A0A3Q0KQ06_SCHMA Loading...

Putative lysine-specific histone demethylase 1

AlphaFold DB , UniProt , Accession A0A3Q0KQ06, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,164 aa.

						>A0A3Q0KQ06_SCHMA|A0A3Q0KQ06
MPRGRSVKRGFRPSHTSVQTMLVTSHGECAATNKDEEMNELEETKASKSNPPKSSSSKKSDECGGEVYEDDEELEDSELENNATGRRLVEGDIDVDDAESESAEDEPVEEEPEDTLTPAEKASQICRLPAKELSAEETQLFPFLESSSNSLKESYIAVRNLACLMWSEDSCTQVTPNRLFIYVVNNMSVENLRVMIDSGLTTPLPVHQGSNSSASSVCEENSSCVGRVRHSKELSRSLQRHLTSLTLPSNYSPWGTPTAKANLERMTYLVVLFLERYGYINFGIFKIISPPLTHVSSSRTADPATTSGSPMEILDKSDVQLTPRRAAAEKALAATRRANNSHSSSTLPVSSSSTSLTTPHFIIIGAGISGLIAARQLTYFGAKVTILESRDRVGGRIWTCRKGGYHAELGAMVVTGLSANPVTILVRQLSLNLLPINTDCSLYDSQGHLINRDLDEQIEEEFNRLLGTAAYVCHSKGLDSLILDSGVEIPLSLGQVIELLIKYQEKHKIQLKITHRKLISQLLDRKNSLLDQMVIERKNIETAYEKWHSASKALNNQSSPNRHYTQQSKTQNPAQNKSRVRNDSSPCSPRSSSTELDGKLVIESASSNGSQKSVNNNPVRLSSSTDISQRPSLPVFNVSAQFEVRQLLSHLHEAWKKFQPLQTALSQVNKQLDILLQEPPKDMYLTKEERSILDWHLANLEFANATELHNLSLRHWDQDDLFELSGDHCVLQDGYGSVTDNLAHYITSGQSLTVGLKPRDNHLTSVTTTTSSSTLSTYKLGSGHIELKSTVKRISYSNTGVQVDVLNSAFSQDDLIEYEADALICTLPLGILKESIQQDNETTMHQSQITTNESSTNCLTKLVVPRFEPRLPDWKISAIQRLGFGVLNKVVLIFERSFWDRSHNLFGHVNESTNSRGELFLFWSITDKPVLIALVAGRAACDLENEKTSPTRRLSPGSKGQNALINNCATSTSHLLGRGLKEPIITRAMQVLRGIFTQEGSNSSSISNNNNNSNSSNCNGMHSNQEKKKVVIPNPIDAYVTRWRTDPYSRGSYSYVAVGATGADYDILAEPVYHPSSSSGEKQTTTHVSHQSHGIDGISMPTNNPRIFFAGEHTCRCYPATVHGALLSGLREAARVANYYFPGQTPVRASGFKLNTSQSTNLHF
					

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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	29.3	Very low	27.9	Very low	215 Å²	215	170.4 Å²	170.4	100%	1.059	87%	0.872	S	S	*	*				0	130.5	0	-64.5	-59	171.5	0	0	107.5
2	P	36.4	Very low	27.4	Very low	133 Å²	133	173.3 Å²	173.3	86%	0.864	86%	0.864	S	S	*	*				-93.4	-177.3	51.4	33.5	-38.2	0	0	0	115.4
3	R	29.9	Very low	27.1	Very low	240 Å²	240	168.2 Å²	168.2	91%	0.906	85%	0.851	S	S	*	*			trans	-93.6	132.7	-176.8	-66.8	173.3	171.8	162.7	-4.6	111.6
4	G	32.5	Very low	26.9	Very low	74 Å²	74	163.4 Å²	163.4	76%	0.763	84%	0.841	S	S	*	*			trans	-119.8	153	164.8	0	0	0	0	0	110.7
5	R	25.6	Very low	26.8	Very low	244 Å²	244	161.2 Å²	161.2	92%	0.921	83%	0.825	S	S	*	*			trans	-79.4	121.9	177.7	-70.3	172.7	171.7	162.3	-5.3	110
6	S	28.1	Very low	26.7	Very low	122 Å²	122	155.5 Å²	155.5	85%	0.853	80%	0.8	S	S	*	*			trans	-78.3	132.3	161.4	-171.9	0	0	0	0	109.7
7	V	29.4	Very low	26.7	Very low	118 Å²	118	148.6 Å²	148.6	72%	0.715	77%	0.769	S	S	*	*			trans	-110.3	129	175.1	172.7	0	0	0	0	107.3	R9	V7-R9 PolarHBondContact O-N 2.95Å
8	K	23.1	Very low	26.8	Very low	211 Å²	211	141.9 Å²	141.9	92%	0.917	74%	0.735	S	S	*	*			trans	-57.7	112.9	-179.4	-67.1	-170.1	174.9	-164.2	0	111.7
9	R	25.7	Very low	26.9	Very low	231 Å²	231	135.7 Å²	135.7	87%	0.872	70%	0.703	S	S	*	*			trans	-136.9	130.7	149.1	-74.1	-170.9	169.6	-172.6	-5.3	106.2	V7	V7-R9 PolarHBondContact O-N 2.95Å
10	G	23.3	Very low	27.1	Very low	79 Å²	79	129.2 Å²	129.2	81%	0.814	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-67.9	137.9	175	0	0	0	0	0	109.6
11	F	24	Very low	27.4	Very low	207 Å²	207	125.2 Å²	125.2	91%	0.908	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-77.6	129.8	163	-97.4	-109	0	0	0	107.8
12	R	22.1	Very low	27.3	Very low	206 Å²	206	116.9 Å²	116.9	78%	0.777	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-88.6	140.9	149.7	-79.5	179.9	158.4	-164.5	-13.4	106.5	S14	R12-S14 PolarHBondContact O-N 2.71Å; R12-S14 VanDerWaalsContact O-N 3.12Å
13	P	23.4	Very low	26.9	Very low	106 Å²	106	110.8 Å²	110.8	69%	0.688	57%	0.568	S	S	*	*			trans	-64.5	109.1	157.4	28.9	-30.8	0	0	0	107.2	H15	P13-H15 PolarHBondContact O-N 3.36Å
14	S	24.2	Very low	26.8	Very low	102 Å²	102	102 Å²	102	71%	0.713	54%	0.541	S	S	*	.			trans	-84.9	94.1	172.3	44.6	0	0	0	0	108.6	R12 T16	R12-S14 PolarHBondContact O-N 2.71Å; R12-S14 VanDerWaalsContact O-N 3.12Å; S14-T16 PolarHBondContact O-N 3.14Å; S14-T16 VanDerWaalsContact O-N 3.13Å
15	H	25.4	Very low	26.5	Very low	130 Å²	130	100.7 Å²	100.7	60%	0.602	52%	0.52	S	S	*	.			trans	-64.4	104.4	163.4	-71.2	-98	0	0	0	108.6	P13 H26	P13-H15 PolarHBondContact O-N 3.36Å; H15-H26 AromaticContact CE1-CD2 3.69Å; H15-H26 AromaticContact CE1-NE2 3.94Å
16	T	24.8	Very low	26.6	Very low	70 Å²	70	96.2 Å²	96.2	43%	0.429	51%	0.509	S	S	.	.			trans	171.7	160	165.9	17.4	0	0	0	0	106.7	S14 E456	S14-T16 PolarHBondContact O-N 3.14Å; S14-T16 VanDerWaalsContact O-N 3.13Å; T16-E456 HydrophobicContact CG2-CG 4.23Å
17	S	26.1	Very low	26.4	Very low	39 Å²	39	93.2 Å²	93.2	27%	0.273	50%	0.498	S	S	.	.	S	Bend	trans	88.8	71.1	174	-160.2	0	0	0	0	116.4	T438 D439 E459	S17-T438 VanDerWaalsContact OG-C 3.28Å; S17-T438 PolarHBondContact OG-O 2.8Å; S17-T438 VanDerWaalsContact OG-O 3.13Å; S17-T438 PolarHBondContact OG-OG1 2.85Å; S17-D439 PolarHBondContact OG-N 3.13Å; S17-E459 PolarHBondContact N-OE2 3.03Å
18	V	29.5	Very low	26.2	Very low	27 Å²	27	96.8 Å²	96.8	16%	0.164	51%	0.507	C	S	.	.			trans	87.2	78.8	131.2	179.3	0	0	0	0	115.3	T20 T438 C440 E459 L905	V18-T20 VanDerWaalsContact C-N 3.28Å; V18-T20 WeakPolarHBondContact CG1-OG1 3.2Å; V18-T20 PolarHBondContact O-N 3.01Å; V18-T20 PolarHBondContact O-OG1 2.82Å; V18-T438 WeakPolarHBondContact CB-O 2.99Å; V18-T438 WeakPolarHBondContact CG2-O 3.39Å; V18-C440 HydrophobicContact CB-CB 4.3Å; V18-C440 HydrophobicContact CG1-CB 4.1Å; V18-C440 HydrophobicContact CG2-CB 3.25Å; V18-E459 PolarHBondContact N-OE1 2.87Å; V18-E459 VanDerWaalsContact N-OE1 3.09Å; V18-L905 HydrophobicContact CG1-CD1 3.93Å
19	Q	29.1	Very low	26.3	Very low	25 Å²	25	91.2 Å²	91.2	12%	0.117	49%	0.493	C	S	.	.			trans	-67.7	71.5	-178.4	-57.5	162.7	-62.9	0	0	113.8	V23 N463 N699	Q19-V23 HydrophobicContact CB-CG2 3.68Å; Q19-V23 HydrophobicContact CG-CG2 4.35Å; Q19-N463 PolarHBondContact NE2-OD1 3.02Å; Q19-N699 PolarHBondContact O-ND2 3.09Å; Q19-N699 VanDerWaalsContact O-ND2 3.1Å
20	T	30.1	Very low	26.3	Very low	5 Å²	5	84.6 Å²	84.6	3%	0.031	49%	0.488	C	S	.	.	S	Bend	trans	-115.5	23.1	-176	-38.3	0	0	0	0	111.9	V18 N699 F702 L921 W923	V18-T20 VanDerWaalsContact C-N 3.28Å; V18-T20 WeakPolarHBondContact CG1-OG1 3.2Å; V18-T20 PolarHBondContact O-N 3.01Å; V18-T20 PolarHBondContact O-OG1 2.82Å; T20-N699 WeakPolarHBondContact CG2-OD1 3.26Å; T20-N699 PolarHBondContact OG1-ND2 3.4Å; T20-F702 HydrophobicContact CG2-CD1 3.69Å; T20-F702 HydrophobicContact CG2-CE1 3.37Å; T20-F702 HydrophobicContact CG2-CZ 4.08Å; T20-F702 WeakPolarHBondContact O-CE1 3.35Å; T20-L921 HydrophobicContact CG2-CD2 3.64Å; T20-W923 HydrophobicContact CG2-CZ2 3.77Å
21	M	32.5	Very low	26.4	Very low	46 Å²	46	85.1 Å²	85.1	23%	0.227	49%	0.485	C	S	.	.	S	Bend	trans	-153.1	-39.4	171.8	-109.9	155.7	-69.9	0	0	113.5	V413 T415 H728 W923	M21-V413 HydrophobicContact CE-CB 4.41Å; M21-V413 HydrophobicContact CE-CG1 4.04Å; M21-V413 HydrophobicContact CE-CG2 4.07Å; M21-V413 HydrophobicContact SD-CB 3.8Å; M21-V413 HydrophobicContact SD-CG1 3.46Å; M21-V413 WeakPolarHBondContact SD-CG1 3.39Å; M21-V413 HydrophobicContact SD-CG2 4.08Å; M21-T415 HydrophobicContact CG-CG2 3.74Å; M21-T415 HydrophobicContact SD-CG2 3.67Å; M21-H728 WeakPolarHBondContact CB-NE2 3.37Å; M21-H728 HydrophobicContact CE-CB 4.36Å; M21-H728 HydrophobicContact SD-CB 4.2Å; M21-H728 PolarHBondContact SD-CD2 3.42Å; M21-W923 HydrophobicContact CE-CH2 4.02Å
22	L	28.9	Very low	26.4	Very low	40 Å²	40	80.3 Å²	80.3	21%	0.209	47%	0.473	C	S	.	.			trans	-134.3	159.5	162.2	-73.9	92.1	0	0	0	109.6	T24 D720 E723	L22-T24 HydrophobicContact CB-CG2 4.44Å; L22-D720 HydrophobicContact CD2-CB 4.21Å; L22-E723 HydrophobicContact CD1-CG 3.91Å; L22-E723 HydrophobicContact CD2-CB 3.9Å; L22-E723 HydrophobicContact CD2-CG 3.85Å
23	V	27.2	Very low	26.6	Very low	5 Å²	5	78.7 Å²	78.7	3%	0.03	48%	0.479	C	S	.	.			trans	-118.6	83.4	169.6	169.2	0	0	0	0	107	Q19 S25 F462 L466 L700 W716	Q19-V23 HydrophobicContact CB-CG2 3.68Å; Q19-V23 HydrophobicContact CG-CG2 4.35Å; V23-S25 PolarHBondContact O-N 3.37Å; V23-F462 HydrophobicContact CG1-CE1 4.15Å; V23-F462 HydrophobicContact CG2-CE1 4.38Å; V23-L466 HydrophobicContact CG1-CD1 3.37Å; V23-L700 HydrophobicContact CB-CD1 4.38Å; V23-L700 HydrophobicContact CG2-CD1 3.98Å; V23-W716 HydrophobicContact CB-CH2 4.13Å; V23-W716 HydrophobicContact CG1-CH2 4.38Å
24	T	27.7	Very low	26.8	Very low	56 Å²	56	81.3 Å²	81.3	34%	0.344	48%	0.48	S	S	.	.			trans	-71.3	89.8	-178.7	42.7	0	0	0	0	111.3	L22 H26	L22-T24 HydrophobicContact CB-CG2 4.44Å; T24-H26 VanDerWaalsContact C-N 3.35Å; T24-H26 PolarHBondContact O-N 3.21Å
25	S	27.1	Very low	26.9	Very low	45 Å²	45	84.5 Å²	84.5	32%	0.315	49%	0.489	S	S	.	.			trans	-71.5	93.1	161.6	58.9	0	0	0	0	108.9	V23 G27	V23-S25 PolarHBondContact O-N 3.37Å; S25-G27 VanDerWaalsContact C-N 3.29Å; S25-G27 PolarHBondContact O-N 3.02Å
26	H	25.9	Very low	27.2	Very low	150 Å²	150	87.8 Å²	87.8	69%	0.694	51%	0.505	S	S	*	.			trans	-67.8	87.5	171.5	-81.7	-98.3	0	0	0	110.3	H15 T24	H15-H26 AromaticContact CE1-CD2 3.69Å; H15-H26 AromaticContact CE1-NE2 3.94Å; T24-H26 VanDerWaalsContact C-N 3.35Å; T24-H26 PolarHBondContact O-N 3.21Å
27	G	25.9	Very low	27.3	Very low	60 Å²	60	93.3 Å²	93.3	62%	0.619	53%	0.525	S	S	*	.			trans	-123.4	120	162.4	0	0	0	0	0	108.7	S25 C29	S25-G27 VanDerWaalsContact C-N 3.29Å; S25-G27 PolarHBondContact O-N 3.02Å; G27-C29 PolarHBondContact O-N 3.31Å
28	E	25.1	Very low	27.4	Very low	192 Å²	192	99.6 Å²	99.6	90%	0.897	55%	0.553	S	S	*	*			trans	-74.7	70.2	-175.7	-66	-163.4	136.4	0	0	112.7	A30	E28-A30 VanDerWaalsContact C-N 3.26Å; E28-A30 PolarHBondContact O-N 3.22Å
29	C	24.7	Very low	27.3	Very low	94 Å²	94	102 Å²	102	64%	0.635	57%	0.565	S	S	*	*			trans	-70.5	88.3	161.3	-93.1	0	0	0	0	109.3	G27 A31	G27-C29 PolarHBondContact O-N 3.31Å; C29-A31 PolarHBondContact O-N 2.72Å
30	A	24.8	Very low	27.3	Very low	92 Å²	92	109.2 Å²	109.2	76%	0.76	60%	0.599	S	S	*	*			trans	-67.5	64	175.5	0	0	0	0	0	112.6	E28 T32	E28-A30 VanDerWaalsContact C-N 3.26Å; E28-A30 PolarHBondContact O-N 3.22Å; A30-T32 VanDerWaalsContact C-N 3.27Å; A30-T32 PolarHBondContact O-N 2.96Å
31	A	25.3	Very low	27.2	Very low	91 Å²	91	116.8 Å²	116.8	75%	0.752	64%	0.638	S	S	*	*			trans	-69.7	81.9	171.1	0	0	0	0	0	109.7	C29 N33	C29-A31 PolarHBondContact O-N 2.72Å; A31-N33 PolarHBondContact O-N 3.08Å
32	T	24.7	Very low	27.1	Very low	106 Å²	106	124 Å²	124	65%	0.65	67%	0.671	S	S	*	*			trans	-56.5	125.8	175.3	58.5	0	0	0	0	110.2	A30 K34	A30-T32 VanDerWaalsContact C-N 3.27Å; A30-T32 PolarHBondContact O-N 2.96Å; T32-K34 PolarHBondContact O-N 3.48Å
33	N	26.3	Very low	27.1	Very low	172 Å²	172	130.7 Å²	130.7	92%	0.92	70%	0.701	S	S	*	*	S	Bend	trans	-50.4	100	176.3	-81.6	-17.8	0	0	0	111.8	A31	A31-N33 PolarHBondContact O-N 3.08Å
34	K	26.9	Very low	27.2	Very low	160 Å²	160	135.4 Å²	135.4	70%	0.696	73%	0.73	S	S	*	*			trans	-145.1	-0.1	178.3	-80.4	-157.6	168.8	-170	0	115.5	T32 E36	T32-K34 PolarHBondContact O-N 3.48Å; K34-E36 VanDerWaalsContact C-N 3.31Å; K34-E36 PolarHBondContact O-N 3.46Å
35	D	27.2	Very low	27.5	Very low	170 Å²	170	142.4 Å²	142.4	91%	0.909	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	16.7	179.2	-69.8	-45	0	0	0	114.3
36	E	30.7	Very low	27.6	Very low	199 Å²	199	145 Å²	145	93%	0.93	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.9	11.7	167.7	-70.7	-156.8	150.7	0	0	114.7	K34	K34-E36 VanDerWaalsContact C-N 3.31Å; K34-E36 PolarHBondContact O-N 3.46Å
37	E	28.5	Very low	27.9	Very low	185 Å²	185	143.3 Å²	143.3	86%	0.864	79%	0.785	S	S	*	*	S	Bend	trans	-153	65.7	173.2	-146.6	-179.6	-132.3	0	0	115.4
38	M	27.1	Very low	28.2	Very low	171 Å²	171	150.3 Å²	150.3	84%	0.842	80%	0.799	S	S	*	*			trans	-152.5	85.2	162.5	-143	-169.3	78.2	0	0	113.9
39	N	27.1	Very low	28.6	Very low	79 Å²	79	146.9 Å²	146.9	42%	0.422	80%	0.796	S	S	.	*			trans	-150.7	42.1	175.4	-163.2	59.6	0	0	0	114.3	S1092	N39-S1092 WeakPolarHBondContact CB-OG 2.84Å; N39-S1092 VanDerWaalsContact CG-O 3.29Å; N39-S1092 PolarHBondContact ND2-O 3.07Å; N39-S1092 PolarHBondContact OD1-O 3.12Å
40	E	28.6	Very low	28.9	Very low	176 Å²	176	149.8 Å²	149.8	82%	0.822	81%	0.805	S	S	*	*			trans	-149.7	150.4	168.5	-118.1	174.6	-137.2	0	0	109.4
41	L	29.4	Very low	29.4	Very low	163 Å²	163	151 Å²	151	85%	0.853	81%	0.806	S	S	*	*			trans	64.5	92.2	174.7	-52.3	172.1	0	0	0	117.7
42	E	30.6	Very low	30.1	Very low	198 Å²	198	152.8 Å²	152.8	93%	0.925	81%	0.809	S	S	*	*				-171.6	111.4	102.4	-101.1	-162.2	168.4	0	0	112.6
43	E	27.8	Very low	30.3	Very low	180 Å²	180	158 Å²	158	84%	0.841	82%	0.823	S	S	*	*			trans	-92.4	149	158.4	-76.3	-161.3	116.8	0	0	111.2
44	T	30.3	Very low	30.8	Very low	105 Å²	105	155.6 Å²	155.6	64%	0.644	82%	0.819	S	S	*	*			trans	75.3	95.9	164.7	78.3	0	0	0	0	118.8
45	K	33.6	Very low	31	Very low	202 Å²	202	153.5 Å²	153.5	88%	0.878	83%	0.825	S	S	*	*				-179.6	149.6	96.6	-91.4	146.2	-159.9	126.1	0	113.5
46	A	29.6	Very low	31.4	Very low	101 Å²	101	151 Å²	151	84%	0.835	82%	0.82	S	S	*	*			trans	-117.5	131.8	176.5	0	0	0	0	0	112
47	S	32.9	Very low	31.4	Very low	114 Å²	114	145.8 Å²	145.8	80%	0.797	81%	0.806	S	S	*	*			trans	-159.2	92.5	163.6	58.9	0	0	0	0	114.6
48	K	30.3	Very low	31.6	Very low	206 Å²	206	145.9 Å²	145.9	90%	0.896	80%	0.804	S	S	*	*			trans	12.9	130.6	145.3	-58.7	171.3	179	175.1	0	119.8
49	S	34.3	Very low	31.8	Very low	120 Å²	120	147.1 Å²	147.1	84%	0.839	80%	0.804	S	S	*	*				-156.1	164.7	124.6	58.3	0	0	0	0	110.9
50	N	30.7	Very low	32	Very low	156 Å²	156	146.7 Å²	146.7	83%	0.834	81%	0.808	S	S	*	*			trans	-112.3	153.8	-163.4	-69.6	-17.2	0	0	0	114.2
51	P	35.9	Very low	32.2	Very low	118 Å²	118	145 Å²	145	77%	0.766	80%	0.804	S	S	*	*			trans	-89.6	167.7	167	38.1	-35.8	0	0	0	112.8
52	P	39.3	Very low	32.4	Very low	127 Å²	127	145.3 Å²	145.3	83%	0.825	80%	0.801	S	S	*	*			trans	-104.9	137.7	166	35.6	-27.8	0	0	0	113.3
53	K	29.3	Very low	32.3	Very low	217 Å²	217	141.6 Å²	141.6	94%	0.943	80%	0.796	S	S	*	*			trans	-114.1	154.1	157	-80.8	-173.5	175.5	-178.1	0	109.2
54	S	36.2	Very low	32.4	Very low	120 Å²	120	137 Å²	137	84%	0.839	80%	0.797	S	S	*	*			trans	-134	154.4	167.5	57.1	0	0	0	0	109.7
55	S	32.1	Very low	32.5	Very low	117 Å²	117	135.3 Å²	135.3	82%	0.818	80%	0.801	S	S	*	*			trans	-164.7	119	-170.2	57.2	0	0	0	0	114.2
56	S	34.5	Very low	32.6	Very low	116 Å²	116	134.8 Å²	134.8	81%	0.811	80%	0.801	S	S	*	*			trans	-166.9	165.4	163.6	50.4	0	0	0	0	111.5
57	S	30.7	Very low	32.7	Very low	90 Å²	90	135.1 Å²	135.1	63%	0.629	79%	0.793	S	S	*	*				174.7	158.4	-61.7	55.4	0	0	0	0	110.4
58	K	33.8	Very low	32.9	Very low	187 Å²	187	140.8 Å²	140.8	81%	0.813	80%	0.798	S	S	*	*			trans	84.9	119.2	168.8	-60.5	174	-176.7	176.9	0	113.9
59	K	31	Very low	33.1	Very low	197 Å²	197	139.2 Å²	139.2	86%	0.857	79%	0.794	S	S	*	*				78.2	145	78.5	-81.1	-160.7	169.5	-149	0	113.1
60	S	30.5	Very low	33.1	Very low	71 Å²	71	140.2 Å²	140.2	50%	0.497	79%	0.79	S	S	.	*			cis	-170.8	175.2	-15.3	45	0	0	0	0	109.2
61	D	34	Very low	33.5	Very low	140 Å²	140	140.1 Å²	140.1	75%	0.749	79%	0.789	S	S	*	*			trans	72.3	146.1	159.6	-35.1	-48	0	0	0	116.8
62	E	32.9	Very low	33.6	Very low	169 Å²	169	142.8 Å²	142.8	79%	0.79	79%	0.792	S	S	*	*			cis	-164.1	166	-18.4	-130.9	-176.6	-169.4	0	0	112
63	C	28.9	Very low	33.4	Very low	120 Å²	120	144.9 Å²	144.9	81%	0.811	79%	0.791	S	S	*	*			trans	60.8	131.3	154	-68.4	0	0	0	0	124.4
64	G	30.7	Very low	33.8	Very low	83 Å²	83	142.6 Å²	142.6	86%	0.856	79%	0.788	S	S	*	*				139.6	112.2	128.9	0	0	0	0	0	120.7
65	G	31.9	Very low	33.8	Very low	71 Å²	71	145.1 Å²	145.1	73%	0.732	79%	0.786	S	S	*	*			trans	92.2	102.6	161.2	0	0	0	0	0	116
66	E	34.5	Very low	34	Very low	190 Å²	190	147.8 Å²	147.8	89%	0.888	79%	0.792	S	S	*	*				69.7	98.6	76.7	-67.9	-179.7	-172	0	0	113.1
67	V	32.6	Very low	33.8	Very low	109 Å²	109	147.2 Å²	147.2	66%	0.661	79%	0.788	S	S	*	*				92.7	125.1	66.2	161.1	0	0	0	0	112.4
68	Y	36	Very low	33.8	Very low	233 Å²	233	151.6 Å²	151.6	91%	0.914	80%	0.798	S	S	*	*			trans	-163.1	151.4	130.2	-94.7	-67.3	0	0	0	108.9
69	E	34.5	Very low	33.7	Very low	172 Å²	172	150.2 Å²	150.2	80%	0.804	80%	0.799	S	S	*	*			trans	-114.3	-145.7	-167	-63.2	175.1	120.8	0	0	111.7
70	D	35.6	Very low	33.7	Very low	142 Å²	142	149.8 Å²	149.8	76%	0.759	80%	0.8	S	S	*	*			trans	85.3	102.4	-178	-48.1	2.7	0	0	0	113.2
71	D	38.8	Very low	33.8	Very low	153 Å²	153	153.1 Å²	153.1	82%	0.818	81%	0.812	S	S	*	*				88.7	142.7	65.3	-73.5	-16.8	0	0	0	112.3
72	E	37.6	Very low	33.6	Very low	174 Å²	174	153.2 Å²	153.2	81%	0.813	81%	0.813	S	S	*	*			cis	-137.2	161.9	10.9	-64	177.6	134.8	0	0	113.4
73	E	35.8	Very low	33.6	Very low	172 Å²	172	149.5 Å²	149.5	80%	0.804	81%	0.81	S	S	*	*			trans	12.4	138.6	148.3	-56.8	-177.3	167.6	0	0	123.7
74	L	37.1	Very low	33.7	Very low	169 Å²	169	149 Å²	149	89%	0.885	80%	0.804	S	S	*	*				-163.4	150.2	105.3	-105.1	171.7	0	0	0	112.4
75	E	35.6	Very low	33.9	Very low	173 Å²	173	146.9 Å²	146.9	81%	0.808	78%	0.782	S	S	*	*			trans	-92.5	148.2	-170.3	-56.3	177.5	120.1	0	0	113.9
76	D	37	Very low	34.3	Very low	173 Å²	173	154.8 Å²	154.8	93%	0.925	79%	0.79	S	S	*	*			trans	-159.7	121.9	137.5	-119	-24	0	0	0	108.2
77	S	29.6	Very low	34.4	Very low	104 Å²	104	156.4 Å²	156.4	73%	0.727	79%	0.787	S	S	*	*			trans	-138.4	129	-170.9	72.1	0	0	0	0	113.4
78	E	31.8	Very low	34.7	Very low	182 Å²	182	155.7 Å²	155.7	85%	0.85	78%	0.78	S	S	*	*			trans	-173.7	162.8	138.9	-109	177.5	-164.2	0	0	111.4
79	L	32.2	Very low	34.7	Very low	158 Å²	158	148.9 Å²	148.9	83%	0.827	76%	0.762	S	S	*	*			trans	72.1	47.1	171.7	-52.8	-177.9	0	0	0	119.5
80	E	29.3	Very low	34.8	Very low	188 Å²	188	146.2 Å²	146.2	88%	0.879	75%	0.75	S	S	*	*			trans	-81.2	124.5	140.2	-78.8	-157.5	138.8	0	0	109.8
81	N	34.4	Very low	35.2	Very low	140 Å²	140	142.2 Å²	142.2	75%	0.749	74%	0.741	S	S	*	*			trans	-161.9	99.1	161.7	-111.5	-69.3	0	0	0	113
82	N	29.5	Very low	35.6	Very low	143 Å²	143	138.8 Å²	138.8	77%	0.765	72%	0.723	S	S	*	*			trans	51.8	90.4	144.6	-59.6	-44.7	0	0	0	120.1
83	A	32.6	Very low	35.9	Very low	90 Å²	90	131.6 Å²	131.6	74%	0.744	69%	0.69	S	S	*	*			trans	-152	89	147.6	0	0	0	0	0	110.7	G85	A83-G85 PolarHBondContact O-N 3.38Å
84	T	30.7	Very low	36.4	Very low	111 Å²	111	127.6 Å²	127.6	68%	0.681	67%	0.674	S	S	*	*			trans	-80.8	36.2	-173.2	27.9	0	0	0	0	115.3	R86 D484	T84-R86 PolarHBondContact O-N 3.23Å; T84-D484 PolarHBondContact OG1-OD2 3.14Å
85	G	34	Very low	36.9	Very low	37 Å²	37	120.1 Å²	120.1	38%	0.381	64%	0.635	S	S	.	*			trans	-68.8	116.1	173.2	0	0	0	0	0	112	A83 R87	A83-G85 PolarHBondContact O-N 3.38Å; G85-R87 PolarHBondContact O-N 2.96Å; G85-R87 VanDerWaalsContact O-N 3.09Å
86	R	41	Very low	37.2	Very low	238 Å²	238	116.8 Å²	116.8	90%	0.898	62%	0.623	S	S	*	*			trans	14.4	78.3	167.8	-162.5	179.7	-170.9	-176.6	0.7	115.6	T84 L88	T84-R86 PolarHBondContact O-N 3.23Å; R86-L88 PolarHBondContact O-N 3.38Å; R86-L88 VanDerWaalsContact O-N 3.1Å
87	R	37.4	Very low	37.5	Very low	223 Å²	223	112.4 Å²	112.4	84%	0.842	60%	0.6	S	S	*	*			trans	-54.4	113.9	176	-174.6	-170.9	-125.9	-171.5	5.1	110.7	G85 V89	G85-R87 PolarHBondContact O-N 2.96Å; G85-R87 VanDerWaalsContact O-N 3.09Å; R87-V89 PolarHBondContact O-N 2.99Å
88	L	38.7	Very low	38	Very low	95 Å²	95	109 Å²	109	50%	0.497	58%	0.578	S	S	.	*			trans	-56.1	125.1	165.5	-68.8	167.2	0	0	0	109	R86 D92 I93	R86-L88 PolarHBondContact O-N 3.38Å; R86-L88 VanDerWaalsContact O-N 3.1Å; L88-D92 HydrophobicContact CD2-CB 4.38Å; L88-I93 HydrophobicContact CD1-CD1 3.92Å; L88-I93 HydrophobicContact CD2-CD1 4.13Å; L88-I93 HydrophobicContact CD2-CG1 4.48Å
89	V	35.3	Very low	38.4	Very low	90 Å²	90	105.3 Å²	105.3	55%	0.545	56%	0.561	S	S	.	*			trans	-93.5	149.2	-180	-170.3	0	0	0	0	109.2	R87 G91 D92	R87-V89 PolarHBondContact O-N 2.99Å; V89-G91 PolarHBondContact O-N 3.05Å; V89-D92 WeakPolarHBondContact CB-OD2 3.44Å; V89-D92 PolarHBondContact N-OD2 3.32Å; V89-D92 PolarHBondContact O-N 3.4Å
90	E	36.5	Very low	38.6	Very low	116 Å²	116	102.1 Å²	102.1	54%	0.542	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56	104.7	165.9	-88.6	157.6	93.6	0	0	108.1	K506 Q510	E90-K506 IonicContact OE2-NZ 3.76Å; E90-K506 PolarHBondContact OE2-NZ 3.15Å; E90-Q510 PolarHBondContact OE1-NE2 2.78Å
91	G	43.9	Very low	38.8	Very low	57 Å²	57	100.6 Å²	100.6	59%	0.588	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	124.4	-12	-172.2	0	0	0	0	0	116.6	V89	V89-G91 PolarHBondContact O-N 3.05Å
92	D	46.7	Very low	38.6	Very low	81 Å²	81	97.4 Å²	97.4	43%	0.433	53%	0.533	S	S	.	.	S	Bend	trans	-82.2	-21.1	174.4	-72.1	-46.8	0	0	0	113	L88 V89 K476	L88-D92 HydrophobicContact CD2-CB 4.38Å; V89-D92 WeakPolarHBondContact CB-OD2 3.44Å; V89-D92 PolarHBondContact N-OD2 3.32Å; V89-D92 PolarHBondContact O-N 3.4Å; D92-K476 PolarHBondContact O-NZ 2.93Å
93	I	45.8	Very low	38.9	Very low	24 Å²	24	95.2 Å²	95.2	12%	0.123	54%	0.535	C	S	.	.			trans	-136.1	90.2	178.4	-52.6	175.7	0	0	0	107.5	L88 V95 Y503	L88-I93 HydrophobicContact CD1-CD1 3.92Å; L88-I93 HydrophobicContact CD2-CD1 4.13Å; L88-I93 HydrophobicContact CD2-CG1 4.48Å; I93-V95 HydrophobicContact CG2-CG2 4.38Å; I93-V95 PolarHBondContact O-N 3.48Å; I93-Y503 PolarHBondContact O-OH 2.7Å
94	D	45	Very low	38.9	Very low	87 Å²	87	99.9 Å²	99.9	47%	0.465	54%	0.542	S	S	.	.			trans	-68.2	119.8	153.8	-87	-49.1	0	0	0	107	D96 D97	D94-D96 VanDerWaalsContact C-N 3.27Å; D94-D97 HydrophobicContact CB-CB 4.23Å
95	V	47.1	Very low	39.2	Very low	12 Å²	12	101.4 Å²	101.4	7%	0.073	55%	0.545	C	S	.	.	H	α-helix	trans	-73	-33.5	174	-179.4	0	0	0	0	108.7	I93 D97 A98 E99 Y503	I93-V95 HydrophobicContact CG2-CG2 4.38Å; I93-V95 PolarHBondContact O-N 3.48Å; V95-D97 PolarHBondContact O-N 2.75Å; V95-A98 CarbonylContact O-C 3.53Å; V95-A98 WeakPolarHBondContact O-CA 3.34Å; V95-A98 WeakPolarHBondContact O-CB 3.43Å; V95-A98 PolarHBondContact O-N 2.86Å; V95-E99 PolarHBondContact O-N 2.87Å; V95-Y503 HydrophobicContact CG2-CE1 3.79Å
96	D	43.3	Very low	39	Very low	104 Å²	104	107.7 Å²	107.7	56%	0.556	57%	0.565	S	S	*	*	H	α-helix	trans	-56.6	-29.3	173.5	-55	38.3	0	0	0	112.7	D94 E99 S100	D94-D96 VanDerWaalsContact C-N 3.27Å; D96-E99 CarbonylContact O-C 3.51Å; D96-E99 PolarHBondContact O-N 2.97Å; D96-S100 WeakPolarHBondContact O-CB 3.3Å; D96-S100 PolarHBondContact O-N 2.86Å
97	D	41.9	Very low	38.4	Very low	81 Å²	81	101.3 Å²	101.3	43%	0.433	55%	0.554	S	S	.	*	H	α-helix	trans	-64.1	-42.8	170.4	-85.5	-9.8	0	0	0	110.8	D94 V95 E99 S100 E101	D94-D97 HydrophobicContact CB-CB 4.23Å; V95-D97 PolarHBondContact O-N 2.75Å; D97-E99 VanDerWaalsContact C-N 3.31Å; D97-S100 WeakPolarHBondContact O-CA 3.42Å; D97-S100 WeakPolarHBondContact O-CB 3.47Å; D97-S100 PolarHBondContact O-N 2.78Å; D97-S100 VanDerWaalsContact O-N 3.09Å; D97-S100 PolarHBondContact O-OG 2.97Å; D97-E101 PolarHBondContact O-N 3.46Å; D97-E101 VanDerWaalsContact O-N 3.11Å
98	A	40.6	Very low	38.3	Very low	33 Å²	33	96.3 Å²	96.3	27%	0.273	55%	0.548	S	S	.	.	H	α-helix	trans	-75.5	-19.2	175.7	0	0	0	0	0	112.9	V95 S102	V95-A98 CarbonylContact O-C 3.53Å; V95-A98 WeakPolarHBondContact O-CA 3.34Å; V95-A98 WeakPolarHBondContact O-CB 3.43Å; V95-A98 PolarHBondContact O-N 2.86Å; A98-S102 PolarHBondContact O-N 3.44Å
99	E	40.6	Very low	37.9	Very low	103 Å²	103	100.5 Å²	100.5	48%	0.481	57%	0.565	S	S	.	*	H	α-helix	trans	-77.8	-25.3	165	-62.3	-179.5	-171.7	0	0	111.1	V95 D96 D97 S102 R464	V95-E99 PolarHBondContact O-N 2.87Å; D96-E99 CarbonylContact O-C 3.51Å; D96-E99 PolarHBondContact O-N 2.97Å; D97-E99 VanDerWaalsContact C-N 3.31Å; E99-S102 VanDerWaalsContact O-CB 3.28Å; E99-S102 WeakPolarHBondContact O-CB 3.28Å; E99-S102 PolarHBondContact O-N 3.47Å; E99-S102 PolarHBondContact O-OG 3.35Å; E99-R464 IonicContact OE1-NH1 2.97Å
100	S	36.3	Very low	37.8	Very low	91 Å²	91	103.9 Å²	103.9	64%	0.636	58%	0.575	S	S	*	*	H	α-helix	trans	-79.6	-21.2	174.7	83	0	0	0	0	114.7	D96 D97	D96-S100 WeakPolarHBondContact O-CB 3.3Å; D96-S100 PolarHBondContact O-N 2.86Å; D97-S100 WeakPolarHBondContact O-CA 3.42Å; D97-S100 WeakPolarHBondContact O-CB 3.47Å; D97-S100 PolarHBondContact O-N 2.78Å; D97-S100 VanDerWaalsContact O-N 3.09Å; D97-S100 PolarHBondContact O-OG 2.97Å
101	E	33.3	Very low	37.8	Very low	156 Å²	156	106.3 Å²	106.3	73%	0.729	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	14.5	162.9	-70.2	-172.8	156.9	0	0	112.1	D97 A103	D97-E101 PolarHBondContact O-N 3.46Å; D97-E101 VanDerWaalsContact O-N 3.11Å; E101-A103 PolarHBondContact O-N 3.31Å
102	S	31.3	Very low	37.3	Very low	73 Å²	73	107.4 Å²	107.4	51%	0.51	58%	0.583	S	S	.	*	S	Bend	trans	-71.5	127.2	162.2	77.7	0	0	0	0	108.9	A98 E99 E104	A98-S102 PolarHBondContact O-N 3.44Å; E99-S102 VanDerWaalsContact O-CB 3.28Å; E99-S102 WeakPolarHBondContact O-CB 3.28Å; E99-S102 PolarHBondContact O-N 3.47Å; E99-S102 PolarHBondContact O-OG 3.35Å; S102-E104 PolarHBondContact O-N 3.47Å
103	A	35.5	Very low	37.3	Very low	98 Å²	98	111.5 Å²	111.5	81%	0.81	60%	0.6	S	S	*	*			trans	-74.9	92	-165.4	0	0	0	0	0	112.7	E101 D105	E101-A103 PolarHBondContact O-N 3.31Å; A103-D105 PolarHBondContact O-N 3.45Å
104	E	32.4	Very low	37.7	Very low	188 Å²	188	116.6 Å²	116.6	88%	0.879	63%	0.627	S	S	*	*			trans	-66.8	73.1	160.6	-78.6	-155.9	151.8	0	0	110.9	S102 E106	S102-E104 PolarHBondContact O-N 3.47Å; E104-E106 PolarHBondContact O-N 2.95Å
105	D	36.4	Very low	39.1	Very low	142 Å²	142	117 Å²	117	76%	0.759	63%	0.633	S	S	*	*			trans	40.7	42.9	164.1	-94.1	-16.2	0	0	0	114.5	A103 P107	A103-D105 PolarHBondContact O-N 3.45Å; D105-P107 WeakPolarHBondContact O-CD 3.22Å
106	E	29.7	Very low	40.9	Very low	170 Å²	170	118 Å²	118	79%	0.794	64%	0.638	S	S	*	*			trans	-56.5	117.2	161	-92.1	-69.6	173.7	0	0	105.4	E104 V108	E104-E106 PolarHBondContact O-N 2.95Å; E106-V108 PolarHBondContact O-N 2.97Å
107	P	28.2	Very low	43.2	Very low	103 Å²	103	116.1 Å²	116.1	67%	0.669	63%	0.63	S	S	*	*			trans	-67.3	109.5	-168.6	26	-33.3	0	0	0	107.5	D105 E109	D105-P107 WeakPolarHBondContact O-CD 3.22Å; P107-E109 PolarHBondContact O-N 3.18Å
108	V	35	Very low	45.6	Very low	118 Å²	118	116.7 Å²	116.7	72%	0.715	64%	0.638	S	S	*	*			trans	-42.4	110.1	169.9	178.2	0	0	0	0	106.9	E106 E110	E106-V108 PolarHBondContact O-N 2.97Å; V108-E110 VanDerWaalsContact C-N 3.33Å; V108-E110 PolarHBondContact O-N 3.32Å
109	E	30.4	Very low	48.2	Very low	183 Å²	183	115.5 Å²	115.5	86%	0.855	63%	0.629	S	S	*	*			trans	-62.7	106.2	169.7	-76.7	-151.1	155.9	0	0	104.7	P107 E111	P107-E109 PolarHBondContact O-N 3.18Å; E109-E111 VanDerWaalsContact C-N 3.29Å; E109-E111 PolarHBondContact O-N 3.29Å
110	E	33.2	Very low	50.8	Low	161 Å²	161	112 Å²	112	75%	0.752	61%	0.612	S	S	*	*			trans	-55.4	94.9	178.5	-70.8	179.5	157	0	0	107.8	V108 P112	V108-E110 VanDerWaalsContact C-N 3.33Å; V108-E110 PolarHBondContact O-N 3.32Å; E110-P112 WeakPolarHBondContact O-CA 3.44Å; E110-P112 WeakPolarHBondContact O-CD 3.33Å
111	E	36.6	Very low	53.5	Low	168 Å²	168	111.1 Å²	111.1	79%	0.785	60%	0.597	S	S	*	*			trans	-52.8	106.4	-179.6	-107.5	-72.3	-177.6	0	0	107.7	E109 E113	E109-E111 VanDerWaalsContact C-N 3.29Å; E109-E111 PolarHBondContact O-N 3.29Å; E111-E113 PolarHBondContact O-N 2.97Å
112	P	34.7	Very low	56.4	Low	79 Å²	79	103.9 Å²	103.9	51%	0.513	56%	0.563	S	S	.	*			trans	-56.3	105.2	-136.2	4.9	-23.2	0	0	0	114.2	E110 D114 T115	E110-P112 WeakPolarHBondContact O-CA 3.44Å; E110-P112 WeakPolarHBondContact O-CD 3.33Å; P112-D114 PolarHBondContact O-N 3.46Å; P112-T115 HydrophobicContact CB-CG2 3.93Å; P112-T115 HydrophobicContact CG-CG2 3.97Å; P112-T115 WeakPolarHBondContact O-CG2 3.43Å; P112-T115 PolarHBondContact O-N 3.4Å; P112-T115 VanDerWaalsContact O-N 3.15Å
113	E	46.1	Very low	59.4	Low	168 Å²	168	100.4 Å²	100.4	79%	0.785	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	24.6	-162.8	-90.7	-136.8	121.6	0	0	116.8	E111	E111-E113 PolarHBondContact O-N 2.97Å
114	D	54.6	Low	62.1	Low	130 Å²	130	100.3 Å²	100.3	70%	0.695	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.6	25	164.2	-121.4	-8.2	0	0	0	115	P112 L116 K121	P112-D114 PolarHBondContact O-N 3.46Å; D114-L116 PolarHBondContact O-N 3.08Å; D114-K121 IonicContact OD1-NZ 3.62Å; D114-K121 PolarHBondContact OD1-NZ 2.63Å
115	T	74.4	Confident	64.8	Low	97 Å²	97	94.7 Å²	94.7	60%	0.595	50%	0.497	S	S	*	.			trans	-70	-12.6	179.2	65.1	0	0	0	0	115.6	P112	P112-T115 HydrophobicContact CB-CG2 3.93Å; P112-T115 HydrophobicContact CG-CG2 3.97Å; P112-T115 WeakPolarHBondContact O-CG2 3.43Å; P112-T115 PolarHBondContact O-N 3.4Å; P112-T115 VanDerWaalsContact O-N 3.15Å
116	L	84.8	Confident	67.4	Low	33 Å²	33	88.2 Å²	88.2	17%	0.173	46%	0.463	C	S	.	.	S	Bend	trans	-102.2	130.3	-177.6	-62.3	-179	0	0	0	112.2	D114 E120 K121 K131	D114-L116 PolarHBondContact O-N 3.08Å; L116-E120 HydrophobicContact CB-CB 4.02Å; L116-E120 HydrophobicContact CD2-CB 4.19Å; L116-K121 HydrophobicContact CB-CG 3.82Å; L116-K121 WeakPolarHBondContact O-CE 3.43Å; L116-K131 VanDerWaalsContact CD2-CE 3.45Å
117	T	91.2	Very high	70.3	Confident	63 Å²	63	83 Å²	83	39%	0.387	44%	0.436	S	S	.	.			trans	-63.9	159.7	174.4	64	0	0	0	0	111.8	A119 E120 K121	T117-A119 PolarHBondContact O-N 2.86Å; T117-E120 VanDerWaalsContact CB-OE2 3.24Å; T117-E120 WeakPolarHBondContact CB-OE2 3.43Å; T117-E120 VanDerWaalsContact CG2-OE2 3.29Å; T117-E120 WeakPolarHBondContact CG2-OE2 3.14Å; T117-E120 PolarHBondContact N-OE2 3.29Å; T117-E120 PolarHBondContact O-N 2.97Å; T117-E120 WeakPolarHBondContact OG1-CG 3.5Å; T117-E120 PolarHBondContact OG1-N 2.85Å; T117-E120 PolarHBondContact OG1-OE2 2.82Å; T117-K121 PolarHBondContact O-N 2.69Å
118	P	93.3	Very high	73.4	Confident	94 Å²	94	78.2 Å²	78.2	61%	0.61	41%	0.405	S	S	*	.	H	α-helix	trans	-54.3	-30.6	176.4	-28.6	36.2	0	0	0	114.2	A122 L164	P118-A122 VanDerWaalsContact O-CB 3.27Å; P118-A122 WeakPolarHBondContact O-CB 3.49Å; P118-A122 PolarHBondContact O-N 2.64Å; P118-L164 HydrophobicContact CB-CD1 4.26Å; P118-L164 HydrophobicContact CB-CD2 4.36Å
119	A	95.1	Very high	76.2	Confident	8 Å²	8	74.8 Å²	74.8	7%	0.066	39%	0.385	C	S	.	.	H	α-helix	trans	-72.2	-40.3	176.4	0	0	0	0	0	112.5	T117 A122 S123 N160 L161 L164	T117-A119 PolarHBondContact O-N 2.86Å; A119-A122 PolarHBondContact O-N 3.34Å; A119-S123 PolarHBondContact O-N 3.35Å; A119-N160 HydrophobicContact CB-CB 3.91Å; A119-N160 WeakPolarHBondContact O-CB 3.3Å; A119-L161 HydrophobicContact CB-CD2 4.27Å; A119-L164 HydrophobicContact CB-CD2 4.31Å
120	E	95.1	Very high	79.2	Confident	28 Å²	28	66.6 Å²	66.6	13%	0.131	35%	0.348	C	S	.	.	H	α-helix	trans	-66.5	-45.3	173.9	-73.2	163.6	108.6	0	0	111.5	L116 T117 A122 S123 Q124 A130 K131	L116-E120 HydrophobicContact CB-CB 4.02Å; L116-E120 HydrophobicContact CD2-CB 4.19Å; T117-E120 VanDerWaalsContact CB-OE2 3.24Å; T117-E120 WeakPolarHBondContact CB-OE2 3.43Å; T117-E120 VanDerWaalsContact CG2-OE2 3.29Å; T117-E120 WeakPolarHBondContact CG2-OE2 3.14Å; T117-E120 PolarHBondContact N-OE2 3.29Å; T117-E120 PolarHBondContact O-N 2.97Å; T117-E120 WeakPolarHBondContact OG1-CG 3.5Å; T117-E120 PolarHBondContact OG1-N 2.85Å; T117-E120 PolarHBondContact OG1-OE2 2.82Å; E120-A122 VanDerWaalsContact C-N 3.28Å; E120-A122 PolarHBondContact O-N 3.14Å; E120-S123 VanDerWaalsContact O-CB 3.28Å; E120-S123 WeakPolarHBondContact O-CB 3.25Å; E120-S123 PolarHBondContact O-N 2.95Å; E120-Q124 PolarHBondContact O-N 2.95Å; E120-Q124 VanDerWaalsContact O-N 3.08Å; E120-A130 HydrophobicContact CB-CB 3.87Å; E120-A130 HydrophobicContact CG-CB 4.13Å; E120-K131 WeakPolarHBondContact OE1-CE 3.15Å; E120-K131 IonicContact OE1-NZ 3.75Å
121	K	92.5	Very high	82	Confident	74 Å²	74	65.2 Å²	65.2	32%	0.322	34%	0.34	S	S	.	.	H	α-helix	trans	-59	-39.4	173.3	-65.5	-168.7	174.9	-170.9	0	111.3	D114 L116 T117 S123 Q124 I125	D114-K121 IonicContact OD1-NZ 3.62Å; D114-K121 PolarHBondContact OD1-NZ 2.63Å; L116-K121 HydrophobicContact CB-CG 3.82Å; L116-K121 WeakPolarHBondContact O-CE 3.43Å; T117-K121 PolarHBondContact O-N 2.69Å; K121-S123 PolarHBondContact O-N 3.39Å; K121-Q124 PolarHBondContact O-N 3.36Å; K121-I125 WeakPolarHBondContact O-CG1 3.47Å; K121-I125 PolarHBondContact O-N 2.84Å
122	A	94.5	Very high	84.8	Confident	3 Å²	3	63.1 Å²	63.1	3%	0.025	33%	0.33	C	S	.	.	H	α-helix	trans	-67.2	-32.3	174.4	0	0	0	0	0	113.5	P118 A119 E120 I125 C126 C163 L164	P118-A122 VanDerWaalsContact O-CB 3.27Å; P118-A122 WeakPolarHBondContact O-CB 3.49Å; P118-A122 PolarHBondContact O-N 2.64Å; A119-A122 PolarHBondContact O-N 3.34Å; E120-A122 VanDerWaalsContact C-N 3.28Å; E120-A122 PolarHBondContact O-N 3.14Å; A122-I125 PolarHBondContact O-N 2.77Å; A122-C126 WeakPolarHBondContact O-CB 3.28Å; A122-C126 PolarHBondContact O-N 3.25Å; A122-C163 HydrophobicContact CB-CB 4.27Å; A122-L164 VanDerWaalsContact CB-CA 3.45Å; A122-L164 HydrophobicContact CB-CB 3.87Å; A122-L164 HydrophobicContact CB-CD1 4.06Å
123	S	94.8	Very high	87.7	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.3	-45.7	171	-170.5	0	0	0	0	111.2	A119 E120 K121 I125 C126 R127 L128 R159 N160	A119-S123 PolarHBondContact O-N 3.35Å; E120-S123 VanDerWaalsContact O-CB 3.28Å; E120-S123 WeakPolarHBondContact O-CB 3.25Å; E120-S123 PolarHBondContact O-N 2.95Å; K121-S123 PolarHBondContact O-N 3.39Å; S123-I125 PolarHBondContact O-N 2.9Å; S123-C126 CarbonylContact O-C 3.36Å; S123-C126 WeakPolarHBondContact O-CA 3.15Å; S123-C126 WeakPolarHBondContact O-CB 3.37Å; S123-C126 PolarHBondContact O-N 3.24Å; S123-C126 VanDerWaalsContact O-N 3.1Å; S123-R127 PolarHBondContact O-N 3Å; S123-R127 VanDerWaalsContact O-N 3.11Å; S123-L128 CarbonylContact C-O 3.33Å; S123-L128 VanDerWaalsContact C-O 3.25Å; S123-L128 PolarHBondContact O-N 3Å; S123-L128 WeakPolarHBondContact OG-CB 3.38Å; S123-L128 PolarHBondContact OG-O 2.93Å; S123-R159 PolarHBondContact OG-NH2 3.41Å; S123-N160 WeakPolarHBondContact CB-OD1 3.36Å; S123-N160 PolarHBondContact OG-OD1 3.07Å
124	Q	91.1	Very high	90	Very high	96 Å²	96	53.7 Å²	53.7	45%	0.449	28%	0.282	S	S	.	.	H	α-helix	trans	-63.7	-40	176.1	-69.4	173.6	-48.5	0	0	112.5	E120 K121 C126 R127 A130	E120-Q124 PolarHBondContact O-N 2.95Å; E120-Q124 VanDerWaalsContact O-N 3.08Å; K121-Q124 PolarHBondContact O-N 3.36Å; Q124-C126 PolarHBondContact O-N 3.07Å; Q124-R127 WeakPolarHBondContact O-CA 3.37Å; Q124-R127 PolarHBondContact O-N 2.97Å; Q124-A130 HydrophobicContact CG-CB 4.27Å
125	I	88.8	Confident	91.8	Very high	70 Å²	70	51.2 Å²	51.2	36%	0.359	28%	0.279	S	S	.	.	H	α-helix	trans	-62	-32.7	172.6	-70.5	165.8	0	0	0	111.6	K121 A122 S123 R127 A419	K121-I125 WeakPolarHBondContact O-CG1 3.47Å; K121-I125 PolarHBondContact O-N 2.84Å; A122-I125 PolarHBondContact O-N 2.77Å; S123-I125 PolarHBondContact O-N 2.9Å; I125-R127 PolarHBondContact O-N 3.47Å; I125-R127 PolarHBondContact O-NH1 3.42Å; I125-A419 WeakPolarHBondContact O-CA 3.45Å
126	C	91.5	Very high	92.6	Very high	6 Å²	6	50 Å²	50	4%	0.041	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-2.7	169.6	-75	0	0	0	0	113.9	A122 S123 Q124 C163 Y279	A122-C126 WeakPolarHBondContact O-CB 3.28Å; A122-C126 PolarHBondContact O-N 3.25Å; S123-C126 CarbonylContact O-C 3.36Å; S123-C126 WeakPolarHBondContact O-CA 3.15Å; S123-C126 WeakPolarHBondContact O-CB 3.37Å; S123-C126 PolarHBondContact O-N 3.24Å; S123-C126 VanDerWaalsContact O-N 3.1Å; Q124-C126 PolarHBondContact O-N 3.07Å; C126-C163 HydrophobicContact CB-CB 4.22Å; C126-Y279 WeakPolarHBondContact O-CD1 3.43Å
127	R	89.8	Confident	93	Very high	60 Å²	60	48.5 Å²	48.5	23%	0.226	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	47	-174.3	-55.4	161.7	-55.3	-62	-21.6	112.7	S123 Q124 I125 A419	S123-R127 PolarHBondContact O-N 3Å; S123-R127 VanDerWaalsContact O-N 3.11Å; Q124-R127 WeakPolarHBondContact O-CA 3.37Å; Q124-R127 PolarHBondContact O-N 2.97Å; I125-R127 PolarHBondContact O-N 3.47Å; I125-R127 PolarHBondContact O-NH1 3.42Å; R127-A419 HydrophobicContact CG-CB 4.41Å; R127-A419 PolarHBondContact NH1-O 2.57Å
