å; H348-E352 WeakPolarHBondContact O-CB 3.34Å; H348-E352 PolarHBondContact O-N 2.79Å; H348-P718 PolarHBondContact NE2-O 3.11Å; H348-L720 HydrophobicContact CB-CD1 4.19Å
349	I	95.5	Very high	93.2	Very high	22 Å²	22	34.6 Å²	34.6	11%	0.113	17%	0.165	C	C	.	.	H	α-helix	trans	-58.8	-35.1	-179.9	-70.2	162	0	0	0	112.6	T184 F187 F188 K263 E345 R346	T184-I349 HydrophobicContact CG2-CB 4.25Å; T184-I349 HydrophobicContact CG2-CG2 4.22Å; F187-I349 HydrophobicContact CD1-CG2 3.85Å; F187-I349 HydrophobicContact CE1-CD1 4.2Å; F187-I349 HydrophobicContact CE1-CG2 3.9Å; F187-I349 HydrophobicContact CG-CG2 4.5Å; F188-I349 HydrophobicContact CE1-CD1 3.69Å; F188-I349 HydrophobicContact CZ-CD1 3.81Å; K263-I349 PolarHBondContact NZ-O 2.89Å; E345-I349 WeakPolarHBondContact O-CD1 3.47Å; E345-I349 WeakPolarHBondContact O-CG1 3.31Å; E345-I349 PolarHBondContact O-N 2.94Å; E345-I349 VanDerWaalsContact O-N 3.11Å; R346-I349 PolarHBondContact O-N 2.97Å
350	Y	95.7	Very high	93.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-78.5	-46.5	176.1	175.2	-97.9	0	0	0	112.1	A180 Y183 A248 S249 D250 V254 R346 S347 H348 E352 E353 S354	A180-Y350 HydrophobicContact CB-CD1 3.56Å; A180-Y350 HydrophobicContact CB-CD2 4.16Å; A180-Y350 HydrophobicContact CB-CE1 4.16Å; A180-Y350 HydrophobicContact CB-CG 3.55Å; Y183-Y350 HydrophobicContact CD1-CD2 4.13Å; Y183-Y350 HydrophobicContact CD2-CD2 4.34Å; Y183-Y350 AromaticContact CG-CD2 3.8Å; Y183-Y350 HydrophobicContact CG-CD2 3.8Å; Y183-Y350 HydrophobicContact CG-CE2 4.41Å; A248-Y350 PolarHBondContact O-OH 3Å; S249-Y350 WeakPolarHBondContact CA-OH 3.12Å; S249-Y350 PolarHBondContact O-OH 2.78Å; D250-Y350 VanDerWaalsContact C-OH 3.28Å; D250-Y350 PolarHBondContact N-OH 2.97Å; D250-Y350 PolarHBondContact O-OH 2.84Å; V254-Y350 HydrophobicContact CB-CD2 4.5Å; V254-Y350 HydrophobicContact CB-CE2 3.78Å; V254-Y350 HydrophobicContact CG1-CD2 4.15Å; V254-Y350 HydrophobicContact CG1-CE2 3.92Å; V254-Y350 HydrophobicContact CG2-CE2 3.66Å; V254-Y350 WeakPolarHBondContact CG2-OH 3.48Å; R346-Y350 PolarHBondContact O-N 3.35Å; S347-Y350 PolarHBondContact O-N 3.44Å; H348-Y350 VanDerWaalsContact C-N 3.26Å; H348-Y350 PolarHBondContact O-N 3.4Å; Y350-E352 PolarHBondContact O-N 3.26Å; Y350-E353 PolarHBondContact O-N 3.09Å; Y350-E353 VanDerWaalsContact O-N 3.13Å; Y350-S354 PolarHBondContact O-N 2.95Å
351	H	95.5	Very high	93.2	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.009	17%	0.17	C	C	.	.	H	α-helix	trans	-64.9	-23.4	178.3	-74.9	97.1	0	0	0	112.9	S347 H348 L355 L720 I756 S761	S347-H351 WeakPolarHBondContact O-CB 3.45Å; S347-H351 PolarHBondContact O-N 2.99Å; S347-H351 PolarHBondContact O-ND1 2.84Å; S347-H351 PolarHBondContact OG-CE1 2.67Å; S347-H351 VanDerWaalsContact OG-CE1 3.29Å; S347-H351 PolarHBondContact OG-ND1 2.64Å; S347-H351 VanDerWaalsContact OG-ND1 3.17Å; H348-H351 PolarHBondContact O-N 2.94Å; H351-L355 WeakPolarHBondContact O-CB 3.49Å; H351-L355 PolarHBondContact O-N 2.86Å; H351-L720 HydrophobicContact CB-CD2 4Å; H351-I756 HydrophobicContact CB-CD1 4.46Å; H351-S761 WeakPolarHBondContact NE2-CB 3.16Å; H351-S761 PolarHBondContact NE2-OG 3.07Å
352	E	95.4	Very high	93	Very high	58 Å²	58	36.2 Å²	36.2	27%	0.271	19%	0.189	S	C	.	.	H	α-helix	trans	-59.1	-48.7	169.5	-167.2	-156.1	158.3	0	0	112.1	K263 H348 Y350 K356 P718	K263-E352 IonicContact NZ-OE2 3.68Å; K263-E352 PolarHBondContact NZ-OE2 2.86Å; H348-E352 WeakPolarHBondContact O-CB 3.34Å; H348-E352 PolarHBondContact O-N 2.79Å; Y350-E352 PolarHBondContact O-N 3.26Å; E352-K356 WeakPolarHBondContact O-CG 3.49Å; E352-K356 PolarHBondContact O-N 3.24Å; E352-K356 VanDerWaalsContact O-N 3.14Å; E352-K356 WeakPolarHBondContact OE1-CE 3.12Å; E352-K356 IonicContact OE1-NZ 3.59Å; E352-K356 PolarHBondContact OE1-NZ 2.68Å; E352-P718 HydrophobicContact CB-CG 4.19Å; E352-P718 HydrophobicContact CG-CG 4.07Å
353	E	95.4	Very high	93	Very high	9 Å²	9	36.5 Å²	36.5	4%	0.042	20%	0.2	C	C	.	.	H	α-helix	trans	-74.4	-39.3	179.2	-59.6	-45	117.6	0	0	112.1	Y183 V254 N258 K263 Y350 L355 K356 L357	Y183-E353 HydrophobicContact CE1-CG 4.42Å; V254-E353 HydrophobicContact CG1-CB 3.64Å; N258-E353 PolarHBondContact ND2-OE2 3.09Å; K263-E353 HydrophobicContact CD-CG 3.77Å; K263-E353 WeakPolarHBondContact CE-OE1 3.34Å; K263-E353 IonicContact NZ-OE1 3.44Å; K263-E353 PolarHBondContact NZ-OE1 3.5Å; Y350-E353 PolarHBondContact O-N 3.09Å; Y350-E353 VanDerWaalsContact O-N 3.13Å; E353-L355 VanDerWaalsContact C-N 3.26Å; E353-L355 PolarHBondContact O-N 3.44Å; E353-K356 WeakPolarHBondContact O-CB 3.45Å; E353-K356 PolarHBondContact O-N 3.27Å; E353-K356 VanDerWaalsContact O-N 3.12Å; E353-K356 IonicContact OE1-NZ 2.67Å; E353-K356 PolarHBondContact OE1-NZ 2.67Å; E353-K356 WeakPolarHBondContact OE2-CD 3.47Å; E353-K356 IonicContact OE2-NZ 2.65Å; E353-K356 PolarHBondContact OE2-NZ 3.32Å; E353-L357 PolarHBondContact O-N 3.08Å
354	S	95.2	Very high	93	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.2	-32.3	176.4	-166.7	0	0	0	0	112.4	L247 A248 Y350 S358	L247-S354 WeakPolarHBondContact CB-OG 3.43Å; A248-S354 WeakPolarHBondContact CA-OG 3.16Å; A248-S354 PolarHBondContact N-OG 2.95Å; A248-S354 PolarHBondContact O-OG 3.27Å; Y350-S354 PolarHBondContact O-N 2.95Å; S354-S358 PolarHBondContact O-N 3.01Å; S354-S358 PolarHBondContact O-OG 2.63Å
355	L	94.6	Very high	93	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-66.9	-45.9	168.6	-178.4	66.9	0	0	0	112	V241 L247 H351 E353 L357 S358 I359 V716 P718 A754 I756 V763	V241-L355 HydrophobicContact CG2-CD1 4.06Å; L247-L355 HydrophobicContact CD2-CD1 4.08Å; H351-L355 WeakPolarHBondContact O-CB 3.49Å; H351-L355 PolarHBondContact O-N 2.86Å; E353-L355 VanDerWaalsContact C-N 3.26Å; E353-L355 PolarHBondContact O-N 3.44Å; L355-L357 VanDerWaalsContact C-N 3.25Å; L355-L357 PolarHBondContact O-N 2.93Å; L355-S358 PolarHBondContact O-N 3.28Å; L355-I359 WeakPolarHBondContact O-CG1 3.48Å; L355-I359 PolarHBondContact O-N 2.84Å; L355-V716 HydrophobicContact CD2-CG1 3.94Å; L355-P718 HydrophobicContact CD2-CB 3.86Å; L355-A754 HydrophobicContact CD1-CB 4.05Å; L355-A754 HydrophobicContact CD2-CB 3.56Å; L355-A754 HydrophobicContact CG-CB 4.49Å; L355-I756 HydrophobicContact CD2-CD1 4.4Å; L355-V763 HydrophobicContact CD1-CG2 4.12Å
356	K	92.8	Very high	93	Very high	87 Å²	87	41.8 Å²	41.8	38%	0.378	23%	0.23	S	C	.	.	H	α-helix	trans	-56.9	-40.1	177.2	-71.2	166.8	-168.8	168.2	0	111.8	E352 E353 S358 I359	E352-K356 WeakPolarHBondContact O-CG 3.49Å; E352-K356 PolarHBondContact O-N 3.24Å; E352-K356 VanDerWaalsContact O-N 3.14Å; E352-K356 WeakPolarHBondContact OE1-CE 3.12Å; E352-K356 IonicContact OE1-NZ 3.59Å; E352-K356 PolarHBondContact OE1-NZ 2.68Å; E353-K356 WeakPolarHBondContact O-CB 3.45Å; E353-K356 PolarHBondContact O-N 3.27Å; E353-K356 VanDerWaalsContact O-N 3.12Å; E353-K356 IonicContact OE1-NZ 2.67Å; E353-K356 PolarHBondContact OE1-NZ 2.67Å; E353-K356 WeakPolarHBondContact OE2-CD 3.47Å; E353-K356 IonicContact OE2-NZ 2.65Å; E353-K356 PolarHBondContact OE2-NZ 3.32Å; K356-S358 VanDerWaalsContact C-N 3.29Å; K356-S358 PolarHBondContact O-N 3.36Å; K356-I359 PolarHBondContact O-N 3.1Å
357	L	91.4	Very high	92.9	Very high	82 Å²	82	41.5 Å²	41.5	43%	0.429	23%	0.229	S	C	.	.	H	α-helix	trans	-63.1	-31	173.6	-93.8	175.1	0	0	0	114.3	S253 V254 A257 E353 L355 I359	S253-L357 WeakPolarHBondContact O-CD1 3.33Å; V254-L357 HydrophobicContact CB-CD1 4.46Å; V254-L357 HydrophobicContact CG2-CD1 4.2Å; A257-L357 HydrophobicContact CB-CD1 3.95Å; A257-L357 HydrophobicContact CB-CD2 3.54Å; A257-L357 HydrophobicContact CB-CG 3.91Å; E353-L357 PolarHBondContact O-N 3.08Å; L355-L357 VanDerWaalsContact C-N 3.25Å; L355-L357 PolarHBondContact O-N 2.93Å; L357-I359 VanDerWaalsContact C-N 3.31Å
358	S	91.2	Very high	92.6	Very high	32 Å²	32	46 Å²	46	22%	0.224	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	2.9	-175.9	-55.8	0	0	0	0	113.4	L247 S354 L355 K356	L247-S358 VanDerWaalsContact CD2-CB 3.48Å; L247-S358 WeakPolarHBondContact CD2-OG 3.39Å; S354-S358 PolarHBondContact O-N 3.01Å; S354-S358 PolarHBondContact O-OG 2.63Å; L355-S358 PolarHBondContact O-N 3.28Å; K356-S358 VanDerWaalsContact C-N 3.29Å; K356-S358 PolarHBondContact O-N 3.36Å
359	I	91.6	Very high	92.3	Very high	14 Å²	14	48 Å²	48	7%	0.072	26%	0.258	C	S	.	.	S	Bend	trans	-87.6	120.5	179.7	-74.8	169.6	0	0	0	110.5	M240 V241 L355 K356 L357 T361 L698	M240-I359 HydrophobicContact CB-CG2 4.2Å; M240-I359 WeakPolarHBondContact O-CA 3.43Å; V241-I359 HydrophobicContact CG2-CB 4.47Å; V241-I359 HydrophobicContact CG2-CD1 4.44Å; V241-I359 HydrophobicContact CG2-CG1 3.46Å; V241-I359 VanDerWaalsContact CG2-CG1 3.46Å; L355-I359 WeakPolarHBondContact O-CG1 3.48Å; L355-I359 PolarHBondContact O-N 2.84Å; K356-I359 PolarHBondContact O-N 3.1Å; L357-I359 VanDerWaalsContact C-N 3.31Å; I359-T361 HydrophobicContact CG2-CG2 4.23Å; I359-T361 PolarHBondContact O-N 2.93Å; I359-L698 HydrophobicContact CD1-CD1 3.63Å; I359-L698 HydrophobicContact CG2-CD1 4.24Å; I359-L698 HydrophobicContact CG2-CD2 3.91Å
360	V	88.8	Confident	92.1	Very high	82 Å²	82	47.5 Å²	47.5	50%	0.497	26%	0.255	S	S	.	.			trans	-67.2	120.1	174.9	-179.5	0	0	0	0	109.1	T236 M240	T236-V360 WeakPolarHBondContact CB-O 3.39Å; T236-V360 PolarHBondContact OG1-O 3Å; M240-V360 PolarHBondContact O-N 2.6Å
361	T	89.1	Confident	91.9	Very high	71 Å²	71	49.2 Å²	49.2	44%	0.436	26%	0.264	S	S	.	.			trans	-111.8	132	178.8	56	0	0	0	0	111.6	N234 I235 I359 G363	N234-T361 HydrophobicContact CB-CG2 3.8Å; I235-T361 CarbonylContact O-C 3.56Å; I235-T361 VanDerWaalsContact O-CA 3.28Å; I235-T361 WeakPolarHBondContact O-CA 3.34Å; I359-T361 HydrophobicContact CG2-CG2 4.23Å; I359-T361 PolarHBondContact O-N 2.93Å; T361-G363 PolarHBondContact O-N 3.23Å
362	N	88.6	Confident	91.7	Very high	81 Å²	81	49.5 Å²	49.5	43%	0.433	27%	0.266	S	S	.	.			trans	-101.6	42	-175.6	-67.2	-15.8	0	0	0	110.7	I235 D237	I235-N362 HydrophobicContact CG2-CB 4.41Å; I235-N362 PolarHBondContact O-N 2.73Å; D237-N362 PolarHBondContact OD1-ND2 2.93Å; D237-N362 VanDerWaalsContact OD1-ND2 3.15Å; D237-N362 PolarHBondContact OD2-ND2 3.23Å
363	G	90.2	Very high	91.4	Very high	43 Å²	43	48.3 Å²	48.3	44%	0.443	26%	0.261	S	S	.	.			trans	85.8	-164.4	-170.4	0	0	0	0	0	113.4	I235 T361	I235-G363 PolarHBondContact N-O 2.84Å; T361-G363 PolarHBondContact O-N 3.23Å
364	S	92.4	Very high	90.9	Very high	69 Å²	69	49 Å²	49	48%	0.483	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	164.5	-175.2	65.1	0	0	0	0	112.8	V233	V233-S364 CarbonylContact O-C 3.33Å; V233-S364 WeakPolarHBondContact O-CA 3.3Å; V233-S364 VanDerWaalsContact O-CB 3.29Å; V233-S364 WeakPolarHBondContact O-CB 3.38Å
365	K	92.4	Very high	89.9	Confident	61 Å²	61	51.4 Å²	51.4	27%	0.265	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	154.1	178.7	-152.8	173.6	-167.7	-179.8	0	111.1	T232 V233 I235 H369 H711	T232-K365 CarbonylContact C-O 3.59Å; T232-K365 WeakPolarHBondContact CA-O 3.42Å; T232-K365 WeakPolarHBondContact CB-O 3.28Å; V233-K365 PolarHBondContact N-O 2.7Å; V233-K365 PolarHBondContact O-N 3.29Å; I235-K365 HydrophobicContact CD1-CB 4.24Å; I235-K365 HydrophobicContact CG1-CB 4.33Å; K365-H369 HydrophobicContact CD-CB 3.88Å; K365-H369 HydrophobicContact CG-CB 4.21Å; K365-H711 PolarHBondContact NZ-CD2 3.48Å; K365-H711 PolarHBondContact NZ-NE2 2.69Å
366	K	92.5	Very high	88.4	Confident	98 Å²	98	54.2 Å²	54.2	43%	0.426	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	140.4	167.9	-73.5	-73.7	-170.8	168.9	0	110.8	G231 T232 F368 H369	G231-K366 WeakPolarHBondContact O-CA 3.29Å; G231-K366 WeakPolarHBondContact O-CD 3.41Å; T232-K366 HydrophobicContact CG2-CD 4.04Å; K366-F368 HydrophobicContact CB-CD1 3.8Å; K366-F368 HydrophobicContact CB-CE1 3.46Å; K366-F368 VanDerWaalsContact CB-CE1 3.46Å; K366-F368 HydrophobicContact CB-CZ 4.1Å; K366-F368 HydrophobicContact CD-CE1 4.38Å; K366-F368 HydrophobicContact CG-CE1 3.88Å; K366-F368 PolarHBondContact O-N 2.72Å; K366-H369 WeakPolarHBondContact O-CB 3.46Å; K366-H369 PolarHBondContact O-N 3.47Å
367	V	92	Very high	86.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-73.1	-27.2	-169.8	173.5	0	0	0	0	114.4	A229 G231 V233 H369 L370 N677 L679	A229-V367 HydrophobicContact CB-CG1 4.41Å; G231-V367 PolarHBondContact O-N 2.85Å; V233-V367 HydrophobicContact CB-CG2 3.84Å; V233-V367 HydrophobicContact CG1-CG2 3.9Å; V367-H369 PolarHBondContact O-N 2.99Å; V367-L370 HydrophobicContact CG1-CD1 4.18Å; V367-L370 WeakPolarHBondContact O-CB 3.14Å; V367-L370 WeakPolarHBondContact O-CG 3.2Å; V367-L370 PolarHBondContact O-N 3.27Å; V367-N677 HydrophobicContact CB-CB 4.23Å; V367-N677 HydrophobicContact CG2-CB 3.36Å; V367-L679 HydrophobicContact CG1-CD1 3.82Å; V367-L679 HydrophobicContact CG1-CD2 3.69Å; V367-L679 HydrophobicContact CG1-CG 3.75Å
368	F	88.4	Confident	85	Confident	96 Å²	96	51.8 Å²	51.8	42%	0.421	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-61.4	-15.3	171.8	72	-101.8	0	0	0	113.8	K366 L370 E667	K366-F368 HydrophobicContact CB-CD1 3.8Å; K366-F368 HydrophobicContact CB-CE1 3.46Å; K366-F368 VanDerWaalsContact CB-CE1 3.46Å; K366-F368 HydrophobicContact CB-CZ 4.1Å; K366-F368 HydrophobicContact CD-CE1 4.38Å; K366-F368 HydrophobicContact CG-CE1 3.88Å; K366-F368 PolarHBondContact O-N 2.72Å; F368-L370 VanDerWaalsContact C-N 3.34Å; F368-E667 WeakPolarHBondContact CD1-OE1 3.33Å
369	H	89.5	Confident	83.4	Confident	96 Å²	96	54 Å²	54	44%	0.444	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-85.7	3.1	171.9	-69.6	-54.4	0	0	0	114.4	K365 K366 V367	K365-H369 HydrophobicContact CD-CB 3.88Å; K365-H369 HydrophobicContact CG-CB 4.21Å; K366-H369 WeakPolarHBondContact O-CB 3.46Å; K366-H369 PolarHBondContact O-N 3.47Å; V367-H369 PolarHBondContact O-N 2.99Å
370	L	91.7	Very high	81.1	Confident	11 Å²	11	59.3 Å²	59.3	6%	0.058	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-81	130.4	171.4	-64.1	-170.8	0	0	0	110.5	V233 V367 F368 T372 V696 T699 H711 P713	V233-L370 HydrophobicContact CG1-CD1 4.13Å; V233-L370 HydrophobicContact CG1-CD2 4.01Å; V233-L370 HydrophobicContact CG1-CG 4.21Å; V367-L370 HydrophobicContact CG1-CD1 4.18Å; V367-L370 WeakPolarHBondContact O-CB 3.14Å; V367-L370 WeakPolarHBondContact O-CG 3.2Å; V367-L370 PolarHBondContact O-N 3.27Å; F368-L370 VanDerWaalsContact C-N 3.34Å; L370-T372 HydrophobicContact CB-CG2 3.81Å; L370-T372 PolarHBondContact O-N 3.08Å; L370-T372 VanDerWaalsContact O-N 3.15Å; L370-V696 HydrophobicContact CD1-CB 4.3Å; L370-V696 HydrophobicContact CD1-CG1 3.98Å; L370-V696 HydrophobicContact CD1-CG2 4.5Å; L370-T699 HydrophobicContact CD2-CG2 3.95Å; L370-T699 VanDerWaalsContact CD2-OG1 3.31Å; L370-T699 WeakPolarHBondContact CD2-OG1 3.42Å; L370-H711 WeakPolarHBondContact CA-O 3.36Å; L370-H711 HydrophobicContact CD2-CB 3.68Å; L370-P713 HydrophobicContact CD1-CG 4.26Å
371	L	91.8	Very high	79	Confident	36 Å²	36	61 Å²	61	19%	0.188	34%	0.338	C	S	.	.			trans	-71.2	102.3	155.6	-178.8	76.3	0	0	0	106.1	E373 V704 Q710 H711 V712 P713 S748	L371-E373 WeakPolarHBondContact CD1-O 3.35Å; L371-E373 VanDerWaalsContact CG-O 3.26Å; L371-E373 WeakPolarHBondContact CG-O 3.34Å; L371-V704 HydrophobicContact CD2-CB 4.39Å; L371-V704 HydrophobicContact CD2-CG1 3.98Å; L371-V704 HydrophobicContact CD2-CG2 3.93Å; L371-Q710 HydrophobicContact CB-CB 4.34Å; L371-Q710 HydrophobicContact CD2-CB 4.43Å; L371-H711 PolarHBondContact N-O 3.34Å; L371-V712 HydrophobicContact CB-CG1 4.37Å; L371-V712 HydrophobicContact CD2-CG1 4.21Å; L371-P713 WeakPolarHBondContact O-CD 3.5Å; L371-S748 PolarHBondContact O-OG 3.07Å
372	T	90.3	Very high	76.8	Confident	9 Å²	9	60.8 Å²	60.8	6%	0.055	34%	0.336	C	S	.	.			trans	-90.8	-27.8	178.4	67.2	0	0	0	0	112.4	Q226 L370 L679 K681 P713 H746 S747 S748	Q226-T372 PolarHBondContact OE1-OG1 3.23Å; L370-T372 HydrophobicContact CB-CG2 3.81Å; L370-T372 PolarHBondContact O-N 3.08Å; L370-T372 VanDerWaalsContact O-N 3.15Å; T372-L679 HydrophobicContact CG2-CD2 3.92Å; T372-K681 WeakPolarHBondContact OG1-CE 3.47Å; T372-K681 PolarHBondContact OG1-NZ 2.81Å; T372-P713 HydrophobicContact CG2-CG 4.42Å; T372-H746 CarbonylContact O-C 3.59Å; T372-H746 WeakPolarHBondContact O-CA 3.24Å; T372-S747 PolarHBondContact O-N 3.02Å; T372-S747 VanDerWaalsContact O-N 3.16Å; T372-S748 WeakPolarHBondContact CA-OG 3.5Å; T372-S748 WeakPolarHBondContact O-CB 3.32Å; T372-S748 PolarHBondContact O-N 2.65Å; T372-S748 VanDerWaalsContact O-N 3.17Å; T372-S748 PolarHBondContact O-OG 3.31Å
373	E	90.4	Very high	74.4	Confident	32 Å²	32	63.7 Å²	63.7	15%	0.15	35%	0.347	C	S	.	.	S	Bend	trans	-112	142.8	174.7	-60	-49.6	137.4	0	0	112.6	F223 L371 K681 S747	F223-E373 HydrophobicContact CD1-CG 4.04Å; F223-E373 HydrophobicContact CD2-CG 4.46Å; F223-E373 HydrophobicContact CE1-CG 3.83Å; F223-E373 HydrophobicContact CE2-CG 4.27Å; F223-E373 HydrophobicContact CG-CG 4.34Å; F223-E373 HydrophobicContact CZ-CG 3.93Å; L371-E373 WeakPolarHBondContact CD1-O 3.35Å; L371-E373 VanDerWaalsContact CG-O 3.26Å; L371-E373 WeakPolarHBondContact CG-O 3.34Å; E373-K681 IonicContact OE1-NZ 2.63Å; E373-K681 PolarHBondContact OE1-NZ 2.71Å; E373-S747 WeakPolarHBondContact CA-OG 3.45Å; E373-S747 WeakPolarHBondContact OE2-CB 3.46Å; E373-S747 PolarHBondContact OE2-N 3.42Å; E373-S747 VanDerWaalsContact OE2-N 3.13Å; E373-S747 PolarHBondContact OE2-OG 3.33Å
374	L	83.3	Confident	71.5	Confident	23 Å²	23	66.4 Å²	66.4	12%	0.12	35%	0.348	C	S	.	.			trans	-74.9	147.7	173.6	-68	176.8	0	0	0	112	Q379 S747	L374-Q379 HydrophobicContact CB-CG 3.86Å; L374-Q379 PolarHBondContact O-NE2 2.83Å; L374-S747 WeakPolarHBondContact CD1-O 3.37Å; L374-S747 PolarHBondContact N-OG 3.37Å
375	P	74.8	Confident	68.9	Low	51 Å²	51	66.1 Å²	66.1	33%	0.331	35%	0.35	S	S	.	.			trans	-57.6	143.2	168.3	-22.4	33.6	0	0	0	111.7	S377 E378 Q379 V704	P375-S377 PolarHBondContact O-N 3.17Å; P375-E378 PolarHBondContact O-N 3.38Å; P375-Q379 PolarHBondContact O-N 3.47Å; P375-Q379 VanDerWaalsContact O-N 3.11Å; P375-V704 HydrophobicContact CG-CG1 4.18Å
376	A	62.5	Low	66.6	Low	65 Å²	65	66 Å²	66	54%	0.537	36%	0.357	S	S	.	.	H	α-helix	trans	-55	-29	-177	0	0	0	0	0	114	Q379 Q380	A376-Q379 PolarHBondContact O-N 3.37Å; A376-Q380 WeakPolarHBondContact O-CB 3.42Å; A376-Q380 WeakPolarHBondContact O-CG 3.43Å; A376-Q380 PolarHBondContact O-N 3.02Å
377	S	54.4	Low	64	Low	76 Å²	76	66.3 Å²	66.3	53%	0.531	37%	0.367	S	S	.	.	H	α-helix	trans	-68.2	-33.5	175	49.6	0	0	0	0	114	P375 L381	P375-S377 PolarHBondContact O-N 3.17Å; S377-L381 PolarHBondContact O-N 2.96Å
378	E	59	Low	61.3	Low	41 Å²	41	75.6 Å²	75.6	19%	0.192	40%	0.402	C	S	.	.	H	α-helix	trans	-80	-34.8	173.3	-67.6	-169.6	-179.3	0	0	110.9	P375 L381 T382 G705	P375-E378 PolarHBondContact O-N 3.38Å; E378-L381 PolarHBondContact O-N 3.26Å; E378-T382 PolarHBondContact O-N 3.41Å; E378-T382 VanDerWaalsContact O-N 3.15Å; E378-T382 PolarHBondContact O-OG1 3.24Å; E378-G705 PolarHBondContact OE1-N 3.1Å
379	Q	57.4	Low	58.6	Low	80 Å²	80	74.2 Å²	74.2	37%	0.374	41%	0.414	S	S	.	.	H	α-helix	trans	-60.1	-45.1	171.9	-65	179.8	-21.8	0	0	111.6	L374 P375 A376 T382 Q383 S747	L374-Q379 HydrophobicContact CB-CG 3.86Å; L374-Q379 PolarHBondContact O-NE2 2.83Å; P375-Q379 PolarHBondContact O-N 3.47Å; P375-Q379 VanDerWaalsContact O-N 3.11Å; A376-Q379 PolarHBondContact O-N 3.37Å; Q379-T382 PolarHBondContact O-N 3Å; Q379-Q383 WeakPolarHBondContact O-CB 3.26Å; Q379-Q383 PolarHBondContact O-N 2.66Å; Q379-Q383 VanDerWaalsContact O-N 3.08Å; Q379-S747 PolarHBondContact NE2-OG 3.39Å
380	Q	42.6	Very low	55.7	Low	124 Å²	124	74.6 Å²	74.6	58%	0.579	43%	0.427	S	S	*	.	H	α-helix	trans	-62.7	-39.8	175.1	-79.4	-178.9	-29.7	0	0	112.9	A376 T382 Q383 E384	A376-Q380 WeakPolarHBondContact O-CB 3.42Å; A376-Q380 WeakPolarHBondContact O-CG 3.43Å; A376-Q380 PolarHBondContact O-N 3.02Å; Q380-T382 PolarHBondContact O-N 3.16Å; Q380-Q383 CarbonylContact O-C 3.57Å; Q380-Q383 PolarHBondContact O-N 3.5Å; Q380-Q383 VanDerWaalsContact O-N 3.17Å; Q380-E384 PolarHBondContact O-N 2.98Å
381	L	45.2	Very low	52.7	Low	119 Å²	119	80 Å²	80	62%	0.623	46%	0.46	S	S	*	.	H	α-helix	trans	-62.5	-43	177.3	-84.5	165.4	0	0	0	112.5	S377 E378 Q383 E384 A385	S377-L381 PolarHBondContact O-N 2.96Å; E378-L381 PolarHBondContact O-N 3.26Å; L381-Q383 VanDerWaalsContact C-N 3.28Å; L381-Q383 PolarHBondContact O-N 2.92Å; L381-E384 PolarHBondContact O-N 3.29Å; L381-A385 WeakPolarHBondContact O-CB 3.2Å; L381-A385 PolarHBondContact O-N 2.94Å
382	T	43.8	Very low	49.7	Very low	66 Å²	66	83.5 Å²	83.5	41%	0.405	49%	0.488	S	S	.	.	H	α-helix	trans	-62.5	-37.2	174	-55.1	0	0	0	0	111.4	E378 Q379 Q380 S386	E378-T382 PolarHBondContact O-N 3.41Å; E378-T382 VanDerWaalsContact O-N 3.15Å; E378-T382 PolarHBondContact O-OG1 3.24Å; Q379-T382 PolarHBondContact O-N 3Å; Q380-T382 PolarHBondContact O-N 3.16Å; T382-S386 PolarHBondContact O-N 3.13Å
383	Q	38.8	Very low	47	Very low	142 Å²	142	89.2 Å²	89.2	66%	0.664	52%	0.522	S	S	*	.	H	α-helix	trans	-76.6	-33.9	179.9	-159.1	167.9	19.8	0	0	113.3	Q379 Q380 L381 S386	Q379-Q383 WeakPolarHBondContact O-CB 3.26Å; Q379-Q383 PolarHBondContact O-N 2.66Å; Q379-Q383 VanDerWaalsContact O-N 3.08Å; Q380-Q383 CarbonylContact O-C 3.57Å; Q380-Q383 PolarHBondContact O-N 3.5Å; Q380-Q383 VanDerWaalsContact O-N 3.17Å; L381-Q383 VanDerWaalsContact C-N 3.28Å; L381-Q383 PolarHBondContact O-N 2.92Å; Q383-S386 VanDerWaalsContact O-CB 3.3Å; Q383-S386 WeakPolarHBondContact O-CB 3.48Å
384	E	28.4	Very low	44.1	Very low	99 Å²	99	95.6 Å²	95.6	46%	0.463	55%	0.552	S	S	.	*	H	α-helix	trans	-71.9	-37.9	172.3	-83.5	-162.2	-151.1	0	0	112.6	Q380 L381 S386 V387 R388	Q380-E384 PolarHBondContact O-N 2.98Å; L381-E384 PolarHBondContact O-N 3.29Å; E384-S386 PolarHBondContact O-N 3.36Å; E384-V387 PolarHBondContact O-N 2.9Å; E384-R388 PolarHBondContact O-N 3.3Å; E384-R388 IonicContact OE2-CZ 3.71Å; E384-R388 IonicContact OE2-NE 3.9Å; E384-R388 IonicContact OE2-NH2 2.72Å; E384-R388 PolarHBondContact OE2-NH2 2.73Å
385	A	37.6	Very low	41.6	Very low	64 Å²	64	102 Å²	102	53%	0.529	59%	0.586	S	S	.	*	H	α-helix	trans	-57.8	-39.4	174	0	0	0	0	0	111.3	L381 V387 R388	L381-A385 WeakPolarHBondContact O-CB 3.2Å; L381-A385 PolarHBondContact O-N 2.94Å; A385-V387 VanDerWaalsContact C-N 3.27Å; A385-V387 PolarHBondContact O-N 3.34Å; A385-R388 PolarHBondContact O-N 2.69Å
386	S	43.8	Very low	39.6	Very low	58 Å²	58	107.9 Å²	107.9	41%	0.406	61%	0.607	S	S	.	*	H	α-helix	trans	-57.2	-33.9	173.8	-164.3	0	0	0	0	113.6	T382 Q383 E384 Q775	T382-S386 PolarHBondContact O-N 3.13Å; Q383-S386 VanDerWaalsContact O-CB 3.3Å; Q383-S386 WeakPolarHBondContact O-CB 3.48Å; E384-S386 PolarHBondContact O-N 3.36Å; S386-Q775 PolarHBondContact OG-NE2 3.25Å
387	V	39.3	Very low	38.2	Very low	104 Å²	104	107.8 Å²	107.8	63%	0.63	61%	0.612	S	S	*	*	H	α-helix	trans	-79.7	-35.5	-179.3	-179.8	0	0	0	0	112.2	E384 A385 G389 C390	E384-V387 PolarHBondContact O-N 2.9Å; A385-V387 VanDerWaalsContact C-N 3.27Å; A385-V387 PolarHBondContact O-N 3.34Å; V387-G389 PolarHBondContact O-N 3.39Å; V387-G389 VanDerWaalsContact O-N 3.13Å; V387-C390 PolarHBondContact O-N 3.06Å
388	R	33.5	Very low	37.3	Very low	196 Å²	196	111.1 Å²	111.1	74%	0.74	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-3.9	-172.7	-63.2	-176.6	-164.2	-159.6	6.7	114.7	E384 A385	E384-R388 PolarHBondContact O-N 3.3Å; E384-R388 IonicContact OE2-CZ 3.71Å; E384-R388 IonicContact OE2-NE 3.9Å; E384-R388 IonicContact OE2-NH2 2.72Å; E384-R388 PolarHBondContact OE2-NH2 2.73Å; A385-R388 PolarHBondContact O-N 2.69Å
389	G	32.6	Very low	36.1	Very low	66 Å²	66	115.4 Å²	115.4	68%	0.68	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-14	169.9	0	0	0	0	0	114.9	V387 V391	V387-G389 PolarHBondContact O-N 3.39Å; V387-G389 VanDerWaalsContact O-N 3.13Å; G389-V391 PolarHBondContact O-N 3.4Å
390	C	27.6	Very low	35.1	Very low	105 Å²	105	119.5 Å²	119.5	71%	0.709	66%	0.664	S	S	*	*			trans	-84.2	101.6	-173	-166.4	0	0	0	0	112.6	V387 S392	V387-C390 PolarHBondContact O-N 3.06Å; C390-S392 PolarHBondContact O-N 3.46Å
391	V	29.6	Very low	35	Very low	123 Å²	123	122.1 Å²	122.1	75%	0.745	68%	0.676	S	S	*	*			trans	-72	121.3	156.9	177.3	0	0	0	0	107.4	G389 V393	G389-V391 PolarHBondContact O-N 3.4Å; V391-V393 VanDerWaalsContact C-N 3.35Å; V391-V393 PolarHBondContact O-N 2.83Å
392	S	28.5	Very low	34.8	Very low	111 Å²	111	120.9 Å²	120.9	78%	0.776	67%	0.674	S	S	*	*			trans	-68.4	86.3	-178.9	46.8	0	0	0	0	112.2	C390	C390-S392 PolarHBondContact O-N 3.46Å
393	V	33.4	Very low	34.4	Very low	128 Å²	128	123.7 Å²	123.7	78%	0.776	69%	0.686	S	S	*	*			trans	-71.6	126.8	159	178.7	0	0	0	0	107.4	V391 N395	V391-V393 VanDerWaalsContact C-N 3.35Å; V391-V393 PolarHBondContact O-N 2.83Å; V393-N395 PolarHBondContact O-N 2.86Å; V393-N395 VanDerWaalsContact O-N 3.09Å
394	E	29.1	Very low	34.6	Very low	166 Å²	166	123.6 Å²	123.6	78%	0.776	69%	0.689	S	S	*	*			trans	-57.8	115.3	-180	-64.2	-178.7	127.6	0	0	110.5	K396	E394-K396 PolarHBondContact O-N 2.72Å
395	N	32.8	Very low	35.4	Very low	157 Å²	157	123.7 Å²	123.7	84%	0.84	70%	0.697	S	S	*	*			trans	-75.6	73.3	177.7	-172.2	32.8	0	0	0	110.3	V393 G397	V393-N395 PolarHBondContact O-N 2.86Å; V393-N395 VanDerWaalsContact O-N 3.09Å; N395-G397 VanDerWaalsContact C-N 3.28Å; N395-G397 PolarHBondContact O-N 2.71Å
396	K	32.4	Very low	35.7	Very low	176 Å²	176	128.1 Å²	128.1	77%	0.765	71%	0.712	S	S	*	*			trans	-66.4	95.4	160.5	-73.9	-160.9	175	-168.1	0	107.5	E394 L398	E394-K396 PolarHBondContact O-N 2.72Å; K396-L398 PolarHBondContact O-N 2.66Å
397	G	32.9	Very low	35.7	Very low	63 Å²	63	132.5 Å²	132.5	65%	0.649	73%	0.73	S	S	*	*			trans	-53.7	113.3	173.7	0	0	0	0	0	109.3	N395 D399	N395-G397 VanDerWaalsContact C-N 3.28Å; N395-G397 PolarHBondContact O-N 2.71Å; G397-D399 PolarHBondContact O-N 2.58Å
398	L	35.3	Very low	35.8	Very low	145 Å²	145	136.4 Å²	136.4	76%	0.759	74%	0.741	S	S	*	*			trans	-75.7	105.2	161	-67.8	178.2	0	0	0	105.7	K396 F400	K396-L398 PolarHBondContact O-N 2.66Å; L398-F400 HydrophobicContact CB-CE2 4.14Å; L398-F400 VanDerWaalsContact O-CD2 3.28Å; L398-F400 WeakPolarHBondContact O-CD2 3.28Å
399	D	33.4	Very low	36.5	Very low	131 Å²	131	133.6 Å²	133.6	70%	0.701	75%	0.746	S	S	*	*			trans	-60.9	144.6	167	-155.3	-21.6	0	0	0	109.1	G397 E401	G397-D399 PolarHBondContact O-N 2.58Å; D399-E401 PolarHBondContact OD1-N 3Å
400	F	35.5	Very low	36.6	Very low	167 Å²	167	140.8 Å²	140.8	73%	0.732	76%	0.759	S	S	*	*			trans	-120.7	27	-177.2	-85.7	-79.9	0	0	0	112.2	L398 V402	L398-F400 HydrophobicContact CB-CE2 4.14Å; L398-F400 VanDerWaalsContact O-CD2 3.28Å; L398-F400 WeakPolarHBondContact O-CD2 3.28Å; F400-V402 HydrophobicContact CD1-CG2 4.18Å; F400-V402 PolarHBondContact O-N 3.37Å
401	E	41.2	Very low	37.1	Very low	178 Å²	178	139.3 Å²	139.3	83%	0.832	76%	0.762	S	S	*	*			trans	-67	73.6	147.7	-68.7	-159.7	145.8	0	0	110	D399 D403	D399-E401 PolarHBondContact OD1-N 3Å; E401-D403 PolarHBondContact O-N 3.41Å
402	V	40.6	Very low	37.2	Very low	94 Å²	94	143 Å²	143	57%	0.57	77%	0.771	S	S	*	*			trans	-78.4	97.7	161.9	178.8	0	0	0	0	106.6	F400 L404	F400-V402 HydrophobicContact CD1-CG2 4.18Å; F400-V402 PolarHBondContact O-N 3.37Å; V402-L404 HydrophobicContact CG1-CD2 4.03Å; V402-L404 PolarHBondContact O-N 3.38Å
403	D	36	Very low	37.3	Very low	124 Å²	124	143.5 Å²	143.5	66%	0.663	77%	0.77	S	S	*	*			trans	-63.8	123	170.1	-162.3	-12	0	0	0	109.2	E401 T405	E401-D403 PolarHBondContact O-N 3.41Å; D403-T405 WeakPolarHBondContact OD1-CG2 3.35Å; D403-T405 PolarHBondContact OD1-OG1 3.37Å