128	L	93.2	Very high	93.1	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.021	25%	0.251	C	S	.	.			trans	-127.2	133	173.1	-76.6	167.8	0	0	0	110.6	S123 A130 F273 L274 Y279	S123-L128 CarbonylContact C-O 3.33Å; S123-L128 VanDerWaalsContact C-O 3.25Å; S123-L128 PolarHBondContact O-N 3Å; S123-L128 WeakPolarHBondContact OG-CB 3.38Å; S123-L128 PolarHBondContact OG-O 2.93Å; L128-A130 PolarHBondContact O-N 3.08Å; L128-F273 HydrophobicContact CD1-CE1 4Å; L128-F273 HydrophobicContact CD2-CE1 4Å; L128-F273 HydrophobicContact CD2-CZ 4.05Å; L128-L274 HydrophobicContact CD1-CD2 3.38Å; L128-Y279 HydrophobicContact CD1-CD1 3.94Å; L128-Y279 HydrophobicContact CD1-CD2 4.03Å; L128-Y279 HydrophobicContact CD1-CE1 4.2Å; L128-Y279 HydrophobicContact CD1-CE2 4.3Å; L128-Y279 HydrophobicContact CD1-CG 3.84Å; L128-Y279 HydrophobicContact CD2-CD1 4.45Å; L128-Y279 HydrophobicContact CD2-CE1 3.88Å; L128-Y279 HydrophobicContact CD2-CE2 3.97Å; L128-Y279 HydrophobicContact CG-CD1 3.94Å; L128-Y279 HydrophobicContact CG-CE1 3.76Å; L128-Y279 HydrophobicContact CG-CE2 4.39Å; L128-Y279 HydrophobicContact CG-CG 4.31Å
129	P	93.8	Very high	92.9	Very high	45 Å²	45	48.4 Å²	48.4	29%	0.292	25%	0.248	S	C	.	.			trans	-68.7	124.5	-171.1	30.3	-36.8	0	0	0	110.9	K131 E132 R159	P129-K131 VanDerWaalsContact C-N 3.31Å; P129-K131 PolarHBondContact O-N 3.41Å; P129-K131 VanDerWaalsContact O-N 3.13Å; P129-E132 HydrophobicContact CB-CG 3.76Å; P129-E132 HydrophobicContact CG-CG 3.82Å; P129-R159 PolarHBondContact O-NH2 3.4Å
130	A	93.5	Very high	92.6	Very high	11 Å²	11	48 Å²	48	9%	0.091	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-29.3	-159	0	0	0	0	0	115.7	E120 Q124 L128 I156 N160	E120-A130 HydrophobicContact CB-CB 3.87Å; E120-A130 HydrophobicContact CG-CB 4.13Å; Q124-A130 HydrophobicContact CG-CB 4.27Å; L128-A130 PolarHBondContact O-N 3.08Å; A130-I156 WeakPolarHBondContact O-CG2 3.16Å; A130-N160 PolarHBondContact O-ND2 2.78Å
131	K	93.8	Very high	92.6	Very high	133 Å²	133	46.7 Å²	46.7	58%	0.578	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-120.2	2.3	-167.1	-67.5	175.6	178.8	169.2	0	114.5	L116 E120 P129	L116-K131 VanDerWaalsContact CD2-CE 3.45Å; E120-K131 WeakPolarHBondContact OE1-CE 3.15Å; E120-K131 IonicContact OE1-NZ 3.75Å; P129-K131 VanDerWaalsContact C-N 3.31Å; P129-K131 PolarHBondContact O-N 3.41Å; P129-K131 VanDerWaalsContact O-N 3.13Å
132	E	94.4	Very high	92.6	Very high	124 Å²	124	45.4 Å²	45.4	58%	0.579	24%	0.238	S	C	*	.	S	Bend	trans	-141.1	177.8	-176	66.2	-160.5	163	0	0	111.6	P129 R159	P129-E132 HydrophobicContact CB-CG 3.76Å; P129-E132 HydrophobicContact CG-CG 3.82Å; E132-R159 PolarHBondContact O-NH1 2.78Å
133	L	95.2	Very high	92.5	Very high	37 Å²	37	45.9 Å²	45.9	19%	0.194	24%	0.24	C	C	.	.			trans	-92	138.3	177.8	-61	174.5	0	0	0	109.8	L144 K152 Y155 I156	L133-L144 HydrophobicContact CD1-CB 3.75Å; L133-L144 HydrophobicContact CD1-CD1 4.24Å; L133-L144 HydrophobicContact CD2-CD1 4.06Å; L133-K152 HydrophobicContact CD1-CG 4.28Å; L133-Y155 HydrophobicContact CD2-CD1 3.56Å; L133-Y155 HydrophobicContact CD2-CE1 3.67Å; L133-I156 HydrophobicContact CD2-CD1 4.09Å; L133-I156 HydrophobicContact CD2-CG1 3.9Å; L133-I156 HydrophobicContact CG-CD1 4.35Å
134	S	94.3	Very high	92.5	Very high	12 Å²	12	45.9 Å²	45.9	8%	0.084	24%	0.24	C	C	.	.			trans	-78.4	158.4	169.8	51.3	0	0	0	0	111.9	E136 E137 T138	S134-E136 PolarHBondContact O-N 3.09Å; S134-E137 PolarHBondContact N-OE2 3.33Å; S134-E137 WeakPolarHBondContact O-CA 3.28Å; S134-E137 WeakPolarHBondContact O-CB 3.4Å; S134-E137 PolarHBondContact O-N 2.81Å; S134-E137 VanDerWaalsContact OG-CD 3.26Å; S134-E137 WeakPolarHBondContact OG-CG 3.47Å; S134-E137 PolarHBondContact OG-OE2 3.46Å; S134-T138 PolarHBondContact O-N 2.66Å; S134-T138 VanDerWaalsContact O-N 3.1Å
135	A	92.2	Very high	92.4	Very high	77 Å²	77	46.5 Å²	46.5	64%	0.636	24%	0.242	S	C	*	.	H	α-helix	trans	-58.6	-35.4	179.4	0	0	0	0	0	112.1	E137 T138 Q139	A135-E137 VanDerWaalsContact C-N 3.3Å; A135-E137 PolarHBondContact O-N 3.38Å; A135-T138 PolarHBondContact O-N 3.38Å; A135-Q139 VanDerWaalsContact O-CB 3.32Å; A135-Q139 WeakPolarHBondContact O-CB 3.41Å; A135-Q139 PolarHBondContact O-N 3.39Å
136	E	91.5	Very high	92.5	Very high	73 Å²	73	48 Å²	48	34%	0.341	26%	0.26	S	S	.	.	H	α-helix	trans	-67.9	-26.6	175.4	-60.6	93.6	148.3	0	0	113.1	S134 L140 F273 Y277	S134-E136 PolarHBondContact O-N 3.09Å; E136-L140 WeakPolarHBondContact O-CB 3.37Å; E136-L140 PolarHBondContact O-N 3.04Å; E136-F273 HydrophobicContact CB-CE2 3.77Å; E136-F273 HydrophobicContact CB-CZ 4.28Å; E136-Y277 HydrophobicContact CB-CD2 4.45Å; E136-Y277 HydrophobicContact CB-CE1 4.19Å; E136-Y277 HydrophobicContact CB-CE2 4.02Å; E136-Y277 HydrophobicContact CG-CD1 4.46Å; E136-Y277 HydrophobicContact CG-CE1 4.12Å
137	E	94.1	Very high	92.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-76.6	-43.6	174.2	-68.9	175.5	118.1	0	0	111.1	S134 A135 Q139 L140 F141 Y155 R159 F273	S134-E137 PolarHBondContact N-OE2 3.33Å; S134-E137 WeakPolarHBondContact O-CA 3.28Å; S134-E137 WeakPolarHBondContact O-CB 3.4Å; S134-E137 PolarHBondContact O-N 2.81Å; S134-E137 VanDerWaalsContact OG-CD 3.26Å; S134-E137 WeakPolarHBondContact OG-CG 3.47Å; S134-E137 PolarHBondContact OG-OE2 3.46Å; A135-E137 VanDerWaalsContact C-N 3.3Å; A135-E137 PolarHBondContact O-N 3.38Å; E137-Q139 VanDerWaalsContact C-N 3.32Å; E137-L140 PolarHBondContact O-N 3.21Å; E137-F141 WeakPolarHBondContact O-CA 3.44Å; E137-F141 WeakPolarHBondContact O-CB 3.16Å; E137-F141 PolarHBondContact O-N 3.42Å; E137-Y155 HydrophobicContact CG-CE1 4.47Å; E137-Y155 WeakPolarHBondContact OE1-CE1 3.36Å; E137-Y155 VanDerWaalsContact OE1-CZ 3.27Å; E137-Y155 PolarHBondContact OE1-OH 3.28Å; E137-R159 WeakPolarHBondContact OE1-CD 3.18Å; E137-R159 IonicContact OE1-NH1 3.96Å; E137-R159 IonicContact OE2-CZ 3.9Å; E137-R159 IonicContact OE2-NH1 2.79Å; E137-R159 PolarHBondContact OE2-NH1 2.83Å; E137-F273 HydrophobicContact CB-CE2 4.4Å; E137-F273 HydrophobicContact CG-CD1 3.75Å; E137-F273 HydrophobicContact CG-CD2 3.75Å; E137-F273 HydrophobicContact CG-CE1 3.4Å; E137-F273 VanDerWaalsContact CG-CE1 3.4Å; E137-F273 HydrophobicContact CG-CE2 3.4Å; E137-F273 VanDerWaalsContact CG-CE2 3.4Å; E137-F273 HydrophobicContact CG-CG 3.94Å; E137-F273 HydrophobicContact CG-CZ 3.23Å; E137-F273 WeakPolarHBondContact OE1-CE1 3.49Å
138	T	92.5	Very high	92.5	Very high	36 Å²	36	48.9 Å²	48.9	22%	0.221	28%	0.275	C	S	.	.	H	α-helix	trans	-55.5	-48.7	166.6	-90.7	0	0	0	0	110.6	S134 A135 L140 F141 P142 E145	S134-T138 PolarHBondContact O-N 2.66Å; S134-T138 VanDerWaalsContact O-N 3.1Å; A135-T138 PolarHBondContact O-N 3.38Å; T138-L140 PolarHBondContact O-N 3.33Å; T138-F141 CarbonylContact O-C 3.29Å; T138-F141 PolarHBondContact O-N 3.49Å; T138-P142 WeakPolarHBondContact O-CA 3.32Å; T138-P142 VanDerWaalsContact O-CD 3.25Å; T138-P142 WeakPolarHBondContact O-CD 3.37Å; T138-P142 WeakPolarHBondContact O-CG 3.4Å; T138-E145 WeakPolarHBondContact CB-OE1 3.35Å; T138-E145 VanDerWaalsContact CG2-CD 3.44Å; T138-E145 HydrophobicContact CG2-CG 4.25Å; T138-E145 WeakPolarHBondContact CG2-OE1 3.4Å; T138-E145 WeakPolarHBondContact OG1-CG 3.06Å; T138-E145 PolarHBondContact OG1-OE1 2.8Å
139	Q	89.2	Confident	92.5	Very high	119 Å²	119	53.6 Å²	53.6	56%	0.556	30%	0.3	S	S	*	.	H	α-helix	trans	-63.5	-39.6	-177.1	-169.5	-173.1	56.4	0	0	112.2	A135 E137 Y277 P1146	A135-Q139 VanDerWaalsContact O-CB 3.32Å; A135-Q139 WeakPolarHBondContact O-CB 3.41Å; A135-Q139 PolarHBondContact O-N 3.39Å; E137-Q139 VanDerWaalsContact C-N 3.32Å; Q139-Y277 PolarHBondContact OE1-OH 3.05Å; Q139-P1146 WeakPolarHBondContact O-CB 3.21Å
140	L	89.9	Confident	92.4	Very high	1 Å²	1	53 Å²	53	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-80.4	-34.1	178.6	-169	62.8	0	0	0	112.5	E136 E137 T138 F273 Y277 T1145 V1147	E136-L140 WeakPolarHBondContact O-CB 3.37Å; E136-L140 PolarHBondContact O-N 3.04Å; E137-L140 PolarHBondContact O-N 3.21Å; T138-L140 PolarHBondContact O-N 3.33Å; L140-F273 HydrophobicContact CD2-CB 4.02Å; L140-F273 HydrophobicContact CD2-CD2 4.03Å; L140-Y277 HydrophobicContact CB-CE2 4.45Å; L140-Y277 HydrophobicContact CD2-CE2 4.22Å; L140-T1145 HydrophobicContact CD1-CG2 3.97Å; L140-V1147 PolarHBondContact O-N 2.98Å
141	F	94	Very high	92.5	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.293	C	S	.	.			trans	-128.8	62.4	-173.6	-53.5	-37.7	0	0	0	113.9	E137 T138 F143 L144 Y155 L269 L272 F273 V1147	E137-F141 WeakPolarHBondContact O-CA 3.44Å; E137-F141 WeakPolarHBondContact O-CB 3.16Å; E137-F141 PolarHBondContact O-N 3.42Å; T138-F141 CarbonylContact O-C 3.29Å; T138-F141 PolarHBondContact O-N 3.49Å; F141-F143 HydrophobicContact CB-CD1 4.17Å; F141-F143 HydrophobicContact CB-CE1 3.74Å; F141-F143 HydrophobicContact CB-CZ 4.34Å; F141-F143 HydrophobicContact CD1-CE1 4.36Å; F141-F143 HydrophobicContact CG-CE1 4.21Å; F141-F143 PolarHBondContact O-N 3.04Å; F141-L144 HydrophobicContact CB-CD1 3.76Å; F141-L144 HydrophobicContact CB-CG 3.99Å; F141-L144 HydrophobicContact CD2-CD1 3.97Å; F141-L144 HydrophobicContact CG-CD1 4.35Å; F141-L144 WeakPolarHBondContact O-CB 3.3Å; F141-L144 PolarHBondContact O-N 3.33Å; F141-Y155 HydrophobicContact CD2-CE2 4.02Å; F141-Y155 AromaticContact CE2-CE2 3.87Å; F141-Y155 HydrophobicContact CE2-CE2 3.87Å; F141-L269 HydrophobicContact CD1-CD2 4.19Å; F141-L269 HydrophobicContact CE1-CD2 3.67Å; F141-L269 HydrophobicContact CE2-CB 4.27Å; F141-L269 HydrophobicContact CZ-CB 4.05Å; F141-L269 HydrophobicContact CZ-CD2 4.02Å; F141-L269 WeakPolarHBondContact CZ-O 3.46Å; F141-L272 HydrophobicContact CE1-CD2 4.43Å; F141-F273 HydrophobicContact CE2-CB 3.66Å; F141-F273 HydrophobicContact CE2-CG 4.47Å; F141-F273 HydrophobicContact CZ-CB 3.9Å; F141-V1147 HydrophobicContact CD1-CB 4Å; F141-V1147 HydrophobicContact CD1-CG2 4.2Å; F141-V1147 HydrophobicContact CE1-CB 4.39Å; F141-V1147 HydrophobicContact CE1-CG2 4.12Å
142	P	92.8	Very high	92.5	Very high	46 Å²	46	48.8 Å²	48.8	30%	0.299	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-17.8	-174.8	-25.6	33.7	0	0	0	115.5	T138 L144 E145 P1146	T138-P142 WeakPolarHBondContact O-CA 3.32Å; T138-P142 VanDerWaalsContact O-CD 3.25Å; T138-P142 WeakPolarHBondContact O-CD 3.37Å; T138-P142 WeakPolarHBondContact O-CG 3.4Å; P142-L144 PolarHBondContact O-N 3.21Å; P142-E145 PolarHBondContact O-N 3.41Å; P142-P1146 HydrophobicContact CG-CB 3.69Å; P142-P1146 HydrophobicContact CG-CG 4.36Å
143	F	93.1	Very high	92.6	Very high	14 Å²	14	47 Å²	47	6%	0.061	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-25.5	173.5	76.9	-96.9	0	0	0	112.6	F141 E145 S146 S147 L269 V1147 F1152	F141-F143 HydrophobicContact CB-CD1 4.17Å; F141-F143 HydrophobicContact CB-CE1 3.74Å; F141-F143 HydrophobicContact CB-CZ 4.34Å; F141-F143 HydrophobicContact CD1-CE1 4.36Å; F141-F143 HydrophobicContact CG-CE1 4.21Å; F141-F143 PolarHBondContact O-N 3.04Å; F143-E145 VanDerWaalsContact C-N 3.34Å; F143-E145 PolarHBondContact O-N 3.17Å; F143-S146 PolarHBondContact O-N 3.44Å; F143-S146 PolarHBondContact O-OG 2.85Å; F143-S147 PolarHBondContact O-N 3.09Å; F143-S147 VanDerWaalsContact O-N 3.16Å; F143-S147 PolarHBondContact O-OG 3.01Å; F143-L269 HydrophobicContact CE1-CD1 4.38Å; F143-L269 HydrophobicContact CZ-CD1 3.97Å; F143-V1147 WeakPolarHBondContact CD1-O 3.34Å; F143-F1152 HydrophobicContact CE2-CE2 4.22Å; F143-F1152 HydrophobicContact CZ-CE2 4.48Å
144	L	93.6	Very high	92.6	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-39.4	-178.3	-74.4	176.8	0	0	0	111.4	L133 F141 P142 S146 S147 K152 Y155	L133-L144 HydrophobicContact CD1-CB 3.75Å; L133-L144 HydrophobicContact CD1-CD1 4.24Å; L133-L144 HydrophobicContact CD2-CD1 4.06Å; F141-L144 HydrophobicContact CB-CD1 3.76Å; F141-L144 HydrophobicContact CB-CG 3.99Å; F141-L144 HydrophobicContact CD2-CD1 3.97Å; F141-L144 HydrophobicContact CG-CD1 4.35Å; F141-L144 WeakPolarHBondContact O-CB 3.3Å; F141-L144 PolarHBondContact O-N 3.33Å; P142-L144 PolarHBondContact O-N 3.21Å; L144-S146 VanDerWaalsContact C-N 3.34Å; L144-S146 PolarHBondContact O-N 3.34Å; L144-S147 VanDerWaalsContact O-CB 3.25Å; L144-S147 WeakPolarHBondContact O-CB 3.46Å; L144-S147 PolarHBondContact O-N 3.15Å; L144-K152 WeakPolarHBondContact O-CE 3.48Å; L144-K152 WeakPolarHBondContact O-CG 3.49Å; L144-Y155 HydrophobicContact CD1-CD1 3.88Å; L144-Y155 HydrophobicContact CD1-CD2 4.26Å; L144-Y155 HydrophobicContact CD1-CE1 3.94Å; L144-Y155 HydrophobicContact CD1-CE2 4.3Å; L144-Y155 HydrophobicContact CD1-CG 4.07Å; L144-Y155 HydrophobicContact CD2-CG 4.21Å
145	E	90	Very high	92.8	Very high	108 Å²	108	44.7 Å²	44.7	51%	0.505	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-45.6	178.2	-57.7	-170.5	129.3	0	0	111.8	T138 P142 F143 S147 K152	T138-E145 WeakPolarHBondContact CB-OE1 3.35Å; T138-E145 VanDerWaalsContact CG2-CD 3.44Å; T138-E145 HydrophobicContact CG2-CG 4.25Å; T138-E145 WeakPolarHBondContact CG2-OE1 3.4Å; T138-E145 WeakPolarHBondContact OG1-CG 3.06Å; T138-E145 PolarHBondContact OG1-OE1 2.8Å; P142-E145 PolarHBondContact O-N 3.41Å; F143-E145 VanDerWaalsContact C-N 3.34Å; F143-E145 PolarHBondContact O-N 3.17Å; E145-S147 PolarHBondContact O-N 3.44Å; E145-K152 WeakPolarHBondContact O-CE 3.45Å; E145-K152 PolarHBondContact O-NZ 3.36Å
146	S	89.6	Confident	93	Very high	103 Å²	103	41.7 Å²	41.7	72%	0.72	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-4.1	175.8	68.4	0	0	0	0	114.9	F143 L144	F143-S146 PolarHBondContact O-N 3.44Å; F143-S146 PolarHBondContact O-OG 2.85Å; L144-S146 VanDerWaalsContact C-N 3.34Å; L144-S146 PolarHBondContact O-N 3.34Å
147	S	90.9	Very high	93.2	Very high	22 Å²	22	38.6 Å²	38.6	15%	0.154	22%	0.215	C	C	.	.	S	Bend	trans	-85.6	160	-179	-64.9	0	0	0	0	112.5	F143 L144 E145 K152	F143-S147 PolarHBondContact O-N 3.09Å; F143-S147 VanDerWaalsContact O-N 3.16Å; F143-S147 PolarHBondContact O-OG 3.01Å; L144-S147 VanDerWaalsContact O-CB 3.25Å; L144-S147 WeakPolarHBondContact O-CB 3.46Å; L144-S147 PolarHBondContact O-N 3.15Å; E145-S147 PolarHBondContact O-N 3.44Å; S147-K152 VanDerWaalsContact O-CE 3.28Å; S147-K152 WeakPolarHBondContact O-CE 3.17Å
148	S	92.1	Very high	93.4	Very high	61 Å²	61	38.6 Å²	38.6	43%	0.427	22%	0.215	S	C	.	.			trans	-61.6	149.5	172.1	56.8	0	0	0	0	111.8	S150 L151 K152	S148-S150 VanDerWaalsContact C-N 3.3Å; S148-S150 PolarHBondContact O-N 2.92Å; S148-L151 WeakPolarHBondContact O-CA 3.32Å; S148-L151 WeakPolarHBondContact O-CB 3.45Å; S148-L151 PolarHBondContact O-N 3.2Å; S148-K152 PolarHBondContact O-N 3.29Å; S148-K152 VanDerWaalsContact O-N 3.08Å
149	N	92.8	Very high	93.7	Very high	104 Å²	104	36.9 Å²	36.9	56%	0.556	20%	0.204	S	C	*	.	H	α-helix	trans	-55.3	-44.7	-179.5	-68.2	9.3	0	0	0	111.8	L151 K152 E153	N149-L151 PolarHBondContact O-N 2.94Å; N149-L151 VanDerWaalsContact O-N 3.12Å; N149-K152 CarbonylContact O-C 3.59Å; N149-K152 WeakPolarHBondContact O-CA 3.3Å; N149-K152 WeakPolarHBondContact O-CB 3.48Å; N149-K152 PolarHBondContact O-N 2.88Å; N149-E153 WeakPolarHBondContact O-CB 3.43Å; N149-E153 VanDerWaalsContact O-CG 3.27Å; N149-E153 WeakPolarHBondContact O-CG 3.34Å; N149-E153 PolarHBondContact O-N 2.94Å
150	S	92.1	Very high	94.1	Very high	33 Å²	33	31.5 Å²	31.5	23%	0.231	18%	0.18	C	C	.	.	H	α-helix	trans	-56.8	-31	175.5	-42.6	0	0	0	0	113.3	S148 S154 V194 S198	S148-S150 VanDerWaalsContact C-N 3.3Å; S148-S150 PolarHBondContact O-N 2.92Å; S150-S154 WeakPolarHBondContact O-CB 3.46Å; S150-S154 PolarHBondContact O-N 2.88Å; S150-S154 PolarHBondContact O-OG 3.15Å; S150-V194 WeakPolarHBondContact O-CG1 3.33Å; S150-S198 WeakPolarHBondContact O-CB 3.41Å
151	L	94	Very high	94.5	Very high	3 Å²	3	31.8 Å²	31.8	2%	0.016	18%	0.181	C	C	.	.	H	α-helix	trans	-79.3	-34.4	175.2	-176.7	57.5	0	0	0	112.5	S148 N149 S154 Y155 L200 M266 F1152 L1154	S148-L151 WeakPolarHBondContact O-CA 3.32Å; S148-L151 WeakPolarHBondContact O-CB 3.45Å; S148-L151 PolarHBondContact O-N 3.2Å; N149-L151 PolarHBondContact O-N 2.94Å; N149-L151 VanDerWaalsContact O-N 3.12Å; L151-S154 PolarHBondContact O-N 2.97Å; L151-Y155 PolarHBondContact O-N 3.23Å; L151-L200 HydrophobicContact CD1-CD1 3.87Å; L151-L200 HydrophobicContact CD1-CD2 4.12Å; L151-L200 HydrophobicContact CD1-CG 4.2Å; L151-M266 HydrophobicContact CD1-CE 3.8Å; L151-F1152 HydrophobicContact CD1-CD2 4.02Å; L151-F1152 HydrophobicContact CD1-CE2 3.92Å; L151-F1152 HydrophobicContact CD2-CD2 4.03Å; L151-F1152 HydrophobicContact CD2-CE2 4.36Å; L151-L1154 HydrophobicContact CD2-CD1 4.15Å
152	K	95.3	Very high	94.7	Very high	52 Å²	52	31.8 Å²	31.8	23%	0.226	18%	0.181	C	C	.	.	H	α-helix	trans	-61.4	-51.4	169.8	-62.7	173	176.4	168.9	0	110.2	L133 L144 E145 S147 S148 N149 S154 Y155 I156	L133-K152 HydrophobicContact CD1-CG 4.28Å; L144-K152 WeakPolarHBondContact O-CE 3.48Å; L144-K152 WeakPolarHBondContact O-CG 3.49Å; E145-K152 WeakPolarHBondContact O-CE 3.45Å; E145-K152 PolarHBondContact O-NZ 3.36Å; S147-K152 VanDerWaalsContact O-CE 3.28Å; S147-K152 WeakPolarHBondContact O-CE 3.17Å; S148-K152 PolarHBondContact O-N 3.29Å; S148-K152 VanDerWaalsContact O-N 3.08Å; N149-K152 CarbonylContact O-C 3.59Å; N149-K152 WeakPolarHBondContact O-CA 3.3Å; N149-K152 WeakPolarHBondContact O-CB 3.48Å; N149-K152 PolarHBondContact O-N 2.88Å; K152-S154 PolarHBondContact O-N 3.15Å; K152-Y155 WeakPolarHBondContact O-CB 3.23Å; K152-Y155 PolarHBondContact O-N 2.84Å; K152-I156 WeakPolarHBondContact O-CD1 3.02Å; K152-I156 WeakPolarHBondContact O-CG1 3.43Å; K152-I156 PolarHBondContact O-N 3.01Å
153	E	95.3	Very high	94.9	Very high	85 Å²	85	29.6 Å²	29.6	40%	0.397	17%	0.167	S	C	.	.	H	α-helix	trans	-60.3	-41	176	-65.4	157.8	-156.6	0	0	111.8	N149 Y155 I156 A157 V194	N149-E153 WeakPolarHBondContact O-CB 3.43Å; N149-E153 VanDerWaalsContact O-CG 3.27Å; N149-E153 WeakPolarHBondContact O-CG 3.34Å; N149-E153 PolarHBondContact O-N 2.94Å; E153-Y155 VanDerWaalsContact C-N 3.34Å; E153-Y155 PolarHBondContact O-N 3.23Å; E153-I156 PolarHBondContact O-N 3.47Å; E153-A157 WeakPolarHBondContact O-CB 3.26Å; E153-A157 PolarHBondContact O-N 3.03Å; E153-V194 HydrophobicContact CB-CG1 3.47Å; E153-V194 VanDerWaalsContact CB-CG1 3.47Å
154	S	95.8	Very high	95.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.7	-42.9	173.6	-70.9	0	0	0	0	112.5	S150 L151 K152 V158 V194 M195 S198	S150-S154 WeakPolarHBondContact O-CB 3.46Å; S150-S154 PolarHBondContact O-N 2.88Å; S150-S154 PolarHBondContact O-OG 3.15Å; L151-S154 PolarHBondContact O-N 2.97Å; K152-S154 PolarHBondContact O-N 3.15Å; S154-V158 PolarHBondContact O-N 2.88Å; S154-V194 PolarHBondContact OG-O 2.92Å; S154-M195 WeakPolarHBondContact CB-SD 3.01Å; S154-S198 VanDerWaalsContact OG-CB 3.31Å; S154-S198 WeakPolarHBondContact OG-CB 3.39Å; S154-S198 PolarHBondContact OG-OG 3.39Å
155	Y	97.5	Very high	95.2	Very high	1 Å²	1	30.8 Å²	30.8	0%	0.004	17%	0.174	C	C	.	.	H	α-helix	trans	-68	-46.5	176.6	166.5	-88.5	0	0	0	111.2	L133 E137 F141 L144 L151 K152 E153 A157 V158 R159 M266 V270	L133-Y155 HydrophobicContact CD2-CD1 3.56Å; L133-Y155 HydrophobicContact CD2-CE1 3.67Å; E137-Y155 HydrophobicContact CG-CE1 4.47Å; E137-Y155 WeakPolarHBondContact OE1-CE1 3.36Å; E137-Y155 VanDerWaalsContact OE1-CZ 3.27Å; E137-Y155 PolarHBondContact OE1-OH 3.28Å; F141-Y155 HydrophobicContact CD2-CE2 4.02Å; F141-Y155 AromaticContact CE2-CE2 3.87Å; F141-Y155 HydrophobicContact CE2-CE2 3.87Å; L144-Y155 HydrophobicContact CD1-CD1 3.88Å; L144-Y155 HydrophobicContact CD1-CD2 4.26Å; L144-Y155 HydrophobicContact CD1-CE1 3.94Å; L144-Y155 HydrophobicContact CD1-CE2 4.3Å; L144-Y155 HydrophobicContact CD1-CG 4.07Å; L144-Y155 HydrophobicContact CD2-CG 4.21Å; L151-Y155 PolarHBondContact O-N 3.23Å; K152-Y155 WeakPolarHBondContact O-CB 3.23Å; K152-Y155 PolarHBondContact O-N 2.84Å; E153-Y155 VanDerWaalsContact C-N 3.34Å; E153-Y155 PolarHBondContact O-N 3.23Å; Y155-A157 VanDerWaalsContact C-N 3.33Å; Y155-A157 PolarHBondContact O-N 3.15Å; Y155-V158 PolarHBondContact O-N 2.91Å; Y155-R159 WeakPolarHBondContact O-CB 3.48Å; Y155-R159 PolarHBondContact O-N 3.02Å; Y155-M266 HydrophobicContact CD2-SD 3.81Å; Y155-M266 HydrophobicContact CG-SD 4.27Å; Y155-V270 HydrophobicContact CD2-CG2 3.69Å; Y155-V270 HydrophobicContact CE2-CG2 3.5Å; Y155-V270 VanDerWaalsContact CE2-CG2 3.5Å
156	I	97	Very high	95.6	Very high	15 Å²	15	25.8 Å²	25.8	8%	0.077	15%	0.15	C	C	.	.	H	α-helix	trans	-57.4	-43.7	176	-72	160.9	0	0	0	111.2	A130 L133 K152 E153 V158 R159 N160	A130-I156 WeakPolarHBondContact O-CG2 3.16Å; L133-I156 HydrophobicContact CD2-CD1 4.09Å; L133-I156 HydrophobicContact CD2-CG1 3.9Å; L133-I156 HydrophobicContact CG-CD1 4.35Å; K152-I156 WeakPolarHBondContact O-CD1 3.02Å; K152-I156 WeakPolarHBondContact O-CG1 3.43Å; K152-I156 PolarHBondContact O-N 3.01Å; E153-I156 PolarHBondContact O-N 3.47Å; I156-V158 PolarHBondContact O-N 3.07Å; I156-R159 WeakPolarHBondContact O-CB 3.22Å; I156-R159 PolarHBondContact O-N 3.22Å; I156-N160 WeakPolarHBondContact O-CB 3.47Å; I156-N160 PolarHBondContact O-N 3.44Å; I156-N160 PolarHBondContact O-OD1 3.44Å
157	A	96.7	Very high	95.7	Very high	7 Å²	7	22.1 Å²	22.1	6%	0.058	12%	0.124	C	C	.	.	H	α-helix	trans	-59.5	-42.7	176.9	0	0	0	0	0	112.8	E153 Y155 L161 M187 N191	E153-A157 WeakPolarHBondContact O-CB 3.26Å; E153-A157 PolarHBondContact O-N 3.03Å; Y155-A157 VanDerWaalsContact C-N 3.33Å; Y155-A157 PolarHBondContact O-N 3.15Å; A157-L161 WeakPolarHBondContact O-CG 3.4Å; A157-L161 PolarHBondContact O-N 2.69Å; A157-L161 VanDerWaalsContact O-N 3.15Å; A157-M187 HydrophobicContact CB-CE 4.48Å; A157-N191 HydrophobicContact CB-CB 4.07Å
158	V	97.8	Very high	95.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-73.4	-35.5	178	176.2	0	0	0	0	111.7	S154 Y155 I156 L161 A162 L179 V183 M187 M195 M266 T267 V270	S154-V158 PolarHBondContact O-N 2.88Å; Y155-V158 PolarHBondContact O-N 2.91Å; I156-V158 PolarHBondContact O-N 3.07Å; V158-L161 PolarHBondContact O-N 3.48Å; V158-A162 PolarHBondContact O-N 3.28Å; V158-L179 HydrophobicContact CG1-CD2 4.05Å; V158-L179 HydrophobicContact CG1-CG 4.48Å; V158-V183 HydrophobicContact CG1-CG2 4.08Å; V158-V183 HydrophobicContact CG2-CG1 4.41Å; V158-V183 HydrophobicContact CG2-CG2 4.38Å; V158-M187 HydrophobicContact CG2-CE 4.03Å; V158-M195 HydrophobicContact CG2-CE 4.18Å; V158-M195 HydrophobicContact CG2-SD 4.48Å; V158-M266 HydrophobicContact CB-CG 4.05Å; V158-M266 HydrophobicContact CG1-CG 4.13Å; V158-M266 HydrophobicContact CG2-CG 3.92Å; V158-T267 HydrophobicContact CG1-CG2 3.97Å; V158-V270 HydrophobicContact CB-CG2 4.16Å; V158-V270 HydrophobicContact CG1-CB 4.2Å; V158-V270 HydrophobicContact CG1-CG1 4.32Å; V158-V270 HydrophobicContact CG1-CG2 3.89Å
159	R	97.9	Very high	96	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.5	-49.6	172	-176.5	-160.9	73.5	-172.7	-3.9	112	S123 P129 E132 E137 Y155 I156 L161 A162 C163 V270 L274	S123-R159 PolarHBondContact OG-NH2 3.41Å; P129-R159 PolarHBondContact O-NH2 3.4Å; E132-R159 PolarHBondContact O-NH1 2.78Å; E137-R159 WeakPolarHBondContact OE1-CD 3.18Å; E137-R159 IonicContact OE1-NH1 3.96Å; E137-R159 IonicContact OE2-CZ 3.9Å; E137-R159 IonicContact OE2-NH1 2.79Å; E137-R159 PolarHBondContact OE2-NH1 2.83Å; Y155-R159 WeakPolarHBondContact O-CB 3.48Å; Y155-R159 PolarHBondContact O-N 3.02Å; I156-R159 WeakPolarHBondContact O-CB 3.22Å; I156-R159 PolarHBondContact O-N 3.22Å; R159-L161 VanDerWaalsContact C-N 3.31Å; R159-L161 PolarHBondContact O-N 2.76Å; R159-A162 WeakPolarHBondContact O-CB 3.44Å; R159-A162 PolarHBondContact O-N 3.19Å; R159-C163 PolarHBondContact O-N 3.29Å; R159-C163 PolarHBondContact O-SG 2.94Å; R159-V270 HydrophobicContact CB-CG1 4.27Å; R159-V270 HydrophobicContact CB-CG2 4.26Å; R159-L274 HydrophobicContact CG-CD1 4.23Å; R159-L274 HydrophobicContact CG-CD2 4.16Å; R159-L274 HydrophobicContact CG-CG 4.49Å
160	N	97.7	Very high	96.1	Very high	7 Å²	7	21.3 Å²	21.3	4%	0.037	11%	0.11	C	C	.	.	H	α-helix	trans	-62.3	-39.3	179.6	-68.7	6.3	0	0	0	111	A119 S123 A130 I156 A162 C163 L164	A119-N160 HydrophobicContact CB-CB 3.91Å; A119-N160 WeakPolarHBondContact O-CB 3.3Å; S123-N160 WeakPolarHBondContact CB-OD1 3.36Å; S123-N160 PolarHBondContact OG-OD1 3.07Å; A130-N160 PolarHBondContact O-ND2 2.78Å; I156-N160 WeakPolarHBondContact O-CB 3.47Å; I156-N160 PolarHBondContact O-N 3.44Å; I156-N160 PolarHBondContact O-OD1 3.44Å; N160-A162 PolarHBondContact O-N 3Å; N160-C163 PolarHBondContact O-N 3.45Å; N160-L164 PolarHBondContact O-N 2.66Å
161	L	97.8	Very high	96.2	Very high	7 Å²	7	22.1 Å²	22.1	4%	0.037	12%	0.115	C	C	.	.	H	α-helix	trans	-66.1	-32.2	172.5	-75.1	169.8	0	0	0	113.5	A119 A157 V158 R159 L164 M165 Y182 V183 N186 M187	A119-L161 HydrophobicContact CB-CD2 4.27Å; A157-L161 WeakPolarHBondContact O-CG 3.4Å; A157-L161 PolarHBondContact O-N 2.69Å; A157-L161 VanDerWaalsContact O-N 3.15Å; V158-L161 PolarHBondContact O-N 3.48Å; R159-L161 VanDerWaalsContact C-N 3.31Å; R159-L161 PolarHBondContact O-N 2.76Å; L161-L164 HydrophobicContact CD2-CD2 4.47Å; L161-M165 WeakPolarHBondContact O-CB 3.15Å; L161-M165 PolarHBondContact O-N 2.95Å; L161-Y182 HydrophobicContact CB-CD1 4.46Å; L161-Y182 HydrophobicContact CB-CE1 4.45Å; L161-Y182 HydrophobicContact CD2-CE1 4.06Å; L161-V183 HydrophobicContact CB-CG2 4.38Å; L161-V183 HydrophobicContact CD1-CG1 4.43Å; L161-V183 HydrophobicContact CD1-CG2 4.02Å; L161-N186 HydrophobicContact CD2-CB 4.32Å; L161-M187 HydrophobicContact CD1-CE 4.41Å; L161-M187 HydrophobicContact CD1-SD 3.66Å
162	A	98.1	Very high	96.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-70.5	-39.2	173.7	0	0	0	0	0	112.3	V158 R159 N160 L164 M165 W166 L179 V270 L274	V158-A162 PolarHBondContact O-N 3.28Å; R159-A162 WeakPolarHBondContact O-CB 3.44Å; R159-A162 PolarHBondContact O-N 3.19Å; N160-A162 PolarHBondContact O-N 3Å; A162-L164 VanDerWaalsContact C-N 3.34Å; A162-M165 PolarHBondContact O-N 2.97Å; A162-W166 PolarHBondContact O-N 3.11Å; A162-L179 HydrophobicContact CB-CD1 3.71Å; A162-L179 HydrophobicContact CB-CD2 3.74Å; A162-L179 HydrophobicContact CB-CG 4.39Å; A162-V270 HydrophobicContact CB-CG1 3.73Å; A162-L274 HydrophobicContact CB-CD1 3.56Å
163	C	97.4	Very high	96.3	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.2	-40.3	173	-60.8	0	0	0	0	111.3	A122 C126 R159 N160 W166 S167	A122-C163 HydrophobicContact CB-CB 4.27Å; C126-C163 HydrophobicContact CB-CB 4.22Å; R159-C163 PolarHBondContact O-N 3.29Å; R159-C163 PolarHBondContact O-SG 2.94Å; N160-C163 PolarHBondContact O-N 3.45Å; C163-W166 PolarHBondContact O-N 3.02Å; C163-S167 VanDerWaalsContact O-CB 3.32Å; C163-S167 WeakPolarHBondContact O-CB 3.29Å; C163-S167 PolarHBondContact O-N 2.95Å; C163-S167 PolarHBondContact O-OG 3.34Å
164	L	97	Very high	96.4	Very high	30 Å²	30	16.8 Å²	16.8	16%	0.157	9%	0.092	C	C	.	.	H	α-helix	trans	-62.6	-50.5	173.4	-177.2	60.6	0	0	0	111.8	P118 A119 A122 N160 L161 A162 W166 S167 E168 Y182	P118-L164 HydrophobicContact CB-CD1 4.26Å; P118-L164 HydrophobicContact CB-CD2 4.36Å; A119-L164 HydrophobicContact CB-CD2 4.31Å; A122-L164 VanDerWaalsContact CB-CA 3.45Å; A122-L164 HydrophobicContact CB-CB 3.87Å; A122-L164 HydrophobicContact CB-CD1 4.06Å; N160-L164 PolarHBondContact O-N 2.66Å; L161-L164 HydrophobicContact CD2-CD2 4.47Å; A162-L164 VanDerWaalsContact C-N 3.34Å; L164-W166 VanDerWaalsContact C-N 3.27Å; L164-W166 PolarHBondContact O-N 3.08Å; L164-S167 CarbonylContact O-C 3.6Å; L164-S167 WeakPolarHBondContact O-CA 3.45Å; L164-S167 WeakPolarHBondContact O-CB 3.18Å; L164-S167 PolarHBondContact O-N 2.9Å; L164-E168 HydrophobicContact CD1-CG 4.36Å; L164-E168 WeakPolarHBondContact O-CG 3.2Å; L164-E168 PolarHBondContact O-N 3.41Å; L164-Y182 WeakPolarHBondContact CD2-OH 2.96Å; L164-Y182 WeakPolarHBondContact CG-OH 3.38Å
165	M	97.3	Very high	96.5	Very high	9 Å²	9	17.2 Å²	17.2	4%	0.044	10%	0.095	C	C	.	.	H	α-helix	trans	-57.5	-39	178.9	-174	-166.5	153.3	0	0	112.4	L161 A162 D169 V174 R178 Y182	L161-M165 WeakPolarHBondContact O-CB 3.15Å; L161-M165 PolarHBondContact O-N 2.95Å; A162-M165 PolarHBondContact O-N 2.97Å; M165-D169 PolarHBondContact O-N 3.34Å; M165-D169 VanDerWaalsContact O-N 3.11Å; M165-V174 HydrophobicContact CE-CB 4.33Å; M165-V174 HydrophobicContact CE-CG1 4.27Å; M165-V174 HydrophobicContact CE-CG2 3.92Å; M165-V174 HydrophobicContact CG-CG2 4.36Å; M165-V174 HydrophobicContact SD-CG1 3.93Å; M165-V174 HydrophobicContact SD-CG2 4.1Å; M165-R178 HydrophobicContact CE-CB 3.56Å; M165-R178 HydrophobicContact CE-CG 4.28Å; M165-R178 VanDerWaalsContact CE-NE 3.31Å; M165-R178 HydrophobicContact SD-CB 4.34Å; M165-Y182 HydrophobicContact CB-CD1 4.17Å; M165-Y182 HydrophobicContact CB-CD2 4.1Å; M165-Y182 HydrophobicContact CB-CE1 4.07Å; M165-Y182 HydrophobicContact CB-CE2 3.99Å; M165-Y182 HydrophobicContact CB-CG 4.18Å; M165-Y182 HydrophobicContact CG-CD2 3.75Å; M165-Y182 HydrophobicContact CG-CE2 3.93Å; M165-Y182 HydrophobicContact CG-CG 4.08Å; M165-Y182 HydrophobicContact SD-CD2 4.23Å; M165-Y182 HydrophobicContact SD-CG 4.16Å
166	W	96.6	Very high	96.5	Very high	3 Å²	3	17.9 Å²	17.9	1%	0.011	10%	0.099	C	C	.	.	H	α-helix	trans	-70.8	-36.6	173.2	178.5	-111	0	0	0	112.8	A162 C163 L164 E168 D169 S170 V174 I280 F282 F285 I424	A162-W166 PolarHBondContact O-N 3.11Å; C163-W166 PolarHBondContact O-N 3.02Å; L164-W166 VanDerWaalsContact C-N 3.27Å; L164-W166 PolarHBondContact O-N 3.08Å; W166-E168 VanDerWaalsContact C-N 3.29Å; W166-E168 PolarHBondContact O-N 3.26Å; W166-D169 CarbonylContact O-C 3.52Å; W166-S170 VanDerWaalsContact CH2-O 3.31Å; W166-S170 WeakPolarHBondContact CH2-O 3.49Å; W166-S170 VanDerWaalsContact O-CA 3.29Å; W166-S170 WeakPolarHBondContact O-CA 3.49Å; W166-S170 VanDerWaalsContact O-CB 3.32Å; W166-S170 WeakPolarHBondContact O-CB 3.4Å; W166-S170 PolarHBondContact O-N 2.74Å; W166-V174 HydrophobicContact CB-CG2 4.1Å; W166-V174 HydrophobicContact CE3-CG2 4.18Å; W166-I280 HydrophobicContact CB-CB 3.99Å; W166-I280 HydrophobicContact CB-CG2 3.56Å; W166-I280 HydrophobicContact CD2-CB 3.88Å; W166-I280 HydrophobicContact CD2-CG2 4.33Å; W166-I280 HydrophobicContact CE3-CB 4.34Å; W166-I280 HydrophobicContact CG-CB 3.71Å; W166-I280 HydrophobicContact CG-CG2 3.62Å; W166-F282 AromaticContact CZ2-CD1 3.87Å; W166-F282 HydrophobicContact CZ2-CD1 3.87Å; W166-F282 HydrophobicContact CZ2-CE1 4.08Å; W166-F282 HydrophobicContact CZ2-CG 4.39Å; W166-F282 AromaticContact NE1-CE1 3.58Å; W166-F285 HydrophobicContact CH2-CB 4.39Å; W166-F285 HydrophobicContact CH2-CD1 4.14Å; W166-F285 HydrophobicContact CH2-CG 4.28Å; W166-I424 HydrophobicContact CZ2-CG2 4.03Å
167	S	92.9	Very high	96.4	Very high	25 Å²	25	22.2 Å²	22.2	18%	0.175	12%	0.122	C	C	.	.	H	α-helix	trans	-67.8	-28.7	176.9	-61.5	0	0	0	0	112.8	C163 L164 R427	C163-S167 VanDerWaalsContact O-CB 3.32Å; C163-S167 WeakPolarHBondContact O-CB 3.29Å; C163-S167 PolarHBondContact O-N 2.95Å; C163-S167 PolarHBondContact O-OG 3.34Å; L164-S167 CarbonylContact O-C 3.6Å; L164-S167 WeakPolarHBondContact O-CA 3.45Å; L164-S167 WeakPolarHBondContact O-CB 3.18Å; L164-S167 PolarHBondContact O-N 2.9Å; S167-R427 PolarHBondContact O-NH1 2.87Å
168	E	93.7	Very high	96.4	Very high	123 Å²	123	25.1 Å²	25.1	58%	0.575	13%	0.132	S	C	*	.	H	α-helix	trans	-77.8	-47.1	173.2	-69.2	-177.4	140.5	0	0	112.8	L164 W166 Y182	L164-E168 HydrophobicContact CD1-CG 4.36Å; L164-E168 WeakPolarHBondContact O-CG 3.2Å; L164-E168 PolarHBondContact O-N 3.41Å; W166-E168 VanDerWaalsContact C-N 3.29Å; W166-E168 PolarHBondContact O-N 3.26Å; E168-Y182 WeakPolarHBondContact OE2-CE2 3.34Å; E168-Y182 PolarHBondContact OE2-OH 2.65Å
169	D	94.9	Very high	96.4	Very high	48 Å²	48	25.1 Å²	25.1	26%	0.257	13%	0.132	S	C	.	.			trans	-132.8	74.8	-178	171.5	27.1	0	0	0	111.5	M165 W166 C171 T172 R178	M165-D169 PolarHBondContact O-N 3.34Å; M165-D169 VanDerWaalsContact O-N 3.11Å; W166-D169 CarbonylContact O-C 3.52Å; D169-C171 PolarHBondContact O-N 3.04Å; D169-C171 PolarHBondContact OD1-N 2.79Å; D169-T172 PolarHBondContact OD1-N 3Å; D169-T172 PolarHBondContact OD1-OG1 2.88Å; D169-T172 WeakPolarHBondContact OD2-CB 3.46Å; D169-T172 PolarHBondContact OD2-OG1 3.45Å; D169-T172 VanDerWaalsContact OD2-OG1 3.09Å; D169-R178 IonicContact OD2-CZ 3.68Å; D169-R178 IonicContact OD2-NH1 2.72Å; D169-R178 IonicContact OD2-NH2 3.22Å; D169-R178 PolarHBondContact OD2-NH2 3.2Å
170	S	95	Very high	96.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	0.2	174.7	68	0	0	0	0	113.6	W166 Q428	W166-S170 VanDerWaalsContact CH2-O 3.31Å; W166-S170 WeakPolarHBondContact CH2-O 3.49Å; W166-S170 VanDerWaalsContact O-CA 3.29Å; W166-S170 WeakPolarHBondContact O-CA 3.49Å; W166-S170 VanDerWaalsContact O-CB 3.32Å; W166-S170 WeakPolarHBondContact O-CB 3.4Å; W166-S170 PolarHBondContact O-N 2.74Å; S170-Q428 WeakPolarHBondContact O-CG 3.17Å; S170-Q428 PolarHBondContact O-NE2 2.92Å
171	C	95.6	Very high	96.3	Very high	50 Å²	50	31.2 Å²	31.2	34%	0.338	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-9.9	179.7	-64.9	0	0	0	0	112.4	D169 F285 K286	D169-C171 PolarHBondContact O-N 3.04Å; D169-C171 PolarHBondContact OD1-N 2.79Å; C171-F285 WeakPolarHBondContact O-CA 3.31Å; C171-K286 PolarHBondContact O-N 3.48Å
172	T	95.1	Very high	96.3	Very high	26 Å²	26	32.4 Å²	32.4	16%	0.16	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-136.5	128.3	-175.6	-42.5	0	0	0	0	111.8	D169 V174 R178 K286 I288	D169-T172 PolarHBondContact OD1-N 3Å; D169-T172 PolarHBondContact OD1-OG1 2.88Å; D169-T172 WeakPolarHBondContact OD2-CB 3.46Å; D169-T172 PolarHBondContact OD2-OG1 3.45Å; D169-T172 VanDerWaalsContact OD2-OG1 3.09Å; T172-V174 PolarHBondContact O-N 3.09Å; T172-R178 PolarHBondContact O-NH1 3.32Å; T172-K286 HydrophobicContact CG2-CB 4.32Å; T172-K286 HydrophobicContact CG2-CD 4.39Å; T172-I288 HydrophobicContact CG2-CD1 3.54Å; T172-I288 HydrophobicContact CG2-CG1 4.19Å
173	Q	96.3	Very high	96.1	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.009	17%	0.166	C	C	.	.			trans	-47.6	126	-178.3	-173	-166.9	11.1	0	0	113.2	T175 R178 N281 F285 K286 S289 Y379	Q173-T175 HydrophobicContact CB-CG2 4.44Å; Q173-T175 HydrophobicContact CG-CG2 3.87Å; Q173-R178 WeakPolarHBondContact O-CD 3.41Å; Q173-R178 PolarHBondContact O-NH1 3.01Å; Q173-N281 WeakPolarHBondContact CA-OD1 3.28Å; Q173-N281 WeakPolarHBondContact CG-ND2 3.26Å; Q173-F285 HydrophobicContact CB-CD2 3.89Å; Q173-F285 HydrophobicContact CB-CE2 3.91Å; Q173-F285 HydrophobicContact CG-CE2 4.1Å; Q173-K286 WeakPolarHBondContact CB-O 3.36Å; Q173-K286 PolarHBondContact N-O 3.03Å; Q173-S289 PolarHBondContact NE2-O 2.92Å; Q173-S289 PolarHBondContact OE1-O 3.2Å; Q173-S289 VanDerWaalsContact OE1-O 3.1Å; Q173-Y379 PolarHBondContact NE2-OH 3.41Å
174	V	97.1	Very high	96	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.184	C	C	.	.			trans	-74.5	123.6	165.4	177.9	0	0	0	0	108	M165 W166 T172 L179 V271 I280 N281	M165-V174 HydrophobicContact CE-CB 4.33Å; M165-V174 HydrophobicContact CE-CG1 4.27Å; M165-V174 HydrophobicContact CE-CG2 3.92Å; M165-V174 HydrophobicContact CG-CG2 4.36Å; M165-V174 HydrophobicContact SD-CG1 3.93Å; M165-V174 HydrophobicContact SD-CG2 4.1Å; W166-V174 HydrophobicContact CB-CG2 4.1Å; W166-V174 HydrophobicContact CE3-CG2 4.18Å; T172-V174 PolarHBondContact O-N 3.09Å; V174-L179 HydrophobicContact CG1-CB 4.38Å; V174-V271 HydrophobicContact CG1-CG2 4.1Å; V174-I280 HydrophobicContact CB-CD1 3.84Å; V174-I280 HydrophobicContact CG1-CD1 3.91Å; V174-I280 HydrophobicContact CG2-CD1 4.34Å; V174-N281 PolarHBondContact N-OD1 3.06Å; V174-N281 PolarHBondContact O-ND2 2.89Å
175	T	96.8	Very high	95.8	Very high	8 Å²	8	39.5 Å²	39.5	5%	0.049	21%	0.207	C	C	.	.			trans	-122.7	157.3	178.2	68	0	0	0	0	109.6	Q173 N177 R178 L179 I288 S289	Q173-T175 HydrophobicContact CB-CG2 4.44Å; Q173-T175 HydrophobicContact CG-CG2 3.87Å; T175-N177 PolarHBondContact O-N 3.13Å; T175-N177 VanDerWaalsContact O-N 3.1Å; T175-R178 PolarHBondContact O-N 2.8Å; T175-R178 PolarHBondContact OG1-N 2.88Å; T175-L179 PolarHBondContact O-N 2.96Å; T175-I288 HydrophobicContact CG2-CB 4.28Å; T175-I288 HydrophobicContact CG2-CG2 4.45Å; T175-S289 WeakPolarHBondContact CG2-OG 3.49Å
176	P	97.1	Very high	95.6	Very high	16 Å²	16	43 Å²	43	10%	0.104	23%	0.225	C	C	.	.	H	α-helix	trans	-54.5	-34.3	-179.5	-29.3	37.5	0	0	0	113.5	F180 T267 V271 L292	P176-F180 VanDerWaalsContact O-CB 3.26Å; P176-F180 WeakPolarHBondContact O-CB 3.32Å; P176-F180 PolarHBondContact O-N 3.28Å; P176-T267 PolarHBondContact O-OG1 3.45Å; P176-V271 HydrophobicContact CG-CB 4.17Å; P176-V271 HydrophobicContact CG-CG1 4.38Å; P176-V271 HydrophobicContact CG-CG2 4.38Å; P176-L292 HydrophobicContact CG-CD1 3.76Å; P176-L292 HydrophobicContact CG-CD2 4.07Å; P176-L292 HydrophobicContact CG-CG 4.41Å
177	N	96.2	Very high	95.3	Very high	105 Å²	105	44.4 Å²	44.4	56%	0.561	23%	0.232	S	C	*	.	H	α-helix	trans	-73.5	-38.1	178.2	-65.5	5.2	0	0	0	112.4	T175 I181	T175-N177 PolarHBondContact O-N 3.13Å; T175-N177 VanDerWaalsContact O-N 3.1Å; N177-I181 WeakPolarHBondContact O-CG1 3.4Å; N177-I181 PolarHBondContact O-N 3.44Å
178	R	96.8	Very high	95.1	Very high	68 Å²	68	45.5 Å²	45.5	26%	0.257	24%	0.24	S	C	.	.	H	α-helix	trans	-66.8	-44.4	171.2	-72.9	-178.7	78	-159.7	7.1	110.6	M165 D169 T172 Q173 T175 F180 I181 Y182	M165-R178 HydrophobicContact CE-CB 3.56Å; M165-R178 HydrophobicContact CE-CG 4.28Å; M165-R178 VanDerWaalsContact CE-NE 3.31Å; M165-R178 HydrophobicContact SD-CB 4.34Å; D169-R178 IonicContact OD2-CZ 3.68Å; D169-R178 IonicContact OD2-NH1 2.72Å; D169-R178 IonicContact OD2-NH2 3.22Å; D169-R178 PolarHBondContact OD2-NH2 3.2Å; T172-R178 PolarHBondContact O-NH1 3.32Å; Q173-R178 WeakPolarHBondContact O-CD 3.41Å; Q173-R178 PolarHBondContact O-NH1 3.01Å; T175-R178 PolarHBondContact O-N 2.8Å; T175-R178 PolarHBondContact OG1-N 2.88Å; R178-F180 PolarHBondContact O-N 3.26Å; R178-I181 PolarHBondContact O-N 2.72Å; R178-Y182 WeakPolarHBondContact O-CB 3.5Å; R178-Y182 PolarHBondContact O-N 2.6Å
179	L	97.7	Very high	94.8	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.2	-39.4	179.6	-176.5	61.3	0	0	0	111.7	V158 A162 V174 T175 I181 Y182 V183 T267 V270 V271	V158-L179 HydrophobicContact CG1-CD2 4.05Å; V158-L179 HydrophobicContact CG1-CG 4.48Å; A162-L179 HydrophobicContact CB-CD1 3.71Å; A162-L179 HydrophobicContact CB-CD2 3.74Å; A162-L179 HydrophobicContact CB-CG 4.39Å; V174-L179 HydrophobicContact CG1-CB 4.38Å; T175-L179 PolarHBondContact O-N 2.96Å; L179-I181 PolarHBondContact O-N 3.42Å; L179-Y182 PolarHBondContact O-N 2.73Å; L179-V183 HydrophobicContact CD1-CG2 3.98Å; L179-V183 HydrophobicContact CG-CG2 4.17Å; L179-V183 WeakPolarHBondContact O-CB 3.33Å; L179-V183 VanDerWaalsContact O-CG2 3.26Å; L179-V183 WeakPolarHBondContact O-CG2 3Å; L179-V183 PolarHBondContact O-N 2.93Å; L179-T267 HydrophobicContact CB-CG2 4.25Å; L179-T267 HydrophobicContact CD2-CG2 3.97Å; L179-T267 HydrophobicContact CG-CG2 3.8Å; L179-V270 HydrophobicContact CD2-CB 4.31Å; L179-V270 HydrophobicContact CD2-CG1 3.8Å; L179-V271 HydrophobicContact CB-CG2 4.32Å; L179-V271 HydrophobicContact CD2-CG2 3.67Å
180	F	97.1	Very high	94.4	Very high	36 Å²	36	47 Å²	47	16%	0.158	25%	0.252	C	S	.	.	H	α-helix	trans	-54.9	-51.5	172.9	179.4	-79.3	0	0	0	111	P176 R178 Y182 V183 V184 K260 L263 E264 T267	P176-F180 VanDerWaalsContact O-CB 3.26Å; P176-F180 WeakPolarHBondContact O-CB 3.32Å; P176-F180 PolarHBondContact O-N 3.28Å; R178-F180 PolarHBondContact O-N 3.26Å; F180-Y182 VanDerWaalsContact C-N 3.33Å; F180-Y182 PolarHBondContact O-N 2.93Å; F180-V183 PolarHBondContact O-N 2.97Å; F180-V184 HydrophobicContact CD1-CG2 4.16Å; F180-V184 HydrophobicContact CE1-CG2 3.85Å; F180-V184 HydrophobicContact CZ-CG2 4.24Å; F180-V184 VanDerWaalsContact O-CG2 3.25Å; F180-V184 WeakPolarHBondContact O-CG2 3.48Å; F180-V184 PolarHBondContact O-N 3.49Å; F180-K260 HydrophobicContact CE2-CG 4.06Å; F180-K260 HydrophobicContact CZ-CG 3.95Å; F180-L263 HydrophobicContact CD2-CB 4.21Å; F180-L263 HydrophobicContact CD2-CD2 3.79Å; F180-L263 HydrophobicContact CD2-CG 3.69Å; F180-L263 HydrophobicContact CE2-CB 3.95Å; F180-L263 HydrophobicContact CE2-CD2 3.63Å; F180-L263 HydrophobicContact CE2-CG 3.8Å; F180-L263 HydrophobicContact CG-CD2 4.43Å; F180-L263 HydrophobicContact CZ-CD2 4.16Å; F180-E264 HydrophobicContact CD2-CG 3.77Å; F180-E264 HydrophobicContact CE2-CG 3.82Å; F180-T267 HydrophobicContact CB-CG2 4.44Å
181	I	96.3	Very high	94.2	Very high	100 Å²	100	49 Å²	49	51%	0.513	26%	0.263	S	S	.	.	H	α-helix	trans	-64	-40.1	178.8	-64	166.4	0	0	0	110.8	N177 R178 L179 V184 N185	N177-I181 WeakPolarHBondContact O-CG1 3.4Å; N177-I181 PolarHBondContact O-N 3.44Å; R178-I181 PolarHBondContact O-N 2.72Å; L179-I181 PolarHBondContact O-N 3.42Å; I181-V184 PolarHBondContact O-N 3.31Å; I181-N185 VanDerWaalsContact O-CG 3.31Å; I181-N185 PolarHBondContact O-N 2.82Å; I181-N185 PolarHBondContact O-ND2 3.04Å; I181-N185 VanDerWaalsContact O-ND2 3.1Å
182	Y	96.5	Very high	94	Very high	32 Å²	32	48 Å²	48	13%	0.125	25%	0.253	C	S	.	.	H	α-helix	trans	-65.1	-43.4	178.8	-168.1	-86.4	0	0	0	112.1	L161 L164 M165 E168 R178 L179 F180 N185 N186	L161-Y182 HydrophobicContact CB-CD1 4.46Å; L161-Y182 HydrophobicContact CB-CE1 4.45Å; L161-Y182 HydrophobicContact CD2-CE1 4.06Å; L164-Y182 WeakPolarHBondContact CD2-OH 2.96Å; L164-Y182 WeakPolarHBondContact CG-OH 3.38Å; M165-Y182 HydrophobicContact CB-CD1 4.17Å; M165-Y182 HydrophobicContact CB-CD2 4.1Å; M165-Y182 HydrophobicContact CB-CE1 4.07Å; M165-Y182 HydrophobicContact CB-CE2 3.99Å; M165-Y182 HydrophobicContact CB-CG 4.18Å; M165-Y182 HydrophobicContact CG-CD2 3.75Å; M165-Y182 HydrophobicContact CG-CE2 3.93Å; M165-Y182 HydrophobicContact CG-CG 4.08Å; M165-Y182 HydrophobicContact SD-CD2 4.23Å; M165-Y182 HydrophobicContact SD-CG 4.16Å; E168-Y182 WeakPolarHBondContact OE2-CE2 3.34Å; E168-Y182 PolarHBondContact OE2-OH 2.65Å; R178-Y182 WeakPolarHBondContact O-CB 3.5Å; R178-Y182 PolarHBondContact O-N 2.6Å; L179-Y182 PolarHBondContact O-N 2.73Å; F180-Y182 VanDerWaalsContact C-N 3.33Å; F180-Y182 PolarHBondContact O-N 2.93Å; Y182-N185 PolarHBondContact O-N 3.48Å; Y182-N186 HydrophobicContact CD1-CB 4.33Å; Y182-N186 HydrophobicContact CE1-CB 4.11Å; Y182-N186 WeakPolarHBondContact O-CB 3.18Å; Y182-N186 PolarHBondContact O-N 3.45Å; Y182-N186 PolarHBondContact O-ND2 3.12Å
183	V	95.9	Very high	93.6	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.9	-45.3	176.2	171.8	0	0	0	0	111	V158 L161 L179 F180 N185 N186 M187 L263	V158-V183 HydrophobicContact CG1-CG2 4.08Å; V158-V183 HydrophobicContact CG2-CG1 4.41Å; V158-V183 HydrophobicContact CG2-CG2 4.38Å; L161-V183 HydrophobicContact CB-CG2 4.38Å; L161-V183 HydrophobicContact CD1-CG1 4.43Å; L161-V183 HydrophobicContact CD1-CG2 4.02Å; L179-V183 HydrophobicContact CD1-CG2 3.98Å; L179-V183 HydrophobicContact CG-CG2 4.17Å; L179-V183 WeakPolarHBondContact O-CB 3.33Å; L179-V183 VanDerWaalsContact O-CG2 3.26Å; L179-V183 WeakPolarHBondContact O-CG2 3Å; L179-V183 PolarHBondContact O-N 2.93Å; F180-V183 PolarHBondContact O-N 2.97Å; V183-N185 PolarHBondContact O-N 3.18Å; V183-N185 VanDerWaalsContact O-N 3.17Å; V183-N186 PolarHBondContact O-N 3.48Å; V183-M187 HydrophobicContact CG1-CB 4.49Å; V183-M187 HydrophobicContact CG1-CE 3.75Å; V183-M187 HydrophobicContact CG1-SD 4.49Å; V183-M187 VanDerWaalsContact O-CB 3.3Å; V183-M187 WeakPolarHBondContact O-CB 3.35Å; V183-M187 PolarHBondContact O-N 3.21Å; V183-L263 HydrophobicContact CG1-CD1 3.97Å; V183-L263 HydrophobicContact CG1-CD2 4.45Å
184	V	93.7	Very high	93.4	Very high	62 Å²	62	51.1 Å²	51.1	38%	0.376	27%	0.265	S	S	.	.	H	α-helix	trans	-57.1	-32.3	177.6	169.6	0	0	0	0	112.2	F180 I181 W254 L263	F180-V184 HydrophobicContact CD1-CG2 4.16Å; F180-V184 HydrophobicContact CE1-CG2 3.85Å; F180-V184 HydrophobicContact CZ-CG2 4.24Å; F180-V184 VanDerWaalsContact O-CG2 3.25Å; F180-V184 WeakPolarHBondContact O-CG2 3.48Å; F180-V184 PolarHBondContact O-N 3.49Å; I181-V184 PolarHBondContact O-N 3.31Å; V184-W254 HydrophobicContact CG2-CG 4.46Å; V184-L263 HydrophobicContact CG2-CD2 3.89Å
185	N	92.6	Very high	93.1	Very high	117 Å²	117	51.1 Å²	51.1	63%	0.626	27%	0.265	S	S	*	.	H	α-helix	trans	-94	-25.6	-177.4	-66.4	-28.7	0	0	0	114.8	I181 Y182 V183	I181-N185 VanDerWaalsContact O-CG 3.31Å; I181-N185 PolarHBondContact O-N 2.82Å; I181-N185 PolarHBondContact O-ND2 3.04Å; I181-N185 VanDerWaalsContact O-ND2 3.1Å; Y182-N185 PolarHBondContact O-N 3.48Å; V183-N185 PolarHBondContact O-N 3.18Å; V183-N185 VanDerWaalsContact O-N 3.17Å
186	N	93.2	Very high	92.8	Very high	82 Å²	82	51.8 Å²	51.8	44%	0.439	27%	0.268	S	S	.	.	H	α-helix	trans	-120.3	1.4	-170.2	-59.9	-69.8	0	0	0	114.9	L161 Y182 V183 S188	L161-N186 HydrophobicContact CD2-CB 4.32Å; Y182-N186 HydrophobicContact CD1-CB 4.33Å; Y182-N186 HydrophobicContact CE1-CB 4.11Å; Y182-N186 WeakPolarHBondContact O-CB 3.18Å; Y182-N186 PolarHBondContact O-N 3.45Å; Y182-N186 PolarHBondContact O-ND2 3.12Å; V183-N186 PolarHBondContact O-N 3.48Å; N186-S188 PolarHBondContact O-N 2.97Å
187	M	90.2	Very high	92.4	Very high	32 Å²	32	56.6 Å²	56.6	16%	0.158	29%	0.293	C	S	.	.			trans	-63.4	129	176.7	-165.8	67.6	106.1	0	0	111.1	A157 V158 L161 V183 N191 L192 M195	A157-M187 HydrophobicContact CB-CE 4.48Å; V158-M187 HydrophobicContact CG2-CE 4.03Å; L161-M187 HydrophobicContact CD1-CE 4.41Å; L161-M187 HydrophobicContact CD1-SD 3.66Å; V183-M187 HydrophobicContact CG1-CB 4.49Å; V183-M187 HydrophobicContact CG1-CE 3.75Å; V183-M187 HydrophobicContact CG1-SD 4.49Å; V183-M187 VanDerWaalsContact O-CB 3.3Å; V183-M187 WeakPolarHBondContact O-CB 3.35Å; V183-M187 PolarHBondContact O-N 3.21Å; M187-N191 HydrophobicContact CE-CB 4.4Å; M187-N191 HydrophobicContact CG-CB 3.97Å; M187-N191 HydrophobicContact SD-CB 3.35Å; M187-N191 WeakPolarHBondContact SD-CB 3.42Å; M187-L192 HydrophobicContact CG-CB 4.28Å; M187-M195 HydrophobicContact CE-CE 4.2Å; M187-M195 HydrophobicContact CE-CG 3.67Å; M187-M195 HydrophobicContact CE-SD 3.94Å
188	S	90	Very high	92.1	Very high	48 Å²	48	51.9 Å²	51.9	34%	0.336	27%	0.268	S	S	.	.			trans	-67.7	157.5	174.2	73.5	0	0	0	0	111.2	N186 E190 N191 L192	N186-S188 PolarHBondContact O-N 2.97Å; S188-E190 PolarHBondContact O-N 3.3Å; S188-N191 PolarHBondContact O-N 3.48Å; S188-N191 WeakPolarHBondContact OG-CB 3.46Å; S188-N191 PolarHBondContact OG-N 3.31Å; S188-N191 PolarHBondContact OG-OD1 2.95Å; S188-L192 VanDerWaalsContact O-CB 3.27Å; S188-L192 WeakPolarHBondContact O-CB 3.44Å; S188-L192 PolarHBondContact O-N 3.21Å
189	V	86.5	Confident	91.7	Very high	93 Å²	93	49 Å²	49	56%	0.564	26%	0.26	S	S	*	.	H	α-helix	trans	-60.9	-32.3	176.4	-178.8	0	0	0	0	111.4	R193	V189-R193 WeakPolarHBondContact O-CG 3.33Å; V189-R193 PolarHBondContact O-N 3.25Å; V189-R193 VanDerWaalsContact O-N 3.12Å
190	E	87.5	Confident	91.4	Very high	110 Å²	110	49 Å²	49	51%	0.514	26%	0.26	S	S	.	.	H	α-helix	trans	-74.8	-46.9	179.2	-155.9	63.3	-167.2	0	0	112	S188 L192 R193 V194	S188-E190 PolarHBondContact O-N 3.3Å; E190-L192 PolarHBondContact O-N 2.95Å; E190-R193 WeakPolarHBondContact O-CB 3.49Å; E190-R193 PolarHBondContact O-N 3.38Å; E190-R193 IonicContact OE1-NH1 3.94Å; E190-R193 WeakPolarHBondContact OE2-CD 3.26Å; E190-R193 IonicContact OE2-CZ 3.68Å; E190-R193 IonicContact OE2-NE 3.91Å; E190-R193 IonicContact OE2-NH1 2.71Å; E190-R193 PolarHBondContact OE2-NH1 3.03Å; E190-V194 PolarHBondContact O-N 3Å; E190-V194 VanDerWaalsContact O-N 3.13Å
191	N	90.8	Very high	91.1	Very high	43 Å²	43	47.5 Å²	47.5	23%	0.23	25%	0.253	C	S	.	.	H	α-helix	trans	-63.4	-30	174	-62.8	11.8	0	0	0	110.8	A157 M187 S188 V194 M195	A157-N191 HydrophobicContact CB-CB 4.07Å; M187-N191 HydrophobicContact CE-CB 4.4Å; M187-N191 HydrophobicContact CG-CB 3.97Å; M187-N191 HydrophobicContact SD-CB 3.35Å; M187-N191 WeakPolarHBondContact SD-CB 3.42Å; S188-N191 PolarHBondContact O-N 3.48Å; S188-N191 WeakPolarHBondContact OG-CB 3.46Å; S188-N191 PolarHBondContact OG-N 3.31Å; S188-N191 PolarHBondContact OG-OD1 2.95Å; N191-V194 WeakPolarHBondContact O-CB 3.29Å; N191-V194 PolarHBondContact O-N 3.26Å; N191-M195 VanDerWaalsContact O-CG 3.28Å; N191-M195 WeakPolarHBondContact O-CG 3.5Å; N191-M195 PolarHBondContact O-N 2.96Å
192	L	90.4	Very high	90.8	Very high	27 Å²	27	43.8 Å²	43.8	14%	0.141	24%	0.236	C	C	.	.	H	α-helix	trans	-67	-34.7	173	-176.3	60.7	0	0	0	112.8	M187 S188 E190 M195 I196 T201 L247 P253 W254	M187-L192 HydrophobicContact CG-CB 4.28Å; S188-L192 VanDerWaalsContact O-CB 3.27Å; S188-L192 WeakPolarHBondContact O-CB 3.44Å; S188-L192 PolarHBondContact O-N 3.21Å; E190-L192 PolarHBondContact O-N 2.95Å; L192-M195 PolarHBondContact O-N 3.48Å; L192-I196 WeakPolarHBondContact O-CG1 3.2Å; L192-I196 PolarHBondContact O-N 2.82Å; L192-I196 VanDerWaalsContact O-N 3.15Å; L192-T201 HydrophobicContact CD1-CG2 4.39Å; L192-L247 HydrophobicContact CD2-CD1 3.84Å; L192-P253 HydrophobicContact CD1-CB 3.77Å; L192-P253 HydrophobicContact CD1-CG 3.74Å; L192-P253 HydrophobicContact CD2-CG 3.97Å; L192-P253 HydrophobicContact CG-CG 4.39Å; L192-W254 HydrophobicContact CD1-CZ2 4.24Å
193	R	88	Confident	90	Very high	69 Å²	69	44.9 Å²	44.9	26%	0.26	25%	0.247	S	C	.	.	H	α-helix	trans	-62.6	-47	170.7	-71.3	163.5	168.6	170.1	-7.8	110.7	V189 E190 M195 I196 D197 T243	V189-R193 WeakPolarHBondContact O-CG 3.33Å; V189-R193 PolarHBondContact O-N 3.25Å; V189-R193 VanDerWaalsContact O-N 3.12Å; E190-R193 WeakPolarHBondContact O-CB 3.49Å; E190-R193 PolarHBondContact O-N 3.38Å; E190-R193 IonicContact OE1-NH1 3.94Å; E190-R193 WeakPolarHBondContact OE2-CD 3.26Å; E190-R193 IonicContact OE2-CZ 3.68Å; E190-R193 IonicContact OE2-NE 3.91Å; E190-R193 IonicContact OE2-NH1 2.71Å; E190-R193 PolarHBondContact OE2-NH1 3.03Å; R193-M195 VanDerWaalsContact C-N 3.27Å; R193-M195 PolarHBondContact O-N 3.42Å; R193-I196 CarbonylContact O-C 3.41Å; R193-I196 WeakPolarHBondContact O-CA 3.45Å; R193-I196 WeakPolarHBondContact O-CB 3.24Å; R193-I196 PolarHBondContact O-N 2.85Å; R193-D197 PolarHBondContact O-N 3.5Å; R193-T243 PolarHBondContact NH2-O 3.13Å; R193-T243 VanDerWaalsContact NH2-O 3.16Å
194	V	90.4	Very high	89.3	Confident	25 Å²	25	47 Å²	47	15%	0.152	26%	0.258	C	S	.	.	H	α-helix	trans	-55.8	-38.7	175.2	175	0	0	0	0	112.4	S150 E153 S154 E190 N191 I196 S198	S150-V194 WeakPolarHBondContact O-CG1 3.33Å; E153-V194 HydrophobicContact CB-CG1 3.47Å; E153-V194 VanDerWaalsContact CB-CG1 3.47Å; S154-V194 PolarHBondContact OG-O 2.92Å; E190-V194 PolarHBondContact O-N 3Å; E190-V194 VanDerWaalsContact O-N 3.13Å; N191-V194 WeakPolarHBondContact O-CB 3.29Å; N191-V194 PolarHBondContact O-N 3.26Å; V194-I196 VanDerWaalsContact C-N 3.35Å; V194-S198 WeakPolarHBondContact O-CB 3.31Å; V194-S198 PolarHBondContact O-N 3.01Å; V194-S198 PolarHBondContact O-OG 3.14Å; V194-S198 VanDerWaalsContact O-OG 3.1Å
195	M	91.7	Very high	88.2	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-71.3	-24.2	174.5	-59.9	-72.2	-80.5	0	0	113.9	S154 V158 M187 N191 L192 R193 S198 L200 T201 W254 L263	S154-M195 WeakPolarHBondContact CB-SD 3.01Å; V158-M195 HydrophobicContact CG2-CE 4.18Å; V158-M195 HydrophobicContact CG2-SD 4.48Å; M187-M195 HydrophobicContact CE-CE 4.2Å; M187-M195 HydrophobicContact CE-CG 3.67Å; M187-M195 HydrophobicContact CE-SD 3.94Å; N191-M195 VanDerWaalsContact O-CG 3.28Å; N191-M195 WeakPolarHBondContact O-CG 3.5Å; N191-M195 PolarHBondContact O-N 2.96Å; L192-M195 PolarHBondContact O-N 3.48Å; R193-M195 VanDerWaalsContact C-N 3.27Å; R193-M195 PolarHBondContact O-N 3.42Å; M195-S198 WeakPolarHBondContact CA-OG 3.45Å; M195-S198 PolarHBondContact O-OG 3.21Å; M195-L200 HydrophobicContact CE-CD1 3.79Å; M195-L200 PolarHBondContact O-N 3.37Å; M195-L200 VanDerWaalsContact O-N 3.11Å; M195-L200 HydrophobicContact SD-CD1 3.78Å; M195-T201 HydrophobicContact CB-CG2 3.88Å; M195-T201 PolarHBondContact O-N 3.01Å; M195-W254 HydrophobicContact CB-CH2 4.14Å; M195-W254 HydrophobicContact CE-CH2 3.56Å; M195-W254 HydrophobicContact CE-CZ2 4.45Å; M195-W254 HydrophobicContact CE-CZ3 4.25Å; M195-W254 HydrophobicContact CG-CH2 4.29Å; M195-L263 HydrophobicContact CE-CD1 4.06Å
196	I	90.2	Very high	86.7	Confident	22 Å²	22	47.6 Å²	47.6	11%	0.113	27%	0.267	C	S	.	.	H	α-helix	trans	-76.7	-47.6	172.4	-66.7	161.6	0	0	0	109.6	L192 R193 V194 S198 G199 T201 L204 L247 Y251	L192-I196 WeakPolarHBondContact O-CG1 3.2Å; L192-I196 PolarHBondContact O-N 2.82Å; L192-I196 VanDerWaalsContact O-N 3.15Å; R193-I196 CarbonylContact O-C 3.41Å; R193-I196 WeakPolarHBondContact O-CA 3.45Å; R193-I196 WeakPolarHBondContact O-CB 3.24Å; R193-I196 PolarHBondContact O-N 2.85Å; V194-I196 VanDerWaalsContact C-N 3.35Å; I196-S198 VanDerWaalsContact C-N 3.32Å; I196-S198 PolarHBondContact O-N 3.05Å; I196-G199 WeakPolarHBondContact O-CA 3.45Å; I196-G199 PolarHBondContact O-N 3.46Å; I196-T201 WeakPolarHBondContact CA-OG1 3.29Å; I196-T201 HydrophobicContact CG1-CG2 4Å; I196-T201 WeakPolarHBondContact CG1-OG1 3.37Å; I196-L204 HydrophobicContact CD1-CD2 4.47Å; I196-L204 HydrophobicContact CG2-CD1 3.97Å; I196-L204 HydrophobicContact CG2-CG 4.13Å; I196-L247 HydrophobicContact CD1-CD2 4.03Å; I196-Y251 HydrophobicContact CD1-CE1 4.15Å
197	D	88.4	Confident	84.7	Confident	118 Å²	118	52.5 Å²	52.5	63%	0.631	29%	0.287	S	S	*	.	H	α-helix	trans	-68.4	-29.7	-177.3	-64	-27.9	0	0	0	112.5	R193 G199	R193-D197 PolarHBondContact O-N 3.5Å; D197-G199 PolarHBondContact O-N 3.05Å
198	S	89.9	Confident	82.1	Confident	5 Å²	5	59.8 Å²	59.8	4%	0.035	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-8.3	168.4	66.9	0	0	0	0	114	S150 S154 V194 M195 I196 L200 L1154	S150-S198 WeakPolarHBondContact O-CB 3.41Å; S154-S198 VanDerWaalsContact OG-CB 3.31Å; S154-S198 WeakPolarHBondContact OG-CB 3.39Å; S154-S198 PolarHBondContact OG-OG 3.39Å; V194-S198 WeakPolarHBondContact O-CB 3.31Å; V194-S198 PolarHBondContact O-N 3.01Å; V194-S198 PolarHBondContact O-OG 3.14Å; V194-S198 VanDerWaalsContact O-OG 3.1Å; M195-S198 WeakPolarHBondContact CA-OG 3.45Å; M195-S198 PolarHBondContact O-OG 3.21Å; I196-S198 VanDerWaalsContact C-N 3.32Å; I196-S198 PolarHBondContact O-N 3.05Å; S198-L200 VanDerWaalsContact C-N 3.33Å; S198-L200 WeakPolarHBondContact OG-CD1 3.39Å; S198-L200 WeakPolarHBondContact OG-CG 3.49Å; S198-L1154 WeakPolarHBondContact O-CD2 3.42Å
199	G	89.9	Confident	79.5	Confident	9 Å²	9	60.6 Å²	60.6	9%	0.093	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	17.5	179.4	0	0	0	0	0	114.5	I196 D197 L1154 N1155	I196-G199 WeakPolarHBondContact O-CA 3.45Å; I196-G199 PolarHBondContact O-N 3.46Å; D197-G199 PolarHBondContact O-N 3.05Å; G199-L1154 WeakPolarHBondContact O-CA 3.3Å; G199-N1155 PolarHBondContact O-N 2.98Å; G199-N1155 VanDerWaalsContact O-N 3.08Å; G199-N1155 PolarHBondContact O-ND2 3.15Å
200	L	91.1	Very high	76.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	35%	0.346	C	S	.	.			trans	-77.3	-30	-179.5	-68.7	169.9	0	0	0	113.1	L151 M195 S198 A259 N262 M266 F1152 L1154	L151-L200 HydrophobicContact CD1-CD1 3.87Å; L151-L200 HydrophobicContact CD1-CD2 4.12Å; L151-L200 HydrophobicContact CD1-CG 4.2Å; M195-L200 HydrophobicContact CE-CD1 3.79Å; M195-L200 PolarHBondContact O-N 3.37Å; M195-L200 VanDerWaalsContact O-N 3.11Å; M195-L200 HydrophobicContact SD-CD1 3.78Å; S198-L200 VanDerWaalsContact C-N 3.33Å; S198-L200 WeakPolarHBondContact OG-CD1 3.39Å; S198-L200 WeakPolarHBondContact OG-CG 3.49Å; L200-A259 WeakPolarHBondContact O-CA 3.37Å; L200-N262 HydrophobicContact CB-CB 4.45Å; L200-N262 HydrophobicContact CD2-CB 3.92Å; L200-N262 PolarHBondContact O-ND2 3.43Å; L200-N262 VanDerWaalsContact O-ND2 3.16Å; L200-M266 HydrophobicContact CD1-CE 3.59Å; L200-F1152 HydrophobicContact CD2-CB 4.25Å; L200-F1152 HydrophobicContact CD2-CD1 3.77Å; L200-F1152 HydrophobicContact CD2-CD2 4.36Å; L200-F1152 HydrophobicContact CD2-CE1 4.18Å; L200-F1152 HydrophobicContact CD2-CG 3.89Å; L200-L1154 HydrophobicContact CD2-CD2 3.58Å; L200-L1154 HydrophobicContact CG-CD2 4.17Å
201	T	90.6	Very high	74.1	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.018	37%	0.367	C	S	.	.	S	Bend	trans	-84	175.7	-177	63.3	0	0	0	0	114	L192 M195 I196 Y251 P253 W254 N1155	L192-T201 HydrophobicContact CD1-CG2 4.39Å; M195-T201 HydrophobicContact CB-CG2 3.88Å; M195-T201 PolarHBondContact O-N 3.01Å; I196-T201 WeakPolarHBondContact CA-OG1 3.29Å; I196-T201 HydrophobicContact CG1-CG2 4Å; I196-T201 WeakPolarHBondContact CG1-OG1 3.37Å; T201-Y251 WeakPolarHBondContact CB-OH 3.21Å; T201-Y251 PolarHBondContact OG1-OH 3.31Å; T201-Y251 VanDerWaalsContact OG1-OH 3.11Å; T201-P253 CarbonylContact C-O 3.51Å; T201-P253 VanDerWaalsContact CA-O 3.31Å; T201-P253 WeakPolarHBondContact CA-O 3.29Å; T201-P253 VanDerWaalsContact CB-O 3.31Å; T201-P253 WeakPolarHBondContact CB-O 3.48Å; T201-P253 HydrophobicContact CG2-CB 3.86Å; T201-W254 HydrophobicContact CG2-CE3 4.44Å; T201-W254 HydrophobicContact CG2-CH2 3.7Å; T201-W254 HydrophobicContact CG2-CZ2 4.37Å; T201-W254 HydrophobicContact CG2-CZ3 3.75Å; T201-N1155 PolarHBondContact O-ND2 3.21Å
202	T	88.4	Confident	71.4	Confident	23 Å²	23	66.9 Å²	66.9	14%	0.141	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-55	132	161.9	-60.3	0	0	0	0	110.2	Y251 S252 P253 G255 T256	T202-Y251 HydrophobicContact CG2-CE2 4.25Å; T202-Y251 WeakPolarHBondContact O-CE2 3.49Å; T202-Y251 PolarHBondContact O-OH 3.07Å; T202-S252 WeakPolarHBondContact CB-O 3.26Å; T202-S252 PolarHBondContact OG1-O 3.49Å; T202-P253 PolarHBondContact N-O 2.93Å; T202-P253 PolarHBondContact OG1-O 3.38Å; T202-G255 PolarHBondContact OG1-N 3.07Å; T202-T256 HydrophobicContact CG2-CG2 3.75Å; T202-T256 PolarHBondContact OG1-N 2.85Å; T202-T256 PolarHBondContact OG1-OG1 3.27Å
203	P	81.6	Confident	68.5	Low	55 Å²	55	71.4 Å²	71.4	36%	0.357	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-53.7	141.7	175.8	-26.9	34.9	0	0	0	113	N1155	P203-N1155 HydrophobicContact CG-CB 4.29Å
204	L	80	Confident	66	Low	44 Å²	44	73.3 Å²	73.3	23%	0.23	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-64.5	136.2	174.6	-75.6	173.3	0	0	0	110.3	I196 V206 L247 Y251 Q1158	I196-L204 HydrophobicContact CD1-CD2 4.47Å; I196-L204 HydrophobicContact CG2-CD1 3.97Å; I196-L204 HydrophobicContact CG2-CG 4.13Å; L204-V206 PolarHBondContact O-N 3.01Å; L204-V206 VanDerWaalsContact O-N 3.15Å; L204-L247 HydrophobicContact CD2-CD2 3.85Å; L204-Y251 HydrophobicContact CD2-CD1 4.38Å; L204-Y251 HydrophobicContact CD2-CD2 4.21Å; L204-Y251 HydrophobicContact CD2-CE1 4.08Å; L204-Y251 HydrophobicContact CD2-CE2 3.91Å; L204-Y251 HydrophobicContact CD2-CG 4.44Å; L204-Q1158 PolarHBondContact O-NE2 3Å
205	P	69.8	Low	63.1	Low	80 Å²	80	77.4 Å²	77.4	52%	0.519	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-59.3	118.8	178.1	-23.6	33.6	0	0	0	111.4	H207	P205-H207 PolarHBondContact O-N 3.43Å
206	V	61.5	Low	60.3	Low	112 Å²	112	82.6 Å²	82.6	68%	0.679	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-67.6	117.5	172.4	-179.2	0	0	0	0	108.2	L204 Q208	L204-V206 PolarHBondContact O-N 3.01Å; L204-V206 VanDerWaalsContact O-N 3.15Å; V206-Q208 PolarHBondContact O-N 3.42Å
207	H	51.4	Low	57.5	Low	184 Å²	184	87.4 Å²	87.4	85%	0.852	55%	0.547	S	S	*	.			trans	-62.6	100.9	169.2	-100.9	-75.1	0	0	0	109.1	P205 G209	P205-H207 PolarHBondContact O-N 3.43Å; H207-G209 PolarHBondContact O-N 3.36Å
208	Q	36.9	Very low	54.8	Low	185 Å²	185	87.7 Å²	87.7	86%	0.864	56%	0.557	S	S	*	*			trans	-66	102.6	166	-71.7	-172.2	-11.4	0	0	108	V206	V206-Q208 PolarHBondContact O-N 3.42Å
209	G	34.5	Very low	52	Low	65 Å²	65	96 Å²	96	67%	0.67	60%	0.595	S	S	*	*			trans	-54.9	138.2	173.8	0	0	0	0	0	110.5	H207 N211	H207-G209 PolarHBondContact O-N 3.36Å; G209-N211 PolarHBondContact O-N 2.95Å
210	S	31.8	Very low	49.2	Very low	109 Å²	109	103.5 Å²	103.5	76%	0.762	63%	0.628	S	S	*	*			trans	-58.1	127.4	-176.8	49.8	0	0	0	0	111.8	S212	S210-S212 PolarHBondContact O-N 3.5Å
211	N	29.3	Very low	46.3	Very low	178 Å²	178	109.3 Å²	109.3	95%	0.952	66%	0.659	S	S	*	*			trans	-61.6	99.2	176.7	-78.6	-39.5	0	0	0	111.8	G209	G209-N211 PolarHBondContact O-N 2.95Å
212	S	32.6	Very low	43.4	Very low	92 Å²	92	114.1 Å²	114.1	64%	0.643	69%	0.692	S	S	*	*			trans	-143.9	78.6	169.6	63.5	0	0	0	0	112.6	S210	S210-S212 PolarHBondContact O-N 3.5Å
213	S	31.4	Very low	40.5	Very low	121 Å²	121	118.3 Å²	118.3	85%	0.846	72%	0.723	S	S	*	*			trans	38.2	98.1	142.8	60.7	0	0	0	0	119.7
214	A	33.9	Very low	38	Very low	110 Å²	110	122.1 Å²	122.1	91%	0.909	75%	0.749	S	S	*	*			trans	-155.7	130.8	138.2	0	0	0	0	0	109.9
215	S	30.4	Very low	35.6	Very low	110 Å²	110	127.2 Å²	127.2	77%	0.769	78%	0.782	S	S	*	*			trans	-102	147.5	172.2	52.8	0	0	0	0	110.6
216	S	32.2	Very low	33.6	Very low	110 Å²	110	126.7 Å²	126.7	77%	0.769	79%	0.791	S	S	*	*				153.3	162.5	115.3	60.1	0	0	0	0	114.7
217	V	31.8	Very low	32	Very low	123 Å²	123	133.3 Å²	133.3	75%	0.745	80%	0.804	S	S	*	*			trans	74.1	85.2	162.4	-164.9	0	0	0	0	119
218	C	32.5	Very low	31	Very low	124 Å²	124	131.2 Å²	131.2	84%	0.838	80%	0.804	S	S	*	*				67.1	136.6	124.7	-55.1	0	0	0	0	123.5
219	E	29.2	Very low	30.6	Very low	180 Å²	180	133.3 Å²	133.3	84%	0.841	80%	0.804	S	S	*	*			trans	-68.7	155.7	155.9	-59.2	153.2	124.1	0	0	109.7
220	E	31.9	Very low	30.4	Very low	165 Å²	165	138.7 Å²	138.7	77%	0.771	81%	0.811	S	S	*	*				-176.8	156.8	79	-96.5	-158.4	163.2	0	0	113.9
221	N	29.8	Very low	30.4	Very low	123 Å²	123	137.8 Å²	137.8	66%	0.658	81%	0.805	S	S	*	*			trans	60.7	120	141.9	-72.7	-44.4	0	0	0	124.3
222	S	29.4	Very low	30.7	Very low	103 Å²	103	138 Å²	138	72%	0.72	80%	0.797	S	S	*	*				92.8	113.6	129.9	74.5	0	0	0	0	121.6
223	S	28	Very low	30.7	Very low	112 Å²	112	140.9 Å²	140.9	78%	0.783	80%	0.801	S	S	*	*			trans	32.5	117.3	139.4	60.5	0	0	0	0	121.2
224	C	29.7	Very low	30.6	Very low	135 Å²	135	141 Å²	141	91%	0.912	79%	0.791	S	S	*	*				-154.1	148.5	127.1	-139.6	0	0	0	0	112.2
225	V	28.8	Very low	30.7	Very low	150 Å²	150	138.5 Å²	138.5	91%	0.909	77%	0.767	S	S	*	*			trans	-94.5	122.3	177.8	174.4	0	0	0	0	109.5
226	G	28.8	Very low	30.7	Very low	70 Å²	70	141.7 Å²	141.7	72%	0.722	76%	0.762	S	S	*	*			trans	-139.9	112.9	-179.6	0	0	0	0	0	113	V228	G226-V228 PolarHBondContact O-N 3.04Å
227	R	28.7	Very low	30.7	Very low	250 Å²	250	139.5 Å²	139.5	94%	0.943	75%	0.747	S	S	*	*			trans	-69.1	125	171.5	-79.3	176	168.7	164.1	-4.4	110.6
228	V	29.6	Very low	30.8	Very low	141 Å²	141	137.8 Å²	137.8	86%	0.855	73%	0.733	S	S	*	*			trans	-131.1	130.5	155.1	-177.2	0	0	0	0	109	G226	G226-V228 PolarHBondContact O-N 3.04Å
229	R	27.5	Very low	31	Very low	229 Å²	229	138.8 Å²	138.8	86%	0.864	73%	0.725	S	S	*	*			trans	-86.9	136.2	170.9	-63.3	166	169.1	161.6	-7.7	107.9
230	H	30.8	Very low	31.1	Very low	177 Å²	177	139.4 Å²	139.4	82%	0.819	72%	0.72	S	S	*	*			trans	152.3	99.5	153.7	-87.3	-71.9	0	0	0	109.5
231	S	32.2	Very low	31.1	Very low	91 Å²	91	138.5 Å²	138.5	64%	0.636	72%	0.715	S	S	*	*			trans	-149.3	7.4	-179.7	61.2	0	0	0	0	117	E233 S235	S231-E233 VanDerWaalsContact C-N 3.29Å; S231-E233 PolarHBondContact O-N 2.95Å; S231-S235 PolarHBondContact O-OG 3.43Å
232	K	34.8	Very low	31.6	Very low	182 Å²	182	137.9 Å²	137.9	79%	0.791	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-8	176.2	-77.8	-165.8	172.9	-172.3	0	114.9
233	E	32.5	Very low	32.2	Very low	153 Å²	153	137.3 Å²	137.3	72%	0.715	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	-29.4	178.5	-73.5	165.8	118.1	0	0	113.5	S231 S235 R236 S237	S231-E233 VanDerWaalsContact C-N 3.29Å; S231-E233 PolarHBondContact O-N 2.95Å; E233-S235 PolarHBondContact O-N 3.03Å; E233-R236 PolarHBondContact O-N 3.18Å; E233-S237 PolarHBondContact O-N 3.33Å
234	L	31	Very low	32.9	Very low	122 Å²	122	136.5 Å²	136.5	64%	0.639	70%	0.698	S	S	*	*	H	α-helix	trans	-62.5	-41.6	171.7	-99.8	76.9	0	0	0	111.8	R236 S237 L238	L234-R236 PolarHBondContact O-N 2.8Å; L234-S237 WeakPolarHBondContact O-CB 3.41Å; L234-S237 PolarHBondContact O-N 3.42Å; L234-L238 PolarHBondContact O-N 2.89Å
235	S	34.5	Very low	33.9	Very low	58 Å²	58	135.3 Å²	135.3	41%	0.406	68%	0.682	S	S	.	*	H	α-helix	trans	-57.8	-46.3	176.9	50.6	0	0	0	0	112.1	S231 E233 S237 L238 Q239	S231-S235 PolarHBondContact O-OG 3.43Å; E233-S235 PolarHBondContact O-N 3.03Å; S235-S237 PolarHBondContact O-N 2.87Å; S235-L238 PolarHBondContact O-N 3.13Å; S235-Q239 VanDerWaalsContact O-CB 3.28Å; S235-Q239 WeakPolarHBondContact O-CB 3.43Å; S235-Q239 PolarHBondContact O-N 3.22Å
236	R	32	Very low	35.3	Very low	177 Å²	177	134.1 Å²	134.1	67%	0.668	68%	0.676	S	S	*	*	H	α-helix	trans	-66.3	-16.5	175.9	-71.9	177.2	166.9	175.8	-5.4	114.1	E233 L234 R240	E233-R236 PolarHBondContact O-N 3.18Å; L234-R236 PolarHBondContact O-N 2.8Å; R236-R240 WeakPolarHBondContact O-CD 3.38Å; R236-R240 WeakPolarHBondContact O-CG 3.39Å
237	S	30.9	Very low	37.1	Very low	64 Å²	64	133.9 Å²	133.9	45%	0.448	66%	0.658	S	S	.	*	H	α-helix	trans	-89.4	-46.1	174	-164.5	0	0	0	0	112.1	E233 L234 S235 Q239 R240 H241	E233-S237 PolarHBondContact O-N 3.33Å; L234-S237 WeakPolarHBondContact O-CB 3.41Å; L234-S237 PolarHBondContact O-N 3.42Å; S235-S237 PolarHBondContact O-N 2.87Å; S237-Q239 PolarHBondContact O-N 2.84Å; S237-R240 WeakPolarHBondContact O-CB 3.41Å; S237-R240 PolarHBondContact O-N 3.5Å; S237-R240 VanDerWaalsContact O-N 3.13Å; S237-H241 PolarHBondContact O-N 3.31Å; S237-H241 PolarHBondContact O-ND1 3.27Å
238	L	33.5	Very low	39	Very low	88 Å²	88	124.3 Å²	124.3	46%	0.461	63%	0.628	S	S	.	*	H	α-helix	trans	-60.2	-44.1	176	-80.4	159.7	0	0	0	112	L234 S235 R240 H241 L242	L234-L238 PolarHBondContact O-N 2.89Å; S235-L238 PolarHBondContact O-N 3.13Å; L238-R240 PolarHBondContact O-N 3.35Å; L238-R240 VanDerWaalsContact O-N 3.09Å; L238-H241 PolarHBondContact O-N 2.91Å; L238-L242 PolarHBondContact O-N 2.79Å; L238-L242 VanDerWaalsContact O-N 3.14Å
239	Q	36.8	Very low	40.9	Very low	144 Å²	144	124.2 Å²	124.2	67%	0.673	63%	0.633	S	S	*	*	H	α-helix	trans	-66.3	-11.2	178.7	-158.3	167.5	11.9	0	0	113.3	S235 S237	S235-Q239 VanDerWaalsContact O-CB 3.28Å; S235-Q239 WeakPolarHBondContact O-CB 3.43Å; S235-Q239 PolarHBondContact O-N 3.22Å; S237-Q239 PolarHBondContact O-N 2.84Å
240	R	31.2	Very low	43.2	Very low	194 Å²	194	119.8 Å²	119.8	73%	0.732	63%	0.627	S	S	*	*	H	α-helix	trans	-95.1	-13.1	170.7	-69.7	175.8	178	165.5	-0.6	114.3	R236 S237 L238 T243	R236-R240 WeakPolarHBondContact O-CD 3.38Å; R236-R240 WeakPolarHBondContact O-CG 3.39Å; S237-R240 WeakPolarHBondContact O-CB 3.41Å; S237-R240 PolarHBondContact O-N 3.5Å; S237-R240 VanDerWaalsContact O-N 3.13Å; L238-R240 PolarHBondContact O-N 3.35Å; L238-R240 VanDerWaalsContact O-N 3.09Å; R240-T243 PolarHBondContact O-OG1 2.97Å
241	H	33.6	Very low	45.6	Very low	145 Å²	145	112.8 Å²	112.8	67%	0.671	59%	0.593	S	S	*	*	H	α-helix	trans	-97.3	-31	177.2	-79.3	72.6	0	0	0	112.7	S237 L238 T243 S244	S237-H241 PolarHBondContact O-N 3.31Å; S237-H241 PolarHBondContact O-ND1 3.27Å; L238-H241 PolarHBondContact O-N 2.91Å; H241-T243 PolarHBondContact O-N 3Å; H241-S244 PolarHBondContact O-N 2.77Å
242	L	39.2	Very low	48.2	Very low	111 Å²	111	111.5 Å²	111.5	58%	0.581	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-67	-18.6	177.8	-74.6	165.1	0	0	0	114.3	L238 S244	L238-L242 PolarHBondContact O-N 2.79Å; L238-L242 VanDerWaalsContact O-N 3.14Å; L242-S244 PolarHBondContact O-N 3.16Å; L242-S244 VanDerWaalsContact O-N 3.16Å
243	T	42.3	Very low	50.6	Low	91 Å²	91	103.8 Å²	103.8	56%	0.558	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-62.7	-21.2	179.1	50.8	0	0	0	0	113.6	R193 R240 H241 L245	R193-T243 PolarHBondContact NH2-O 3.13Å; R193-T243 VanDerWaalsContact NH2-O 3.16Å; R240-T243 PolarHBondContact O-OG1 2.97Å; H241-T243 PolarHBondContact O-N 3Å; T243-L245 PolarHBondContact O-N 3.26Å
244	S	43.2	Very low	53.4	Low	95 Å²	95	98.1 Å²	98.1	66%	0.664	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-88.4	9.8	-173.1	-166.7	0	0	0	0	115.7	H241 L242 T246	H241-S244 PolarHBondContact O-N 2.77Å; L242-S244 PolarHBondContact O-N 3.16Å; L242-S244 VanDerWaalsContact O-N 3.16Å; S244-T246 PolarHBondContact O-N 2.97Å
245	L	50	Low	56	Low	109 Å²	109	94.9 Å²	94.9	57%	0.571	52%	0.521	S	S	*	.			trans	-71.4	94.6	171.1	-91.7	165.6	0	0	0	110.6	T243	T243-L245 PolarHBondContact O-N 3.26Å
246	T	58.6	Low	58.7	Low	126 Å²	126	94.1 Å²	94.1	77%	0.773	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-74.2	118.3	167.1	40.6	0	0	0	0	109.8	S244	S244-T246 PolarHBondContact O-N 2.97Å
247	L	65.8	Low	61.5	Low	65 Å²	65	91 Å²	91	34%	0.34	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-60.6	136.9	173	-68.2	172.5	0	0	0	109.8	L192 I196 L204 S249 Y251	L192-L247 HydrophobicContact CD2-CD1 3.84Å; I196-L247 HydrophobicContact CD1-CD2 4.03Å; L204-L247 HydrophobicContact CD2-CD2 3.85Å; L247-S249 PolarHBondContact O-N 3.45Å; L247-Y251 HydrophobicContact CD2-CD1 4.04Å; L247-Y251 HydrophobicContact CD2-CE1 4.18Å
248	P	68.7	Low	64.5	Low	49 Å²	49	90.7 Å²	90.7	32%	0.318	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-55.5	137.6	175.5	-24.9	33.4	0	0	0	111.2	N250 Y251	P248-N250 WeakPolarHBondContact CB-OD1 3.42Å; P248-N250 PolarHBondContact O-N 2.81Å; P248-Y251 VanDerWaalsContact O-CB 3.3Å; P248-Y251 WeakPolarHBondContact O-CB 3.38Å; P248-Y251 PolarHBondContact O-N 3.34Å
249	S	70.7	Confident	67.3	Low	138 Å²	138	86.5 Å²	86.5	97%	0.965	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-9.2	-175.1	54.6	0	0	0	0	114.8	L247	L247-S249 PolarHBondContact O-N 3.45Å
250	N	75	Confident	70	Confident	137 Å²	137	84.3 Å²	84.3	73%	0.733	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	5.1	174.6	65.5	-20	0	0	0	113.6	P248 S252	P248-N250 WeakPolarHBondContact CB-OD1 3.42Å; P248-N250 PolarHBondContact O-N 2.81Å; N250-S252 PolarHBondContact O-N 3Å
251	Y	81.4	Confident	73	Confident	30 Å²	30	77.2 Å²	77.2	12%	0.118	46%	0.461	C	S	.	.			trans	-70.9	125.6	177.7	175.1	-111.7	0	0	0	110.6	I196 T201 T202 L204 L247 P248 P253	I196-Y251 HydrophobicContact CD1-CE1 4.15Å; T201-Y251 WeakPolarHBondContact CB-OH 3.21Å; T201-Y251 PolarHBondContact OG1-OH 3.31Å; T201-Y251 VanDerWaalsContact OG1-OH 3.11Å; T202-Y251 HydrophobicContact CG2-CE2 4.25Å; T202-Y251 WeakPolarHBondContact O-CE2 3.49Å; T202-Y251 PolarHBondContact O-OH 3.07Å; L204-Y251 HydrophobicContact CD2-CD1 4.38Å; L204-Y251 HydrophobicContact CD2-CD2 4.21Å; L204-Y251 HydrophobicContact CD2-CE1 4.08Å; L204-Y251 HydrophobicContact CD2-CE2 3.91Å; L204-Y251 HydrophobicContact CD2-CG 4.44Å; L247-Y251 HydrophobicContact CD2-CD1 4.04Å; L247-Y251 HydrophobicContact CD2-CE1 4.18Å; P248-Y251 VanDerWaalsContact O-CB 3.3Å; P248-Y251 WeakPolarHBondContact O-CB 3.38Å; P248-Y251 PolarHBondContact O-N 3.34Å; Y251-P253 HydrophobicContact CD1-CG 4.07Å; Y251-P253 HydrophobicContact CE1-CB 4.06Å; Y251-P253 HydrophobicContact CE1-CG 3.67Å
252	S	86.3	Confident	75.9	Confident	64 Å²	64	70.6 Å²	70.6	45%	0.448	43%	0.431	S	S	.	.			trans	-111.9	105.4	174.2	-174.2	0	0	0	0	109.7	T202 N250 W254 G255	T202-S252 WeakPolarHBondContact CB-O 3.26Å; T202-S252 PolarHBondContact OG1-O 3.49Å; N250-S252 PolarHBondContact O-N 3Å; S252-W254 PolarHBondContact O-N 3.47Å; S252-W254 VanDerWaalsContact O-N 3.09Å; S252-G255 PolarHBondContact O-N 3.16Å; S252-G255 PolarHBondContact OG-N 3.45Å
253	P	86.6	Confident	78.6	Confident	20 Å²	20	65.4 Å²	65.4	13%	0.13	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-27.7	-178.8	-22	29.4	0	0	0	113.5	L192 T201 T202 Y251 A259	L192-P253 HydrophobicContact CD1-CB 3.77Å; L192-P253 HydrophobicContact CD1-CG 3.74Å; L192-P253 HydrophobicContact CD2-CG 3.97Å; L192-P253 HydrophobicContact CG-CG 4.39Å; T201-P253 CarbonylContact C-O 3.51Å; T201-P253 VanDerWaalsContact CA-O 3.31Å; T201-P253 WeakPolarHBondContact CA-O 3.29Å; T201-P253 VanDerWaalsContact CB-O 3.31Å; T201-P253 WeakPolarHBondContact CB-O 3.48Å; T201-P253 HydrophobicContact CG2-CB 3.86Å; T202-P253 PolarHBondContact N-O 2.93Å; T202-P253 PolarHBondContact OG1-O 3.38Å; Y251-P253 HydrophobicContact CD1-CG 4.07Å; Y251-P253 HydrophobicContact CE1-CB 4.06Å; Y251-P253 HydrophobicContact CE1-CG 3.67Å; P253-A259 WeakPolarHBondContact O-CB 3.47Å