404	L	43.2	Very low	37.2	Very low	140 Å²	140	143.9 Å²	143.9	73%	0.733	77%	0.772	S	S	*	*			trans	-96.2	15.8	-171	-73.4	173.8	0	0	0	112.9	V402	V402-L404 HydrophobicContact CG1-CD2 4.03Å; V402-L404 PolarHBondContact O-N 3.38Å
405	T	44.3	Very low	37.4	Very low	101 Å²	101	141.6 Å²	141.6	62%	0.62	77%	0.77	S	S	*	*			trans	-80.7	-30.6	-179.1	52.8	0	0	0	0	114.5	D403 L407	D403-T405 WeakPolarHBondContact OD1-CG2 3.35Å; D403-T405 PolarHBondContact OD1-OG1 3.37Å; T405-L407 PolarHBondContact O-N 3.45Å; T405-L407 VanDerWaalsContact O-N 3.11Å
406	D	44	Very low	37.3	Very low	158 Å²	158	143.5 Å²	143.5	85%	0.845	77%	0.77	S	S	*	*			trans	-90.2	60.2	-174.3	-82.6	0.9	0	0	0	113.1
407	L	43.8	Very low	37.4	Very low	149 Å²	149	143.8 Å²	143.8	78%	0.78	78%	0.777	S	S	*	*			trans	-125.1	24.1	174.8	-107.3	169.1	0	0	0	115	T405	T405-L407 PolarHBondContact O-N 3.45Å; T405-L407 VanDerWaalsContact O-N 3.11Å
408	E	41.9	Very low	37.3	Very low	186 Å²	186	147 Å²	147	87%	0.869	79%	0.786	S	S	*	*			trans	-111.8	90	164.5	-73.8	-157.9	142	0	0	112.4
409	T	48.6	Very low	37	Very low	138 Å²	138	151.7 Å²	151.7	85%	0.847	79%	0.793	S	S	*	*			trans	-153.5	111.8	149.6	-71.6	0	0	0	0	109.3
410	F	35.1	Very low	36.7	Very low	216 Å²	216	151.9 Å²	151.9	95%	0.947	80%	0.8	S	S	*	*			trans	-86.3	117.2	176.7	-110.9	-103.5	0	0	0	111.2
411	G	37.8	Very low	36.3	Very low	75 Å²	75	154 Å²	154	77%	0.773	81%	0.809	S	S	*	*			trans	63.6	100.7	147.7	0	0	0	0	0	119.4
412	E	31	Very low	35.7	Very low	200 Å²	200	155.2 Å²	155.2	94%	0.935	81%	0.811	S	S	*	*			trans	-139.3	154.3	144	-165.6	159.8	-149.4	0	0	111
413	T	32.1	Very low	34.8	Very low	122 Å²	122	157 Å²	157	75%	0.748	82%	0.822	S	S	*	*			trans	-106.9	133.3	-177.8	61.4	0	0	0	0	111.1
414	T	30.8	Very low	34.5	Very low	136 Å²	136	159.4 Å²	159.4	83%	0.834	83%	0.83	S	S	*	*				178.5	148.7	125.1	28.4	0	0	0	0	115.8
415	T	32	Very low	33.8	Very low	117 Å²	117	157 Å²	157	72%	0.718	82%	0.824	S	S	*	*			trans	-25.4	127.2	159.2	-27.9	0	0	0	0	118.4
416	K	30.9	Very low	32.9	Very low	197 Å²	197	161.7 Å²	161.7	86%	0.857	84%	0.839	S	S	*	*				168.8	153.8	114.8	-89.5	156.4	-169.1	168.8	0	114.5
417	M	35	Very low	32.2	Very low	183 Å²	183	162.3 Å²	162.3	90%	0.901	84%	0.837	S	S	*	*			trans	-81.7	151	166.3	-67.9	178.3	168.4	0	0	112.3
418	P	31.8	Very low	31.4	Very low	129 Å²	129	162.7 Å²	162.7	84%	0.838	84%	0.84	S	S	*	*			trans	-100.4	157.3	154.4	35.4	-28.9	0	0	0	112.9
419	R	27.4	Very low	30.8	Very low	244 Å²	244	160.9 Å²	160.9	92%	0.921	83%	0.832	S	S	*	*			trans	-108.6	160.5	-179.4	-128.9	174.8	175.6	168.7	-4.1	110.9
420	T	28	Very low	29.7	Very low	136 Å²	136	163.3 Å²	163.3	83%	0.834	83%	0.833	S	S	*	*			trans	-64.8	153.2	177.1	45.7	0	0	0	0	114.4
421	K	27.8	Very low	29.2	Very low	211 Å²	211	156.2 Å²	156.2	92%	0.917	82%	0.821	S	S	*	*			trans	-141.6	159.4	153.8	-78.1	-162.1	176.7	-177.9	0	111.3
422	K	27	Very low	28.8	Very low	204 Å²	204	162.3 Å²	162.3	89%	0.887	83%	0.829	S	S	*	*			trans	-119.3	154.4	178.2	-70.9	179.5	171.9	-176.2	0	110.7
423	T	23.1	Very low	28.7	Very low	130 Å²	130	158.8 Å²	158.8	80%	0.798	83%	0.826	S	S	*	*			trans	-145.7	125.4	147.2	-26.8	0	0	0	0	104.3
424	Q	29.3	Very low	28.3	Very low	176 Å²	176	157 Å²	157	82%	0.822	83%	0.832	S	S	*	*				53.9	138.2	67.3	-84.2	-172.8	-75.7	0	0	114.3
425	S	27.5	Very low	28	Very low	89 Å²	89	154 Å²	154	62%	0.622	83%	0.829	S	S	*	*			cis	176	145.7	-24.5	41.8	0	0	0	0	109
426	Q	27.2	Very low	27.6	Very low	200 Å²	200	154.2 Å²	154.2	94%	0.935	84%	0.835	S	S	*	*			trans	-158.9	167.6	153.7	-116.3	155.4	2.8	0	0	112
427	Q	28.8	Very low	27.4	Very low	170 Å²	170	150.4 Å²	150.4	79%	0.794	83%	0.833	S	S	*	*			trans	-135.9	158.3	-171.5	-65.2	170.6	-116.1	0	0	109.9
428	D	25.5	Very low	27.1	Very low	158 Å²	158	152.7 Å²	152.7	85%	0.845	83%	0.832	S	S	*	*			trans	-158.2	123.6	142	-79.2	-43.3	0	0	0	104.2
429	E	30.3	Very low	27	Very low	148 Å²	148	152.9 Å²	152.9	69%	0.692	83%	0.831	S	S	*	*				97.3	119.9	54.7	-81.7	-73.7	93.1	0	0	112.5
430	E	25.5	Very low	27.3	Very low	189 Å²	189	147.5 Å²	147.5	88%	0.883	83%	0.827	S	S	*	*			trans	42.3	148.9	164.8	-54.1	-154.4	126.9	0	0	122.2
431	G	25	Very low	27.1	Very low	66 Å²	66	145.1 Å²	145.1	68%	0.68	82%	0.822	S	S	*	*			cis	170.2	-164.1	-1.7	0	0	0	0	0	113.6
432	Q	28.9	Very low	27.1	Very low	204 Å²	204	141.3 Å²	141.3	95%	0.953	82%	0.816	S	S	*	*			trans	73.4	163.8	176.2	-58.8	-161.6	4.7	0	0	119.1
433	S	28.4	Very low	27	Very low	125 Å²	125	138.3 Å²	138.3	87%	0.874	82%	0.815	S	S	*	*			trans	-164.1	147.3	-147.1	59.4	0	0	0	0	114.5
434	G	24.3	Very low	27.2	Very low	84 Å²	84	141.2 Å²	141.2	87%	0.866	82%	0.816	S	S	*	*			trans	120.4	147	166.5	0	0	0	0	0	113.7
435	G	23.6	Very low	27.2	Very low	74 Å²	74	139 Å²	139	76%	0.763	82%	0.817	S	S	*	*			cis	172.3	142	-8.8	0	0	0	0	0	113.4
436	S	25.3	Very low	27	Very low	121 Å²	121	141.4 Å²	141.4	85%	0.846	82%	0.823	S	S	*	*			trans	62.8	121.5	167.3	-165.3	0	0	0	0	119.1
437	S	25.4	Very low	27	Very low	118 Å²	118	138.6 Å²	138.6	83%	0.825	81%	0.814	S	S	*	*				-141.3	147.4	128.9	72.9	0	0	0	0	110.4
438	R	29.2	Very low	27	Very low	231 Å²	231	136 Å²	136	87%	0.872	82%	0.815	S	S	*	*			trans	-124.8	155.6	169.2	-89.8	176.3	61.6	-177.3	-2.2	108.5
439	T	30.1	Very low	27.1	Very low	133 Å²	133	137.9 Å²	137.9	82%	0.816	82%	0.816	S	S	*	*			trans	-58.6	157.1	175.9	49.7	0	0	0	0	112.5
440	P	33	Very low	26.8	Very low	131 Å²	131	140 Å²	140	85%	0.851	83%	0.825	S	S	*	*				-140.9	175.2	107.7	39.2	-26.9	0	0	0	115.6
441	A	24.7	Very low	26.7	Very low	86 Å²	86	136.1 Å²	136.1	71%	0.711	82%	0.815	S	S	*	*			trans	-93.1	167.3	-164.3	0	0	0	0	0	116
442	V	26.1	Very low	26.7	Very low	131 Å²	131	141.2 Å²	141.2	79%	0.794	83%	0.826	S	S	*	*			trans	70.1	124.9	143.4	167.5	0	0	0	0	120
443	T	25.2	Very low	26.5	Very low	141 Å²	141	140.7 Å²	140.7	87%	0.865	82%	0.82	S	S	*	*				-157.5	157.2	126.8	-1.4	0	0	0	0	111.8
444	K	28.8	Very low	26.2	Very low	190 Å²	190	139 Å²	139	83%	0.826	81%	0.814	S	S	*	*			trans	-99.3	170.2	167	-66.9	-177.1	178.5	-178.9	0	109.5
445	P	28.3	Very low	26.1	Very low	130 Å²	130	140.6 Å²	140.6	84%	0.844	81%	0.807	S	S	*	*				-124.1	177.9	122	36.7	-32.6	0	0	0	113.3
446	N	24.4	Very low	26.1	Very low	140 Å²	140	140.8 Å²	140.8	75%	0.749	80%	0.796	S	S	*	*			trans	-154.3	172.8	-179.5	-166.2	27.1	0	0	0	108.8
447	N	26.1	Very low	26	Very low	141 Å²	141	143.9 Å²	143.9	75%	0.754	80%	0.795	S	S	*	*			trans	79.2	147.6	-178	-56.8	-11	0	0	0	114.7
448	S	28.4	Very low	26.1	Very low	116 Å²	116	142.4 Å²	142.4	81%	0.811	79%	0.785	S	S	*	*			cis	-157.2	170.1	-10.5	36	0	0	0	0	112.4
449	K	28.2	Very low	25.9	Very low	197 Å²	197	140.1 Å²	140.1	86%	0.857	78%	0.784	S	S	*	*			trans	-61.3	155.1	179.8	-52.8	166.7	-178.9	175.4	0	113.7
450	E	23.9	Very low	25.7	Very low	191 Å²	191	138.1 Å²	138.1	89%	0.893	79%	0.79	S	S	*	*			trans	-128.6	164.1	141	-168.4	157	-129.9	0	0	109.3
451	T	23.3	Very low	25.2	Very low	108 Å²	108	134.4 Å²	134.4	66%	0.663	78%	0.776	S	S	*	*			trans	-149.8	127.8	-172.3	-59.3	0	0	0	0	110.6
452	L	25.4	Very low	25.4	Very low	174 Å²	174	138.2 Å²	138.2	91%	0.911	78%	0.782	S	S	*	*			trans	-122.5	141.2	164.2	-74.1	175.6	0	0	0	110.8
453	K	23.8	Very low	25.4	Very low	193 Å²	193	139.1 Å²	139.1	84%	0.839	78%	0.783	S	S	*	*			trans	-101.6	174.9	173.9	-78.7	-178.8	171.5	-179.8	0	109.5
454	A	23.4	Very low	25.4	Very low	90 Å²	90	138.5 Å²	138.5	74%	0.744	78%	0.784	S	S	*	*			trans	86.2	151	148	0	0	0	0	0	118.1
455	T	21.7	Very low	25.2	Very low	117 Å²	117	134 Å²	134	72%	0.718	78%	0.782	S	S	*	*			cis	-167.7	146.2	-23.3	-91.4	0	0	0	0	108.7
456	S	22.9	Very low	26.4	Very low	77 Å²	77	133.4 Å²	133.4	54%	0.538	78%	0.778	S	S	.	*			trans	68.6	160	153.2	67.7	0	0	0	0	122.2
457	F	24.8	Very low	26.4	Very low	186 Å²	186	135.6 Å²	135.6	82%	0.816	78%	0.781	S	S	*	*			trans	64.3	137.8	160.4	-51.7	-55.8	0	0	0	118.8
458	S	26.3	Very low	26.4	Very low	88 Å²	88	135.1 Å²	135.1	62%	0.615	78%	0.779	S	S	*	*			cis	157	144.9	-35.1	52.2	0	0	0	0	108.2
459	Q	24.9	Very low	26.3	Very low	183 Å²	183	138.6 Å²	138.6	86%	0.855	78%	0.779	S	S	*	*			trans	66.6	88	144.1	-163.9	166.9	1.4	0	0	118.1
460	G	26	Very low	26.2	Very low	90 Å²	90	137.6 Å²	137.6	93%	0.928	78%	0.775	S	S	*	*			trans	-123.7	89.7	152	0	0	0	0	0	109.3
461	G	23.4	Very low	26.1	Very low	54 Å²	54	135.6 Å²	135.6	56%	0.557	77%	0.77	S	S	*	*			trans	-152.9	128.6	-173.8	0	0	0	0	0	114
462	I	29.1	Very low	26.3	Very low	166 Å²	166	136.9 Å²	136.9	85%	0.851	77%	0.772	S	S	*	*			trans	-143	98.3	169.6	-39.9	176	0	0	0	105.2
463	N	24.9	Very low	26.3	Very low	150 Å²	150	138 Å²	138	80%	0.802	76%	0.764	S	S	*	*				58.5	93	74.3	-68.1	-23.5	0	0	0	114.9
464	S	25.6	Very low	26.3	Very low	127 Å²	127	134 Å²	134	89%	0.888	76%	0.755	S	S	*	*				-153.2	143.4	126	59	0	0	0	0	111.2
465	A	24.9	Very low	26.4	Very low	96 Å²	96	135.8 Å²	135.8	79%	0.793	75%	0.748	S	S	*	*			trans	-141.9	-161.1	178.1	0	0	0	0	0	108.5
466	P	52.1	Low	26.5	Very low	117 Å²	117	136.5 Å²	136.5	76%	0.76	75%	0.753	S	S	*	*				-114.3	-176.2	-104.9	39.3	-25.6	0	0	0	112.7
467	K	25.5	Very low	26.7	Very low	186 Å²	186	138.2 Å²	138.2	81%	0.809	77%	0.765	S	S	*	*			trans	-172.3	135.4	154.2	-106.3	147.6	-170.9	174.1	0	114.9
468	N	25.2	Very low	26.7	Very low	132 Å²	132	137.5 Å²	137.5	71%	0.706	76%	0.764	S	S	*	*			trans	61.5	164.5	137.8	-71.1	-14.6	0	0	0	120.9
469	K	27.2	Very low	26.6	Very low	188 Å²	188	141.8 Å²	141.8	82%	0.817	78%	0.779	S	S	*	*			cis	-167.1	149.9	-44.4	-123.3	176.9	-175.9	173.3	0	109.3
470	K	25.5	Very low	26.5	Very low	177 Å²	177	140.2 Å²	140.2	77%	0.77	77%	0.773	S	S	*	*			trans	-13.7	133.1	169.9	-61.8	179.8	172.6	-174	0	120.2
471	N	23.3	Very low	26.4	Very low	149 Å²	149	142.1 Å²	142.1	80%	0.797	77%	0.767	S	S	*	*				-176.1	146.9	113.6	-87	-11.7	0	0	0	108.4
472	I	25.6	Very low	26.3	Very low	135 Å²	135	145.3 Å²	145.3	69%	0.692	78%	0.781	S	S	*	*			cis	97.8	117	25.6	-67.2	176.1	0	0	0	114.3
473	R	25.6	Very low	26	Very low	198 Å²	198	146 Å²	146	75%	0.747	78%	0.781	S	S	*	*			trans	70.6	150.6	168.5	-105.3	-162.8	156.8	148.9	-6.3	117.1	E475	R473-E475 IonicContact CZ-OE1 3.79Å; R473-E475 IonicContact NE-OE1 2.66Å; R473-E475 PolarHBondContact NE-OE1 3.39Å; R473-E475 IonicContact NH2-OE1 3.13Å; R473-E475 PolarHBondContact NH2-OE1 3.24Å; R473-E475 IonicContact NH2-OE2 3.5Å
474	T	24.6	Very low	26.6	Very low	107 Å²	107	143.3 Å²	143.3	66%	0.656	77%	0.771	S	S	*	*			cis	-139.6	167.5	14	-44.3	0	0	0	0	113.5
475	E	25.9	Very low	26.4	Very low	128 Å²	128	145.5 Å²	145.5	60%	0.598	77%	0.767	S	S	*	*			trans	-37	164.4	167.5	-53.7	113.1	-129	0	0	115.4	R473	R473-E475 IonicContact CZ-OE1 3.79Å; R473-E475 IonicContact NE-OE1 2.66Å; R473-E475 PolarHBondContact NE-OE1 3.39Å; R473-E475 IonicContact NH2-OE1 3.13Å; R473-E475 PolarHBondContact NH2-OE1 3.24Å; R473-E475 IonicContact NH2-OE2 3.5Å
476	T	23.9	Very low	26.3	Very low	132 Å²	132	147.7 Å²	147.7	81%	0.81	77%	0.765	S	S	*	*			cis	-144.6	177.9	28.8	-4.9	0	0	0	0	109.5
477	S	26.3	Very low	24.9	Very low	113 Å²	113	149.9 Å²	149.9	79%	0.79	77%	0.765	S	S	*	*			cis	-141.8	-174.6	18	-81.9	0	0	0	0	112.3
478	Q	26	Very low	24.7	Very low	172 Å²	172	149.6 Å²	149.6	80%	0.804	76%	0.764	S	S	*	*			trans	-116.7	169.9	176.9	-56.3	158	-59	0	0	111.5
479	L	22.6	Very low	24.6	Very low	178 Å²	178	147.7 Å²	147.7	93%	0.932	76%	0.757	S	S	*	*			trans	-153.8	163.6	132.7	-114.7	170.7	0	0	0	110.4
480	M	23.5	Very low	24.4	Very low	149 Å²	149	146.8 Å²	146.8	73%	0.734	76%	0.756	S	S	*	*			trans	-133.6	158.5	-164	-69.2	179.4	65.8	0	0	114.7
481	V	23.7	Very low	24.3	Very low	130 Å²	130	143.3 Å²	143.3	79%	0.788	75%	0.753	S	S	*	*			trans	-18.6	145.4	155.2	-179.6	0	0	0	0	117.3
482	S	21.4	Very low	24.4	Very low	122 Å²	122	142.5 Å²	142.5	85%	0.853	76%	0.759	S	S	*	*			trans	-139.9	139.4	155.2	-72.4	0	0	0	0	113.5
483	E	23.6	Very low	24.3	Very low	181 Å²	181	139.7 Å²	139.7	85%	0.846	76%	0.764	S	S	*	*			trans	-153.6	175.1	164.3	-131.5	-170.5	-170.5	0	0	104.5
484	P	36.5	Very low	24.3	Very low	92 Å²	92	135.8 Å²	135.8	60%	0.597	77%	0.767	S	S	*	*			cis	-140.3	-176.5	-8.2	41.8	-22.4	0	0	0	116.1
485	E	22	Very low	24.4	Very low	173 Å²	173	138.2 Å²	138.2	81%	0.808	78%	0.776	S	S	*	*			trans	66.4	165.8	140.1	-87.9	-164.7	132.5	0	0	126.4
486	L	22.5	Very low	24.5	Very low	143 Å²	143	141.8 Å²	141.8	75%	0.749	79%	0.793	S	S	*	*			trans	75.9	135.9	176.5	-58.4	107.7	0	0	0	116.1
487	Q	23.1	Very low	24.6	Very low	162 Å²	162	143.3 Å²	143.3	76%	0.757	79%	0.788	S	S	*	*			cis	-153.5	144.1	13.7	-130.7	164.9	54.8	0	0	113.3
488	K	21.6	Very low	24.4	Very low	181 Å²	181	144.1 Å²	144.1	79%	0.787	79%	0.792	S	S	*	*			trans	31.9	137.7	133.7	-133.5	-179.3	-176.1	-168.8	0	118.9
489	T	21.9	Very low	24.4	Very low	92 Å²	92	141.3 Å²	141.3	56%	0.564	78%	0.783	S	S	*	*				179	138.4	66.1	-54.3	0	0	0	0	112.9
490	E	22.6	Very low	24.6	Very low	169 Å²	169	140.9 Å²	140.9	79%	0.79	77%	0.773	S	S	*	*			trans	53.5	177.9	154.6	-71.3	157.1	-147.5	0	0	121.1
491	S	23.4	Very low	24.7	Very low	103 Å²	103	140.6 Å²	140.6	72%	0.72	77%	0.77	S	S	*	*				-173.2	134.7	-69.5	58.5	0	0	0	0	111.1
492	S	26.2	Very low	24.8	Very low	132 Å²	132	143.4 Å²	143.4	92%	0.923	78%	0.775	S	S	*	*			trans	-167.1	156.3	151.5	55.2	0	0	0	0	111.1
493	G	23.6	Very low	24.9	Very low	77 Å²	77	140.5 Å²	140.5	79%	0.794	76%	0.764	S	S	*	*			trans	-169.4	169.7	173.4	0	0	0	0	0	109.5
494	S	26	Very low	25.1	Very low	115 Å²	115	141 Å²	141	80%	0.804	76%	0.763	S	S	*	*			trans	-154.4	112.6	170.2	59.1	0	0	0	0	110.5
495	D	26.2	Very low	24.6	Very low	159 Å²	159	142 Å²	142	85%	0.85	77%	0.768	S	S	*	*			trans	-67.6	147.1	162.2	-61.4	-75.1	0	0	0	110.3
496	Q	27.4	Very low	25	Very low	202 Å²	202	138.4 Å²	138.4	94%	0.944	77%	0.768	S	S	*	*			trans	-152.6	143.8	140.7	-131.1	159	103.2	0	0	111.9
497	K	25.8	Very low	25.2	Very low	165 Å²	165	139 Å²	139	72%	0.717	77%	0.772	S	S	*	*			trans	-128.3	133.1	-177.1	177.8	-159	169.9	-167.4	0	108.7	D499	K497-D499 WeakPolarHBondContact CE-OD1 3.42Å; K497-D499 VanDerWaalsContact CE-OD2 3.31Å; K497-D499 WeakPolarHBondContact CE-OD2 3.44Å; K497-D499 IonicContact NZ-OD1 3.89Å; K497-D499 IonicContact NZ-OD2 3.51Å
498	C	22.4	Very low	25.9	Very low	129 Å²	129	137 Å²	137	87%	0.872	78%	0.776	S	S	*	*			trans	-154.5	155.5	147.2	-133.5	0	0	0	0	110.9
499	D	26.8	Very low	26.4	Very low	113 Å²	113	135.5 Å²	135.5	60%	0.604	78%	0.776	S	S	*	*			trans	-101.5	153.7	-171.8	-47.1	-88.3	0	0	0	111.1	K497	K497-D499 WeakPolarHBondContact CE-OD1 3.42Å; K497-D499 VanDerWaalsContact CE-OD2 3.31Å; K497-D499 WeakPolarHBondContact CE-OD2 3.44Å; K497-D499 IonicContact NZ-OD1 3.89Å; K497-D499 IonicContact NZ-OD2 3.51Å
500	K	26.8	Very low	27	Very low	169 Å²	169	137.7 Å²	137.7	74%	0.735	79%	0.785	S	S	*	*				176.1	125.8	128.9	-99.4	174.4	174.1	-81.1	0	116.2
501	E	25	Very low	27.7	Very low	144 Å²	144	135.9 Å²	135.9	67%	0.673	78%	0.776	S	S	*	*				44.4	133.6	123.7	-65.6	168.8	166.6	0	0	123.3
502	E	25.4	Very low	28.3	Very low	189 Å²	189	137.9 Å²	137.9	88%	0.883	77%	0.772	S	S	*	*			trans	66.3	150.2	155.8	-63	177.7	173.3	0	0	118.7
503	G	24.1	Very low	28.5	Very low	60 Å²	60	138.9 Å²	138.9	62%	0.619	77%	0.766	S	S	*	*			cis	170.3	166.2	-6.4	0	0	0	0	0	112.3
504	F	27.3	Very low	28.9	Very low	192 Å²	192	143.2 Å²	143.2	84%	0.842	77%	0.769	S	S	*	*			trans	65.9	169.1	169.9	-62.4	-87.3	0	0	0	118.6
505	T	26.6	Very low	29.1	Very low	113 Å²	113	144.6 Å²	144.6	69%	0.693	77%	0.766	S	S	*	*				-166.8	138.6	-65.3	34.4	0	0	0	0	109
506	A	29.7	Very low	29.4	Very low	98 Å²	98	145 Å²	145	81%	0.81	77%	0.768	S	S	*	*			trans	55.3	-177.7	161.6	0	0	0	0	0	114.9
507	D	26.7	Very low	29.5	Very low	154 Å²	154	143.8 Å²	143.8	82%	0.824	76%	0.763	S	S	*	*			cis	-145.2	156.6	-18.6	-148.9	-17.4	0	0	0	107.3
508	S	39	Very low	29.8	Very low	121 Å²	121	140.8 Å²	140.8	85%	0.846	77%	0.768	S	S	*	*			trans	-163.4	123.9	167	-158.5	0	0	0	0	112.7
509	D	32.5	Very low	30.1	Very low	149 Å²	149	138.6 Å²	138.6	80%	0.797	77%	0.768	S	S	*	*			trans	-109	158.8	-170.3	-160.2	23.2	0	0	0	113.3
510	D	33	Very low	30.2	Very low	138 Å²	138	138.7 Å²	138.7	74%	0.738	78%	0.778	S	S	*	*			trans	-17	179.8	174.3	-109	-10.5	0	0	0	125.6
511	E	37.7	Very low	30.5	Very low	131 Å²	131	135.4 Å²	135.4	61%	0.612	78%	0.776	S	S	*	*			trans	80.5	93.4	159.5	-71.2	-65.3	91.8	0	0	122.1
512	K	35.6	Very low	30.7	Very low	146 Å²	146	135.4 Å²	135.4	64%	0.635	79%	0.785	S	S	*	*				59	113.4	124.4	-71.5	-166.6	-169.6	79.7	0	123.1
513	L	31.5	Very low	30.9	Very low	153 Å²	153	130.7 Å²	130.7	80%	0.801	78%	0.778	S	S	*	*				45.8	104.6	114.1	-58.8	175.4	0	0	0	119.7
514	I	32.1	Very low	30.9	Very low	167 Å²	167	135.5 Å²	135.5	86%	0.856	79%	0.789	S	S	*	*			trans	-123.5	139.9	144.2	-64.1	177.8	0	0	0	108
515	I	30.3	Very low	31.3	Very low	145 Å²	145	131.3 Å²	131.3	74%	0.744	78%	0.781	S	S	*	*			trans	-110.1	132.4	173.2	-58.9	170.2	0	0	0	107.2
516	D	32.5	Very low	31.3	Very low	166 Å²	166	131 Å²	131	89%	0.888	78%	0.779	S	S	*	*			trans	-155.7	159.7	146.5	-118.9	-32.1	0	0	0	111.6
517	E	29	Very low	31.2	Very low	178 Å²	178	132.1 Å²	132.1	83%	0.832	77%	0.772	S	S	*	*			trans	-117.9	150.9	-160.7	-165.2	173.7	136.5	0	0	114.1
518	A	31	Very low	31.3	Very low	101 Å²	101	132 Å²	132	84%	0.835	77%	0.766	S	S	*	*			trans	64	107.5	165.8	0	0	0	0	0	118.9
519	G	30.5	Very low	30.7	Very low	83 Å²	83	130.6 Å²	130.6	86%	0.856	76%	0.756	S	S	*	*			trans	-161.2	122.5	163.4	0	0	0	0	0	110.9
520	S	28.3	Very low	30.6	Very low	116 Å²	116	132.1 Å²	132.1	81%	0.811	76%	0.759	S	S	*	*			trans	-104.6	157.2	-173.7	-170.3	0	0	0	0	113.1
521	S	32.2	Very low	30.9	Very low	100 Å²	100	130.2 Å²	130.2	70%	0.699	75%	0.754	S	S	*	*			trans	84.3	113.4	155.6	72.8	0	0	0	0	120.7
522	V	30	Very low	30.5	Very low	143 Å²	143	130.7 Å²	130.7	87%	0.867	76%	0.76	S	S	*	*				79.2	136.7	125.1	173.5	0	0	0	0	120
523	A	29	Very low	29.9	Very low	90 Å²	90	129.1 Å²	129.1	74%	0.744	76%	0.762	S	S	*	*			trans	72.8	99.4	160.6	0	0	0	0	0	119.6
524	L	24.8	Very low	29.6	Very low	161 Å²	161	127.1 Å²	127.1	84%	0.843	76%	0.757	S	S	*	*			trans	-51.7	160	132.1	-113.6	86.2	0	0	0	110
525	P	36.1	Very low	29.3	Very low	104 Å²	104	124.8 Å²	124.8	68%	0.675	75%	0.751	S	S	*	*			cis	-155.8	-175	43.8	47	-26.9	0	0	0	118.6
526	T	25.9	Very low	29	Very low	106 Å²	106	123.3 Å²	123.3	65%	0.65	75%	0.752	S	S	*	*			trans	78.2	112.3	139	-64.3	0	0	0	0	120.9
527	N	27	Very low	28.8	Very low	123 Å²	123	120.5 Å²	120.5	66%	0.658	75%	0.745	S	S	*	*			trans	69.9	153.9	144	-66.8	-0.5	0	0	0	120.2
528	Q	28.8	Very low	28.7	Very low	152 Å²	152	116.2 Å²	116.2	71%	0.71	74%	0.74	S	S	*	*			cis	-161.3	168.6	-17.9	-113.7	167.1	13.9	0	0	109.2
529	S	27.4	Very low	28.4	Very low	90 Å²	90	118 Å²	118	63%	0.629	74%	0.736	S	S	*	*			trans	22.1	117.1	153.5	59.8	0	0	0	0	119.2
530	E	29.8	Very low	28.3	Very low	181 Å²	181	118.7 Å²	118.7	85%	0.846	73%	0.727	S	S	*	*				68.4	152.5	77.9	-82.2	-157	136.4	0	0	115.6
531	P	40.2	Very low	28.2	Very low	98 Å²	98	118.1 Å²	118.1	64%	0.636	72%	0.723	S	S	*	*			cis	-140.2	-143.1	-41.3	37.2	-16.4	0	0	0	110.9
532	L	28.3	Very low	28	Very low	142 Å²	142	119 Å²	119	74%	0.743	72%	0.724	S	S	*	*			trans	93.7	98	163.5	-59.9	173.9	0	0	0	119.2
533	T	24.2	Very low	27.8	Very low	112 Å²	112	118.2 Å²	118.2	69%	0.687	72%	0.72	S	S	*	*				45.2	146.1	116.7	61.5	0	0	0	0	120
534	T	25.4	Very low	27.7	Very low	112 Å²	112	118.8 Å²	118.8	69%	0.687	72%	0.719	S	S	*	*			cis	-169.8	167.3	42.5	-28.4	0	0	0	0	111.4
535	T	24.8	Very low	27.9	Very low	118 Å²	118	116 Å²	116	72%	0.724	71%	0.713	S	S	*	*			trans	66.6	123	157.7	38.2	0	0	0	0	117.7
536	C	24.8	Very low	27.6	Very low	113 Å²	113	117.3 Å²	117.3	76%	0.764	72%	0.718	S	S	*	*				73	142.7	70.9	-63.5	0	0	0	0	113.1
537	S	26.4	Very low	27.9	Very low	108 Å²	108	121 Å²	121	76%	0.755	73%	0.728	S	S	*	*			cis	-165.9	174.4	-0.6	-109.4	0	0	0	0	110.9
538	A	28.2	Very low	27.9	Very low	87 Å²	87	120.9 Å²	120.9	72%	0.719	74%	0.737	S	S	*	*			trans	72.8	154.3	159.2	0	0	0	0	0	116.8
539	D	25	Very low	27.8	Very low	140 Å²	140	120 Å²	120	75%	0.749	74%	0.742	S	S	*	*			cis	-152	165.3	-3.2	-136.8	-33.6	0	0	0	113.5
540	S	27.7	Very low	28.8	Very low	97 Å²	97	121.4 Å²	121.4	68%	0.678	75%	0.749	S	S	*	*			trans	-0.2	148.9	142.2	-60.4	0	0	0	0	120
541	S	26.7	Very low	28.7	Very low	104 Å²	104	117.5 Å²	117.5	73%	0.727	75%	0.748	S	S	*	*			cis	-179.3	169	0	51.3	0	0	0	0	114.2
542	V	28.4	Very low	28.2	Very low	118 Å²	118	122.1 Å²	122.1	72%	0.715	76%	0.758	S	S	*	*			trans	75.7	105.8	138.4	158.2	0	0	0	0	123.1
543	T	25.3	Very low	28.2	Very low	126 Å²	126	121.7 Å²	121.7	77%	0.773	76%	0.761	S	S	*	*			trans	64.4	152.9	143.1	71.1	0	0	0	0	120.5
544	S	26.7	Very low	28.5	Very low	103 Å²	103	122.1 Å²	122.1	72%	0.72	76%	0.764	S	S	*	*			cis	-169.5	163.5	34.7	43.9	0	0	0	0	115.1
545	S	27.9	Very low	28.6	Very low	103 Å²	103	122.4 Å²	122.4	72%	0.72	77%	0.77	S	S	*	*			trans	44.8	106.1	149	61.6	0	0	0	0	125.4
546	V	30.9	Very low	28.8	Very low	130 Å²	130	121.7 Å²	121.7	79%	0.788	77%	0.77	S	S	*	*				51.3	123.7	108.3	-179.5	0	0	0	0	122.8
547	Q	31.3	Very low	30.4	Very low	184 Å²	184	121.8 Å²	121.8	86%	0.86	77%	0.769	S	S	*	*			trans	60.6	125.3	153.5	-76.7	178.5	-6.7	0	0	123.6
548	S	27.3	Very low	31.3	Very low	121 Å²	121	122.4 Å²	122.4	85%	0.846	77%	0.771	S	S	*	*				178.8	168.8	117.2	43.4	0	0	0	0	113.6
549	T	27.1	Very low	31.1	Very low	134 Å²	134	123.8 Å²	123.8	82%	0.822	77%	0.774	S	S	*	*			trans	-142.5	-179.9	176.3	63.2	0	0	0	0	108.5
550	P	48.7	Very low	31.3	Very low	118 Å²	118	125.5 Å²	125.5	77%	0.766	78%	0.775	S	S	*	*			cis	-138.6	-159	-4.5	40.3	-18.9	0	0	0	115.1
551	A	28	Very low	31.3	Very low	100 Å²	100	128 Å²	128	83%	0.826	78%	0.775	S	S	*	*			trans	102.3	176	150	0	0	0	0	0	121.8
552	K	29.5	Very low	31.3	Very low	195 Å²	195	128.8 Å²	128.8	85%	0.848	78%	0.776	S	S	*	*			trans	-139.2	178.2	-145.9	-69.2	-178.6	174.2	178.6	0	116.7
553	T	28.5	Very low	31.3	Very low	132 Å²	132	134.8 Å²	134.8	81%	0.81	79%	0.785	S	S	*	*			trans	90.3	150.2	152	-4.8	0	0	0	0	115.4
554	V	29.7	Very low	31.6	Very low	122 Å²	122	134.6 Å²	134.6	74%	0.739	79%	0.789	S	S	*	*			cis	-161.4	121.7	44.5	170.4	0	0	0	0	112.1
555	S	28.9	Very low	31.8	Very low	117 Å²	117	139 Å²	139	82%	0.818	80%	0.795	S	S	*	*				85.4	176.1	109	99.2	0	0	0	0	122.6
556	S	28	Very low	31.9	Very low	104 Å²	104	144.4 Å²	144.4	73%	0.727	80%	0.8	S	S	*	*			trans	-128.3	-159.4	-159.4	68	0	0	0	0	112.7
557	P	57.4	Low	32	Very low	115 Å²	115	143.5 Å²	143.5	75%	0.747	80%	0.795	S	S	*	*			cis	-117.6	-122.8	-0.6	41.4	-20.5	0	0	0	112.6
558	P	45.4	Very low	32.1	Very low	121 Å²	121	140.6 Å²	140.6	79%	0.786	79%	0.79	S	S	*	*			cis	-121.3	-137.3	4.6	44.3	-26.1	0	0	0	115.1
559	C	25.7	Very low	32.3	Very low	116 Å²	116	146.3 Å²	146.3	78%	0.784	79%	0.793	S	S	*	*			trans	-151.7	153.4	-170	-48.8	0	0	0	0	116.3
560	K	28.9	Very low	32.5	Very low	176 Å²	176	148.9 Å²	148.9	77%	0.765	80%	0.795	S	S	*	*				152.6	137.2	125.7	-89.5	176.8	172.7	180	0	118.4
561	H	26.9	Very low	31.6	Very low	150 Å²	150	149.4 Å²	149.4	69%	0.694	80%	0.797	S	S	*	*			trans	59.9	151.3	149.5	-57.8	-46.5	0	0	0	120.8
562	T	28	Very low	31.8	Very low	119 Å²	119	154 Å²	154	73%	0.73	80%	0.798	S	S	*	*			cis	-162.4	138	-15.8	19.3	0	0	0	0	114.3
563	R	27.5	Very low	32.2	Very low	245 Å²	245	148.8 Å²	148.8	93%	0.925	79%	0.791	S	S	*	*			trans	63.7	114.8	132.8	-160.5	-175.8	-156.1	179.5	7.3	122.3
564	S	31.9	Very low	32.8	Very low	121 Å²	121	148.7 Å²	148.7	85%	0.846	79%	0.793	S	S	*	*			trans	-148.3	-179.5	146.8	-161.5	0	0	0	0	112.7
565	K	30.6	Very low	33.5	Very low	196 Å²	196	150.8 Å²	150.8	85%	0.852	79%	0.794	S	S	*	*			trans	-101.2	168.9	-168.5	-49.9	162.9	-178.3	166.8	0	110.9
566	R	30.9	Very low	35.3	Very low	216 Å²	216	150.3 Å²	150.3	82%	0.815	78%	0.783	S	S	*	*			cis	-163	144.7	10.3	-152.8	-176.1	-177.9	167.2	-1.5	110.1
567	T	32.1	Very low	37.2	Very low	111 Å²	111	152.9 Å²	152.9	68%	0.681	78%	0.783	S	S	*	*			trans	50.7	137.7	150.7	44.6	0	0	0	0	122.6
568	T	33.4	Very low	37.6	Very low	123 Å²	123	153 Å²	153	76%	0.755	78%	0.777	S	S	*	*			cis	-178.3	154.4	-23.1	12.7	0	0	0	0	111.3
569	R	30.4	Very low	39	Very low	241 Å²	241	147.9 Å²	147.9	91%	0.909	75%	0.746	S	S	*	*			trans	89.5	145.3	165.5	-66.2	-177.5	170	-176.9	-3.9	118.6
570	Q	31.5	Very low	41.2	Very low	188 Å²	188	147.3 Å²	147.3	88%	0.879	73%	0.732	S	S	*	*			trans	62.4	143.3	-177.8	-73.8	-173.5	-6.5	0	0	114.7
571	T	29.9	Very low	43.4	Very low	129 Å²	129	142.8 Å²	142.8	79%	0.791	72%	0.715	S	S	*	*			cis	-141.6	157.6	-7.4	-29.8	0	0	0	0	108.7
572	K	33	Very low	45.5	Very low	198 Å²	198	140.1 Å²	140.1	86%	0.861	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-83.7	136.4	166.1	-90.5	-167.4	170.7	-167.3	0	110.4
573	A	36.9	Very low	47.5	Very low	85 Å²	85	141.3 Å²	141.3	70%	0.702	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-84.1	164.9	169.6	0	0	0	0	0	110.6
574	P	42.2	Very low	49.6	Very low	129 Å²	129	135.3 Å²	135.3	84%	0.838	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-76.4	160	-167.4	31.5	-35.9	0	0	0	114.1
575	E	43.5	Very low	51.4	Low	166 Å²	166	134 Å²	134	78%	0.776	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-86.7	146.7	179.3	-74.6	166.7	131.5	0	0	112.4	Q577	E575-Q577 PolarHBondContact O-N 3.39Å
576	D	67.9	Low	53.2	Low	107 Å²	107	128.5 Å²	128.5	57%	0.572	64%	0.644	S	S	*	*			trans	-73.9	100.9	179	169	23.2	0	0	0	111.3	L578 G579 E580	D576-L578 VanDerWaalsContact C-N 3.27Å; D576-L578 PolarHBondContact O-N 3.4Å; D576-L578 WeakPolarHBondContact OD1-CB 3.5Å; D576-L578 PolarHBondContact OD1-N 3.07Å; D576-G579 VanDerWaalsContact CG-N 3.35Å; D576-G579 PolarHBondContact O-N 2.94Å; D576-G579 PolarHBondContact OD1-N 3.16Å; D576-G579 VanDerWaalsContact OD1-N 3.15Å; D576-G579 WeakPolarHBondContact OD2-CA 3.38Å; D576-G579 PolarHBondContact OD2-N 3.29Å; D576-E580 PolarHBondContact O-N 2.84Å
577	Q	67.6	Low	54.8	Low	158 Å²	158	121.2 Å²	121.2	74%	0.738	63%	0.631	S	S	*	*	H	α-helix	trans	-62.3	-30.6	177.2	-68.1	-177.4	-24.2	0	0	113.1	E575 E580 I581	E575-Q577 PolarHBondContact O-N 3.39Å; Q577-E580 WeakPolarHBondContact O-CB 3.44Å; Q577-E580 PolarHBondContact O-N 2.85Å; Q577-I581 WeakPolarHBondContact O-CD1 3.15Å; Q577-I581 VanDerWaalsContact O-CG1 3.3Å; Q577-I581 WeakPolarHBondContact O-CG1 3.45Å; Q577-I581 PolarHBondContact O-N 2.69Å
578	L	64.9	Low	56	Low	118 Å²	118	122 Å²	122	62%	0.618	63%	0.628	S	S	*	*	H	α-helix	trans	-72.5	-42.4	-178.4	-172	65.5	0	0	0	110.5	D576 E580 I581 L582	D576-L578 VanDerWaalsContact C-N 3.27Å; D576-L578 PolarHBondContact O-N 3.4Å; D576-L578 WeakPolarHBondContact OD1-CB 3.5Å; D576-L578 PolarHBondContact OD1-N 3.07Å; L578-E580 VanDerWaalsContact C-N 3.25Å; L578-E580 PolarHBondContact O-N 2.86Å; L578-I581 PolarHBondContact O-N 2.7Å; L578-L582 HydrophobicContact CG-CD1 4.46Å; L578-L582 WeakPolarHBondContact O-CG 3.37Å; L578-L582 PolarHBondContact O-N 3.48Å; L578-L582 VanDerWaalsContact O-N 3.08Å
579	G	74.6	Confident	56.8	Low	14 Å²	14	125.2 Å²	125.2	14%	0.144	63%	0.632	C	S	.	*	H	α-helix	trans	-60.6	-31.2	170.6	0	0	0	0	0	113.5	D576 R583	D576-G579 VanDerWaalsContact CG-N 3.35Å; D576-G579 PolarHBondContact O-N 2.94Å; D576-G579 PolarHBondContact OD1-N 3.16Å; D576-G579 VanDerWaalsContact OD1-N 3.15Å; D576-G579 WeakPolarHBondContact OD2-CA 3.38Å; D576-G579 PolarHBondContact OD2-N 3.29Å; G579-R583 VanDerWaalsContact O-CG 3.31Å; G579-R583 WeakPolarHBondContact O-CG 3.5Å; G579-R583 PolarHBondContact O-N 2.7Å; G579-R583 PolarHBondContact O-NH1 2.7Å