254	W	90.5	Very high	81.2	Confident	34 Å²	34	63 Å²	63	13%	0.129	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	9.1	-178.1	-41.9	115.7	0	0	0	112.9	V184 L192 M195 T201 S252 T256 A259 L263	V184-W254 HydrophobicContact CG2-CG 4.46Å; L192-W254 HydrophobicContact CD1-CZ2 4.24Å; M195-W254 HydrophobicContact CB-CH2 4.14Å; M195-W254 HydrophobicContact CE-CH2 3.56Å; M195-W254 HydrophobicContact CE-CZ2 4.45Å; M195-W254 HydrophobicContact CE-CZ3 4.25Å; M195-W254 HydrophobicContact CG-CH2 4.29Å; T201-W254 HydrophobicContact CG2-CE3 4.44Å; T201-W254 HydrophobicContact CG2-CH2 3.7Å; T201-W254 HydrophobicContact CG2-CZ2 4.37Å; T201-W254 HydrophobicContact CG2-CZ3 3.75Å; S252-W254 PolarHBondContact O-N 3.47Å; S252-W254 VanDerWaalsContact O-N 3.09Å; W254-T256 PolarHBondContact O-N 3.3Å; W254-A259 HydrophobicContact CE3-CB 4.3Å; W254-L263 HydrophobicContact CD2-CD2 3.73Å; W254-L263 HydrophobicContact CE3-CB 3.93Å; W254-L263 HydrophobicContact CE3-CD2 3.96Å; W254-L263 HydrophobicContact CG-CD2 4.24Å; W254-L263 HydrophobicContact CH2-CD1 4.47Å; W254-L263 HydrophobicContact CH2-CD2 4.31Å; W254-L263 HydrophobicContact CZ2-CD2 4.07Å; W254-L263 HydrophobicContact CZ3-CB 3.96Å; W254-L263 HydrophobicContact CZ3-CD2 4.25Å
255	G	85.7	Confident	83.6	Confident	53 Å²	53	61.5 Å²	61.5	55%	0.546	37%	0.366	S	S	.	.			trans	-70.3	-9.5	-173.7	0	0	0	0	0	115.9	T202 S252	T202-G255 PolarHBondContact OG1-N 3.07Å; S252-G255 PolarHBondContact O-N 3.16Å; S252-G255 PolarHBondContact OG-N 3.45Å
256	T	90.2	Very high	85.8	Confident	43 Å²	43	56.3 Å²	56.3	26%	0.264	34%	0.339	S	S	.	.	S	Bend	trans	-101.7	145.1	172.4	53.6	0	0	0	0	111.3	T202 W254 T258 A259 K260	T202-T256 HydrophobicContact CG2-CG2 3.75Å; T202-T256 PolarHBondContact OG1-N 2.85Å; T202-T256 PolarHBondContact OG1-OG1 3.27Å; W254-T256 PolarHBondContact O-N 3.3Å; T256-T258 PolarHBondContact O-N 3.06Å; T256-A259 PolarHBondContact O-N 3.28Å; T256-A259 VanDerWaalsContact O-N 3.07Å; T256-A259 WeakPolarHBondContact OG1-CB 3.27Å; T256-A259 PolarHBondContact OG1-N 3.47Å; T256-K260 PolarHBondContact O-N 3.08Å
257	P	92.1	Very high	87.7	Confident	112 Å²	112	50.4 Å²	50.4	73%	0.727	30%	0.302	S	S	*	.	H	α-helix	trans	-55.9	-35.5	176.3	-27	35.4	0	0	0	113.3	A261	P257-A261 WeakPolarHBondContact O-CB 3.35Å; P257-A261 PolarHBondContact O-N 3.05Å
258	T	92.6	Very high	89.1	Confident	57 Å²	57	51.5 Å²	51.5	35%	0.35	30%	0.303	S	S	.	.	H	α-helix	trans	-62.9	-46.8	175.2	-46.1	0	0	0	0	111.7	T256 A261 N262 K1153	T256-T258 PolarHBondContact O-N 3.06Å; T258-A261 PolarHBondContact O-N 2.8Å; T258-N262 WeakPolarHBondContact O-CB 3.37Å; T258-N262 VanDerWaalsContact O-CG 3.27Å; T258-N262 PolarHBondContact O-N 3.08Å; T258-N262 PolarHBondContact O-ND2 2.75Å; T258-K1153 HydrophobicContact CG2-CB 3.65Å
259	A	92.7	Very high	90.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66.8	-39.4	179.2	0	0	0	0	0	112.6	L200 P253 W254 T256 N262 L263	L200-A259 WeakPolarHBondContact O-CA 3.37Å; P253-A259 WeakPolarHBondContact O-CB 3.47Å; W254-A259 HydrophobicContact CE3-CB 4.3Å; T256-A259 PolarHBondContact O-N 3.28Å; T256-A259 VanDerWaalsContact O-N 3.07Å; T256-A259 WeakPolarHBondContact OG1-CB 3.27Å; T256-A259 PolarHBondContact OG1-N 3.47Å; A259-N262 PolarHBondContact O-N 2.91Å; A259-L263 PolarHBondContact O-N 2.83Å
260	K	93.8	Very high	91.6	Very high	97 Å²	97	42.6 Å²	42.6	42%	0.422	24%	0.242	S	C	.	.	H	α-helix	trans	-59.8	-49.2	172.3	-176	169.4	-175.3	-80.5	0	111.3	F180 T256 N262 L263 E264	F180-K260 HydrophobicContact CE2-CG 4.06Å; F180-K260 HydrophobicContact CZ-CG 3.95Å; T256-K260 PolarHBondContact O-N 3.08Å; K260-N262 VanDerWaalsContact C-N 3.35Å; K260-N262 PolarHBondContact O-N 2.68Å; K260-L263 PolarHBondContact O-N 2.96Å; K260-E264 WeakPolarHBondContact CE-OE1 3.41Å; K260-E264 IonicContact NZ-OE1 2.61Å; K260-E264 PolarHBondContact NZ-OE1 3.34Å; K260-E264 VanDerWaalsContact O-CG 3.3Å; K260-E264 WeakPolarHBondContact O-CG 3.35Å; K260-E264 PolarHBondContact O-N 2.78Å
261	A	94.4	Very high	92.6	Very high	46 Å²	46	36.1 Å²	36.1	38%	0.38	21%	0.207	S	C	.	.	H	α-helix	trans	-64.9	-34.8	178.2	0	0	0	0	0	113.2	P257 T258 R265	P257-A261 WeakPolarHBondContact O-CB 3.35Å; P257-A261 PolarHBondContact O-N 3.05Å; T258-A261 PolarHBondContact O-N 2.8Å; A261-R265 VanDerWaalsContact O-CB 3.25Å; A261-R265 WeakPolarHBondContact O-CB 3.29Å; A261-R265 PolarHBondContact O-N 3.1Å
262	N	95.4	Very high	93.2	Very high	6 Å²	6	35.4 Å²	35.4	3%	0.032	21%	0.205	C	C	.	.	H	α-helix	trans	-63.2	-45.6	172.7	-78.5	-20.8	0	0	0	111.3	L200 T258 A259 K260 R265 M266 F1152 K1153	L200-N262 HydrophobicContact CB-CB 4.45Å; L200-N262 HydrophobicContact CD2-CB 3.92Å; L200-N262 PolarHBondContact O-ND2 3.43Å; L200-N262 VanDerWaalsContact O-ND2 3.16Å; T258-N262 WeakPolarHBondContact O-CB 3.37Å; T258-N262 VanDerWaalsContact O-CG 3.27Å; T258-N262 PolarHBondContact O-N 3.08Å; T258-N262 PolarHBondContact O-ND2 2.75Å; A259-N262 PolarHBondContact O-N 2.91Å; K260-N262 VanDerWaalsContact C-N 3.35Å; K260-N262 PolarHBondContact O-N 2.68Å; N262-R265 PolarHBondContact O-N 3.5Å; N262-M266 WeakPolarHBondContact O-CB 3.41Å; N262-M266 PolarHBondContact O-N 3.13Å; N262-F1152 HydrophobicContact CB-CD1 4.47Å; N262-F1152 WeakPolarHBondContact O-CE1 3.33Å; N262-K1153 PolarHBondContact ND2-O 3.27Å; N262-K1153 PolarHBondContact OD1-N 3.48Å
263	L	95.2	Very high	93.7	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-68.1	-41.2	177.1	-179	59.8	0	0	0	112.1	F180 V183 V184 M195 W254 A259 K260 R265 M266 T267	F180-L263 HydrophobicContact CD2-CB 4.21Å; F180-L263 HydrophobicContact CD2-CD2 3.79Å; F180-L263 HydrophobicContact CD2-CG 3.69Å; F180-L263 HydrophobicContact CE2-CB 3.95Å; F180-L263 HydrophobicContact CE2-CD2 3.63Å; F180-L263 HydrophobicContact CE2-CG 3.8Å; F180-L263 HydrophobicContact CG-CD2 4.43Å; F180-L263 HydrophobicContact CZ-CD2 4.16Å; V183-L263 HydrophobicContact CG1-CD1 3.97Å; V183-L263 HydrophobicContact CG1-CD2 4.45Å; V184-L263 HydrophobicContact CG2-CD2 3.89Å; M195-L263 HydrophobicContact CE-CD1 4.06Å; W254-L263 HydrophobicContact CD2-CD2 3.73Å; W254-L263 HydrophobicContact CE3-CB 3.93Å; W254-L263 HydrophobicContact CE3-CD2 3.96Å; W254-L263 HydrophobicContact CG-CD2 4.24Å; W254-L263 HydrophobicContact CH2-CD1 4.47Å; W254-L263 HydrophobicContact CH2-CD2 4.31Å; W254-L263 HydrophobicContact CZ2-CD2 4.07Å; W254-L263 HydrophobicContact CZ3-CB 3.96Å; W254-L263 HydrophobicContact CZ3-CD2 4.25Å; A259-L263 PolarHBondContact O-N 2.83Å; K260-L263 PolarHBondContact O-N 2.96Å; L263-R265 VanDerWaalsContact C-N 3.3Å; L263-R265 PolarHBondContact O-N 3.11Å; L263-M266 WeakPolarHBondContact O-CB 3.42Å; L263-M266 PolarHBondContact O-N 3.17Å; L263-M266 VanDerWaalsContact O-N 3.14Å; L263-T267 HydrophobicContact CD1-CG2 4.07Å; L263-T267 HydrophobicContact CG-CG2 4.47Å; L263-T267 WeakPolarHBondContact O-CG2 3.33Å; L263-T267 PolarHBondContact O-N 3.32Å; L263-T267 PolarHBondContact O-OG1 3.37Å
264	E	95.6	Very high	94.1	Very high	42 Å²	42	31.4 Å²	31.4	20%	0.196	18%	0.178	C	C	.	.	H	α-helix	trans	-58.7	-40.3	172.6	-73.1	168	170.9	0	0	112.2	F180 K260 T267 Y268 M311	F180-E264 HydrophobicContact CD2-CG 3.77Å; F180-E264 HydrophobicContact CE2-CG 3.82Å; K260-E264 WeakPolarHBondContact CE-OE1 3.41Å; K260-E264 IonicContact NZ-OE1 2.61Å; K260-E264 PolarHBondContact NZ-OE1 3.34Å; K260-E264 VanDerWaalsContact O-CG 3.3Å; K260-E264 WeakPolarHBondContact O-CG 3.35Å; K260-E264 PolarHBondContact O-N 2.78Å; E264-T267 PolarHBondContact O-OG1 2.63Å; E264-Y268 VanDerWaalsContact O-CB 3.27Å; E264-Y268 WeakPolarHBondContact O-CB 3.37Å; E264-Y268 PolarHBondContact O-N 2.82Å; E264-M311 HydrophobicContact CB-CE 3.89Å; E264-M311 HydrophobicContact CG-CE 4.09Å; E264-M311 WeakPolarHBondContact OE2-CE 3.2Å
265	R	94.6	Very high	94.3	Very high	63 Å²	63	29.9 Å²	29.9	24%	0.238	17%	0.172	C	C	.	.	H	α-helix	trans	-66.8	-38.9	174.3	179.5	58.5	175.2	165.6	2	111.7	A261 N262 L263 L269 A1149 S1150 F1152	A261-R265 VanDerWaalsContact O-CB 3.25Å; A261-R265 WeakPolarHBondContact O-CB 3.29Å; A261-R265 PolarHBondContact O-N 3.1Å; N262-R265 PolarHBondContact O-N 3.5Å; L263-R265 VanDerWaalsContact C-N 3.3Å; L263-R265 PolarHBondContact O-N 3.11Å; R265-L269 HydrophobicContact CG-CD1 4.32Å; R265-L269 WeakPolarHBondContact O-CG 3.34Å; R265-L269 PolarHBondContact O-N 2.74Å; R265-L269 VanDerWaalsContact O-N 3.1Å; R265-A1149 PolarHBondContact NH2-O 3.48Å; R265-S1150 VanDerWaalsContact CZ-O 3.3Å; R265-S1150 PolarHBondContact NE-O 3.36Å; R265-S1150 PolarHBondContact NH2-O 3.35Å; R265-F1152 HydrophobicContact CB-CD1 4.11Å; R265-F1152 HydrophobicContact CB-CE1 3.85Å; R265-F1152 HydrophobicContact CG-CD1 3.83Å; R265-F1152 HydrophobicContact CG-CE1 3.58Å; R265-F1152 HydrophobicContact CG-CZ 4.34Å
266	M	96.6	Very high	94.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-66.6	-48.7	178.3	-172.6	63.8	87.1	0	0	111.3	L151 Y155 V158 L200 N262 L263 Y268 L269 V270 F1152	L151-M266 HydrophobicContact CD1-CE 3.8Å; Y155-M266 HydrophobicContact CD2-SD 3.81Å; Y155-M266 HydrophobicContact CG-SD 4.27Å; V158-M266 HydrophobicContact CB-CG 4.05Å; V158-M266 HydrophobicContact CG1-CG 4.13Å; V158-M266 HydrophobicContact CG2-CG 3.92Å; L200-M266 HydrophobicContact CD1-CE 3.59Å; N262-M266 WeakPolarHBondContact O-CB 3.41Å; N262-M266 PolarHBondContact O-N 3.13Å; L263-M266 WeakPolarHBondContact O-CB 3.42Å; L263-M266 PolarHBondContact O-N 3.17Å; L263-M266 VanDerWaalsContact O-N 3.14Å; M266-Y268 VanDerWaalsContact C-N 3.32Å; M266-Y268 PolarHBondContact O-N 3.19Å; M266-L269 PolarHBondContact O-N 2.91Å; M266-V270 PolarHBondContact O-N 3.47Å; M266-F1152 HydrophobicContact CB-CE1 4.05Å; M266-F1152 HydrophobicContact CB-CZ 4.24Å; M266-F1152 HydrophobicContact CE-CE1 4.23Å; M266-F1152 HydrophobicContact CE-CE2 4.03Å; M266-F1152 HydrophobicContact CE-CZ 3.57Å; M266-F1152 HydrophobicContact SD-CE1 4.47Å; M266-F1152 HydrophobicContact SD-CZ 3.75Å
267	T	97.1	Very high	94.8	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-68.7	-30.5	178.7	62	0	0	0	0	112.5	V158 P176 L179 F180 L263 E264 V271	V158-T267 HydrophobicContact CG1-CG2 3.97Å; P176-T267 PolarHBondContact O-OG1 3.45Å; L179-T267 HydrophobicContact CB-CG2 4.25Å; L179-T267 HydrophobicContact CD2-CG2 3.97Å; L179-T267 HydrophobicContact CG-CG2 3.8Å; F180-T267 HydrophobicContact CB-CG2 4.44Å; L263-T267 HydrophobicContact CD1-CG2 4.07Å; L263-T267 HydrophobicContact CG-CG2 4.47Å; L263-T267 WeakPolarHBondContact O-CG2 3.33Å; L263-T267 PolarHBondContact O-N 3.32Å; L263-T267 PolarHBondContact O-OG1 3.37Å; E264-T267 PolarHBondContact O-OG1 2.63Å; T267-V271 WeakPolarHBondContact O-CB 3.17Å; T267-V271 VanDerWaalsContact O-CG2 3.29Å; T267-V271 WeakPolarHBondContact O-CG2 3.46Å; T267-V271 PolarHBondContact O-N 2.85Å
268	Y	95.8	Very high	95	Very high	89 Å²	89	21.9 Å²	21.9	35%	0.349	11%	0.107	S	C	.	.	H	α-helix	trans	-60.1	-49.3	168.4	174.2	-84.2	0	0	0	111.9	E264 M266 L272 L292	E264-Y268 VanDerWaalsContact O-CB 3.27Å; E264-Y268 WeakPolarHBondContact O-CB 3.37Å; E264-Y268 PolarHBondContact O-N 2.82Å; M266-Y268 VanDerWaalsContact C-N 3.32Å; M266-Y268 PolarHBondContact O-N 3.19Å; Y268-L272 HydrophobicContact CE1-CD2 3.86Å; Y268-L272 VanDerWaalsContact O-CB 3.23Å; Y268-L272 WeakPolarHBondContact O-CB 3.45Å; Y268-L272 PolarHBondContact O-N 3.4Å; Y268-L292 HydrophobicContact CD2-CD1 4.03Å; Y268-L292 HydrophobicContact CD2-CD2 4.24Å; Y268-L292 HydrophobicContact CE2-CD1 4.11Å; Y268-L292 HydrophobicContact CE2-CD2 4.04Å; Y268-L292 HydrophobicContact CE2-CG 4.48Å; Y268-L292 WeakPolarHBondContact O-CD1 3.38Å
269	L	95.1	Very high	95.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-66.4	-46.7	-177.7	-71.4	169.6	0	0	0	111.4	F141 F143 R265 M266 V271 L272 F273 F1152	F141-L269 HydrophobicContact CD1-CD2 4.19Å; F141-L269 HydrophobicContact CE1-CD2 3.67Å; F141-L269 HydrophobicContact CE2-CB 4.27Å; F141-L269 HydrophobicContact CZ-CB 4.05Å; F141-L269 HydrophobicContact CZ-CD2 4.02Å; F141-L269 WeakPolarHBondContact CZ-O 3.46Å; F143-L269 HydrophobicContact CE1-CD1 4.38Å; F143-L269 HydrophobicContact CZ-CD1 3.97Å; R265-L269 HydrophobicContact CG-CD1 4.32Å; R265-L269 WeakPolarHBondContact O-CG 3.34Å; R265-L269 PolarHBondContact O-N 2.74Å; R265-L269 VanDerWaalsContact O-N 3.1Å; M266-L269 PolarHBondContact O-N 2.91Å; L269-V271 PolarHBondContact O-N 3.3Å; L269-L272 PolarHBondContact O-N 3.25Å; L269-F273 PolarHBondContact O-N 3.34Å; L269-F1152 HydrophobicContact CD1-CZ 3.99Å
270	V	97.3	Very high	95.3	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-58.3	-47.8	176.8	162.7	0	0	0	0	112	Y155 V158 R159 A162 L179 M266 L272 F273 L274	Y155-V270 HydrophobicContact CD2-CG2 3.69Å; Y155-V270 HydrophobicContact CE2-CG2 3.5Å; Y155-V270 VanDerWaalsContact CE2-CG2 3.5Å; V158-V270 HydrophobicContact CB-CG2 4.16Å; V158-V270 HydrophobicContact CG1-CB 4.2Å; V158-V270 HydrophobicContact CG1-CG1 4.32Å; V158-V270 HydrophobicContact CG1-CG2 3.89Å; R159-V270 HydrophobicContact CB-CG1 4.27Å; R159-V270 HydrophobicContact CB-CG2 4.26Å; A162-V270 HydrophobicContact CB-CG1 3.73Å; L179-V270 HydrophobicContact CD2-CB 4.31Å; L179-V270 HydrophobicContact CD2-CG1 3.8Å; M266-V270 PolarHBondContact O-N 3.47Å; V270-L272 VanDerWaalsContact C-N 3.34Å; V270-L272 PolarHBondContact O-N 2.75Å; V270-F273 PolarHBondContact O-N 2.99Å; V270-L274 HydrophobicContact CG1-CD1 3.77Å; V270-L274 WeakPolarHBondContact O-CG 3.45Å; V270-L274 PolarHBondContact O-N 3.22Å; V270-L274 VanDerWaalsContact O-N 3.08Å
271	V	96.7	Very high	95.4	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.006	8%	0.075	C	C	.	.	H	α-helix	trans	-67	-37.5	177.9	175.7	0	0	0	0	111	V174 P176 L179 T267 L269 F273 L274 E275 L292	V174-V271 HydrophobicContact CG1-CG2 4.1Å; P176-V271 HydrophobicContact CG-CB 4.17Å; P176-V271 HydrophobicContact CG-CG1 4.38Å; P176-V271 HydrophobicContact CG-CG2 4.38Å; L179-V271 HydrophobicContact CB-CG2 4.32Å; L179-V271 HydrophobicContact CD2-CG2 3.67Å; T267-V271 WeakPolarHBondContact O-CB 3.17Å; T267-V271 VanDerWaalsContact O-CG2 3.29Å; T267-V271 WeakPolarHBondContact O-CG2 3.46Å; T267-V271 PolarHBondContact O-N 2.85Å; L269-V271 PolarHBondContact O-N 3.3Å; V271-F273 VanDerWaalsContact C-N 3.34Å; V271-F273 PolarHBondContact O-N 3.24Å; V271-L274 PolarHBondContact O-N 3Å; V271-E275 HydrophobicContact CG1-CB 4.48Å; V271-E275 WeakPolarHBondContact O-CB 3.34Å; V271-E275 PolarHBondContact O-N 3.48Å; V271-L292 HydrophobicContact CB-CD1 4Å; V271-L292 HydrophobicContact CG1-CD1 3.86Å; V271-L292 HydrophobicContact CG1-CG 4.49Å
272	L	93.9	Very high	95.5	Very high	15 Å²	15	13.9 Å²	13.9	8%	0.079	6%	0.058	C	C	.	.	H	α-helix	trans	-60.1	-43	177.8	175.3	63.2	0	0	0	111.8	F141 Y268 L269 V270 R276 L292 T293	F141-L272 HydrophobicContact CE1-CD2 4.43Å; Y268-L272 HydrophobicContact CE1-CD2 3.86Å; Y268-L272 VanDerWaalsContact O-CB 3.23Å; Y268-L272 WeakPolarHBondContact O-CB 3.45Å; Y268-L272 PolarHBondContact O-N 3.4Å; L269-L272 PolarHBondContact O-N 3.25Å; V270-L272 VanDerWaalsContact C-N 3.34Å; V270-L272 PolarHBondContact O-N 2.75Å; L272-R276 WeakPolarHBondContact O-CB 3.24Å; L272-R276 PolarHBondContact O-N 3.33Å; L272-L292 HydrophobicContact CB-CD1 4Å; L272-L292 HydrophobicContact CD1-CB 3.95Å; L272-T293 HydrophobicContact CD1-CG2 4.04Å
273	F	94.9	Very high	95.5	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-64.7	-57.4	175.2	169.8	-107	0	0	0	111.7	L128 E136 E137 L140 F141 L269 V270 V271 E275 R276 Y277 Y279	L128-F273 HydrophobicContact CD1-CE1 4Å; L128-F273 HydrophobicContact CD2-CE1 4Å; L128-F273 HydrophobicContact CD2-CZ 4.05Å; E136-F273 HydrophobicContact CB-CE2 3.77Å; E136-F273 HydrophobicContact CB-CZ 4.28Å; E137-F273 HydrophobicContact CB-CE2 4.4Å; E137-F273 HydrophobicContact CG-CD1 3.75Å; E137-F273 HydrophobicContact CG-CD2 3.75Å; E137-F273 HydrophobicContact CG-CE1 3.4Å; E137-F273 VanDerWaalsContact CG-CE1 3.4Å; E137-F273 HydrophobicContact CG-CE2 3.4Å; E137-F273 VanDerWaalsContact CG-CE2 3.4Å; E137-F273 HydrophobicContact CG-CG 3.94Å; E137-F273 HydrophobicContact CG-CZ 3.23Å; E137-F273 WeakPolarHBondContact OE1-CE1 3.49Å; L140-F273 HydrophobicContact CD2-CB 4.02Å; L140-F273 HydrophobicContact CD2-CD2 4.03Å; F141-F273 HydrophobicContact CE2-CB 3.66Å; F141-F273 HydrophobicContact CE2-CG 4.47Å; F141-F273 HydrophobicContact CZ-CB 3.9Å; L269-F273 PolarHBondContact O-N 3.34Å; V270-F273 PolarHBondContact O-N 2.99Å; V271-F273 VanDerWaalsContact C-N 3.34Å; V271-F273 PolarHBondContact O-N 3.24Å; F273-E275 VanDerWaalsContact C-N 3.27Å; F273-E275 PolarHBondContact O-N 2.81Å; F273-R276 PolarHBondContact O-N 3.27Å; F273-R276 VanDerWaalsContact O-N 3.15Å; F273-Y277 AromaticContact CD2-CD2 3.42Å; F273-Y277 HydrophobicContact CD2-CD2 3.42Å; F273-Y277 VanDerWaalsContact CD2-CD2 3.42Å; F273-Y277 AromaticContact CD2-CE2 3.63Å; F273-Y277 HydrophobicContact CD2-CE2 3.63Å; F273-Y277 AromaticContact CE2-CD2 3.27Å; F273-Y277 HydrophobicContact CE2-CD2 3.27Å; F273-Y277 AromaticContact CE2-CE2 3.55Å; F273-Y277 HydrophobicContact CE2-CE2 3.55Å; F273-Y277 HydrophobicContact CE2-CG 4.18Å; F273-Y277 HydrophobicContact CG-CD2 4.41Å; F273-Y277 HydrophobicContact CZ-CD2 4.19Å; F273-Y277 PolarHBondContact O-N 3.44Å; F273-Y277 VanDerWaalsContact O-N 3.09Å; F273-Y279 AromaticContact CE1-CD2 3.91Å; F273-Y279 HydrophobicContact CE1-CD2 3.91Å; F273-Y279 AromaticContact CE1-CE2 3.79Å; F273-Y279 HydrophobicContact CE1-CE2 3.79Å; F273-Y279 HydrophobicContact CE2-CE2 4.2Å; F273-Y279 AromaticContact CZ-CD2 3.99Å; F273-Y279 HydrophobicContact CZ-CD2 3.99Å; F273-Y279 AromaticContact CZ-CE2 3.41Å; F273-Y279 HydrophobicContact CZ-CE2 3.41Å; F273-Y279 VanDerWaalsContact CZ-CE2 3.41Å
274	L	96.6	Very high	95.5	Very high	0 Å²	0	14 Å²	14	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-64.7	-31.1	-173.2	-63.8	173	0	0	0	112.8	L128 R159 A162 V270 V271 G278 Y279 I280	L128-L274 HydrophobicContact CD1-CD2 3.38Å; R159-L274 HydrophobicContact CG-CD1 4.23Å; R159-L274 HydrophobicContact CG-CD2 4.16Å; R159-L274 HydrophobicContact CG-CG 4.49Å; A162-L274 HydrophobicContact CB-CD1 3.56Å; V270-L274 HydrophobicContact CG1-CD1 3.77Å; V270-L274 WeakPolarHBondContact O-CG 3.45Å; V270-L274 PolarHBondContact O-N 3.22Å; V270-L274 VanDerWaalsContact O-N 3.08Å; V271-L274 PolarHBondContact O-N 3Å; L274-G278 PolarHBondContact O-N 3.35Å; L274-Y279 HydrophobicContact CD2-CD2 4.04Å; L274-Y279 HydrophobicContact CD2-CG 4.14Å; L274-Y279 PolarHBondContact O-N 3.01Å; L274-I280 HydrophobicContact CB-CB 4.43Å; L274-I280 HydrophobicContact CB-CD1 3.55Å; L274-I280 HydrophobicContact CB-CG1 3.64Å; L274-I280 HydrophobicContact CB-CG2 4.19Å; L274-I280 HydrophobicContact CD1-CD1 4.01Å; L274-I280 HydrophobicContact CD1-CG2 4.35Å; L274-I280 HydrophobicContact CG-CD1 4.45Å; L274-I280 PolarHBondContact O-N 3Å
275	E	94.6	Very high	95.4	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.005	5%	0.051	C	C	.	.	H	α-helix	trans	-78.3	-36.8	174.6	-178.5	167	-102.5	0	0	112.9	V271 F273 N281 P291 L292 Y379 F380	V271-E275 HydrophobicContact CG1-CB 4.48Å; V271-E275 WeakPolarHBondContact O-CB 3.34Å; V271-E275 PolarHBondContact O-N 3.48Å; F273-E275 VanDerWaalsContact C-N 3.27Å; F273-E275 PolarHBondContact O-N 2.81Å; E275-N281 HydrophobicContact CG-CB 4.26Å; E275-N281 PolarHBondContact OE1-ND2 3.39Å; E275-P291 HydrophobicContact CG-CB 4.42Å; E275-P291 VanDerWaalsContact OE2-CA 3.24Å; E275-P291 WeakPolarHBondContact OE2-CA 3.21Å; E275-P291 WeakPolarHBondContact OE2-CB 3.4Å; E275-L292 PolarHBondContact OE2-N 3.18Å; E275-Y379 HydrophobicContact CG-CE1 3.94Å; E275-Y379 WeakPolarHBondContact OE1-CE1 3.22Å; E275-Y379 PolarHBondContact OE1-OH 3.36Å; E275-F380 HydrophobicContact CG-CE1 4.24Å; E275-F380 WeakPolarHBondContact O-CE1 3.32Å; E275-F380 VanDerWaalsContact O-CZ 3.28Å; E275-F380 WeakPolarHBondContact O-CZ 3.44Å
276	R	92.3	Very high	95.3	Very high	10 Å²	10	15.5 Å²	15.5	4%	0.038	7%	0.066	C	C	.	.	H	α-helix	trans	-62.4	-47	176.9	170.6	62.2	66.2	79.7	-5.1	111.2	L272 F273 T293 A1134 N1138 T1145	L272-R276 WeakPolarHBondContact O-CB 3.24Å; L272-R276 PolarHBondContact O-N 3.33Å; F273-R276 PolarHBondContact O-N 3.27Å; F273-R276 VanDerWaalsContact O-N 3.15Å; R276-T293 HydrophobicContact CB-CG2 4.06Å; R276-A1134 WeakPolarHBondContact O-CA 3.48Å; R276-A1134 WeakPolarHBondContact O-CB 3.39Å; R276-N1138 WeakPolarHBondContact CD-OD1 3.45Å; R276-N1138 PolarHBondContact NH1-OD1 2.63Å; R276-T1145 PolarHBondContact NH1-OG1 2.96Å
277	Y	94.3	Very high	95	Very high	29 Å²	29	16.6 Å²	16.6	11%	0.114	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-4.4	-177.6	-69.3	-77.1	0	0	0	114.5	E136 Q139 L140 F273 Y279 A1134 N1138	E136-Y277 HydrophobicContact CB-CD2 4.45Å; E136-Y277 HydrophobicContact CB-CE1 4.19Å; E136-Y277 HydrophobicContact CB-CE2 4.02Å; E136-Y277 HydrophobicContact CG-CD1 4.46Å; E136-Y277 HydrophobicContact CG-CE1 4.12Å; Q139-Y277 PolarHBondContact OE1-OH 3.05Å; L140-Y277 HydrophobicContact CB-CE2 4.45Å; L140-Y277 HydrophobicContact CD2-CE2 4.22Å; F273-Y277 AromaticContact CD2-CD2 3.42Å; F273-Y277 HydrophobicContact CD2-CD2 3.42Å; F273-Y277 VanDerWaalsContact CD2-CD2 3.42Å; F273-Y277 AromaticContact CD2-CE2 3.63Å; F273-Y277 HydrophobicContact CD2-CE2 3.63Å; F273-Y277 AromaticContact CE2-CD2 3.27Å; F273-Y277 HydrophobicContact CE2-CD2 3.27Å; F273-Y277 AromaticContact CE2-CE2 3.55Å; F273-Y277 HydrophobicContact CE2-CE2 3.55Å; F273-Y277 HydrophobicContact CE2-CG 4.18Å; F273-Y277 HydrophobicContact CG-CD2 4.41Å; F273-Y277 HydrophobicContact CZ-CD2 4.19Å; F273-Y277 PolarHBondContact O-N 3.44Å; F273-Y277 VanDerWaalsContact O-N 3.09Å; Y277-Y279 HydrophobicContact CG-CE2 4.17Å; Y277-A1134 HydrophobicContact CD1-CB 3.59Å; Y277-A1134 HydrophobicContact CE1-CB 4.11Å; Y277-A1134 HydrophobicContact CG-CB 4.25Å; Y277-N1138 PolarHBondContact OH-ND2 2.97Å; Y277-N1138 VanDerWaalsContact OH-ND2 3.13Å
278	G	95.2	Very high	94.7	Very high	2 Å²	2	19.8 Å²	19.8	2%	0.021	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	21.3	174.8	0	0	0	0	0	114.7	L274 I280 F282	L274-G278 PolarHBondContact O-N 3.35Å; G278-I280 VanDerWaalsContact C-N 3.29Å; G278-F282 WeakPolarHBondContact O-CD1 3.27Å
279	Y	95.9	Very high	94.4	Very high	27 Å²	27	17.2 Å²	17.2	11%	0.106	8%	0.083	C	C	.	.	S	Bend	trans	-66.9	-33.7	170.1	-64.1	-71.1	0	0	0	111.7	C126 L128 F273 L274 Y277	C126-Y279 WeakPolarHBondContact O-CD1 3.43Å; L128-Y279 HydrophobicContact CD1-CD1 3.94Å; L128-Y279 HydrophobicContact CD1-CD2 4.03Å; L128-Y279 HydrophobicContact CD1-CE1 4.2Å; L128-Y279 HydrophobicContact CD1-CE2 4.3Å; L128-Y279 HydrophobicContact CD1-CG 3.84Å; L128-Y279 HydrophobicContact CD2-CD1 4.45Å; L128-Y279 HydrophobicContact CD2-CE1 3.88Å; L128-Y279 HydrophobicContact CD2-CE2 3.97Å; L128-Y279 HydrophobicContact CG-CD1 3.94Å; L128-Y279 HydrophobicContact CG-CE1 3.76Å; L128-Y279 HydrophobicContact CG-CE2 4.39Å; L128-Y279 HydrophobicContact CG-CG 4.31Å; F273-Y279 AromaticContact CE1-CD2 3.91Å; F273-Y279 HydrophobicContact CE1-CD2 3.91Å; F273-Y279 AromaticContact CE1-CE2 3.79Å; F273-Y279 HydrophobicContact CE1-CE2 3.79Å; F273-Y279 HydrophobicContact CE2-CE2 4.2Å; F273-Y279 AromaticContact CZ-CD2 3.99Å; F273-Y279 HydrophobicContact CZ-CD2 3.99Å; F273-Y279 AromaticContact CZ-CE2 3.41Å; F273-Y279 HydrophobicContact CZ-CE2 3.41Å; F273-Y279 VanDerWaalsContact CZ-CE2 3.41Å; L274-Y279 HydrophobicContact CD2-CD2 4.04Å; L274-Y279 HydrophobicContact CD2-CG 4.14Å; L274-Y279 PolarHBondContact O-N 3.01Å; Y277-Y279 HydrophobicContact CG-CE2 4.17Å
280	I	96.3	Very high	94.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.1	C	C	.	.	S	Bend	trans	-129.5	171.3	170.5	76.4	-172.6	0	0	0	109.6	W166 V174 L274 G278 F282	W166-I280 HydrophobicContact CB-CB 3.99Å; W166-I280 HydrophobicContact CB-CG2 3.56Å; W166-I280 HydrophobicContact CD2-CB 3.88Å; W166-I280 HydrophobicContact CD2-CG2 4.33Å; W166-I280 HydrophobicContact CE3-CB 4.34Å; W166-I280 HydrophobicContact CG-CB 3.71Å; W166-I280 HydrophobicContact CG-CG2 3.62Å; V174-I280 HydrophobicContact CB-CD1 3.84Å; V174-I280 HydrophobicContact CG1-CD1 3.91Å; V174-I280 HydrophobicContact CG2-CD1 4.34Å; L274-I280 HydrophobicContact CB-CB 4.43Å; L274-I280 HydrophobicContact CB-CD1 3.55Å; L274-I280 HydrophobicContact CB-CG1 3.64Å; L274-I280 HydrophobicContact CB-CG2 4.19Å; L274-I280 HydrophobicContact CD1-CD1 4.01Å; L274-I280 HydrophobicContact CD1-CG2 4.35Å; L274-I280 HydrophobicContact CG-CD1 4.45Å; L274-I280 PolarHBondContact O-N 3Å; G278-I280 VanDerWaalsContact C-N 3.29Å; I280-F282 VanDerWaalsContact C-N 3.27Å; I280-F282 PolarHBondContact O-N 2.85Å
281	N	96.3	Very high	93.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.102	C	C	.	.	S	Bend	trans	54.1	41.1	177.2	-61	-11.9	0	0	0	113.3	Q173 V174 E275 F285 Q376 Y379	Q173-N281 WeakPolarHBondContact CA-OD1 3.28Å; Q173-N281 WeakPolarHBondContact CG-ND2 3.26Å; V174-N281 PolarHBondContact N-OD1 3.06Å; V174-N281 PolarHBondContact O-ND2 2.89Å; E275-N281 HydrophobicContact CG-CB 4.26Å; E275-N281 PolarHBondContact OE1-ND2 3.39Å; N281-F285 HydrophobicContact CB-CE2 4.22Å; N281-F285 HydrophobicContact CB-CZ 3.94Å; N281-F285 WeakPolarHBondContact O-CE1 3.17Å; N281-F285 WeakPolarHBondContact O-CZ 3.34Å; N281-Q376 PolarHBondContact O-NE2 3.07Å; N281-Q376 PolarHBondContact O-OE1 2.96Å; N281-Y379 HydrophobicContact CB-CE1 4.15Å
282	F	96.1	Very high	93.2	Very high	4 Å²	4	22.4 Å²	22.4	2%	0.018	11%	0.114	C	C	.	.			trans	-113.1	159.5	172	74.4	-92.5	0	0	0	111.7	W166 G278 I280 F285 P421 I424 L425 Q428 L1130	W166-F282 AromaticContact CZ2-CD1 3.87Å; W166-F282 HydrophobicContact CZ2-CD1 3.87Å; W166-F282 HydrophobicContact CZ2-CE1 4.08Å; W166-F282 HydrophobicContact CZ2-CG 4.39Å; W166-F282 AromaticContact NE1-CE1 3.58Å; G278-F282 WeakPolarHBondContact O-CD1 3.27Å; I280-F282 VanDerWaalsContact C-N 3.27Å; I280-F282 PolarHBondContact O-N 2.85Å; F282-F285 VanDerWaalsContact O-CD1 3.3Å; F282-F285 WeakPolarHBondContact O-CD1 3.35Å; F282-P421 HydrophobicContact CE2-CB 4.19Å; F282-P421 HydrophobicContact CZ-CB 4.02Å; F282-I424 HydrophobicContact CE1-CG2 4.27Å; F282-I424 HydrophobicContact CE2-CB 4.05Å; F282-I424 HydrophobicContact CE2-CG2 3.89Å; F282-I424 HydrophobicContact CZ-CB 3.72Å; F282-I424 HydrophobicContact CZ-CG1 3.92Å; F282-I424 HydrophobicContact CZ-CG2 3.65Å; F282-L425 HydrophobicContact CD2-CD2 4.37Å; F282-L425 HydrophobicContact CE2-CD2 4.35Å; F282-Q428 PolarHBondContact O-NE2 2.91Å; F282-L1130 HydrophobicContact CB-CD1 4.34Å; F282-L1130 HydrophobicContact CB-CD2 3.94Å; F282-L1130 HydrophobicContact CD2-CD1 4.31Å; F282-L1130 HydrophobicContact CG-CD1 4.22Å
283	G	95.7	Very high	92.6	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.112	C	C	.	.	S	Bend	trans	76.2	-140.5	178.1	0	0	0	0	0	114	F285 R375	G283-F285 WeakPolarHBondContact O-CD1 3.45Å; G283-R375 PolarHBondContact O-NE 2.91Å; G283-R375 PolarHBondContact O-NH2 3.37Å; G283-R375 VanDerWaalsContact O-NH2 3.08Å
284	I	93.8	Very high	91.8	Very high	10 Å²	10	24.3 Å²	24.3	5%	0.051	12%	0.123	C	C	.	.	S	Bend	trans	-110.1	95.4	-167.7	-67.5	170.5	0	0	0	109.3	Q428 L429 N741 L742 Y745 L752	I284-Q428 HydrophobicContact CB-CB 4.47Å; I284-Q428 VanDerWaalsContact O-CB 3.24Å; I284-Q428 WeakPolarHBondContact O-CB 3.5Å; I284-Q428 VanDerWaalsContact O-CD 3.25Å; I284-Q428 WeakPolarHBondContact O-CG 3.47Å; I284-L429 HydrophobicContact CD1-CD1 4.46Å; I284-L429 HydrophobicContact CD1-CD2 3.69Å; I284-L429 HydrophobicContact CD1-CG 4.3Å; I284-L429 HydrophobicContact CG2-CD2 4.25Å; I284-N741 HydrophobicContact CD1-CB 4.15Å; I284-L742 HydrophobicContact CD1-CD2 3.97Å; I284-L742 HydrophobicContact CD1-CG 4.22Å; I284-L742 HydrophobicContact CG1-CD2 4.05Å; I284-Y745 HydrophobicContact CB-CD2 4.23Å; I284-Y745 HydrophobicContact CB-CE2 4.44Å; I284-Y745 HydrophobicContact CD1-CD2 4.5Å; I284-Y745 HydrophobicContact CG1-CD2 3.86Å; I284-Y745 HydrophobicContact CG1-CE2 4.47Å; I284-Y745 HydrophobicContact CG1-CG 4.13Å; I284-Y745 HydrophobicContact CG2-CD2 3.72Å; I284-Y745 HydrophobicContact CG2-CE2 3.88Å; I284-L752 HydrophobicContact CG2-CD1 3.97Å
285	F	93.9	Very high	90.3	Very high	8 Å²	8	25.1 Å²	25.1	4%	0.035	13%	0.127	C	C	.	.			trans	-137.8	161.5	-175.6	58	-85.1	0	0	0	111.3	W166 C171 Q173 N281 F282 G283 I287 R375 Y379 Y745	W166-F285 HydrophobicContact CH2-CB 4.39Å; W166-F285 HydrophobicContact CH2-CD1 4.14Å; W166-F285 HydrophobicContact CH2-CG 4.28Å; C171-F285 WeakPolarHBondContact O-CA 3.31Å; Q173-F285 HydrophobicContact CB-CD2 3.89Å; Q173-F285 HydrophobicContact CB-CE2 3.91Å; Q173-F285 HydrophobicContact CG-CE2 4.1Å; N281-F285 HydrophobicContact CB-CE2 4.22Å; N281-F285 HydrophobicContact CB-CZ 3.94Å; N281-F285 WeakPolarHBondContact O-CE1 3.17Å; N281-F285 WeakPolarHBondContact O-CZ 3.34Å; F282-F285 VanDerWaalsContact O-CD1 3.3Å; F282-F285 WeakPolarHBondContact O-CD1 3.35Å; G283-F285 WeakPolarHBondContact O-CD1 3.45Å; F285-I287 HydrophobicContact CD2-CG1 4.19Å; F285-I287 HydrophobicContact CE2-CG1 3.81Å; F285-I287 PolarHBondContact O-N 3.48Å; F285-R375 VanDerWaalsContact CE1-NH2 3.32Å; F285-Y379 AromaticContact CE2-CE2 3.94Å; F285-Y379 HydrophobicContact CE2-CE2 3.94Å; F285-Y379 AromaticContact CE2-CZ 3.95Å; F285-Y379 HydrophobicContact CZ-CD1 4.31Å; F285-Y379 HydrophobicContact CZ-CD2 4.13Å; F285-Y379 AromaticContact CZ-CE1 3.98Å; F285-Y379 HydrophobicContact CZ-CE1 3.98Å; F285-Y379 AromaticContact CZ-CE2 3.77Å; F285-Y379 HydrophobicContact CZ-CE2 3.77Å; F285-Y379 HydrophobicContact CZ-CG 4.38Å; F285-Y379 AromaticContact CZ-CZ 3.7Å; F285-Y745 PolarHBondContact O-OH 2.91Å
286	K	92.3	Very high	88.6	Confident	128 Å²	128	27 Å²	27	56%	0.557	14%	0.14	S	C	*	.	B	Isolated β-bridge	trans	-74.6	117.6	173	178.8	-178.9	176.1	-175.7	0	110.1	C171 T172 Q173	C171-K286 PolarHBondContact O-N 3.48Å; T172-K286 HydrophobicContact CG2-CB 4.32Å; T172-K286 HydrophobicContact CG2-CD 4.39Å; Q173-K286 WeakPolarHBondContact CB-O 3.36Å; Q173-K286 PolarHBondContact N-O 3.03Å
287	I	91.1	Very high	86.4	Confident	23 Å²	23	31.1 Å²	31.1	12%	0.118	17%	0.171	C	C	.	.			trans	-82.1	137.2	174.9	-59.7	167.2	0	0	0	109.1	F285 S289 Y379 Y778 L780	F285-I287 HydrophobicContact CD2-CG1 4.19Å; F285-I287 HydrophobicContact CE2-CG1 3.81Å; F285-I287 PolarHBondContact O-N 3.48Å; I287-S289 VanDerWaalsContact CG2-O 3.27Å; I287-S289 WeakPolarHBondContact CG2-O 3.47Å; I287-Y379 HydrophobicContact CD1-CD2 3.81Å; I287-Y379 HydrophobicContact CD1-CE2 3.87Å; I287-Y379 HydrophobicContact CG1-CD2 4.37Å; I287-Y379 HydrophobicContact CG1-CE2 3.96Å; I287-Y379 HydrophobicContact CG2-CE2 4.44Å; I287-Y778 HydrophobicContact CG2-CD1 4.05Å; I287-L780 HydrophobicContact CD1-CD1 3.95Å; I287-L780 HydrophobicContact CD1-CD2 4.12Å; I287-L780 HydrophobicContact CD1-CG 4.28Å
288	I	91.6	Very high	83.8	Confident	68 Å²	68	34.2 Å²	34.2	35%	0.349	20%	0.197	S	C	.	.			trans	-112	-40.4	-179.6	-68.9	176.7	0	0	0	110.8	T172 T175	T172-I288 HydrophobicContact CG2-CD1 3.54Å; T172-I288 HydrophobicContact CG2-CG1 4.19Å; T175-I288 HydrophobicContact CG2-CB 4.28Å; T175-I288 HydrophobicContact CG2-CG2 4.45Å
289	S	89.3	Confident	81	Confident	36 Å²	36	44.6 Å²	44.6	25%	0.252	24%	0.235	S	C	.	.	S	Bend	trans	-137.7	161.2	178.4	62.5	0	0	0	0	110.7	Q173 T175 I287	Q173-S289 PolarHBondContact NE2-O 2.92Å; Q173-S289 PolarHBondContact OE1-O 3.2Å; Q173-S289 VanDerWaalsContact OE1-O 3.1Å; T175-S289 WeakPolarHBondContact CG2-OG 3.49Å; I287-S289 VanDerWaalsContact CG2-O 3.27Å; I287-S289 WeakPolarHBondContact CG2-O 3.47Å
290	P	87.8	Confident	77.7	Confident	54 Å²	54	50 Å²	50	35%	0.351	27%	0.272	S	S	.	.			trans	-51.1	144.5	164.8	-21.3	31.6	0	0	0	110.5	H294 Y778	P290-H294 HydrophobicContact CB-CB 4.47Å; P290-Y778 HydrophobicContact CB-CD2 3.66Å; P290-Y778 HydrophobicContact CB-CE2 3.98Å; P290-Y778 HydrophobicContact CB-CG 4.19Å; P290-Y778 HydrophobicContact CG-CD2 3.68Å; P290-Y778 HydrophobicContact CG-CE2 4.47Å; P290-Y778 HydrophobicContact CG-CG 4.02Å
291	P	87.9	Confident	74.4	Confident	6 Å²	6	54.3 Å²	54.3	4%	0.039	31%	0.307	C	S	.	.			trans	-63.8	155.8	172.1	16.3	-20.1	0	0	0	111.9	E275 T293 H294 Y379 F380	E275-P291 HydrophobicContact CG-CB 4.42Å; E275-P291 VanDerWaalsContact OE2-CA 3.24Å; E275-P291 WeakPolarHBondContact OE2-CA 3.21Å; E275-P291 WeakPolarHBondContact OE2-CB 3.4Å; P291-T293 PolarHBondContact O-N 3.23Å; P291-H294 HydrophobicContact CG-CB 4.08Å; P291-H294 WeakPolarHBondContact O-CB 3.46Å; P291-H294 PolarHBondContact O-N 3.39Å; P291-Y379 HydrophobicContact CB-CD1 4.39Å; P291-Y379 HydrophobicContact CB-CE1 3.76Å; P291-Y379 HydrophobicContact CB-CE2 4.22Å; P291-Y379 HydrophobicContact CG-CD1 4.29Å; P291-Y379 HydrophobicContact CG-CD2 4.13Å; P291-Y379 HydrophobicContact CG-CE1 4.05Å; P291-Y379 HydrophobicContact CG-CE2 3.88Å; P291-Y379 HydrophobicContact CG-CG 4.32Å; P291-Y379 WeakPolarHBondContact CG-O 3.38Å; P291-F380 HydrophobicContact CB-CD1 4.48Å; P291-F380 HydrophobicContact CG-CD1 4.49Å
292	L	87.8	Confident	71.1	Confident	50 Å²	50	60.9 Å²	60.9	26%	0.262	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-21.3	178	-55.2	-176.5	0	0	0	112.2	P176 Y268 V271 L272 E275 H294	P176-L292 HydrophobicContact CG-CD1 3.76Å; P176-L292 HydrophobicContact CG-CD2 4.07Å; P176-L292 HydrophobicContact CG-CG 4.41Å; Y268-L292 HydrophobicContact CD2-CD1 4.03Å; Y268-L292 HydrophobicContact CD2-CD2 4.24Å; Y268-L292 HydrophobicContact CE2-CD1 4.11Å; Y268-L292 HydrophobicContact CE2-CD2 4.04Å; Y268-L292 HydrophobicContact CE2-CG 4.48Å; Y268-L292 WeakPolarHBondContact O-CD1 3.38Å; V271-L292 HydrophobicContact CB-CD1 4Å; V271-L292 HydrophobicContact CG1-CD1 3.86Å; V271-L292 HydrophobicContact CG1-CG 4.49Å; L272-L292 HydrophobicContact CB-CD1 4Å; L272-L292 HydrophobicContact CD1-CB 3.95Å; E275-L292 PolarHBondContact OE2-N 3.18Å; L292-H294 VanDerWaalsContact C-N 3.32Å
293	T	80.8	Confident	68	Low	5 Å²	5	66.5 Å²	66.5	3%	0.031	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	2.2	175.5	55.2	0	0	0	0	113.9	L272 R276 P291 F380	L272-T293 HydrophobicContact CD1-CG2 4.04Å; R276-T293 HydrophobicContact CB-CG2 4.06Å; P291-T293 PolarHBondContact O-N 3.23Å; T293-F380 HydrophobicContact CG2-CE1 4.39Å; T293-F380 HydrophobicContact CG2-CZ 4.48Å; T293-F380 WeakPolarHBondContact OG1-CD1 3.47Å; T293-F380 VanDerWaalsContact OG1-CE1 3.26Å; T293-F380 WeakPolarHBondContact OG1-CE1 3.34Å; T293-F380 WeakPolarHBondContact OG1-CG 3.33Å
294	H	78.4	Confident	65	Low	50 Å²	50	70.5 Å²	70.5	23%	0.231	41%	0.412	C	S	.	.			trans	-70.4	135.4	-167.4	-178.9	-96.7	0	0	0	115.6	P290 P291 L292 S296 F380 Y778	P290-H294 HydrophobicContact CB-CB 4.47Å; P291-H294 HydrophobicContact CG-CB 4.08Å; P291-H294 WeakPolarHBondContact O-CB 3.46Å; P291-H294 PolarHBondContact O-N 3.39Å; L292-H294 VanDerWaalsContact C-N 3.32Å; H294-S296 PolarHBondContact O-N 3.12Å; H294-F380 WeakPolarHBondContact CA-O 3.45Å; H294-F380 PolarHBondContact CD2-O 3.49Å; H294-Y778 AromaticContact CD2-CE2 3.45Å; H294-Y778 VanDerWaalsContact CD2-CE2 3.45Å; H294-Y778 WeakPolarHBondContact CD2-CE2 3.39Å; H294-Y778 AromaticContact CD2-CZ 3.77Å; H294-Y778 PolarHBondContact CD2-OH 3.03Å; H294-Y778 AromaticContact CG-CE2 3.95Å; H294-Y778 AromaticContact NE2-CE2 3.56Å
295	V	65.1	Low	61.9	Low	16 Å²	16	75.8 Å²	75.8	10%	0.097	45%	0.445	C	S	.	.			trans	-73.8	88.4	174.8	-167	0	0	0	0	112.2	S297 P359 F380 F1141 P1142	V295-S297 PolarHBondContact O-N 2.99Å; V295-P359 HydrophobicContact CG2-CG 3.98Å; V295-F380 PolarHBondContact N-O 3.39Å; V295-F1141 HydrophobicContact CG2-CB 4.49Å; V295-F1141 HydrophobicContact CG2-CD1 3.22Å; V295-F1141 HydrophobicContact CG2-CE1 3.55Å; V295-F1141 HydrophobicContact CG2-CG 3.98Å; V295-P1142 HydrophobicContact CG1-CG 4.23Å