580	E	72.1	Confident	57.9	Low	103 Å²	103	122 Å²	122	48%	0.481	63%	0.625	S	S	.	*	H	α-helix	trans	-71.2	-47.8	174.6	-167.1	106.3	-89	0	0	112.3	D576 Q577 L578 L582 R583 M584	D576-E580 PolarHBondContact O-N 2.84Å; Q577-E580 WeakPolarHBondContact O-CB 3.44Å; Q577-E580 PolarHBondContact O-N 2.85Å; L578-E580 VanDerWaalsContact C-N 3.25Å; L578-E580 PolarHBondContact O-N 2.86Å; E580-L582 VanDerWaalsContact C-N 3.31Å; E580-L582 PolarHBondContact O-N 2.87Å; E580-R583 WeakPolarHBondContact O-CB 3.32Å; E580-R583 PolarHBondContact O-N 2.82Å; E580-R583 VanDerWaalsContact O-N 3.15Å; E580-R583 IonicContact OE1-CZ 2.8Å; E580-R583 IonicContact OE1-NE 3.83Å; E580-R583 IonicContact OE1-NH2 2.77Å; E580-R583 PolarHBondContact OE1-NH2 3.14Å; E580-M584 PolarHBondContact O-N 2.9Å
581	I	76.1	Confident	58.2	Low	81 Å²	81	118.4 Å²	118.4	42%	0.415	62%	0.62	S	S	.	*	H	α-helix	trans	-59	-44.2	178.6	-68.7	162.2	0	0	0	110.5	Q577 L578 R583 M584 Q585	Q577-I581 WeakPolarHBondContact O-CD1 3.15Å; Q577-I581 VanDerWaalsContact O-CG1 3.3Å; Q577-I581 WeakPolarHBondContact O-CG1 3.45Å; Q577-I581 PolarHBondContact O-N 2.69Å; L578-I581 PolarHBondContact O-N 2.7Å; I581-R583 PolarHBondContact O-N 3.13Å; I581-M584 PolarHBondContact O-N 3.11Å; I581-Q585 HydrophobicContact CG2-CG 4.42Å; I581-Q585 WeakPolarHBondContact O-CB 3.22Å; I581-Q585 WeakPolarHBondContact O-CG 3.45Å; I581-Q585 PolarHBondContact O-N 3.46Å
582	L	70.6	Confident	58.2	Low	94 Å²	94	115.9 Å²	115.9	49%	0.492	62%	0.619	S	S	.	*	H	α-helix	trans	-63.7	-38	176.8	-75	167	0	0	0	112.9	L578 E580 T586	L578-L582 HydrophobicContact CG-CD1 4.46Å; L578-L582 WeakPolarHBondContact O-CG 3.37Å; L578-L582 PolarHBondContact O-N 3.48Å; L578-L582 VanDerWaalsContact O-N 3.08Å; E580-L582 VanDerWaalsContact C-N 3.31Å; E580-L582 PolarHBondContact O-N 2.87Å; L582-T586 WeakPolarHBondContact O-CB 3.5Å; L582-T586 PolarHBondContact O-N 3.23Å; L582-T586 PolarHBondContact O-OG1 3.42Å
583	R	70.4	Confident	58.2	Low	145 Å²	145	112.6 Å²	112.6	55%	0.547	62%	0.621	S	S	.	*	H	α-helix	trans	-62.6	-46.8	172.5	-75.4	-176.1	-58.8	-94.9	15.2	111.2	G579 E580 I581 T586 A587	G579-R583 VanDerWaalsContact O-CG 3.31Å; G579-R583 WeakPolarHBondContact O-CG 3.5Å; G579-R583 PolarHBondContact O-N 2.7Å; G579-R583 PolarHBondContact O-NH1 2.7Å; E580-R583 WeakPolarHBondContact O-CB 3.32Å; E580-R583 PolarHBondContact O-N 2.82Å; E580-R583 VanDerWaalsContact O-N 3.15Å; E580-R583 IonicContact OE1-CZ 2.8Å; E580-R583 IonicContact OE1-NE 3.83Å; E580-R583 IonicContact OE1-NH2 2.77Å; E580-R583 PolarHBondContact OE1-NH2 3.14Å; I581-R583 PolarHBondContact O-N 3.13Å; R583-T586 PolarHBondContact O-N 2.93Å; R583-A587 PolarHBondContact O-N 3.13Å
584	M	71.1	Confident	57.8	Low	119 Å²	119	117.3 Å²	117.3	59%	0.586	63%	0.629	S	S	*	*	H	α-helix	trans	-67.3	-40.2	-177	-166.8	174.3	67.7	0	0	112.4	E580 I581 A587 M588	E580-M584 PolarHBondContact O-N 2.9Å; I581-M584 PolarHBondContact O-N 3.11Å; M584-A587 PolarHBondContact O-N 3.36Å; M584-M588 HydrophobicContact CG-CE 4.43Å; M584-M588 PolarHBondContact O-N 2.95Å
585	Q	69.4	Low	57.6	Low	93 Å²	93	116.5 Å²	116.5	44%	0.435	62%	0.624	S	S	.	*	H	α-helix	trans	-62.6	-46.1	171.8	-72.8	173.3	-18.6	0	0	111.5	I581 A587 M588 F589	I581-Q585 HydrophobicContact CG2-CG 4.42Å; I581-Q585 WeakPolarHBondContact O-CB 3.22Å; I581-Q585 WeakPolarHBondContact O-CG 3.45Å; I581-Q585 PolarHBondContact O-N 3.46Å; Q585-A587 PolarHBondContact O-N 3.48Å; Q585-M588 PolarHBondContact O-N 3.32Å; Q585-F589 WeakPolarHBondContact O-CD2 3.5Å
586	T	68.3	Low	57.1	Low	80 Å²	80	113 Å²	113	49%	0.491	62%	0.623	S	S	.	*	H	α-helix	trans	-62.4	-28.8	178.5	-56.3	0	0	0	0	112.8	L582 R583	L582-T586 WeakPolarHBondContact O-CB 3.5Å; L582-T586 PolarHBondContact O-N 3.23Å; L582-T586 PolarHBondContact O-OG1 3.42Å; R583-T586 PolarHBondContact O-N 2.93Å
587	A	64.6	Low	55.7	Low	64 Å²	64	113.8 Å²	113.8	53%	0.529	63%	0.634	S	S	.	*	H	α-helix	trans	-73.3	-40.6	175.9	0	0	0	0	0	112.9	R583 M584 Q585 F589 K590	R583-A587 PolarHBondContact O-N 3.13Å; M584-A587 PolarHBondContact O-N 3.36Å; Q585-A587 PolarHBondContact O-N 3.48Å; A587-F589 VanDerWaalsContact C-N 3.29Å; A587-F589 PolarHBondContact O-N 3.13Å; A587-K590 PolarHBondContact O-N 3.17Å
588	M	57.1	Low	54	Low	128 Å²	128	110.7 Å²	110.7	63%	0.631	64%	0.635	S	S	*	*	H	α-helix	trans	-63.9	-30	-178.2	-76.4	-173.3	-78.4	0	0	113.5	M584 Q585 K590	M584-M588 HydrophobicContact CG-CE 4.43Å; M584-M588 PolarHBondContact O-N 2.95Å; Q585-M588 PolarHBondContact O-N 3.32Å; M588-K590 VanDerWaalsContact C-N 3.32Å; M588-K590 PolarHBondContact O-N 3.11Å
589	F	50.4	Low	52.5	Low	189 Å²	189	110.6 Å²	110.6	83%	0.829	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	12	-179.5	-73	-71.1	0	0	0	115.3	Q585 A587	Q585-F589 WeakPolarHBondContact O-CD2 3.5Å; A587-F589 VanDerWaalsContact C-N 3.29Å; A587-F589 PolarHBondContact O-N 3.13Å
590	K	53	Low	50.2	Low	175 Å²	175	118.6 Å²	118.6	76%	0.761	67%	0.67	S	S	*	*	S	Bend	trans	-133.4	2.3	-168.8	-75.5	-168.9	173.1	-177.1	0	118.4	A587 M588	A587-K590 PolarHBondContact O-N 3.17Å; M588-K590 VanDerWaalsContact C-N 3.32Å; M588-K590 PolarHBondContact O-N 3.11Å
591	S	38.1	Very low	48	Very low	112 Å²	112	118.8 Å²	118.8	78%	0.783	68%	0.683	S	S	*	*			trans	-107.2	100.5	179.2	56.7	0	0	0	0	112.6
592	G	30.9	Very low	46.8	Very low	75 Å²	75	120.6 Å²	120.6	77%	0.773	70%	0.7	S	S	*	*			trans	-161.5	66.1	-179.1	0	0	0	0	0	114.2
593	S	31.6	Very low	44.9	Very low	129 Å²	129	122 Å²	122	90%	0.902	72%	0.718	S	S	*	*			trans	-162.7	151.3	163.4	25.4	0	0	0	0	112
594	E	30	Very low	43.1	Very low	185 Å²	185	126.4 Å²	126.4	86%	0.864	73%	0.734	S	S	*	*			trans	-84.4	-179.3	-174.8	-97.7	-161.5	139.2	0	0	114.6
595	P	38.1	Very low	40.9	Very low	112 Å²	112	125.8 Å²	125.8	73%	0.727	74%	0.74	S	S	*	*			cis	-131.9	-174.4	-19.1	26.3	-3.5	0	0	0	113.7
596	A	31.8	Very low	38.9	Very low	92 Å²	92	128.3 Å²	128.3	76%	0.76	76%	0.762	S	S	*	*			trans	-98.7	167.2	174.4	0	0	0	0	0	113.7
597	P	40.1	Very low	36.9	Very low	123 Å²	123	127.6 Å²	127.6	80%	0.799	77%	0.77	S	S	*	*				-157.6	159.8	105.3	40	-21.7	0	0	0	119.3
598	A	29.9	Very low	35.7	Very low	93 Å²	93	130.3 Å²	130.3	77%	0.769	78%	0.782	S	S	*	*			trans	70	154.1	140.4	0	0	0	0	0	121.5
599	V	33.4	Very low	34.3	Very low	116 Å²	116	132.2 Å²	132.2	70%	0.703	79%	0.79	S	S	*	*			cis	-167.8	146	-12.9	122.1	0	0	0	0	113.5
600	K	27	Very low	33.1	Very low	182 Å²	182	130.2 Å²	130.2	79%	0.791	79%	0.787	S	S	*	*			trans	51.3	117.1	155.7	-63.7	166.8	-161.8	172.9	0	124.5
601	S	26.9	Very low	32	Very low	108 Å²	108	128.8 Å²	128.8	76%	0.755	79%	0.788	S	S	*	*				8.4	-177.4	123.6	71.4	0	0	0	0	123.3
602	P	51	Low	32	Very low	119 Å²	119	128.6 Å²	128.6	77%	0.773	78%	0.784	S	S	*	*			cis	-139.6	-178.2	-6.2	43.6	-26.8	0	0	0	117
603	S	29.3	Very low	31.9	Very low	124 Å²	124	133 Å²	133	87%	0.867	78%	0.784	S	S	*	*			trans	-172.7	172.8	138.7	59.4	0	0	0	0	115.2
604	R	32	Very low	31.7	Very low	236 Å²	236	132.5 Å²	132.5	89%	0.891	78%	0.776	S	S	*	*			trans	-126	172.7	-168	-86.6	-175.4	166.4	167.5	-6	110.4
605	C	25.4	Very low	31.7	Very low	106 Å²	106	130.1 Å²	130.1	72%	0.716	77%	0.774	S	S	*	*			cis	-168.9	173.7	-8.6	-109.7	0	0	0	0	109.7
606	V	28.5	Very low	31.2	Very low	147 Å²	147	129.9 Å²	129.9	89%	0.891	78%	0.775	S	S	*	*			trans	145.5	140.5	142	168.4	0	0	0	0	112.1
607	G	24.8	Very low	31.1	Very low	64 Å²	64	133.1 Å²	133.1	66%	0.66	78%	0.779	S	S	*	*			trans	-124.2	-162.8	177.4	0	0	0	0	0	112.5
608	P	40.7	Very low	30.6	Very low	121 Å²	121	133.7 Å²	133.7	79%	0.786	78%	0.78	S	S	*	*			cis	-146.8	177.2	39.5	42.7	-23.7	0	0	0	118.5
609	Q	26.9	Very low	30.7	Very low	168 Å²	168	137.9 Å²	137.9	79%	0.785	78%	0.78	S	S	*	*			trans	54.5	126.8	150.8	-74.8	-99.8	-60.8	0	0	119.1
610	L	25	Very low	30.6	Very low	148 Å²	148	138.6 Å²	138.6	78%	0.775	79%	0.787	S	S	*	*			cis	-157.8	174.7	40.3	-106.8	157.9	0	0	0	113.2
611	N	29.5	Very low	30.9	Very low	145 Å²	145	134.8 Å²	134.8	78%	0.775	78%	0.783	S	S	*	*			trans	-87.3	173.8	-176.6	-85.9	-12.7	0	0	0	114.1
612	P	39.3	Very low	31.4	Very low	107 Å²	107	136.4 Å²	136.4	70%	0.695	79%	0.788	S	S	*	*			cis	-135.3	178.4	14	36.7	-15.3	0	0	0	118.6
613	H	27.9	Very low	30.3	Very low	167 Å²	167	136.9 Å²	136.9	77%	0.773	79%	0.794	S	S	*	*			trans	-8.7	144	165.4	-43.2	-71.1	0	0	0	119.8
614	T	28	Very low	30.3	Very low	120 Å²	120	136.6 Å²	136.6	74%	0.736	79%	0.792	S	S	*	*			cis	-153.4	152.2	36.2	46	0	0	0	0	110.7
615	T	29.1	Very low	30.2	Very low	134 Å²	134	135.9 Å²	135.9	82%	0.822	79%	0.791	S	S	*	*				170.8	150.4	83.4	36.2	0	0	0	0	110.5
616	S	28.2	Very low	30.6	Very low	108 Å²	108	139 Å²	139	76%	0.755	80%	0.8	S	S	*	*			trans	169.7	113.3	154.6	-172.2	0	0	0	0	107.3
617	L	29.2	Very low	30.8	Very low	160 Å²	160	141.3 Å²	141.3	84%	0.838	80%	0.801	S	S	*	*				75.4	120.4	69.8	-68.4	175.6	0	0	0	115.8
618	V	30.3	Very low	31.2	Very low	135 Å²	135	149 Å²	149	82%	0.818	81%	0.809	S	S	*	*			trans	78.6	93.4	170	-164	0	0	0	0	119.2
619	K	32.7	Very low	30.9	Very low	180 Å²	180	151.7 Å²	151.7	78%	0.783	81%	0.811	S	S	*	*			trans	11.3	122.6	146.3	-57.2	179.6	-177.9	179.8	0	120.3
620	P	31.7	Very low	31.1	Very low	131 Å²	131	152.6 Å²	152.6	85%	0.851	82%	0.816	S	S	*	*			trans	-93.8	116.9	144.6	33.3	-25.6	0	0	0	110.8
621	C	32.5	Very low	31.2	Very low	102 Å²	102	153.2 Å²	153.2	69%	0.689	82%	0.82	S	S	*	*			trans	-115.2	157.6	162.1	-62	0	0	0	0	107.9
622	V	37.5	Very low	31.5	Very low	142 Å²	142	155.4 Å²	155.4	86%	0.861	83%	0.825	S	S	*	*			trans	69.5	80.8	-175.4	-166.8	0	0	0	0	114.3
623	S	28.1	Very low	31	Very low	129 Å²	129	158.1 Å²	158.1	90%	0.902	83%	0.834	S	S	*	*			trans	-171.5	86.7	147	-83.4	0	0	0	0	110.5
624	S	29.3	Very low	31.1	Very low	118 Å²	118	154.8 Å²	154.8	83%	0.825	84%	0.835	S	S	*	*			trans	-165.6	66.2	166.2	-165.5	0	0	0	0	110.7
625	Y	30.4	Very low	31	Very low	221 Å²	221	158.4 Å²	158.4	87%	0.867	84%	0.844	S	S	*	*	S	Bend	trans	-143.3	2.1	175.1	-156.7	-101.8	0	0	0	114.4
626	L	32.2	Very low	30.8	Very low	173 Å²	173	157.5 Å²	157.5	91%	0.906	84%	0.843	S	S	*	*	S	Bend	trans	-133.1	12.6	-177.5	-71.5	176.1	0	0	0	114.2
627	E	33.6	Very low	31	Very low	195 Å²	195	157.8 Å²	157.8	91%	0.911	84%	0.842	S	S	*	*			trans	-114.1	57.9	-175.4	-159.4	166.7	-123.8	0	0	112.8
628	R	33.6	Very low	30.8	Very low	224 Å²	224	156.2 Å²	156.2	85%	0.845	84%	0.839	S	S	*	*	S	Bend	trans	-160.1	75.9	161.8	-168.9	-173.8	-64.2	178	0.9	111.8
629	H	33.7	Very low	30.6	Very low	179 Å²	179	156 Å²	156	83%	0.829	84%	0.837	S	S	*	*			trans	-177.1	88.9	149.6	-98.1	-63.6	0	0	0	110.9
630	Q	30.7	Very low	30.5	Very low	187 Å²	187	153.1 Å²	153.1	87%	0.874	84%	0.837	S	S	*	*			trans	-172.5	155	152.6	-109.4	146.4	105.1	0	0	110.7
631	N	28.3	Very low	30.3	Very low	161 Å²	161	155.4 Å²	155.4	86%	0.861	84%	0.837	S	S	*	*			trans	103.7	82.2	177.2	-57.1	-9.8	0	0	0	115.8
632	E	35.6	Very low	30.1	Very low	190 Å²	190	160.7 Å²	160.7	89%	0.888	85%	0.848	S	S	*	*			trans	-124.4	134.3	145.3	-71.7	-168.4	143.2	0	0	107.8
633	D	28.1	Very low	29.6	Very low	165 Å²	165	158.4 Å²	158.4	88%	0.882	84%	0.844	S	S	*	*			trans	-179.4	120.7	145.9	-106.4	-27.7	0	0	0	110.2
634	A	30.4	Very low	29.7	Very low	97 Å²	97	157.8 Å²	157.8	80%	0.802	84%	0.84	S	S	*	*			trans	53.2	143.1	161.3	0	0	0	0	0	120.1
635	E	26.2	Very low	29.5	Very low	196 Å²	196	158.6 Å²	158.6	92%	0.916	84%	0.84	S	S	*	*			cis	-133.2	173.8	7.3	-68.6	-176.1	109.6	0	0	112.2
636	S	24.1	Very low	29.2	Very low	114 Å²	114	156 Å²	156	80%	0.797	84%	0.841	S	S	*	*			trans	-102.7	-179.7	172.6	-133	0	0	0	0	110.4
637	P	33.7	Very low	29.2	Very low	115 Å²	115	155.4 Å²	155.4	75%	0.747	84%	0.837	S	S	*	*			cis	-125.9	-159	2.8	28.9	-2.4	0	0	0	111.2
638	V	23.5	Very low	28.8	Very low	126 Å²	126	149.9 Å²	149.9	76%	0.764	82%	0.82	S	S	*	*			cis	-147.4	147.3	14.5	-174.1	0	0	0	0	109.7
639	V	27.6	Very low	28.9	Very low	130 Å²	130	145 Å²	145	79%	0.788	82%	0.817	S	S	*	*			trans	-140.7	139.2	166.5	174.6	0	0	0	0	109.7
640	P	30.4	Very low	29	Very low	120 Å²	120	142.4 Å²	142.4	78%	0.779	81%	0.814	S	S	*	*			trans	-86.2	145.3	164.7	4.8	14	0	0	0	112
641	E	27	Very low	29.2	Very low	179 Å²	179	141.2 Å²	141.2	84%	0.836	81%	0.808	S	S	*	*			trans	-60.9	154.5	-173.3	-59.2	159.1	97.1	0	0	115.3
642	F	29	Very low	30	Very low	214 Å²	214	142.1 Å²	142.1	94%	0.939	80%	0.8	S	S	*	*				-149.4	164	119.8	-99.8	-64.1	0	0	0	111.1
643	A	27.5	Very low	30.6	Very low	94 Å²	94	142.6 Å²	142.6	78%	0.777	80%	0.799	S	S	*	*			trans	-86.6	160.4	-150.2	0	0	0	0	0	116.9
644	S	28.8	Very low	32.2	Very low	116 Å²	116	141.1 Å²	141.1	81%	0.811	78%	0.784	S	S	*	*			trans	-68.5	144	179.7	55.2	0	0	0	0	115.2
645	V	25.8	Very low	34.5	Very low	135 Å²	135	139.1 Å²	139.1	82%	0.818	76%	0.76	S	S	*	*			trans	-127	142.6	158.9	179.1	0	0	0	0	108.8	I647	V645-I647 PolarHBondContact O-N 3.32Å
646	N	24.8	Very low	37.1	Very low	165 Å²	165	130.2 Å²	130.2	88%	0.882	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-65	128.7	-174.9	-71.5	-49.5	0	0	0	112.7
647	I	30.3	Very low	39.6	Very low	162 Å²	162	127.6 Å²	127.6	83%	0.831	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-82.5	126	168.8	-61.7	174.1	0	0	0	108.9	V645	V645-I647 PolarHBondContact O-N 3.32Å
648	S	27	Very low	41.7	Very low	78 Å²	78	129.6 Å²	129.6	55%	0.545	70%	0.699	S	S	.	*	P	Polyproline II helix	trans	-93.8	162.3	174.5	76.6	0	0	0	0	111	T650	S648-T650 PolarHBondContact O-N 3.32Å
649	P	35	Very low	44.1	Very low	121 Å²	121	129.8 Å²	129.8	79%	0.786	70%	0.696	S	S	*	*	S	Bend	trans	-75.7	124.7	-162.8	28.3	-34.2	0	0	0	114
650	T	35.9	Very low	46.7	Very low	125 Å²	125	125.4 Å²	125.4	77%	0.767	67%	0.668	S	S	*	*			trans	67.7	61.1	167.2	-36.6	0	0	0	0	115.6	S648 R652	S648-T650 PolarHBondContact O-N 3.32Å; T650-R652 PolarHBondContact O-N 3.1Å
651	E	34.1	Very low	49	Very low	163 Å²	163	122.7 Å²	122.7	76%	0.762	65%	0.645	S	S	*	*			trans	-59.9	106.4	157	-69	-171.3	154.2	0	0	110	K653	E651-K653 PolarHBondContact O-N 3.05Å
652	R	45.7	Very low	51.5	Low	179 Å²	179	118.3 Å²	118.3	68%	0.675	64%	0.64	S	S	*	*			trans	-66.8	119.2	168.8	-65.4	179.9	-178.8	176.8	-0.5	107.6	T650 K654	T650-R652 PolarHBondContact O-N 3.1Å; R652-K654 PolarHBondContact O-N 3.44Å
653	K	48.5	Very low	53.8	Low	201 Å²	201	110.4 Å²	110.4	87%	0.874	61%	0.61	S	S	*	*			trans	-58.2	105.9	173.5	-67.1	-175.4	177.9	-175.5	0	109.1	E651 I655	E651-K653 PolarHBondContact O-N 3.05Å; K653-I655 PolarHBondContact O-N 2.91Å
654	K	61.6	Low	56.5	Low	133 Å²	133	110.4 Å²	110.4	58%	0.578	61%	0.61	S	S	*	*			trans	-58.1	129.9	170.6	-69.4	-178.4	179	175.4	0	108.4	R652 L656	R652-K654 PolarHBondContact O-N 3.44Å; K654-L656 VanDerWaalsContact C-N 3.34Å
655	I	78.9	Confident	59.4	Low	56 Å²	56	106.8 Å²	106.8	29%	0.287	58%	0.581	S	S	.	*	S	Bend	trans	-77.4	-30.2	-178.5	-49.9	178.9	0	0	0	109.8	K653 L688 L689	K653-I655 PolarHBondContact O-N 2.91Å; I655-L688 WeakPolarHBondContact CD1-O 3.24Å; I655-L689 HydrophobicContact CB-CD1 4.3Å; I655-L689 HydrophobicContact CG2-CB 4.04Å; I655-L689 HydrophobicContact CG2-CD1 4.5Å
656	L	80	Confident	62.2	Low	9 Å²	9	104.3 Å²	104.3	5%	0.047	56%	0.563	C	S	.	*	S	Bend	trans	-81.2	139.4	172.3	-164.8	69	0	0	0	111.2	K225 Y284 K654 L660 Q661 L682 L689	K225-L656 HydrophobicContact CD-CD2 4.24Å; Y284-L656 HydrophobicContact CD1-CD1 4.07Å; Y284-L656 HydrophobicContact CD1-CD2 4.44Å; K654-L656 VanDerWaalsContact C-N 3.34Å; L656-L660 HydrophobicContact CD1-CB 3.7Å; L656-L660 HydrophobicContact CD1-CD1 3.73Å; L656-L660 HydrophobicContact CD1-CG 4.38Å; L656-L660 HydrophobicContact CD2-CB 4.02Å; L656-L660 HydrophobicContact CG-CB 3.78Å; L656-Q661 HydrophobicContact CD2-CB 4.4Å; L656-L682 HydrophobicContact CD1-CD2 3.99Å; L656-L682 HydrophobicContact CD2-CD2 4.01Å; L656-L682 HydrophobicContact CG-CD2 4.47Å; L656-L689 HydrophobicContact CD1-CD2 4.28Å
657	S	77.8	Confident	65	Low	58 Å²	58	99.9 Å²	99.9	41%	0.406	54%	0.537	S	S	.	.			trans	-71.8	148.7	175.1	66.9	0	0	0	0	111.9	N659 L660 Q661	S657-N659 PolarHBondContact O-N 2.98Å; S657-L660 PolarHBondContact O-N 2.79Å; S657-L660 WeakPolarHBondContact OG-CG 3.42Å; S657-Q661 PolarHBondContact O-N 3.05Å
658	E	77.2	Confident	67.7	Low	157 Å²	157	99.7 Å²	99.7	73%	0.734	53%	0.532	S	S	*	.	H	α-helix	trans	-60.1	-33.3	-176.2	-58.1	-170.9	136.7	0	0	112.9	Q661 A662	E658-Q661 WeakPolarHBondContact O-CB 3.49Å; E658-Q661 PolarHBondContact O-N 3.38Å; E658-A662 WeakPolarHBondContact O-CB 3.36Å; E658-A662 PolarHBondContact O-N 3.32Å
659	N	74	Confident	70.7	Confident	130 Å²	130	101.3 Å²	101.3	70%	0.695	54%	0.535	S	S	*	.	H	α-helix	trans	-59.4	-51.6	172.8	-65	-21.4	0	0	0	111.3	S657 Q661 A662 C663	S657-N659 PolarHBondContact O-N 2.98Å; N659-Q661 VanDerWaalsContact C-N 3.26Å; N659-Q661 PolarHBondContact O-N 2.98Å; N659-A662 PolarHBondContact O-N 3.43Å; N659-A662 VanDerWaalsContact O-N 3.15Å; N659-C663 PolarHBondContact O-N 3.12Å; N659-C663 PolarHBondContact O-SG 2.97Å
660	L	80.9	Confident	73.5	Confident	39 Å²	39	96.9 Å²	96.9	20%	0.204	50%	0.503	C	S	.	.	H	α-helix	trans	-68	-26.9	178.1	-67.9	174.9	0	0	0	112.2	K225 Y283 Y284 L656 S657	K225-L660 PolarHBondContact NZ-O 3.25Å; Y283-L660 HydrophobicContact CD1-CD2 3.73Å; Y283-L660 HydrophobicContact CE1-CD2 3.28Å; Y284-L660 HydrophobicContact CD1-CB 4.34Å; Y284-L660 HydrophobicContact CE1-CB 4.22Å; Y284-L660 HydrophobicContact CE1-CD2 4.46Å; L656-L660 HydrophobicContact CD1-CB 3.7Å; L656-L660 HydrophobicContact CD1-CD1 3.73Å; L656-L660 HydrophobicContact CD1-CG 4.38Å; L656-L660 HydrophobicContact CD2-CB 4.02Å; L656-L660 HydrophobicContact CG-CB 3.78Å; S657-L660 PolarHBondContact O-N 2.79Å; S657-L660 WeakPolarHBondContact OG-CG 3.42Å
661	Q	79.8	Confident	76.2	Confident	62 Å²	62	98.2 Å²	98.2	29%	0.29	50%	0.5	S	S	.	.	H	α-helix	trans	-66.7	-38.7	171.6	-169.6	68	29.3	0	0	111.8	E224 L656 S657 E658 N659	E224-Q661 PolarHBondContact O-NE2 2.97Å; L656-Q661 HydrophobicContact CD2-CB 4.4Å; S657-Q661 PolarHBondContact O-N 3.05Å; E658-Q661 WeakPolarHBondContact O-CB 3.49Å; E658-Q661 PolarHBondContact O-N 3.38Å; N659-Q661 VanDerWaalsContact C-N 3.26Å; N659-Q661 PolarHBondContact O-N 2.98Å
662	A	78.1	Confident	78.8	Confident	88 Å²	88	93.2 Å²	93.2	73%	0.727	49%	0.487	S	S	*	.	H	α-helix	trans	-84.4	-24.1	-175.8	0	0	0	0	0	114.9	E658 N659	E658-A662 WeakPolarHBondContact O-CB 3.36Å; E658-A662 PolarHBondContact O-N 3.32Å; N659-A662 PolarHBondContact O-N 3.43Å; N659-A662 VanDerWaalsContact O-N 3.15Å
663	C	78.9	Confident	81	Confident	47 Å²	47	86.4 Å²	86.4	32%	0.318	47%	0.466	S	S	.	.			trans	-61.9	153.5	174.5	-68.7	0	0	0	0	112.3	K225 Y283 N659	K225-C663 WeakPolarHBondContact CE-O 3.4Å; K225-C663 PolarHBondContact NZ-O 3.12Å; Y283-C663 PolarHBondContact OH-SG 3Å; Y283-C663 VanDerWaalsContact OH-SG 3.39Å; N659-C663 PolarHBondContact O-N 3.12Å; N659-C663 PolarHBondContact O-SG 2.97Å
664	A	83.4	Confident	82.8	Confident	94 Å²	94	84.4 Å²	84.4	78%	0.777	47%	0.47	S	S	*	.			trans	-122.1	145.5	168	0	0	0	0	0	109.3
665	E	89.4	Confident	84	Confident	41 Å²	41	84.6 Å²	84.6	19%	0.192	47%	0.473	C	S	.	.			trans	-81.1	145.2	171.9	-58.3	-54	124.5	0	0	110.1	L227 L280 Y284 Y670	L227-E665 VanDerWaalsContact O-CG 3.26Å; L227-E665 WeakPolarHBondContact O-CG 3.11Å; L280-E665 HydrophobicContact CD2-CG 4.12Å; Y284-E665 HydrophobicContact CE2-CG 4.45Å; Y284-E665 WeakPolarHBondContact CE2-OE1 3.42Å; Y284-E665 VanDerWaalsContact CZ-OE1 3.24Å; Y284-E665 PolarHBondContact OH-OE1 3.02Å; E665-Y670 HydrophobicContact CB-CE2 3.97Å; E665-Y670 HydrophobicContact CG-CE2 4.31Å; E665-Y670 WeakPolarHBondContact OE2-CE2 3.35Å; E665-Y670 PolarHBondContact OE2-OH 3.09Å
666	D	84.5	Confident	84.6	Confident	82 Å²	82	83.4 Å²	83.4	44%	0.439	48%	0.475	S	S	.	.			trans	-88.3	123.4	167	-167.8	-27	0	0	0	109.2	Q668 D669 Y670	D666-Q668 PolarHBondContact O-N 3.19Å; D666-Q668 WeakPolarHBondContact OD1-CB 3.33Å; D666-Q668 PolarHBondContact OD1-N 3.44Å; D666-Q668 PolarHBondContact OD1-NE2 2.94Å; D666-D669 PolarHBondContact O-N 3.15Å; D666-D669 VanDerWaalsContact O-N 3.12Å; D666-Y670 VanDerWaalsContact O-CD2 3.31Å; D666-Y670 WeakPolarHBondContact O-CD2 3.49Å
667	E	84.6	Confident	85.3	Confident	72 Å²	72	83.6 Å²	83.6	34%	0.336	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-57.1	-21.4	175.4	-70.9	-173.9	-159.5	0	0	112.8	L228 F368 D669 Y670	L228-E667 HydrophobicContact CD1-CG 4.35Å; F368-E667 WeakPolarHBondContact CD1-OE1 3.33Å; E667-D669 VanDerWaalsContact C-N 3.33Å; E667-Y670 PolarHBondContact O-N 3.32Å
668	Q	86.3	Confident	86.1	Confident	158 Å²	158	82.7 Å²	82.7	74%	0.738	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-74.2	-20	179.6	-79	88.9	119	0	0	113.5	D666 Y670	D666-Q668 PolarHBondContact O-N 3.19Å; D666-Q668 WeakPolarHBondContact OD1-CB 3.33Å; D666-Q668 PolarHBondContact OD1-N 3.44Å; D666-Q668 PolarHBondContact OD1-NE2 2.94Å; Q668-Y670 VanDerWaalsContact C-N 3.25Å; Q668-Y670 PolarHBondContact O-N 2.96Å
669	D	90.4	Very high	86.9	Confident	113 Å²	113	75.2 Å²	75.2	60%	0.604	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-80.4	-4.4	175.8	-80.3	-30.1	0	0	0	112.9	K279 D666 E667	K279-D669 PolarHBondContact NZ-O 2.92Å; D666-D669 PolarHBondContact O-N 3.15Å; D666-D669 VanDerWaalsContact O-N 3.12Å; E667-D669 VanDerWaalsContact C-N 3.33Å
670	Y	93.4	Very high	88	Confident	27 Å²	27	69 Å²	69	11%	0.106	40%	0.398	C	S	.	.	S	Bend	trans	-123.8	154.3	-171.5	-65.4	-85.1	0	0	0	113.1	L228 N276 K279 L280 E665 D666 E667 Q668	L228-Y670 HydrophobicContact CD1-CD2 4Å; L228-Y670 HydrophobicContact CD1-CG 4.24Å; L228-Y670 HydrophobicContact CD2-CD1 3.54Å; L228-Y670 HydrophobicContact CD2-CD2 3.93Å; L228-Y670 HydrophobicContact CD2-CE1 4.07Å; L228-Y670 HydrophobicContact CD2-CE2 4.43Å; L228-Y670 HydrophobicContact CD2-CG 3.46Å; L228-Y670 VanDerWaalsContact CD2-CG 3.46Å; N276-Y670 HydrophobicContact CB-CD1 3.94Å; N276-Y670 WeakPolarHBondContact OD1-CB 3.31Å; N276-Y670 WeakPolarHBondContact OD1-CD1 3.48Å; K279-Y670 HydrophobicContact CB-CE1 3.72Å; K279-Y670 HydrophobicContact CD-CD1 3.98Å; K279-Y670 HydrophobicContact CD-CE1 3.86Å; K279-Y670 HydrophobicContact CG-CE1 4.47Å; L280-Y670 HydrophobicContact CD2-CE1 4.14Å; L280-Y670 WeakPolarHBondContact CD2-OH 3.41Å; L280-Y670 HydrophobicContact CG-CE1 3.89Å; E665-Y670 HydrophobicContact CB-CE2 3.97Å; E665-Y670 HydrophobicContact CG-CE2 4.31Å; E665-Y670 WeakPolarHBondContact OE2-CE2 3.35Å; E665-Y670 PolarHBondContact OE2-OH 3.09Å; D666-Y670 VanDerWaalsContact O-CD2 3.31Å; D666-Y670 WeakPolarHBondContact O-CD2 3.49Å; E667-Y670 PolarHBondContact O-N 3.32Å; Q668-Y670 VanDerWaalsContact C-N 3.25Å; Q668-Y670 PolarHBondContact O-N 2.96Å
671	E	92.3	Very high	88.7	Confident	154 Å²	154	67.1 Å²	67.1	72%	0.72	39%	0.388	S	S	*	.			trans	-91.9	107.9	-179.5	-171.7	164.3	-151	0	0	110.1	M230 N276	M230-E671 VanDerWaalsContact CE-O 3.24Å; M230-E671 WeakPolarHBondContact CE-O 3.25Å; N276-E671 PolarHBondContact ND2-O 2.68Å; N276-E671 PolarHBondContact OD1-N 3.46Å
672	A	90.3	Very high	89.5	Confident	58 Å²	58	64.2 Å²	64.2	48%	0.479	37%	0.374	S	S	.	.			trans	-70.2	143	179.5	0	0	0	0	0	111.6	M230	M230-A672 HydrophobicContact CB-CB 4.35Å; M230-A672 HydrophobicContact SD-CB 4.22Å
673	P	91.1	Very high	90.4	Very high	35 Å²	35	60 Å²	60	23%	0.227	34%	0.34	C	S	.	.			trans	-66.4	142.6	179.2	29.9	-36.2	0	0	0	111.3	E675 L678	P673-E675 VanDerWaalsContact C-N 3.31Å; P673-E675 PolarHBondContact O-N 2.86Å; P673-L678 HydrophobicContact CB-CD1 4.13Å; P673-L678 HydrophobicContact CB-CG 4.24Å; P673-L678 HydrophobicContact CG-CD1 4.27Å; P673-L678 HydrophobicContact CG-CG 4.08Å
674	V	86.6	Confident	91.1	Very high	159 Å²	159	58.2 Å²	58.2	96%	0.964	33%	0.328	S	S	*	.	S	Bend	trans	-64.4	-36.3	-179.8	-179.3	0	0	0	0	111.7
675	E	86.6	Confident	91.6	Very high	138 Å²	138	53.7 Å²	53.7	65%	0.645	29%	0.291	S	S	*	.	S	Bend	trans	-135.8	153.5	177.1	-156.2	-169.9	118.2	0	0	110.1	K262 P673	K262-E675 IonicContact NZ-OE1 2.69Å; K262-E675 PolarHBondContact NZ-OE1 3.29Å; K262-E675 IonicContact NZ-OE2 3.63Å; K262-E675 PolarHBondContact NZ-OE2 2.93Å; P673-E675 VanDerWaalsContact C-N 3.31Å; P673-E675 PolarHBondContact O-N 2.86Å
676	G	90.3	Very high	91.7	Very high	31 Å²	31	57.2 Å²	57.2	32%	0.32	31%	0.307	S	S	.	.	S	Bend	trans	64.9	-140.3	-179.2	0	0	0	0	0	112.9	G231 T232	G231-G676 CarbonylContact C-O 3.59Å; G231-G676 WeakPolarHBondContact CA-O 3.36Å; T232-G676 PolarHBondContact N-O 3.49Å; T232-G676 CarbonylContact O-C 3.58Å
677	N	94.6	Very high	92.1	Very high	12 Å²	12	56.5 Å²	56.5	6%	0.064	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	161.2	-172.6	58.1	86.1	0	0	0	113.6	M230 T232 V367 S695 V696	M230-N677 VanDerWaalsContact O-CA 3.23Å; M230-N677 WeakPolarHBondContact O-CA 3.45Å; M230-N677 WeakPolarHBondContact O-CB 3.48Å; T232-N677 WeakPolarHBondContact O-CB 3.3Å; T232-N677 PolarHBondContact O-ND2 3.24Å; V367-N677 HydrophobicContact CB-CB 4.23Å; V367-N677 HydrophobicContact CG2-CB 3.36Å; N677-S695 WeakPolarHBondContact O-CB 3.22Å; N677-S695 WeakPolarHBondContact OD1-CA 3.23Å; N677-V696 PolarHBondContact ND2-O 3.05Å; N677-V696 PolarHBondContact OD1-N 2.97Å
678	L	94.7	Very high	92.6	Very high	39 Å²	39	53.3 Å²	53.3	20%	0.204	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	130.8	176.6	-65.6	173.7	0	0	0	109.9	A229 M230 P673 Y680 R693	A229-L678 CarbonylContact C-O 3.51Å; A229-L678 WeakPolarHBondContact CA-O 3.36Å; M230-L678 PolarHBondContact N-O 2.96Å; M230-L678 PolarHBondContact O-N 3.34Å; P673-L678 HydrophobicContact CB-CD1 4.13Å; P673-L678 HydrophobicContact CB-CG 4.24Å; P673-L678 HydrophobicContact CG-CD1 4.27Å; P673-L678 HydrophobicContact CG-CG 4.08Å; L678-Y680 HydrophobicContact CB-CE2 3.99Å; L678-R693 HydrophobicContact CD2-CG 4.23Å
679	L	95.6	Very high	93	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.1	170.8	-55.5	93.7	0	0	0	110.1	L228 A229 V367 T372 R693 S694 V696 H746	L228-L679 WeakPolarHBondContact O-CA 3.47Å; A229-L679 HydrophobicContact CB-CD2 4.2Å; A229-L679 HydrophobicContact CB-CG 4.25Å; V367-L679 HydrophobicContact CG1-CD1 3.82Å; V367-L679 HydrophobicContact CG1-CD2 3.69Å; V367-L679 HydrophobicContact CG1-CG 3.75Å; T372-L679 HydrophobicContact CG2-CD2 3.92Å; L679-R693 WeakPolarHBondContact O-CA 3.49Å; L679-S694 PolarHBondContact N-O 3.29Å; L679-S694 PolarHBondContact O-N 3.35Å; L679-S694 PolarHBondContact O-OG 3.48Å; L679-V696 HydrophobicContact CD1-CB 4.48Å; L679-V696 HydrophobicContact CD1-CG2 3.94Å; L679-H746 VanDerWaalsContact CB-CE1 3.45Å; L679-H746 WeakPolarHBondContact CB-CE1 3.44Å; L679-H746 WeakPolarHBondContact CD2-CE1 3.39Å
680	Y	96.5	Very high	93.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	115.3	173.6	-60.8	-95.3	0	0	0	108.4	L227 L228 M230 D274 N276 A277 L280 L678 M691 R693	L227-Y680 PolarHBondContact N-O 2.7Å; L228-Y680 HydrophobicContact CB-CD2 3.93Å; L228-Y680 HydrophobicContact CB-CG 4.5Å; L228-Y680 HydrophobicContact CD2-CD2 3.93Å; L228-Y680 HydrophobicContact CD2-CE2 4.07Å; L228-Y680 HydrophobicContact CG-CD2 4.14Å; L228-Y680 PolarHBondContact O-N 3.4Å; M230-Y680 HydrophobicContact CE-CE2 4.45Å; D274-Y680 PolarHBondContact OD1-OH 3.01Å; D274-Y680 PolarHBondContact OD2-OH 2.88Å; N276-Y680 HydrophobicContact CB-CE2 4.39Å; A277-Y680 HydrophobicContact CB-CE1 4.09Å; L280-Y680 HydrophobicContact CD1-CD1 3.69Å; L280-Y680 HydrophobicContact CD1-CD2 4.01Å; L280-Y680 HydrophobicContact CD1-CE1 4.36Å; L280-Y680 HydrophobicContact CD1-CG 3.49Å; L280-Y680 VanDerWaalsContact CD1-CG 3.49Å; L678-Y680 HydrophobicContact CB-CE2 3.99Å; Y680-M691 HydrophobicContact CD1-SD 4.44Å; Y680-R693 HydrophobicContact CD1-CB 4.15Å; Y680-R693 HydrophobicContact CD1-CG 4.06Å; Y680-R693 HydrophobicContact CE1-CB 3.96Å; Y680-R693 HydrophobicContact CE1-CG 3.54Å; Y680-R693 HydrophobicContact CE2-CG 4.48Å; Y680-R693 WeakPolarHBondContact OH-CD 3.43Å