296	S	58	Low	58.8	Low	40 Å²	40	81.2 Å²	81.2	28%	0.28	48%	0.479	S	S	.	.			trans	-76.4	114.1	169.5	64.8	0	0	0	0	111.9	H294 S298	H294-S296 PolarHBondContact O-N 3.12Å; S296-S298 PolarHBondContact O-N 3.48Å
297	S	46.9	Very low	55.9	Low	98 Å²	98	81.7 Å²	81.7	69%	0.685	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	19.2	179.8	58	0	0	0	0	115.6	V295	V295-S297 PolarHBondContact O-N 2.99Å
298	S	38.8	Very low	52.9	Low	94 Å²	94	83 Å²	83	66%	0.657	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.2	7	-164.3	58.4	0	0	0	0	115.9	S296 T300	S296-S298 PolarHBondContact O-N 3.48Å; S298-T300 PolarHBondContact O-N 2.93Å
299	R	36.5	Very low	50	Low	219 Å²	219	84 Å²	84	83%	0.826	53%	0.531	S	S	*	.			trans	-96.6	78.6	-179.6	-77.2	-171.2	170.5	-170.6	-0.9	113.3
300	T	26.7	Very low	47.1	Very low	142 Å²	142	88.6 Å²	88.6	87%	0.871	56%	0.56	S	S	*	*			trans	-92	88	162.6	53.3	0	0	0	0	110.3	S298	S298-T300 PolarHBondContact O-N 2.93Å
301	A	28.4	Very low	44.6	Very low	90 Å²	90	91 Å²	91	74%	0.744	57%	0.568	S	S	*	*			trans	-156.7	132.9	170.4	0	0	0	0	0	110.3
302	D	27	Very low	41.9	Very low	137 Å²	137	99.6 Å²	99.6	73%	0.733	61%	0.607	S	S	*	*			trans	-66.2	133.3	-179.9	-72.6	-71.4	0	0	0	112.5	A304	D302-A304 PolarHBondContact O-N 3.24Å; D302-A304 VanDerWaalsContact O-N 3.17Å
303	P	30.7	Very low	39.1	Very low	123 Å²	123	104.1 Å²	104.1	80%	0.799	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	7	179.8	32.7	-36.2	0	0	0	114
304	A	31.5	Very low	36.6	Very low	84 Å²	84	112 Å²	112	69%	0.694	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-22.3	-165	0	0	0	0	0	115.7	D302	D302-A304 PolarHBondContact O-N 3.24Å; D302-A304 VanDerWaalsContact O-N 3.17Å
305	T	29.8	Very low	34.2	Very low	121 Å²	121	116.6 Å²	116.6	74%	0.742	70%	0.697	S	S	*	*	S	Bend	trans	-142.3	42.6	-162.5	51.3	0	0	0	0	114.9
306	T	28	Very low	32.7	Very low	122 Å²	122	125.6 Å²	125.6	75%	0.748	74%	0.735	S	S	*	*			trans	-145.9	104.6	172.3	-50.6	0	0	0	0	112.8	G308	T306-G308 PolarHBondContact O-N 2.64Å
307	S	31	Very low	31.6	Very low	138 Å²	138	128.3 Å²	128.3	97%	0.965	76%	0.755	S	S	*	*			trans	-78.4	40.1	172.3	61.3	0	0	0	0	112.7
308	G	28.4	Very low	30.7	Very low	50 Å²	50	131.8 Å²	131.8	52%	0.515	77%	0.765	S	S	.	*			trans	-98.4	145.9	-177.3	0	0	0	0	0	111.9	T306	T306-G308 PolarHBondContact O-N 2.64Å
309	S	30.8	Very low	30.5	Very low	90 Å²	90	132.8 Å²	132.8	63%	0.629	77%	0.767	S	S	*	*			trans	-66.8	131.2	177.3	40.6	0	0	0	0	111.5	M311	S309-M311 PolarHBondContact O-N 3.27Å
310	P	28.6	Very low	30.2	Very low	132 Å²	132	131.6 Å²	131.6	86%	0.857	77%	0.771	S	S	*	*	S	Bend	trans	-76.9	44.3	178.2	33.3	-36.7	0	0	0	113.2
311	M	36.2	Very low	30.6	Very low	105 Å²	105	131.3 Å²	131.3	52%	0.517	76%	0.763	S	S	.	*			trans	-153.6	74.5	172.4	-109.3	-157.8	-62.1	0	0	111.6	E264 S309	E264-M311 HydrophobicContact CB-CE 3.89Å; E264-M311 HydrophobicContact CG-CE 4.09Å; E264-M311 WeakPolarHBondContact OE2-CE 3.2Å; S309-M311 PolarHBondContact O-N 3.27Å
312	E	30	Very low	31.3	Very low	185 Å²	185	131.7 Å²	131.7	86%	0.864	76%	0.757	S	S	*	*			trans	-122	38.5	160.9	-78.2	-154.2	129.4	0	0	111.5
313	I	29.6	Very low	31.9	Very low	145 Å²	145	131 Å²	131	74%	0.744	76%	0.76	S	S	*	*	S	Bend	trans	-135.3	134.9	167.2	-54.2	179.6	0	0	0	106.4
314	L	28.9	Very low	32.4	Very low	171 Å²	171	136.2 Å²	136.2	90%	0.895	76%	0.763	S	S	*	*	S	Bend	trans	77.8	48.3	-172.5	-61.1	153.7	0	0	0	116.8
315	D	28.1	Very low	33	Very low	146 Å²	146	141 Å²	141	78%	0.781	76%	0.764	S	S	*	*			trans	-140.6	114.9	140.8	-166.2	2.9	0	0	0	112.4
316	K	34	Very low	33.5	Very low	205 Å²	205	138.9 Å²	138.9	89%	0.891	76%	0.758	S	S	*	*			trans	-173.9	119.7	148.2	-104.9	149.1	-168.5	158.5	0	109.7
317	S	33.7	Very low	34.1	Very low	98 Å²	98	136.6 Å²	136.6	69%	0.685	75%	0.752	S	S	*	*			trans	-66.2	163.4	177.5	46.2	0	0	0	0	113.7	V319	S317-V319 PolarHBondContact O-N 3.31Å
318	D	27.9	Very low	34.5	Very low	171 Å²	171	133 Å²	133	91%	0.914	73%	0.731	S	S	*	*			trans	-55.4	106	176.1	-73.5	-74.4	0	0	0	113
319	V	34.6	Very low	35.2	Very low	115 Å²	115	138.1 Å²	138.1	70%	0.697	74%	0.741	S	S	*	*			trans	-126.9	113	163.1	-178.2	0	0	0	0	108	S317 L321	S317-V319 PolarHBondContact O-N 3.31Å; V319-L321 PolarHBondContact O-N 2.76Å
320	Q	29.8	Very low	35.7	Very low	193 Å²	193	142.9 Å²	142.9	90%	0.902	75%	0.75	S	S	*	*			trans	-63.3	96.8	-175.2	-70.1	-177.8	-15.9	0	0	112.2
321	L	35.5	Very low	36.1	Very low	136 Å²	136	140 Å²	140	71%	0.712	74%	0.738	S	S	*	*			trans	-81.4	119.5	169.2	-89.8	158.3	0	0	0	110.1	V319	V319-L321 PolarHBondContact O-N 2.76Å
322	T	42.7	Very low	36.3	Very low	98 Å²	98	142 Å²	142	60%	0.601	75%	0.75	S	S	*	*			trans	-69.7	154.7	-171.8	56.5	0	0	0	0	112.4	R324 R325	T322-R324 PolarHBondContact O-N 3.23Å; T322-R325 PolarHBondContact O-N 3.49Å
323	P	39.2	Very low	36.6	Very low	124 Å²	124	137.9 Å²	137.9	81%	0.805	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-8.7	-175.7	-27.6	35.8	0	0	0	116.3
324	R	42.3	Very low	36.9	Very low	231 Å²	231	135.1 Å²	135.1	87%	0.872	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-11.8	-174.5	-148.4	170.4	-171.7	162.6	1.9	114.3	T322	T322-R324 PolarHBondContact O-N 3.23Å
325	R	43.7	Very low	37.2	Very low	185 Å²	185	132.4 Å²	132.4	70%	0.698	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	-37.8	179	-117.7	176	178.6	142.4	0.1	114	T322 A327 A328	T322-R325 PolarHBondContact O-N 3.49Å; R325-A327 PolarHBondContact O-N 3.03Å; R325-A327 VanDerWaalsContact O-N 3.1Å; R325-A328 WeakPolarHBondContact O-CB 3.45Å; R325-A328 PolarHBondContact O-N 2.84Å
326	A	40.2	Very low	37.6	Very low	76 Å²	76	137.3 Å²	137.3	63%	0.628	74%	0.744	S	S	*	*	H	α-helix	trans	-61.7	-20	-180	0	0	0	0	0	114.5
327	A	39.9	Very low	37.5	Very low	75 Å²	75	139.7 Å²	139.7	62%	0.62	75%	0.748	S	S	*	*	H	α-helix	trans	-77.8	-18.4	175.1	0	0	0	0	0	114.1	R325	R325-A327 PolarHBondContact O-N 3.03Å; R325-A327 VanDerWaalsContact O-N 3.1Å
328	A	40.2	Very low	37.6	Very low	62 Å²	62	139 Å²	139	51%	0.512	75%	0.748	S	S	.	*	H	α-helix	trans	-84.9	-46.4	-172.8	0	0	0	0	0	113	R325 K330 A331	R325-A328 WeakPolarHBondContact O-CB 3.45Å; R325-A328 PolarHBondContact O-N 2.84Å; A328-K330 VanDerWaalsContact C-N 3.32Å; A328-K330 PolarHBondContact O-N 3.34Å; A328-A331 PolarHBondContact O-N 2.8Å
329	E	42.7	Very low	38.1	Very low	158 Å²	158	138 Å²	138	74%	0.738	74%	0.743	S	S	*	*	H	α-helix	trans	-69.7	-32.4	-176.9	-65.5	177.9	142.2	0	0	112	A331 L332	E329-A331 PolarHBondContact O-N 3.11Å; E329-A331 VanDerWaalsContact O-N 3.12Å; E329-L332 PolarHBondContact O-N 2.9Å; E329-L332 VanDerWaalsContact O-N 3.07Å
330	K	41	Very low	38.1	Very low	189 Å²	189	139.7 Å²	139.7	82%	0.822	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-10	176.6	-151.4	168.8	-172.9	175.2	0	113.8	A328	A328-K330 VanDerWaalsContact C-N 3.32Å; A328-K330 PolarHBondContact O-N 3.34Å
331	A	38.4	Very low	38.4	Very low	72 Å²	72	134.5 Å²	134.5	60%	0.595	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-13.2	173.8	0	0	0	0	0	114	A328 E329	A328-A331 PolarHBondContact O-N 2.8Å; E329-A331 PolarHBondContact O-N 3.11Å; E329-A331 VanDerWaalsContact O-N 3.12Å
332	L	39.5	Very low	38.6	Very low	148 Å²	148	137 Å²	137	78%	0.775	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-18.7	-171.6	-165.1	59.8	0	0	0	114	E329 A334	E329-L332 PolarHBondContact O-N 2.9Å; E329-L332 VanDerWaalsContact O-N 3.07Å; L332-A334 VanDerWaalsContact C-N 3.31Å; L332-A334 PolarHBondContact O-N 2.8Å
333	A	36.5	Very low	38.2	Very low	97 Å²	97	137.6 Å²	137.6	80%	0.802	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-0.4	-178.3	0	0	0	0	0	115
334	A	35.7	Very low	38.1	Very low	87 Å²	87	137.8 Å²	137.8	72%	0.719	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-6.2	-170.3	0	0	0	0	0	115.2	L332	L332-A334 VanDerWaalsContact C-N 3.31Å; L332-A334 PolarHBondContact O-N 2.8Å
335	T	36.5	Very low	37.6	Very low	114 Å²	114	132 Å²	132	70%	0.699	75%	0.748	S	S	*	*			trans	-135.2	63.7	-158.2	-13.3	0	0	0	0	114.3
336	R	36.2	Very low	37.2	Very low	250 Å²	250	129.5 Å²	129.5	94%	0.943	75%	0.754	S	S	*	*			trans	-160.5	84.6	162.7	-107.3	155.9	-164.5	-153.9	2.7	112.7
337	R	30.5	Very low	36.9	Very low	254 Å²	254	133.5 Å²	133.5	96%	0.958	76%	0.763	S	S	*	*			trans	-144.7	101.7	165.9	-87	-173.6	172.3	179.2	-2.4	109.8
338	A	37.2	Very low	36.3	Very low	85 Å²	85	136 Å²	136	70%	0.702	77%	0.773	S	S	*	*			trans	-178	142.1	158.5	0	0	0	0	0	110.1
339	N	37.1	Very low	35.9	Very low	149 Å²	149	139.4 Å²	139.4	80%	0.797	79%	0.787	S	S	*	*			trans	66.2	143.3	160.4	-55.7	-4.1	0	0	0	116.5
340	N	36.2	Very low	35.1	Very low	150 Å²	150	137.5 Å²	137.5	80%	0.802	79%	0.792	S	S	*	*			cis	-140.3	161.7	6.3	-113.7	-5.4	0	0	0	112
341	S	34.4	Very low	34.6	Very low	85 Å²	85	133.6 Å²	133.6	59%	0.594	79%	0.788	S	S	*	*			trans	-87.3	153.7	173.3	55.2	0	0	0	0	113
342	H	39.5	Very low	34.1	Very low	188 Å²	188	135.1 Å²	135.1	87%	0.87	79%	0.794	S	S	*	*				-171.2	175.8	118.4	-90.7	-44.1	0	0	0	111.5
343	S	36.1	Very low	33.4	Very low	110 Å²	110	133.7 Å²	133.7	77%	0.769	80%	0.797	S	S	*	*			trans	-132.5	144.5	-152.8	54.6	0	0	0	0	114.6
344	S	36.7	Very low	33.2	Very low	128 Å²	128	134.6 Å²	134.6	90%	0.895	79%	0.792	S	S	*	*			trans	-154.1	152.2	141.8	56.6	0	0	0	0	110.9
345	S	32.2	Very low	33.2	Very low	109 Å²	109	135.2 Å²	135.2	76%	0.762	79%	0.792	S	S	*	*			trans	-103.2	145	-163.6	53.1	0	0	0	0	114.2
346	T	35.1	Very low	34	Very low	134 Å²	134	135.5 Å²	135.5	82%	0.822	79%	0.788	S	S	*	*			trans	-155.6	119.4	139.5	11.4	0	0	0	0	112.5
347	L	33	Very low	35.7	Very low	159 Å²	159	128.6 Å²	128.6	83%	0.832	77%	0.774	S	S	*	*			trans	56.4	135.7	156	-58.1	173.7	0	0	0	120.3
348	P	27.8	Very low	38.2	Very low	128 Å²	128	120 Å²	120	83%	0.831	75%	0.75	S	S	*	*			trans	-87.5	129.9	179.5	34.3	-32.7	0	0	0	112.7
349	V	30.9	Very low	40.8	Very low	133 Å²	133	116.4 Å²	116.4	81%	0.806	72%	0.72	S	S	*	*			trans	-107.2	128.6	157	177.8	0	0	0	0	107.3	S351	V349-S351 VanDerWaalsContact C-N 3.33Å; V349-S351 PolarHBondContact O-N 2.81Å
350	S	27.5	Very low	43.6	Very low	118 Å²	118	110.4 Å²	110.4	83%	0.825	69%	0.686	S	S	*	*			trans	-77.9	78	-177.1	54.6	0	0	0	0	111.7	S352	S350-S352 PolarHBondContact O-N 2.97Å
351	S	28.6	Very low	46.5	Very low	108 Å²	108	103.3 Å²	103.3	76%	0.755	65%	0.648	S	S	*	*			trans	-73.3	90.3	169.8	43.6	0	0	0	0	110.7	V349 S353	V349-S351 VanDerWaalsContact C-N 3.33Å; V349-S351 PolarHBondContact O-N 2.81Å; S351-S353 PolarHBondContact O-N 3.16Å
352	S	28.1	Very low	49.6	Very low	103 Å²	103	99.2 Å²	99.2	72%	0.72	62%	0.62	S	S	*	*			trans	-64.7	96.8	168.3	54	0	0	0	0	109.6	S350 T354	S350-S352 PolarHBondContact O-N 2.97Å; S352-T354 VanDerWaalsContact C-N 3.26Å; S352-T354 PolarHBondContact O-N 2.82Å
353	S	26.5	Very low	52.4	Low	118 Å²	118	90.3 Å²	90.3	83%	0.825	58%	0.579	S	S	*	*			trans	-72.7	78.5	178.2	60.9	0	0	0	0	110.8	S351 S355	S351-S353 PolarHBondContact O-N 3.16Å; S353-S355 PolarHBondContact O-N 2.83Å; S353-S355 VanDerWaalsContact O-N 3.09Å
354	T	31.2	Very low	55.4	Low	116 Å²	116	85.1 Å²	85.1	71%	0.712	54%	0.543	S	S	*	.			trans	-63.5	107.1	168.7	33.5	0	0	0	0	109.1	S352 L356	S352-T354 VanDerWaalsContact C-N 3.26Å; S352-T354 PolarHBondContact O-N 2.82Å; T354-L356 PolarHBondContact O-N 2.89Å
355	S	35.3	Very low	58.3	Low	100 Å²	100	79.6 Å²	79.6	70%	0.699	51%	0.506	S	S	*	.			trans	-55.7	124.1	161.7	52.4	0	0	0	0	108	S353 T357	S353-S355 PolarHBondContact O-N 2.83Å; S353-S355 VanDerWaalsContact O-N 3.09Å; S355-T357 PolarHBondContact O-N 3.01Å
356	L	53.6	Low	61.5	Low	121 Å²	121	74.4 Å²	74.4	63%	0.634	47%	0.47	S	S	*	.			trans	-62.1	98.6	-177.3	-79.1	81.4	0	0	0	110.3	T354	T354-L356 PolarHBondContact O-N 2.89Å
357	T	71.4	Confident	64.5	Low	104 Å²	104	68.7 Å²	68.7	64%	0.638	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-65.1	146.6	166.9	40.8	0	0	0	0	109.2	S355	S355-T357 PolarHBondContact O-N 3.01Å
358	T	84.6	Confident	67.6	Low	73 Å²	73	61.5 Å²	61.5	45%	0.448	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-59.5	123.9	168.2	-58.7	0	0	0	0	108.3	G381	T358-G381 WeakPolarHBondContact CG2-O 3.43Å
359	P	91.3	Very high	71	Confident	11 Å²	11	55.8 Å²	55.8	7%	0.071	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-61.8	141.3	-177.9	25.4	-33.9	0	0	0	110	V295 F361 A382 K383 D821	V295-P359 HydrophobicContact CG2-CG 3.98Å; P359-F361 HydrophobicContact CB-CE2 3.96Å; P359-F361 HydrophobicContact CB-CZ 3.79Å; P359-F361 HydrophobicContact CG-CE2 4.29Å; P359-F361 HydrophobicContact CG-CZ 4.44Å; P359-A382 HydrophobicContact CG-CB 4.14Å; P359-A382 WeakPolarHBondContact O-CB 3.42Å; P359-K383 PolarHBondContact O-N 2.87Å; P359-D821 WeakPolarHBondContact CA-OD2 3.32Å
360	H	95.4	Very high	74.2	Confident	22 Å²	22	49.5 Å²	49.5	10%	0.102	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.8	-176.2	179.2	-159.1	0	0	0	109.9	K383 T385 E819 A820 D821	H360-K383 WeakPolarHBondContact CA-O 3.23Å; H360-K383 HydrophobicContact CB-CB 4.13Å; H360-K383 HydrophobicContact CB-CD 3.95Å; H360-K383 HydrophobicContact CB-CG 4.29Å; H360-K383 VanDerWaalsContact CE1-CE 3.49Å; H360-K383 WeakPolarHBondContact CE1-CE 3.48Å; H360-K383 PolarHBondContact CE1-NZ 2.91Å; H360-K383 WeakPolarHBondContact ND1-CE 3.19Å; H360-K383 PolarHBondContact ND1-NZ 2.96Å; H360-T385 PolarHBondContact NE2-OG1 3.17Å; H360-E819 PolarHBondContact CE1-O 3.12Å; H360-E819 PolarHBondContact ND1-O 3.29Å; H360-A820 VanDerWaalsContact O-CB 3.23Å; H360-A820 WeakPolarHBondContact O-CB 3.26Å; H360-D821 PolarHBondContact N-OD2 3.18Å; H360-D821 PolarHBondContact O-N 2.96Å
361	F	97.7	Very high	77.6	Confident	1 Å²	1	43.9 Å²	43.9	0%	0.004	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.7	176.1	-52.8	-67.6	0	0	0	111.6	P359 L377 A382 K383 V384 T385 D821 A822 V1136 Y1140 F1141	P359-F361 HydrophobicContact CB-CE2 3.96Å; P359-F361 HydrophobicContact CB-CZ 3.79Å; P359-F361 HydrophobicContact CG-CE2 4.29Å; P359-F361 HydrophobicContact CG-CZ 4.44Å; F361-L377 HydrophobicContact CB-CD1 4.34Å; F361-L377 HydrophobicContact CD2-CD1 3.95Å; F361-L377 HydrophobicContact CD2-CD2 4.3Å; F361-L377 HydrophobicContact CE2-CD2 4.27Å; F361-L377 HydrophobicContact CG-CD1 4.27Å; F361-A382 HydrophobicContact CD2-CB 3.79Å; F361-A382 HydrophobicContact CE2-CB 3.62Å; F361-K383 PolarHBondContact N-O 3.35Å; F361-V384 WeakPolarHBondContact O-CA 3.34Å; F361-T385 PolarHBondContact O-N 3.35Å; F361-D821 HydrophobicContact CE1-CB 4.22Å; F361-A822 WeakPolarHBondContact CA-O 3.32Å; F361-A822 HydrophobicContact CD1-CB 3.96Å; F361-A822 HydrophobicContact CE1-CB 4.15Å; F361-V1136 HydrophobicContact CD1-CG1 3.88Å; F361-V1136 HydrophobicContact CD2-CG1 4.16Å; F361-V1136 HydrophobicContact CE1-CG1 3.45Å; F361-V1136 VanDerWaalsContact CE1-CG1 3.45Å; F361-V1136 HydrophobicContact CE2-CG1 3.76Å; F361-V1136 HydrophobicContact CG-CG1 4.21Å; F361-V1136 HydrophobicContact CZ-CG1 3.38Å; F361-Y1140 HydrophobicContact CE1-CD1 4.3Å; F361-Y1140 HydrophobicContact CE1-CD2 4.08Å; F361-Y1140 AromaticContact CE1-CG 3.91Å; F361-Y1140 HydrophobicContact CE1-CG 3.91Å; F361-Y1140 HydrophobicContact CZ-CD2 4.45Å; F361-Y1140 HydrophobicContact CZ-CG 4.03Å; F361-F1141 AromaticContact CE2-CE2 3.57Å; F361-F1141 HydrophobicContact CE2-CE2 3.57Å; F361-F1141 AromaticContact CE2-CZ 3.92Å; F361-F1141 HydrophobicContact CE2-CZ 3.92Å; F361-F1141 AromaticContact CZ-CE2 3.83Å; F361-F1141 HydrophobicContact CZ-CE2 3.83Å
362	I	98.5	Very high	80.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	142.1	166.6	-69.1	165	0	0	0	108.6	I364 T385 L387 V803 Y818 A820 A822 L823 I824	I362-I364 HydrophobicContact CG2-CG1 4.48Å; I362-T385 CarbonylContact C-O 3.4Å; I362-T385 WeakPolarHBondContact CA-O 3.5Å; I362-L387 HydrophobicContact CG2-CD1 3.64Å; I362-L387 HydrophobicContact CG2-CG 4.24Å; I362-V803 HydrophobicContact CD1-CB 4.21Å; I362-V803 HydrophobicContact CD1-CG2 3.69Å; I362-V803 HydrophobicContact CG2-CG2 4.3Å; I362-Y818 WeakPolarHBondContact CD1-O 3.46Å; I362-A820 HydrophobicContact CB-CB 4.34Å; I362-A820 HydrophobicContact CD1-CB 3.72Å; I362-A820 HydrophobicContact CG1-CB 3.66Å; I362-A822 PolarHBondContact N-O 2.79Å; I362-A822 VanDerWaalsContact N-O 3.13Å; I362-L823 HydrophobicContact CB-CD1 4.02Å; I362-L823 HydrophobicContact CB-CG 4.45Å; I362-L823 HydrophobicContact CG2-CD1 3.7Å; I362-L823 HydrophobicContact CG2-CG 4.35Å; I362-L823 CarbonylContact O-C 3.53Å; I362-L823 VanDerWaalsContact O-CA 3.3Å; I362-L823 WeakPolarHBondContact O-CA 3.34Å; I362-I824 PolarHBondContact O-N 2.71Å
363	I	98.7	Very high	84.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	125.3	171.5	-56.5	-167.7	0	0	0	108.3	A373 A374 V384 T385 I386 L387 I824 T826	I363-A373 HydrophobicContact CD1-CB 3.9Å; I363-A374 HydrophobicContact CD1-CB 3.95Å; I363-V384 HydrophobicContact CD1-CG1 3.81Å; I363-V384 HydrophobicContact CG1-CG1 3.89Å; I363-T385 PolarHBondContact N-O 3.27Å; I363-I386 HydrophobicContact CB-CG1 4.37Å; I363-I386 HydrophobicContact CB-CG2 4.36Å; I363-I386 HydrophobicContact CG2-CG2 4.39Å; I363-I386 CarbonylContact O-C 3.49Å; I363-I386 VanDerWaalsContact O-CA 3.3Å; I363-I386 WeakPolarHBondContact O-CA 3.24Å; I363-L387 PolarHBondContact O-N 3.38Å; I363-I824 WeakPolarHBondContact CA-O 3.48Å; I363-I824 HydrophobicContact CD1-CB 4.49Å; I363-I824 HydrophobicContact CD1-CD1 4.07Å; I363-I824 HydrophobicContact CG1-CB 4.11Å; I363-I824 HydrophobicContact CG1-CD1 4.42Å; I363-I824 HydrophobicContact CG1-CG1 4.41Å; I363-I824 HydrophobicContact CG2-CB 4.41Å; I363-T826 HydrophobicContact CG2-CG2 4.18Å
364	I	98.6	Very high	87.6	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	117.9	175.8	-54.1	179.1	0	0	0	108.3	I362 V791 I794 L823 I824 T826 L827	I362-I364 HydrophobicContact CG2-CG1 4.48Å; I364-V791 HydrophobicContact CD1-CB 4.47Å; I364-V791 HydrophobicContact CD1-CG1 4.17Å; I364-V791 HydrophobicContact CD1-CG2 4.06Å; I364-V791 HydrophobicContact CG1-CG2 4.14Å; I364-V791 HydrophobicContact CG2-CG2 3.97Å; I364-I794 HydrophobicContact CD1-CD1 3.38Å; I364-I794 HydrophobicContact CD1-CG1 3.77Å; I364-L823 HydrophobicContact CD1-CD1 3.81Å; I364-L823 HydrophobicContact CD1-CD2 3.79Å; I364-L823 HydrophobicContact CD1-CG 4.3Å; I364-L823 HydrophobicContact CG1-CD1 3.95Å; I364-L823 HydrophobicContact CG1-CD2 4.06Å; I364-L823 HydrophobicContact CG1-CG 4.28Å; I364-I824 PolarHBondContact N-O 3.39Å; I364-T826 WeakPolarHBondContact O-CA 3.47Å; I364-T826 WeakPolarHBondContact O-CB 3.46Å; I364-T826 PolarHBondContact O-N 3.32Å; I364-T826 PolarHBondContact O-OG1 2.83Å; I364-L827 HydrophobicContact CG2-CD2 3.53Å; I364-L827 HydrophobicContact CG2-CG 3.91Å
365	G	98.1	Very high	90.7	Very high	12 Å²	12	22.7 Å²	22.7	12%	0.124	14%	0.141	C	C	.	.			trans	97.7	129.4	-177.8	0	0	0	0	0	113.5	G367 I386 L387 T826	G365-G367 VanDerWaalsContact C-N 3.33Å; G365-I386 WeakPolarHBondContact O-CG2 3.41Å; G365-L387 PolarHBondContact N-O 3.21Å; G365-T826 PolarHBondContact O-OG1 2.66Å
366	A	98.5	Very high	93.6	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.108	C	C	.	.			trans	-98.9	35	172.3	0	0	0	0	0	111.8	L371 I386 E388 V393 G394 I785	A366-L371 HydrophobicContact CB-CD2 4.45Å; A366-L371 WeakPolarHBondContact O-CD1 3.46Å; A366-I386 HydrophobicContact CB-CG2 3.92Å; A366-E388 HydrophobicContact CB-CB 3.76Å; A366-E388 HydrophobicContact CB-CG 3.93Å; A366-E388 PolarHBondContact N-OE2 2.97Å; A366-V393 HydrophobicContact CB-CB 4.12Å; A366-V393 HydrophobicContact CB-CG1 3.89Å; A366-G394 PolarHBondContact O-N 2.95Å; A366-I785 HydrophobicContact CB-CG2 4.28Å
367	G	98.4	Very high	95.6	Very high	13 Å²	13	12.2 Å²	12.2	13%	0.134	8%	0.078	C	C	.	.	B	Isolated β-bridge	trans	-69.2	174.4	164.5	0	0	0	0	0	111.9	G365 S369 G370 L371	G365-G367 VanDerWaalsContact C-N 3.33Å; G367-S369 VanDerWaalsContact C-N 3.25Å; G367-S369 PolarHBondContact O-N 2.81Å; G367-G370 PolarHBondContact O-N 3.03Å; G367-L371 WeakPolarHBondContact O-CB 3.45Å; G367-L371 WeakPolarHBondContact O-CG 3.49Å; G367-L371 PolarHBondContact O-N 2.86Å
368	I	98.5	Very high	96.7	Very high	9 Å²	9	7.4 Å²	7.4	5%	0.046	5%	0.049	C	C	.	.	H	α-helix	trans	-57.6	-36.8	-177.2	-170.6	62.1	0	0	0	113.1	I372 I397 L425 V738 T739 L742 V1122 A1125 L1126	I368-I372 WeakPolarHBondContact O-CB 3.31Å; I368-I372 WeakPolarHBondContact O-CG2 3.37Å; I368-I372 PolarHBondContact O-N 2.86Å; I368-I397 HydrophobicContact CB-CD1 3.95Å; I368-I397 HydrophobicContact CG2-CD1 4.25Å; I368-L425 HydrophobicContact CD1-CD1 4.41Å; I368-V738 HydrophobicContact CD1-CG1 4.34Å; I368-T739 HydrophobicContact CB-CG2 4.36Å; I368-T739 HydrophobicContact CD1-CG2 4.03Å; I368-L742 HydrophobicContact CD1-CD1 3.51Å; I368-V1122 HydrophobicContact CG1-CG1 4.47Å; I368-V1122 HydrophobicContact CG2-CG1 4.38Å; I368-A1125 HydrophobicContact CG2-CB 3.54Å; I368-L1126 HydrophobicContact CG1-CB 4.1Å; I368-L1126 HydrophobicContact CG1-CG 4.42Å
369	S	98.6	Very high	97.1	Very high	8 Å²	8	3.9 Å²	3.9	6%	0.056	3%	0.027	C	C	.	.	H	α-helix	trans	-60	-54.4	174.2	47.9	0	0	0	0	112.2	G367 L371 A373 A1125 G1129	G367-S369 VanDerWaalsContact C-N 3.25Å; G367-S369 PolarHBondContact O-N 2.81Å; S369-L371 PolarHBondContact O-N 2.94Å; S369-A373 VanDerWaalsContact O-CB 3.24Å; S369-A373 WeakPolarHBondContact O-CB 3.23Å; S369-A373 PolarHBondContact O-N 3.34Å; S369-A1125 WeakPolarHBondContact CA-O 3.42Å; S369-A1125 WeakPolarHBondContact CB-O 3.38Å; S369-G1129 WeakPolarHBondContact O-CA 3.4Å
370	G	98.5	Very high	97.1	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-65.5	-37.7	179.2	0	0	0	0	0	113.2	G367 A374	G367-G370 PolarHBondContact O-N 3.03Å; G370-A374 VanDerWaalsContact O-CB 3.28Å; G370-A374 WeakPolarHBondContact O-CB 3.41Å; G370-A374 PolarHBondContact O-N 3.24Å
371	L	98.5	Very high	96.9	Very high	0 Å²	0	2.7 Å²	2.7	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-65.6	-48	176.1	-73.2	170.3	0	0	0	112.2	A366 G367 S369 A374 R375 I386 V393 T739 L742 A743 I746 I785	A366-L371 HydrophobicContact CB-CD2 4.45Å; A366-L371 WeakPolarHBondContact O-CD1 3.46Å; G367-L371 WeakPolarHBondContact O-CB 3.45Å; G367-L371 WeakPolarHBondContact O-CG 3.49Å; G367-L371 PolarHBondContact O-N 2.86Å; S369-L371 PolarHBondContact O-N 2.94Å; L371-A374 PolarHBondContact O-N 3.41Å; L371-R375 WeakPolarHBondContact O-CB 3.47Å; L371-R375 PolarHBondContact O-N 3.03Å; L371-I386 HydrophobicContact CD2-CD1 4.07Å; L371-V393 HydrophobicContact CD1-CB 4.42Å; L371-T739 HydrophobicContact CD1-CG2 3.84Å; L371-L742 HydrophobicContact CB-CB 4.33Å; L371-L742 HydrophobicContact CB-CD1 4.47Å; L371-A743 HydrophobicContact CD2-CB 3.96Å; L371-I746 HydrophobicContact CB-CD1 4.3Å; L371-I746 HydrophobicContact CD2-CD1 3.79Å; L371-I746 VanDerWaalsContact O-CD1 3.26Å; L371-I746 WeakPolarHBondContact O-CD1 3.28Å; L371-I785 HydrophobicContact CD2-CD1 3.8Å
372	I	98.2	Very high	96.6	Very high	0 Å²	0	2.6 Å²	2.6	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-70.7	-35.5	-179.1	-159.3	68.5	0	0	0	111.4	I368 R375 Q376 L425 L742 L1126 L1130	I368-I372 WeakPolarHBondContact O-CB 3.31Å; I368-I372 WeakPolarHBondContact O-CG2 3.37Å; I368-I372 PolarHBondContact O-N 2.86Å; I372-R375 PolarHBondContact O-N 3.29Å; I372-Q376 PolarHBondContact O-N 3.42Å; I372-L425 HydrophobicContact CD1-CD2 4.43Å; I372-L742 HydrophobicContact CD1-CD2 4.1Å; I372-L1126 HydrophobicContact CG1-CD2 4.29Å; I372-L1126 HydrophobicContact CG1-CG 4.36Å; I372-L1126 HydrophobicContact CG2-CG 4.3Å; I372-L1126 VanDerWaalsContact CG2-O 3.26Å; I372-L1126 WeakPolarHBondContact CG2-O 3.41Å; I372-L1130 HydrophobicContact CG1-CD2 3.72Å; I372-L1130 HydrophobicContact CG1-CG 4.08Å; I372-L1130 HydrophobicContact CG2-CG 4.39Å
373	A	98.4	Very high	96.5	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-60.9	-48	171.6	0	0	0	0	0	111.9	I363 S369 R375 Q376 L377 I824 G1129	I363-A373 HydrophobicContact CD1-CB 3.9Å; S369-A373 VanDerWaalsContact O-CB 3.24Å; S369-A373 WeakPolarHBondContact O-CB 3.23Å; S369-A373 PolarHBondContact O-N 3.34Å; A373-R375 VanDerWaalsContact C-N 3.32Å; A373-R375 PolarHBondContact O-N 3.15Å; A373-Q376 PolarHBondContact O-N 2.9Å; A373-L377 WeakPolarHBondContact O-CB 3.37Å; A373-L377 WeakPolarHBondContact O-CG 3.49Å; A373-L377 PolarHBondContact O-N 3.2Å; A373-I824 HydrophobicContact CB-CD1 4Å; A373-G1129 WeakPolarHBondContact CA-O 3.44Å; A373-G1129 WeakPolarHBondContact CB-O 3.24Å
374	A	97.8	Very high	96.4	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-60	-42.1	174.3	0	0	0	0	0	111.9	I363 G370 L371 Q376 T378 V384 I386 I746	I363-A374 HydrophobicContact CD1-CB 3.95Å; G370-A374 VanDerWaalsContact O-CB 3.28Å; G370-A374 WeakPolarHBondContact O-CB 3.41Å; G370-A374 PolarHBondContact O-N 3.24Å; L371-A374 PolarHBondContact O-N 3.41Å; A374-Q376 VanDerWaalsContact C-N 3.32Å; A374-Q376 PolarHBondContact O-N 2.76Å; A374-T378 WeakPolarHBondContact O-CB 3.44Å; A374-T378 VanDerWaalsContact O-CG2 3.31Å; A374-T378 WeakPolarHBondContact O-CG2 3.48Å; A374-T378 PolarHBondContact O-N 3.05Å; A374-T378 PolarHBondContact O-OG1 3.15Å; A374-V384 HydrophobicContact CB-CG1 3.78Å; A374-I386 HydrophobicContact CB-CD1 3.46Å; A374-I386 VanDerWaalsContact CB-CD1 3.46Å; A374-I386 HydrophobicContact CB-CG1 3.91Å; A374-I746 HydrophobicContact CB-CD1 4.13Å; A374-I746 HydrophobicContact CB-CG2 4.39Å
375	R	96.1	Very high	96.4	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-62.1	-39.1	178.9	173	58.8	-165.9	113.8	10.4	111.8	G283 F285 L371 I372 A373 T378 Y379 L742 I746	G283-R375 PolarHBondContact O-NE 2.91Å; G283-R375 PolarHBondContact O-NH2 3.37Å; G283-R375 VanDerWaalsContact O-NH2 3.08Å; F285-R375 VanDerWaalsContact CE1-NH2 3.32Å; L371-R375 WeakPolarHBondContact O-CB 3.47Å; L371-R375 PolarHBondContact O-N 3.03Å; I372-R375 PolarHBondContact O-N 3.29Å; A373-R375 VanDerWaalsContact C-N 3.32Å; A373-R375 PolarHBondContact O-N 3.15Å; R375-T378 PolarHBondContact O-OG1 3.23Å; R375-T378 VanDerWaalsContact O-OG1 3.1Å; R375-Y379 VanDerWaalsContact O-CB 3.25Å; R375-Y379 WeakPolarHBondContact O-CB 3.36Å; R375-Y379 PolarHBondContact O-N 3.16Å; R375-L742 HydrophobicContact CG-CD2 4.34Å; R375-I746 HydrophobicContact CB-CD1 4.19Å; R375-I746 HydrophobicContact CB-CG1 3.99Å
376	Q	96.1	Very high	96.4	Very high	1 Å²	1	6.5 Å²	6.5	1%	0.005	4%	0.036	C	C	.	.	H	α-helix	trans	-78.1	-40.3	179.5	-152.7	67	9.1	0	0	112.3	N281 I372 A373 A374 Y379 F380 L1130 A1133	N281-Q376 PolarHBondContact O-NE2 3.07Å; N281-Q376 PolarHBondContact O-OE1 2.96Å; I372-Q376 PolarHBondContact O-N 3.42Å; A373-Q376 PolarHBondContact O-N 2.9Å; A374-Q376 VanDerWaalsContact C-N 3.32Å; A374-Q376 PolarHBondContact O-N 2.76Å; Q376-Y379 WeakPolarHBondContact O-CB 3.45Å; Q376-Y379 PolarHBondContact O-N 3.47Å; Q376-F380 HydrophobicContact CG-CE1 3.99Å; Q376-F380 HydrophobicContact CG-CE2 4.06Å; Q376-F380 HydrophobicContact CG-CZ 3.64Å; Q376-F380 WeakPolarHBondContact O-CD1 3.38Å; Q376-F380 WeakPolarHBondContact O-CG 3.5Å; Q376-F380 PolarHBondContact O-N 3.41Å; Q376-L1130 HydrophobicContact CB-CD2 4.36Å; Q376-L1130 HydrophobicContact CG-CD2 4.29Å; Q376-A1133 HydrophobicContact CB-CB 3.89Å; Q376-A1133 HydrophobicContact CG-CB 4.36Å
377	L	95.5	Very high	96.4	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-67.4	-39.4	175.4	-70.9	173.6	0	0	0	112.8	F361 A373 F380 G381 A382 V384 I824 A1133 V1136 F1141	F361-L377 HydrophobicContact CB-CD1 4.34Å; F361-L377 HydrophobicContact CD2-CD1 3.95Å; F361-L377 HydrophobicContact CD2-CD2 4.3Å; F361-L377 HydrophobicContact CE2-CD2 4.27Å; F361-L377 HydrophobicContact CG-CD1 4.27Å; A373-L377 WeakPolarHBondContact O-CB 3.37Å; A373-L377 WeakPolarHBondContact O-CG 3.49Å; A373-L377 PolarHBondContact O-N 3.2Å; L377-F380 CarbonylContact O-C 3.49Å; L377-F380 PolarHBondContact O-N 2.82Å; L377-G381 PolarHBondContact O-N 2.84Å; L377-A382 HydrophobicContact CB-CB 4.47Å; L377-A382 WeakPolarHBondContact O-CB 3.39Å; L377-A382 PolarHBondContact O-N 3.17Å; L377-V384 HydrophobicContact CB-CG2 3.72Å; L377-I824 HydrophobicContact CD1-CD1 3.83Å; L377-A1133 HydrophobicContact CD2-CB 4.3Å; L377-A1133 HydrophobicContact CG-CB 4.03Å; L377-V1136 HydrophobicContact CD1-CG1 4.41Å; L377-V1136 HydrophobicContact CD2-CB 4.2Å; L377-V1136 HydrophobicContact CD2-CG1 3.79Å; L377-F1141 HydrophobicContact CD2-CE2 3.94Å; L377-F1141 HydrophobicContact CD2-CZ 3.83Å
378	T	94.2	Very high	96.4	Very high	3 Å²	3	6.4 Å²	6.4	2%	0.018	3%	0.033	C	C	.	.	H	α-helix	trans	-68	-34.5	171.6	52.9	0	0	0	0	111.9	A374 R375 F380 G381 V384 G781	A374-T378 WeakPolarHBondContact O-CB 3.44Å; A374-T378 VanDerWaalsContact O-CG2 3.31Å; A374-T378 WeakPolarHBondContact O-CG2 3.48Å; A374-T378 PolarHBondContact O-N 3.05Å; A374-T378 PolarHBondContact O-OG1 3.15Å; R375-T378 PolarHBondContact O-OG1 3.23Å; R375-T378 VanDerWaalsContact O-OG1 3.1Å; T378-F380 VanDerWaalsContact C-N 3.34Å; T378-G381 PolarHBondContact O-N 3.44Å; T378-G381 VanDerWaalsContact O-N 3.14Å; T378-V384 HydrophobicContact CG2-CB 4Å; T378-V384 HydrophobicContact CG2-CG2 3.77Å; T378-G781 WeakPolarHBondContact CB-O 3.2Å; T378-G781 PolarHBondContact O-N 3.1Å
379	Y	93	Very high	96.3	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-59.6	-43.8	169.7	177.4	-127	0	0	0	111.6	Q173 E275 N281 F285 I287 P291 R375 Q376 G381 Y778	Q173-Y379 PolarHBondContact NE2-OH 3.41Å; E275-Y379 HydrophobicContact CG-CE1 3.94Å; E275-Y379 WeakPolarHBondContact OE1-CE1 3.22Å; E275-Y379 PolarHBondContact OE1-OH 3.36Å; N281-Y379 HydrophobicContact CB-CE1 4.15Å; F285-Y379 AromaticContact CE2-CE2 3.94Å; F285-Y379 HydrophobicContact CE2-CE2 3.94Å; F285-Y379 AromaticContact CE2-CZ 3.95Å; F285-Y379 HydrophobicContact CZ-CD1 4.31Å; F285-Y379 HydrophobicContact CZ-CD2 4.13Å; F285-Y379 AromaticContact CZ-CE1 3.98Å; F285-Y379 HydrophobicContact CZ-CE1 3.98Å; F285-Y379 AromaticContact CZ-CE2 3.77Å; F285-Y379 HydrophobicContact CZ-CE2 3.77Å; F285-Y379 HydrophobicContact CZ-CG 4.38Å; F285-Y379 AromaticContact CZ-CZ 3.7Å; I287-Y379 HydrophobicContact CD1-CD2 3.81Å; I287-Y379 HydrophobicContact CD1-CE2 3.87Å; I287-Y379 HydrophobicContact CG1-CD2 4.37Å; I287-Y379 HydrophobicContact CG1-CE2 3.96Å; I287-Y379 HydrophobicContact CG2-CE2 4.44Å; P291-Y379 HydrophobicContact CB-CD1 4.39Å; P291-Y379 HydrophobicContact CB-CE1 3.76Å; P291-Y379 HydrophobicContact CB-CE2 4.22Å; P291-Y379 HydrophobicContact CG-CD1 4.29Å; P291-Y379 HydrophobicContact CG-CD2 4.13Å; P291-Y379 HydrophobicContact CG-CE1 4.05Å; P291-Y379 HydrophobicContact CG-CE2 3.88Å; P291-Y379 HydrophobicContact CG-CG 4.32Å; P291-Y379 WeakPolarHBondContact CG-O 3.38Å; R375-Y379 VanDerWaalsContact O-CB 3.25Å; R375-Y379 WeakPolarHBondContact O-CB 3.36Å; R375-Y379 PolarHBondContact O-N 3.16Å; Q376-Y379 WeakPolarHBondContact O-CB 3.45Å; Q376-Y379 PolarHBondContact O-N 3.47Å; Y379-G381 PolarHBondContact O-N 3.02Å; Y379-Y778 PolarHBondContact O-OH 3.38Å
380	F	92	Very high	96.1	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.036	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-2.1	175.9	-56.9	-18.4	0	0	0	114.2	E275 P291 T293 H294 V295 Q376 L377 T378 A1137 F1141	E275-F380 HydrophobicContact CG-CE1 4.24Å; E275-F380 WeakPolarHBondContact O-CE1 3.32Å; E275-F380 VanDerWaalsContact O-CZ 3.28Å; E275-F380 WeakPolarHBondContact O-CZ 3.44Å; P291-F380 HydrophobicContact CB-CD1 4.48Å; P291-F380 HydrophobicContact CG-CD1 4.49Å; T293-F380 HydrophobicContact CG2-CE1 4.39Å; T293-F380 HydrophobicContact CG2-CZ 4.48Å; T293-F380 WeakPolarHBondContact OG1-CD1 3.47Å; T293-F380 VanDerWaalsContact OG1-CE1 3.26Å; T293-F380 WeakPolarHBondContact OG1-CE1 3.34Å; T293-F380 WeakPolarHBondContact OG1-CG 3.33Å; H294-F380 WeakPolarHBondContact CA-O 3.45Å; H294-F380 PolarHBondContact CD2-O 3.49Å; V295-F380 PolarHBondContact N-O 3.39Å; Q376-F380 HydrophobicContact CG-CE1 3.99Å; Q376-F380 HydrophobicContact CG-CE2 4.06Å; Q376-F380 HydrophobicContact CG-CZ 3.64Å; Q376-F380 WeakPolarHBondContact O-CD1 3.38Å; Q376-F380 WeakPolarHBondContact O-CG 3.5Å; Q376-F380 PolarHBondContact O-N 3.41Å; L377-F380 CarbonylContact O-C 3.49Å; L377-F380 PolarHBondContact O-N 2.82Å; T378-F380 VanDerWaalsContact C-N 3.34Å; F380-A1137 HydrophobicContact CD2-CB 3.86Å; F380-A1137 HydrophobicContact CE2-CB 3.79Å; F380-F1141 HydrophobicContact CB-CD1 4Å; F380-F1141 HydrophobicContact CB-CE1 3.33Å; F380-F1141 HydrophobicContact CB-CZ 4Å; F380-F1141 HydrophobicContact CD2-CE1 4.36Å; F380-F1141 HydrophobicContact CD2-CZ 4.48Å; F380-F1141 HydrophobicContact CG-CE1 4.36Å
381	G	90.2	Very high	96	Very high	7 Å²	7	9.5 Å²	9.5	7%	0.072	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.8	1.3	173.4	0	0	0	0	0	116.1	T358 L377 T378 Y379	T358-G381 WeakPolarHBondContact CG2-O 3.43Å; L377-G381 PolarHBondContact O-N 2.84Å; T378-G381 PolarHBondContact O-N 3.44Å; T378-G381 VanDerWaalsContact O-N 3.14Å; Y379-G381 PolarHBondContact O-N 3.02Å
382	A	92.7	Very high	95.9	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.057	C	C	.	.			trans	-77.9	153.2	179.8	0	0	0	0	0	113.5	P359 F361 L377 G781 F1141	P359-A382 HydrophobicContact CG-CB 4.14Å; P359-A382 WeakPolarHBondContact O-CB 3.42Å; F361-A382 HydrophobicContact CD2-CB 3.79Å; F361-A382 HydrophobicContact CE2-CB 3.62Å; L377-A382 HydrophobicContact CB-CB 4.47Å; L377-A382 WeakPolarHBondContact O-CB 3.39Å; L377-A382 PolarHBondContact O-N 3.17Å; A382-G781 CarbonylContact O-C 3.25Å; A382-G781 WeakPolarHBondContact O-CA 3.31Å; A382-F1141 HydrophobicContact CB-CE1 4.18Å; A382-F1141 HydrophobicContact CB-CZ 3.62Å
383	K	95	Very high	95.9	Very high	84 Å²	84	12.3 Å²	12.3	37%	0.365	6%	0.062	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	131.8	167.1	175.6	-174.2	166.3	-153.4	0	108.2	P359 H360 F361 S782	P359-K383 PolarHBondContact O-N 2.87Å; H360-K383 WeakPolarHBondContact CA-O 3.23Å; H360-K383 HydrophobicContact CB-CB 4.13Å; H360-K383 HydrophobicContact CB-CD 3.95Å; H360-K383 HydrophobicContact CB-CG 4.29Å; H360-K383 VanDerWaalsContact CE1-CE 3.49Å; H360-K383 WeakPolarHBondContact CE1-CE 3.48Å; H360-K383 PolarHBondContact CE1-NZ 2.91Å; H360-K383 WeakPolarHBondContact ND1-CE 3.19Å; H360-K383 PolarHBondContact ND1-NZ 2.96Å; F361-K383 PolarHBondContact N-O 3.35Å; K383-S782 WeakPolarHBondContact CA-O 3.43Å
384	V	97.3	Very high	95.8	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	131.9	178.2	-174.3	0	0	0	0	110.8	F361 I363 A374 L377 T378 I386 S782 G783 H784	F361-V384 WeakPolarHBondContact O-CA 3.34Å; I363-V384 HydrophobicContact CD1-CG1 3.81Å; I363-V384 HydrophobicContact CG1-CG1 3.89Å; A374-V384 HydrophobicContact CB-CG1 3.78Å; L377-V384 HydrophobicContact CB-CG2 3.72Å; T378-V384 HydrophobicContact CG2-CB 4Å; T378-V384 HydrophobicContact CG2-CG2 3.77Å; V384-I386 HydrophobicContact CG1-CG1 4.37Å; V384-S782 PolarHBondContact N-O 3.24Å; V384-G783 WeakPolarHBondContact O-CA 3.48Å; V384-H784 PolarHBondContact O-N 3.27Å
385	T	98	Very high	95.8	Very high	11 Å²	11	12.8 Å²	12.8	7%	0.067	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	109.7	172.2	-56	0	0	0	0	109	H360 F361 I362 I363 L387 Y818	H360-T385 PolarHBondContact NE2-OG1 3.17Å; F361-T385 PolarHBondContact O-N 3.35Å; I362-T385 CarbonylContact C-O 3.4Å; I362-T385 WeakPolarHBondContact CA-O 3.5Å; I363-T385 PolarHBondContact N-O 3.27Å; T385-L387 HydrophobicContact CG2-CD2 4.16Å; T385-Y818 HydrophobicContact CG2-CD1 4.12Å; T385-Y818 HydrophobicContact CG2-CE1 4.2Å
386	I	98.6	Very high	95.9	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	131	170.7	-42.1	-173.5	0	0	0	109	I363 G365 A366 L371 A374 V384 H784 I785 E786	I363-I386 HydrophobicContact CB-CG1 4.37Å; I363-I386 HydrophobicContact CB-CG2 4.36Å; I363-I386 HydrophobicContact CG2-CG2 4.39Å; I363-I386 CarbonylContact O-C 3.49Å; I363-I386 VanDerWaalsContact O-CA 3.3Å; I363-I386 WeakPolarHBondContact O-CA 3.24Å; G365-I386 WeakPolarHBondContact O-CG2 3.41Å; A366-I386 HydrophobicContact CB-CG2 3.92Å; L371-I386 HydrophobicContact CD2-CD1 4.07Å; A374-I386 HydrophobicContact CB-CD1 3.46Å; A374-I386 VanDerWaalsContact CB-CD1 3.46Å; A374-I386 HydrophobicContact CB-CG1 3.91Å; V384-I386 HydrophobicContact CG1-CG1 4.37Å; I386-H784 PolarHBondContact N-O 2.94Å; I386-I785 HydrophobicContact CB-CB 4.5Å; I386-I785 HydrophobicContact CB-CG1 4.2Å; I386-I785 HydrophobicContact CB-CG2 4.35Å; I386-I785 HydrophobicContact CD1-CD1 4.01Å; I386-I785 HydrophobicContact CD1-CG1 3.82Å; I386-I785 HydrophobicContact CG1-CG1 4.09Å; I386-E786 PolarHBondContact O-N 3.14Å
387	L	98.4	Very high	96	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.005	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	116.6	175.1	-60.5	170.4	0	0	0	108.7	I362 I363 G365 T385 E786 V791 V803 V805 Y818	I362-L387 HydrophobicContact CG2-CD1 3.64Å; I362-L387 HydrophobicContact CG2-CG 4.24Å; I363-L387 PolarHBondContact O-N 3.38Å; G365-L387 PolarHBondContact N-O 3.21Å; T385-L387 HydrophobicContact CG2-CD2 4.16Å; L387-E786 HydrophobicContact CD2-CB 4.34Å; L387-V791 HydrophobicContact CB-CG2 4.3Å; L387-V791 HydrophobicContact CD1-CG2 4.05Å; L387-V803 HydrophobicContact CD1-CG1 3.92Å; L387-V805 HydrophobicContact CD1-CG2 3.63Å; L387-V805 HydrophobicContact CD2-CG2 4.17Å; L387-V805 HydrophobicContact CG-CG2 4.48Å; L387-Y818 HydrophobicContact CD2-CD1 4.47Å; L387-Y818 HydrophobicContact CD2-CE1 4.22Å; L387-Y818 HydrophobicContact CD2-CE2 4.3Å
388	E	98.1	Very high	96	Very high	11 Å²	11	16.6 Å²	16.6	5%	0.051	8%	0.082	C	C	.	.			trans	-124.9	127.3	-177.8	172.3	55.3	-110.1	0	0	110.2	A366 R390 R392 E786 L787 K788 S789	A366-E388 HydrophobicContact CB-CB 3.76Å; A366-E388 HydrophobicContact CB-CG 3.93Å; A366-E388 PolarHBondContact N-OE2 2.97Å; E388-R390 HydrophobicContact CG-CB 4.24Å; E388-R390 VanDerWaalsContact OE1-CB 3.31Å; E388-R390 WeakPolarHBondContact OE1-CB 3.4Å; E388-R390 VanDerWaalsContact OE1-CG 3.28Å; E388-R390 WeakPolarHBondContact OE1-CG 3.26Å; E388-R390 PolarHBondContact OE1-N 3.43Å; E388-R392 WeakPolarHBondContact CG-O 3.43Å; E388-E786 PolarHBondContact N-O 3.4Å; E388-L787 HydrophobicContact CB-CD2 4.02Å; E388-L787 HydrophobicContact CG-CD2 3.86Å; E388-L787 CarbonylContact O-C 3.54Å; E388-L787 VanDerWaalsContact O-C 3.29Å; E388-L787 WeakPolarHBondContact O-CA 3.42Å; E388-K788 PolarHBondContact O-N 2.92Å; E388-S789 CarbonylContact C-O 3.52Å; E388-S789 PolarHBondContact O-N 2.87Å
389	S	96.9	Very high	96.1	Very high	21 Å²	21	17.2 Å²	17.2	15%	0.147	9%	0.086	C	C	.	.	S	Bend	trans	-80.7	-22.4	-173.7	-48.6	0	0	0	0	113	S789 T790 Y1048	S389-S789 VanDerWaalsContact CA-O 3.25Å; S389-S789 WeakPolarHBondContact CA-O 3.5Å; S389-S789 PolarHBondContact N-O 3Å; S389-S789 PolarHBondContact OG-O 3.33Å; S389-T790 WeakPolarHBondContact OG-CA 3.44Å; S389-Y1048 VanDerWaalsContact CB-CD1 3.44Å; S389-Y1048 VanDerWaalsContact CB-CE1 3.47Å
390	R	95.7	Very high	96	Very high	8 Å²	8	17.7 Å²	17.7	3%	0.03	9%	0.089	C	C	.	.	S	Bend	trans	-77.3	166.7	173.4	-59.5	171	-169.6	-93.1	7.7	111.5	E388 R392 K788 D1046 Y1048	E388-R390 HydrophobicContact CG-CB 4.24Å; E388-R390 VanDerWaalsContact OE1-CB 3.31Å; E388-R390 WeakPolarHBondContact OE1-CB 3.4Å; E388-R390 VanDerWaalsContact OE1-CG 3.28Å; E388-R390 WeakPolarHBondContact OE1-CG 3.26Å; E388-R390 PolarHBondContact OE1-N 3.43Å; R390-R392 HydrophobicContact CB-CG 4.2Å; R390-R392 PolarHBondContact O-N 3.08Å; R390-K788 PolarHBondContact O-N 2.95Å; R390-D1046 IonicContact CZ-OD1 3.8Å; R390-D1046 IonicContact CZ-OD2 2.73Å; R390-D1046 IonicContact NH1-OD1 3.24Å; R390-D1046 IonicContact NH1-OD2 3.8Å; R390-D1046 PolarHBondContact NH1-OD2 3.45Å; R390-D1046 IonicContact NH2-OD1 3.72Å; R390-D1046 IonicContact NH2-OD2 3.47Å; R390-D1046 PolarHBondContact NH2-OD2 3.03Å; R390-Y1048 HydrophobicContact CG-CD2 3.79Å; R390-Y1048 HydrophobicContact CG-CE2 4.44Å; R390-Y1048 HydrophobicContact CG-CG 4.03Å; R390-Y1048 PolarHBondContact NH2-O 3.37Å
391	D	95.4	Very high	96	Very high	53 Å²	53	23.2 Å²	23.2	28%	0.283	11%	0.11	S	C	.	.	S	Bend	trans	-85.7	13.1	171.3	60.1	-8.7	0	0	0	113.4	K788 T972	D391-K788 HydrophobicContact CB-CD 4.47Å; D391-K788 HydrophobicContact CB-CG 4.09Å; D391-T972 WeakPolarHBondContact OD1-CG2 3.17Å; D391-T972 WeakPolarHBondContact OD2-CG2 3.35Å; D391-T972 PolarHBondContact OD2-OG1 2.72Å
392	R	96.5	Very high	95.8	Very high	40 Å²	40	27.2 Å²	27.2	15%	0.151	13%	0.125	C	C	.	.	S	Bend	trans	-151.3	159.7	-177.4	60.8	168.4	-174	82.3	-1.8	111.1	E388 R390 G395 I397 W398	E388-R392 WeakPolarHBondContact CG-O 3.43Å; R390-R392 HydrophobicContact CB-CG 4.2Å; R390-R392 PolarHBondContact O-N 3.08Å; R392-G395 VanDerWaalsContact CZ-O 3.3Å; R392-G395 PolarHBondContact NH1-O 3.01Å; R392-G395 PolarHBondContact NH2-O 3.31Å; R392-I397 PolarHBondContact NH1-O 3.22Å; R392-W398 VanDerWaalsContact NE-CE2 3.33Å; R392-W398 VanDerWaalsContact NH2-CE3 3.27Å
393	V	97.9	Very high	95.5	Very high	18 Å²	18	31.2 Å²	31.2	11%	0.109	17%	0.167	C	C	.	.	S	Bend	trans	-82.6	-176.3	169.1	-58.8	0	0	0	0	111.9	A366 L371 G395 A743 I785 L787	A366-V393 HydrophobicContact CB-CB 4.12Å; A366-V393 HydrophobicContact CB-CG1 3.89Å; L371-V393 HydrophobicContact CD1-CB 4.42Å; V393-G395 VanDerWaalsContact C-N 3.3Å; V393-G395 PolarHBondContact O-N 3.26Å; V393-A743 HydrophobicContact CB-CB 4.41Å; V393-A743 HydrophobicContact CG1-CB 3.89Å; V393-A743 HydrophobicContact CG2-CB 4.06Å; V393-I785 HydrophobicContact CG1-CG2 4.22Å; V393-L787 HydrophobicContact CG1-CD2 4.09Å
394	G	97.2	Very high	95.2	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.01	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	87.6	-23.8	171.7	0	0	0	0	0	115.1	A366 R396 I397	A366-G394 PolarHBondContact O-N 2.95Å; G394-R396 PolarHBondContact O-N 3.4Å; G394-I397 CarbonylContact C-O 3.58Å; G394-I397 PolarHBondContact O-N 2.9Å
395	G	97.1	Very high	94.9	Very high	9 Å²	9	32.6 Å²	32.6	9%	0.093	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	-107.3	177.5	0	0	0	0	0	111.9	R392 V393 I397	R392-G395 VanDerWaalsContact CZ-O 3.3Å; R392-G395 PolarHBondContact NH1-O 3.01Å; R392-G395 PolarHBondContact NH2-O 3.31Å; V393-G395 VanDerWaalsContact C-N 3.3Å; V393-G395 PolarHBondContact O-N 3.26Å; G395-I397 VanDerWaalsContact C-N 3.34Å
396	R	97.9	Very high	94.6	Very high	48 Å²	48	33.2 Å²	33.2	18%	0.181	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-2.6	176.1	-74.2	178	-83.8	161.7	0.1	114.7	G394 G410 A411 W1043 S1049 S1052 E1112	G394-R396 PolarHBondContact O-N 3.4Å; R396-G410 VanDerWaalsContact O-CA 3.24Å; R396-G410 WeakPolarHBondContact O-CA 3.21Å; R396-A411 PolarHBondContact O-N 3.24Å; R396-A411 VanDerWaalsContact O-N 3.09Å; R396-W1043 HydrophobicContact CG-CE3 4.31Å; R396-W1043 HydrophobicContact CG-CH2 4.29Å; R396-W1043 HydrophobicContact CG-CZ3 3.83Å; R396-S1049 WeakPolarHBondContact CD-OG 3.43Å; R396-S1052 WeakPolarHBondContact CD-O 3.4Å; R396-S1052 PolarHBondContact NH1-O 3.15Å; R396-E1112 IonicContact CZ-OE1 3.73Å; R396-E1112 IonicContact CZ-OE2 3.73Å; R396-E1112 IonicContact NH1-OE1 3.62Å; R396-E1112 PolarHBondContact NH1-OE1 3.24Å; R396-E1112 IonicContact NH1-OE2 2.95Å; R396-E1112 PolarHBondContact NH1-OE2 3.4Å; R396-E1112 IonicContact NH2-OE1 3Å; R396-E1112 PolarHBondContact NH2-OE1 3.3Å; R396-E1112 IonicContact NH2-OE2 2.84Å
397	I	98.1	Very high	94.4	Very high	8 Å²	8	33.2 Å²	33.2	4%	0.041	19%	0.189	C	C	.	.			trans	-89.1	121.2	157.9	-52.6	-177.3	0	0	0	106.6	I368 R392 G394 G395 A411 Y735 T739 V1122	I368-I397 HydrophobicContact CB-CD1 3.95Å; I368-I397 HydrophobicContact CG2-CD1 4.25Å; R392-I397 PolarHBondContact NH1-O 3.22Å; G394-I397 CarbonylContact C-O 3.58Å; G394-I397 PolarHBondContact O-N 2.9Å; G395-I397 VanDerWaalsContact C-N 3.34Å; I397-A411 HydrophobicContact CG1-CB 4.42Å; I397-Y735 HydrophobicContact CG2-CD1 4.3Å; I397-Y735 HydrophobicContact CG2-CG 4.06Å; I397-T739 HydrophobicContact CB-CG2 4.47Å; I397-T739 HydrophobicContact CD1-CG2 3.89Å; I397-V1122 HydrophobicContact CD1-CB 4.45Å; I397-V1122 HydrophobicContact CD1-CG1 3.72Å; I397-V1122 HydrophobicContact CD1-CG2 3.87Å; I397-V1122 HydrophobicContact CG1-CG2 3.99Å
398	W	96.4	Very high	94.2	Very high	25 Å²	25	33.7 Å²	33.7	10%	0.095	19%	0.191	C	C	.	.			trans	-153.7	89.1	-175.3	-169.8	11.6	0	0	0	113.6	R392 C400 E408 L409 L975 L976 W1043	R392-W398 VanDerWaalsContact NE-CE2 3.33Å; R392-W398 VanDerWaalsContact NH2-CE3 3.27Å; W398-C400 PolarHBondContact O-N 3.25Å; W398-E408 VanDerWaalsContact C-OE2 3.26Å; W398-L409 HydrophobicContact CB-CB 4.33Å; W398-L409 HydrophobicContact CD2-CB 4.17Å; W398-L409 HydrophobicContact CD2-CD1 3.59Å; W398-L409 HydrophobicContact CD2-CG 4.49Å; W398-L409 HydrophobicContact CE3-CB 4.03Å; W398-L409 HydrophobicContact CE3-CD1 3.75Å; W398-L409 HydrophobicContact CG-CB 4.31Å; W398-L409 HydrophobicContact CG-CD1 4.15Å; W398-L409 HydrophobicContact CH2-CD1 4.16Å; W398-L409 HydrophobicContact CZ2-CD1 4.01Å; W398-L409 HydrophobicContact CZ3-CD1 4.02Å; W398-L409 WeakPolarHBondContact O-CB 3.28Å; W398-L409 PolarHBondContact O-N 2.98Å; W398-L975 HydrophobicContact CH2-CB 4.02Å; W398-L975 HydrophobicContact CH2-CD1 4.05Å; W398-L975 HydrophobicContact CZ3-CB 4.15Å; W398-L975 HydrophobicContact CZ3-CD1 3.85Å; W398-L975 HydrophobicContact CZ3-CD2 4.12Å; W398-L975 HydrophobicContact CZ3-CG 4.28Å; W398-L976 HydrophobicContact CH2-CD1 3.72Å; W398-L976 HydrophobicContact CH2-CD2 4.39Å; W398-L976 HydrophobicContact CH2-CG 3.83Å; W398-L976 HydrophobicContact CZ2-CD1 3.8Å; W398-L976 HydrophobicContact CZ2-CG 4.41Å; W398-W1043 HydrophobicContact CE3-CH2 4.05Å; W398-W1043 HydrophobicContact CE3-CZ2 4.25Å
399	T	95.6	Very high	94.1	Very high	16 Å²	16	33.2 Å²	33.2	10%	0.098	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	117.4	163.3	-44.7	0	0	0	0	109.2	R401 H406 A407 E408 Y735 G736	T399-R401 HydrophobicContact CG2-CG 4Å; T399-H406 HydrophobicContact CG2-CB 3.96Å; T399-A407 WeakPolarHBondContact CA-O 3.2Å; T399-E408 WeakPolarHBondContact CA-OE2 3.36Å; T399-E408 VanDerWaalsContact CB-OE1 3.3Å; T399-E408 WeakPolarHBondContact CB-OE1 3.47Å; T399-E408 WeakPolarHBondContact CG2-OE1 3.32Å; T399-E408 PolarHBondContact N-OE2 3.28Å; T399-E408 VanDerWaalsContact N-OE2 3.09Å; T399-E408 VanDerWaalsContact OG1-CD 3.28Å; T399-E408 PolarHBondContact OG1-OE1 2.92Å; T399-E408 PolarHBondContact OG1-OE2 2.94Å; T399-Y735 PolarHBondContact OG1-N 2.92Å; T399-G736 WeakPolarHBondContact OG1-CA 3.26Å; T399-G736 PolarHBondContact OG1-N 3.09Å
400	C	92.2	Very high	94.1	Very high	11 Å²	11	32.6 Å²	32.6	7%	0.074	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	144.4	161.7	73.5	0	0	0	0	109.6	W398 H406 A407 L409 Y1039	W398-C400 PolarHBondContact O-N 3.25Å; C400-H406 CarbonylContact O-C 3.58Å; C400-H406 WeakPolarHBondContact O-CA 3.32Å; C400-A407 PolarHBondContact N-O 2.78Å; C400-A407 PolarHBondContact O-N 3.49Å; C400-A407 PolarHBondContact SG-O 2.73Å; C400-L409 HydrophobicContact CB-CD1 3.72Å; C400-L409 HydrophobicContact CB-CG 4.1Å; C400-Y1039 HydrophobicContact CB-CE1 4.49Å
401	R	91.1	Very high	94.1	Very high	116 Å²	116	33.7 Å²	33.7	44%	0.438	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	134.8	-179.7	-56.5	-176.4	-170.2	-84.8	7.4	110	T399 Y405 H406 D733 S737	T399-R401 HydrophobicContact CG2-CG 4Å; R401-Y405 CarbonylContact C-O 3.25Å; R401-Y405 WeakPolarHBondContact CA-O 3.31Å; R401-H406 HydrophobicContact CG-CB 4.32Å; R401-D733 VanDerWaalsContact CZ-O 3.29Å; R401-D733 PolarHBondContact NH1-O 2.71Å; R401-D733 PolarHBondContact NH2-O 2.86Å; R401-S737 PolarHBondContact NH2-OG 2.99Å
402	K	85.4	Confident	94	Very high	90 Å²	90	31.7 Å²	31.7	39%	0.391	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	108.7	177.8	-174.6	-178.6	-178.9	-172.9	0	110.8	G404 Y405 D1037	K402-G404 PolarHBondContact O-N 2.67Å; K402-Y405 PolarHBondContact N-O 3.3Å; K402-Y405 WeakPolarHBondContact O-CB 3.35Å; K402-Y405 PolarHBondContact O-N 2.98Å; K402-D1037 HydrophobicContact CD-CB 4.43Å; K402-D1037 WeakPolarHBondContact CD-OD2 3.42Å; K402-D1037 WeakPolarHBondContact CE-OD2 3.48Å; K402-D1037 IonicContact NZ-OD1 3.72Å; K402-D1037 PolarHBondContact NZ-OD1 3.39Å; K402-D1037 IonicContact NZ-OD2 3.83Å; K402-D1037 PolarHBondContact NZ-OD2 2.84Å
403	G	86.7	Confident	93.9	Very high	84 Å²	84	30.8 Å²	30.8	87%	0.866	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.8	-127.9	-173.3	0	0	0	0	0	110.5	Y405	G403-Y405 VanDerWaalsContact C-N 3.31Å
404	G	88.9	Confident	93.7	Very high	55 Å²	55	30 Å²	30	57%	0.567	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-1.1	174	0	0	0	0	0	115.4	K402 K928	K402-G404 PolarHBondContact O-N 2.67Å; G404-K928 WeakPolarHBondContact O-CE 3.28Å
405	Y	91	Very high	93.4	Very high	59 Å²	59	31.4 Å²	31.4	23%	0.231	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	145.5	-176.8	-60.4	-90.1	0	0	0	112.2	R401 K402 G403 I893 F894 K928 P929 V930 I1036	R401-Y405 CarbonylContact C-O 3.25Å; R401-Y405 WeakPolarHBondContact CA-O 3.31Å; K402-Y405 PolarHBondContact N-O 3.3Å; K402-Y405 WeakPolarHBondContact O-CB 3.35Å; K402-Y405 PolarHBondContact O-N 2.98Å; G403-Y405 VanDerWaalsContact C-N 3.31Å; Y405-I893 HydrophobicContact CD1-CG2 3.38Å; Y405-I893 HydrophobicContact CD2-CG2 4.22Å; Y405-I893 HydrophobicContact CE1-CG2 3.65Å; Y405-I893 HydrophobicContact CE2-CG2 4.46Å; Y405-I893 HydrophobicContact CG-CG2 3.69Å; Y405-F894 PolarHBondContact OH-O 2.86Å; Y405-K928 HydrophobicContact CD1-CB 3.8Å; Y405-K928 HydrophobicContact CD1-CG 4.23Å; Y405-K928 HydrophobicContact CE1-CB 4.19Å; Y405-P929 HydrophobicContact CE1-CG 3.99Å; Y405-V930 HydrophobicContact CD1-CG2 4.07Å; Y405-I1036 HydrophobicContact CE2-CD1 3.83Å
406	H	91.9	Very high	93	Very high	23 Å²	23	31 Å²	31	11%	0.106	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	157.8	168.3	67.1	-96.9	0	0	0	110.2	T399 C400 R401 Q732 D927	T399-H406 HydrophobicContact CG2-CB 3.96Å; C400-H406 CarbonylContact O-C 3.58Å; C400-H406 WeakPolarHBondContact O-CA 3.32Å; R401-H406 HydrophobicContact CG-CB 4.32Å; H406-Q732 PolarHBondContact CE1-O 2.83Å; H406-Q732 VanDerWaalsContact CE1-O 3.27Å; H406-Q732 PolarHBondContact NE2-O 2.94Å; H406-D927 IonicContact CE1-OD1 3.41Å
407	A	93.2	Very high	92.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	150.6	171.3	0	0	0	0	0	111.3	T399 C400 V891 V930 I932	T399-A407 WeakPolarHBondContact CA-O 3.2Å; C400-A407 PolarHBondContact N-O 2.78Å; C400-A407 PolarHBondContact O-N 3.49Å; C400-A407 PolarHBondContact SG-O 2.73Å; A407-V891 HydrophobicContact CB-CB 4.44Å; A407-V891 HydrophobicContact CB-CG1 3.45Å; A407-V891 VanDerWaalsContact CB-CG1 3.45Å; A407-V891 HydrophobicContact CB-CG2 4.11Å; A407-V930 HydrophobicContact CB-CG1 4Å; A407-I932 HydrophobicContact CB-CD1 4.36Å
408	E	95.4	Very high	92	Very high	12 Å²	12	33.5 Å²	33.5	6%	0.056	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	118.1	178.8	-64.2	-54.3	146.4	0	0	112.6	W398 T399 M412 G734 Y735	W398-E408 VanDerWaalsContact C-OE2 3.26Å; T399-E408 WeakPolarHBondContact CA-OE2 3.36Å; T399-E408 VanDerWaalsContact CB-OE1 3.3Å; T399-E408 WeakPolarHBondContact CB-OE1 3.47Å; T399-E408 WeakPolarHBondContact CG2-OE1 3.32Å; T399-E408 PolarHBondContact N-OE2 3.28Å; T399-E408 VanDerWaalsContact N-OE2 3.09Å; T399-E408 VanDerWaalsContact OG1-CD 3.28Å; T399-E408 PolarHBondContact OG1-OE1 2.92Å; T399-E408 PolarHBondContact OG1-OE2 2.94Å; E408-M412 HydrophobicContact CB-CB 3.62Å; E408-M412 HydrophobicContact CG-CB 3.92Å; E408-G734 WeakPolarHBondContact OE1-CA 3.29Å; E408-Y735 PolarHBondContact OE1-N 2.95Å
409	L	95.7	Very high	91.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-88	-24.1	173.1	-60	173.8	0	0	0	112	W398 C400 V891 L976 Y1039 T1041 W1043	W398-L409 HydrophobicContact CB-CB 4.33Å; W398-L409 HydrophobicContact CD2-CB 4.17Å; W398-L409 HydrophobicContact CD2-CD1 3.59Å; W398-L409 HydrophobicContact CD2-CG 4.49Å; W398-L409 HydrophobicContact CE3-CB 4.03Å; W398-L409 HydrophobicContact CE3-CD1 3.75Å; W398-L409 HydrophobicContact CG-CB 4.31Å; W398-L409 HydrophobicContact CG-CD1 4.15Å; W398-L409 HydrophobicContact CH2-CD1 4.16Å; W398-L409 HydrophobicContact CZ2-CD1 4.01Å; W398-L409 HydrophobicContact CZ3-CD1 4.02Å; W398-L409 WeakPolarHBondContact O-CB 3.28Å; W398-L409 PolarHBondContact O-N 2.98Å; C400-L409 HydrophobicContact CB-CD1 3.72Å; C400-L409 HydrophobicContact CB-CG 4.1Å; L409-V891 HydrophobicContact CD2-CG2 3.74Å; L409-L976 HydrophobicContact CD1-CD1 4.33Å; L409-L976 HydrophobicContact CD1-CD2 3.86Å; L409-L976 HydrophobicContact CD2-CD2 4.34Å; L409-Y1039 HydrophobicContact CD2-CG 4.4Å; L409-T1041 HydrophobicContact CB-CG2 3.84Å; L409-T1041 HydrophobicContact CD2-CG2 3.87Å; L409-T1041 HydrophobicContact CG-CG2 4.4Å; L409-W1043 WeakPolarHBondContact O-CZ2 3.37Å; L409-W1043 PolarHBondContact O-NE1 3.14Å; L409-W1043 VanDerWaalsContact O-NE1 3.1Å
410	G	95.9	Very high	91.4	Very high	8 Å²	8	32.4 Å²	32.4	8%	0.082	20%	0.203	C	C	.	.	S	Bend	trans	-109.1	-136.9	-179.7	0	0	0	0	0	112.3	R396 K889	R396-G410 VanDerWaalsContact O-CA 3.24Å; R396-G410 WeakPolarHBondContact O-CA 3.21Å; G410-K889 PolarHBondContact O-NZ 3.21Å
411	A	95.7	Very high	91.6	Very high	31 Å²	31	32 Å²	32	26%	0.256	20%	0.2	S	C	.	.			trans	-53	138.9	169.9	0	0	0	0	0	111.5	R396 I397 Y735 V1122	R396-A411 PolarHBondContact O-N 3.24Å; R396-A411 VanDerWaalsContact O-N 3.09Å; I397-A411 HydrophobicContact CG1-CB 4.42Å; A411-Y735 HydrophobicContact CB-CD2 4.1Å; A411-Y735 HydrophobicContact CB-CE2 4.05Å; A411-Y735 WeakPolarHBondContact O-CD2 3.44Å; A411-V1122 HydrophobicContact CB-CG2 3.46Å; A411-V1122 VanDerWaalsContact CB-CG2 3.46Å
412	M	94.4	Very high	91.8	Very high	12 Å²	12	26.5 Å²	26.5	6%	0.059	18%	0.179	C	C	.	.			trans	-132.3	-15.3	-177	77	-168.1	-177.1	0	0	115.6	E408 K889 W923 I925	E408-M412 HydrophobicContact CB-CB 3.62Å; E408-M412 HydrophobicContact CG-CB 3.92Å; M412-K889 PolarHBondContact SD-NZ 3.18Å; M412-W923 HydrophobicContact CE-CD2 3.51Å; M412-W923 HydrophobicContact CE-CE3 3.66Å; M412-W923 HydrophobicContact CE-CG 4.1Å; M412-W923 HydrophobicContact CE-CH2 3.99Å; M412-W923 HydrophobicContact CE-CZ2 3.83Å; M412-W923 HydrophobicContact CE-CZ3 3.9Å; M412-I925 HydrophobicContact CB-CD1 4.25Å; M412-I925 HydrophobicContact CG-CD1 4.18Å; M412-I925 HydrophobicContact SD-CD1 4.05Å
413	V	94.3	Very high	92.2	Very high	21 Å²	21	23.3 Å²	23.3	13%	0.127	17%	0.167	C	C	.	.			trans	-122.8	146.2	-175.7	-166.5	0	0	0	0	111.8	M21 I436 H728 C729 Y735 W923	M21-V413 HydrophobicContact CE-CB 4.41Å; M21-V413 HydrophobicContact CE-CG1 4.04Å; M21-V413 HydrophobicContact CE-CG2 4.07Å; M21-V413 HydrophobicContact SD-CB 3.8Å; M21-V413 HydrophobicContact SD-CG1 3.46Å; M21-V413 WeakPolarHBondContact SD-CG1 3.39Å; M21-V413 HydrophobicContact SD-CG2 4.08Å; V413-I436 HydrophobicContact CB-CD1 4.33Å; V413-I436 HydrophobicContact CG1-CD1 3.46Å; V413-I436 VanDerWaalsContact CG1-CD1 3.46Å; V413-I436 HydrophobicContact CG2-CD1 3.89Å; V413-H728 HydrophobicContact CG1-CB 4.01Å; V413-C729 CarbonylContact C-O 3.57Å; V413-C729 WeakPolarHBondContact CG1-O 3.33Å; V413-Y735 VanDerWaalsContact O-CE2 3.29Å; V413-Y735 WeakPolarHBondContact O-CE2 3.5Å; V413-Y735 PolarHBondContact O-OH 3.27Å; V413-W923 HydrophobicContact CG2-CZ3 4.4Å
414	V	94.6	Very high	92.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	13%	0.13	C	C	.	.	B	Isolated β-bridge	trans	-95.9	102.7	162.2	-176.9	0	0	0	0	106.7	G416 L417 N420 V422 L433 C729 L731 Y735	V414-G416 PolarHBondContact O-N 3.09Å; V414-L417 HydrophobicContact CG1-CD2 4.24Å; V414-N420 WeakPolarHBondContact CG1-ND2 3.32Å; V414-V422 HydrophobicContact CG1-CB 4.42Å; V414-V422 HydrophobicContact CG1-CG1 4.49Å; V414-V422 HydrophobicContact CG2-CG1 4.02Å; V414-L433 HydrophobicContact CB-CD2 4.42Å; V414-L433 HydrophobicContact CG2-CD2 3.88Å; V414-C729 PolarHBondContact N-O 3.05Å; V414-C729 PolarHBondContact O-N 2.91Å; V414-L731 HydrophobicContact CG2-CD1 3.52Å; V414-Y735 HydrophobicContact CG2-CE1 4.4Å
415	T	90.6	Very high	92.9	Very high	31 Å²	31	17.6 Å²	17.6	19%	0.19	10%	0.103	C	C	.	.			trans	-71.5	109.8	174.4	47	0	0	0	0	109.6	M21 N420 H1123	M21-T415 HydrophobicContact CG-CG2 3.74Å; M21-T415 HydrophobicContact SD-CG2 3.67Å; T415-N420 PolarHBondContact O-ND2 2.89Å; T415-H1123 PolarHBondContact OG1-CE1 3.34Å; T415-H1123 PolarHBondContact OG1-ND1 3.28Å
416	G	87.9	Confident	93.1	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	10%	0.095	C	C	.	.			trans	74.5	140.6	-177.9	0	0	0	0	0	114.3	V414 N420 L724 G726	V414-G416 PolarHBondContact O-N 3.09Å; G416-N420 VanDerWaalsContact O-CB 3.27Å; G416-N420 WeakPolarHBondContact O-CB 3.5Å; G416-N420 PolarHBondContact O-ND2 3.07Å; G416-L724 WeakPolarHBondContact CA-O 3.32Å; G416-G726 WeakPolarHBondContact CA-O 3.2Å
417	L	88.3	Confident	93.2	Very high	60 Å²	60	19.5 Å²	19.5	31%	0.314	11%	0.11	S	C	.	.	S	Bend	trans	-101.9	-28.3	170.8	-58.7	-172	0	0	0	112.6	V414 T423 L433 S725 D727 C729	V414-L417 HydrophobicContact CG1-CD2 4.24Å; L417-T423 HydrophobicContact CB-CG2 4.26Å; L417-T423 HydrophobicContact CD2-CG2 3.84Å; L417-L433 HydrophobicContact CD2-CD1 3.86Å; L417-S725 PolarHBondContact N-O 2.95Å; L417-S725 VanDerWaalsContact N-O 3.12Å; L417-D727 WeakPolarHBondContact CG-O 3.48Å; L417-C729 HydrophobicContact CD2-CB 4.18Å
418	S	86.1	Confident	93.3	Very high	49 Å²	49	20 Å²	20	34%	0.343	11%	0.112	S	C	.	.	S	Bend	trans	-69.6	139.9	174.1	-163.4	0	0	0	0	110.5	N420 S725	S418-N420 PolarHBondContact O-N 3.09Å; S418-S725 WeakPolarHBondContact CB-O 3.39Å; S418-S725 VanDerWaalsContact CB-OG 3.27Å; S418-S725 WeakPolarHBondContact CB-OG 3.44Å; S418-S725 PolarHBondContact N-O 3.4Å
419	A	87.4	Confident	93.3	Very high	17 Å²	17	20.3 Å²	20.3	14%	0.14	11%	0.114	C	C	.	.	S	Bend	trans	51.7	-3.8	-177.3	0	0	0	0	0	118	I125 R127 P421 L724	I125-A419 WeakPolarHBondContact O-CA 3.45Å; R127-A419 HydrophobicContact CG-CB 4.41Å; R127-A419 PolarHBondContact NH1-O 2.57Å; A419-P421 WeakPolarHBondContact O-CD 3.42Å; A419-L724 HydrophobicContact CB-CD2 4.17Å
420	N	93.5	Very high	93.2	Very high	2 Å²	2	24 Å²	24	1%	0.011	14%	0.14	C	C	.	.			trans	-77.2	115.7	-174.2	-172.8	-31.2	0	0	0	111.6	V414 T415 G416 S418 V422 T423 L724	V414-N420 WeakPolarHBondContact CG1-ND2 3.32Å; T415-N420 PolarHBondContact O-ND2 2.89Å; G416-N420 VanDerWaalsContact O-CB 3.27Å; G416-N420 WeakPolarHBondContact O-CB 3.5Å; G416-N420 PolarHBondContact O-ND2 3.07Å; S418-N420 PolarHBondContact O-N 3.09Å; N420-V422 PolarHBondContact O-N 2.81Å; N420-V422 VanDerWaalsContact O-N 3.14Å; N420-V422 WeakPolarHBondContact OD1-CB 3.16Å; N420-V422 WeakPolarHBondContact OD1-CG2 3.43Å; N420-V422 PolarHBondContact OD1-N 3.47Å; N420-T423 HydrophobicContact CB-CG2 4.22Å; N420-T423 PolarHBondContact O-N 3.37Å; N420-T423 VanDerWaalsContact O-N 3.09Å; N420-T423 PolarHBondContact O-OG1 3.23Å; N420-L724 HydrophobicContact CB-CD1 3.74Å
421	P	94.7	Very high	93.1	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.013	14%	0.143	C	C	.	.	H	α-helix	trans	-66.5	-16	-176	28.4	-37	0	0	0	114.2	F282 A419 T423 I424 L425 H1123 L1126 L1127	F282-P421 HydrophobicContact CE2-CB 4.19Å; F282-P421 HydrophobicContact CZ-CB 4.02Å; A419-P421 WeakPolarHBondContact O-CD 3.42Å; P421-T423 VanDerWaalsContact C-N 3.27Å; P421-T423 PolarHBondContact O-N 2.91Å; P421-I424 WeakPolarHBondContact O-CB 3.45Å; P421-I424 PolarHBondContact O-N 3.1Å; P421-L425 PolarHBondContact O-N 3.18Å; P421-H1123 HydrophobicContact CG-CB 4.14Å; P421-L1126 HydrophobicContact CB-CD1 4.23Å; P421-L1126 HydrophobicContact CB-CD2 3.97Å; P421-L1126 HydrophobicContact CG-CD1 4.29Å; P421-L1126 HydrophobicContact CG-CD2 4.09Å; P421-L1127 HydrophobicContact CG-CD1 4.45Å; P421-L1127 HydrophobicContact CG-CD2 4.04Å; P421-L1127 HydrophobicContact CG-CG 4.05Å
422	V	95.6	Very high	93.1	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-65.8	-32.9	173.8	179.6	0	0	0	0	110.8	V414 N420 I424 L425 V426 Y735 V1122 H1123 L1126	V414-V422 HydrophobicContact CG1-CB 4.42Å; V414-V422 HydrophobicContact CG1-CG1 4.49Å; V414-V422 HydrophobicContact CG2-CG1 4.02Å; N420-V422 PolarHBondContact O-N 2.81Å; N420-V422 VanDerWaalsContact O-N 3.14Å; N420-V422 WeakPolarHBondContact OD1-CB 3.16Å; N420-V422 WeakPolarHBondContact OD1-CG2 3.43Å; N420-V422 PolarHBondContact OD1-N 3.47Å; V422-I424 VanDerWaalsContact C-N 3.25Å; V422-I424 PolarHBondContact O-N 2.91Å; V422-L425 PolarHBondContact O-N 2.98Å; V422-L425 VanDerWaalsContact O-N 3.14Å; V422-V426 HydrophobicContact CG1-CG2 4.31Å; V422-V426 WeakPolarHBondContact O-CG2 3.49Å; V422-V426 PolarHBondContact O-N 3.16Å; V422-Y735 HydrophobicContact CG1-CE1 4.03Å; V422-V1122 HydrophobicContact CG2-CG1 3.97Å; V422-H1123 HydrophobicContact CG2-CB 4.02Å; V422-L1126 HydrophobicContact CG2-CD1 4.16Å
423	T	94.1	Very high	93	Very high	23 Å²	23	29.2 Å²	29.2	14%	0.141	16%	0.162	C	C	.	.	H	α-helix	trans	-64	-31.4	177.8	68	0	0	0	0	112.6	L417 N420 P421 V426 R427	L417-T423 HydrophobicContact CB-CG2 4.26Å; L417-T423 HydrophobicContact CD2-CG2 3.84Å; N420-T423 HydrophobicContact CB-CG2 4.22Å; N420-T423 PolarHBondContact O-N 3.37Å; N420-T423 VanDerWaalsContact O-N 3.09Å; N420-T423 PolarHBondContact O-OG1 3.23Å; P421-T423 VanDerWaalsContact C-N 3.27Å; P421-T423 PolarHBondContact O-N 2.91Å; T423-V426 PolarHBondContact O-N 3.19Å; T423-R427 WeakPolarHBondContact O-CB 3.39Å; T423-R427 PolarHBondContact O-N 3.02Å
424	I	95.1	Very high	92.9	Very high	16 Å²	16	31.3 Å²	31.3	8%	0.082	17%	0.172	C	C	.	.	H	α-helix	trans	-66.1	-44.7	174.1	-60.7	-60.3	0	0	0	110.4	W166 F282 P421 V422 R427 Q428	W166-I424 HydrophobicContact CZ2-CG2 4.03Å; F282-I424 HydrophobicContact CE1-CG2 4.27Å; F282-I424 HydrophobicContact CE2-CB 4.05Å; F282-I424 HydrophobicContact CE2-CG2 3.89Å; F282-I424 HydrophobicContact CZ-CB 3.72Å; F282-I424 HydrophobicContact CZ-CG1 3.92Å; F282-I424 HydrophobicContact CZ-CG2 3.65Å; P421-I424 WeakPolarHBondContact O-CB 3.45Å; P421-I424 PolarHBondContact O-N 3.1Å; V422-I424 VanDerWaalsContact C-N 3.25Å; V422-I424 PolarHBondContact O-N 2.91Å; I424-R427 PolarHBondContact O-N 3.05Å; I424-Q428 HydrophobicContact CG2-CG 4.47Å; I424-Q428 VanDerWaalsContact O-CB 3.31Å; I424-Q428 WeakPolarHBondContact O-CB 3.49Å; I424-Q428 VanDerWaalsContact O-CG 3.22Å; I424-Q428 WeakPolarHBondContact O-CG 3.42Å; I424-Q428 PolarHBondContact O-N 3.41Å
425	L	95.7	Very high	92.8	Very high	2 Å²	2	35 Å²	35	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-64.8	-41.3	175.5	-60.6	-174.9	0	0	0	112.1	F282 I368 I372 P421 V422 Q428 L429 V738 L742 L1126	F282-L425 HydrophobicContact CD2-CD2 4.37Å; F282-L425 HydrophobicContact CE2-CD2 4.35Å; I368-L425 HydrophobicContact CD1-CD1 4.41Å; I372-L425 HydrophobicContact CD1-CD2 4.43Å; P421-L425 PolarHBondContact O-N 3.18Å; V422-L425 PolarHBondContact O-N 2.98Å; V422-L425 VanDerWaalsContact O-N 3.14Å; L425-Q428 PolarHBondContact O-N 3.3Å; L425-L429 WeakPolarHBondContact O-CB 3.48Å; L425-L429 WeakPolarHBondContact O-CG 3.45Å; L425-L429 PolarHBondContact O-N 3.35Å; L425-V738 HydrophobicContact CB-CG1 4.11Å; L425-V738 HydrophobicContact CD1-CG1 3.65Å; L425-L742 HydrophobicContact CD1-CD1 4.13Å; L425-L1126 HydrophobicContact CD1-CD1 3.57Å; L425-L1126 HydrophobicContact CG-CD1 4.29Å
426	V	94.8	Very high	92.8	Very high	9 Å²	9	34.4 Å²	34.4	6%	0.055	19%	0.192	C	C	.	.	H	α-helix	trans	-57.9	-48.4	174.4	164.7	0	0	0	0	110.8	V422 T423 L429 S430 L431 L433 L731	V422-V426 HydrophobicContact CG1-CG2 4.31Å; V422-V426 WeakPolarHBondContact O-CG2 3.49Å; V422-V426 PolarHBondContact O-N 3.16Å; T423-V426 PolarHBondContact O-N 3.19Å; V426-L429 CarbonylContact O-C 3.39Å; V426-L429 PolarHBondContact O-N 2.91Å; V426-S430 PolarHBondContact O-N 3.09Å; V426-L431 HydrophobicContact CG1-CB 4.19Å; V426-L431 VanDerWaalsContact CG1-O 3.22Å; V426-L431 WeakPolarHBondContact CG1-O 3.31Å; V426-L431 PolarHBondContact O-N 3.32Å; V426-L433 HydrophobicContact CB-CD1 4.45Å; V426-L433 HydrophobicContact CG1-CD1 3.87Å; V426-L433 HydrophobicContact CG1-CG 3.87Å; V426-L433 HydrophobicContact CG2-CD1 4.36Å; V426-L433 HydrophobicContact CG2-CD2 4.4Å; V426-L433 HydrophobicContact CG2-CG 4.37Å; V426-L731 HydrophobicContact CG2-CD2 3.99Å; V426-L731 HydrophobicContact CG2-CG 4.37Å
427	R	94.1	Very high	92.9	Very high	114 Å²	114	37.5 Å²	37.5	43%	0.43	21%	0.208	S	C	.	.	H	α-helix	trans	-63.7	-46.2	178.9	-169.3	-170.7	-60.2	173.6	-1.7	111.9	S167 T423 I424 L429 S430	S167-R427 PolarHBondContact O-NH1 2.87Å; T423-R427 WeakPolarHBondContact O-CB 3.39Å; T423-R427 PolarHBondContact O-N 3.02Å; I424-R427 PolarHBondContact O-N 3.05Å; R427-L429 VanDerWaalsContact C-N 3.25Å; R427-L429 PolarHBondContact O-N 3.02Å; R427-S430 PolarHBondContact O-N 3.01Å; R427-S430 VanDerWaalsContact O-N 3.11Å
428	Q	95.4	Very high	92.8	Very high	9 Å²	9	37.7 Å²	37.7	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-57	-37.1	175.5	-80.8	174.4	-9.9	0	0	112.9	S170 F282 I284 I424 L425	S170-Q428 WeakPolarHBondContact O-CG 3.17Å; S170-Q428 PolarHBondContact O-NE2 2.92Å; F282-Q428 PolarHBondContact O-NE2 2.91Å; I284-Q428 HydrophobicContact CB-CB 4.47Å; I284-Q428 VanDerWaalsContact O-CB 3.24Å; I284-Q428 WeakPolarHBondContact O-CB 3.5Å; I284-Q428 VanDerWaalsContact O-CD 3.25Å; I284-Q428 WeakPolarHBondContact O-CG 3.47Å; I424-Q428 HydrophobicContact CG2-CG 4.47Å; I424-Q428 VanDerWaalsContact O-CB 3.31Å; I424-Q428 WeakPolarHBondContact O-CB 3.49Å; I424-Q428 VanDerWaalsContact O-CG 3.22Å; I424-Q428 WeakPolarHBondContact O-CG 3.42Å; I424-Q428 PolarHBondContact O-N 3.41Å; L425-Q428 PolarHBondContact O-N 3.3Å
429	L	94.6	Very high	92.9	Very high	19 Å²	19	37.6 Å²	37.6	10%	0.099	21%	0.207	C	C	.	.	H	α-helix	trans	-89	-7.2	178.5	-68.6	174.1	0	0	0	114.3	I284 L425 V426 R427 L431 N741	I284-L429 HydrophobicContact CD1-CD1 4.46Å; I284-L429 HydrophobicContact CD1-CD2 3.69Å; I284-L429 HydrophobicContact CD1-CG 4.3Å; I284-L429 HydrophobicContact CG2-CD2 4.25Å; L425-L429 WeakPolarHBondContact O-CB 3.48Å; L425-L429 WeakPolarHBondContact O-CG 3.45Å; L425-L429 PolarHBondContact O-N 3.35Å; V426-L429 CarbonylContact O-C 3.39Å; V426-L429 PolarHBondContact O-N 2.91Å; R427-L429 VanDerWaalsContact C-N 3.25Å; R427-L429 PolarHBondContact O-N 3.02Å; L429-L431 VanDerWaalsContact C-N 3.26Å; L429-L431 HydrophobicContact CB-CD1 3.9Å; L429-L431 HydrophobicContact CB-CG 3.74Å; L429-L431 HydrophobicContact CD1-CD1 3.87Å; L429-L431 PolarHBondContact O-N 2.72Å; L429-N741 HydrophobicContact CD1-CB 3.85Å; L429-N741 HydrophobicContact CD2-CB 3.57Å; L429-N741 HydrophobicContact CG-CB 4.39Å
430	S	94.5	Very high	93.2	Very high	78 Å²	78	37.5 Å²	37.5	55%	0.545	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	41.9	-171	-58.8	0	0	0	0	113.2	V426 R427	V426-S430 PolarHBondContact O-N 3.09Å; R427-S430 PolarHBondContact O-N 3.01Å; R427-S430 VanDerWaalsContact O-N 3.11Å
431	L	94.6	Very high	93.2	Very high	27 Å²	27	38.9 Å²	38.9	14%	0.141	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-84.8	150.4	173.3	-63.7	173.2	0	0	0	110.6	V426 L429 L731 D733 V738	V426-L431 HydrophobicContact CG1-CB 4.19Å; V426-L431 VanDerWaalsContact CG1-O 3.22Å; V426-L431 WeakPolarHBondContact CG1-O 3.31Å; V426-L431 PolarHBondContact O-N 3.32Å; L429-L431 VanDerWaalsContact C-N 3.26Å; L429-L431 HydrophobicContact CB-CD1 3.9Å; L429-L431 HydrophobicContact CB-CG 3.74Å; L429-L431 HydrophobicContact CD1-CD1 3.87Å; L429-L431 PolarHBondContact O-N 2.72Å; L431-L731 HydrophobicContact CD1-CD2 4.02Å; L431-D733 HydrophobicContact CD2-CB 4.37Å; L431-V738 HydrophobicContact CD1-CG2 3.98Å
432	N	94.1	Very high	93.3	Very high	89 Å²	89	38.9 Å²	38.9	48%	0.476	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-91	130.1	177.9	-66.6	-21.3	0	0	0	111.5	L731 Q732	N432-L731 WeakPolarHBondContact O-CA 3.25Å; N432-Q732 HydrophobicContact CB-CB 3.94Å; N432-Q732 PolarHBondContact ND2-OE1 3.05Å; N432-Q732 PolarHBondContact O-N 2.8Å
433	L	93.6	Very high	93.4	Very high	45 Å²	45	40.9 Å²	40.9	24%	0.236	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	143.5	163.4	-72.7	166.8	0	0	0	109.7	V414 L417 V426 C729 V730 L731	V414-L433 HydrophobicContact CB-CD2 4.42Å; V414-L433 HydrophobicContact CG2-CD2 3.88Å; L417-L433 HydrophobicContact CD2-CD1 3.86Å; V426-L433 HydrophobicContact CB-CD1 4.45Å; V426-L433 HydrophobicContact CG1-CD1 3.87Å; V426-L433 HydrophobicContact CG1-CG 3.87Å; V426-L433 HydrophobicContact CG2-CD1 4.36Å; V426-L433 HydrophobicContact CG2-CD2 4.4Å; V426-L433 HydrophobicContact CG2-CG 4.37Å; L433-C729 HydrophobicContact CB-CB 4.06Å; L433-C729 HydrophobicContact CD2-CB 3.92Å; L433-C729 HydrophobicContact CG-CB 4.41Å; L433-V730 CarbonylContact C-O 3.57Å; L433-V730 WeakPolarHBondContact CA-O 3.37Å; L433-L731 HydrophobicContact CD2-CD1 3.73Å; L433-L731 HydrophobicContact CD2-CG 3.84Å
434	L	92.4	Very high	93.5	Very high	65 Å²	65	41.9 Å²	41.9	34%	0.34	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	126.5	173.1	-58.2	175.2	0	0	0	108.3	C729 V730 Q732	L434-C729 CarbonylContact O-C 3.3Å; L434-C729 VanDerWaalsContact O-CA 3.23Å; L434-C729 WeakPolarHBondContact O-CA 3.39Å; L434-C729 WeakPolarHBondContact O-CB 3.19Å; L434-V730 HydrophobicContact CB-CG2 4.02Å; L434-V730 PolarHBondContact N-O 2.89Å; L434-V730 PolarHBondContact O-N 3.03Å; L434-Q732 HydrophobicContact CD1-CB 4.01Å; L434-Q732 HydrophobicContact CD1-CG 4.02Å; L434-Q732 HydrophobicContact CG-CB 4.25Å
435	P	92.6	Very high	93.4	Very high	76 Å²	76	43.1 Å²	43.1	49%	0.494	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	150	175.2	29.9	-35.2	0	0	0	110.9	D727 C729	P435-D727 HydrophobicContact CB-CB 4.06Å; P435-C729 VanDerWaalsContact CA-SG 3.56Å
436	I	90.1	Very high	93.3	Very high	20 Å²	20	48.2 Å²	48.2	10%	0.103	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-91.5	125.2	177.1	-62.7	158.7	0	0	0	108.7	V413 T438 H728 V730 N904 L905 W923	V413-I436 HydrophobicContact CB-CD1 4.33Å; V413-I436 HydrophobicContact CG1-CD1 3.46Å; V413-I436 VanDerWaalsContact CG1-CD1 3.46Å; V413-I436 HydrophobicContact CG2-CD1 3.89Å; I436-T438 PolarHBondContact O-N 3.1Å; I436-H728 HydrophobicContact CD1-CB 4.11Å; I436-H728 PolarHBondContact N-O 2.79Å; I436-V730 HydrophobicContact CD1-CG1 3.88Å; I436-V730 HydrophobicContact CG1-CG1 3.88Å; I436-N904 HydrophobicContact CG2-CB 4.21Å; I436-L905 HydrophobicContact CG2-CD2 4.28Å; I436-W923 HydrophobicContact CD1-CH2 4.41Å; I436-W923 HydrophobicContact CD1-CZ3 3.96Å; I436-W923 HydrophobicContact CG1-CZ3 4.44Å; I436-W923 HydrophobicContact CG2-CH2 4.42Å; I436-W923 HydrophobicContact CG2-CZ3 4.06Å
437	N	88.7	Confident	93.2	Very high	64 Å²	64	48.1 Å²	48.1	34%	0.342	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-70.1	117.7	162.4	-178.9	11.8	0	0	0	108.6	D439 S902 N904	N437-D439 VanDerWaalsContact C-N 3.33Å; N437-D439 WeakPolarHBondContact OD1-CB 3.48Å; N437-D439 PolarHBondContact OD1-N 2.94Å; N437-S902 PolarHBondContact ND2-O 3.3Å; N437-N904 HydrophobicContact CB-CB 4.48Å; N437-N904 WeakPolarHBondContact CB-OD1 3.49Å; N437-N904 PolarHBondContact N-OD1 3.05Å
438	T	86.9	Confident	93.3	Very high	65 Å²	65	47 Å²	47	40%	0.399	26%	0.262	S	S	.	.			trans	-80.2	-12.7	-176.5	54.1	0	0	0	0	113.8	S17 V18 I436 C440	S17-T438 VanDerWaalsContact OG-C 3.28Å; S17-T438 PolarHBondContact OG-O 2.8Å; S17-T438 VanDerWaalsContact OG-O 3.13Å; S17-T438 PolarHBondContact OG-OG1 2.85Å; V18-T438 WeakPolarHBondContact CB-O 2.99Å; V18-T438 WeakPolarHBondContact CG2-O 3.39Å; I436-T438 PolarHBondContact O-N 3.1Å; T438-C440 PolarHBondContact O-N 2.95Å