681	K	96.1	Very high	93.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	144.5	-180	-73.4	-173.8	167.9	-175.5	0	110.8	F223 Q226 T372 E373 Y683 M691 V692 L745 H746	F223-K681 HydrophobicContact CD2-CD 4.2Å; F223-K681 HydrophobicContact CE2-CB 4.34Å; F223-K681 HydrophobicContact CE2-CD 3.81Å; F223-K681 HydrophobicContact CE2-CG 4.02Å; Q226-K681 HydrophobicContact CB-CG 4.2Å; Q226-K681 HydrophobicContact CG-CG 4.06Å; T372-K681 WeakPolarHBondContact OG1-CE 3.47Å; T372-K681 PolarHBondContact OG1-NZ 2.81Å; E373-K681 IonicContact OE1-NZ 2.63Å; E373-K681 PolarHBondContact OE1-NZ 2.71Å; K681-Y683 HydrophobicContact CB-CD2 4.44Å; K681-Y683 HydrophobicContact CB-CE2 3.47Å; K681-Y683 VanDerWaalsContact CB-CE2 3.47Å; K681-Y683 WeakPolarHBondContact CB-OH 3.47Å; K681-Y683 WeakPolarHBondContact CD-OH 3.38Å; K681-M691 CarbonylContact O-C 3.54Å; K681-M691 WeakPolarHBondContact O-CA 3.32Å; K681-V692 PolarHBondContact N-O 2.69Å; K681-V692 PolarHBondContact O-N 2.73Å; K681-L745 WeakPolarHBondContact CD-O 3.11Å; K681-L745 PolarHBondContact NZ-O 3.04Å; K681-H746 PolarHBondContact NZ-ND1 3.02Å
682	L	95.9	Very high	93.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	130.6	-176.8	-162.9	69.9	0	0	0	109.6	E224 K225 L227 Y284 P286 L656 L689 M691	E224-L682 PolarHBondContact N-O 2.88Å; K225-L682 HydrophobicContact CB-CB 4.48Å; K225-L682 PolarHBondContact N-O 2.81Å; K225-L682 PolarHBondContact O-N 2.79Å; L227-L682 HydrophobicContact CD1-CB 4.25Å; L227-L682 HydrophobicContact CD1-CD1 4.49Å; L227-L682 HydrophobicContact CD2-CB 4.04Å; L227-L682 HydrophobicContact CD2-CD2 4.27Å; L227-L682 HydrophobicContact CG-CB 4.2Å; Y284-L682 HydrophobicContact CD1-CD2 4.35Å; P286-L682 HydrophobicContact CB-CD1 4.23Å; L656-L682 HydrophobicContact CD1-CD2 3.99Å; L656-L682 HydrophobicContact CD2-CD2 4.01Å; L656-L682 HydrophobicContact CG-CD2 4.47Å; L682-L689 HydrophobicContact CD1-CD1 4.2Å; L682-L689 HydrophobicContact CD1-CD2 4.47Å; L682-L689 HydrophobicContact CD1-CG 3.96Å; L682-L689 HydrophobicContact CD2-CD1 3.93Å; L682-L689 HydrophobicContact CD2-CD2 4.22Å; L682-L689 HydrophobicContact CD2-CG 4.24Å; L682-L689 HydrophobicContact CG-CD1 3.79Å; L682-L689 HydrophobicContact CG-CG 4.11Å; L682-M691 HydrophobicContact CD1-CB 3.92Å
683	Y	96.2	Very high	94.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	147.7	-176.9	-54.9	-97.7	0	0	0	110.8	L221 T222 F223 K681 V690 V692 L745	L221-Y683 HydrophobicContact CD1-CD1 4.4Å; L221-Y683 HydrophobicContact CD1-CG 4.07Å; L221-Y683 HydrophobicContact CD2-CD1 4.21Å; L221-Y683 HydrophobicContact CD2-CG 4.42Å; L221-Y683 HydrophobicContact CG-CD1 3.88Å; L221-Y683 HydrophobicContact CG-CG 4.06Å; T222-Y683 CarbonylContact O-C 3.48Å; T222-Y683 WeakPolarHBondContact O-CA 3.38Å; T222-Y683 WeakPolarHBondContact O-CB 3.38Å; F223-Y683 HydrophobicContact CB-CD1 4.05Å; F223-Y683 HydrophobicContact CB-CE1 3.99Å; F223-Y683 AromaticContact CD2-CE1 3.98Å; F223-Y683 HydrophobicContact CD2-CE1 3.98Å; K681-Y683 HydrophobicContact CB-CD2 4.44Å; K681-Y683 HydrophobicContact CB-CE2 3.47Å; K681-Y683 VanDerWaalsContact CB-CE2 3.47Å; K681-Y683 WeakPolarHBondContact CB-OH 3.47Å; K681-Y683 WeakPolarHBondContact CD-OH 3.38Å; Y683-V690 PolarHBondContact N-O 2.93Å; Y683-V690 PolarHBondContact O-N 2.88Å; Y683-V692 HydrophobicContact CD2-CB 4.42Å; Y683-V692 HydrophobicContact CD2-CG2 3.72Å; Y683-V692 HydrophobicContact CE2-CB 3.96Å; Y683-V692 HydrophobicContact CE2-CG2 3.67Å; Y683-L745 HydrophobicContact CE1-CD2 4.38Å; Y683-L745 HydrophobicContact CE2-CD2 3.81Å; Y683-L745 VanDerWaalsContact OH-CA 3.3Å; Y683-L745 WeakPolarHBondContact OH-CA 3.32Å; Y683-L745 VanDerWaalsContact OH-CD2 3.3Å; Y683-L745 WeakPolarHBondContact OH-CD2 3.37Å; Y683-L745 PolarHBondContact OH-O 2.57Å
684	S	94.9	Very high	94.3	Very high	9 Å²	9	29.2 Å²	29.2	6%	0.063	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	139.9	164.2	48.2	0	0	0	0	110.9	T222 E224 L688	T222-S684 PolarHBondContact N-O 3.16Å; T222-S684 PolarHBondContact O-N 2.97Å; T222-S684 PolarHBondContact O-OG 2.93Å; T222-S684 PolarHBondContact OG1-O 3.06Å; T222-S684 PolarHBondContact OG1-OG 3.11Å; E224-S684 WeakPolarHBondContact OE1-CB 3.46Å; E224-S684 PolarHBondContact OE1-OG 2.98Å; S684-L688 WeakPolarHBondContact CA-O 3.33Å
685	L	94.3	Very high	94.7	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	87.2	172.8	-175.1	66.9	0	0	0	107.9	L219 L221 D687 L688 L787 L790 H791 L794	L219-L685 HydrophobicContact CD1-CD1 3.74Å; L219-L685 HydrophobicContact CD1-CG 4.24Å; L219-L685 HydrophobicContact CD2-CD1 4.37Å; L219-L685 HydrophobicContact CG-CD1 3.96Å; L221-L685 HydrophobicContact CD1-CB 4.32Å; L221-L685 HydrophobicContact CD1-CD1 4.48Å; L685-D687 PolarHBondContact O-N 3.3Å; L685-L688 PolarHBondContact N-O 3.04Å; L685-L688 PolarHBondContact O-N 3.46Å; L685-L787 HydrophobicContact CD1-CD2 4.05Å; L685-L790 HydrophobicContact CD2-CD2 3.8Å; L685-L790 HydrophobicContact CD2-CG 3.92Å; L685-H791 HydrophobicContact CD2-CB 3.95Å; L685-H791 HydrophobicContact CG-CB 4.24Å; L685-H791 PolarHBondContact O-CD2 3.34Å; L685-L794 HydrophobicContact CD2-CD1 4.36Å
686	Q	91.5	Very high	95	Very high	115 Å²	115	18.7 Å²	18.7	54%	0.537	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	-81.3	-173.6	-174.6	64.1	74.3	0	0	114.8	N216 L219	N216-Q686 PolarHBondContact ND2-OE1 3.2Å; N216-Q686 VanDerWaalsContact ND2-OE1 3.15Å; L219-Q686 HydrophobicContact CD1-CB 3.72Å
687	D	91.4	Very high	94.9	Very high	67 Å²	67	20.7 Å²	20.7	36%	0.358	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.4	2.2	-179.1	60.6	-38.9	0	0	0	112.7	L685 H791 K795	L685-D687 PolarHBondContact O-N 3.3Å; D687-H791 IonicContact OD1-CD2 3.85Å; D687-H791 IonicContact OD1-CE1 3.54Å; D687-H791 IonicContact OD1-NE2 2.74Å; D687-H791 PolarHBondContact OD1-NE2 2.99Å; D687-K795 IonicContact OD1-NZ 3.73Å; D687-K795 IonicContact OD2-NZ 2.63Å; D687-K795 PolarHBondContact OD2-NZ 3.02Å
688	L	94.9	Very high	94.9	Very high	5 Å²	5	20.9 Å²	20.9	3%	0.026	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137.3	179	-57.8	177.5	0	0	0	111.2	I655 S684 L685 V690 L794 K795 T798	I655-L688 WeakPolarHBondContact CD1-O 3.24Å; S684-L688 WeakPolarHBondContact CA-O 3.33Å; L685-L688 PolarHBondContact N-O 3.04Å; L685-L688 PolarHBondContact O-N 3.46Å; L688-V690 HydrophobicContact CB-CG2 4.34Å; L688-L794 HydrophobicContact CD1-CB 3.59Å; L688-K795 HydrophobicContact CD1-CB 4.29Å; L688-T798 HydrophobicContact CD2-CG2 4.25Å
689	L	95.8	Very high	94.8	Very high	5 Å²	5	19 Å²	19	3%	0.026	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118	170.4	-169.1	65.4	0	0	0	108.9	H287 V288 I655 L656 L682	H287-L689 PolarHBondContact N-O 2.81Å; H287-L689 WeakPolarHBondContact ND1-CB 3.27Å; H287-L689 PolarHBondContact ND1-N 3.33Å; V288-L689 PolarHBondContact N-O 2.96Å; I655-L689 HydrophobicContact CB-CD1 4.3Å; I655-L689 HydrophobicContact CG2-CB 4.04Å; I655-L689 HydrophobicContact CG2-CD1 4.5Å; L656-L689 HydrophobicContact CD1-CD2 4.28Å; L682-L689 HydrophobicContact CD1-CD1 4.2Å; L682-L689 HydrophobicContact CD1-CD2 4.47Å; L682-L689 HydrophobicContact CD1-CG 3.96Å; L682-L689 HydrophobicContact CD2-CD1 3.93Å; L682-L689 HydrophobicContact CD2-CD2 4.22Å; L682-L689 HydrophobicContact CD2-CG 4.24Å; L682-L689 HydrophobicContact CG-CD1 3.79Å; L682-L689 HydrophobicContact CG-CG 4.11Å
690	V	97.4	Very high	94.6	Very high	2 Å²	2	19.2 Å²	19.2	1%	0.012	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	121.2	-169.9	-174.8	0	0	0	0	110	V288 L290 Y683 L688 V692 L794	V288-V690 HydrophobicContact CB-CG1 4.35Å; V288-V690 HydrophobicContact CB-CG2 4.41Å; V288-V690 CarbonylContact O-C 3.49Å; V288-V690 WeakPolarHBondContact O-CA 3.49Å; L290-V690 HydrophobicContact CD2-CG1 4.05Å; L290-V690 HydrophobicContact CG-CG1 4.11Å; Y683-V690 PolarHBondContact N-O 2.93Å; Y683-V690 PolarHBondContact O-N 2.88Å; L688-V690 HydrophobicContact CB-CG2 4.34Å; V690-V692 HydrophobicContact CG1-CG2 4.28Å; V690-L794 HydrophobicContact CG1-CD1 4.45Å; V690-L794 HydrophobicContact CG2-CD1 3.81Å
691	M	97.7	Very high	94.2	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	132.8	169.1	-171.8	167.4	70.7	0	0	110.1	L227 A277 L280 C281 P286 V288 C289 L290 Y680 K681 L682	L227-M691 HydrophobicContact CD1-CG 4.28Å; L227-M691 HydrophobicContact CD1-SD 3.55Å; L227-M691 VanDerWaalsContact CD1-SD 3.55Å; A277-M691 HydrophobicContact CB-CE 4.19Å; L280-M691 HydrophobicContact CB-CE 3.93Å; L280-M691 HydrophobicContact CB-SD 3.79Å; L280-M691 HydrophobicContact CD1-SD 4.15Å; C281-M691 VanDerWaalsContact SG-CE 3.52Å; P286-M691 HydrophobicContact CB-CB 4.21Å; P286-M691 HydrophobicContact CG-CB 4.3Å; V288-M691 PolarHBondContact O-N 3.18Å; C289-M691 CarbonylContact C-O 3.56Å; C289-M691 WeakPolarHBondContact CA-O 3.42Å; C289-M691 HydrophobicContact CB-CE 4.43Å; C289-M691 WeakPolarHBondContact SG-CE 3.37Å; L290-M691 PolarHBondContact N-O 2.86Å; Y680-M691 HydrophobicContact CD1-SD 4.44Å; K681-M691 CarbonylContact O-C 3.54Å; K681-M691 WeakPolarHBondContact O-CA 3.32Å; L682-M691 HydrophobicContact CD1-CB 3.92Å
692	V	97.9	Very high	93.6	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	126.2	177.7	-172.3	0	0	0	0	109.4	L290 L295 K681 Y683 V690 L745	L290-V692 HydrophobicContact CD1-CB 4.29Å; L290-V692 HydrophobicContact CD1-CG1 4.02Å; L290-V692 HydrophobicContact CD1-CG2 3.82Å; L290-V692 WeakPolarHBondContact O-CA 3.19Å; L295-V692 HydrophobicContact CD2-CG1 4.36Å; L295-V692 HydrophobicContact CD2-CG2 4.2Å; K681-V692 PolarHBondContact N-O 2.69Å; K681-V692 PolarHBondContact O-N 2.73Å; Y683-V692 HydrophobicContact CD2-CB 4.42Å; Y683-V692 HydrophobicContact CD2-CG2 3.72Å; Y683-V692 HydrophobicContact CE2-CB 3.96Å; Y683-V692 HydrophobicContact CE2-CG2 3.67Å; V690-V692 HydrophobicContact CG1-CG2 4.28Å; V692-L745 HydrophobicContact CB-CD2 4.19Å; V692-L745 HydrophobicContact CG1-CD1 4.4Å; V692-L745 HydrophobicContact CG1-CD2 3.89Å; V692-L745 HydrophobicContact CG2-CD2 4.16Å
693	R	96.8	Very high	92.8	Very high	27 Å²	27	32 Å²	32	10%	0.102	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	121.8	165.4	-167.4	-173.7	77.8	-157.1	-2.8	109.3	A269 R270 I271 D274 L290 R292 L678 L679 Y680	A269-R693 PolarHBondContact O-NH2 2.88Å; R270-R693 PolarHBondContact O-NH1 2.74Å; I271-R693 HydrophobicContact CD1-CB 3.56Å; I271-R693 HydrophobicContact CG1-CB 4.45Å; D274-R693 WeakPolarHBondContact OD2-CD 3.27Å; D274-R693 IonicContact OD2-CZ 2.79Å; D274-R693 IonicContact OD2-NE 3.67Å; D274-R693 IonicContact OD2-NH1 3.68Å; D274-R693 PolarHBondContact OD2-NH1 3.39Å; L290-R693 PolarHBondContact O-N 2.8Å; R292-R693 PolarHBondContact N-O 2.77Å; L678-R693 HydrophobicContact CD2-CG 4.23Å; L679-R693 WeakPolarHBondContact O-CA 3.49Å; Y680-R693 HydrophobicContact CD1-CB 4.15Å; Y680-R693 HydrophobicContact CD1-CG 4.06Å; Y680-R693 HydrophobicContact CE1-CB 3.96Å; Y680-R693 HydrophobicContact CE1-CG 3.54Å; Y680-R693 HydrophobicContact CE2-CG 4.48Å; Y680-R693 WeakPolarHBondContact OH-CD 3.43Å
694	S	95.4	Very high	91.6	Very high	4 Å²	4	32.3 Å²	32.3	3%	0.028	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	171.3	-179.6	63.2	0	0	0	0	111.2	L679 H746	L679-S694 PolarHBondContact N-O 3.29Å; L679-S694 PolarHBondContact O-N 3.35Å; L679-S694 PolarHBondContact O-OG 3.48Å; S694-H746 WeakPolarHBondContact CB-NE2 3.46Å; S694-H746 PolarHBondContact OG-CE1 2.82Å; S694-H746 PolarHBondContact OG-NE2 3.42Å
695	S	94.3	Very high	90.2	Very high	67 Å²	67	34.1 Å²	34.1	47%	0.469	19%	0.19	S	C	.	.			trans	-142	159.5	173.6	58.6	0	0	0	0	109.5	N677	N677-S695 WeakPolarHBondContact O-CB 3.22Å; N677-S695 WeakPolarHBondContact OD1-CA 3.23Å
696	V	93.4	Very high	88.6	Confident	9 Å²	9	42 Å²	42	6%	0.055	23%	0.232	C	C	.	.			trans	-124.7	112.7	-179.5	174.2	0	0	0	0	108.7	V233 L370 N677 L679 L698 P713	V233-V696 HydrophobicContact CG2-CG1 4.06Å; V233-V696 WeakPolarHBondContact CG2-O 3.45Å; L370-V696 HydrophobicContact CD1-CB 4.3Å; L370-V696 HydrophobicContact CD1-CG1 3.98Å; L370-V696 HydrophobicContact CD1-CG2 4.5Å; N677-V696 PolarHBondContact ND2-O 3.05Å; N677-V696 PolarHBondContact OD1-N 2.97Å; L679-V696 HydrophobicContact CD1-CB 4.48Å; L679-V696 HydrophobicContact CD1-CG2 3.94Å; V696-L698 WeakPolarHBondContact CG1-O 3.31Å; V696-P713 HydrophobicContact CG1-CB 3.7Å; V696-P713 HydrophobicContact CG1-CG 4.26Å; V696-P713 HydrophobicContact CG2-CB 4.2Å; V696-P713 HydrophobicContact CG2-CG 4.24Å
697	S	88.5	Confident	86.9	Confident	73 Å²	73	43.9 Å²	43.9	51%	0.51	25%	0.246	S	C	.	.			trans	-69.9	-36.1	-176.8	-47.4	0	0	0	0	113.3
698	L	93.3	Very high	86.1	Confident	16 Å²	16	47.1 Å²	47.1	8%	0.084	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	152	-168.6	-64.9	168.2	0	0	0	112.1	N234 T236 I359 V696 V714 V716	N234-L698 HydrophobicContact CB-CD2 4.26Å; N234-L698 WeakPolarHBondContact O-CA 3.29Å; T236-L698 HydrophobicContact CG2-CB 4.32Å; T236-L698 HydrophobicContact CG2-CD2 4.25Å; I359-L698 HydrophobicContact CD1-CD1 3.63Å; I359-L698 HydrophobicContact CG2-CD1 4.24Å; I359-L698 HydrophobicContact CG2-CD2 3.91Å; V696-L698 WeakPolarHBondContact CG1-O 3.31Å; L698-V714 HydrophobicContact CB-CB 4.14Å; L698-V714 PolarHBondContact O-N 3.48Å; L698-V716 HydrophobicContact CD1-CG2 4.06Å
699	T	93.5	Very high	85.6	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	147.5	169.3	-176.4	0	0	0	0	111.8	V233 N234 I235 T236 L370 H711 V712	V233-T699 HydrophobicContact CG1-CG2 3.8Å; V233-T699 HydrophobicContact CG2-CG2 4.01Å; N234-T699 PolarHBondContact O-N 3.21Å; I235-T699 CarbonylContact C-O 3.52Å; I235-T699 WeakPolarHBondContact CA-O 3.05Å; I235-T699 HydrophobicContact CB-CG2 4.48Å; I235-T699 HydrophobicContact CG1-CG2 4.06Å; T236-T699 PolarHBondContact N-O 2.73Å; L370-T699 HydrophobicContact CD2-CG2 3.95Å; L370-T699 VanDerWaalsContact CD2-OG1 3.31Å; L370-T699 WeakPolarHBondContact CD2-OG1 3.42Å; T699-H711 WeakPolarHBondContact OG1-CB 3.17Å; T699-V712 VanDerWaalsContact CA-O 3.26Å; T699-V712 WeakPolarHBondContact CA-O 3.37Å; T699-V712 WeakPolarHBondContact CB-O 3.35Å; T699-V712 PolarHBondContact OG1-N 3.33Å; T699-V712 PolarHBondContact OG1-O 3.21Å
700	H	91	Very high	85.2	Confident	5 Å²	5	54 Å²	54	2%	0.023	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	157.6	168.1	70.7	20.5	0	0	0	111.5	T236 H238 R702 V712 V714 A750 Y752	T236-H700 WeakPolarHBondContact O-CA 3.31Å; T236-H700 WeakPolarHBondContact O-CB 3.31Å; H238-H700 AromaticContact CE1-CD2 3.44Å; H238-H700 PolarHBondContact CE1-CD2 3.19Å; H238-H700 VanDerWaalsContact CE1-CD2 3.44Å; H238-H700 AromaticContact CE1-CE1 3.7Å; H238-H700 AromaticContact CE1-CG 3.79Å; H238-H700 AromaticContact CE1-ND1 3.94Å; H238-H700 AromaticContact CE1-NE2 3.36Å; H238-H700 PolarHBondContact CE1-NE2 2.61Å; H238-H700 AromaticContact ND1-CD2 3.16Å; H238-H700 PolarHBondContact ND1-CD2 3.4Å; H238-H700 AromaticContact ND1-CG 3.88Å; H238-H700 AromaticContact ND1-NE2 3.32Å; H238-H700 PolarHBondContact ND1-NE2 2.93Å; H700-R702 PolarHBondContact O-N 2.84Å; H700-V712 VanDerWaalsContact CE1-CG2 3.47Å; H700-V712 WeakPolarHBondContact CE1-CG2 3.5Å; H700-V712 PolarHBondContact N-O 2.84Å; H700-V712 WeakPolarHBondContact ND1-CG2 3.48Å; H700-V712 PolarHBondContact O-N 2.69Å; H700-V712 VanDerWaalsContact O-N 3.12Å; H700-V714 HydrophobicContact CB-CG2 3.88Å; H700-V714 VanDerWaalsContact CD2-CG2 3.43Å; H700-V714 WeakPolarHBondContact CD2-CG2 3.43Å; H700-V714 VanDerWaalsContact CG-CG2 3.43Å; H700-A750 VanDerWaalsContact NE2-CB 3.34Å; H700-A750 WeakPolarHBondContact NE2-CB 3.32Å; H700-Y752 AromaticContact NE2-CE2 3.89Å
701	T	88.1	Confident	85	Confident	52 Å²	52	55.5 Å²	55.5	32%	0.319	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	113.9	176.9	-54.8	0	0	0	0	111	N709 Q710	T701-N709 HydrophobicContact CG2-CB 3.59Å; T701-Q710 CarbonylContact C-O 3.52Å; T701-Q710 WeakPolarHBondContact CA-O 3.49Å
702	R	83.8	Confident	84.7	Confident	51 Å²	51	55.5 Å²	55.5	19%	0.192	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	142.1	172	-178.5	177.7	-179.9	149.7	8.2	109.4	H700 V704 Q710 V712 D771	H700-R702 PolarHBondContact O-N 2.84Å; R702-V704 HydrophobicContact CB-CG2 4.31Å; R702-V704 HydrophobicContact CG-CG2 3.98Å; R702-Q710 PolarHBondContact N-O 3.16Å; R702-Q710 PolarHBondContact O-N 3.2Å; R702-V712 HydrophobicContact CB-CG1 4.07Å; R702-V712 HydrophobicContact CB-CG2 3.66Å; R702-V712 HydrophobicContact CG-CG2 4.49Å; R702-D771 IonicContact CZ-OD2 2.69Å; R702-D771 IonicContact NH1-OD2 2.7Å; R702-D771 IonicContact NH2-OD2 3.7Å; R702-D771 PolarHBondContact NH2-OD2 3.2Å
703	K	78.2	Confident	84.6	Confident	165 Å²	165	55.6 Å²	55.6	72%	0.717	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	121.4	163.5	-74.2	-176.4	177.7	-173.9	0	108.6	N709	K703-N709 WeakPolarHBondContact CG-OD1 3.42Å
704	V	70.8	Confident	84.5	Confident	6 Å²	6	54.6 Å²	54.6	4%	0.036	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	123.9	179.8	179.3	0	0	0	0	107.3	L371 P375 R702 Q708 Q710	L371-V704 HydrophobicContact CD2-CB 4.39Å; L371-V704 HydrophobicContact CD2-CG1 3.98Å; L371-V704 HydrophobicContact CD2-CG2 3.93Å; P375-V704 HydrophobicContact CG-CG1 4.18Å; R702-V704 HydrophobicContact CB-CG2 4.31Å; R702-V704 HydrophobicContact CG-CG2 3.98Å; V704-Q708 PolarHBondContact N-O 3Å; V704-Q708 VanDerWaalsContact N-O 3.16Å; V704-Q710 HydrophobicContact CB-CG 4.3Å; V704-Q710 HydrophobicContact CG2-CB 4.22Å
705	G	66.3	Low	84.4	Confident	47 Å²	47	56.3 Å²	56.3	49%	0.485	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	-156.9	-169.8	0	0	0	0	0	115.6	E378 N707	E378-G705 PolarHBondContact OE1-N 3.1Å; G705-N707 PolarHBondContact O-N 2.91Å; G705-N707 VanDerWaalsContact O-N 3.11Å
706	N	60.5	Low	84.5	Confident	165 Å²	165	54 Å²	54	88%	0.882	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	87.6	-172.3	-70.2	-19.9	0	0	0	112.5
707	N	55.8	Low	84.6	Confident	156 Å²	156	53.7 Å²	53.7	83%	0.834	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.6	5	165.7	-51.1	-39.4	0	0	0	119.1	G705	G705-N707 PolarHBondContact O-N 2.91Å; G705-N707 VanDerWaalsContact O-N 3.11Å
708	Q	75.6	Confident	84.9	Confident	134 Å²	134	50.6 Å²	50.6	63%	0.626	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	122.1	171.3	-69.8	-168.4	-1.1	0	0	112.3	V704 Q710	V704-Q708 PolarHBondContact N-O 3Å; V704-Q708 VanDerWaalsContact N-O 3.16Å; Q708-Q710 HydrophobicContact CB-CG 4.32Å
709	N	84	Confident	85.1	Confident	105 Å²	105	49.9 Å²	49.9	56%	0.561	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	113.7	167.4	-82.6	-4	0	0	0	108.3	T701 K703	T701-N709 HydrophobicContact CG2-CB 3.59Å; K703-N709 WeakPolarHBondContact CG-OD1 3.42Å
710	Q	87.9	Confident	85.1	Confident	51 Å²	51	50 Å²	50	24%	0.238	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	149.1	-179.7	-57	-161.7	41.3	0	0	110.7	L371 T701 R702 V704 Q708	L371-Q710 HydrophobicContact CB-CB 4.34Å; L371-Q710 HydrophobicContact CD2-CB 4.43Å; T701-Q710 CarbonylContact C-O 3.52Å; T701-Q710 WeakPolarHBondContact CA-O 3.49Å; R702-Q710 PolarHBondContact N-O 3.16Å; R702-Q710 PolarHBondContact O-N 3.2Å; V704-Q710 HydrophobicContact CB-CG 4.3Å; V704-Q710 HydrophobicContact CG2-CB 4.22Å; Q708-Q710 HydrophobicContact CB-CG 4.32Å
711	H	91.3	Very high	85.3	Confident	32 Å²	32	49.8 Å²	49.8	15%	0.148	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	120	176.2	-67.6	-102.7	0	0	0	108.5	K365 L370 L371 T699	K365-H711 PolarHBondContact NZ-CD2 3.48Å; K365-H711 PolarHBondContact NZ-NE2 2.69Å; L370-H711 WeakPolarHBondContact CA-O 3.36Å; L370-H711 HydrophobicContact CD2-CB 3.68Å; L371-H711 PolarHBondContact N-O 3.34Å; T699-H711 WeakPolarHBondContact OG1-CB 3.17Å
712	V	92.9	Very high	85.6	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	150.2	176.9	-61.5	0	0	0	0	110.3	L371 T699 H700 R702	L371-V712 HydrophobicContact CB-CG1 4.37Å; L371-V712 HydrophobicContact CD2-CG1 4.21Å; T699-V712 VanDerWaalsContact CA-O 3.26Å; T699-V712 WeakPolarHBondContact CA-O 3.37Å; T699-V712 WeakPolarHBondContact CB-O 3.35Å; T699-V712 PolarHBondContact OG1-N 3.33Å; T699-V712 PolarHBondContact OG1-O 3.21Å; H700-V712 VanDerWaalsContact CE1-CG2 3.47Å; H700-V712 WeakPolarHBondContact CE1-CG2 3.5Å; H700-V712 PolarHBondContact N-O 2.84Å; H700-V712 WeakPolarHBondContact ND1-CG2 3.48Å; H700-V712 PolarHBondContact O-N 2.69Å; H700-V712 VanDerWaalsContact O-N 3.12Å; R702-V712 HydrophobicContact CB-CG1 4.07Å; R702-V712 HydrophobicContact CB-CG2 3.66Å; R702-V712 HydrophobicContact CG-CG2 4.49Å
713	P	94.8	Very high	86	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.019	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	150.3	171.6	-25.3	35.3	0	0	0	112.7	L370 L371 T372 V696 H746 S748 T749 A750	L370-P713 HydrophobicContact CD1-CG 4.26Å; L371-P713 WeakPolarHBondContact O-CD 3.5Å; T372-P713 HydrophobicContact CG2-CG 4.42Å; V696-P713 HydrophobicContact CG1-CB 3.7Å; V696-P713 HydrophobicContact CG1-CG 4.26Å; V696-P713 HydrophobicContact CG2-CB 4.2Å; V696-P713 HydrophobicContact CG2-CG 4.24Å; P713-H746 HydrophobicContact CG-CB 4.24Å; P713-S748 VanDerWaalsContact CD-OG 3.3Å; P713-S748 WeakPolarHBondContact CD-OG 3.34Å; P713-T749 HydrophobicContact CB-CG2 4.34Å; P713-T749 WeakPolarHBondContact O-CA 3.13Å; P713-A750 PolarHBondContact O-N 2.67Å
714	V	94.4	Very high	86.6	Confident	6 Å²	6	39.6 Å²	39.6	4%	0.036	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	126.2	169.9	-176.7	0	0	0	0	108.7	M240 L698 H700 V716 A750 Y752	M240-V714 HydrophobicContact CE-CB 4.46Å; M240-V714 HydrophobicContact CE-CG1 3.6Å; M240-V714 HydrophobicContact CE-CG2 4.47Å; M240-V714 HydrophobicContact SD-CG1 4.27Å; L698-V714 HydrophobicContact CB-CB 4.14Å; L698-V714 PolarHBondContact O-N 3.48Å; H700-V714 HydrophobicContact CB-CG2 3.88Å; H700-V714 VanDerWaalsContact CD2-CG2 3.43Å; H700-V714 WeakPolarHBondContact CD2-CG2 3.43Å; H700-V714 VanDerWaalsContact CG-CG2 3.43Å; V714-V716 HydrophobicContact CG1-CG2 4.11Å; V714-A750 HydrophobicContact CG2-CB 4.44Å; V714-Y752 HydrophobicContact CG1-CD2 3.57Å; V714-Y752 HydrophobicContact CG1-CE2 3.84Å; V714-Y752 HydrophobicContact CG1-CG 4.5Å
715	H	95	Very high	87.5	Confident	39 Å²	39	41 Å²	41	18%	0.181	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	124.6	171.3	-170.9	79.7	0	0	0	109.3	R292 Q738 E742 T749 A750 Y752	R292-H715 PolarHBondContact NH2-CE1 2.92Å; R292-H715 VanDerWaalsContact NH2-CE1 3.35Å; H715-Q738 PolarHBondContact CE1-NE2 2.93Å; H715-Q738 VanDerWaalsContact CE1-NE2 3.26Å; H715-Q738 PolarHBondContact NE2-NE2 3.22Å; H715-E742 HydrophobicContact CB-CB 4.36Å; H715-E742 HydrophobicContact CB-CG 4.37Å; H715-E742 IonicContact CE1-OE1 2.69Å; H715-E742 PolarHBondContact CE1-OE1 3.05Å; H715-E742 VanDerWaalsContact CE1-OE1 3.31Å; H715-E742 IonicContact ND1-OE1 2.7Å; H715-E742 PolarHBondContact ND1-OE1 2.84Å; H715-T749 HydrophobicContact CB-CG2 3.94Å; H715-A750 PolarHBondContact N-O 3.5Å; H715-A750 VanDerWaalsContact N-O 3.17Å; H715-Y752 PolarHBondContact O-N 3.21Å
716	V	95.3	Very high	88.7	Confident	19 Å²	19	38.8 Å²	38.8	12%	0.115	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	113.8	176.6	-170.7	0	0	0	0	108.2	M240 L355 L698 V714 P718 Y752 A754 L766	M240-V716 HydrophobicContact SD-CG2 3.58Å; M240-V716 VanDerWaalsContact SD-CG2 3.58Å; L355-V716 HydrophobicContact CD2-CG1 3.94Å; L698-V716 HydrophobicContact CD1-CG2 4.06Å; V714-V716 HydrophobicContact CG1-CG2 4.11Å; V716-P718 WeakPolarHBondContact O-CD 3.42Å; V716-Y752 WeakPolarHBondContact CA-O 3.27Å; V716-A754 HydrophobicContact CG1-CB 3.86Å; V716-L766 HydrophobicContact CG1-CD1 4.17Å
717	L	95.8	Very high	90.3	Very high	2 Å²	2	31 Å²	31	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	110.5	172.7	-179.8	70.6	0	0	0	109.4	L731 E735 L739 Y752 I753 A754	L717-L731 HydrophobicContact CD2-CD2 4.07Å; L717-E735 HydrophobicContact CD2-CB 3.89Å; L717-E735 HydrophobicContact CD2-CG 4.04Å; L717-L739 HydrophobicContact CB-CD2 4.08Å; L717-L739 HydrophobicContact CD2-CD1 3.8Å; L717-L739 HydrophobicContact CD2-CG 4.08Å; L717-Y752 PolarHBondContact N-O 2.8Å; L717-I753 WeakPolarHBondContact O-CA 3.46Å; L717-A754 PolarHBondContact O-N 3.34Å
718	P	95.6	Very high	92	Very high	9 Å²	9	23.5 Å²	23.5	6%	0.058	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	132.8	166	26.2	-30.5	0	0	0	109.4	H348 E352 L355 V716 I756	H348-P718 PolarHBondContact NE2-O 3.11Å; E352-P718 HydrophobicContact CB-CG 4.19Å; E352-P718 HydrophobicContact CG-CG 4.07Å; L355-P718 HydrophobicContact CD2-CB 3.86Å; V716-P718 WeakPolarHBondContact O-CD 3.42Å; P718-I756 HydrophobicContact CB-CD1 3.93Å
719	K	95.7	Very high	92.9	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	121	176.2	-172.2	174.8	177.1	70.2	0	109.5	E721 E729 R730 E735 I753 A754 I756	K719-E721 WeakPolarHBondContact CD-OE1 3.41Å; K719-E721 WeakPolarHBondContact CG-OE1 3.46Å; K719-E729 WeakPolarHBondContact CE-O 3.39Å; K719-R730 WeakPolarHBondContact CE-O 3.39Å; K719-R730 PolarHBondContact NZ-O 3.4Å; K719-E735 IonicContact NZ-OE1 3.27Å; K719-E735 PolarHBondContact NZ-OE1 3.24Å; K719-E735 IonicContact NZ-OE2 2.81Å; K719-E735 PolarHBondContact NZ-OE2 2.82Å; K719-I753 HydrophobicContact CB-CG2 3.98Å; K719-I753 HydrophobicContact CD-CG2 4.39Å; K719-A754 PolarHBondContact N-O 2.88Å; K719-I756 PolarHBondContact O-N 3.32Å
720	L	95.1	Very high	93.4	Very high	4 Å²	4	15 Å²	15	2%	0.021	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	129.7	176.2	-66.5	-177.4	0	0	0	110.4	R344 S347 H348 H351 Y722 I756 A758	R344-L720 PolarHBondContact NH2-O 3.33Å; S347-L720 WeakPolarHBondContact OG-CD1 3.25Å; H348-L720 HydrophobicContact CB-CD1 4.19Å; H351-L720 HydrophobicContact CB-CD2 4Å; L720-Y722 HydrophobicContact CB-CE2 4.07Å; L720-I756 CarbonylContact C-O 3.5Å; L720-I756 WeakPolarHBondContact CA-O 3.25Å; L720-I756 HydrophobicContact CD2-CB 4.18Å; L720-I756 HydrophobicContact CD2-CG2 4.04Å; L720-A758 HydrophobicContact CB-CB 4.33Å
721	E	95.1	Very high	93.7	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	117.9	-176.8	-57.2	-64	159.1	0	0	109.6	K719 L724 V728 E729 H755 I756 A758	K719-E721 WeakPolarHBondContact CD-OE1 3.41Å; K719-E721 WeakPolarHBondContact CG-OE1 3.46Å; E721-L724 HydrophobicContact CB-CB 4.23Å; E721-L724 HydrophobicContact CB-CD1 4.21Å; E721-L724 HydrophobicContact CG-CD1 4.38Å; E721-V728 HydrophobicContact CG-CG1 4.39Å; E721-V728 WeakPolarHBondContact OE2-CA 3.32Å; E721-E729 WeakPolarHBondContact OE2-CB 3.47Å; E721-E729 WeakPolarHBondContact OE2-CG 3.46Å; E721-E729 PolarHBondContact OE2-N 3.03Å; E721-H755 HydrophobicContact CG-CB 3.96Å; E721-H755 IonicContact OE1-CE1 3.52Å; E721-H755 IonicContact OE1-CG 2.78Å; E721-H755 IonicContact OE1-ND1 3.69Å; E721-H755 PolarHBondContact OE1-ND1 3.45Å; E721-I756 WeakPolarHBondContact CB-O 3.44Å; E721-I756 PolarHBondContact N-O 3.25Å; E721-A758 PolarHBondContact O-N 3.29Å; E721-A758 VanDerWaalsContact O-N 3.07Å
722	Y	93.6	Very high	93.8	Very high	18 Å²	18	14 Å²	14	7%	0.071	7%	0.073	C	C	.	.	S	Bend	trans	-97.6	-31.5	179.8	-70.8	-94.7	0	0	0	112.3	D172 Y173 R344 L720 E729 A758 H759	D172-Y722 VanDerWaalsContact O-CD1 3.22Å; D172-Y722 WeakPolarHBondContact O-CD1 3.46Å; D172-Y722 VanDerWaalsContact O-CE1 3.26Å; D172-Y722 WeakPolarHBondContact O-CE1 3.45Å; Y173-Y722 AromaticContact CD1-CD1 3.83Å; Y173-Y722 HydrophobicContact CD1-CD1 3.83Å; Y173-Y722 AromaticContact CD1-CD2 3.93Å; Y173-Y722 HydrophobicContact CD1-CD2 3.93Å; Y173-Y722 HydrophobicContact CD1-CE1 4.21Å; Y173-Y722 HydrophobicContact CD1-CE2 4.31Å; Y173-Y722 AromaticContact CD1-CG 3.67Å; Y173-Y722 HydrophobicContact CD1-CG 3.67Å; Y173-Y722 VanDerWaalsContact CE1-CB 3.45Å; Y173-Y722 HydrophobicContact CE1-CD1 4.07Å; Y173-Y722 AromaticContact CE1-CD2 3.75Å; Y173-Y722 HydrophobicContact CE1-CD2 3.75Å; Y173-Y722 AromaticContact CE1-CG 3.48Å; Y173-Y722 HydrophobicContact CE1-CG 3.48Å; Y173-Y722 VanDerWaalsContact CE1-CG 3.48Å; Y173-Y722 HydrophobicContact CG-CD1 4.17Å; Y173-Y722 HydrophobicContact CG-CG 4.4Å; R344-Y722 HydrophobicContact CG-CE2 3.86Å; L720-Y722 HydrophobicContact CB-CE2 4.07Å; Y722-E729 PolarHBondContact N-OE1 2.86Å; Y722-A758 HydrophobicContact CD1-CB 3.79Å; Y722-A758 HydrophobicContact CD2-CB 4.12Å; Y722-A758 HydrophobicContact CE1-CB 3.56Å; Y722-A758 HydrophobicContact CE2-CB 3.9Å; Y722-A758 HydrophobicContact CG-CB 4.07Å; Y722-H759 AromaticContact CD1-CE1 3.99Å
723	Q	92.8	Very high	93.8	Very high	8 Å²	8	16.5 Å²	16.5	4%	0.037	9%	0.086	C	C	.	.	S	Bend	trans	-105.3	33.3	-177.8	-80.1	-173.3	-15.8	0	0	113.6	L162 S725 Y726 I854	L162-Q723 PolarHBondContact O-NE2 2.85Å; Q723-S725 PolarHBondContact O-N 3.32Å; Q723-S725 VanDerWaalsContact O-N 3.09Å; Q723-Y726 HydrophobicContact CB-CD2 4.08Å; Q723-Y726 HydrophobicContact CG-CD2 4.4Å; Q723-Y726 PolarHBondContact O-N 3.47Å; Q723-I854 HydrophobicContact CB-CD1 3.98Å; Q723-I854 HydrophobicContact CB-CG1 4.42Å
724	L	91.3	Very high	93.7	Very high	27 Å²	27	17.9 Å²	17.9	14%	0.141	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	-57.1	-29	-170.5	-173.9	66	0	0	0	115.2	E721 Y726 G727 V728 N757 A764 L860	E721-L724 HydrophobicContact CB-CB 4.23Å; E721-L724 HydrophobicContact CB-CD1 4.21Å; E721-L724 HydrophobicContact CG-CD1 4.38Å; L724-Y726 PolarHBondContact O-N 3.46Å; L724-Y726 VanDerWaalsContact O-N 3.11Å; L724-G727 VanDerWaalsContact CA-O 3.29Å; L724-G727 WeakPolarHBondContact CA-O 3.49Å; L724-G727 PolarHBondContact O-N 3.25Å; L724-V728 HydrophobicContact CD1-CG1 4.04Å; L724-N757 HydrophobicContact CD2-CB 3.78Å; L724-A764 HydrophobicContact CD1-CB 3.82Å; L724-A764 HydrophobicContact CD2-CB 3.47Å; L724-A764 VanDerWaalsContact CD2-CB 3.47Å; L724-A764 HydrophobicContact CG-CB 4.25Å; L724-L860 HydrophobicContact CD1-CD1 4.03Å
725	S	89.8	Confident	93.8	Very high	35 Å²	35	18.9 Å²	18.9	25%	0.245	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-63.1	-13.3	175.7	48.8	0	0	0	0	113.9	Q723	Q723-S725 PolarHBondContact O-N 3.32Å; Q723-S725 VanDerWaalsContact O-N 3.09Å
726	Y	91.4	Very high	93.8	Very high	2 Å²	2	17 Å²	17	1%	0.008	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-111.6	-14.7	179.9	-52.5	-72.1	0	0	0	114.3	P113 R114 Y117 F158 Y161 L162 V165 Q723 L724	P113-Y726 HydrophobicContact CB-CE1 3.66Å; R114-Y726 PolarHBondContact N-OH 2.89Å; Y117-Y726 HydrophobicContact CE1-CD1 4.37Å; Y117-Y726 HydrophobicContact CE1-CE1 4.05Å; F158-Y726 HydrophobicContact CE1-CD1 4.26Å; F158-Y726 AromaticContact CZ-CD1 3.91Å; F158-Y726 HydrophobicContact CZ-CD1 3.91Å; Y161-Y726 HydrophobicContact CE1-CE1 4.01Å; Y161-Y726 PolarHBondContact OH-OH 3.44Å; L162-Y726 HydrophobicContact CD2-CD1 3.93Å; L162-Y726 HydrophobicContact CD2-CD2 3.36Å; L162-Y726 HydrophobicContact CD2-CE1 4.23Å; L162-Y726 HydrophobicContact CD2-CE2 3.7Å; L162-Y726 HydrophobicContact CD2-CG 3.46Å; L162-Y726 VanDerWaalsContact CD2-CG 3.46Å; V165-Y726 HydrophobicContact CG1-CE2 4.49Å; Q723-Y726 HydrophobicContact CB-CD2 4.08Å; Q723-Y726 HydrophobicContact CG-CD2 4.4Å; Q723-Y726 PolarHBondContact O-N 3.47Å; L724-Y726 PolarHBondContact O-N 3.46Å; L724-Y726 VanDerWaalsContact O-N 3.11Å
727	G	92.3	Very high	93.8	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.086	C	C	.	.			trans	148	-162	-174.3	0	0	0	0	0	111.6	L724	L724-G727 VanDerWaalsContact CA-O 3.29Å; L724-G727 WeakPolarHBondContact CA-O 3.49Å; L724-G727 PolarHBondContact O-N 3.25Å
728	V	93.4	Very high	93.8	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.095	C	C	.	.			trans	-113.3	147	171.1	-67.1	0	0	0	0	111.4	E721 L724 H755 I854 D855 V858 L860	E721-V728 HydrophobicContact CG-CG1 4.39Å; E721-V728 WeakPolarHBondContact OE2-CA 3.32Å; L724-V728 HydrophobicContact CD1-CG1 4.04Å; V728-H755 HydrophobicContact CG1-CB 4.05Å; V728-I854 CarbonylContact O-C 3.55Å; V728-I854 WeakPolarHBondContact O-CA 3.26Å; V728-I854 WeakPolarHBondContact O-CG2 3.3Å; V728-D855 PolarHBondContact O-N 2.78Å; V728-V858 HydrophobicContact CG2-CB 3.69Å; V728-V858 HydrophobicContact CG2-CG1 3.57Å; V728-V858 HydrophobicContact CG2-CG2 4.13Å; V728-L860 HydrophobicContact CG1-CD1 4.26Å; V728-L860 HydrophobicContact CG1-CD2 4.04Å; V728-L860 HydrophobicContact CG1-CG 4.49Å
729	E	94.6	Very high	93.8	Very high	2 Å²	2	17.6 Å²	17.6	1%	0.009	9%	0.093	C	C	.	.	B	Isolated β-bridge	trans	-64.6	144.8	178.3	-67.6	175.9	-140	0	0	111	R344 K719 E721 Y722 I852 I854	R344-E729 IonicContact CZ-OE2 2.71Å; R344-E729 IonicContact NH1-OE2 2.98Å; R344-E729 PolarHBondContact NH1-OE2 3.39Å; R344-E729 IonicContact NH2-OE1 3.18Å; R344-E729 IonicContact NH2-OE2 2.73Å; R344-E729 PolarHBondContact NH2-OE2 3.03Å; K719-E729 WeakPolarHBondContact CE-O 3.39Å; E721-E729 WeakPolarHBondContact OE2-CB 3.47Å; E721-E729 WeakPolarHBondContact OE2-CG 3.46Å; E721-E729 PolarHBondContact OE2-N 3.03Å; Y722-E729 PolarHBondContact N-OE1 2.86Å; E729-I852 HydrophobicContact CB-CB 4.1Å; E729-I852 HydrophobicContact CB-CG2 4.18Å; E729-I852 HydrophobicContact CG-CB 4.31Å; E729-I852 WeakPolarHBondContact OE2-CB 3.38Å; E729-I854 HydrophobicContact CG-CD1 3.76Å
730	R	93.1	Very high	93.8	Very high	59 Å²	59	19 Å²	19	22%	0.223	10%	0.098	C	C	.	.	P	Polyproline II helix	trans	-63.6	159.5	175.8	-71.1	170.4	-153.8	-173.1	9.6	111.3	K719 I852 P853 I854 D855	K719-R730 WeakPolarHBondContact CE-O 3.39Å; K719-R730 PolarHBondContact NZ-O 3.4Å; R730-I852 HydrophobicContact CB-CG2 4.25Å; R730-P853 WeakPolarHBondContact CB-O 3.35Å; R730-P853 VanDerWaalsContact CG-O 3.27Å; R730-P853 WeakPolarHBondContact CG-O 3.49Å; R730-P853 PolarHBondContact N-O 3.34Å; R730-I854 PolarHBondContact NE-O 3.15Å; R730-I854 PolarHBondContact NH2-O 2.78Å; R730-D855 HydrophobicContact CG-CB 3.64Å
731	L	93.6	Very high	93.8	Very high	17 Å²	17	18.9 Å²	18.9	9%	0.089	10%	0.097	C	C	.	.	P	Polyproline II helix	trans	-60.6	140.9	165.1	-73.5	173	0	0	0	110.1	L717 E735 L739 I753 W773 I777 C779	L717-L731 HydrophobicContact CD2-CD2 4.07Å; L731-E735 VanDerWaalsContact CA-OE2 3.23Å; L731-E735 WeakPolarHBondContact CA-OE2 3.29Å; L731-E735 HydrophobicContact CD2-CB 3.92Å; L731-L739 HydrophobicContact CD1-CD1 4.15Å; L731-L739 HydrophobicContact CD2-CD1 3.88Å; L731-I753 HydrophobicContact CD1-CD1 4.36Å; L731-I753 HydrophobicContact CD2-CD1 3.82Å; L731-I753 HydrophobicContact CG-CD1 4.3Å; L731-W773 HydrophobicContact CD1-CE3 4.43Å; L731-W773 HydrophobicContact CD1-CZ3 4.23Å; L731-I777 HydrophobicContact CD1-CD1 4.16Å; L731-I777 HydrophobicContact CD1-CG1 4.31Å; L731-C779 WeakPolarHBondContact O-CB 3.37Å
732	T	93.5	Very high	93.8	Very high	43 Å²	43	19.5 Å²	19.5	26%	0.264	10%	0.1	S	C	.	.	P	Polyproline II helix	trans	-79.8	172.9	164.4	71.4	0	0	0	0	110.6	S734 E735 A736 I852	T732-S734 VanDerWaalsContact C-N 3.35Å; T732-S734 PolarHBondContact OG1-N 2.98Å; T732-E735 HydrophobicContact CG2-CG 4.48Å; T732-E735 PolarHBondContact N-OE2 3.28Å; T732-E735 WeakPolarHBondContact OG1-CB 3.38Å; T732-E735 VanDerWaalsContact OG1-CG 3.31Å; T732-E735 WeakPolarHBondContact OG1-CG 3.46Å; T732-E735 PolarHBondContact OG1-N 3.13Å; T732-A736 VanDerWaalsContact O-CB 3.26Å; T732-A736 WeakPolarHBondContact O-CB 3.37Å; T732-A736 PolarHBondContact O-N 3.37Å; T732-A736 VanDerWaalsContact O-N 3.11Å; T732-I852 HydrophobicContact CG2-CD1 3.54Å; T732-I852 HydrophobicContact CG2-CG1 4.37Å
733	N	93.8	Very high	93.8	Very high	53 Å²	53	20 Å²	20	28%	0.283	11%	0.105	S	C	.	.	H	α-helix	trans	-66.7	-38	171.2	-73.9	-59.6	0	0	0	111.6	H302 A736 C737 C779 F781	H302-N733 HydrophobicContact CB-CB 4.41Å; H302-N733 WeakPolarHBondContact CD2-CB 3.46Å; H302-N733 PolarHBondContact NE2-O 2.92Å; N733-A736 WeakPolarHBondContact O-CB 3.32Å; N733-A736 PolarHBondContact O-N 2.62Å; N733-C737 VanDerWaalsContact O-CB 3.27Å; N733-C737 WeakPolarHBondContact O-CB 3.42Å; N733-C737 PolarHBondContact O-N 3.48Å; N733-C779 PolarHBondContact ND2-O 2.93Å; N733-C779 PolarHBondContact OD1-O 3.19Å; N733-C779 VanDerWaalsContact OD1-O 3.12Å; N733-F781 VanDerWaalsContact OD1-CA 3.24Å; N733-F781 WeakPolarHBondContact OD1-CA 3.36Å; N733-F781 WeakPolarHBondContact OD1-CB 3.22Å; N733-F781 PolarHBondContact OD1-N 3.4Å
734	S	93.6	Very high	93.8	Very high	32 Å²	32	21.1 Å²	21.1	22%	0.224	11%	0.113	C	C	.	.	H	α-helix	trans	-68.3	-43.3	177.8	-50.3	0	0	0	0	113	D300 T732 A736 C737 Q738	D300-S734 WeakPolarHBondContact OD1-CA 3.33Å; D300-S734 WeakPolarHBondContact OD1-CB 3.39Å; D300-S734 PolarHBondContact OD1-OG 2.91Å; D300-S734 VanDerWaalsContact OD2-CB 3.28Å; D300-S734 WeakPolarHBondContact OD2-CB 3.49Å; D300-S734 PolarHBondContact OD2-OG 2.62Å; T732-S734 VanDerWaalsContact C-N 3.35Å; T732-S734 PolarHBondContact OG1-N 2.98Å; S734-A736 VanDerWaalsContact C-N 3.31Å; S734-A736 PolarHBondContact O-N 2.93Å; S734-C737 WeakPolarHBondContact O-CB 3.37Å; S734-C737 PolarHBondContact O-N 3.39Å; S734-Q738 WeakPolarHBondContact O-CB 3.41Å; S734-Q738 PolarHBondContact O-N 3.33Å
735	E	95.4	Very high	93.9	Very high	27 Å²	27	19.8 Å²	19.8	13%	0.126	11%	0.107	C	C	.	.	H	α-helix	trans	-61.6	-40	172.7	-72.4	172.2	165.6	0	0	111.5	L717 K719 L731 T732 L739	L717-E735 HydrophobicContact CD2-CB 3.89Å; L717-E735 HydrophobicContact CD2-CG 4.04Å; K719-E735 IonicContact NZ-OE1 3.27Å; K719-E735 PolarHBondContact NZ-OE1 3.24Å; K719-E735 IonicContact NZ-OE2 2.81Å; K719-E735 PolarHBondContact NZ-OE2 2.82Å; L731-E735 VanDerWaalsContact CA-OE2 3.23Å; L731-E735 WeakPolarHBondContact CA-OE2 3.29Å; L731-E735 HydrophobicContact CD2-CB 3.92Å; T732-E735 HydrophobicContact CG2-CG 4.48Å; T732-E735 PolarHBondContact N-OE2 3.28Å; T732-E735 WeakPolarHBondContact OG1-CB 3.38Å; T732-E735 VanDerWaalsContact OG1-CG 3.31Å; T732-E735 WeakPolarHBondContact OG1-CG 3.46Å; T732-E735 PolarHBondContact OG1-N 3.13Å; E735-L739 WeakPolarHBondContact O-CB 3.43Å; E735-L739 WeakPolarHBondContact O-CG 3.43Å; E735-L739 PolarHBondContact O-N 3.46Å
736	A	95.6	Very high	94	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-65.9	-43.1	174	0	0	0	0	0	112.3	T732 N733 S734 L739 W740 I777 F781	T732-A736 VanDerWaalsContact O-CB 3.26Å; T732-A736 WeakPolarHBondContact O-CB 3.37Å; T732-A736 PolarHBondContact O-N 3.37Å; T732-A736 VanDerWaalsContact O-N 3.11Å; N733-A736 WeakPolarHBondContact O-CB 3.32Å; N733-A736 PolarHBondContact O-N 2.62Å; S734-A736 VanDerWaalsContact C-N 3.31Å; S734-A736 PolarHBondContact O-N 2.93Å; A736-L739 PolarHBondContact O-N 2.71Å; A736-W740 WeakPolarHBondContact O-CB 3.27Å; A736-W740 PolarHBondContact O-N 3.27Å; A736-I777 HydrophobicContact CB-CD1 3.34Å; A736-F781 HydrophobicContact CB-CB 3.91Å; A736-F781 HydrophobicContact CB-CD1 3.81Å; A736-F781 HydrophobicContact CB-CG 3.93Å
737	C	95.8	Very high	93.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-61.1	-44.3	176.5	-171.4	0	0	0	0	111	L299 N733 S734 T741 F781	L299-C737 VanDerWaalsContact C-SG 3.5Å; L299-C737 VanDerWaalsContact CB-SG 3.56Å; N733-C737 VanDerWaalsContact O-CB 3.27Å; N733-C737 WeakPolarHBondContact O-CB 3.42Å; N733-C737 PolarHBondContact O-N 3.48Å; S734-C737 WeakPolarHBondContact O-CB 3.37Å; S734-C737 PolarHBondContact O-N 3.39Å; C737-T741 VanDerWaalsContact O-CB 3.32Å; C737-T741 WeakPolarHBondContact O-CB 3.5Å; C737-T741 PolarHBondContact O-N 3.47Å; C737-T741 PolarHBondContact O-OG1 2.85Å; C737-F781 HydrophobicContact CB-CD2 4.41Å; C737-F781 HydrophobicContact CB-CE2 3.85Å; C737-F781 HydrophobicContact CB-CZ 4.05Å
738	Q	95.2	Very high	93.8	Very high	42 Å²	42	19.8 Å²	19.8	20%	0.196	11%	0.107	C	C	.	.	H	α-helix	trans	-59.5	-56.6	173.9	176	173.5	-9.3	0	0	111.5	V296 H715 S734 W740 T741 E742	V296-Q738 HydrophobicContact CG1-CB 4.45Å; H715-Q738 PolarHBondContact CE1-NE2 2.93Å; H715-Q738 VanDerWaalsContact CE1-NE2 3.26Å; H715-Q738 PolarHBondContact NE2-NE2 3.22Å; S734-Q738 WeakPolarHBondContact O-CB 3.41Å; S734-Q738 PolarHBondContact O-N 3.33Å; Q738-W740 VanDerWaalsContact C-N 3.28Å; Q738-W740 PolarHBondContact O-N 2.87Å; Q738-T741 PolarHBondContact O-N 3.12Å; Q738-T741 VanDerWaalsContact O-N 3.12Å; Q738-E742 WeakPolarHBondContact O-CG 3.15Å; Q738-E742 PolarHBondContact O-N 3.43Å
739	L	95.6	Very high	93.8	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-57.8	-41.2	-179.1	-76.9	167.7	0	0	0	112	L717 L731 E735 A736 T743 P751 I753 L769 W773	L717-L739 HydrophobicContact CB-CD2 4.08Å; L717-L739 HydrophobicContact CD2-CD1 3.8Å; L717-L739 HydrophobicContact CD2-CG 4.08Å; L731-L739 HydrophobicContact CD1-CD1 4.15Å; L731-L739 HydrophobicContact CD2-CD1 3.88Å; E735-L739 WeakPolarHBondContact O-CB 3.43Å; E735-L739 WeakPolarHBondContact O-CG 3.43Å; E735-L739 PolarHBondContact O-N 3.46Å; A736-L739 PolarHBondContact O-N 2.71Å; L739-T743 PolarHBondContact O-N 3.38Å; L739-T743 PolarHBondContact O-OG1 3.27Å; L739-P751 HydrophobicContact CD2-CB 3.99Å; L739-I753 HydrophobicContact CD1-CD1 4.47Å; L739-I753 HydrophobicContact CD1-CG1 4.37Å; L739-L769 HydrophobicContact CD1-CD1 4Å; L739-W773 HydrophobicContact CB-CH2 3.38Å; L739-W773 HydrophobicContact CB-CZ2 3.8Å; L739-W773 HydrophobicContact CB-CZ3 4.14Å; L739-W773 HydrophobicContact CD1-CH2 4.37Å; L739-W773 HydrophobicContact CD1-CZ3 4.33Å
740	W	95.7	Very high	93.7	Very high	30 Å²	30	20.2 Å²	20.2	11%	0.114	11%	0.11	C	C	.	.	H	α-helix	trans	-66.8	-41.2	176.3	169.2	68.8	0	0	0	112.3	L299 A736 Q738 E742 T743 S744 W773 M774 F781 P783 L787	L299-W740 HydrophobicContact CD1-CH2 4.42Å; L299-W740 HydrophobicContact CD1-CZ3 3.84Å; L299-W740 HydrophobicContact CD2-CH2 4.22Å; L299-W740 HydrophobicContact CD2-CZ3 3.96Å; L299-W740 HydrophobicContact CG-CZ3 4.33Å; A736-W740 WeakPolarHBondContact O-CB 3.27Å; A736-W740 PolarHBondContact O-N 3.27Å; Q738-W740 VanDerWaalsContact C-N 3.28Å; Q738-W740 PolarHBondContact O-N 2.87Å; W740-E742 PolarHBondContact O-N 3.1Å; W740-T743 WeakPolarHBondContact CA-OG1 3.48Å; W740-T743 CarbonylContact O-C 3.53Å; W740-T743 PolarHBondContact O-N 2.65Å; W740-T743 PolarHBondContact O-OG1 3.1Å; W740-S744 PolarHBondContact NE1-OG 2.67Å; W740-S744 VanDerWaalsContact NE1-OG 3.12Å; W740-S744 WeakPolarHBondContact O-CB 3.48Å; W740-S744 PolarHBondContact O-N 2.95Å; W740-S744 PolarHBondContact O-OG 3.49Å; W740-W773 HydrophobicContact CB-CH2 4.22Å; W740-W773 HydrophobicContact CB-CZ2 4.4Å; W740-M774 HydrophobicContact CB-CE 4.48Å; W740-M774 HydrophobicContact CB-SD 3.99Å; W740-M774 HydrophobicContact CG-CE 4.29Å; W740-M774 HydrophobicContact CG-SD 4.34Å; W740-F781 HydrophobicContact CB-CE1 3.71Å; W740-F781 HydrophobicContact CB-CZ 4.33Å; W740-F781 HydrophobicContact CD2-CE1 4.06Å; W740-F781 HydrophobicContact CD2-CZ 4.01Å; W740-F781 HydrophobicContact CE3-CE1 4.1Å; W740-F781 AromaticContact CE3-CZ 3.6Å; W740-F781 HydrophobicContact CE3-CZ 3.6Å; W740-F781 AromaticContact CG-CE1 3.87Å; W740-F781 HydrophobicContact CG-CE1 3.87Å; W740-F781 HydrophobicContact CG-CZ 4.3Å; W740-F781 HydrophobicContact CZ3-CZ 4.31Å; W740-P783 HydrophobicContact CD2-CB 4.1Å; W740-P783 HydrophobicContact CD2-CG 3.99Å; W740-P783 HydrophobicContact CE3-CB 4.47Å; W740-P783 HydrophobicContact CG-CG 4.19Å; W740-P783 HydrophobicContact CH2-CB 4.08Å; W740-P783 HydrophobicContact CZ2-CB 3.69Å; W740-P783 HydrophobicContact CZ2-CG 4.39Å; W740-P783 HydrophobicContact CZ3-CB 4.43Å; W740-L787 HydrophobicContact CH2-CD1 4.1Å; W740-L787 HydrophobicContact CH2-CD2 3.93Å; W740-L787 HydrophobicContact CH2-CG 3.81Å; W740-L787 HydrophobicContact CZ2-CD1 4.17Å; W740-L787 HydrophobicContact CZ2-CG 4.38Å
741	T	95.7	Very high	93.7	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.006	10%	0.102	C	C	.	.	H	α-helix	trans	-62.2	-43.2	177.9	-57.2	0	0	0	0	111	L295 V296 L299 C737 Q738 S744 L745	L295-T741 HydrophobicContact CD2-CG2 3.97Å; L295-T741 HydrophobicContact CG-CG2 4.18Å; V296-T741 HydrophobicContact CG2-CG2 3.73Å; L299-T741 HydrophobicContact CD1-CG2 3.91Å; L299-T741 WeakPolarHBondContact CD1-OG1 3.45Å; C737-T741 VanDerWaalsContact O-CB 3.32Å; C737-T741 WeakPolarHBondContact O-CB 3.5Å; C737-T741 PolarHBondContact O-N 3.47Å; C737-T741 PolarHBondContact O-OG1 2.85Å; Q738-T741 PolarHBondContact O-N 3.12Å; Q738-T741 VanDerWaalsContact O-N 3.12Å; T741-S744 CarbonylContact O-C 3.56Å; T741-S744 PolarHBondContact O-N 2.98Å; T741-L745 HydrophobicContact CG2-CD1 4.15Å; T741-L745 HydrophobicContact CG2-CG 4.33Å; T741-L745 WeakPolarHBondContact O-CG 3.26Å; T741-L745 PolarHBondContact O-N 3.11Å
742	E	94.7	Very high	93.8	Very high	13 Å²	13	17.4 Å²	17.4	6%	0.061	10%	0.099	C	C	.	.	H	α-helix	trans	-59.8	-48.2	175	-65.7	-68.9	178.3	0	0	111.8	R292 H715 Q738 W740 S744 L745 H746	R292-E742 IonicContact CZ-OE1 2.7Å; R292-E742 IonicContact NE-OE1 3.22Å; R292-E742 PolarHBondContact NE-OE1 3.21Å; R292-E742 IonicContact NH2-OE1 2.7Å; R292-E742 PolarHBondContact NH2-OE1 3.19Å; H715-E742 HydrophobicContact CB-CB 4.36Å; H715-E742 HydrophobicContact CB-CG 4.37Å; H715-E742 IonicContact CE1-OE1 2.69Å; H715-E742 PolarHBondContact CE1-OE1 3.05Å; H715-E742 VanDerWaalsContact CE1-OE1 3.31Å; H715-E742 IonicContact ND1-OE1 2.7Å; H715-E742 PolarHBondContact ND1-OE1 2.84Å; Q738-E742 WeakPolarHBondContact O-CG 3.15Å; Q738-E742 PolarHBondContact O-N 3.43Å; W740-E742 PolarHBondContact O-N 3.1Å; E742-S744 PolarHBondContact O-N 3.07Å; E742-L745 PolarHBondContact O-N 2.8Å; E742-H746 PolarHBondContact O-N 3.01Å
743	T	93.2	Very high	93.8	Very high	29 Å²	29	15.4 Å²	15.4	18%	0.178	9%	0.086	C	C	.	.	H	α-helix	trans	-68.3	-12.3	175	56.3	0	0	0	0	114.1	L739 W740 S747 P751	L739-T743 PolarHBondContact O-N 3.38Å; L739-T743 PolarHBondContact O-OG1 3.27Å; W740-T743 WeakPolarHBondContact CA-OG1 3.48Å; W740-T743 CarbonylContact O-C 3.53Å; W740-T743 PolarHBondContact O-N 2.65Å; W740-T743 PolarHBondContact O-OG1 3.1Å; T743-S747 WeakPolarHBondContact O-CA 3.43Å; T743-P751 HydrophobicContact CG2-CB 4.45Å; T743-P751 HydrophobicContact CG2-CG 4.08Å
744	S	92.3	Very high	93.9	Very high	30 Å²	30	12.9 Å²	12.9	21%	0.21	7%	0.073	C	C	.	.	H	α-helix	trans	-94.9	-27.3	174.9	-57.5	0	0	0	0	112.7	W740 T741 E742	W740-S744 PolarHBondContact NE1-OG 2.67Å; W740-S744 VanDerWaalsContact NE1-OG 3.12Å; W740-S744 WeakPolarHBondContact O-CB 3.48Å; W740-S744 PolarHBondContact O-N 2.95Å; W740-S744 PolarHBondContact O-OG 3.49Å; T741-S744 CarbonylContact O-C 3.56Å; T741-S744 PolarHBondContact O-N 2.98Å; E742-S744 PolarHBondContact O-N 3.07Å
745	L	93.3	Very high	94	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-80.2	-23.4	172.6	-72.4	177.1	0	0	0	112.9	R292 L295 K681 Y683 V692 T741 E742	R292-L745 HydrophobicContact CB-CD1 4.4Å; R292-L745 HydrophobicContact CG-CD1 3.94Å; L295-L745 HydrophobicContact CD2-CD1 4.21Å; L295-L745 HydrophobicContact CD2-CD2 3.68Å; L295-L745 HydrophobicContact CD2-CG 4.15Å; K681-L745 WeakPolarHBondContact CD-O 3.11Å; K681-L745 PolarHBondContact NZ-O 3.04Å; Y683-L745 HydrophobicContact CE1-CD2 4.38Å; Y683-L745 HydrophobicContact CE2-CD2 3.81Å; Y683-L745 VanDerWaalsContact OH-CA 3.3Å; Y683-L745 WeakPolarHBondContact OH-CA 3.32Å; Y683-L745 VanDerWaalsContact OH-CD2 3.3Å; Y683-L745 WeakPolarHBondContact OH-CD2 3.37Å; Y683-L745 PolarHBondContact OH-O 2.57Å; V692-L745 HydrophobicContact CB-CD2 4.19Å; V692-L745 HydrophobicContact CG1-CD1 4.4Å; V692-L745 HydrophobicContact CG1-CD2 3.89Å; V692-L745 HydrophobicContact CG2-CD2 4.16Å; T741-L745 HydrophobicContact CG2-CD1 4.15Å; T741-L745 HydrophobicContact CG2-CG 4.33Å; T741-L745 WeakPolarHBondContact O-CG 3.26Å; T741-L745 PolarHBondContact O-N 3.11Å; E742-L745 PolarHBondContact O-N 2.8Å
746	H	91.6	Very high	93.9	Very high	1 Å²	1	10 Å²	10	1%	0.005	6%	0.056	C	C	.	.	S	Bend	trans	-149.4	88.4	-177.8	-55.7	-82.9	0	0	0	108.8	T372 L679 K681 S694 P713 E742 S748 T749	T372-H746 CarbonylContact O-C 3.59Å; T372-H746 WeakPolarHBondContact O-CA 3.24Å; L679-H746 VanDerWaalsContact CB-CE1 3.45Å; L679-H746 WeakPolarHBondContact CB-CE1 3.44Å; L679-H746 WeakPolarHBondContact CD2-CE1 3.39Å; K681-H746 PolarHBondContact NZ-ND1 3.02Å; S694-H746 WeakPolarHBondContact CB-NE2 3.46Å; S694-H746 PolarHBondContact OG-CE1 2.82Å; S694-H746 PolarHBondContact OG-NE2 3.42Å; P713-H746 HydrophobicContact CG-CB 4.24Å; E742-H746 PolarHBondContact O-N 3.01Å; H746-S748 PolarHBondContact O-N 2.84Å; H746-T749 VanDerWaalsContact CB-OG1 3.24Å; H746-T749 WeakPolarHBondContact CB-OG1 3.36Å; H746-T749 VanDerWaalsContact O-CB 3.31Å; H746-T749 WeakPolarHBondContact O-CB 3.06Å; H746-T749 PolarHBondContact O-N 3.45Å; H746-T749 PolarHBondContact O-OG1 3.37Å
747	S	90.2	Very high	93.9	Very high	35 Å²	35	11.6 Å²	11.6	25%	0.245	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-12.8	-168.2	65.1	0	0	0	0	115.9	T372 E373 L374 Q379 T743	T372-S747 PolarHBondContact O-N 3.02Å; T372-S747 VanDerWaalsContact O-N 3.16Å; E373-S747 WeakPolarHBondContact CA-OG 3.45Å; E373-S747 WeakPolarHBondContact OE2-CB 3.46Å; E373-S747 PolarHBondContact OE2-N 3.42Å; E373-S747 VanDerWaalsContact OE2-N 3.13Å; E373-S747 PolarHBondContact OE2-OG 3.33Å; L374-S747 WeakPolarHBondContact CD1-O 3.37Å; L374-S747 PolarHBondContact N-OG 3.37Å; Q379-S747 PolarHBondContact NE2-OG 3.39Å; T743-S747 WeakPolarHBondContact O-CA 3.43Å
748	S	91.3	Very high	93.8	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-10.6	175.1	64.3	0	0	0	0	115.3	L371 T372 P713 H746	L371-S748 PolarHBondContact O-OG 3.07Å; T372-S748 WeakPolarHBondContact CA-OG 3.5Å; T372-S748 WeakPolarHBondContact O-CB 3.32Å; T372-S748 PolarHBondContact O-N 2.65Å; T372-S748 VanDerWaalsContact O-N 3.17Å; T372-S748 PolarHBondContact O-OG 3.31Å; P713-S748 VanDerWaalsContact CD-OG 3.3Å; P713-S748 WeakPolarHBondContact CD-OG 3.34Å; H746-S748 PolarHBondContact O-N 2.84Å
749	T	92.6	Very high	93.6	Very high	11 Å²	11	12.4 Å²	12.4	7%	0.067	7%	0.068	C	C	.	.			trans	-55	136.6	-171.9	-60.5	0	0	0	0	112.1	P713 H715 H746 P751	P713-T749 HydrophobicContact CB-CG2 4.34Å; P713-T749 WeakPolarHBondContact O-CA 3.13Å; H715-T749 HydrophobicContact CB-CG2 3.94Å; H746-T749 VanDerWaalsContact CB-OG1 3.24Å; H746-T749 WeakPolarHBondContact CB-OG1 3.36Å; H746-T749 VanDerWaalsContact O-CB 3.31Å; H746-T749 WeakPolarHBondContact O-CB 3.06Å; H746-T749 PolarHBondContact O-N 3.45Å; H746-T749 PolarHBondContact O-OG1 3.37Å; T749-P751 WeakPolarHBondContact O-CD 3.29Å
750	A	92.1	Very high	93.4	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.008	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	107.6	165.8	0	0	0	0	0	110.2	H700 P713 V714 H715 Y752	H700-A750 VanDerWaalsContact NE2-CB 3.34Å; H700-A750 WeakPolarHBondContact NE2-CB 3.32Å; P713-A750 PolarHBondContact O-N 2.67Å; V714-A750 HydrophobicContact CG2-CB 4.44Å; H715-A750 PolarHBondContact N-O 3.5Å; H715-A750 VanDerWaalsContact N-O 3.17Å; A750-Y752 HydrophobicContact CB-CD2 4.31Å; A750-Y752 HydrophobicContact CB-CE2 3.9Å
751	P	93.9	Very high	93.3	Very high	8 Å²	8	14.1 Å²	14.1	5%	0.052	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	129.7	172.7	27.9	-33.4	0	0	0	111.9	L739 T743 T749 L769	L739-P751 HydrophobicContact CD2-CB 3.99Å; T743-P751 HydrophobicContact CG2-CB 4.45Å; T743-P751 HydrophobicContact CG2-CG 4.08Å; T749-P751 WeakPolarHBondContact O-CD 3.29Å; P751-L769 HydrophobicContact CB-CD1 4.32Å; P751-L769 HydrophobicContact CG-CB 4.16Å; P751-L769 PolarHBondContact O-N 3.44Å
752	Y	94.3	Very high	93.2	Very high	9 Å²	9	18 Å²	18	4%	0.035	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	151.5	173.1	-77.4	-105.9	0	0	0	110.3	H238 M240 H700 V714 H715 V716 L717 A750 L766 R767 K768	H238-Y752 PolarHBondContact ND1-OH 2.74Å; M240-Y752 HydrophobicContact CE-CD2 4.49Å; M240-Y752 HydrophobicContact CE-CE2 4.18Å; H700-Y752 AromaticContact NE2-CE2 3.89Å; V714-Y752 HydrophobicContact CG1-CD2 3.57Å; V714-Y752 HydrophobicContact CG1-CE2 3.84Å; V714-Y752 HydrophobicContact CG1-CG 4.5Å; H715-Y752 PolarHBondContact O-N 3.21Å; V716-Y752 WeakPolarHBondContact CA-O 3.27Å; L717-Y752 PolarHBondContact N-O 2.8Å; A750-Y752 HydrophobicContact CB-CD2 4.31Å; A750-Y752 HydrophobicContact CB-CE2 3.9Å; Y752-L766 HydrophobicContact CD1-CD1 3.93Å; Y752-L766 HydrophobicContact CD1-CD2 4.39Å; Y752-L766 HydrophobicContact CD1-CG 3.98Å; Y752-R767 CarbonylContact C-O 3.52Å; Y752-R767 WeakPolarHBondContact CA-O 3.45Å; Y752-K768 HydrophobicContact CD1-CB 3.89Å; Y752-K768 HydrophobicContact CD1-CG 4.37Å; Y752-K768 HydrophobicContact CD2-CG 4.1Å; Y752-K768 HydrophobicContact CE1-CB 3.63Å; Y752-K768 HydrophobicContact CE1-CG 4.09Å; Y752-K768 HydrophobicContact CE2-CB 4.28Å; Y752-K768 HydrophobicContact CE2-CG 3.79Å; Y752-K768 HydrophobicContact CG-CB 4.34Å; Y752-K768 HydrophobicContact CG-CG 4.39Å
753	I	94.9	Very high	93.2	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.7	168.4	-56.9	164.9	0	0	0	107.9	L717 K719 L731 L739 R767 L769	L717-I753 WeakPolarHBondContact O-CA 3.46Å; K719-I753 HydrophobicContact CB-CG2 3.98Å; K719-I753 HydrophobicContact CD-CG2 4.39Å; L731-I753 HydrophobicContact CD1-CD1 4.36Å; L731-I753 HydrophobicContact CD2-CD1 3.82Å; L731-I753 HydrophobicContact CG-CD1 4.3Å; L739-I753 HydrophobicContact CD1-CD1 4.47Å; L739-I753 HydrophobicContact CD1-CG1 4.37Å; I753-R767 PolarHBondContact N-O 3.46Å; I753-R767 PolarHBondContact O-N 2.9Å; I753-L769 HydrophobicContact CD1-CD1 4.1Å; I753-L769 HydrophobicContact CD1-CD2 3.85Å; I753-L769 HydrophobicContact CD1-CG 4.14Å; I753-L769 HydrophobicContact CG1-CD1 4.44Å; I753-L769 HydrophobicContact CG1-CG 4.47Å
754	A	94.9	Very high	93	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	101.6	170.2	0	0	0	0	0	108.7	L355 V716 L717 K719 I756 L766	L355-A754 HydrophobicContact CD1-CB 4.05Å; L355-A754 HydrophobicContact CD2-CB 3.56Å; L355-A754 HydrophobicContact CG-CB 4.49Å; V716-A754 HydrophobicContact CG1-CB 3.86Å; L717-A754 PolarHBondContact O-N 3.34Å; K719-A754 PolarHBondContact N-O 2.88Å; A754-I756 PolarHBondContact O-N 2.85Å; A754-L766 HydrophobicContact CB-CD1 4.16Å
755	H	94.8	Very high	92.9	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	115.3	175.5	-62.8	-84.2	0	0	0	108.8	E721 V728 A764 L765 R767	E721-H755 HydrophobicContact CG-CB 3.96Å; E721-H755 IonicContact OE1-CE1 3.52Å; E721-H755 IonicContact OE1-CG 2.78Å; E721-H755 IonicContact OE1-ND1 3.69Å; E721-H755 PolarHBondContact OE1-ND1 3.45Å; V728-H755 HydrophobicContact CG1-CB 4.05Å; H755-A764 PolarHBondContact O-N 3.32Å; H755-L765 HydrophobicContact CB-CB 4.16Å; H755-L765 WeakPolarHBondContact CB-O 3.36Å; H755-L765 PolarHBondContact CD2-O 3.2Å; H755-L765 PolarHBondContact N-O 3.04Å; H755-L765 PolarHBondContact O-N 3Å; H755-R767 PolarHBondContact NE2-NE 3.25Å
756	I	95.1	Very high	92.9	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.4	-171.3	-61.4	162.3	0	0	0	109.1	L247 H351 L355 P718 K719 L720 E721 A754 A758 K762 V763	L247-I756 HydrophobicContact CD1-CD1 3.76Å; L247-I756 HydrophobicContact CD1-CG1 3.98Å; L247-I756 HydrophobicContact CD1-CG2 3.78Å; H351-I756 HydrophobicContact CB-CD1 4.46Å; L355-I756 HydrophobicContact CD2-CD1 4.4Å; P718-I756 HydrophobicContact CB-CD1 3.93Å; K719-I756 PolarHBondContact O-N 3.32Å; L720-I756 CarbonylContact C-O 3.5Å; L720-I756 WeakPolarHBondContact CA-O 3.25Å; L720-I756 HydrophobicContact CD2-CB 4.18Å; L720-I756 HydrophobicContact CD2-CG2 4.04Å; E721-I756 WeakPolarHBondContact CB-O 3.44Å; E721-I756 PolarHBondContact N-O 3.25Å; A754-I756 PolarHBondContact O-N 2.85Å; I756-A758 PolarHBondContact O-N 2.88Å; I756-K762 CarbonylContact C-O 3.57Å; I756-K762 WeakPolarHBondContact CA-O 3.26Å; I756-V763 HydrophobicContact CG1-CG2 4.35Å