439	D	88.9	Confident	93.3	Very high	47 Å²	47	51.8 Å²	51.8	25%	0.251	29%	0.287	S	S	.	.			trans	-57.9	119.5	-177.7	-177.3	58.3	0	0	0	112	S17 N437 H903	S17-D439 PolarHBondContact OG-N 3.13Å; N437-D439 VanDerWaalsContact C-N 3.33Å; N437-D439 WeakPolarHBondContact OD1-CB 3.48Å; N437-D439 PolarHBondContact OD1-N 2.94Å; D439-H903 IonicContact OD2-CE1 2.83Å; D439-H903 PolarHBondContact OD2-CE1 2.88Å; D439-H903 IonicContact OD2-ND1 3.65Å; D439-H903 PolarHBondContact OD2-ND1 2.95Å
440	C	92.6	Very high	93.4	Very high	14 Å²	14	51.8 Å²	51.8	10%	0.095	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	130.3	-178.5	-167.1	0	0	0	0	110.5	V18 T438 L905 G907	V18-C440 HydrophobicContact CB-CB 4.3Å; V18-C440 HydrophobicContact CG1-CB 4.1Å; V18-C440 HydrophobicContact CG2-CB 3.25Å; T438-C440 PolarHBondContact O-N 2.95Å; C440-L905 HydrophobicContact CB-CD1 3.35Å; C440-G907 PolarHBondContact SG-N 3.13Å; C440-G907 VanDerWaalsContact SG-N 3.37Å
441	S	94.2	Very high	93.4	Very high	31 Å²	31	52.3 Å²	52.3	22%	0.217	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	124.9	162.1	-66.3	0	0	0	0	109.6	G907	S441-G907 PolarHBondContact O-N 3.33Å
442	L	96.7	Very high	93.4	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.01	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	137.8	170.1	-59.3	-167.2	0	0	0	111.6	I450 D455 I692 W695 V909	L442-I450 HydrophobicContact CB-CB 4.32Å; L442-I450 HydrophobicContact CB-CD1 3.89Å; L442-I450 PolarHBondContact O-N 2.97Å; L442-D455 WeakPolarHBondContact CD1-OD1 3.3Å; L442-D455 WeakPolarHBondContact CG-OD2 3.43Å; L442-I692 HydrophobicContact CD1-CG2 4.14Å; L442-W695 HydrophobicContact CD1-CD2 4.08Å; L442-W695 HydrophobicContact CD1-CE3 3.88Å; L442-W695 HydrophobicContact CD1-CZ3 4.35Å; L442-W695 HydrophobicContact CD2-CD2 3.67Å; L442-W695 VanDerWaalsContact CD2-CE2 3.44Å; L442-W695 HydrophobicContact CD2-CE3 3.88Å; L442-W695 HydrophobicContact CD2-CG 4.39Å; L442-W695 HydrophobicContact CD2-CH2 3.77Å; L442-W695 HydrophobicContact CD2-CZ2 3.52Å; L442-W695 HydrophobicContact CD2-CZ3 3.93Å; L442-V909 HydrophobicContact CB-CG2 4.28Å; L442-V909 HydrophobicContact CD1-CG2 4.31Å
443	Y	97.5	Very high	93.5	Very high	43 Å²	43	57.9 Å²	57.9	17%	0.169	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	141.5	176.4	-64.7	-89.7	0	0	0	111.7	H448 L449 F906 G907 H908 V909 I995	Y443-H448 CarbonylContact C-O 3.57Å; Y443-H448 WeakPolarHBondContact CA-O 3.49Å; Y443-L449 HydrophobicContact CD1-CB 4.26Å; Y443-L449 HydrophobicContact CD1-CD1 4.45Å; Y443-L449 HydrophobicContact CE1-CB 3.99Å; Y443-L449 HydrophobicContact CE1-CD1 3.97Å; Y443-F906 HydrophobicContact CD2-CD2 4.43Å; Y443-F906 HydrophobicContact CE2-CB 4.15Å; Y443-F906 HydrophobicContact CE2-CD2 4.39Å; Y443-G907 WeakPolarHBondContact CD2-O 3.33Å; Y443-G907 PolarHBondContact N-O 3.26Å; Y443-H908 WeakPolarHBondContact O-CA 3.3Å; Y443-V909 PolarHBondContact O-N 3.09Å; Y443-I995 HydrophobicContact CD1-CB 4.5Å; Y443-I995 HydrophobicContact CD1-CG1 4.11Å; Y443-I995 HydrophobicContact CD1-CG2 3.91Å; Y443-I995 HydrophobicContact CD2-CD1 3.93Å; Y443-I995 HydrophobicContact CD2-CG1 4.27Å; Y443-I995 HydrophobicContact CD2-CG2 4.18Å; Y443-I995 HydrophobicContact CE1-CG2 3.75Å; Y443-I995 HydrophobicContact CE2-CG2 4.01Å; Y443-I995 HydrophobicContact CG-CD1 3.94Å; Y443-I995 HydrophobicContact CG-CG1 3.83Å; Y443-I995 HydrophobicContact CG-CG2 4.14Å
444	D	96.2	Very high	93.6	Very high	44 Å²	44	57.4 Å²	57.4	24%	0.235	30%	0.3	C	S	.	.			trans	-70.1	176.1	176.4	81.8	-2.5	0	0	0	113.1	Q446 G447 H448 I450	D444-Q446 PolarHBondContact O-N 3.2Å; D444-Q446 VanDerWaalsContact OD1-C 3.26Å; D444-Q446 VanDerWaalsContact OD1-CA 3.28Å; D444-Q446 WeakPolarHBondContact OD1-CA 3.38Å; D444-Q446 WeakPolarHBondContact OD1-CB 3.33Å; D444-Q446 PolarHBondContact OD1-N 2.88Å; D444-G447 PolarHBondContact O-N 3.05Å; D444-G447 PolarHBondContact OD1-N 3.5Å; D444-H448 PolarHBondContact N-O 3.25Å; D444-H448 IonicContact OD1-CG 3.19Å; D444-H448 PolarHBondContact OD1-N 2.97Å; D444-H448 IonicContact OD1-ND1 3.77Å; D444-H448 PolarHBondContact OD1-ND1 3.25Å; D444-H448 IonicContact OD2-CE1 3.29Å; D444-H448 IonicContact OD2-CG 2.82Å; D444-H448 IonicContact OD2-ND1 3.81Å; D444-H448 PolarHBondContact OD2-ND1 3.32Å; D444-I450 HydrophobicContact CB-CG1 4.47Å
445	S	94	Very high	93.7	Very high	42 Å²	42	55.5 Å²	55.5	29%	0.294	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-11.4	178.9	70.3	0	0	0	0	114.7	V909 E911	S445-V909 PolarHBondContact N-O 2.77Å; S445-E911 WeakPolarHBondContact CB-OE1 3.47Å; S445-E911 WeakPolarHBondContact OG-CG 3.42Å; S445-E911 PolarHBondContact OG-OE1 3.01Å
446	Q	93.2	Very high	93.9	Very high	110 Å²	110	54.7 Å²	54.7	51%	0.514	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-6.8	178	-48.9	-56	-61.5	0	0	112.2	D444 H448 Q998	D444-Q446 PolarHBondContact O-N 3.2Å; D444-Q446 VanDerWaalsContact OD1-C 3.26Å; D444-Q446 VanDerWaalsContact OD1-CA 3.28Å; D444-Q446 WeakPolarHBondContact OD1-CA 3.38Å; D444-Q446 WeakPolarHBondContact OD1-CB 3.33Å; D444-Q446 PolarHBondContact OD1-N 2.88Å; Q446-H448 VanDerWaalsContact CB-CE1 3.47Å; Q446-H448 WeakPolarHBondContact CB-CE1 3.4Å; Q446-Q998 PolarHBondContact O-NE2 3.43Å
447	G	93.5	Very high	94.2	Very high	7 Å²	7	58.8 Å²	58.8	7%	0.072	30%	0.299	C	S	.	.	S	Bend	trans	88	16	-178.5	0	0	0	0	0	115.6	D444	D444-G447 PolarHBondContact O-N 3.05Å; D444-G447 PolarHBondContact OD1-N 3.5Å
448	H	95.1	Very high	94.6	Very high	91 Å²	91	56 Å²	56	42%	0.421	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-80	145.5	170.4	-46.7	112.6	0	0	0	110.8	Y443 D444 Q446 Q998	Y443-H448 CarbonylContact C-O 3.57Å; Y443-H448 WeakPolarHBondContact CA-O 3.49Å; D444-H448 PolarHBondContact N-O 3.25Å; D444-H448 IonicContact OD1-CG 3.19Å; D444-H448 PolarHBondContact OD1-N 2.97Å; D444-H448 IonicContact OD1-ND1 3.77Å; D444-H448 PolarHBondContact OD1-ND1 3.25Å; D444-H448 IonicContact OD2-CE1 3.29Å; D444-H448 IonicContact OD2-CG 2.82Å; D444-H448 IonicContact OD2-ND1 3.81Å; D444-H448 PolarHBondContact OD2-ND1 3.32Å; Q446-H448 VanDerWaalsContact CB-CE1 3.47Å; Q446-H448 WeakPolarHBondContact CB-CE1 3.4Å; H448-Q998 PolarHBondContact CD2-NE2 3.2Å; H448-Q998 VanDerWaalsContact CD2-NE2 3.33Å; H448-Q998 PolarHBondContact NE2-NE2 2.86Å
449	L	96	Very high	95	Very high	109 Å²	109	53.8 Å²	53.8	57%	0.571	27%	0.269	S	S	*	.	B	Isolated β-bridge	trans	-70.5	128.6	173.9	-178.7	67.9	0	0	0	109.9	Y443	Y443-L449 HydrophobicContact CD1-CB 4.26Å; Y443-L449 HydrophobicContact CD1-CD1 4.45Å; Y443-L449 HydrophobicContact CE1-CB 3.99Å; Y443-L449 HydrophobicContact CE1-CD1 3.97Å
450	I	96.2	Very high	95.4	Very high	18 Å²	18	58.2 Å²	58.2	9%	0.092	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-73.1	148.3	175.4	-71	163.6	0	0	0	109.5	L442 D444 R452 I692 V909	L442-I450 HydrophobicContact CB-CB 4.32Å; L442-I450 HydrophobicContact CB-CD1 3.89Å; L442-I450 PolarHBondContact O-N 2.97Å; D444-I450 HydrophobicContact CB-CG1 4.47Å; I450-R452 PolarHBondContact O-N 2.83Å; I450-I692 HydrophobicContact CD1-CD1 4.41Å; I450-I692 HydrophobicContact CD1-CG1 4.18Å; I450-I692 HydrophobicContact CG2-CD1 3.86Å; I450-V909 HydrophobicContact CD1-CB 4.12Å; I450-V909 HydrophobicContact CD1-CG2 3.54Å
451	N	95.4	Very high	95.6	Very high	89 Å²	89	59.1 Å²	59.1	48%	0.476	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-68.9	128.3	177.5	-174.1	16.1	0	0	0	110.3	D453 L454 D455	N451-D453 PolarHBondContact ND2-OD2 3.01Å; N451-D453 PolarHBondContact O-N 2.89Å; N451-D453 PolarHBondContact OD1-N 2.75Å; N451-D453 PolarHBondContact OD1-OD2 3.41Å; N451-L454 HydrophobicContact CB-CB 4.37Å; N451-L454 WeakPolarHBondContact O-CA 3.23Å; N451-L454 WeakPolarHBondContact O-CB 3.48Å; N451-L454 PolarHBondContact O-N 3.22Å; N451-D455 PolarHBondContact O-N 2.91Å
452	R	93.4	Very high	95.7	Very high	140 Å²	140	57.8 Å²	57.8	53%	0.528	28%	0.281	S	S	.	.	H	α-helix	trans	-54.2	-39.1	176.5	-178.2	177.3	174.7	116	14.1	112.6	I450 L454 D455 E456	I450-R452 PolarHBondContact O-N 2.83Å; R452-L454 PolarHBondContact O-N 3.15Å; R452-D455 WeakPolarHBondContact O-CB 3.43Å; R452-D455 PolarHBondContact O-N 3.29Å; R452-E456 HydrophobicContact CG-CG 4.23Å; R452-E456 IonicContact CZ-OE1 3.16Å; R452-E456 IonicContact NE-OE1 3.06Å; R452-E456 PolarHBondContact NE-OE1 3.04Å; R452-E456 IonicContact NH2-OE1 2.66Å; R452-E456 PolarHBondContact NH2-OE1 2.92Å; R452-E456 WeakPolarHBondContact O-CG 3.29Å; R452-E456 PolarHBondContact O-N 2.92Å
453	D	96.3	Very high	95.7	Very high	94 Å²	94	60.3 Å²	60.3	50%	0.503	30%	0.295	S	S	.	.	H	α-helix	trans	-61.6	-28.8	178.2	-44.6	-40.6	0	0	0	112.2	N451 Q457	N451-D453 PolarHBondContact ND2-OD2 3.01Å; N451-D453 PolarHBondContact O-N 2.89Å; N451-D453 PolarHBondContact OD1-N 2.75Å; N451-D453 PolarHBondContact OD1-OD2 3.41Å; D453-Q457 VanDerWaalsContact O-CG 3.31Å; D453-Q457 WeakPolarHBondContact O-CG 3.48Å; D453-Q457 PolarHBondContact O-N 3.44Å; D453-Q457 PolarHBondContact O-NE2 2.9Å
454	L	96.3	Very high	95.6	Very high	35 Å²	35	61.7 Å²	61.7	18%	0.183	30%	0.3	C	S	.	.	H	α-helix	trans	-86.3	-35.2	178.5	-179.1	63.8	0	0	0	111.7	N451 R452 I458 E689 I692	N451-L454 HydrophobicContact CB-CB 4.37Å; N451-L454 WeakPolarHBondContact O-CA 3.23Å; N451-L454 WeakPolarHBondContact O-CB 3.48Å; N451-L454 PolarHBondContact O-N 3.22Å; R452-L454 PolarHBondContact O-N 3.15Å; L454-I458 HydrophobicContact CD1-CG1 4.42Å; L454-I458 WeakPolarHBondContact O-CG1 3.2Å; L454-I458 PolarHBondContact O-N 2.83Å; L454-I458 VanDerWaalsContact O-N 3.15Å; L454-E689 HydrophobicContact CD1-CG 4.02Å; L454-I692 HydrophobicContact CD2-CD1 3.75Å; L454-I692 HydrophobicContact CG-CD1 3.89Å
455	D	94.7	Very high	95.6	Very high	25 Å²	25	59.8 Å²	59.8	13%	0.134	29%	0.289	C	S	.	.	H	α-helix	trans	-58.7	-54.2	172.2	-156.8	-9	0	0	0	110	L442 N451 R452 Q457 I458 E459	L442-D455 WeakPolarHBondContact CD1-OD1 3.3Å; L442-D455 WeakPolarHBondContact CG-OD2 3.43Å; N451-D455 PolarHBondContact O-N 2.91Å; R452-D455 WeakPolarHBondContact O-CB 3.43Å; R452-D455 PolarHBondContact O-N 3.29Å; D455-Q457 PolarHBondContact O-N 2.83Å; D455-I458 PolarHBondContact O-N 3.37Å; D455-I458 VanDerWaalsContact O-N 3.07Å; D455-E459 PolarHBondContact O-N 2.93Å
456	E	95.6	Very high	95.7	Very high	59 Å²	59	58 Å²	58	28%	0.276	28%	0.277	S	S	.	.	H	α-helix	trans	-60.4	-41.4	178.3	-68.9	175.7	166.3	0	0	112.2	T16 R452 I458 E459 E460	T16-E456 HydrophobicContact CG2-CG 4.23Å; R452-E456 HydrophobicContact CG-CG 4.23Å; R452-E456 IonicContact CZ-OE1 3.16Å; R452-E456 IonicContact NE-OE1 3.06Å; R452-E456 PolarHBondContact NE-OE1 3.04Å; R452-E456 IonicContact NH2-OE1 2.66Å; R452-E456 PolarHBondContact NH2-OE1 2.92Å; R452-E456 WeakPolarHBondContact O-CG 3.29Å; R452-E456 PolarHBondContact O-N 2.92Å; E456-I458 VanDerWaalsContact C-N 3.29Å; E456-I458 PolarHBondContact O-N 3.2Å; E456-E459 PolarHBondContact O-N 3.25Å; E456-E460 WeakPolarHBondContact O-CG 3.41Å; E456-E460 PolarHBondContact O-N 2.98Å
457	Q	96.5	Very high	95.8	Very high	105 Å²	105	54.4 Å²	54.4	49%	0.491	27%	0.269	S	S	.	.	H	α-helix	trans	-62.7	-30.1	175.1	-85.1	171.3	76.7	0	0	113.9	D453 D455 E461	D453-Q457 VanDerWaalsContact O-CG 3.31Å; D453-Q457 WeakPolarHBondContact O-CG 3.48Å; D453-Q457 PolarHBondContact O-N 3.44Å; D453-Q457 PolarHBondContact O-NE2 2.9Å; D455-Q457 PolarHBondContact O-N 2.83Å; Q457-E461 PolarHBondContact O-N 2.75Å
458	I	97.6	Very high	95.9	Very high	5 Å²	5	55 Å²	55	3%	0.026	27%	0.271	C	S	.	.	H	α-helix	trans	-91.1	-26.9	179.1	-61.5	-65.7	0	0	0	111.6	L454 D455 E456 E461 F462 L685 E689 I692 L693	L454-I458 HydrophobicContact CD1-CG1 4.42Å; L454-I458 WeakPolarHBondContact O-CG1 3.2Å; L454-I458 PolarHBondContact O-N 2.83Å; L454-I458 VanDerWaalsContact O-N 3.15Å; D455-I458 PolarHBondContact O-N 3.37Å; D455-I458 VanDerWaalsContact O-N 3.07Å; E456-I458 VanDerWaalsContact C-N 3.29Å; E456-I458 PolarHBondContact O-N 3.2Å; I458-E461 PolarHBondContact O-N 2.97Å; I458-F462 WeakPolarHBondContact O-CB 3.37Å; I458-F462 PolarHBondContact O-N 3.28Å; I458-L685 HydrophobicContact CD1-CD2 4.07Å; I458-E689 HydrophobicContact CD1-CB 3.82Å; I458-E689 HydrophobicContact CD1-CG 4.02Å; I458-I692 HydrophobicContact CB-CB 4.43Å; I458-I692 HydrophobicContact CB-CG2 3.83Å; I458-I692 HydrophobicContact CG1-CB 4.49Å; I458-I692 HydrophobicContact CG1-CG2 4.31Å; I458-I692 HydrophobicContact CG2-CB 4.01Å; I458-I692 HydrophobicContact CG2-CG2 3.63Å; I458-L693 HydrophobicContact CG2-CB 3.93Å
459	E	95.5	Very high	95.9	Very high	19 Å²	19	50.7 Å²	50.7	9%	0.089	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-45	164.8	-165.8	170.5	-143.2	0	0	110.1	S17 V18 D455 E456 N463	S17-E459 PolarHBondContact N-OE2 3.03Å; V18-E459 PolarHBondContact N-OE1 2.87Å; V18-E459 VanDerWaalsContact N-OE1 3.09Å; D455-E459 PolarHBondContact O-N 2.93Å; E456-E459 PolarHBondContact O-N 3.25Å; E459-N463 WeakPolarHBondContact O-CB 3.18Å; E459-N463 VanDerWaalsContact O-CG 3.24Å; E459-N463 PolarHBondContact O-N 3.47Å; E459-N463 PolarHBondContact O-ND2 3.42Å
460	E	96.7	Very high	95.7	Very high	140 Å²	140	46.7 Å²	46.7	65%	0.654	23%	0.234	S	C	*	.	H	α-helix	trans	-59.1	-49.8	173	-76.1	-175.4	157.4	0	0	112.7	E456 F462 N463 R464	E456-E460 WeakPolarHBondContact O-CG 3.41Å; E456-E460 PolarHBondContact O-N 2.98Å; E460-F462 PolarHBondContact O-N 2.57Å; E460-N463 PolarHBondContact O-N 2.85Å; E460-R464 WeakPolarHBondContact O-CB 3.19Å; E460-R464 PolarHBondContact O-N 3.19Å
461	E	96.7	Very high	95.6	Very high	34 Å²	34	48.4 Å²	48.4	16%	0.159	24%	0.24	C	C	.	.	H	α-helix	trans	-67.9	-34.4	-178.5	-176.3	60.5	-166.3	0	0	112.8	Q457 I458 R464 L465 Y684	Q457-E461 PolarHBondContact O-N 2.75Å; I458-E461 PolarHBondContact O-N 2.97Å; E461-R464 PolarHBondContact O-N 3.16Å; E461-R464 IonicContact OE1-CZ 3.66Å; E461-R464 IonicContact OE1-NE 2.71Å; E461-R464 IonicContact OE1-NH2 3.36Å; E461-R464 PolarHBondContact OE1-NH2 3.26Å; E461-R464 IonicContact OE2-CZ 2.85Å; E461-R464 IonicContact OE2-NE 2.89Å; E461-R464 PolarHBondContact OE2-NE 2.99Å; E461-R464 IonicContact OE2-NH2 3.91Å; E461-R464 PolarHBondContact OE2-NH2 3.4Å; E461-L465 WeakPolarHBondContact O-CG 3.38Å; E461-L465 PolarHBondContact O-N 3.17Å; E461-Y684 WeakPolarHBondContact OE1-CE2 3.44Å; E461-Y684 VanDerWaalsContact OE1-CZ 3.25Å; E461-Y684 PolarHBondContact OE1-OH 3.3Å
462	F	97.5	Very high	95.4	Very high	3 Å²	3	44.6 Å²	44.6	1%	0.013	22%	0.22	C	C	.	.	H	α-helix	trans	-60.2	-46.9	170.4	170	-101.8	0	0	0	111.5	V23 I458 E460 R464 L465 L466 L693 H696 L697 L700	V23-F462 HydrophobicContact CG1-CE1 4.15Å; V23-F462 HydrophobicContact CG2-CE1 4.38Å; I458-F462 WeakPolarHBondContact O-CB 3.37Å; I458-F462 PolarHBondContact O-N 3.28Å; E460-F462 PolarHBondContact O-N 2.57Å; F462-R464 PolarHBondContact O-N 2.83Å; F462-L465 PolarHBondContact O-N 3.45Å; F462-L466 HydrophobicContact CD1-CD1 4.28Å; F462-L466 HydrophobicContact CE1-CD1 3.65Å; F462-L466 HydrophobicContact CE2-CD1 4Å; F462-L466 HydrophobicContact CZ-CD1 3.5Å; F462-L466 PolarHBondContact O-N 3.29Å; F462-L693 HydrophobicContact CB-CD1 3.75Å; F462-L693 HydrophobicContact CD2-CD1 3.91Å; F462-L693 HydrophobicContact CG-CD1 4.33Å; F462-H696 HydrophobicContact CB-CB 4.12Å; F462-H696 HydrophobicContact CD1-CB 3.93Å; F462-H696 HydrophobicContact CD2-CB 3.47Å; F462-H696 VanDerWaalsContact CD2-CB 3.47Å; F462-H696 HydrophobicContact CE1-CB 4.17Å; F462-H696 HydrophobicContact CE2-CB 3.73Å; F462-H696 HydrophobicContact CG-CB 3.56Å; F462-H696 HydrophobicContact CZ-CB 4.07Å; F462-L697 HydrophobicContact CD2-CD2 4.22Å; F462-L697 HydrophobicContact CD2-CG 4.35Å; F462-L697 HydrophobicContact CE2-CD2 3.85Å; F462-L697 HydrophobicContact CE2-CG 4.19Å; F462-L700 HydrophobicContact CZ-CB 4.23Å; F462-L700 HydrophobicContact CZ-CD2 4.31Å
463	N	95.5	Very high	95.4	Very high	55 Å²	55	37.9 Å²	37.9	29%	0.294	19%	0.194	S	C	.	.	H	α-helix	trans	-63.8	-40.9	177.1	-72.9	-38.1	0	0	0	112	Q19 E459 E460 L465 L466 G467	Q19-N463 PolarHBondContact NE2-OD1 3.02Å; E459-N463 WeakPolarHBondContact O-CB 3.18Å; E459-N463 VanDerWaalsContact O-CG 3.24Å; E459-N463 PolarHBondContact O-N 3.47Å; E459-N463 PolarHBondContact O-ND2 3.42Å; E460-N463 PolarHBondContact O-N 2.85Å; N463-L465 PolarHBondContact O-N 3Å; N463-L466 PolarHBondContact O-N 3.27Å; N463-G467 PolarHBondContact O-N 3.07Å
464	R	96.4	Very high	95.2	Very high	71 Å²	71	37.4 Å²	37.4	27%	0.268	19%	0.189	S	C	.	.	H	α-helix	trans	-63.3	-39.4	176.8	-158.8	-177.6	70.7	82.9	10.2	112.2	E99 E460 E461 F462 T468	E99-R464 IonicContact OE1-NH1 2.97Å; E460-R464 WeakPolarHBondContact O-CB 3.19Å; E460-R464 PolarHBondContact O-N 3.19Å; E461-R464 PolarHBondContact O-N 3.16Å; E461-R464 IonicContact OE1-CZ 3.66Å; E461-R464 IonicContact OE1-NE 2.71Å; E461-R464 IonicContact OE1-NH2 3.36Å; E461-R464 PolarHBondContact OE1-NH2 3.26Å; E461-R464 IonicContact OE2-CZ 2.85Å; E461-R464 IonicContact OE2-NE 2.89Å; E461-R464 PolarHBondContact OE2-NE 2.99Å; E461-R464 IonicContact OE2-NH2 3.91Å; E461-R464 PolarHBondContact OE2-NH2 3.4Å; F462-R464 PolarHBondContact O-N 2.83Å; R464-T468 WeakPolarHBondContact O-CB 3.41Å; R464-T468 PolarHBondContact O-N 3.14Å; R464-T468 PolarHBondContact O-OG1 2.71Å
465	L	96.6	Very high	94.9	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-62.3	-40.8	173.6	-77.4	168.5	0	0	0	112.3	E461 F462 N463 A469 L500 I501 L693	E461-L465 WeakPolarHBondContact O-CG 3.38Å; E461-L465 PolarHBondContact O-N 3.17Å; F462-L465 PolarHBondContact O-N 3.45Å; N463-L465 PolarHBondContact O-N 3Å; L465-A469 WeakPolarHBondContact O-CB 3.5Å; L465-A469 PolarHBondContact O-N 2.93Å; L465-L500 HydrophobicContact CD2-CB 3.76Å; L465-L500 WeakPolarHBondContact O-CD1 3.22Å; L465-I501 HydrophobicContact CD1-CD1 4.44Å; L465-I501 HydrophobicContact CD1-CG1 4.05Å; L465-I501 HydrophobicContact CD2-CG1 4.28Å; L465-L693 HydrophobicContact CD1-CD1 4.22Å; L465-L693 HydrophobicContact CD1-CD2 3.92Å
466	L	95	Very high	94.6	Very high	5 Å²	5	42.5 Å²	42.5	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-72.7	-43.3	177.9	-70.5	175.8	0	0	0	112.9	V23 F462 N463 T468 A469 A470 L493 I497 L700	V23-L466 HydrophobicContact CG1-CD1 3.37Å; F462-L466 HydrophobicContact CD1-CD1 4.28Å; F462-L466 HydrophobicContact CE1-CD1 3.65Å; F462-L466 HydrophobicContact CE2-CD1 4Å; F462-L466 HydrophobicContact CZ-CD1 3.5Å; F462-L466 PolarHBondContact O-N 3.29Å; N463-L466 PolarHBondContact O-N 3.27Å; L466-T468 VanDerWaalsContact C-N 3.27Å; L466-T468 PolarHBondContact O-N 3.01Å; L466-A469 WeakPolarHBondContact O-CB 3.3Å; L466-A469 PolarHBondContact O-N 3.49Å; L466-A469 VanDerWaalsContact O-N 3.09Å; L466-A470 PolarHBondContact O-N 2.98Å; L466-L493 HydrophobicContact CD2-CD1 3.97Å; L466-L493 HydrophobicContact CD2-CD2 4.35Å; L466-L493 HydrophobicContact CD2-CG 4.47Å; L466-I497 HydrophobicContact CD2-CD1 3.73Å; L466-I497 HydrophobicContact CD2-CG1 4.3Å; L466-L700 HydrophobicContact CD1-CD2 4.33Å; L466-L700 HydrophobicContact CD2-CD2 4.25Å
467	G	94.9	Very high	94.3	Very high	34 Å²	34	41.9 Å²	41.9	35%	0.351	23%	0.227	S	C	.	.	H	α-helix	trans	-57.9	-40.9	171.8	0	0	0	0	0	112	N463 A470 Y471	N463-G467 PolarHBondContact O-N 3.07Å; G467-A470 PolarHBondContact O-N 2.74Å; G467-Y471 WeakPolarHBondContact O-CB 3.45Å; G467-Y471 PolarHBondContact O-N 3.37Å
468	T	95.6	Very high	93.8	Very high	19 Å²	19	39.2 Å²	39.2	12%	0.117	22%	0.216	C	C	.	.	H	α-helix	trans	-64.2	-40.9	173.8	-53.5	0	0	0	0	111.8	R464 L466 Y471 V472 L500	R464-T468 WeakPolarHBondContact O-CB 3.41Å; R464-T468 PolarHBondContact O-N 3.14Å; R464-T468 PolarHBondContact O-OG1 2.71Å; L466-T468 VanDerWaalsContact C-N 3.27Å; L466-T468 PolarHBondContact O-N 3.01Å; T468-Y471 PolarHBondContact O-N 3.38Å; T468-V472 HydrophobicContact CG2-CG2 4.38Å; T468-V472 WeakPolarHBondContact O-CB 3.47Å; T468-V472 VanDerWaalsContact O-CG2 3.27Å; T468-V472 WeakPolarHBondContact O-CG2 3.39Å; T468-V472 PolarHBondContact O-N 3.39Å; T468-L500 HydrophobicContact CG2-CD1 3.96Å; T468-L500 HydrophobicContact CG2-CD2 3.64Å; T468-L500 HydrophobicContact CG2-CG 4.46Å
469	A	95.1	Very high	93.4	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.008	22%	0.223	C	C	.	.	H	α-helix	trans	-64.1	-42.5	176.1	0	0	0	0	0	112	L465 L466 V472 C473 L493 V496 L500 L713	L465-A469 WeakPolarHBondContact O-CB 3.5Å; L465-A469 PolarHBondContact O-N 2.93Å; L466-A469 WeakPolarHBondContact O-CB 3.3Å; L466-A469 PolarHBondContact O-N 3.49Å; L466-A469 VanDerWaalsContact O-N 3.09Å; A469-V472 PolarHBondContact O-N 3.09Å; A469-C473 VanDerWaalsContact O-CB 3.32Å; A469-C473 WeakPolarHBondContact O-CB 3.28Å; A469-C473 PolarHBondContact O-N 2.73Å; A469-L493 HydrophobicContact CB-CD1 4.29Å; A469-V496 HydrophobicContact CB-CG1 3.8Å; A469-L500 HydrophobicContact CB-CD1 4.05Å; A469-L713 HydrophobicContact CB-CD1 4.31Å
470	A	93.2	Very high	93.1	Very high	25 Å²	25	40.7 Å²	40.7	21%	0.207	23%	0.226	C	C	.	.	H	α-helix	trans	-64.1	-43.1	175.6	0	0	0	0	0	112.2	L466 G467 C473 H474	L466-A470 PolarHBondContact O-N 2.98Å; G467-A470 PolarHBondContact O-N 2.74Å; A470-C473 PolarHBondContact O-N 3.28Å; A470-H474 WeakPolarHBondContact O-CB 3.35Å; A470-H474 PolarHBondContact O-N 3.39Å; A470-H474 PolarHBondContact O-ND1 3.41Å
471	Y	92.9	Very high	92.6	Very high	55 Å²	55	37.6 Å²	37.6	22%	0.216	21%	0.213	C	C	.	.	H	α-helix	trans	-63.1	-44.5	174.4	173.2	-88.2	0	0	0	112.3	G467 T468 C473 H474 S475 K476	G467-Y471 WeakPolarHBondContact O-CB 3.45Å; G467-Y471 PolarHBondContact O-N 3.37Å; T468-Y471 PolarHBondContact O-N 3.38Å; Y471-C473 VanDerWaalsContact C-N 3.33Å; Y471-C473 PolarHBondContact O-N 2.99Å; Y471-H474 PolarHBondContact O-N 3.18Å; Y471-S475 WeakPolarHBondContact O-CA 3.43Å; Y471-S475 VanDerWaalsContact O-CB 3.25Å; Y471-S475 WeakPolarHBondContact O-CB 3.35Å; Y471-S475 PolarHBondContact O-N 3.39Å; Y471-K476 HydrophobicContact CD1-CG 4.46Å; Y471-K476 HydrophobicContact CE1-CD 4.37Å; Y471-K476 VanDerWaalsContact CE1-CE 3.45Å; Y471-K476 HydrophobicContact CE1-CG 4.01Å; Y471-K476 PolarHBondContact O-N 3.15Å; Y471-K476 WeakPolarHBondContact OH-CE 3.44Å
472	V	91.5	Very high	92	Very high	8 Å²	8	41.4 Å²	41.4	5%	0.048	23%	0.234	C	C	.	.	H	α-helix	trans	-65.5	-36.8	177.7	166.4	0	0	0	0	111.4	T468 A469 K476 G477 L478	T468-V472 HydrophobicContact CG2-CG2 4.38Å; T468-V472 WeakPolarHBondContact O-CB 3.47Å; T468-V472 VanDerWaalsContact O-CG2 3.27Å; T468-V472 WeakPolarHBondContact O-CG2 3.39Å; T468-V472 PolarHBondContact O-N 3.39Å; A469-V472 PolarHBondContact O-N 3.09Å; V472-K476 WeakPolarHBondContact O-CB 3.37Å; V472-G477 PolarHBondContact O-N 3.42Å; V472-L478 HydrophobicContact CG1-CB 3.8Å; V472-L478 HydrophobicContact CG1-CD2 3.63Å; V472-L478 HydrophobicContact CG1-CG 4.29Å; V472-L478 PolarHBondContact O-N 3.27Å; V472-L478 VanDerWaalsContact O-N 3.12Å
473	C	93.2	Very high	91.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.8	-58.3	172.1	-179.6	0	0	0	0	112	A469 A470 Y471 G477 L478 L713	A469-C473 VanDerWaalsContact O-CB 3.32Å; A469-C473 WeakPolarHBondContact O-CB 3.28Å; A469-C473 PolarHBondContact O-N 2.73Å; A470-C473 PolarHBondContact O-N 3.28Å; Y471-C473 VanDerWaalsContact C-N 3.33Å; Y471-C473 PolarHBondContact O-N 2.99Å; C473-G477 VanDerWaalsContact O-CA 3.25Å; C473-G477 WeakPolarHBondContact O-CA 3.44Å; C473-G477 PolarHBondContact O-N 3.22Å; C473-L478 PolarHBondContact O-N 2.96Å; C473-L713 HydrophobicContact CB-CD2 3.76Å; C473-L713 HydrophobicContact CB-CG 3.94Å
474	H	91.3	Very high	90.9	Very high	83 Å²	83	48 Å²	48	38%	0.384	27%	0.269	S	S	.	.	H	α-helix	trans	-85.3	-46.2	-167.8	-63.9	102.8	0	0	0	113.8	A470 Y471	A470-H474 WeakPolarHBondContact O-CB 3.35Å; A470-H474 PolarHBondContact O-N 3.39Å; A470-H474 PolarHBondContact O-ND1 3.41Å; Y471-H474 PolarHBondContact O-N 3.18Å
475	S	90.6	Very high	90.3	Very high	74 Å²	74	48.7 Å²	48.7	52%	0.517	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-30.3	-174.3	-50.6	0	0	0	0	113.3	Y471	Y471-S475 WeakPolarHBondContact O-CA 3.43Å; Y471-S475 VanDerWaalsContact O-CB 3.25Å; Y471-S475 WeakPolarHBondContact O-CB 3.35Å; Y471-S475 PolarHBondContact O-N 3.39Å
476	K	89.7	Confident	89.8	Confident	94 Å²	94	51.4 Å²	51.4	41%	0.409	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-10.6	177.4	-54.8	-78.9	-177.9	163.7	0	113.3	D92 Y471 V472	D92-K476 PolarHBondContact O-NZ 2.93Å; Y471-K476 HydrophobicContact CD1-CG 4.46Å; Y471-K476 HydrophobicContact CE1-CD 4.37Å; Y471-K476 VanDerWaalsContact CE1-CE 3.45Å; Y471-K476 HydrophobicContact CE1-CG 4.01Å; Y471-K476 PolarHBondContact O-N 3.15Å; Y471-K476 WeakPolarHBondContact OH-CE 3.44Å; V472-K476 WeakPolarHBondContact O-CB 3.37Å
477	G	87.9	Confident	89.3	Confident	45 Å²	45	55 Å²	55	46%	0.464	34%	0.335	S	S	.	.			trans	69	35.4	177.7	0	0	0	0	0	113.9	V472 C473	V472-G477 PolarHBondContact O-N 3.42Å; C473-G477 VanDerWaalsContact O-CA 3.25Å; C473-G477 WeakPolarHBondContact O-CA 3.44Å; C473-G477 PolarHBondContact O-N 3.22Å
478	L	87.4	Confident	88.9	Confident	49 Å²	49	59.2 Å²	59.2	26%	0.257	35%	0.346	S	S	.	.			trans	-105.1	58.9	-177.6	-166.6	73.4	0	0	0	111.5	V472 C473 L481 L491 L713	V472-L478 HydrophobicContact CG1-CB 3.8Å; V472-L478 HydrophobicContact CG1-CD2 3.63Å; V472-L478 HydrophobicContact CG1-CG 4.29Å; V472-L478 PolarHBondContact O-N 3.27Å; V472-L478 VanDerWaalsContact O-N 3.12Å; C473-L478 PolarHBondContact O-N 2.96Å; L478-L481 HydrophobicContact CD1-CD2 4.33Å; L478-L491 HydrophobicContact CG-CD1 4.14Å; L478-L491 WeakPolarHBondContact O-CD1 3.39Å; L478-L713 VanDerWaalsContact O-CD2 3.25Å; L478-L713 WeakPolarHBondContact O-CD2 3.31Å
479	D	87.6	Confident	88.6	Confident	35 Å²	35	61.7 Å²	61.7	19%	0.187	36%	0.358	C	S	.	.	S	Bend	trans	-93.4	-6.9	170.2	65	-57	0	0	0	113.9	P490 L491 R714	D479-P490 WeakPolarHBondContact O-CA 3.33Å; D479-L491 PolarHBondContact O-N 3.46Å; D479-R714 HydrophobicContact CB-CB 4.17Å; D479-R714 IonicContact OD1-CZ 3.72Å; D479-R714 IonicContact OD1-NH1 2.77Å; D479-R714 PolarHBondContact OD1-NH1 3.25Å; D479-R714 VanDerWaalsContact OD2-CD 3.28Å; D479-R714 WeakPolarHBondContact OD2-CD 3.43Å; D479-R714 IonicContact OD2-CZ 3.8Å; D479-R714 IonicContact OD2-NE 2.63Å; D479-R714 IonicContact OD2-NH1 3.9Å; D479-R714 PolarHBondContact OD2-NH1 2.87Å
480	S	88.9	Confident	88.5	Confident	20 Å²	20	63.9 Å²	63.9	14%	0.14	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	161.3	176	75.2	0	0	0	0	113.4	E488 I489	S480-E488 VanDerWaalsContact CB-OE1 3.28Å; S480-E488 WeakPolarHBondContact CB-OE1 3.05Å; S480-E488 WeakPolarHBondContact OG-CG 3.4Å; S480-E488 PolarHBondContact OG-OE1 3.18Å; S480-I489 CarbonylContact C-O 3.54Å; S480-I489 VanDerWaalsContact CA-O 3.31Å; S480-I489 WeakPolarHBondContact CA-O 3.23Å
481	L	86.3	Confident	88.6	Confident	75 Å²	75	63 Å²	63	39%	0.393	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118.3	168.4	-64.4	179.1	0	0	0	109.5	L478 L483 I489 L491	L478-L481 HydrophobicContact CD1-CD2 4.33Å; L481-L483 PolarHBondContact O-N 3.46Å; L481-I489 PolarHBondContact N-O 3.38Å; L481-I489 PolarHBondContact O-N 2.97Å; L481-L491 HydrophobicContact CD1-CD2 3.92Å; L481-L491 HydrophobicContact CD2-CD1 4.41Å; L481-L491 HydrophobicContact CG-CD1 4.21Å; L481-L491 HydrophobicContact CG-CD2 3.96Å; L481-L491 HydrophobicContact CG-CG 4.18Å
482	I	85.4	Confident	88.8	Confident	115 Å²	115	60.4 Å²	60.4	59%	0.59	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	115.3	169.7	-56.7	174.2	0	0	0	107.9
483	L	83.6	Confident	89	Confident	65 Å²	65	60.1 Å²	60.1	34%	0.34	35%	0.352	S	S	.	.			trans	-72.1	161.5	173.2	-66.6	-173.9	0	0	0	111.8	L481 S485 G486 V487 I489	L481-L483 PolarHBondContact O-N 3.46Å; L483-S485 WeakPolarHBondContact CB-OG 3.44Å; L483-S485 PolarHBondContact O-N 3.24Å; L483-G486 PolarHBondContact O-N 3.38Å; L483-V487 PolarHBondContact N-O 3.19Å; L483-I489 HydrophobicContact CD1-CD1 3.59Å; L483-I489 HydrophobicContact CD1-CG1 4.36Å; L483-I489 HydrophobicContact CD2-CD1 4.34Å; L483-I489 HydrophobicContact CG-CD1 3.92Å; L483-I489 HydrophobicContact CG-CG1 4.38Å
484	D	85	Confident	89.2	Confident	131 Å²	131	60.3 Å²	60.3	70%	0.701	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-17.5	172	-66	-53.7	0	0	0	113.6	T84 G486	T84-D484 PolarHBondContact OG1-OD2 3.14Å; D484-G486 VanDerWaalsContact C-N 3.32Å
485	S	85.4	Confident	89.4	Confident	86 Å²	86	60 Å²	60	60%	0.601	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-4.4	172.7	57.8	0	0	0	0	114.7	L483 V487	L483-S485 WeakPolarHBondContact CB-OG 3.44Å; L483-S485 PolarHBondContact O-N 3.24Å; S485-V487 PolarHBondContact O-N 3.43Å; S485-V487 WeakPolarHBondContact OG-CG2 3.23Å; S485-V487 PolarHBondContact OG-N 3.13Å
486	G	84.6	Confident	89.7	Confident	60 Å²	60	56.8 Å²	56.8	62%	0.619	33%	0.329	S	S	*	.	S	Bend	trans	75	4.9	-170.1	0	0	0	0	0	114.3	L483 D484	L483-G486 PolarHBondContact O-N 3.38Å; D484-G486 VanDerWaalsContact C-N 3.32Å
487	V	84.8	Confident	90	Very high	81 Å²	81	52.5 Å²	52.5	49%	0.491	31%	0.311	S	S	.	.			trans	-80	122	174.3	178.1	0	0	0	0	109.3	L483 S485 I489	L483-V487 PolarHBondContact N-O 3.19Å; S485-V487 PolarHBondContact O-N 3.43Å; S485-V487 WeakPolarHBondContact OG-CG2 3.23Å; S485-V487 PolarHBondContact OG-N 3.13Å; V487-I489 HydrophobicContact CG1-CG1 4.36Å
488	E	86.9	Confident	90.4	Very high	122 Å²	122	52.1 Å²	52.1	57%	0.57	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	125.8	171.6	-175.7	170	-156.4	0	0	110.4	S480	S480-E488 VanDerWaalsContact CB-OE1 3.28Å; S480-E488 WeakPolarHBondContact CB-OE1 3.05Å; S480-E488 WeakPolarHBondContact OG-CG 3.4Å; S480-E488 PolarHBondContact OG-OE1 3.18Å
489	I	89.1	Confident	90.8	Very high	72 Å²	72	54.7 Å²	54.7	37%	0.369	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	109	175.4	-63.6	-175.5	0	0	0	108.1	S480 L481 L483 V487	S480-I489 CarbonylContact C-O 3.54Å; S480-I489 VanDerWaalsContact CA-O 3.31Å; S480-I489 WeakPolarHBondContact CA-O 3.23Å; L481-I489 PolarHBondContact N-O 3.38Å; L481-I489 PolarHBondContact O-N 2.97Å; L483-I489 HydrophobicContact CD1-CD1 3.59Å; L483-I489 HydrophobicContact CD1-CG1 4.36Å; L483-I489 HydrophobicContact CD2-CD1 4.34Å; L483-I489 HydrophobicContact CG-CD1 3.92Å; L483-I489 HydrophobicContact CG-CG1 4.38Å; V487-I489 HydrophobicContact CG1-CG1 4.36Å
490	P	93	Very high	91.2	Very high	47 Å²	47	54 Å²	54	31%	0.305	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	141.9	174	24.4	-31.8	0	0	0	111.2	D479 V1058	D479-P490 WeakPolarHBondContact O-CA 3.33Å; P490-V1058 HydrophobicContact CB-CG1 4.11Å; P490-V1058 HydrophobicContact CG-CG1 3.75Å; P490-V1058 WeakPolarHBondContact O-CG1 3.34Å
491	L	94.9	Very high	91.6	Very high	6 Å²	6	53 Å²	53	3%	0.031	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-86	146.9	-177.6	-75.7	168.2	0	0	0	112.1	L478 D479 L481 Q495 V496 L713	L478-L491 HydrophobicContact CG-CD1 4.14Å; L478-L491 WeakPolarHBondContact O-CD1 3.39Å; D479-L491 PolarHBondContact O-N 3.46Å; L481-L491 HydrophobicContact CD1-CD2 3.92Å; L481-L491 HydrophobicContact CD2-CD1 4.41Å; L481-L491 HydrophobicContact CG-CD1 4.21Å; L481-L491 HydrophobicContact CG-CD2 3.96Å; L481-L491 HydrophobicContact CG-CG 4.18Å; L491-Q495 HydrophobicContact CD2-CB 4.48Å; L491-V496 HydrophobicContact CB-CG2 4.3Å; L491-V496 HydrophobicContact CD1-CG2 4.24Å; L491-L713 HydrophobicContact CB-CB 4.47Å; L491-L713 HydrophobicContact CB-CD2 4.34Å; L491-L713 WeakPolarHBondContact O-CB 3.44Å; L491-L713 PolarHBondContact O-N 3.33Å; L491-L713 VanDerWaalsContact O-N 3.13Å
492	S	97	Very high	92	Very high	1 Å²	1	55 Å²	55	1%	0.007	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-91.2	153.2	167.6	65.4	0	0	0	0	112.7	G494 Q495 V496 H709 L711	S492-G494 VanDerWaalsContact C-N 3.28Å; S492-G494 PolarHBondContact O-N 2.86Å; S492-Q495 PolarHBondContact O-N 2.99Å; S492-Q495 WeakPolarHBondContact OG-CB 3.47Å; S492-Q495 VanDerWaalsContact OG-CD 3.25Å; S492-Q495 WeakPolarHBondContact OG-CG 3.25Å; S492-Q495 PolarHBondContact OG-N 2.82Å; S492-Q495 VanDerWaalsContact OG-N 3.14Å; S492-Q495 PolarHBondContact OG-OE1 2.87Å; S492-V496 PolarHBondContact O-N 3.24Å; S492-H709 WeakPolarHBondContact CB-O 3.43Å; S492-H709 PolarHBondContact OG-O 3.38Å; S492-L711 CarbonylContact C-O 3.59Å; S492-L711 WeakPolarHBondContact CA-O 3.45Å; S492-L711 WeakPolarHBondContact CB-O 3.5Å
493	L	97.3	Very high	92.5	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-55.9	-43.6	171.4	-176.3	62.1	0	0	0	111.6	L466 A469 Q495 V496 I497 L700 L711 L713 W716	L466-L493 HydrophobicContact CD2-CD1 3.97Å; L466-L493 HydrophobicContact CD2-CD2 4.35Å; L466-L493 HydrophobicContact CD2-CG 4.47Å; A469-L493 HydrophobicContact CB-CD1 4.29Å; L493-Q495 PolarHBondContact O-N 3.48Å; L493-V496 PolarHBondContact O-N 3.37Å; L493-I497 HydrophobicContact CD1-CD1 4.14Å; L493-I497 HydrophobicContact CD1-CG1 4.42Å; L493-I497 HydrophobicContact CG-CD1 3.86Å; L493-I497 WeakPolarHBondContact O-CG1 3.28Å; L493-I497 PolarHBondContact O-N 3.22Å; L493-L700 HydrophobicContact CD2-CD2 3.96Å; L493-L711 HydrophobicContact CB-CB 4.17Å; L493-L711 HydrophobicContact CD2-CD1 4.23Å; L493-L711 PolarHBondContact N-O 2.94Å; L493-L713 HydrophobicContact CD1-CD1 3.95Å; L493-W716 HydrophobicContact CD2-CD2 3.77Å; L493-W716 HydrophobicContact CD2-CE3 4.39Å; L493-W716 HydrophobicContact CD2-CG 3.99Å; L493-W716 HydrophobicContact CD2-CZ2 4.25Å
494	G	96.7	Very high	93	Very high	3 Å²	3	50 Å²	50	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-61.1	-39.3	177.6	0	0	0	0	0	114.2	S492 E498 L708	S492-G494 VanDerWaalsContact C-N 3.28Å; S492-G494 PolarHBondContact O-N 2.86Å; G494-E498 PolarHBondContact O-N 3.13Å; G494-E498 VanDerWaalsContact O-N 3.13Å; G494-L708 PolarHBondContact N-O 2.89Å
495	Q	96	Very high	93.4	Very high	78 Å²	78	48 Å²	48	36%	0.364	26%	0.262	S	S	.	.	H	α-helix	trans	-64.5	-42.9	175	-78	162.4	-48.8	0	0	111.6	L491 S492 L493 L499	L491-Q495 HydrophobicContact CD2-CB 4.48Å; S492-Q495 PolarHBondContact O-N 2.99Å; S492-Q495 WeakPolarHBondContact OG-CB 3.47Å; S492-Q495 VanDerWaalsContact OG-CD 3.25Å; S492-Q495 WeakPolarHBondContact OG-CG 3.25Å; S492-Q495 PolarHBondContact OG-N 2.82Å; S492-Q495 VanDerWaalsContact OG-N 3.14Å; S492-Q495 PolarHBondContact OG-OE1 2.87Å; L493-Q495 PolarHBondContact O-N 3.48Å; Q495-L499 WeakPolarHBondContact O-CB 3.31Å; Q495-L499 VanDerWaalsContact O-CG 3.23Å; Q495-L499 WeakPolarHBondContact O-CG 3.3Å; Q495-L499 PolarHBondContact O-N 2.96Å
496	V	96.5	Very high	93.8	Very high	6 Å²	6	49.2 Å²	49.2	4%	0.036	26%	0.256	C	S	.	.	H	α-helix	trans	-68.9	-42.1	-179.2	175.7	0	0	0	0	111.3	A469 L491 S492 L493 E498 L499 L500 L713	A469-V496 HydrophobicContact CB-CG1 3.8Å; L491-V496 HydrophobicContact CB-CG2 4.3Å; L491-V496 HydrophobicContact CD1-CG2 4.24Å; S492-V496 PolarHBondContact O-N 3.24Å; L493-V496 PolarHBondContact O-N 3.37Å; V496-E498 PolarHBondContact O-N 3.01Å; V496-L499 PolarHBondContact O-N 3.04Å; V496-L500 HydrophobicContact CG1-CD1 3.96Å; V496-L500 HydrophobicContact CG1-CG 4.23Å; V496-L500 WeakPolarHBondContact O-CB 3.4Å; V496-L500 VanDerWaalsContact O-CG 3.3Å; V496-L500 WeakPolarHBondContact O-CG 3.28Å; V496-L500 PolarHBondContact O-N 3.42Å; V496-L713 HydrophobicContact CB-CD1 3.81Å; V496-L713 HydrophobicContact CG1-CD1 4.14Å; V496-L713 HydrophobicContact CG2-CD1 3.71Å; V496-L713 HydrophobicContact CG2-CD2 3.73Å; V496-L713 HydrophobicContact CG2-CG 4.29Å
497	I	96.7	Very high	94.2	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-59.2	-47.9	175.2	-67.3	166.5	0	0	0	111.1	L466 L493 L499 L500 I501 L697 L708	L466-I497 HydrophobicContact CD2-CD1 3.73Å; L466-I497 HydrophobicContact CD2-CG1 4.3Å; L493-I497 HydrophobicContact CD1-CD1 4.14Å; L493-I497 HydrophobicContact CD1-CG1 4.42Å; L493-I497 HydrophobicContact CG-CD1 3.86Å; L493-I497 WeakPolarHBondContact O-CG1 3.28Å; L493-I497 PolarHBondContact O-N 3.22Å; I497-L499 VanDerWaalsContact C-N 3.29Å; I497-L499 PolarHBondContact O-N 2.98Å; I497-L500 PolarHBondContact O-N 2.93Å; I497-I501 HydrophobicContact CG2-CD1 3.87Å; I497-I501 HydrophobicContact CG2-CG1 4.5Å; I497-I501 WeakPolarHBondContact O-CG1 3.46Å; I497-I501 PolarHBondContact O-N 3.3Å; I497-L697 HydrophobicContact CD1-CD2 3.92Å; I497-L697 HydrophobicContact CG2-CD2 4.01Å; I497-L708 HydrophobicContact CD1-CD1 4.02Å