757	N	94	Very high	92.8	Very high	33 Å²	33	22 Å²	22	18%	0.176	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	117.6	173.4	-176.8	-34.5	0	0	0	110.2	L724 H759 T760 S761 K762	L724-N757 HydrophobicContact CD2-CB 3.78Å; N757-H759 PolarHBondContact O-N 3.44Å; N757-H759 PolarHBondContact OD1-N 3.09Å; N757-T760 WeakPolarHBondContact CB-OG1 3.23Å; N757-T760 PolarHBondContact ND2-OG1 2.97Å; N757-T760 PolarHBondContact O-N 3.23Å; N757-T760 PolarHBondContact OD1-N 3.22Å; N757-S761 WeakPolarHBondContact O-CA 3.19Å; N757-S761 PolarHBondContact O-N 3.33Å; N757-K762 PolarHBondContact N-O 3.45Å
758	A	93.5	Very high	92.9	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-25.1	-175.6	0	0	0	0	0	114.4	F175 L720 E721 Y722 I756	F175-A758 WeakPolarHBondContact CD1-O 3.34Å; L720-A758 HydrophobicContact CB-CB 4.33Å; E721-A758 PolarHBondContact O-N 3.29Å; E721-A758 VanDerWaalsContact O-N 3.07Å; Y722-A758 HydrophobicContact CD1-CB 3.79Å; Y722-A758 HydrophobicContact CD2-CB 4.12Å; Y722-A758 HydrophobicContact CE1-CB 3.56Å; Y722-A758 HydrophobicContact CE2-CB 3.9Å; Y722-A758 HydrophobicContact CG-CB 4.07Å; I756-A758 PolarHBondContact O-N 2.88Å
759	H	91.6	Very high	92.9	Very high	59 Å²	59	24.6 Å²	24.6	27%	0.273	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-29	-175.9	-59.8	93	0	0	0	113.7	D172 F175 Y722 N757	D172-H759 PolarHBondContact O-NE2 2.91Å; D172-H759 VanDerWaalsContact O-NE2 3.17Å; F175-H759 AromaticContact CD1-CD2 3.98Å; F175-H759 AromaticContact CG-CD2 3.78Å; Y722-H759 AromaticContact CD1-CE1 3.99Å; N757-H759 PolarHBondContact O-N 3.44Å; N757-H759 PolarHBondContact OD1-N 3.09Å
760	T	92.4	Very high	92.7	Very high	63 Å²	63	27.2 Å²	27.2	39%	0.387	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-5.5	-174.6	65.6	0	0	0	0	113.8	Q246 N757 K762	Q246-T760 PolarHBondContact NE2-O 3.04Å; Q246-T760 PolarHBondContact OE1-O 3.09Å; N757-T760 WeakPolarHBondContact CB-OG1 3.23Å; N757-T760 PolarHBondContact ND2-OG1 2.97Å; N757-T760 PolarHBondContact O-N 3.23Å; N757-T760 PolarHBondContact OD1-N 3.22Å; T760-K762 PolarHBondContact O-N 2.79Å
761	S	93.8	Very high	92.3	Very high	3 Å²	3	30.9 Å²	30.9	2%	0.021	16%	0.16	C	C	.	.			trans	54.2	31.1	-175.2	-52.7	0	0	0	0	113.2	Q246 L247 H351 N757	Q246-S761 PolarHBondContact NE2-O 3.35Å; L247-S761 WeakPolarHBondContact CB-O 3.4Å; L247-S761 VanDerWaalsContact CG-O 3.23Å; L247-S761 WeakPolarHBondContact CG-O 3.46Å; L247-S761 PolarHBondContact N-O 2.82Å; H351-S761 WeakPolarHBondContact NE2-CB 3.16Å; H351-S761 PolarHBondContact NE2-OG 3.07Å; N757-S761 WeakPolarHBondContact O-CA 3.19Å; N757-S761 PolarHBondContact O-N 3.33Å
762	K	93.5	Very high	91.8	Very high	83 Å²	83	33.7 Å²	33.7	36%	0.361	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	139.3	177.2	-68.5	-169.8	176.9	-172.2	0	112.5	A245 Q246 I756 N757 T760 A764	A245-K762 WeakPolarHBondContact O-CA 3.42Å; Q246-K762 VanDerWaalsContact OE1-CG 3.32Å; I756-K762 CarbonylContact C-O 3.57Å; I756-K762 WeakPolarHBondContact CA-O 3.26Å; N757-K762 PolarHBondContact N-O 3.45Å; T760-K762 PolarHBondContact O-N 2.79Å; K762-A764 PolarHBondContact O-N 2.87Å
763	V	93.1	Very high	91.5	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	101	173.7	-176.9	0	0	0	0	109.7	V241 D244 A245 L247 L355 I756	V241-V763 HydrophobicContact CG1-CB 4.26Å; V241-V763 HydrophobicContact CG1-CG1 4.31Å; V241-V763 HydrophobicContact CG1-CG2 3.9Å; D244-V763 WeakPolarHBondContact CA-O 3.36Å; D244-V763 PolarHBondContact N-O 3.2Å; A245-V763 HydrophobicContact CB-CB 4.43Å; A245-V763 HydrophobicContact CB-CG2 4.46Å; A245-V763 PolarHBondContact O-N 2.95Å; L247-V763 HydrophobicContact CD1-CG2 4.09Å; L247-V763 HydrophobicContact CD2-CG2 3.52Å; L247-V763 HydrophobicContact CG-CG2 3.83Å; L355-V763 HydrophobicContact CD1-CG2 4.12Å; I756-V763 HydrophobicContact CG1-CG2 4.35Å
764	A	89.9	Confident	91.1	Very high	23 Å²	23	36.5 Å²	36.5	19%	0.19	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-34.2	-177.4	0	0	0	0	0	113	L724 H755 K762	L724-A764 HydrophobicContact CD1-CB 3.82Å; L724-A764 HydrophobicContact CD2-CB 3.47Å; L724-A764 VanDerWaalsContact CD2-CB 3.47Å; L724-A764 HydrophobicContact CG-CB 4.25Å; H755-A764 PolarHBondContact O-N 3.32Å; K762-A764 PolarHBondContact O-N 2.87Å
765	L	90.1	Very high	90.6	Very high	42 Å²	42	41.4 Å²	41.4	22%	0.22	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	121.6	176.5	176.1	64.8	0	0	0	111.1	H755 R767 V858 L860	H755-L765 HydrophobicContact CB-CB 4.16Å; H755-L765 WeakPolarHBondContact CB-O 3.36Å; H755-L765 PolarHBondContact CD2-O 3.2Å; H755-L765 PolarHBondContact N-O 3.04Å; H755-L765 PolarHBondContact O-N 3Å; L765-R767 HydrophobicContact CD2-CB 4.12Å; L765-R767 HydrophobicContact CG-CB 4.1Å; L765-V858 HydrophobicContact CD2-CG1 4.15Å; L765-L860 HydrophobicContact CB-CD2 4.23Å; L765-L860 HydrophobicContact CD2-CD2 3.94Å
766	L	92.4	Very high	89.8	Confident	33 Å²	33	47.3 Å²	47.3	17%	0.173	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	112.5	161	180	66.2	0	0	0	109.1	M240 V241 V716 Y752 A754	M240-L766 HydrophobicContact CG-CD2 3.47Å; M240-L766 VanDerWaalsContact CG-CD2 3.47Å; M240-L766 HydrophobicContact SD-CD2 4.42Å; V241-L766 HydrophobicContact CB-CD2 4.38Å; V716-L766 HydrophobicContact CG1-CD1 4.17Å; Y752-L766 HydrophobicContact CD1-CD1 3.93Å; Y752-L766 HydrophobicContact CD1-CD2 4.39Å; Y752-L766 HydrophobicContact CD1-CG 3.98Å; A754-L766 HydrophobicContact CB-CD1 4.16Å
767	R	90.9	Very high	89.3	Confident	59 Å²	59	48.8 Å²	48.8	22%	0.223	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	115.7	-175.8	179.9	168.1	66.8	118.8	-6.6	110.9	Y752 I753 H755 L765	Y752-R767 CarbonylContact C-O 3.52Å; Y752-R767 WeakPolarHBondContact CA-O 3.45Å; I753-R767 PolarHBondContact N-O 3.46Å; I753-R767 PolarHBondContact O-N 2.9Å; H755-R767 PolarHBondContact NE2-NE 3.25Å; L765-R767 HydrophobicContact CD2-CB 4.12Å; L765-R767 HydrophobicContact CG-CB 4.1Å
768	K	91.9	Very high	88.5	Confident	82 Å²	82	49.8 Å²	49.8	36%	0.357	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	135.5	161.4	-162.5	-150.3	164.7	-157.1	0	108.3	Y752 D771	Y752-K768 HydrophobicContact CD1-CB 3.89Å; Y752-K768 HydrophobicContact CD1-CG 4.37Å; Y752-K768 HydrophobicContact CD2-CG 4.1Å; Y752-K768 HydrophobicContact CE1-CB 3.63Å; Y752-K768 HydrophobicContact CE1-CG 4.09Å; Y752-K768 HydrophobicContact CE2-CB 4.28Å; Y752-K768 HydrophobicContact CE2-CG 3.79Å; Y752-K768 HydrophobicContact CG-CB 4.34Å; Y752-K768 HydrophobicContact CG-CG 4.39Å; K768-D771 IonicContact NZ-OD1 3.48Å; K768-D771 PolarHBondContact NZ-OD1 2.96Å
769	L	91.4	Very high	87.9	Confident	6 Å²	6	51.2 Å²	51.2	3%	0.031	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-77.5	148.6	167.4	-67.1	178.2	0	0	0	110.7	L739 P751 I753 W773	L739-L769 HydrophobicContact CD1-CD1 4Å; P751-L769 HydrophobicContact CB-CD1 4.32Å; P751-L769 HydrophobicContact CG-CB 4.16Å; P751-L769 PolarHBondContact O-N 3.44Å; I753-L769 HydrophobicContact CD1-CD1 4.1Å; I753-L769 HydrophobicContact CD1-CD2 3.85Å; I753-L769 HydrophobicContact CD1-CG 4.14Å; I753-L769 HydrophobicContact CG1-CD1 4.44Å; I753-L769 HydrophobicContact CG1-CG 4.47Å; L769-W773 HydrophobicContact CB-CB 4.01Å; L769-W773 HydrophobicContact CB-CG 4.04Å; L769-W773 HydrophobicContact CD1-CB 4.36Å; L769-W773 HydrophobicContact CD1-CD2 3.72Å; L769-W773 HydrophobicContact CD1-CE3 3.79Å; L769-W773 HydrophobicContact CD1-CG 3.97Å; L769-W773 HydrophobicContact CD1-CZ3 4.38Å
770	P	87.8	Confident	87.6	Confident	67 Å²	67	51 Å²	51	44%	0.435	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-71.7	156.3	171.7	34.2	-37.3	0	0	0	110.3	D772 W773	P770-D772 WeakPolarHBondContact CB-OD1 3.25Å; P770-D772 PolarHBondContact O-N 2.88Å; P770-D772 VanDerWaalsContact O-N 3.08Å; P770-W773 HydrophobicContact CG-CB 4.15Å; P770-W773 WeakPolarHBondContact O-CB 3.47Å; P770-W773 PolarHBondContact O-N 3.17Å; P770-W773 VanDerWaalsContact O-N 3.08Å
771	D	83.5	Confident	87.5	Confident	77 Å²	77	48.5 Å²	48.5	41%	0.412	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-14.4	-171.9	-65.2	19.3	0	0	0	112.5	R702 K768	R702-D771 IonicContact CZ-OD2 2.69Å; R702-D771 IonicContact NH1-OD2 2.7Å; R702-D771 IonicContact NH2-OD2 3.7Å; R702-D771 PolarHBondContact NH2-OD2 3.2Å; K768-D771 IonicContact NZ-OD1 3.48Å; K768-D771 PolarHBondContact NZ-OD1 2.96Å
772	D	84.1	Confident	87.4	Confident	67 Å²	67	54.5 Å²	54.5	36%	0.358	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	6.2	175.7	73.1	-44.2	0	0	0	115	P770 M774 Q775 N776	P770-D772 WeakPolarHBondContact CB-OD1 3.25Å; P770-D772 PolarHBondContact O-N 2.88Å; P770-D772 VanDerWaalsContact O-N 3.08Å; D772-M774 PolarHBondContact O-N 2.8Å; D772-Q775 WeakPolarHBondContact O-CB 3.41Å; D772-Q775 PolarHBondContact O-N 3.29Å; D772-N776 PolarHBondContact OD2-ND2 3.43Å
773	W	87.8	Confident	87.3	Confident	20 Å²	20	52 Å²	52	8%	0.076	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-47.2	-36.1	-168.7	68.3	-78.6	0	0	0	115.9	L731 L739 W740 L769 P770 Q775 N776 I777	L731-W773 HydrophobicContact CD1-CE3 4.43Å; L731-W773 HydrophobicContact CD1-CZ3 4.23Å; L739-W773 HydrophobicContact CB-CH2 3.38Å; L739-W773 HydrophobicContact CB-CZ2 3.8Å; L739-W773 HydrophobicContact CB-CZ3 4.14Å; L739-W773 HydrophobicContact CD1-CH2 4.37Å; L739-W773 HydrophobicContact CD1-CZ3 4.33Å; W740-W773 HydrophobicContact CB-CH2 4.22Å; W740-W773 HydrophobicContact CB-CZ2 4.4Å; L769-W773 HydrophobicContact CB-CB 4.01Å; L769-W773 HydrophobicContact CB-CG 4.04Å; L769-W773 HydrophobicContact CD1-CB 4.36Å; L769-W773 HydrophobicContact CD1-CD2 3.72Å; L769-W773 HydrophobicContact CD1-CE3 3.79Å; L769-W773 HydrophobicContact CD1-CG 3.97Å; L769-W773 HydrophobicContact CD1-CZ3 4.38Å; P770-W773 HydrophobicContact CG-CB 4.15Å; P770-W773 WeakPolarHBondContact O-CB 3.47Å; P770-W773 PolarHBondContact O-N 3.17Å; P770-W773 VanDerWaalsContact O-N 3.08Å; W773-Q775 PolarHBondContact O-N 3.01Å; W773-N776 PolarHBondContact O-N 3.45Å; W773-N776 VanDerWaalsContact O-N 3.13Å; W773-I777 HydrophobicContact CE3-CD1 4.05Å; W773-I777 HydrophobicContact CZ3-CD1 3.59Å; W773-I777 PolarHBondContact O-N 3.38Å
774	M	87.3	Confident	87.3	Confident	49 Å²	49	53.7 Å²	53.7	24%	0.241	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-59	-27	178.1	-84.4	-64.3	-61.7	0	0	114.3	W740 D772 N776 I777 F781 P783	W740-M774 HydrophobicContact CB-CE 4.48Å; W740-M774 HydrophobicContact CB-SD 3.99Å; W740-M774 HydrophobicContact CG-CE 4.29Å; W740-M774 HydrophobicContact CG-SD 4.34Å; D772-M774 PolarHBondContact O-N 2.8Å; M774-N776 VanDerWaalsContact C-N 3.35Å; M774-I777 HydrophobicContact SD-CD1 4.43Å; M774-F781 HydrophobicContact CE-CD1 3.74Å; M774-F781 HydrophobicContact CE-CE1 3.72Å; M774-F781 HydrophobicContact SD-CD1 4.12Å; M774-F781 HydrophobicContact SD-CE1 4.19Å; M774-P783 HydrophobicContact CE-CG 3.41Å; M774-P783 VanDerWaalsContact CE-CG 3.41Å
775	Q	83.5	Confident	87.4	Confident	102 Å²	102	58.3 Å²	58.3	48%	0.477	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-75.7	-26.9	178.8	-59	-179.4	37.5	0	0	112.2	S386 D772 W773	S386-Q775 PolarHBondContact OG-NE2 3.25Å; D772-Q775 WeakPolarHBondContact O-CB 3.41Å; D772-Q775 PolarHBondContact O-N 3.29Å; W773-Q775 PolarHBondContact O-N 3.01Å
776	N	79.1	Confident	87.6	Confident	124 Å²	124	56.3 Å²	56.3	66%	0.663	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-109.5	19.2	-171	-66.6	-66.8	0	0	0	112.6	D772 W773 M774	D772-N776 PolarHBondContact OD2-ND2 3.43Å; W773-N776 PolarHBondContact O-N 3.45Å; W773-N776 VanDerWaalsContact O-N 3.13Å; M774-N776 VanDerWaalsContact C-N 3.35Å
777	I	83.4	Confident	87.8	Confident	32 Å²	32	55.2 Å²	55.2	16%	0.164	30%	0.295	C	S	.	.			trans	-79.8	132.1	-168.5	-157.4	174.7	0	0	0	113.4	L731 A736 W773 M774 C779	L731-I777 HydrophobicContact CD1-CD1 4.16Å; L731-I777 HydrophobicContact CD1-CG1 4.31Å; A736-I777 HydrophobicContact CB-CD1 3.34Å; W773-I777 HydrophobicContact CE3-CD1 4.05Å; W773-I777 HydrophobicContact CZ3-CD1 3.59Å; W773-I777 PolarHBondContact O-N 3.38Å; M774-I777 HydrophobicContact SD-CD1 4.43Å; I777-C779 PolarHBondContact O-N 3.21Å
778	S	77.9	Confident	88	Confident	54 Å²	54	53.2 Å²	53.2	38%	0.378	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-7.9	-168.6	55.2	0	0	0	0	115.7
779	C	81.2	Confident	88.2	Confident	30 Å²	30	49.7 Å²	49.7	20%	0.203	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-12.7	-176.3	59.4	0	0	0	0	115.6	L731 N733 I777	L731-C779 WeakPolarHBondContact O-CB 3.37Å; N733-C779 PolarHBondContact ND2-O 2.93Å; N733-C779 PolarHBondContact OD1-O 3.19Å; N733-C779 VanDerWaalsContact OD1-O 3.12Å; I777-C779 PolarHBondContact O-N 3.21Å
780	G	83.8	Confident	88.4	Confident	53 Å²	53	49.5 Å²	49.5	55%	0.546	27%	0.273	S	S	.	.			trans	80	11.6	-178.3	0	0	0	0	0	115.4
781	F	91.5	Very high	88.8	Confident	12 Å²	12	47.4 Å²	47.4	5%	0.053	26%	0.258	C	S	.	.			trans	-53.2	137.8	174.8	172.6	-119.8	0	0	0	112	H302 N733 A736 C737 W740 M774 P783	H302-F781 AromaticContact CE1-CD2 3.65Å; H302-F781 AromaticContact CE1-CE2 3.68Å; N733-F781 VanDerWaalsContact OD1-CA 3.24Å; N733-F781 WeakPolarHBondContact OD1-CA 3.36Å; N733-F781 WeakPolarHBondContact OD1-CB 3.22Å; N733-F781 PolarHBondContact OD1-N 3.4Å; A736-F781 HydrophobicContact CB-CB 3.91Å; A736-F781 HydrophobicContact CB-CD1 3.81Å; A736-F781 HydrophobicContact CB-CG 3.93Å; C737-F781 HydrophobicContact CB-CD2 4.41Å; C737-F781 HydrophobicContact CB-CE2 3.85Å; C737-F781 HydrophobicContact CB-CZ 4.05Å; W740-F781 HydrophobicContact CB-CE1 3.71Å; W740-F781 HydrophobicContact CB-CZ 4.33Å; W740-F781 HydrophobicContact CD2-CE1 4.06Å; W740-F781 HydrophobicContact CD2-CZ 4.01Å; W740-F781 HydrophobicContact CE3-CE1 4.1Å; W740-F781 AromaticContact CE3-CZ 3.6Å; W740-F781 HydrophobicContact CE3-CZ 3.6Å; W740-F781 AromaticContact CG-CE1 3.87Å; W740-F781 HydrophobicContact CG-CE1 3.87Å; W740-F781 HydrophobicContact CG-CZ 4.3Å; W740-F781 HydrophobicContact CZ3-CZ 4.31Å; M774-F781 HydrophobicContact CE-CD1 3.74Å; M774-F781 HydrophobicContact CE-CE1 3.72Å; M774-F781 HydrophobicContact SD-CD1 4.12Å; M774-F781 HydrophobicContact SD-CE1 4.19Å; F781-P783 HydrophobicContact CD1-CG 4.4Å; F781-P783 HydrophobicContact CE1-CG 3.69Å; F781-P783 HydrophobicContact CZ-CB 4.44Å; F781-P783 HydrophobicContact CZ-CG 3.95Å
782	K	90.6	Very high	89.4	Confident	128 Å²	128	45.1 Å²	45.1	56%	0.557	24%	0.244	S	C	*	.			trans	-134.9	101.9	-179	-69.8	-174	-178.2	-173.2	0	110.8	S784 K785	K782-S784 PolarHBondContact O-N 2.9Å; K782-S784 VanDerWaalsContact O-N 3.09Å; K782-K785 HydrophobicContact CB-CG 4.34Å; K782-K785 WeakPolarHBondContact O-CB 3.44Å; K782-K785 PolarHBondContact O-N 2.8Å
783	P	92.7	Very high	90	Very high	30 Å²	30	42.2 Å²	42.2	20%	0.195	23%	0.229	C	C	.	.	H	α-helix	trans	-49.7	-36.6	179.4	-32.7	36.2	0	0	0	115.2	W740 M774 F781 K785 S786 L787	W740-P783 HydrophobicContact CD2-CB 4.1Å; W740-P783 HydrophobicContact CD2-CG 3.99Å; W740-P783 HydrophobicContact CE3-CB 4.47Å; W740-P783 HydrophobicContact CG-CG 4.19Å; W740-P783 HydrophobicContact CH2-CB 4.08Å; W740-P783 HydrophobicContact CZ2-CB 3.69Å; W740-P783 HydrophobicContact CZ2-CG 4.39Å; W740-P783 HydrophobicContact CZ3-CB 4.43Å; M774-P783 HydrophobicContact CE-CG 3.41Å; M774-P783 VanDerWaalsContact CE-CG 3.41Å; F781-P783 HydrophobicContact CD1-CG 4.4Å; F781-P783 HydrophobicContact CE1-CG 3.69Å; F781-P783 HydrophobicContact CZ-CB 4.44Å; F781-P783 HydrophobicContact CZ-CG 3.95Å; P783-K785 VanDerWaalsContact C-N 3.28Å; P783-K785 PolarHBondContact O-N 2.9Å; P783-S786 PolarHBondContact O-N 3.15Å; P783-L787 WeakPolarHBondContact O-CB 3.41Å; P783-L787 WeakPolarHBondContact O-CG 3.21Å; P783-L787 PolarHBondContact O-N 3.2Å
784	S	92.4	Very high	90.4	Very high	38 Å²	38	41.2 Å²	41.2	27%	0.266	23%	0.225	S	C	.	.	H	α-helix	trans	-62.7	-30.5	178.9	54.4	0	0	0	0	113.4	K782 N788	K782-S784 PolarHBondContact O-N 2.9Å; K782-S784 VanDerWaalsContact O-N 3.09Å; S784-N788 PolarHBondContact O-N 3.4Å; S784-N788 PolarHBondContact O-ND2 2.95Å
785	K	92.6	Very high	90.8	Very high	120 Å²	120	43.6 Å²	43.6	52%	0.522	23%	0.234	S	C	.	.	H	α-helix	trans	-66.3	-53.3	171.3	-72.9	-170.7	171.4	-170.1	0	110.6	K782 P783 L787 N788 I789	K782-K785 HydrophobicContact CB-CG 4.34Å; K782-K785 WeakPolarHBondContact O-CB 3.44Å; K782-K785 PolarHBondContact O-N 2.8Å; P783-K785 VanDerWaalsContact C-N 3.28Å; P783-K785 PolarHBondContact O-N 2.9Å; K785-L787 PolarHBondContact O-N 2.94Å; K785-N788 PolarHBondContact O-N 3.04Å; K785-N788 VanDerWaalsContact O-N 3.15Å; K785-I789 WeakPolarHBondContact O-CG1 3.48Å; K785-I789 PolarHBondContact O-N 3.29Å; K785-I789 VanDerWaalsContact O-N 3.08Å
786	S	94.3	Very high	91.4	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-57.6	-44.1	-179.7	-65.9	0	0	0	0	112.8	L299 P783 N788 I789 L790	L299-S786 WeakPolarHBondContact O-CB 3.15Å; L299-S786 PolarHBondContact O-OG 3.05Å; P783-S786 PolarHBondContact O-N 3.15Å; S786-N788 VanDerWaalsContact C-N 3.34Å; S786-N788 PolarHBondContact O-N 2.96Å; S786-I789 PolarHBondContact O-N 3.24Å; S786-L790 WeakPolarHBondContact O-CB 3.35Å; S786-L790 PolarHBondContact O-N 3.36Å
787	L	95.7	Very high	92.2	Very high	9 Å²	9	36.2 Å²	36.2	5%	0.047	19%	0.194	C	C	.	.	H	α-helix	trans	-63.6	-36.2	177	-74.1	169.1	0	0	0	113	L219 L221 L299 L685 W740 P783 K785 L790 H791	L219-L787 HydrophobicContact CD2-CB 3.98Å; L219-L787 VanDerWaalsContact CD2-O 3.29Å; L219-L787 WeakPolarHBondContact CD2-O 3.36Å; L219-L787 HydrophobicContact CG-CB 4.21Å; L219-L787 WeakPolarHBondContact O-CD1 3.32Å; L221-L787 HydrophobicContact CB-CD2 3.95Å; L299-L787 HydrophobicContact CD2-CD2 4.18Å; L685-L787 HydrophobicContact CD1-CD2 4.05Å; W740-L787 HydrophobicContact CH2-CD1 4.1Å; W740-L787 HydrophobicContact CH2-CD2 3.93Å; W740-L787 HydrophobicContact CH2-CG 3.81Å; W740-L787 HydrophobicContact CZ2-CD1 4.17Å; W740-L787 HydrophobicContact CZ2-CG 4.38Å; P783-L787 WeakPolarHBondContact O-CB 3.41Å; P783-L787 WeakPolarHBondContact O-CG 3.21Å; P783-L787 PolarHBondContact O-N 3.2Å; K785-L787 PolarHBondContact O-N 2.94Å; L787-L790 HydrophobicContact CD2-CD2 4.49Å; L787-H791 WeakPolarHBondContact O-CB 3.4Å; L787-H791 PolarHBondContact O-N 2.76Å
788	N	95.4	Very high	92.7	Very high	17 Å²	17	36.2 Å²	36.2	9%	0.091	20%	0.196	C	C	.	.	H	α-helix	trans	-72.2	-36.2	177.6	-84.7	-89.3	0	0	0	112.2	T214 F215 N216 L219 S784 K785 S786 H792	T214-N788 PolarHBondContact O-OD1 3.04Å; F215-N788 WeakPolarHBondContact CA-OD1 3.36Å; F215-N788 HydrophobicContact CD2-CB 3.98Å; F215-N788 HydrophobicContact CE2-CB 4.36Å; N216-N788 PolarHBondContact N-OD1 3.04Å; N216-N788 PolarHBondContact O-ND2 2.71Å; L219-N788 HydrophobicContact CD2-CB 4.41Å; S784-N788 PolarHBondContact O-N 3.4Å; S784-N788 PolarHBondContact O-ND2 2.95Å; K785-N788 PolarHBondContact O-N 3.04Å; K785-N788 VanDerWaalsContact O-N 3.15Å; S786-N788 VanDerWaalsContact C-N 3.34Å; S786-N788 PolarHBondContact O-N 2.96Å; N788-H792 WeakPolarHBondContact O-CB 3.47Å; N788-H792 PolarHBondContact O-N 3.39Å
789	I	95.3	Very high	93.5	Very high	9 Å²	9	36.3 Å²	36.3	5%	0.046	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-48.9	171.4	-63.7	171	0	0	0	109.7	L210 T211 N301 K785 S786 H791 H792 L793	L210-I789 HydrophobicContact CB-CG2 4.31Å; L210-I789 HydrophobicContact CD2-CG2 3.95Å; T211-I789 HydrophobicContact CG2-CD1 4.38Å; T211-I789 HydrophobicContact CG2-CG1 4.31Å; N301-I789 HydrophobicContact CB-CD1 3.9Å; N301-I789 HydrophobicContact CB-CG2 4.04Å; N301-I789 VanDerWaalsContact O-CD1 3.24Å; N301-I789 WeakPolarHBondContact O-CD1 3.26Å; K785-I789 WeakPolarHBondContact O-CG1 3.48Å; K785-I789 PolarHBondContact O-N 3.29Å; K785-I789 VanDerWaalsContact O-N 3.08Å; S786-I789 PolarHBondContact O-N 3.24Å; I789-H791 PolarHBondContact O-N 3.35Å; I789-H792 PolarHBondContact O-N 2.55Å; I789-L793 HydrophobicContact CG2-CD1 3.88Å; I789-L793 HydrophobicContact CG2-CG 4.36Å; I789-L793 WeakPolarHBondContact O-CB 3.31Å; I789-L793 WeakPolarHBondContact O-CG 3.39Å; I789-L793 PolarHBondContact O-N 3.09Å
790	L	96.7	Very high	94.2	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-55.1	-51.9	175.6	177.3	69.3	0	0	0	111.6	L295 L298 L299 L685 S786 L787 H792 L793 L794	L295-L790 HydrophobicContact CD1-CD1 4.06Å; L295-L790 HydrophobicContact CD1-CD2 3.67Å; L298-L790 HydrophobicContact CB-CD1 3.59Å; L298-L790 HydrophobicContact CD1-CD1 3.87Å; L298-L790 HydrophobicContact CG-CD1 4.35Å; L299-L790 HydrophobicContact CD2-CB 3.95Å; L299-L790 HydrophobicContact CD2-CD2 3.79Å; L299-L790 HydrophobicContact CD2-CG 4.42Å; L299-L790 HydrophobicContact CG-CD2 4.27Å; L685-L790 HydrophobicContact CD2-CD2 3.8Å; L685-L790 HydrophobicContact CD2-CG 3.92Å; S786-L790 WeakPolarHBondContact O-CB 3.35Å; S786-L790 PolarHBondContact O-N 3.36Å; L787-L790 HydrophobicContact CD2-CD2 4.49Å; L790-H792 PolarHBondContact O-N 2.79Å; L790-L793 PolarHBondContact O-N 3.23Å; L790-L794 HydrophobicContact CD1-CD1 3.88Å; L790-L794 HydrophobicContact CD1-CD2 4.24Å; L790-L794 HydrophobicContact CD1-CG 3.82Å; L790-L794 HydrophobicContact CG-CD1 4.07Å; L790-L794 HydrophobicContact CG-CG 4.21Å; L790-L794 WeakPolarHBondContact O-CB 3.37Å; L790-L794 VanDerWaalsContact O-CG 3.3Å; L790-L794 WeakPolarHBondContact O-CG 3.49Å; L790-L794 PolarHBondContact O-N 3.19Å
791	H	96.3	Very high	94.7	Very high	23 Å²	23	38 Å²	38	11%	0.106	20%	0.2	C	C	.	.	H	α-helix	trans	-61.6	-42.5	-179.6	178.6	-101.9	0	0	0	112.4	L219 L685 D687 L787 I789 K795	L219-H791 HydrophobicContact CD2-CB 3.76Å; L685-H791 HydrophobicContact CD2-CB 3.95Å; L685-H791 HydrophobicContact CG-CB 4.24Å; L685-H791 PolarHBondContact O-CD2 3.34Å; D687-H791 IonicContact OD1-CD2 3.85Å; D687-H791 IonicContact OD1-CE1 3.54Å; D687-H791 IonicContact OD1-NE2 2.74Å; D687-H791 PolarHBondContact OD1-NE2 2.99Å; L787-H791 WeakPolarHBondContact O-CB 3.4Å; L787-H791 PolarHBondContact O-N 2.76Å; I789-H791 PolarHBondContact O-N 3.35Å; H791-K795 WeakPolarHBondContact O-CB 3.37Å; H791-K795 PolarHBondContact O-N 3.42Å
792	H	95.6	Very high	94.8	Very high	29 Å²	29	42.1 Å²	42.1	13%	0.134	22%	0.219	C	C	.	.	H	α-helix	trans	-60.5	-49.2	175.9	-176.4	64.9	0	0	0	112.1	S209 G212 G213 N788 I789 L790 K795 K796	S209-H792 PolarHBondContact O-CD2 3.07Å; S209-H792 PolarHBondContact O-NE2 2.95Å; G212-H792 PolarHBondContact O-CE1 2.86Å; G212-H792 VanDerWaalsContact O-CE1 3.22Å; G213-H792 WeakPolarHBondContact CA-ND1 3.41Å; G213-H792 PolarHBondContact N-ND1 2.87Å; N788-H792 WeakPolarHBondContact O-CB 3.47Å; N788-H792 PolarHBondContact O-N 3.39Å; I789-H792 PolarHBondContact O-N 2.55Å; L790-H792 PolarHBondContact O-N 2.79Å; H792-K795 PolarHBondContact O-N 3.43Å; H792-K796 WeakPolarHBondContact O-CB 2.87Å; H792-K796 WeakPolarHBondContact O-CG 3.14Å; H792-K796 PolarHBondContact O-N 3.37Å
793	L	96.4	Very high	95	Very high	5 Å²	5	37.1 Å²	37.1	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-64.2	-48.7	179.3	-68.5	177.4	0	0	0	111.7	T208 L210 L298 W310 I789 L790 K795 K796 L797 V816	T208-L793 HydrophobicContact CG2-CD2 4.35Å; L210-L793 HydrophobicContact CD2-CD1 4Å; L298-L793 HydrophobicContact CD2-CD1 3.74Å; W310-L793 HydrophobicContact CH2-CD1 4.38Å; I789-L793 HydrophobicContact CG2-CD1 3.88Å; I789-L793 HydrophobicContact CG2-CG 4.36Å; I789-L793 WeakPolarHBondContact O-CB 3.31Å; I789-L793 WeakPolarHBondContact O-CG 3.39Å; I789-L793 PolarHBondContact O-N 3.09Å; L790-L793 PolarHBondContact O-N 3.23Å; L793-K795 VanDerWaalsContact C-N 3.33Å; L793-K795 PolarHBondContact O-N 2.67Å; L793-K796 WeakPolarHBondContact O-CB 3.33Å; L793-K796 PolarHBondContact O-N 3.46Å; L793-L797 VanDerWaalsContact O-CG 3.3Å; L793-L797 WeakPolarHBondContact O-CG 3.48Å; L793-L797 PolarHBondContact O-N 3.19Å; L793-V816 HydrophobicContact CD2-CG2 3.79Å
794	L	96.8	Very high	95.2	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.2	-42	178.5	-67.3	-166.1	0	0	0	111.6	V288 L290 L298 I332 L685 L688 V690 L790 K796 L797 T798	V288-L794 HydrophobicContact CG1-CD1 4.46Å; V288-L794 HydrophobicContact CG1-CD2 3.95Å; V288-L794 HydrophobicContact CG2-CB 4.3Å; V288-L794 HydrophobicContact CG2-CD1 4.31Å; V288-L794 HydrophobicContact CG2-CD2 4.3Å; L290-L794 HydrophobicContact CD2-CD2 4.33Å; L298-L794 HydrophobicContact CD1-CD2 4.09Å; I332-L794 HydrophobicContact CD1-CD2 3.59Å; L685-L794 HydrophobicContact CD2-CD1 4.36Å; L688-L794 HydrophobicContact CD1-CB 3.59Å; V690-L794 HydrophobicContact CG1-CD1 4.45Å; V690-L794 HydrophobicContact CG2-CD1 3.81Å; L790-L794 HydrophobicContact CD1-CD1 3.88Å; L790-L794 HydrophobicContact CD1-CD2 4.24Å; L790-L794 HydrophobicContact CD1-CG 3.82Å; L790-L794 HydrophobicContact CG-CD1 4.07Å; L790-L794 HydrophobicContact CG-CG 4.21Å; L790-L794 WeakPolarHBondContact O-CB 3.37Å; L790-L794 VanDerWaalsContact O-CG 3.3Å; L790-L794 WeakPolarHBondContact O-CG 3.49Å; L790-L794 PolarHBondContact O-N 3.19Å; L794-K796 VanDerWaalsContact C-N 3.34Å; L794-K796 PolarHBondContact O-N 3.06Å; L794-L797 HydrophobicContact CD2-CD1 4.24Å; L794-L797 PolarHBondContact O-N 3.05Å; L794-T798 WeakPolarHBondContact O-CG2 3.29Å; L794-T798 PolarHBondContact O-N 2.69Å; L794-T798 PolarHBondContact O-OG1 2.96Å
795	K	95.4	Very high	95.4	Very high	99 Å²	99	38.3 Å²	38.3	43%	0.43	20%	0.202	S	C	.	.	H	α-helix	trans	-62.4	-41.1	176.8	-169.8	155.6	-174.6	156.4	0	111.8	D687 L688 H791 H792 L793 T798 G799	D687-K795 IonicContact OD1-NZ 3.73Å; D687-K795 IonicContact OD2-NZ 2.63Å; D687-K795 PolarHBondContact OD2-NZ 3.02Å; L688-K795 HydrophobicContact CD1-CB 4.29Å; H791-K795 WeakPolarHBondContact O-CB 3.37Å; H791-K795 PolarHBondContact O-N 3.42Å; H792-K795 PolarHBondContact O-N 3.43Å; L793-K795 VanDerWaalsContact C-N 3.33Å; L793-K795 PolarHBondContact O-N 2.67Å; K795-T798 PolarHBondContact O-N 3.17Å; K795-T798 PolarHBondContact O-OG1 2.8Å; K795-G799 PolarHBondContact O-N 3.45Å
796	K	95.4	Very high	95.6	Very high	67 Å²	67	32.6 Å²	32.6	29%	0.291	18%	0.178	S	C	.	.	H	α-helix	trans	-59.4	-48.9	171.1	-85.2	-82.8	-172.7	177.9	0	112.4	E206 T208 H792 L793 L794 T798 G799	E206-K796 VanDerWaalsContact CD-NZ 3.3Å; E206-K796 IonicContact OE1-NZ 2.59Å; E206-K796 PolarHBondContact OE1-NZ 2.88Å; E206-K796 IonicContact OE2-NZ 3.31Å; E206-K796 PolarHBondContact OE2-NZ 3.33Å; T208-K796 HydrophobicContact CG2-CD 4.17Å; T208-K796 HydrophobicContact CG2-CG 3.95Å; H792-K796 WeakPolarHBondContact O-CB 2.87Å; H792-K796 WeakPolarHBondContact O-CG 3.14Å; H792-K796 PolarHBondContact O-N 3.37Å; L793-K796 WeakPolarHBondContact O-CB 3.33Å; L793-K796 PolarHBondContact O-N 3.46Å; L794-K796 VanDerWaalsContact C-N 3.34Å; L794-K796 PolarHBondContact O-N 3.06Å; K796-T798 VanDerWaalsContact C-N 3.33Å; K796-T798 PolarHBondContact O-N 2.83Å; K796-G799 WeakPolarHBondContact O-CA 3.49Å; K796-G799 PolarHBondContact O-N 3.05Å
797	L	96.1	Very high	95.8	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.016	18%	0.178	C	C	.	.	H	α-helix	trans	-62.2	-37.8	178.8	-63.9	171.2	0	0	0	112.5	V314 V330 I332 L793 L794 G799 L800 I807 L818	V314-L797 HydrophobicContact CG2-CD2 4.42Å; V330-L797 HydrophobicContact CG1-CB 4Å; V330-L797 HydrophobicContact CG1-CD1 4.48Å; V330-L797 HydrophobicContact CG2-CB 4.42Å; I332-L797 HydrophobicContact CD1-CD1 3.6Å; I332-L797 HydrophobicContact CG1-CD1 4.43Å; L793-L797 VanDerWaalsContact O-CG 3.3Å; L793-L797 WeakPolarHBondContact O-CG 3.48Å; L793-L797 PolarHBondContact O-N 3.19Å; L794-L797 HydrophobicContact CD2-CD1 4.24Å; L794-L797 PolarHBondContact O-N 3.05Å; L797-G799 PolarHBondContact O-N 2.84Å; L797-G799 VanDerWaalsContact O-N 3.17Å; L797-L800 HydrophobicContact CD2-CD1 3.76Å; L797-L800 WeakPolarHBondContact O-CB 3.35Å; L797-L800 WeakPolarHBondContact O-CG 3.36Å; L797-L800 PolarHBondContact O-N 3.33Å; L797-L800 VanDerWaalsContact O-N 3.09Å; L797-I807 HydrophobicContact CD1-CD1 3.77Å; L797-I807 HydrophobicContact CD2-CD1 3.96Å; L797-I807 HydrophobicContact CD2-CG1 4.17Å; L797-I807 HydrophobicContact CG-CD1 4.41Å; L797-L818 HydrophobicContact CD2-CD2 3.96Å
798	T	95	Very high	95.8	Very high	32 Å²	32	32.5 Å²	32.5	20%	0.196	18%	0.178	C	C	.	.	H	α-helix	trans	-65.5	-14.2	173.8	60	0	0	0	0	113.8	H287 V288 K328 V330 L688 L794 K795 K796	H287-T798 HydrophobicContact CB-CG2 4.12Å; V288-T798 HydrophobicContact CG2-CG2 3.89Å; K328-T798 WeakPolarHBondContact CE-O 3.38Å; K328-T798 PolarHBondContact NZ-O 3.19Å; V330-T798 HydrophobicContact CG2-CG2 4.14Å; L688-T798 HydrophobicContact CD2-CG2 4.25Å; L794-T798 WeakPolarHBondContact O-CG2 3.29Å; L794-T798 PolarHBondContact O-N 2.69Å; L794-T798 PolarHBondContact O-OG1 2.96Å; K795-T798 PolarHBondContact O-N 3.17Å; K795-T798 PolarHBondContact O-OG1 2.8Å; K796-T798 VanDerWaalsContact C-N 3.33Å; K796-T798 PolarHBondContact O-N 2.83Å
799	G	93.8	Very high	95.9	Very high	56 Å²	56	31.8 Å²	31.8	58%	0.577	17%	0.173	S	C	*	.	H	α-helix	trans	-72.2	-32.8	170.3	0	0	0	0	0	113.8	K328 K795 K796 L797	K328-G799 PolarHBondContact NZ-O 3.13Å; K795-G799 PolarHBondContact O-N 3.45Å; K796-G799 WeakPolarHBondContact O-CA 3.49Å; K796-G799 PolarHBondContact O-N 3.05Å; L797-G799 PolarHBondContact O-N 2.84Å; L797-G799 VanDerWaalsContact O-N 3.17Å
800	L	95.4	Very high	95.8	Very high	7 Å²	7	35.3 Å²	35.3	4%	0.037	19%	0.189	C	C	.	.	S	Bend	trans	-62	148	-168.7	-62.4	176.9	0	0	0	114.4	H205 V316 K328 L797 Y805 L818	H205-L800 VanDerWaalsContact CD2-CD2 3.5Å; H205-L800 WeakPolarHBondContact CD2-CD2 3.46Å; H205-L800 WeakPolarHBondContact NE2-CD2 3.47Å; V316-L800 HydrophobicContact CG2-CB 4.18Å; K328-L800 WeakPolarHBondContact CD-O 3.48Å; K328-L800 WeakPolarHBondContact CE-O 3.24Å; K328-L800 PolarHBondContact NZ-O 3.2Å; L797-L800 HydrophobicContact CD2-CD1 3.76Å; L797-L800 WeakPolarHBondContact O-CB 3.35Å; L797-L800 WeakPolarHBondContact O-CG 3.36Å; L797-L800 PolarHBondContact O-N 3.33Å; L797-L800 VanDerWaalsContact O-N 3.09Å; L800-Y805 HydrophobicContact CB-CE1 4.4Å; L800-Y805 HydrophobicContact CB-CE2 4.22Å; L800-Y805 HydrophobicContact CD1-CD1 4.03Å; L800-Y805 HydrophobicContact CD1-CD2 4.21Å; L800-Y805 HydrophobicContact CD1-CE1 4.07Å; L800-Y805 HydrophobicContact CD1-CE2 4.27Å; L800-Y805 HydrophobicContact CD1-CG 4.09Å; L800-Y805 HydrophobicContact CD2-CE1 4.07Å; L800-Y805 HydrophobicContact CG-CE1 4.43Å; L800-L818 HydrophobicContact CD2-CD1 4.42Å
801	D	94.5	Very high	95.5	Very high	111 Å²	111	39.4 Å²	39.4	59%	0.594	21%	0.214	S	C	*	.	P	Polyproline II helix	trans	-67.9	167	169.9	-68.2	-46.5	0	0	0	112.2	Y805	D801-Y805 PolarHBondContact N-OH 3.15Å; D801-Y805 VanDerWaalsContact O-CE2 3.24Å; D801-Y805 WeakPolarHBondContact O-CE2 3.33Å; D801-Y805 PolarHBondContact O-OH 2.88Å
802	E	94.9	Very high	95.2	Very high	100 Å²	100	40.7 Å²	40.7	47%	0.467	23%	0.233	S	C	.	.	S	Bend	trans	-52.7	145.2	169.5	-174.9	150.6	-128.8	0	0	112.8	I318 K820	I318-E802 WeakPolarHBondContact CB-OE1 3.46Å; I318-E802 HydrophobicContact CD1-CB 3.84Å; I318-E802 HydrophobicContact CG1-CB 4.04Å; I318-E802 HydrophobicContact CG1-CG 4.44Å; I318-E802 PolarHBondContact N-OE1 3.37Å; E802-K820 PolarHBondContact O-NZ 2.9Å
803	G	94.8	Very high	95.1	Very high	22 Å²	22	41.3 Å²	41.3	23%	0.227	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	132.9	-174.9	178.3	0	0	0	0	0	114.3	V316 Y805	V316-G803 PolarHBondContact N-O 3.36Å; V316-G803 PolarHBondContact O-N 2.92Å; V316-G803 VanDerWaalsContact O-N 3.13Å; G803-Y805 WeakPolarHBondContact O-CD2 3.23Å
804	Q	96.1	Very high	95	Very high	90 Å²	90	43 Å²	43	42%	0.421	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	139.8	179	-69.5	174.1	13.5	0	0	110.8	P199 L315 A821	P199-Q804 VanDerWaalsContact CD-OE1 3.25Å; P199-Q804 HydrophobicContact CG-CB 4.41Å; L315-Q804 HydrophobicContact CD1-CG 3.46Å; L315-Q804 VanDerWaalsContact CD1-CG 3.46Å; Q804-A821 HydrophobicContact CB-CB 4.01Å; Q804-A821 WeakPolarHBondContact O-CB 3.44Å; Q804-A821 PolarHBondContact O-N 3.45Å
805	Y	97.1	Very high	94.9	Very high	3 Å²	3	46.5 Å²	46.5	1%	0.012	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	163.7	-175.6	-58.4	-100.1	0	0	0	110.5	V314 V316 L800 D801 G803 L819 K820	V314-Y805 PolarHBondContact N-O 2.75Å; V314-Y805 PolarHBondContact O-N 3.25Å; V316-Y805 HydrophobicContact CB-CE2 4.23Å; V316-Y805 HydrophobicContact CG2-CD2 3.96Å; V316-Y805 HydrophobicContact CG2-CE2 3.74Å; L800-Y805 HydrophobicContact CB-CE1 4.4Å; L800-Y805 HydrophobicContact CB-CE2 4.22Å; L800-Y805 HydrophobicContact CD1-CD1 4.03Å; L800-Y805 HydrophobicContact CD1-CD2 4.21Å; L800-Y805 HydrophobicContact CD1-CE1 4.07Å; L800-Y805 HydrophobicContact CD1-CE2 4.27Å; L800-Y805 HydrophobicContact CD1-CG 4.09Å; L800-Y805 HydrophobicContact CD2-CE1 4.07Å; L800-Y805 HydrophobicContact CG-CE1 4.43Å; D801-Y805 PolarHBondContact N-OH 3.15Å; D801-Y805 VanDerWaalsContact O-CE2 3.24Å; D801-Y805 WeakPolarHBondContact O-CE2 3.33Å; D801-Y805 PolarHBondContact O-OH 2.88Å; G803-Y805 WeakPolarHBondContact O-CD2 3.23Å; Y805-L819 CarbonylContact C-O 3.57Å; Y805-L819 WeakPolarHBondContact CA-O 3.41Å; Y805-L819 VanDerWaalsContact CB-O 3.28Å; Y805-L819 WeakPolarHBondContact CB-O 3.45Å; Y805-K820 HydrophobicContact CD1-CB 3.7Å; Y805-K820 HydrophobicContact CD1-CD 4.34Å; Y805-K820 HydrophobicContact CD1-CG 3.86Å; Y805-K820 HydrophobicContact CE1-CB 3.71Å; Y805-K820 HydrophobicContact CE1-CD 3.54Å; Y805-K820 HydrophobicContact CE1-CG 3.57Å; Y805-K820 WeakPolarHBondContact OH-CE 3.37Å; Y805-K820 PolarHBondContact OH-NZ 3Å
806	L	97.3	Very high	94.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	125.5	171.7	-170.9	72.9	0	0	0	108.2	Y202 E311 P313 L336 V808 L819 Y831 L833	Y202-L806 HydrophobicContact CD1-CB 3.94Å; Y202-L806 HydrophobicContact CE1-CB 3.72Å; Y202-L806 HydrophobicContact CG-CB 4.49Å; E311-L806 HydrophobicContact CB-CD1 4.32Å; P313-L806 HydrophobicContact CB-CD1 4.47Å; P313-L806 HydrophobicContact CG-CD1 4.31Å; L336-L806 HydrophobicContact CD1-CD1 4.07Å; L806-V808 HydrophobicContact CD2-CG2 3.66Å; L806-V808 HydrophobicContact CG-CG2 3.86Å; L806-L819 HydrophobicContact CB-CB 4.38Å; L806-L819 HydrophobicContact CD2-CD1 4.32Å; L806-L819 PolarHBondContact N-O 3.45Å; L806-L819 PolarHBondContact O-N 3.36Å; L806-Y831 HydrophobicContact CD2-CD1 4.28Å; L806-Y831 HydrophobicContact CD2-CE1 3.96Å; L806-L833 HydrophobicContact CD2-CD1 3.81Å
807	I	97.4	Very high	95	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.4	167.9	-43.5	173.4	0	0	0	106.7	W310 E311 L312 V314 L797 V816 L818	W310-I807 HydrophobicContact CH2-CG2 3.82Å; W310-I807 HydrophobicContact CZ3-CB 3.94Å; W310-I807 HydrophobicContact CZ3-CG2 3.51Å; E311-I807 CarbonylContact C-O 3.56Å; E311-I807 VanDerWaalsContact CA-O 3.26Å; E311-I807 WeakPolarHBondContact CA-O 3.14Å; L312-I807 HydrophobicContact CB-CB 4.27Å; L312-I807 HydrophobicContact CB-CD1 4.25Å; L312-I807 HydrophobicContact CB-CG1 4.45Å; L312-I807 PolarHBondContact N-O 3.44Å; L312-I807 PolarHBondContact O-N 3.49Å; V314-I807 HydrophobicContact CG2-CD1 3.83Å; V314-I807 HydrophobicContact CG2-CG1 3.82Å; L797-I807 HydrophobicContact CD1-CD1 3.77Å; L797-I807 HydrophobicContact CD2-CD1 3.96Å; L797-I807 HydrophobicContact CD2-CG1 4.17Å; L797-I807 HydrophobicContact CG-CD1 4.41Å; I807-V816 HydrophobicContact CG2-CB 3.83Å; I807-V816 HydrophobicContact CG2-CG1 4.24Å; I807-V816 HydrophobicContact CG2-CG2 3.91Å; I807-L818 HydrophobicContact CB-CD2 4.25Å; I807-L818 HydrophobicContact CG1-CD2 3.84Å; I807-L818 HydrophobicContact CG2-CD2 4.01Å
808	V	96.7	Very high	95	Very high	7 Å²	7	39.4 Å²	39.4	4%	0.042	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	124.5	177.2	179.7	0	0	0	0	109.7	E311 L806 V816 T817 L819	E311-V808 HydrophobicContact CG-CG1 4.21Å; E311-V808 HydrophobicContact CG-CG2 4.11Å; L806-V808 HydrophobicContact CD2-CG2 3.66Å; L806-V808 HydrophobicContact CG-CG2 3.86Å; V808-V816 CarbonylContact O-C 3.55Å; V808-V816 WeakPolarHBondContact O-CA 3.2Å; V808-T817 PolarHBondContact N-O 2.98Å; V808-T817 PolarHBondContact O-N 2.79Å; V808-L819 HydrophobicContact CG2-CD1 3.62Å; V808-L819 HydrophobicContact CG2-CG 4.22Å
809	H	95.9	Very high	95.1	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.6	172.5	177.5	-96.5	0	0	0	109.7	D308 Q309 W310 E813 F815 V816	D308-H809 PolarHBondContact O-CE1 3.48Å; D308-H809 VanDerWaalsContact O-CE1 3.29Å; D308-H809 PolarHBondContact O-ND1 3.4Å; Q309-H809 WeakPolarHBondContact CG-O 3.41Å; W310-H809 AromaticContact CD1-CG 3.86Å; W310-H809 AromaticContact CD1-ND1 3.45Å; W310-H809 HydrophobicContact CD2-CB 3.52Å; W310-H809 VanDerWaalsContact CE2-CB 3.41Å; W310-H809 AromaticContact CE2-CG 3.76Å; W310-H809 HydrophobicContact CE3-CB 4.03Å; W310-H809 HydrophobicContact CG-CB 3.85Å; W310-H809 HydrophobicContact CH2-CB 4.34Å; W310-H809 HydrophobicContact CZ2-CB 3.87Å; W310-H809 HydrophobicContact CZ3-CB 4.39Å; W310-H809 PolarHBondContact N-O 3.3Å; W310-H809 AromaticContact NE1-CG 3.48Å; W310-H809 AromaticContact NE1-ND1 3.39Å; W310-H809 PolarHBondContact NE1-ND1 2.77Å; W310-H809 PolarHBondContact O-N 3.3Å; H809-E813 PolarHBondContact CD2-O 3.33Å; H809-E813 PolarHBondContact NE2-O 3.17Å; H809-F815 PolarHBondContact CD2-O 2.98Å; H809-V816 HydrophobicContact CB-CG1 4.01Å
810	K	93.4	Very high	95.2	Very high	84 Å²	84	38.2 Å²	38.2	37%	0.365	21%	0.213	S	C	.	.			trans	-119	143.4	176	-46.8	-171.3	-148.3	76.9	0	110.5	G812 E813	K810-G812 PolarHBondContact O-N 2.98Å; K810-E813 HydrophobicContact CB-CG 4.11Å; K810-E813 WeakPolarHBondContact CB-OE2 3.41Å; K810-E813 WeakPolarHBondContact CG-OE2 3.49Å; K810-E813 IonicContact NZ-OE1 3.83Å; K810-E813 PolarHBondContact NZ-OE1 3.17Å; K810-E813 IonicContact NZ-OE2 3.66Å; K810-E813 PolarHBondContact NZ-OE2 3.35Å; K810-E813 WeakPolarHBondContact O-CB 3.43Å; K810-E813 PolarHBondContact O-N 3.19Å
811	T	91.1	Very high	95.1	Very high	88 Å²	88	39.1 Å²	39.1	54%	0.54	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-40.8	124	167.6	-64.5	0	0	0	0	111.8	F306 G307 Q309 E813	F306-T811 WeakPolarHBondContact O-CA 3.36Å; G307-T811 WeakPolarHBondContact O-CB 3.25Å; G307-T811 WeakPolarHBondContact O-CG2 3.47Å; G307-T811 PolarHBondContact O-OG1 3.2Å; Q309-T811 PolarHBondContact N-OG1 3.11Å; T811-E813 PolarHBondContact O-N 3.23Å
812	G	90.9	Very high	94.3	Very high	50 Å²	50	35.4 Å²	35.4	52%	0.515	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	-11.7	179.6	0	0	0	0	0	116	D305 F306 K810	D305-G812 WeakPolarHBondContact O-CA 3.43Å; F306-G812 PolarHBondContact O-N 3.11Å; K810-G812 PolarHBondContact O-N 2.98Å
813	E	93.1	Very high	92.9	Very high	42 Å²	42	33.6 Å²	33.6	20%	0.196	22%	0.217	C	C	.	.			trans	-87.7	125.1	-179.2	-66.5	-175.7	162.6	0	0	111.8	H809 K810 T811 F815	H809-E813 PolarHBondContact CD2-O 3.33Å; H809-E813 PolarHBondContact NE2-O 3.17Å; K810-E813 HydrophobicContact CB-CG 4.11Å; K810-E813 WeakPolarHBondContact CB-OE2 3.41Å; K810-E813 WeakPolarHBondContact CG-OE2 3.49Å; K810-E813 IonicContact NZ-OE1 3.83Å; K810-E813 PolarHBondContact NZ-OE1 3.17Å; K810-E813 IonicContact NZ-OE2 3.66Å; K810-E813 PolarHBondContact NZ-OE2 3.35Å; K810-E813 WeakPolarHBondContact O-CB 3.43Å; K810-E813 PolarHBondContact O-N 3.19Å; T811-E813 PolarHBondContact O-N 3.23Å; E813-F815 HydrophobicContact CB-CD1 4.18Å; E813-F815 HydrophobicContact CB-CD2 4.3Å; E813-F815 HydrophobicContact CB-CE1 3.96Å; E813-F815 HydrophobicContact CB-CE2 4.09Å; E813-F815 HydrophobicContact CB-CG 4.35Å; E813-F815 HydrophobicContact CB-CZ 3.91Å; E813-F815 HydrophobicContact CG-CE1 4.02Å; E813-F815 HydrophobicContact CG-CE2 4.05Å; E813-F815 HydrophobicContact CG-CZ 3.64Å; E813-F815 PolarHBondContact O-N 3.19Å; E813-F815 WeakPolarHBondContact OE1-CZ 3.25Å; E813-F815 VanDerWaalsContact OE2-CE2 3.24Å; E813-F815 WeakPolarHBondContact OE2-CE2 3.25Å
814	A	93.2	Very high	91	Very high	39 Å²	39	42 Å²	42	32%	0.322	25%	0.251	S	S	.	.	S	Bend	trans	-78	21.5	173	0	0	0	0	0	113.4	S209 L210 F306	S209-A814 WeakPolarHBondContact CA-O 3.4Å; S209-A814 PolarHBondContact OG-O 3.08Å; S209-A814 VanDerWaalsContact OG-O 3.05Å; L210-A814 PolarHBondContact N-O 3.49Å; F306-A814 HydrophobicContact CD2-CB 4.03Å; F306-A814 HydrophobicContact CE2-CB 3.61Å; F306-A814 HydrophobicContact CZ-CB 4.29Å
815	F	94.6	Very high	89.2	Confident	75 Å²	75	46.8 Å²	46.8	33%	0.329	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	157	-174.2	59.3	-97.5	0	0	0	111.6	V207 T208 H809 E813	V207-F815 HydrophobicContact CG1-CB 4.2Å; V207-F815 HydrophobicContact CG1-CD2 3.56Å; V207-F815 HydrophobicContact CG1-CE2 4.21Å; V207-F815 HydrophobicContact CG1-CG 4.06Å; T208-F815 CarbonylContact O-C 3.51Å; T208-F815 VanDerWaalsContact O-CA 3.29Å; T208-F815 WeakPolarHBondContact O-CA 3.35Å; T208-F815 WeakPolarHBondContact O-CB 3.25Å; H809-F815 PolarHBondContact CD2-O 2.98Å; E813-F815 HydrophobicContact CB-CD1 4.18Å; E813-F815 HydrophobicContact CB-CD2 4.3Å; E813-F815 HydrophobicContact CB-CE1 3.96Å; E813-F815 HydrophobicContact CB-CE2 4.09Å; E813-F815 HydrophobicContact CB-CG 4.35Å; E813-F815 HydrophobicContact CB-CZ 3.91Å; E813-F815 HydrophobicContact CG-CE1 4.02Å; E813-F815 HydrophobicContact CG-CE2 4.05Å; E813-F815 HydrophobicContact CG-CZ 3.64Å; E813-F815 PolarHBondContact O-N 3.19Å; E813-F815 WeakPolarHBondContact OE1-CZ 3.25Å; E813-F815 VanDerWaalsContact OE2-CE2 3.24Å; E813-F815 WeakPolarHBondContact OE2-CE2 3.25Å
816	V	96.6	Very high	87.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	147.8	173.8	-55.9	0	0	0	0	110	V207 T208 L210 W310 L793 I807 V808 H809	V207-V816 WeakPolarHBondContact CA-O 3.22Å; T208-V816 PolarHBondContact N-O 3Å; T208-V816 PolarHBondContact O-N 2.76Å; L210-V816 HydrophobicContact CD2-CG1 3.52Å; L210-V816 HydrophobicContact CG-CG1 4.07Å; W310-V816 HydrophobicContact CH2-CG1 3.89Å; W310-V816 HydrophobicContact CZ2-CG1 4.02Å; L793-V816 HydrophobicContact CD2-CG2 3.79Å; I807-V816 HydrophobicContact CG2-CB 3.83Å; I807-V816 HydrophobicContact CG2-CG1 4.24Å; I807-V816 HydrophobicContact CG2-CG2 3.91Å; V808-V816 CarbonylContact O-C 3.55Å; V808-V816 WeakPolarHBondContact O-CA 3.2Å; H809-V816 HydrophobicContact CB-CG1 4.01Å
817	T	96.6	Very high	85.7	Confident	16 Å²	16	52.5 Å²	52.5	10%	0.098	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	121.1	170.7	-49.8	0	0	0	0	108.6	I204 V207 V808 L819	I204-T817 HydrophobicContact CG1-CG2 4.18Å; I204-T817 HydrophobicContact CG2-CG2 3.96Å; V207-T817 HydrophobicContact CG2-CG2 4.19Å; V808-T817 PolarHBondContact N-O 2.98Å; V808-T817 PolarHBondContact O-N 2.79Å; T817-L819 HydrophobicContact CG2-CD2 3.51Å; T817-L819 HydrophobicContact CG2-CG 4.33Å
818	L	97	Very high	84.3	Confident	3 Å²	3	65 Å²	65	2%	0.016	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	117.5	169	-61.7	179.2	0	0	0	108.3	H205 E206 L797 L800 I807	H205-L818 WeakPolarHBondContact CB-O 3.3Å; H205-L818 PolarHBondContact N-O 2.94Å; E206-L818 HydrophobicContact CB-CB 4.43Å; E206-L818 HydrophobicContact CB-CD1 4.4Å; E206-L818 PolarHBondContact N-O 3.43Å; E206-L818 PolarHBondContact O-N 3.34Å; L797-L818 HydrophobicContact CD2-CD2 3.96Å; L800-L818 HydrophobicContact CD2-CD1 4.42Å; I807-L818 HydrophobicContact CB-CD2 4.25Å; I807-L818 HydrophobicContact CG1-CD2 3.84Å; I807-L818 HydrophobicContact CG2-CD2 4.01Å
819	L	96.1	Very high	83.1	Confident	6 Å²	6	68.4 Å²	68.4	3%	0.031	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	139	175.8	-48.5	177.4	0	0	0	109.6	Y202 Q203 I204 Y805 L806 V808 T817 Y831	Y202-L819 HydrophobicContact CD1-CB 4.25Å; Y202-L819 HydrophobicContact CG-CB 4.28Å; Q203-L819 CarbonylContact O-C 3.57Å; Q203-L819 VanDerWaalsContact O-CA 3.26Å; Q203-L819 WeakPolarHBondContact O-CA 3.41Å; I204-L819 HydrophobicContact CB-CD2 4.24Å; I204-L819 HydrophobicContact CG1-CD2 3.66Å; Y805-L819 CarbonylContact C-O 3.57Å; Y805-L819 WeakPolarHBondContact CA-O 3.41Å; Y805-L819 VanDerWaalsContact CB-O 3.28Å; Y805-L819 WeakPolarHBondContact CB-O 3.45Å; L806-L819 HydrophobicContact CB-CB 4.38Å; L806-L819 HydrophobicContact CD2-CD1 4.32Å; L806-L819 PolarHBondContact N-O 3.45Å; L806-L819 PolarHBondContact O-N 3.36Å; V808-L819 HydrophobicContact CG2-CD1 3.62Å; V808-L819 HydrophobicContact CG2-CG 4.22Å; T817-L819 HydrophobicContact CG2-CD2 3.51Å; T817-L819 HydrophobicContact CG2-CG 4.33Å; L819-Y831 HydrophobicContact CD1-CD1 3.61Å; L819-Y831 HydrophobicContact CD1-CD2 4.17Å; L819-Y831 HydrophobicContact CD1-CE1 4.24Å; L819-Y831 HydrophobicContact CD1-CG 3.59Å
820	K	95.4	Very high	82.6	Confident	57 Å²	57	69.5 Å²	69.5	25%	0.248	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.4	173.1	-171.9	168.1	-171.2	151.9	0	110.2	Y202 Q203 H205 E802 Y805 G822	Y202-K820 CarbonylContact C-O 3.51Å; Y202-K820 VanDerWaalsContact CA-O 3.3Å; Y202-K820 WeakPolarHBondContact CA-O 3.5Å; Q203-K820 PolarHBondContact N-O 2.97Å; Q203-K820 PolarHBondContact O-N 2.91Å; H205-K820 HydrophobicContact CB-CB 4.09Å; E802-K820 PolarHBondContact O-NZ 2.9Å; Y805-K820 HydrophobicContact CD1-CB 3.7Å; Y805-K820 HydrophobicContact CD1-CD 4.34Å; Y805-K820 HydrophobicContact CD1-CG 3.86Å; Y805-K820 HydrophobicContact CE1-CB 3.71Å; Y805-K820 HydrophobicContact CE1-CD 3.54Å; Y805-K820 HydrophobicContact CE1-CG 3.57Å; Y805-K820 WeakPolarHBondContact OH-CE 3.37Å; Y805-K820 PolarHBondContact OH-NZ 3Å; K820-G822 PolarHBondContact O-N 3.13Å
821	A	94.1	Very high	82.5	Confident	27 Å²	27	67.8 Å²	67.8	22%	0.223	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	131.9	176.1	0	0	0	0	0	110.5	P199 Y202 Q804	P199-A821 HydrophobicContact CB-CB 3.86Å; P199-A821 HydrophobicContact CG-CB 3.85Å; Y202-A821 HydrophobicContact CD1-CB 4.03Å; Y202-A821 HydrophobicContact CE1-CB 3.98Å; Q804-A821 HydrophobicContact CB-CB 4.01Å; Q804-A821 WeakPolarHBondContact O-CB 3.44Å; Q804-A821 PolarHBondContact O-N 3.45Å
822	G	77.6	Confident	82.6	Confident	33 Å²	33	64.8 Å²	64.8	34%	0.34	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-90.6	154.9	-179.9	0	0	0	0	0	113.1	F201 K820	F201-G822 PolarHBondContact O-N 2.88Å; K820-G822 PolarHBondContact O-N 3.13Å
823	G	65.1	Low	82.6	Confident	61 Å²	61	62.4 Å²	62.4	63%	0.629	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-74.2	173.1	158	0	0	0	0	0	111.4	K825	G823-K825 PolarHBondContact O-N 3.35Å
824	E	55	Low	82.5	Confident	198 Å²	198	62.6 Å²	62.6	93%	0.925	35%	0.349	S	S	*	.	S	Bend	trans	-51.8	-15.9	-169.5	-58.6	176.5	133.4	0	0	116.8	V826	E824-V826 VanDerWaalsContact C-N 3.28Å; E824-V826 PolarHBondContact O-N 3.36Å
825	K	59.9	Low	82.4	Confident	191 Å²	191	67.4 Å²	67.4	83%	0.83	37%	0.365	S	S	*	.			trans	-77.3	77.5	175.1	-65.5	-176.1	-179.3	178.9	0	110.7	G823 S827	G823-K825 PolarHBondContact O-N 3.35Å; K825-S827 PolarHBondContact O-N 2.98Å; K825-S827 VanDerWaalsContact O-N 3.07Å
826	V	58.5	Low	82.1	Confident	74 Å²	74	66.1 Å²	66.1	45%	0.448	36%	0.361	S	S	.	.			trans	-61.4	107.1	175.9	-175.8	0	0	0	0	110.3	F201 E824 A830	F201-V826 HydrophobicContact CB-CG2 4.47Å; F201-V826 HydrophobicContact CD1-CG1 4.09Å; F201-V826 HydrophobicContact CD1-CG2 4.34Å; F201-V826 HydrophobicContact CD2-CG2 3.64Å; F201-V826 HydrophobicContact CE1-CG1 4.32Å; F201-V826 HydrophobicContact CE2-CG2 3.89Å; F201-V826 HydrophobicContact CG-CG1 4.34Å; F201-V826 HydrophobicContact CG-CG2 3.89Å; F201-V826 HydrophobicContact CZ-CG2 4.34Å; E824-V826 VanDerWaalsContact C-N 3.28Å; E824-V826 PolarHBondContact O-N 3.36Å; V826-A830 HydrophobicContact CG1-CB 4.03Å
827	S	62.5	Low	81.9	Confident	49 Å²	49	66.7 Å²	66.7	34%	0.343	36%	0.364	S	S	.	.			trans	-70.3	138.1	170	54.5	0	0	0	0	110.8	Q203 K825 G829 A830	Q203-S827 PolarHBondContact NE2-OG 3.07Å; K825-S827 PolarHBondContact O-N 2.98Å; K825-S827 VanDerWaalsContact O-N 3.07Å; S827-G829 PolarHBondContact O-N 2.96Å; S827-A830 PolarHBondContact O-N 3.25Å
828	R	66.8	Low	81.4	Confident	263 Å²	263	68.8 Å²	68.8	99%	0.992	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	111.2	174.2	-171.5	179.3	-173.8	-178.2	2.2	109.7
829	G	72.6	Confident	81	Confident	80 Å²	80	72.9 Å²	72.9	83%	0.825	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.9	8.9	-174	0	0	0	0	0	116	S827	S827-G829 PolarHBondContact O-N 2.96Å
830	A	84.6	Confident	80.7	Confident	23 Å²	23	74.3 Å²	74.3	19%	0.19	43%	0.426	C	S	.	.			trans	-63.2	145.3	170.9	0	0	0	0	0	112.7	F201 Y202 Q203 V826 S827 N832	F201-A830 HydrophobicContact CB-CB 4.38Å; F201-A830 HydrophobicContact CD1-CB 4.41Å; Y202-A830 CarbonylContact O-C 3.5Å; Y202-A830 WeakPolarHBondContact O-CA 3.36Å; Q203-A830 HydrophobicContact CG-CB 4.46Å; V826-A830 HydrophobicContact CG1-CB 4.03Å; S827-A830 PolarHBondContact O-N 3.25Å; A830-N832 PolarHBondContact O-N 2.75Å
831	Y	91.6	Very high	80.5	Confident	49 Å²	49	71.8 Å²	71.8	19%	0.192	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	114.2	173.8	-166.8	-101.9	0	0	0	109.9	F201 Y202 E311 L806 L819 L833 N836	F201-Y831 WeakPolarHBondContact CA-O 3.45Å; Y202-Y831 PolarHBondContact N-O 2.93Å; Y202-Y831 PolarHBondContact O-N 3.15Å; E311-Y831 PolarHBondContact OE1-OH 3.34Å; L806-Y831 HydrophobicContact CD2-CD1 4.28Å; L806-Y831 HydrophobicContact CD2-CE1 3.96Å; L819-Y831 HydrophobicContact CD1-CD1 3.61Å; L819-Y831 HydrophobicContact CD1-CD2 4.17Å; L819-Y831 HydrophobicContact CD1-CE1 4.24Å; L819-Y831 HydrophobicContact CD1-CG 3.59Å; Y831-L833 HydrophobicContact CE1-CD1 4.14Å; Y831-N836 WeakPolarHBondContact CE2-ND2 3.24Å; Y831-N836 PolarHBondContact OH-ND2 2.94Å
832	N	92.3	Very high	80.2	Confident	25 Å²	25	76 Å²	76	13%	0.134	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	100.4	178.6	-174.3	-6	0	0	0	109.6	Q200 F201 A830 Q835 N836	Q200-N832 VanDerWaalsContact CG-OD1 3.31Å; Q200-N832 WeakPolarHBondContact CG-OD1 3.38Å; Q200-N832 PolarHBondContact NE2-OD1 2.8Å; Q200-N832 WeakPolarHBondContact O-CA 3.3Å; F201-N832 HydrophobicContact CD1-CB 4.19Å; F201-N832 HydrophobicContact CE1-CB 4.01Å; A830-N832 PolarHBondContact O-N 2.75Å; N832-Q835 HydrophobicContact CB-CB 3.92Å; N832-Q835 VanDerWaalsContact CG-CB 3.4Å; N832-Q835 VanDerWaalsContact ND2-CB 3.31Å; N832-Q835 WeakPolarHBondContact ND2-CB 3.41Å; N832-Q835 PolarHBondContact ND2-OE1 2.81Å; N832-Q835 PolarHBondContact O-N 3.33Å; N832-Q835 PolarHBondContact OD1-N 2.98Å; N832-N836 PolarHBondContact O-N 2.8Å; N832-N836 VanDerWaalsContact O-N 3.16Å
833	L	92.2	Very high	80.5	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	43%	0.433	C	S	.	.	H	α-helix	trans	-64.3	-49.9	-172.8	-179.3	68.8	0	0	0	111.1	V195 L198 Q200 Y202 E311 L336 L806 Y831 Q835 N836 H837	V195-L833 HydrophobicContact CG1-CD2 3.84Å; V195-L833 HydrophobicContact CG1-CG 3.81Å; L198-L833 HydrophobicContact CB-CD2 3.84Å; L198-L833 HydrophobicContact CD1-CD2 3.95Å; Q200-L833 PolarHBondContact O-N 3.2Å; Y202-L833 HydrophobicContact CD2-CB 4.4Å; Y202-L833 HydrophobicContact CE2-CB 4.08Å; Y202-L833 HydrophobicContact CE2-CD2 3.93Å; E311-L833 WeakPolarHBondContact OE2-CD1 3.29Å; L336-L833 HydrophobicContact CD1-CD1 3.82Å; L336-L833 HydrophobicContact CD1-CD2 4.33Å; L806-L833 HydrophobicContact CD2-CD1 3.81Å; Y831-L833 HydrophobicContact CE1-CD1 4.14Å; L833-Q835 PolarHBondContact O-N 3.2Å; L833-N836 PolarHBondContact O-N 3.15Å; L833-N836 VanDerWaalsContact O-N 3.07Å; L833-H837 VanDerWaalsContact CD1-CD2 3.45Å; L833-H837 WeakPolarHBondContact CD1-CD2 3.38Å; L833-H837 PolarHBondContact O-CD2 3.22Å; L833-H837 PolarHBondContact O-N 3.03Å
834	Q	90.5	Very high	81.4	Confident	46 Å²	46	76.4 Å²	76.4	22%	0.215	42%	0.417	C	S	.	.	H	α-helix	trans	-63.2	-26.8	-179.3	-81.8	75.8	-21	0	0	112.8	L198 Q200 H837 G838	L198-Q834 PolarHBondContact O-NE2 2.87Å; Q200-Q834 HydrophobicContact CG-CB 4.44Å; Q834-H837 CarbonylContact O-C 3.55Å; Q834-G838 VanDerWaalsContact O-CA 3.27Å; Q834-G838 WeakPolarHBondContact O-CA 3.41Å; Q834-G838 PolarHBondContact O-N 2.78Å; Q834-G838 VanDerWaalsContact O-N 3.16Å
835	Q	90.3	Very high	82.2	Confident	140 Å²	140	76.5 Å²	76.5	65%	0.654	41%	0.414	S	S	*	.	H	α-helix	trans	-76.8	-39.1	173	179.1	176.7	1.2	0	0	111.9	N832 L833 H837 G838	N832-Q835 HydrophobicContact CB-CB 3.92Å; N832-Q835 VanDerWaalsContact CG-CB 3.4Å; N832-Q835 VanDerWaalsContact ND2-CB 3.31Å; N832-Q835 WeakPolarHBondContact ND2-CB 3.41Å; N832-Q835 PolarHBondContact ND2-OE1 2.81Å; N832-Q835 PolarHBondContact O-N 3.33Å; N832-Q835 PolarHBondContact OD1-N 2.98Å; L833-Q835 PolarHBondContact O-N 3.2Å; Q835-H837 VanDerWaalsContact C-N 3.29Å; Q835-H837 PolarHBondContact O-N 3.09Å; Q835-G838 PolarHBondContact O-N 3.37Å
836	N	89.5	Confident	82.6	Confident	47 Å²	47	73.9 Å²	73.9	25%	0.251	41%	0.408	S	S	.	.	H	α-helix	trans	-74.1	-21.1	178.5	-74.6	0	0	0	0	113.4	R339 Y831 N832 L833	R339-N836 PolarHBondContact NE-O 2.94Å; R339-N836 PolarHBondContact NH1-ND2 3.22Å; Y831-N836 WeakPolarHBondContact CE2-ND2 3.24Å; Y831-N836 PolarHBondContact OH-ND2 2.94Å; N832-N836 PolarHBondContact O-N 2.8Å; N832-N836 VanDerWaalsContact O-N 3.16Å; L833-N836 PolarHBondContact O-N 3.15Å; L833-N836 VanDerWaalsContact O-N 3.07Å
837	H	91.3	Very high	82.8	Confident	13 Å²	13	74.3 Å²	74.3	6%	0.06	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	31	172.2	-67.3	-91.2	0	0	0	111.5	L192 V195 E311 L337 L833 Q834 Q835 S839	L192-H837 HydrophobicContact CD2-CB 3.95Å; V195-H837 HydrophobicContact CG1-CB 4.06Å; E311-H837 IonicContact OE1-NE2 3.22Å; E311-H837 IonicContact OE2-CD2 3.61Å; E311-H837 IonicContact OE2-CE1 2.62Å; E311-H837 IonicContact OE2-NE2 2.73Å; E311-H837 PolarHBondContact OE2-NE2 2.79Å; L337-H837 PolarHBondContact O-CE1 3.18Å; L833-H837 VanDerWaalsContact CD1-CD2 3.45Å; L833-H837 WeakPolarHBondContact CD1-CD2 3.38Å; L833-H837 PolarHBondContact O-CD2 3.22Å; L833-H837 PolarHBondContact O-N 3.03Å; Q834-H837 CarbonylContact O-C 3.55Å; Q835-H837 VanDerWaalsContact C-N 3.29Å; Q835-H837 PolarHBondContact O-N 3.09Å; H837-S839 VanDerWaalsContact C-N 3.33Å; H837-S839 PolarHBondContact O-N 2.71Å
838	G	85.9	Confident	83.7	Confident	59 Å²	59	78.3 Å²	78.3	61%	0.608	44%	0.444	S	S	*	.	S	Bend	trans	-79.8	-7.1	-175.6	0	0	0	0	0	115.6	Q834 Q835	Q834-G838 VanDerWaalsContact O-CA 3.27Å; Q834-G838 WeakPolarHBondContact O-CA 3.41Å; Q834-G838 PolarHBondContact O-N 2.78Å; Q834-G838 VanDerWaalsContact O-N 3.16Å; Q835-G838 PolarHBondContact O-N 3.37Å
839	S	88.8	Confident	84.6	Confident	90 Å²	90	67.5 Å²	67.5	63%	0.629	41%	0.407	S	S	*	.	S	Bend	trans	-147.5	156.7	-175.9	57.9	0	0	0	0	112.2	L192 H837	L192-S839 VanDerWaalsContact CD1-C 3.47Å; L192-S839 WeakPolarHBondContact CD1-O 3.4Å; H837-S839 VanDerWaalsContact C-N 3.33Å; H837-S839 PolarHBondContact O-N 2.71Å
840	V	90.4	Very high	85.3	Confident	35 Å²	35	66 Å²	66	21%	0.212	38%	0.383	C	S	.	.			trans	-59.4	132.9	176.8	176.2	0	0	0	0	110.2	F188 L192 Q842	F188-V840 HydrophobicContact CB-CG1 4Å; F188-V840 HydrophobicContact CD2-CG1 3.89Å; F188-V840 HydrophobicContact CG-CG1 4.45Å; L192-V840 HydrophobicContact CD1-CG2 4.45Å; V840-Q842 PolarHBondContact O-NE2 2.82Å
841	P	90.9	Very high	85.7	Confident	5 Å²	5	67.1 Å²	67.1	3%	0.032	38%	0.382	C	S	.	.			trans	-55.9	140	-179	-27.5	35.2	0	0	0	113.7	L337 K338 V341 R346	L337-P841 HydrophobicContact CD1-CG 4.37Å; L337-P841 HydrophobicContact CD2-CG 3.56Å; L337-P841 HydrophobicContact CG-CG 3.73Å; K338-P841 WeakPolarHBondContact O-CB 3.26Å; K338-P841 WeakPolarHBondContact O-CG 3.22Å; V341-P841 HydrophobicContact CB-CB 4.09Å; V341-P841 HydrophobicContact CG2-CB 3.62Å; V341-P841 HydrophobicContact CG2-CG 4.16Å; R346-P841 PolarHBondContact NH1-O 2.9Å
842	Q	87.7	Confident	85.9	Confident	115 Å²	115	66 Å²	66	54%	0.537	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-104.9	158.3	179.5	-61	-55.4	-51.5	0	0	110.3	E340 V341 V840	E340-Q842 CarbonylContact C-O 3.59Å; E340-Q842 VanDerWaalsContact CA-O 3.26Å; E340-Q842 WeakPolarHBondContact CA-O 3.22Å; V341-Q842 PolarHBondContact N-O 3.18Å; V840-Q842 PolarHBondContact O-NE2 2.82Å
843	P	85.2	Confident	86	Confident	58 Å²	58	66.7 Å²	66.7	38%	0.377	39%	0.385	S	S	.	.			trans	-60.3	146.3	168.4	26.6	-34.6	0	0	0	110.8	V341	V341-P843 WeakPolarHBondContact O-CA 3.5Å
844	P	83.1	Confident	86.1	Confident	45 Å²	45	66.7 Å²	66.7	29%	0.292	39%	0.385	S	S	.	.			trans	-54.1	139.5	174.1	-26.2	33.9	0	0	0	112.5	E340 T342 L846	E340-P844 HydrophobicContact CB-CG 4.04Å; E340-P844 WeakPolarHBondContact OE2-CA 3.45Å; E340-P844 WeakPolarHBondContact OE2-CB 3.34Å; T342-P844 HydrophobicContact CG2-CG 4Å; P844-L846 PolarHBondContact O-N 2.85Å
845	K	72.2	Confident	86.1	Confident	200 Å²	200	65.4 Å²	65.4	87%	0.87	38%	0.379	S	S	*	.	S	Bend	trans	-66.5	-18.6	-179.5	-63.7	-173.2	179.5	-173.9	0	113.9	G847	K845-G847 PolarHBondContact O-N 2.86Å
846	L	67.9	Low	86.1	Confident	135 Å²	135	60.4 Å²	60.4	71%	0.707	36%	0.359	S	S	*	.	S	Bend	trans	-86.9	105.2	175.1	-64.4	175.4	0	0	0	108.9	P844 I848	P844-L846 PolarHBondContact O-N 2.85Å; L846-I848 HydrophobicContact CB-CD1 4.32Å; L846-I848 HydrophobicContact CB-CG1 4.3Å; L846-I848 PolarHBondContact O-N 2.89Å
847	G	63.7	Low	86.1	Confident	83 Å²	83	61.1 Å²	61.1	86%	0.856	37%	0.372	S	S	*	.			trans	-69	45.2	177.6	0	0	0	0	0	114.7	K845 V849	K845-G847 PolarHBondContact O-N 2.86Å; G847-V849 PolarHBondContact O-N 3.23Å
848	I	80.3	Confident	86	Confident	134 Å²	134	61 Å²	61	69%	0.687	37%	0.372	S	S	*	.			trans	-77.4	114.3	174	-59.2	173.7	0	0	0	107.5	L846 P850	L846-I848 HydrophobicContact CB-CD1 4.32Å; L846-I848 HydrophobicContact CB-CG1 4.3Å; L846-I848 PolarHBondContact O-N 2.89Å; I848-P850 WeakPolarHBondContact O-CD 3.46Å
849	V	85.8	Confident	86.2	Confident	36 Å²	36	59.1 Å²	59.1	22%	0.218	35%	0.348	C	S	.	.			trans	-56.7	123.5	177.9	-177	0	0	0	0	109.8	A166 A170 Y173 G847 W851	A166-V849 HydrophobicContact CB-CG1 4.35Å; A170-V849 HydrophobicContact CB-CG2 3.65Å; Y173-V849 HydrophobicContact CD1-CG1 4.09Å; Y173-V849 HydrophobicContact CD2-CG1 3.36Å; Y173-V849 HydrophobicContact CE1-CG1 4.41Å; Y173-V849 HydrophobicContact CE2-CG1 3.74Å; Y173-V849 HydrophobicContact CG-CG1 3.57Å; G847-V849 PolarHBondContact O-N 3.23Å; V849-W851 HydrophobicContact CG1-CB 4.24Å; V849-W851 PolarHBondContact O-N 3.41Å
850	P	87.8	Confident	86.2	Confident	48 Å²	48	55.1 Å²	55.1	31%	0.312	32%	0.32	S	S	.	.			trans	-78.6	57.6	-178.4	33.6	-36.5	0	0	0	111.2	Y173 R344 I848	Y173-P850 HydrophobicContact CD1-CG 4.18Å; R344-P850 HydrophobicContact CB-CG 4.39Å; R344-P850 PolarHBondContact NH1-O 2.87Å; I848-P850 WeakPolarHBondContact O-CD 3.46Å
851	W	93.6	Very high	86.1	Confident	47 Å²	47	57.8 Å²	57.8	18%	0.178	34%	0.338	C	S	.	.			trans	-78.8	131.9	-176.9	177.2	77.5	0	0	0	111.7	T159 L162 Q163 A166 V849 P853	T159-W851 HydrophobicContact CG2-CH2 3.8Å; T159-W851 HydrophobicContact CG2-CZ2 4.4Å; L162-W851 HydrophobicContact CB-CZ2 3.99Å; Q163-W851 HydrophobicContact CB-CD2 4.38Å; Q163-W851 HydrophobicContact CB-CE3 4.24Å; Q163-W851 HydrophobicContact CB-CH2 3.63Å; Q163-W851 HydrophobicContact CB-CZ2 3.84Å; Q163-W851 HydrophobicContact CB-CZ3 3.86Å; Q163-W851 HydrophobicContact CG-CD2 4.1Å; Q163-W851 HydrophobicContact CG-CE3 3.7Å; Q163-W851 HydrophobicContact CG-CH2 3.96Å; Q163-W851 HydrophobicContact CG-CZ2 4.38Å; Q163-W851 HydrophobicContact CG-CZ3 3.61Å; A166-W851 HydrophobicContact CB-CB 4.07Å; A166-W851 HydrophobicContact CB-CG 3.75Å; V849-W851 HydrophobicContact CG1-CB 4.24Å; V849-W851 PolarHBondContact O-N 3.41Å; W851-P853 HydrophobicContact CE3-CG 4.36Å; W851-P853 HydrophobicContact CH2-CB 4.02Å; W851-P853 HydrophobicContact CH2-CG 3.8Å; W851-P853 HydrophobicContact CZ2-CB 4.39Å; W851-P853 HydrophobicContact CZ3-CB 4.42Å; W851-P853 HydrophobicContact CZ3-CG 3.7Å
852	I	93.9	Very high	86	Confident	25 Å²	25	58.6 Å²	58.6	13%	0.128	34%	0.341	C	S	.	.			trans	-115.1	134.1	173.7	-54.6	171.9	0	0	0	108	E729 R730 T732	E729-I852 HydrophobicContact CB-CB 4.1Å; E729-I852 HydrophobicContact CB-CG2 4.18Å; E729-I852 HydrophobicContact CG-CB 4.31Å; E729-I852 WeakPolarHBondContact OE2-CB 3.38Å; R730-I852 HydrophobicContact CB-CG2 4.25Å; T732-I852 HydrophobicContact CG2-CD1 3.54Å; T732-I852 HydrophobicContact CG2-CG1 4.37Å
853	P	94.1	Very high	86.1	Confident	40 Å²	40	53.1 Å²	53.1	26%	0.26	32%	0.315	S	S	.	.			trans	-59.1	140.3	174.8	-22.9	31.8	0	0	0	112.7	T159 R730 W851	T159-P853 HydrophobicContact CG2-CB 4.18Å; R730-P853 WeakPolarHBondContact CB-O 3.35Å; R730-P853 VanDerWaalsContact CG-O 3.27Å; R730-P853 WeakPolarHBondContact CG-O 3.49Å; R730-P853 PolarHBondContact N-O 3.34Å; W851-P853 HydrophobicContact CE3-CG 4.36Å; W851-P853 HydrophobicContact CH2-CB 4.02Å; W851-P853 HydrophobicContact CH2-CG 3.8Å; W851-P853 HydrophobicContact CZ2-CB 4.39Å; W851-P853 HydrophobicContact CZ3-CB 4.42Å; W851-P853 HydrophobicContact CZ3-CG 3.7Å
854	I	94.3	Very high	86.2	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-64.6	143.8	171.6	-61.5	-62.1	0	0	0	111	L162 Q723 V728 E729 R730 P856 C871	L162-I854 HydrophobicContact CD1-CB 3.89Å; L162-I854 HydrophobicContact CD1-CG1 3.51Å; Q723-I854 HydrophobicContact CB-CD1 3.98Å; Q723-I854 HydrophobicContact CB-CG1 4.42Å; V728-I854 CarbonylContact O-C 3.55Å; V728-I854 WeakPolarHBondContact O-CA 3.26Å; V728-I854 WeakPolarHBondContact O-CG2 3.3Å; E729-I854 HydrophobicContact CG-CD1 3.76Å; R730-I854 PolarHBondContact NE-O 3.15Å; R730-I854 PolarHBondContact NH2-O 2.78Å; I854-P856 WeakPolarHBondContact O-CD 3.28Å; I854-C871 WeakPolarHBondContact CG2-SG 3.5Å
855	D	91.6	Very high	86.4	Confident	18 Å²	18	57.6 Å²	57.6	10%	0.096	33%	0.327	C	S	.	.			trans	-83.9	112.3	179.7	-163.2	-32.7	0	0	0	111.3	V728 R730 A857 V858	V728-D855 PolarHBondContact O-N 2.78Å; R730-D855 HydrophobicContact CG-CB 3.64Å; D855-A857 PolarHBondContact O-N 2.73Å; D855-A857 WeakPolarHBondContact OD1-CB 3.39Å; D855-A857 PolarHBondContact OD1-N 2.98Å; D855-V858 HydrophobicContact CB-CG2 4.13Å; D855-V858 PolarHBondContact O-N 2.72Å
856	P	90.9	Very high	87.1	Confident	36 Å²	36	51.1 Å²	51.1	23%	0.234	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-9.3	-179.9	32.3	-36.9	0	0	0	113.7	V155 I854 C871	V155-P856 HydrophobicContact CG1-CB 3.99Å; V155-P856 HydrophobicContact CG1-CG 4.19Å; V155-P856 HydrophobicContact CG2-CB 4.3Å; I854-P856 WeakPolarHBondContact O-CD 3.28Å; P856-C871 HydrophobicContact CB-CB 4.37Å
857	A	88.8	Confident	88	Confident	62 Å²	62	44.9 Å²	44.9	51%	0.512	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-20.6	178.7	0	0	0	0	0	113.4	D855	D855-A857 PolarHBondContact O-N 2.73Å; D855-A857 WeakPolarHBondContact OD1-CB 3.39Å; D855-A857 PolarHBondContact OD1-N 2.98Å
858	V	89.4	Confident	89.2	Confident	11 Å²	11	41.5 Å²	41.5	7%	0.067	23%	0.23	C	C	.	.			trans	-93.2	116.4	-176.2	-175	0	0	0	0	111.1	V728 L765 D855 P870	V728-V858 HydrophobicContact CG2-CB 3.69Å; V728-V858 HydrophobicContact CG2-CG1 3.57Å; V728-V858 HydrophobicContact CG2-CG2 4.13Å; L765-V858 HydrophobicContact CD2-CG1 4.15Å; D855-V858 HydrophobicContact CB-CG2 4.13Å; D855-V858 PolarHBondContact O-N 2.72Å; V858-P870 WeakPolarHBondContact O-CG 3.5Å
859	V	89.2	Confident	89.7	Confident	18 Å²	18	35.1 Å²	35.1	11%	0.109	20%	0.197	C	C	.	.			trans	-99.4	107.8	-176.1	-174.3	0	0	0	0	110.7	V132 L135 M136 H863 Q864 P870	V132-V859 HydrophobicContact CG1-CG1 4.07Å; L135-V859 HydrophobicContact CB-CG2 3.77Å; L135-V859 HydrophobicContact CD1-CG2 3.55Å; L135-V859 HydrophobicContact CG-CG2 4.34Å; M136-V859 HydrophobicContact CE-CB 3.71Å; M136-V859 HydrophobicContact CE-CG1 3.69Å; M136-V859 HydrophobicContact CG-CG1 4.49Å; M136-V859 HydrophobicContact SD-CB 3.82Å; M136-V859 HydrophobicContact SD-CG1 4.21Å; M136-V859 HydrophobicContact SD-CG2 4.17Å; V859-H863 HydrophobicContact CG1-CB 3.69Å; V859-Q864 HydrophobicContact CG1-CB 4.44Å; V859-P870 HydrophobicContact CB-CG 4.49Å; V859-P870 HydrophobicContact CG2-CG 4.08Å
860	L	89.6	Confident	89.9	Confident	7 Å²	7	33.4 Å²	33.4	4%	0.037	19%	0.187	C	C	.	.			trans	-74.2	160.1	172.3	-64.6	178.4	0	0	0	112.5	L724 V728 L765 F862 H863 Q864	L724-L860 HydrophobicContact CD1-CD1 4.03Å; V728-L860 HydrophobicContact CG1-CD1 4.26Å; V728-L860 HydrophobicContact CG1-CD2 4.04Å; V728-L860 HydrophobicContact CG1-CG 4.49Å; L765-L860 HydrophobicContact CB-CD2 4.23Å; L765-L860 HydrophobicContact CD2-CD2 3.94Å; L860-F862 VanDerWaalsContact C-N 3.34Å; L860-F862 HydrophobicContact CB-CD1 4.08Å; L860-F862 HydrophobicContact CB-CE1 3.77Å; L860-F862 HydrophobicContact CB-CZ 4.19Å; L860-F862 HydrophobicContact CD1-CE1 3.56Å; L860-F862 HydrophobicContact CD1-CZ 3.81Å; L860-F862 HydrophobicContact CG-CE1 4.33Å; L860-F862 PolarHBondContact O-N 3.22Å; L860-H863 VanDerWaalsContact O-CB 3.31Å; L860-H863 WeakPolarHBondContact O-CB 3.36Å; L860-H863 PolarHBondContact O-N 3.16Å; L860-Q864 PolarHBondContact O-N 3.41Å
861	P	87.9	Confident	90.1	Very high	90 Å²	90	31.1 Å²	31.1	58%	0.584	17%	0.172	S	C	*	.	H	α-helix	trans	-52.8	-42.2	-176.1	-29.6	36.3	0	0	0	115.1	H863 Q864 Q865	P861-H863 VanDerWaalsContact C-N 3.3Å; P861-H863 PolarHBondContact O-N 3.36Å; P861-Q864 WeakPolarHBondContact O-CB 3.41Å; P861-Q864 PolarHBondContact O-N 3.41Å; P861-Q864 VanDerWaalsContact O-N 3.09Å; P861-Q865 PolarHBondContact O-N 2.95Å
862	F	88.2	Confident	90.1	Very high	23 Å²	23	29 Å²	29	10%	0.101	16%	0.164	C	C	.	.	H	α-helix	trans	-65	-30.6	178.1	63.1	-101.2	0	0	0	113.2	Y110 P111 L860 H866	Y110-F862 HydrophobicContact CD2-CD2 4.06Å; Y110-F862 HydrophobicContact CE1-CD2 4.15Å; Y110-F862 AromaticContact CE1-CE2 3.99Å; Y110-F862 HydrophobicContact CE1-CE2 3.99Å; Y110-F862 AromaticContact CE2-CD2 3.66Å; Y110-F862 HydrophobicContact CE2-CD2 3.66Å; Y110-F862 HydrophobicContact CE2-CE2 4.06Å; Y110-F862 HydrophobicContact CG-CD2 4.48Å; Y110-F862 AromaticContact CZ-CD2 3.71Å; Y110-F862 AromaticContact CZ-CE2 3.62Å; P111-F862 HydrophobicContact CG-CD1 3.84Å; P111-F862 HydrophobicContact CG-CD2 4.22Å; P111-F862 HydrophobicContact CG-CE1 3.86Å; P111-F862 HydrophobicContact CG-CE2 4.25Å; P111-F862 HydrophobicContact CG-CG 4.02Å; P111-F862 HydrophobicContact CG-CZ 4.06Å; L860-F862 VanDerWaalsContact C-N 3.34Å; L860-F862 HydrophobicContact CB-CD1 4.08Å; L860-F862 HydrophobicContact CB-CE1 3.77Å; L860-F862 HydrophobicContact CB-CZ 4.19Å; L860-F862 HydrophobicContact CD1-CE1 3.56Å; L860-F862 HydrophobicContact CD1-CZ 3.81Å; L860-F862 HydrophobicContact CG-CE1 4.33Å; L860-F862 PolarHBondContact O-N 3.22Å; F862-H866 PolarHBondContact O-N 3.23Å; F862-H866 PolarHBondContact O-ND1 3.11Å
863	H	90.4	Very high	90	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66.8	-39.4	172.2	-67.5	108.3	0	0	0	111.3	Y110 V859 L860 P861 G867 R868 P870	Y110-H863 PolarHBondContact OH-CD2 3.29Å; Y110-H863 PolarHBondContact OH-NE2 3.34Å; V859-H863 HydrophobicContact CG1-CB 3.69Å; L860-H863 VanDerWaalsContact O-CB 3.31Å; L860-H863 WeakPolarHBondContact O-CB 3.36Å; L860-H863 PolarHBondContact O-N 3.16Å; P861-H863 VanDerWaalsContact C-N 3.3Å; P861-H863 PolarHBondContact O-N 3.36Å; H863-G867 CarbonylContact O-C 3.59Å; H863-G867 WeakPolarHBondContact O-CA 3.5Å; H863-G867 PolarHBondContact O-N 3.26Å; H863-R868 WeakPolarHBondContact CB-O 3.49Å; H863-R868 PolarHBondContact CD2-O 3.47Å; H863-R868 PolarHBondContact O-N 3.24Å; H863-P870 WeakPolarHBondContact NE2-CA 3.46Å
864	Q	88.4	Confident	89.8	Confident	123 Å²	123	27.4 Å²	27.4	58%	0.575	16%	0.155	S	C	*	.	H	α-helix	trans	-66	-48.9	178	177.5	177.4	-25.2	0	0	112	M136 V859 L860 P861 G867	M136-Q864 HydrophobicContact CE-CB 4.42Å; M136-Q864 VanDerWaalsContact CE-OE1 3.26Å; V859-Q864 HydrophobicContact CG1-CB 4.44Å; L860-Q864 PolarHBondContact O-N 3.41Å; P861-Q864 WeakPolarHBondContact O-CB 3.41Å; P861-Q864 PolarHBondContact O-N 3.41Å; P861-Q864 VanDerWaalsContact O-N 3.09Å; Q864-G867 PolarHBondContact O-N 3.39Å
865	Q	87.3	Confident	89.4	Confident	74 Å²	74	28.6 Å²	28.6	35%	0.346	16%	0.163	S	C	.	.	H	α-helix	trans	-61.8	-52.4	-178.4	-178.4	-175	-24.9	0	0	112.1	D107 V108 P861 G867	D107-Q865 PolarHBondContact OD1-NE2 3.13Å; V108-Q865 PolarHBondContact O-NE2 3.48Å; V108-Q865 PolarHBondContact O-OE1 3.04Å; P861-Q865 PolarHBondContact O-N 2.95Å; Q865-G867 VanDerWaalsContact C-N 3.29Å; Q865-G867 PolarHBondContact O-N 3.45Å
866	H	86.6	Confident	88.6	Confident	64 Å²	64	31.2 Å²	31.2	30%	0.296	18%	0.177	S	C	.	.	H	α-helix	trans	-72.3	-26.5	177.4	-63.1	86.4	0	0	0	112.3	V108 Y110 K129 F862	V108-H866 PolarHBondContact O-CE1 3.02Å; Y110-H866 HydrophobicContact CD2-CB 4.15Å; Y110-H866 AromaticContact CD2-CG 3.79Å; Y110-H866 AromaticContact CD2-ND1 3.7Å; Y110-H866 PolarHBondContact N-CE1 3.42Å; Y110-H866 PolarHBondContact N-NE2 3.19Å; K129-H866 WeakPolarHBondContact CE-O 3.31Å; K129-H866 PolarHBondContact NZ-O 3.11Å; F862-H866 PolarHBondContact O-N 3.23Å; F862-H866 PolarHBondContact O-ND1 3.11Å
867	G	86.8	Confident	87.3	Confident	4 Å²	4	34.3 Å²	34.3	4%	0.041	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	28.6	-174.1	0	0	0	0	0	114	Q128 K129 H863 Q864 Q865	Q128-G867 CarbonylContact C-O 3.57Å; Q128-G867 VanDerWaalsContact C-O 3.3Å; Q128-G867 WeakPolarHBondContact CB-O 3.26Å; K129-G867 PolarHBondContact N-O 3.42Å; H863-G867 CarbonylContact O-C 3.59Å; H863-G867 WeakPolarHBondContact O-CA 3.5Å; H863-G867 PolarHBondContact O-N 3.26Å; Q864-G867 PolarHBondContact O-N 3.39Å; Q865-G867 VanDerWaalsContact C-N 3.29Å; Q865-G867 PolarHBondContact O-N 3.45Å
868	R	89.1	Confident	85.1	Confident	11 Å²	11	40 Å²	40	4%	0.042	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-90.9	139.1	174.2	175.3	169.8	167.2	-152.9	-4.8	109.1	Y110 Y117 V132 H863 T872 F873	Y110-R868 HydrophobicContact CE2-CB 4.08Å; Y110-R868 HydrophobicContact CE2-CG 4.19Å; Y117-R868 VanDerWaalsContact CE1-NH2 3.29Å; Y117-R868 VanDerWaalsContact CZ-NH2 3.3Å; Y117-R868 PolarHBondContact OH-NH1 3.23Å; Y117-R868 VanDerWaalsContact OH-NH1 3.11Å; Y117-R868 PolarHBondContact OH-NH2 2.87Å; Y117-R868 VanDerWaalsContact OH-NH2 3.15Å; V132-R868 WeakPolarHBondContact CG2-O 3.46Å; H863-R868 WeakPolarHBondContact CB-O 3.49Å; H863-R868 PolarHBondContact CD2-O 3.47Å; H863-R868 PolarHBondContact O-N 3.24Å; R868-T872 VanDerWaalsContact CZ-O 3.25Å; R868-T872 PolarHBondContact NE-O 2.88Å; R868-T872 PolarHBondContact NH2-O 3.03Å; R868-F873 PolarHBondContact NE-O 3.28Å
869	V	90.1	Very high	82.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-77.5	138.3	-177.7	179.8	0	0	0	0	109.5	Q128 Y131 V132 I151 T872	Q128-V869 HydrophobicContact CB-CG2 4.01Å; Q128-V869 HydrophobicContact CG-CG2 4.29Å; Y131-V869 HydrophobicContact CD1-CB 4.35Å; Y131-V869 HydrophobicContact CD1-CG1 3.51Å; Y131-V869 HydrophobicContact CD1-CG2 3.79Å; Y131-V869 HydrophobicContact CE1-CG1 3.8Å; Y131-V869 HydrophobicContact CG-CG2 4.22Å; V132-V869 HydrophobicContact CG2-CB 4.46Å; V132-V869 HydrophobicContact CG2-CG2 3.88Å; I151-V869 HydrophobicContact CG2-CG1 4.35Å; V869-T872 HydrophobicContact CB-CG2 3.75Å; V869-T872 HydrophobicContact CG1-CG2 3.95Å; V869-T872 PolarHBondContact N-OG1 2.95Å; V869-T872 PolarHBondContact O-N 2.92Å; V869-T872 PolarHBondContact O-OG1 3.31Å
870	P	90.9	Very high	80.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	141.6	170.5	-26.9	35.4	0	0	0	112.1	V858 V859 H863 T872	V858-P870 WeakPolarHBondContact O-CG 3.5Å; V859-P870 HydrophobicContact CB-CG 4.49Å; V859-P870 HydrophobicContact CG2-CG 4.08Å; H863-P870 WeakPolarHBondContact NE2-CA 3.46Å; P870-T872 VanDerWaalsContact C-N 3.31Å; P870-T872 PolarHBondContact O-N 3.33Å
871	C	91.8	Very high	77.4	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.007	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	34.4	-174.7	-58.2	0	0	0	0	115.5	V155 F158 I854 P856	V155-C871 WeakPolarHBondContact CA-O 3.22Å; V155-C871 HydrophobicContact CB-CB 4.41Å; V155-C871 HydrophobicContact CG1-CB 3.99Å; V155-C871 HydrophobicContact CG2-CB 4.08Å; V155-C871 WeakPolarHBondContact CG2-O 3.35Å; F158-C871 WeakPolarHBondContact CB-O 3.02Å; F158-C871 VanDerWaalsContact CD1-CA 3.46Å; F158-C871 HydrophobicContact CD1-CB 3.95Å; F158-C871 HydrophobicContact CG-CB 4.46Å; F158-C871 WeakPolarHBondContact CG-O 3.46Å; I854-C871 WeakPolarHBondContact CG2-SG 3.5Å; P856-C871 HydrophobicContact CB-CB 4.37Å
872	T	92.3	Very high	74.7	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.006	33%	0.326	C	S	.	.			trans	-122.8	155.2	170.1	62.7	0	0	0	0	111.9	L123 E154 V155 F158 R868 V869 P870	L123-T872 HydrophobicContact CD1-CG2 3.95Å; E154-T872 WeakPolarHBondContact OE1-CB 3.29Å; V155-T872 HydrophobicContact CG2-CG2 4.22Å; F158-T872 VanDerWaalsContact CD2-C 3.48Å; F158-T872 VanDerWaalsContact CE2-O 3.24Å; F158-T872 WeakPolarHBondContact CE2-O 3.31Å; R868-T872 VanDerWaalsContact CZ-O 3.25Å; R868-T872 PolarHBondContact NE-O 2.88Å; R868-T872 PolarHBondContact NH2-O 3.03Å; V869-T872 HydrophobicContact CB-CG2 3.75Å; V869-T872 HydrophobicContact CG1-CG2 3.95Å; V869-T872 PolarHBondContact N-OG1 2.95Å; V869-T872 PolarHBondContact O-N 2.92Å; V869-T872 PolarHBondContact O-OG1 3.31Å; P870-T872 VanDerWaalsContact C-N 3.31Å; P870-T872 PolarHBondContact O-N 3.33Å
873	F	92.4	Very high	72.1	Confident	4 Å²	4	70.9 Å²	70.9	2%	0.018	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-71.6	165.9	-179.1	-67.1	-68.8	0	0	0	111.5	Y117 P118 C119 Q128 E154 Q157 F158 Y161 R868	Y117-F873 HydrophobicContact CD1-CD1 4.09Å; P118-F873 HydrophobicContact CG-CE1 3.74Å; P118-F873 HydrophobicContact CG-CZ 4.11Å; C119-F873 VanDerWaalsContact SG-CD2 3.53Å; C119-F873 VanDerWaalsContact SG-CE2 3.56Å; Q128-F873 PolarHBondContact NE2-O 2.72Å; E154-F873 HydrophobicContact CG-CD2 3.64Å; E154-F873 HydrophobicContact CG-CE2 4.12Å; E154-F873 PolarHBondContact OE1-N 3.33Å; Q157-F873 HydrophobicContact CB-CE2 3.95Å; Q157-F873 HydrophobicContact CB-CZ 4.4Å; F158-F873 HydrophobicContact CB-CE2 4.22Å; F158-F873 HydrophobicContact CB-CZ 4.07Å; F158-F873 AromaticContact CD2-CD1 3.5Å; F158-F873 HydrophobicContact CD2-CD1 3.5Å; F158-F873 VanDerWaalsContact CD2-CD1 3.5Å; F158-F873 HydrophobicContact CD2-CD2 4.24Å; F158-F873 AromaticContact CD2-CE1 3.46Å; F158-F873 HydrophobicContact CD2-CE1 3.46Å; F158-F873 VanDerWaalsContact CD2-CE1 3.46Å; F158-F873 HydrophobicContact CD2-CE2 4.22Å; F158-F873 AromaticContact CD2-CG 3.89Å; F158-F873 HydrophobicContact CD2-CG 3.89Å; F158-F873 AromaticContact CD2-CZ 3.85Å; F158-F873 HydrophobicContact CD2-CZ 3.85Å; F158-F873 AromaticContact CE2-CD1 3.82Å; F158-F873 HydrophobicContact CE2-CD1 3.82Å; F158-F873 HydrophobicContact CE2-CE1 4.02Å; F158-F873 HydrophobicContact CE2-CG 4.41Å; F158-F873 HydrophobicContact CG-CE1 4.31Å; F158-F873 HydrophobicContact CG-CZ 4.36Å; Y161-F873 HydrophobicContact CD1-CE1 4.41Å; Y161-F873 HydrophobicContact CG-CE1 4.42Å; R868-F873 PolarHBondContact NE-O 3.28Å
874	P	89.2	Confident	69.4	Low	28 Å²	28	77 Å²	77	18%	0.182	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-56.1	131.9	174.1	-24	34.4	0	0	0	110.4	Y117 L120 S121 N876	Y117-P874 HydrophobicContact CD1-CG 4.38Å; Y117-P874 HydrophobicContact CD2-CG 3.35Å; Y117-P874 HydrophobicContact CE2-CG 3.56Å; Y117-P874 HydrophobicContact CG-CG 3.79Å; L120-P874 HydrophobicContact CD2-CB 4.22Å; S121-P874 WeakPolarHBondContact CB-O 3.19Å; S121-P874 PolarHBondContact N-O 2.78Å; P874-N876 PolarHBondContact O-N 3.26Å
875	P	86.1	Confident	66.8	Low	25 Å²	25	79.4 Å²	79.4	16%	0.162	40%	0.403	C	S	.	.	B	Isolated β-bridge	trans	-58.8	139.8	178.8	24.6	-33.6	0	0	0	110.1	T877	P875-T877 VanDerWaalsContact C-N 3.32Å; P875-T877 PolarHBondContact O-N 2.75Å
876	N	76.3	Confident	64.1	Low	73 Å²	73	81.1 Å²	81.1	39%	0.39	42%	0.422	S	S	.	.			trans	-65.4	95	174.2	-172.6	-11.6	0	0	0	109.6	L120 P874 F878	L120-N876 HydrophobicContact CB-CB 4.28Å; L120-N876 HydrophobicContact CD1-CB 4.36Å; P874-N876 PolarHBondContact O-N 3.26Å; N876-F878 VanDerWaalsContact C-N 3.28Å; N876-F878 PolarHBondContact O-N 2.8Å
877	T	62.1	Low	61.5	Low	102 Å²	102	85 Å²	85	63%	0.626	44%	0.444	S	S	*	.			trans	-70.8	89	171.6	41.6	0	0	0	0	107.9	P875 Q879	P875-T877 VanDerWaalsContact C-N 3.32Å; P875-T877 PolarHBondContact O-N 2.75Å; T877-Q879 VanDerWaalsContact C-N 3.28Å; T877-Q879 PolarHBondContact O-N 3.09Å
878	F	42.9	Very low	58.8	Low	181 Å²	181	94 Å²	94	79%	0.794	48%	0.481	S	S	*	.			trans	-49.1	100.8	159.7	-79.4	-84.2	0	0	0	107.7	N876 K880	N876-F878 VanDerWaalsContact C-N 3.28Å; N876-F878 PolarHBondContact O-N 2.8Å; F878-K880 PolarHBondContact O-N 3.04Å
879	Q	41.3	Very low	56	Low	175 Å²	175	99 Å²	99	82%	0.818	51%	0.513	S	S	*	.			trans	-54.5	114.5	170.2	-69	-178	-3.1	0	0	105.4	T877 K881	T877-Q879 VanDerWaalsContact C-N 3.28Å; T877-Q879 PolarHBondContact O-N 3.09Å; Q879-K881 VanDerWaalsContact C-N 3.25Å; Q879-K881 PolarHBondContact O-N 3.05Å
880	K	33.5	Very low	53.1	Low	198 Å²	198	104.2 Å²	104.2	86%	0.861	55%	0.55	S	S	*	.			trans	-57.5	104.5	161.3	-81.1	-176.1	176.3	178.9	0	104.3	F878 V882	F878-K880 PolarHBondContact O-N 3.04Å; K880-V882 PolarHBondContact O-N 3.35Å
881	K	32.7	Very low	50.2	Low	194 Å²	194	115.3 Å²	115.3	84%	0.843	59%	0.592	S	S	*	*			trans	-48.4	114.7	164.5	-73.8	-172.2	175.4	-174.5	0	104.8	Q879 P883	Q879-K881 VanDerWaalsContact C-N 3.25Å; Q879-K881 PolarHBondContact O-N 3.05Å; K881-P883 WeakPolarHBondContact O-CD 3.45Å
882	V	30.7	Very low	47.2	Very low	121 Å²	121	118.5 Å²	118.5	73%	0.733	62%	0.624	S	S	*	*			trans	-50.4	122.5	173.2	178.2	0	0	0	0	104.7	K880 V884	K880-V882 PolarHBondContact O-N 3.35Å; V882-V884 PolarHBondContact O-N 3.33Å
883	P	33.1	Very low	44.3	Very low	109 Å²	109	125 Å²	125	71%	0.708	66%	0.664	S	S	*	*			trans	-55.7	114.1	176.4	-22	32.7	0	0	0	105.9	K881 E885	K881-P883 WeakPolarHBondContact O-CD 3.45Å; P883-E885 PolarHBondContact O-N 3.04Å
884	V	34.8	Very low	41.4	Very low	130 Å²	130	134.4 Å²	134.4	79%	0.788	71%	0.705	S	S	*	*			trans	-58.4	110.1	179.7	175.5	0	0	0	0	105.3	V882 C886	V882-V884 PolarHBondContact O-N 3.33Å; V884-C886 PolarHBondContact O-N 3.33Å
885	E	33	Very low	38.4	Very low	172 Å²	172	144 Å²	144	80%	0.804	74%	0.737	S	S	*	*			trans	-62.4	105.8	179.4	-73	-162.3	119.8	0	0	106.8	P883 I887	P883-E885 PolarHBondContact O-N 3.04Å; E885-I887 PolarHBondContact O-N 3.27Å
886	C	30.2	Very low	35.7	Very low	111 Å²	111	148.9 Å²	148.9	75%	0.75	77%	0.77	S	S	*	*			trans	-64	93.6	169.4	-62.3	0	0	0	0	106.5	V884 K888	V884-C886 PolarHBondContact O-N 3.33Å; C886-K888 VanDerWaalsContact C-N 3.34Å; C886-K888 PolarHBondContact O-N 3.3Å
887	I	32.8	Very low	33.3	Very low	145 Å²	145	152.7 Å²	152.7	74%	0.744	79%	0.791	S	S	*	*			trans	-56	98.5	-178.7	-59.5	178.5	0	0	0	107.5	E885 V889	E885-I887 PolarHBondContact O-N 3.27Å; I887-V889 HydrophobicContact CG2-CG2 4.11Å; I887-V889 PolarHBondContact O-N 3.5Å
888	K	30.3	Very low	31.8	Very low	192 Å²	192	154.2 Å²	154.2	84%	0.835	80%	0.8	S	S	*	*			trans	-72.8	86.8	175.1	-75.9	-177.2	178	177	0	107.3	C886 S890	C886-K888 VanDerWaalsContact C-N 3.34Å; C886-K888 PolarHBondContact O-N 3.3Å; K888-S890 VanDerWaalsContact C-N 3.3Å; K888-S890 PolarHBondContact O-N 3.05Å
889	V	30.3	Very low	31.2	Very low	117 Å²	117	152.6 Å²	152.6	71%	0.709	80%	0.799	S	S	*	*			trans	-59.9	93.5	174.7	179.9	0	0	0	0	108.8	I887 R891	I887-V889 HydrophobicContact CG2-CG2 4.11Å; I887-V889 PolarHBondContact O-N 3.5Å; V889-R891 PolarHBondContact O-N 3.11Å; V889-R891 VanDerWaalsContact O-N 3.09Å
890	S	29.6	Very low	30.6	Very low	110 Å²	110	153.7 Å²	153.7	77%	0.769	80%	0.801	S	S	*	*			trans	-73.2	99.3	179.3	44.5	0	0	0	0	109	K888 G892	K888-S890 VanDerWaalsContact C-N 3.3Å; K888-S890 PolarHBondContact O-N 3.05Å; S890-G892 PolarHBondContact O-N 3.06Å
891	R	29.5	Very low	30.5	Very low	233 Å²	233	155.2 Å²	155.2	88%	0.879	80%	0.801	S	S	*	*			trans	-68.8	69.6	172.7	-78.8	-173.8	167.6	-177	-3.1	111.5	V889 V893	V889-R891 PolarHBondContact O-N 3.11Å; V889-R891 VanDerWaalsContact O-N 3.09Å; R891-V893 PolarHBondContact O-N 3.17Å
892	G	28.6	Very low	30.4	Very low	67 Å²	67	154.6 Å²	154.6	69%	0.691	80%	0.801	S	S	*	*			trans	-74.5	84.4	172.3	0	0	0	0	0	111.2	S890 K894	S890-G892 PolarHBondContact O-N 3.06Å; G892-K894 PolarHBondContact O-N 3.45Å; G892-K894 VanDerWaalsContact O-N 3.11Å
893	V	30.8	Very low	30.4	Very low	139 Å²	139	157.2 Å²	157.2	84%	0.842	81%	0.805	S	S	*	*			trans	-66.2	109	176.7	179.7	0	0	0	0	110.1	R891	R891-V893 PolarHBondContact O-N 3.17Å
894	K	30.8	Very low	30.3	Very low	201 Å²	201	159.3 Å²	159.3	87%	0.874	81%	0.81	S	S	*	*			trans	-110.2	140.3	163.5	-77.1	-171.6	175.4	179.9	0	110.1	G892	G892-K894 PolarHBondContact O-N 3.45Å; G892-K894 VanDerWaalsContact O-N 3.11Å
895	R	27.2	Very low	30.2	Very low	229 Å²	229	162.3 Å²	162.3	86%	0.864	81%	0.813	S	S	*	*			trans	-76.8	140	-174.4	-63.6	169.8	172.8	155.9	-5.7	111.2
896	C	29	Very low	30.1	Very low	127 Å²	127	157.3 Å²	157.3	86%	0.858	81%	0.807	S	S	*	*			trans	-114.3	130.7	152.9	-75.2	0	0	0	0	108.8
897	N	26.6	Very low	30.2	Very low	153 Å²	153	159.1 Å²	159.1	82%	0.818	81%	0.809	S	S	*	*			trans	-103.2	118.1	175.5	-78.9	-13.4	0	0	0	109.5
898	V	30.8	Very low	30.3	Very low	134 Å²	134	160.7 Å²	160.7	81%	0.812	81%	0.811	S	S	*	*			trans	-137.2	121.7	164.5	174.3	0	0	0	0	110.9
899	L	29.8	Very low	30.6	Very low	148 Å²	148	163.3 Å²	163.3	78%	0.775	83%	0.826	S	S	*	*			trans	13.4	120.3	164.8	-69.1	91.4	0	0	0	122.9
900	K	29.3	Very low	30.6	Very low	197 Å²	197	165.6 Å²	165.6	86%	0.857	83%	0.832	S	S	*	*				25.3	118.3	124.3	-65.3	-179.8	176	179	0	120.2
901	R	29.9	Very low	30.7	Very low	230 Å²	230	168.5 Å²	168.5	87%	0.868	84%	0.835	S	S	*	*				-163.7	112.3	123.5	-102.4	165.6	-177	-178.7	1.5	107.5
902	Q	32.1	Very low	30.7	Very low	181 Å²	181	164.9 Å²	164.9	85%	0.846	83%	0.832	S	S	*	*				75.2	135.1	95.4	-92	-178.1	-34.1	0	0	115.6
903	H	30.9	Very low	30.9	Very low	176 Å²	176	170.7 Å²	170.7	82%	0.815	84%	0.841	S	S	*	*			trans	-48.5	145.4	177.5	-85.2	-123.7	0	0	0	114.6
904	N	30.9	Very low	30.9	Very low	153 Å²	153	172.7 Å²	172.7	82%	0.818	84%	0.841	S	S	*	*				-160.6	179.7	93.1	-131.5	-21.1	0	0	0	115
905	K	32.9	Very low	30.9	Very low	193 Å²	193	170.8 Å²	170.8	84%	0.839	84%	0.838	S	S	*	*			trans	-95.8	158	-172.8	-60.6	174.4	176.6	177.9	0	114
906	G	29.5	Very low	31.2	Very low	67 Å²	67	166.6 Å²	166.6	69%	0.691	84%	0.837	S	S	*	*			trans	95	168.6	152.9	0	0	0	0	0	115.8
907	L	33.7	Very low	31.3	Very low	149 Å²	149	169.7 Å²	169.7	78%	0.78	84%	0.835	S	S	*	*			cis	-174.3	135.3	-22.2	-147.5	77.6	0	0	0	106.1
908	F	34.1	Very low	31.7	Very low	178 Å²	178	171.1 Å²	171.1	78%	0.781	84%	0.836	S	S	*	*			trans	61.3	158.3	179.7	-68.3	-99.6	0	0	0	115.1
909	E	36.7	Very low	31.8	Very low	247 Å²	247	174.5 Å²	174.5	100%	1.154	84%	0.838	S	S	*	*			cis	-133	0	-8.1	-159	153.6	-140.4	0	0	109.8

Retrieved 909 of 909 residues in 478.2 ms (Link to these results)

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