498	E	96.2	Very high	94.6	Very high	37 Å²	37	48.2 Å²	48.2	17%	0.173	23%	0.229	C	C	.	.	H	α-helix	trans	-68.9	-24.3	178.3	-75.3	-71.1	156.2	0	0	113.2	G494 V496 K502 R690	G494-E498 PolarHBondContact O-N 3.13Å; G494-E498 VanDerWaalsContact O-N 3.13Å; V496-E498 PolarHBondContact O-N 3.01Å; E498-K502 VanDerWaalsContact O-CD 3.23Å; E498-K502 WeakPolarHBondContact O-CD 3.47Å; E498-K502 VanDerWaalsContact O-CG 3.24Å; E498-K502 WeakPolarHBondContact O-CG 3.24Å; E498-K502 PolarHBondContact O-N 2.83Å; E498-R690 IonicContact OE1-CZ 2.78Å; E498-R690 IonicContact OE1-NH1 2.74Å; E498-R690 PolarHBondContact OE1-NH1 3.16Å; E498-R690 IonicContact OE1-NH2 3.68Å; E498-R690 PolarHBondContact OE1-NH2 3.08Å; E498-R690 IonicContact OE2-NH1 3.77Å
499	L	94.7	Very high	94.8	Very high	103 Å²	103	47.2 Å²	47.2	54%	0.539	23%	0.227	S	C	.	.	H	α-helix	trans	-73.6	-41.5	169.6	-76.1	167.9	0	0	0	112	Q495 V496 I497 K502 Y503	Q495-L499 WeakPolarHBondContact O-CB 3.31Å; Q495-L499 VanDerWaalsContact O-CG 3.23Å; Q495-L499 WeakPolarHBondContact O-CG 3.3Å; Q495-L499 PolarHBondContact O-N 2.96Å; V496-L499 PolarHBondContact O-N 3.04Å; I497-L499 VanDerWaalsContact C-N 3.29Å; I497-L499 PolarHBondContact O-N 2.98Å; L499-K502 PolarHBondContact O-N 2.88Å; L499-Y503 WeakPolarHBondContact O-CB 2.98Å; L499-Y503 PolarHBondContact O-N 2.99Å
500	L	96.5	Very high	95	Very high	19 Å²	19	47.1 Å²	47.1	10%	0.099	22%	0.224	C	C	.	.	H	α-helix	trans	-65.5	-42.5	177.3	-71	173.3	0	0	0	111.7	L465 T468 A469 V496 I497 K502 Y503 Q504	L465-L500 HydrophobicContact CD2-CB 3.76Å; L465-L500 WeakPolarHBondContact O-CD1 3.22Å; T468-L500 HydrophobicContact CG2-CD1 3.96Å; T468-L500 HydrophobicContact CG2-CD2 3.64Å; T468-L500 HydrophobicContact CG2-CG 4.46Å; A469-L500 HydrophobicContact CB-CD1 4.05Å; V496-L500 HydrophobicContact CG1-CD1 3.96Å; V496-L500 HydrophobicContact CG1-CG 4.23Å; V496-L500 WeakPolarHBondContact O-CB 3.4Å; V496-L500 VanDerWaalsContact O-CG 3.3Å; V496-L500 WeakPolarHBondContact O-CG 3.28Å; V496-L500 PolarHBondContact O-N 3.42Å; I497-L500 PolarHBondContact O-N 2.93Å; L500-K502 PolarHBondContact O-N 2.86Å; L500-Y503 WeakPolarHBondContact O-CB 3.38Å; L500-Y503 PolarHBondContact O-N 3.37Å; L500-Q504 WeakPolarHBondContact O-CG 3.39Å; L500-Q504 PolarHBondContact O-N 2.76Å
501	I	96.6	Very high	94.9	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-57.4	-50.5	173.9	-70.2	168.6	0	0	0	110.3	L465 I497 Y503 Q504 E505 Y684 L693	L465-I501 HydrophobicContact CD1-CD1 4.44Å; L465-I501 HydrophobicContact CD1-CG1 4.05Å; L465-I501 HydrophobicContact CD2-CG1 4.28Å; I497-I501 HydrophobicContact CG2-CD1 3.87Å; I497-I501 HydrophobicContact CG2-CG1 4.5Å; I497-I501 WeakPolarHBondContact O-CG1 3.46Å; I497-I501 PolarHBondContact O-N 3.3Å; I501-Y503 VanDerWaalsContact C-N 3.3Å; I501-Y503 PolarHBondContact O-N 2.78Å; I501-Q504 PolarHBondContact O-N 2.78Å; I501-Q504 VanDerWaalsContact O-N 3.13Å; I501-E505 WeakPolarHBondContact O-CG 3.49Å; I501-E505 PolarHBondContact O-N 3.2Å; I501-Y684 HydrophobicContact CB-CE1 4.3Å; I501-Y684 HydrophobicContact CG1-CE1 4.29Å; I501-Y684 HydrophobicContact CG2-CD1 4.36Å; I501-Y684 HydrophobicContact CG2-CE1 4.06Å; I501-L693 HydrophobicContact CD1-CD2 4.05Å
502	K	95.8	Very high	94.8	Very high	115 Å²	115	49.9 Å²	49.9	50%	0.5	23%	0.234	S	C	.	.	H	α-helix	trans	-64.3	-32.5	178.7	-71.1	166.1	-166.3	162.2	0	113.1	E498 L499 L500 K506	E498-K502 VanDerWaalsContact O-CD 3.23Å; E498-K502 WeakPolarHBondContact O-CD 3.47Å; E498-K502 VanDerWaalsContact O-CG 3.24Å; E498-K502 WeakPolarHBondContact O-CG 3.24Å; E498-K502 PolarHBondContact O-N 2.83Å; L499-K502 PolarHBondContact O-N 2.88Å; L500-K502 PolarHBondContact O-N 2.86Å; K502-K506 WeakPolarHBondContact O-CB 3.33Å; K502-K506 PolarHBondContact O-N 3.44Å
503	Y	94.8	Very high	94.7	Very high	66 Å²	66	53.1 Å²	53.1	26%	0.259	25%	0.251	S	S	.	.	H	α-helix	trans	-63.5	-46.2	172.2	-177.4	-96	0	0	0	111.2	I93 V95 L499 L500 I501 K506 H507	I93-Y503 PolarHBondContact O-OH 2.7Å; V95-Y503 HydrophobicContact CG2-CE1 3.79Å; L499-Y503 WeakPolarHBondContact O-CB 2.98Å; L499-Y503 PolarHBondContact O-N 2.99Å; L500-Y503 WeakPolarHBondContact O-CB 3.38Å; L500-Y503 PolarHBondContact O-N 3.37Å; I501-Y503 VanDerWaalsContact C-N 3.3Å; I501-Y503 PolarHBondContact O-N 2.78Å; Y503-K506 PolarHBondContact O-N 3.02Å; Y503-H507 WeakPolarHBondContact O-CB 3.2Å; Y503-H507 PolarHBondContact O-N 2.8Å
504	Q	94.8	Very high	94.5	Very high	10 Å²	10	56.8 Å²	56.8	5%	0.047	27%	0.274	C	S	.	.	H	α-helix	trans	-66.2	-40.1	177.3	-65.5	-63	-12.7	0	0	112.5	L500 I501 H507 K508 Y684	L500-Q504 WeakPolarHBondContact O-CG 3.39Å; L500-Q504 PolarHBondContact O-N 2.76Å; I501-Q504 PolarHBondContact O-N 2.78Å; I501-Q504 VanDerWaalsContact O-N 3.13Å; Q504-H507 PolarHBondContact O-N 3.36Å; Q504-K508 WeakPolarHBondContact O-CG 3.38Å; Q504-K508 PolarHBondContact O-N 3.49Å; Q504-Y684 HydrophobicContact CB-CD1 3.68Å; Q504-Y684 HydrophobicContact CB-CD2 3.76Å; Q504-Y684 HydrophobicContact CB-CE1 3.63Å; Q504-Y684 HydrophobicContact CB-CE2 3.71Å; Q504-Y684 HydrophobicContact CB-CG 3.73Å; Q504-Y684 HydrophobicContact CG-CE1 4.29Å; Q504-Y684 HydrophobicContact CG-CE2 4.06Å
505	E	94.1	Very high	94.4	Very high	89 Å²	89	58.2 Å²	58.2	42%	0.416	28%	0.279	S	S	.	.	H	α-helix	trans	-56.7	-51.5	172	-70.2	174.9	159.2	0	0	111.6	I501 H507 K508 I509 Y684	I501-E505 WeakPolarHBondContact O-CG 3.49Å; I501-E505 PolarHBondContact O-N 3.2Å; E505-H507 VanDerWaalsContact C-N 3.29Å; E505-H507 PolarHBondContact O-N 3.43Å; E505-K508 PolarHBondContact O-N 3.09Å; E505-I509 WeakPolarHBondContact O-CG1 3.3Å; E505-I509 PolarHBondContact O-N 2.99Å; E505-I509 VanDerWaalsContact O-N 3.17Å; E505-Y684 HydrophobicContact CG-CD1 3.95Å
506	K	93.8	Very high	94.3	Very high	112 Å²	112	62.6 Å²	62.6	49%	0.487	29%	0.292	S	S	.	.	H	α-helix	trans	-58.8	-41.2	175.4	-170.3	-154.7	175	-146.2	0	111.3	E90 K502 Y503 I509 Q510	E90-K506 IonicContact OE2-NZ 3.76Å; E90-K506 PolarHBondContact OE2-NZ 3.15Å; K502-K506 WeakPolarHBondContact O-CB 3.33Å; K502-K506 PolarHBondContact O-N 3.44Å; Y503-K506 PolarHBondContact O-N 3.02Å; K506-I509 WeakPolarHBondContact O-CB 3.34Å; K506-I509 PolarHBondContact O-N 3.42Å; K506-Q510 PolarHBondContact O-N 3.06Å
507	H	93	Very high	94.2	Very high	61 Å²	61	68.2 Å²	68.2	28%	0.282	32%	0.316	S	S	.	.	H	α-helix	trans	-63.4	-45.2	179.7	-176.9	-155.5	0	0	0	111.9	Y503 Q504 E505 I509 Q510 L511	Y503-H507 WeakPolarHBondContact O-CB 3.2Å; Y503-H507 PolarHBondContact O-N 2.8Å; Q504-H507 PolarHBondContact O-N 3.36Å; E505-H507 VanDerWaalsContact C-N 3.29Å; E505-H507 PolarHBondContact O-N 3.43Å; H507-I509 VanDerWaalsContact C-N 3.29Å; H507-I509 PolarHBondContact O-N 2.53Å; H507-Q510 PolarHBondContact O-N 3.03Å; H507-Q510 VanDerWaalsContact O-N 3.14Å; H507-L511 WeakPolarHBondContact O-CG 3.47Å; H507-L511 PolarHBondContact O-N 3.37Å
508	K	91.9	Very high	94.2	Very high	58 Å²	58	71.7 Å²	71.7	25%	0.252	33%	0.334	S	S	.	.	H	α-helix	trans	-63.4	-34.2	175.5	-56.2	-43.6	-179.4	-169.6	0	112.2	Q504 E505 L511 K512	Q504-K508 WeakPolarHBondContact O-CG 3.38Å; Q504-K508 PolarHBondContact O-N 3.49Å; E505-K508 PolarHBondContact O-N 3.09Å; K508-L511 HydrophobicContact CD-CD1 4.12Å; K508-K512 WeakPolarHBondContact O-CG 3.36Å; K508-K512 PolarHBondContact O-N 3.3Å; K508-K512 VanDerWaalsContact O-N 3.08Å
509	I	91.5	Very high	94.1	Very high	102 Å²	102	71.1 Å²	71.1	52%	0.523	33%	0.333	S	S	.	.	H	α-helix	trans	-63.3	-45.7	172.2	-65.1	167.9	0	0	0	111	E505 K506 H507 L511 K512 I513	E505-I509 WeakPolarHBondContact O-CG1 3.3Å; E505-I509 PolarHBondContact O-N 2.99Å; E505-I509 VanDerWaalsContact O-N 3.17Å; K506-I509 WeakPolarHBondContact O-CB 3.34Å; K506-I509 PolarHBondContact O-N 3.42Å; H507-I509 VanDerWaalsContact C-N 3.29Å; H507-I509 PolarHBondContact O-N 2.53Å; I509-L511 PolarHBondContact O-N 3.26Å; I509-K512 PolarHBondContact O-N 2.74Å; I509-I513 HydrophobicContact CG2-CD1 4.02Å; I509-I513 WeakPolarHBondContact O-CG1 3.31Å; I509-I513 PolarHBondContact O-N 2.9Å
510	Q	92.3	Very high	94.2	Very high	69 Å²	69	68.9 Å²	68.9	32%	0.322	33%	0.326	S	S	.	.	H	α-helix	trans	-61.7	-42.7	177.8	-175	74.3	-53.1	0	0	111.9	E90 K506 H507 K512 I513 T514	E90-Q510 PolarHBondContact OE1-NE2 2.78Å; K506-Q510 PolarHBondContact O-N 3.06Å; H507-Q510 PolarHBondContact O-N 3.03Å; H507-Q510 VanDerWaalsContact O-N 3.14Å; Q510-K512 VanDerWaalsContact C-N 3.34Å; Q510-K512 PolarHBondContact O-N 2.85Å; Q510-I513 WeakPolarHBondContact O-CB 3.4Å; Q510-I513 PolarHBondContact O-N 2.88Å; Q510-T514 PolarHBondContact O-N 2.76Å; Q510-T514 PolarHBondContact O-OG1 2.99Å
511	L	92.6	Very high	94.2	Very high	68 Å²	68	73.9 Å²	73.9	36%	0.356	35%	0.348	S	S	.	.	H	α-helix	trans	-59.1	-43.2	174	-70.1	171	0	0	0	111.9	H507 K508 I509 I513 T514 H515 P680	H507-L511 WeakPolarHBondContact O-CG 3.47Å; H507-L511 PolarHBondContact O-N 3.37Å; K508-L511 HydrophobicContact CD-CD1 4.12Å; I509-L511 PolarHBondContact O-N 3.26Å; L511-I513 PolarHBondContact O-N 2.89Å; L511-T514 PolarHBondContact O-N 2.78Å; L511-H515 WeakPolarHBondContact O-CB 3.12Å; L511-H515 PolarHBondContact O-N 3.21Å; L511-P680 HydrophobicContact CB-CB 4.44Å
512	K	92.8	Very high	94.1	Very high	44 Å²	44	74.7 Å²	74.7	19%	0.191	35%	0.353	C	S	.	.	H	α-helix	trans	-64.7	-35.3	175.4	-74.3	170.2	52.6	164.8	0	112.9	K508 I509 Q510 R516 P680 D682	K508-K512 WeakPolarHBondContact O-CG 3.36Å; K508-K512 PolarHBondContact O-N 3.3Å; K508-K512 VanDerWaalsContact O-N 3.08Å; I509-K512 PolarHBondContact O-N 2.74Å; Q510-K512 VanDerWaalsContact C-N 3.34Å; Q510-K512 PolarHBondContact O-N 2.85Å; K512-R516 WeakPolarHBondContact O-CB 3.15Å; K512-R516 VanDerWaalsContact O-CG 3.26Å; K512-R516 WeakPolarHBondContact O-CG 3.47Å; K512-R516 PolarHBondContact O-N 3.24Å; K512-R516 VanDerWaalsContact O-N 3.12Å; K512-P680 HydrophobicContact CG-CB 4.08Å; K512-P680 HydrophobicContact CG-CG 4.49Å; K512-D682 PolarHBondContact NZ-O 3.28Å; K512-D682 IonicContact NZ-OD1 3.93Å; K512-D682 PolarHBondContact NZ-OD1 2.91Å
513	I	93.2	Very high	94.2	Very high	68 Å²	68	72.5 Å²	72.5	35%	0.349	35%	0.346	S	S	.	.	H	α-helix	trans	-65.9	-46.2	173.5	-70.1	167.4	0	0	0	110.5	I509 Q510 L511 R516 K517	I509-I513 HydrophobicContact CG2-CD1 4.02Å; I509-I513 WeakPolarHBondContact O-CG1 3.31Å; I509-I513 PolarHBondContact O-N 2.9Å; Q510-I513 WeakPolarHBondContact O-CB 3.4Å; Q510-I513 PolarHBondContact O-N 2.88Å; L511-I513 PolarHBondContact O-N 2.89Å; I513-R516 PolarHBondContact O-N 2.96Å; I513-K517 HydrophobicContact CG2-CD 3.98Å; I513-K517 VanDerWaalsContact CG2-CE 3.5Å; I513-K517 WeakPolarHBondContact O-CB 3.2Å; I513-K517 VanDerWaalsContact O-CG 3.32Å; I513-K517 WeakPolarHBondContact O-CG 3.34Å; I513-K517 PolarHBondContact O-N 3.13Å
514	T	94.2	Very high	94.3	Very high	80 Å²	80	73.7 Å²	73.7	49%	0.491	36%	0.357	S	S	.	.	H	α-helix	trans	-63.8	-44.5	179	-64.8	0	0	0	0	112.2	Q510 L511 K517 L518	Q510-T514 PolarHBondContact O-N 2.76Å; Q510-T514 PolarHBondContact O-OG1 2.99Å; L511-T514 PolarHBondContact O-N 2.78Å; T514-K517 PolarHBondContact O-N 2.91Å; T514-L518 PolarHBondContact O-N 2.94Å
515	H	93.9	Very high	94.4	Very high	32 Å²	32	79.5 Å²	79.5	15%	0.148	38%	0.378	C	S	.	.	H	α-helix	trans	-58.8	-47.9	175.3	178.7	-97.6	0	0	0	112.3	L511 K517 L518 I519 L675 E678 P680	L511-H515 WeakPolarHBondContact O-CB 3.12Å; L511-H515 PolarHBondContact O-N 3.21Å; H515-K517 PolarHBondContact O-N 3.05Å; H515-L518 PolarHBondContact O-N 3.03Å; H515-I519 WeakPolarHBondContact CE1-CD1 3.5Å; H515-I519 PolarHBondContact O-N 3.28Å; H515-L675 PolarHBondContact CE1-O 2.91Å; H515-L675 PolarHBondContact NE2-O 3.46Å; H515-E678 PolarHBondContact NE2-O 3.49Å; H515-P680 HydrophobicContact CB-CG 3.9Å
516	R	93.9	Very high	94.5	Very high	170 Å²	170	77.8 Å²	77.8	64%	0.642	37%	0.369	S	S	*	.	H	α-helix	trans	-63.3	-40	176.4	-72.8	174.6	179.1	-167.1	0.1	112.8	K512 I513 I519 S520	K512-R516 WeakPolarHBondContact O-CB 3.15Å; K512-R516 VanDerWaalsContact O-CG 3.26Å; K512-R516 WeakPolarHBondContact O-CG 3.47Å; K512-R516 PolarHBondContact O-N 3.24Å; K512-R516 VanDerWaalsContact O-N 3.12Å; I513-R516 PolarHBondContact O-N 2.96Å; R516-I519 PolarHBondContact O-N 2.78Å; R516-S520 PolarHBondContact O-N 2.9Å
517	K	95.7	Very high	94.7	Very high	124 Å²	124	76.5 Å²	76.5	54%	0.539	37%	0.368	S	S	.	.	H	α-helix	trans	-60.3	-44	174.3	-77.3	170.4	178.2	172.1	0	111.6	I513 T514 H515 S520 Q521	I513-K517 HydrophobicContact CG2-CD 3.98Å; I513-K517 VanDerWaalsContact CG2-CE 3.5Å; I513-K517 WeakPolarHBondContact O-CB 3.2Å; I513-K517 VanDerWaalsContact O-CG 3.32Å; I513-K517 WeakPolarHBondContact O-CG 3.34Å; I513-K517 PolarHBondContact O-N 3.13Å; T514-K517 PolarHBondContact O-N 2.91Å; H515-K517 PolarHBondContact O-N 3.05Å; K517-S520 PolarHBondContact O-N 3.09Å; K517-Q521 WeakPolarHBondContact O-CG 3.42Å; K517-Q521 PolarHBondContact O-N 3.44Å
518	L	95	Very high	94.8	Very high	77 Å²	77	75.9 Å²	75.9	40%	0.403	37%	0.371	S	S	.	.	H	α-helix	trans	-66	-40.3	178.5	-173.4	62.2	0	0	0	112.1	T514 H515 Q521 L522 L675	T514-L518 PolarHBondContact O-N 2.94Å; H515-L518 PolarHBondContact O-N 3.03Å; L518-Q521 PolarHBondContact O-N 2.92Å; L518-L522 WeakPolarHBondContact O-CG 3.48Å; L518-L522 PolarHBondContact O-N 3.29Å; L518-L522 VanDerWaalsContact O-N 3.13Å; L518-L675 HydrophobicContact CB-CD1 4.33Å; L518-L675 HydrophobicContact CD2-CD1 3.57Å; L518-L675 HydrophobicContact CD2-CD2 3.96Å; L518-L675 HydrophobicContact CD2-CG 4.42Å; L518-L675 HydrophobicContact CG-CD1 3.63Å
519	I	95.8	Very high	95	Very high	26 Å²	26	73.3 Å²	73.3	13%	0.133	36%	0.359	C	S	.	.	H	α-helix	trans	-60.9	-44.9	172.2	-74.1	175.4	0	0	0	111.3	H515 R516 Q521 L522 L523 L672 L675 L676	H515-I519 WeakPolarHBondContact CE1-CD1 3.5Å; H515-I519 PolarHBondContact O-N 3.28Å; R516-I519 PolarHBondContact O-N 2.78Å; I519-Q521 PolarHBondContact O-N 3.1Å; I519-L522 PolarHBondContact O-N 3.27Å; I519-L523 HydrophobicContact CG2-CD1 3.88Å; I519-L523 HydrophobicContact CG2-CG 4.36Å; I519-L523 WeakPolarHBondContact O-CG 3.42Å; I519-L523 PolarHBondContact O-N 3.37Å; I519-L672 HydrophobicContact CG1-CD1 4.44Å; I519-L672 HydrophobicContact CG2-CD1 3.99Å; I519-L675 HydrophobicContact CD1-CB 4.25Å; I519-L675 HydrophobicContact CG1-CB 4.01Å; I519-L675 HydrophobicContact CG1-CD1 4.16Å; I519-L676 HydrophobicContact CD1-CD2 4.01Å
520	S	95.9	Very high	95.3	Very high	56 Å²	56	71.8 Å²	71.8	39%	0.392	35%	0.352	S	S	.	.	H	α-helix	trans	-57.5	-50.6	176.3	-164.6	0	0	0	0	111.3	R516 K517 L522 L523 D524	R516-S520 PolarHBondContact O-N 2.9Å; K517-S520 PolarHBondContact O-N 3.09Å; S520-L522 VanDerWaalsContact C-N 3.25Å; S520-L522 PolarHBondContact O-N 3.09Å; S520-L523 CarbonylContact O-C 3.54Å; S520-L523 WeakPolarHBondContact O-CA 3.45Å; S520-L523 WeakPolarHBondContact O-CB 3.35Å; S520-L523 PolarHBondContact O-N 2.87Å; S520-D524 VanDerWaalsContact O-CG 3.28Å; S520-D524 PolarHBondContact O-N 2.75Å; S520-D524 PolarHBondContact OG-OD2 3.1Å
521	Q	96	Very high	95.4	Very high	124 Å²	124	73.4 Å²	73.4	58%	0.579	36%	0.363	S	S	*	.	H	α-helix	trans	-57.4	-36.5	179.3	-70.5	172.3	5.7	0	0	112.9	K517 L518 I519 R525	K517-Q521 WeakPolarHBondContact O-CG 3.42Å; K517-Q521 PolarHBondContact O-N 3.44Å; L518-Q521 PolarHBondContact O-N 2.92Å; I519-Q521 PolarHBondContact O-N 3.1Å; Q521-R525 VanDerWaalsContact O-CB 3.24Å; Q521-R525 WeakPolarHBondContact O-CB 3.02Å; Q521-R525 PolarHBondContact O-N 3.09Å
522	L	96	Very high	95.6	Very high	18 Å²	18	73.7 Å²	73.7	9%	0.094	36%	0.363	C	S	.	.	H	α-helix	trans	-72.8	-35.3	174	-68.8	177.4	0	0	0	112.9	L518 I519 S520 R525 K526 V668 Q671 L675	L518-L522 WeakPolarHBondContact O-CG 3.48Å; L518-L522 PolarHBondContact O-N 3.29Å; L518-L522 VanDerWaalsContact O-N 3.13Å; I519-L522 PolarHBondContact O-N 3.27Å; S520-L522 VanDerWaalsContact C-N 3.25Å; S520-L522 PolarHBondContact O-N 3.09Å; L522-R525 PolarHBondContact O-N 3.2Å; L522-K526 WeakPolarHBondContact O-CB 3.42Å; L522-K526 PolarHBondContact O-N 3.25Å; L522-V668 HydrophobicContact CB-CG1 4.38Å; L522-V668 HydrophobicContact CD2-CG1 4.35Å; L522-V668 WeakPolarHBondContact O-CG1 3.48Å; L522-Q671 HydrophobicContact CD1-CB 3.8Å; L522-Q671 HydrophobicContact CD2-CB 4.2Å; L522-L675 HydrophobicContact CD1-CD1 3.64Å
523	L	96.7	Very high	95.7	Very high	68 Å²	68	72.8 Å²	72.8	36%	0.356	36%	0.359	S	S	.	.	H	α-helix	trans	-67.8	-43.8	174.1	-70.3	172.1	0	0	0	111.6	I519 S520 R525 K526 N527 L672	I519-L523 HydrophobicContact CG2-CD1 3.88Å; I519-L523 HydrophobicContact CG2-CG 4.36Å; I519-L523 WeakPolarHBondContact O-CG 3.42Å; I519-L523 PolarHBondContact O-N 3.37Å; S520-L523 CarbonylContact O-C 3.54Å; S520-L523 WeakPolarHBondContact O-CA 3.45Å; S520-L523 WeakPolarHBondContact O-CB 3.35Å; S520-L523 PolarHBondContact O-N 2.87Å; L523-R525 VanDerWaalsContact C-N 3.32Å; L523-R525 PolarHBondContact O-N 3.34Å; L523-K526 WeakPolarHBondContact O-CB 3.41Å; L523-K526 PolarHBondContact O-N 3.07Å; L523-K526 VanDerWaalsContact O-N 3.15Å; L523-N527 PolarHBondContact O-N 2.73Å; L523-N527 PolarHBondContact O-ND2 2.57Å; L523-L672 HydrophobicContact CD2-CD1 4.3Å; L523-L672 HydrophobicContact CD2-CD2 3.76Å; L523-L672 HydrophobicContact CG-CD1 4.36Å
524	D	97.2	Very high	95.8	Very high	92 Å²	92	74.3 Å²	74.3	49%	0.492	37%	0.371	S	S	.	.	H	α-helix	trans	-61.2	-42.6	174.2	-63.3	-42.2	0	0	0	110.8	S520 K526 N527 S528	S520-D524 VanDerWaalsContact O-CG 3.28Å; S520-D524 PolarHBondContact O-N 2.75Å; S520-D524 PolarHBondContact OG-OD2 3.1Å; D524-K526 PolarHBondContact O-N 2.93Å; D524-N527 PolarHBondContact O-N 3.38Å; D524-S528 WeakPolarHBondContact O-CB 3.42Å; D524-S528 PolarHBondContact O-N 2.78Å
525	R	96.6	Very high	95.8	Very high	131 Å²	131	75.3 Å²	75.3	49%	0.494	37%	0.373	S	S	.	.	H	α-helix	trans	-64.6	-38.4	174.3	-173.7	56.9	174.4	169.9	-1	112.5	Q521 L522 L523 L529 V668	Q521-R525 VanDerWaalsContact O-CB 3.24Å; Q521-R525 WeakPolarHBondContact O-CB 3.02Å; Q521-R525 PolarHBondContact O-N 3.09Å; L522-R525 PolarHBondContact O-N 3.2Å; L523-R525 VanDerWaalsContact C-N 3.32Å; L523-R525 PolarHBondContact O-N 3.34Å; R525-L529 HydrophobicContact CG-CD1 4.32Å; R525-L529 WeakPolarHBondContact O-CB 3.47Å; R525-L529 VanDerWaalsContact O-CG 3.29Å; R525-L529 WeakPolarHBondContact O-CG 3.47Å; R525-L529 PolarHBondContact O-N 3Å; R525-V668 HydrophobicContact CG-CG2 3.98Å
526	K	97.1	Very high	95.7	Very high	53 Å²	53	75.4 Å²	75.4	23%	0.23	37%	0.373	C	S	.	.	H	α-helix	trans	-65.7	-44.8	176.2	175.7	169	174.1	164.7	0	111.6	L522 L523 D524 L529 L530 L665 V668 N669 L672	L522-K526 WeakPolarHBondContact O-CB 3.42Å; L522-K526 PolarHBondContact O-N 3.25Å; L523-K526 WeakPolarHBondContact O-CB 3.41Å; L523-K526 PolarHBondContact O-N 3.07Å; L523-K526 VanDerWaalsContact O-N 3.15Å; D524-K526 PolarHBondContact O-N 2.93Å; K526-L529 PolarHBondContact O-N 3.13Å; K526-L530 HydrophobicContact CG-CD1 4.06Å; K526-L530 VanDerWaalsContact O-CG 3.3Å; K526-L530 WeakPolarHBondContact O-CG 3.42Å; K526-L530 PolarHBondContact O-N 2.77Å; K526-L665 HydrophobicContact CG-CD1 3.93Å; K526-V668 HydrophobicContact CB-CG1 3.9Å; K526-N669 WeakPolarHBondContact CE-OD1 3.5Å; K526-N669 PolarHBondContact NZ-OD1 2.69Å; K526-L672 HydrophobicContact CD-CD2 4.3Å
527	N	96.5	Very high	95.8	Very high	86 Å²	86	74.2 Å²	74.2	46%	0.46	37%	0.369	S	S	.	.	H	α-helix	trans	-59.9	-51.5	175.1	-67	-21.4	0	0	0	110.5	L523 D524 L529 L530 D531	L523-N527 PolarHBondContact O-N 2.73Å; L523-N527 PolarHBondContact O-ND2 2.57Å; D524-N527 PolarHBondContact O-N 3.38Å; N527-L529 VanDerWaalsContact C-N 3.26Å; N527-L529 PolarHBondContact O-N 2.92Å; N527-L530 WeakPolarHBondContact O-CB 3.12Å; N527-L530 PolarHBondContact O-N 2.72Å; N527-D531 PolarHBondContact O-N 2.97Å
528	S	96.5	Very high	95.7	Very high	48 Å²	48	75 Å²	75	34%	0.336	37%	0.372	S	S	.	.	H	α-helix	trans	-55.9	-37.1	176.5	-178.1	0	0	0	0	113.4	D524 Q532	D524-S528 WeakPolarHBondContact O-CB 3.42Å; D524-S528 PolarHBondContact O-N 2.78Å; S528-Q532 WeakPolarHBondContact O-CG 3.29Å; S528-Q532 PolarHBondContact O-N 3.43Å; S528-Q532 PolarHBondContact O-NE2 3.27Å; S528-Q532 PolarHBondContact OG-NE2 3.27Å
529	L	96.1	Very high	95.7	Very high	3 Å²	3	74.5 Å²	74.5	2%	0.016	37%	0.37	C	S	.	.	H	α-helix	trans	-72	-39.5	174.7	-74.9	168.3	0	0	0	112.6	R525 K526 N527 Q532 M533 L661 A664 V668	R525-L529 HydrophobicContact CG-CD1 4.32Å; R525-L529 WeakPolarHBondContact O-CB 3.47Å; R525-L529 VanDerWaalsContact O-CG 3.29Å; R525-L529 WeakPolarHBondContact O-CG 3.47Å; R525-L529 PolarHBondContact O-N 3Å; K526-L529 PolarHBondContact O-N 3.13Å; N527-L529 VanDerWaalsContact C-N 3.26Å; N527-L529 PolarHBondContact O-N 2.92Å; L529-Q532 PolarHBondContact O-N 2.84Å; L529-M533 VanDerWaalsContact O-CG 3.29Å; L529-M533 WeakPolarHBondContact O-CG 3.46Å; L529-M533 PolarHBondContact O-N 2.92Å; L529-L661 HydrophobicContact CD2-CD2 4.02Å; L529-A664 HydrophobicContact CD1-CB 3.94Å; L529-A664 HydrophobicContact CD2-CB 3.81Å; L529-V668 HydrophobicContact CD1-CB 4.44Å; L529-V668 HydrophobicContact CD1-CG2 3.87Å
530	L	96.3	Very high	95.6	Very high	71 Å²	71	74.6 Å²	74.6	37%	0.372	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-42.4	176.8	-73	167.4	0	0	0	111.5	K526 N527 Q532 M533 V534 L665	K526-L530 HydrophobicContact CG-CD1 4.06Å; K526-L530 VanDerWaalsContact O-CG 3.3Å; K526-L530 WeakPolarHBondContact O-CG 3.42Å; K526-L530 PolarHBondContact O-N 2.77Å; N527-L530 WeakPolarHBondContact O-CB 3.12Å; N527-L530 PolarHBondContact O-N 2.72Å; L530-Q532 PolarHBondContact O-N 2.98Å; L530-M533 CarbonylContact O-C 3.58Å; L530-M533 PolarHBondContact O-N 3.5Å; L530-M533 VanDerWaalsContact O-N 3.15Å; L530-V534 WeakPolarHBondContact O-CG2 3.47Å; L530-V534 PolarHBondContact O-N 2.85Å; L530-L665 HydrophobicContact CD2-CD1 4.26Å; L530-L665 HydrophobicContact CD2-CD2 3.74Å; L530-L665 HydrophobicContact CG-CD1 4.25Å
531	D	96.3	Very high	95.6	Very high	103 Å²	103	75.9 Å²	75.9	55%	0.551	37%	0.37	S	S	*	.	H	α-helix	trans	-60.3	-45.9	175.7	-68	-35.5	0	0	0	111.8	N527 M533 V534 I535	N527-D531 PolarHBondContact O-N 2.97Å; D531-M533 VanDerWaalsContact C-N 3.31Å; D531-M533 PolarHBondContact O-N 3.27Å; D531-V534 PolarHBondContact O-N 3.46Å; D531-I535 WeakPolarHBondContact O-CG1 3.47Å; D531-I535 PolarHBondContact O-N 2.98Å
532	Q	95.2	Very high	95.5	Very high	74 Å²	74	72.5 Å²	72.5	35%	0.346	36%	0.358	S	S	.	.	H	α-helix	trans	-60.7	-39.6	174.1	-72.6	168.4	72	0	0	111.9	S528 L529 L530 I535 E536 L661	S528-Q532 WeakPolarHBondContact O-CG 3.29Å; S528-Q532 PolarHBondContact O-N 3.43Å; S528-Q532 PolarHBondContact O-NE2 3.27Å; S528-Q532 PolarHBondContact OG-NE2 3.27Å; L529-Q532 PolarHBondContact O-N 2.84Å; L530-Q532 PolarHBondContact O-N 2.98Å; Q532-I535 PolarHBondContact O-N 3.1Å; Q532-E536 PolarHBondContact O-N 2.72Å; Q532-L661 HydrophobicContact CB-CD1 3.83Å; Q532-L661 HydrophobicContact CB-CD2 3.98Å
533	M	94.8	Very high	95.4	Very high	24 Å²	24	72.2 Å²	72.2	12%	0.118	36%	0.359	C	S	.	.	H	α-helix	trans	-68.8	-32.7	176.2	-73	179.1	72.7	0	0	112.9	L529 L530 D531 R537 F658 L661 Q662 L665	L529-M533 VanDerWaalsContact O-CG 3.29Å; L529-M533 WeakPolarHBondContact O-CG 3.46Å; L529-M533 PolarHBondContact O-N 2.92Å; L530-M533 CarbonylContact O-C 3.58Å; L530-M533 PolarHBondContact O-N 3.5Å; L530-M533 VanDerWaalsContact O-N 3.15Å; D531-M533 VanDerWaalsContact C-N 3.31Å; D531-M533 PolarHBondContact O-N 3.27Å; M533-R537 WeakPolarHBondContact O-CB 3.38Å; M533-R537 PolarHBondContact O-N 3.46Å; M533-F658 HydrophobicContact CB-CE2 3.98Å; M533-F658 HydrophobicContact CE-CE1 3.94Å; M533-F658 HydrophobicContact CE-CE2 3.75Å; M533-F658 HydrophobicContact CE-CZ 3.37Å; M533-F658 HydrophobicContact CG-CE2 4.2Å; M533-L661 HydrophobicContact CG-CB 3.49Å; M533-L661 VanDerWaalsContact CG-CB 3.49Å; M533-L661 HydrophobicContact CG-CD1 4.02Å; M533-L661 HydrophobicContact CG-CG 4.38Å; M533-L661 HydrophobicContact SD-CB 4.09Å; M533-Q662 HydrophobicContact CE-CB 4.01Å; M533-Q662 HydrophobicContact CE-CG 4.33Å; M533-L665 HydrophobicContact CE-CD2 4.15Å; M533-L665 HydrophobicContact SD-CB 4.03Å; M533-L665 HydrophobicContact SD-CD2 3.58Å; M533-L665 VanDerWaalsContact SD-CD2 3.58Å; M533-L665 HydrophobicContact SD-CG 4.43Å
534	V	95.3	Very high	95.3	Very high	100 Å²	100	74.4 Å²	74.4	61%	0.606	36%	0.363	S	S	*	.	H	α-helix	trans	-66.4	-41.9	172.4	169.4	0	0	0	0	110.9	L530 D531 K538	L530-V534 WeakPolarHBondContact O-CG2 3.47Å; L530-V534 PolarHBondContact O-N 2.85Å; D531-V534 PolarHBondContact O-N 3.46Å; V534-K538 PolarHBondContact O-N 2.82Å; V534-K538 VanDerWaalsContact O-N 3.08Å
535	I	94.4	Very high	95.2	Very high	101 Å²	101	76.2 Å²	76.2	52%	0.518	37%	0.368	S	S	.	.	H	α-helix	trans	-62.8	-52.8	176.3	-66.7	165.2	0	0	0	110.8	D531 Q532 R537 K538 N539	D531-I535 WeakPolarHBondContact O-CG1 3.47Å; D531-I535 PolarHBondContact O-N 2.98Å; Q532-I535 PolarHBondContact O-N 3.1Å; I535-R537 VanDerWaalsContact C-N 3.34Å; I535-R537 PolarHBondContact O-N 2.86Å; I535-K538 WeakPolarHBondContact O-CB 3.24Å; I535-K538 PolarHBondContact O-N 3.34Å; I535-N539 PolarHBondContact O-N 2.81Å; I535-N539 VanDerWaalsContact O-N 3.09Å
536	E	93.2	Very high	95	Very high	34 Å²	34	75.7 Å²	75.7	16%	0.159	37%	0.369	C	S	.	.	H	α-helix	trans	-70.5	-28.9	-178.9	-70.5	-62.7	171.1	0	0	112.9	Q532 N539 I540 K657 F658 L661	Q532-E536 PolarHBondContact O-N 2.72Å; E536-N539 VanDerWaalsContact CD-ND2 3.31Å; E536-N539 WeakPolarHBondContact O-CB 3.42Å; E536-N539 PolarHBondContact O-N 3.17Å; E536-N539 PolarHBondContact OE2-ND2 3Å; E536-I540 WeakPolarHBondContact O-CG1 3.49Å; E536-I540 PolarHBondContact O-N 2.92Å; E536-K657 HydrophobicContact CG-CB 4.04Å; E536-K657 WeakPolarHBondContact OE1-CD 3.5Å; E536-F658 HydrophobicContact CB-CB 4.43Å; E536-F658 HydrophobicContact CB-CD2 4.3Å; E536-L661 HydrophobicContact CB-CD1 4.46Å; E536-L661 HydrophobicContact CG-CD1 4.14Å
537	R	95	Very high	95	Very high	146 Å²	146	76 Å²	76	55%	0.551	37%	0.37	S	S	*	.	H	α-helix	trans	-60	-45.2	168.7	175.5	178.1	169.1	166.4	1.4	111.5	M533 I535 N539 I540 E541 F658	M533-R537 WeakPolarHBondContact O-CB 3.38Å; M533-R537 PolarHBondContact O-N 3.46Å; I535-R537 VanDerWaalsContact C-N 3.34Å; I535-R537 PolarHBondContact O-N 2.86Å; R537-N539 VanDerWaalsContact C-N 3.26Å; R537-N539 PolarHBondContact O-N 2.83Å; R537-I540 WeakPolarHBondContact O-CB 3.44Å; R537-I540 PolarHBondContact O-N 2.73Å; R537-I540 VanDerWaalsContact O-N 3.15Å; R537-E541 HydrophobicContact CG-CG 4.45Å; R537-E541 IonicContact CZ-OE1 3.27Å; R537-E541 VanDerWaalsContact CZ-OE1 3.27Å; R537-E541 IonicContact NE-OE1 2.75Å; R537-E541 PolarHBondContact NE-OE1 2.88Å; R537-E541 IonicContact NH2-OE1 2.86Å; R537-E541 PolarHBondContact NH2-OE1 2.95Å; R537-E541 WeakPolarHBondContact O-CG 3.26Å; R537-E541 PolarHBondContact O-N 2.72Å; R537-F658 HydrophobicContact CB-CE2 4.32Å
538	K	94.7	Very high	94.8	Very high	141 Å²	141	75.7 Å²	75.7	61%	0.613	37%	0.365	S	S	*	.	H	α-helix	trans	-63.2	-34	176.2	-172.2	178.7	-179.5	179.6	0	111.9	V534 I535 T542	V534-K538 PolarHBondContact O-N 2.82Å; V534-K538 VanDerWaalsContact O-N 3.08Å; I535-K538 WeakPolarHBondContact O-CB 3.24Å; I535-K538 PolarHBondContact O-N 3.34Å; K538-T542 VanDerWaalsContact O-CB 3.3Å; K538-T542 WeakPolarHBondContact O-CB 3.44Å; K538-T542 PolarHBondContact O-N 3.36Å; K538-T542 PolarHBondContact O-OG1 2.86Å
539	N	94.1	Very high	94.5	Very high	66 Å²	66	77 Å²	77	35%	0.353	37%	0.374	S	S	.	.	H	α-helix	trans	-65	-44	172.3	-65.6	-22.9	0	0	0	111.6	I535 E536 R537 T542 A543 A654	I535-N539 PolarHBondContact O-N 2.81Å; I535-N539 VanDerWaalsContact O-N 3.09Å; E536-N539 VanDerWaalsContact CD-ND2 3.31Å; E536-N539 WeakPolarHBondContact O-CB 3.42Å; E536-N539 PolarHBondContact O-N 3.17Å; E536-N539 PolarHBondContact OE2-ND2 3Å; R537-N539 VanDerWaalsContact C-N 3.26Å; R537-N539 PolarHBondContact O-N 2.83Å; N539-T542 PolarHBondContact O-N 3.15Å; N539-A543 WeakPolarHBondContact O-CB 3.33Å; N539-A543 PolarHBondContact O-N 3.38Å; N539-A654 HydrophobicContact CB-CB 4.39Å
540	I	94.4	Very high	94.2	Very high	27 Å²	27	77.5 Å²	77.5	14%	0.138	38%	0.378	C	S	.	.	H	α-helix	trans	-61.4	-48.6	175.1	-69.2	164.1	0	0	0	111	E536 R537 T542 A543 Y544 L651 A654 W655 F658	E536-I540 WeakPolarHBondContact O-CG1 3.49Å; E536-I540 PolarHBondContact O-N 2.92Å; R537-I540 WeakPolarHBondContact O-CB 3.44Å; R537-I540 PolarHBondContact O-N 2.73Å; R537-I540 VanDerWaalsContact O-N 3.15Å; I540-T542 PolarHBondContact O-N 3.4Å; I540-A543 PolarHBondContact O-N 2.74Å; I540-Y544 WeakPolarHBondContact O-CB 3.46Å; I540-Y544 PolarHBondContact O-N 2.68Å; I540-L651 HydrophobicContact CG2-CD1 4.01Å; I540-A654 HydrophobicContact CG1-CB 3.67Å; I540-W655 HydrophobicContact CD1-CE3 4.03Å; I540-F658 HydrophobicContact CD1-CB 3.68Å; I540-F658 HydrophobicContact CD1-CD2 4.14Å; I540-F658 HydrophobicContact CD1-CG 3.91Å
541	E	94.7	Very high	93.9	Very high	83 Å²	83	75.3 Å²	75.3	39%	0.388	37%	0.369	S	S	.	.	H	α-helix	trans	-59.4	-47	178.1	-72	169.4	167.9	0	0	110.8	R537 A543 Y544 E545	R537-E541 HydrophobicContact CG-CG 4.45Å; R537-E541 IonicContact CZ-OE1 3.27Å; R537-E541 VanDerWaalsContact CZ-OE1 3.27Å; R537-E541 IonicContact NE-OE1 2.75Å; R537-E541 PolarHBondContact NE-OE1 2.88Å; R537-E541 IonicContact NH2-OE1 2.86Å; R537-E541 PolarHBondContact NH2-OE1 2.95Å; R537-E541 WeakPolarHBondContact O-CG 3.26Å; R537-E541 PolarHBondContact O-N 2.72Å; E541-A543 VanDerWaalsContact C-N 3.34Å; E541-A543 PolarHBondContact O-N 2.8Å; E541-Y544 PolarHBondContact O-N 2.73Å; E541-E545 WeakPolarHBondContact O-CG 3.42Å; E541-E545 PolarHBondContact O-N 3.38Å
542	T	94.5	Very high	93.4	Very high	53 Å²	53	76.1 Å²	76.1	33%	0.325	37%	0.368	S	S	.	.	H	α-helix	trans	-62.7	-36.1	176.3	-56.1	0	0	0	0	113	K538 N539 I540 K546	K538-T542 VanDerWaalsContact O-CB 3.3Å; K538-T542 WeakPolarHBondContact O-CB 3.44Å; K538-T542 PolarHBondContact O-N 3.36Å; K538-T542 PolarHBondContact O-OG1 2.86Å; N539-T542 PolarHBondContact O-N 3.15Å; I540-T542 PolarHBondContact O-N 3.4Å; T542-K546 WeakPolarHBondContact O-CD 3.45Å; T542-K546 WeakPolarHBondContact O-CG 3.37Å
543	A	93.3	Very high	92.9	Very high	13 Å²	13	74.8 Å²	74.8	11%	0.107	37%	0.37	C	S	.	.	H	α-helix	trans	-72.7	-39.4	176.2	0	0	0	0	0	111.6	N539 I540 E541 W547 L651	N539-A543 WeakPolarHBondContact O-CB 3.33Å; N539-A543 PolarHBondContact O-N 3.38Å; I540-A543 PolarHBondContact O-N 2.74Å; E541-A543 VanDerWaalsContact C-N 3.34Å; E541-A543 PolarHBondContact O-N 2.8Å; A543-W547 WeakPolarHBondContact O-CB 3.48Å; A543-W547 PolarHBondContact O-N 3.03Å; A543-L651 HydrophobicContact CB-CB 4.19Å; A543-L651 HydrophobicContact CB-CD1 4.03Å
544	Y	95.4	Very high	92.2	Very high	113 Å²	113	75.1 Å²	75.1	44%	0.443	37%	0.372	S	S	.	.	H	α-helix	trans	-63.9	-46.5	177.4	178.8	-90.8	0	0	0	111.9	I540 E541 K546 W547 H548 L651	I540-Y544 WeakPolarHBondContact O-CB 3.46Å; I540-Y544 PolarHBondContact O-N 2.68Å; E541-Y544 PolarHBondContact O-N 2.73Å; Y544-K546 VanDerWaalsContact C-N 3.33Å; Y544-K546 PolarHBondContact O-N 3.12Å; Y544-W547 HydrophobicContact CD2-CE3 4.14Å; Y544-W547 HydrophobicContact CD2-CZ3 4.34Å; Y544-W547 HydrophobicContact CE2-CE3 4.12Å; Y544-W547 AromaticContact CE2-CZ3 3.89Å; Y544-W547 HydrophobicContact CE2-CZ3 3.89Å; Y544-W547 PolarHBondContact O-N 3.41Å; Y544-H548 HydrophobicContact CD1-CB 4.47Å; Y544-H548 HydrophobicContact CE1-CB 4.13Å; Y544-H548 VanDerWaalsContact O-CB 3.22Å; Y544-H548 WeakPolarHBondContact O-CB 3.41Å; Y544-H548 PolarHBondContact O-N 3.03Å; Y544-L651 HydrophobicContact CD2-CD2 4.3Å
545	E	94.5	Very high	91.1	Very high	130 Å²	130	75.3 Å²	75.3	61%	0.607	37%	0.369	S	S	*	.	H	α-helix	trans	-58	-44.3	178.6	-74.9	-176.9	160.4	0	0	112.4	E541 S549	E541-E545 WeakPolarHBondContact O-CG 3.42Å; E541-E545 PolarHBondContact O-N 3.38Å; E545-S549 VanDerWaalsContact O-CB 3.28Å; E545-S549 WeakPolarHBondContact O-CB 3.43Å; E545-S549 PolarHBondContact O-N 2.9Å; E545-S549 PolarHBondContact O-OG 3.41Å
546	K	93.8	Very high	89.8	Confident	120 Å²	120	76.3 Å²	76.3	52%	0.522	38%	0.376	S	S	.	.	H	α-helix	trans	-62.9	-51.8	176.3	-67.6	169.8	-175.4	175.1	0	110.8	T542 Y544 H548 S549 A550 L647	T542-K546 WeakPolarHBondContact O-CD 3.45Å; T542-K546 WeakPolarHBondContact O-CG 3.37Å; Y544-K546 VanDerWaalsContact C-N 3.33Å; Y544-K546 PolarHBondContact O-N 3.12Å; K546-H548 PolarHBondContact O-N 2.84Å; K546-S549 PolarHBondContact O-N 3.2Å; K546-A550 PolarHBondContact O-N 2.97Å; K546-L647 HydrophobicContact CB-CD1 4.36Å; K546-L647 HydrophobicContact CB-CD2 3.96Å
547	W	95	Very high	88.2	Confident	61 Å²	61	80.8 Å²	80.8	23%	0.231	40%	0.397	C	S	.	.	H	α-helix	trans	-59.5	-46.2	179.1	172.1	77.3	0	0	0	112.4	A543 Y544 S549 A550 S551 L647 L651	A543-W547 WeakPolarHBondContact O-CB 3.48Å; A543-W547 PolarHBondContact O-N 3.03Å; Y544-W547 HydrophobicContact CD2-CE3 4.14Å; Y544-W547 HydrophobicContact CD2-CZ3 4.34Å; Y544-W547 HydrophobicContact CE2-CE3 4.12Å; Y544-W547 AromaticContact CE2-CZ3 3.89Å; Y544-W547 HydrophobicContact CE2-CZ3 3.89Å; Y544-W547 PolarHBondContact O-N 3.41Å; W547-S549 VanDerWaalsContact C-N 3.34Å; W547-S549 PolarHBondContact O-N 3.13Å; W547-A550 PolarHBondContact O-N 2.93Å; W547-S551 VanDerWaalsContact O-CB 3.26Å; W547-S551 WeakPolarHBondContact O-CB 3.32Å; W547-S551 PolarHBondContact O-N 3.18Å; W547-L647 HydrophobicContact CB-CB 3.95Å; W547-L651 HydrophobicContact CE3-CD2 4.44Å
548	H	92.7	Very high	86.2	Confident	79 Å²	79	77.5 Å²	77.5	37%	0.366	40%	0.396	S	S	.	.	H	α-helix	trans	-62.9	-41.2	179.1	-175.7	92.1	0	0	0	111.3	Y544 K546 S551 K552	Y544-H548 HydrophobicContact CD1-CB 4.47Å; Y544-H548 HydrophobicContact CE1-CB 4.13Å; Y544-H548 VanDerWaalsContact O-CB 3.22Å; Y544-H548 WeakPolarHBondContact O-CB 3.41Å; Y544-H548 PolarHBondContact O-N 3.03Å; K546-H548 PolarHBondContact O-N 2.84Å; H548-S551 PolarHBondContact O-N 3.19Å; H548-K552 WeakPolarHBondContact O-CB 3.46Å; H548-K552 PolarHBondContact O-N 3.21Å
549	S	91.6	Very high	83.5	Confident	74 Å²	74	75.7 Å²	75.7	52%	0.517	40%	0.401	S	S	.	.	H	α-helix	trans	-62.9	-47.2	177.4	-61	0	0	0	0	112	E545 K546 W547 K552 A553	E545-S549 VanDerWaalsContact O-CB 3.28Å; E545-S549 WeakPolarHBondContact O-CB 3.43Å; E545-S549 PolarHBondContact O-N 2.9Å; E545-S549 PolarHBondContact O-OG 3.41Å; K546-S549 PolarHBondContact O-N 3.2Å; W547-S549 VanDerWaalsContact C-N 3.34Å; W547-S549 PolarHBondContact O-N 3.13Å; S549-K552 PolarHBondContact O-N 2.84Å; S549-A553 WeakPolarHBondContact O-CB 3.28Å; S549-A553 PolarHBondContact O-N 3.29Å
550	A	89.5	Confident	80.8	Confident	14 Å²	14	78.9 Å²	78.9	12%	0.116	43%	0.425	C	S	.	.	H	α-helix	trans	-64.9	-42.4	176	0	0	0	0	0	112.3	K546 W547 A553 L554 V644 L647	K546-A550 PolarHBondContact O-N 2.97Å; W547-A550 PolarHBondContact O-N 2.93Å; A550-A553 PolarHBondContact O-N 3.09Å; A550-L554 PolarHBondContact O-N 2.98Å; A550-V644 HydrophobicContact CB-CG2 3.78Å; A550-L647 HydrophobicContact CB-CD1 3.68Å
551	S	89.1	Confident	78	Confident	26 Å²	26	85 Å²	85	18%	0.182	46%	0.459	C	S	.	.	H	α-helix	trans	-63.3	-42	177.1	-177	0	0	0	0	112.1	W547 H548 L554 N555	W547-S551 VanDerWaalsContact O-CB 3.26Å; W547-S551 WeakPolarHBondContact O-CB 3.32Å; W547-S551 PolarHBondContact O-N 3.18Å; H548-S551 PolarHBondContact O-N 3.19Å; S551-L554 PolarHBondContact O-N 2.69Å; S551-N555 PolarHBondContact O-N 3.14Å
552	K	87.2	Confident	75.2	Confident	119 Å²	119	93 Å²	93	52%	0.517	49%	0.485	S	S	.	.	H	α-helix	trans	-66.6	-38.5	175.3	-171.4	173.9	-176.5	175.6	0	112.1	H548 S549 N555 N556	H548-K552 WeakPolarHBondContact O-CB 3.46Å; H548-K552 PolarHBondContact O-N 3.21Å; S549-K552 PolarHBondContact O-N 2.84Å; K552-N555 PolarHBondContact O-N 3.19Å; K552-N556 WeakPolarHBondContact O-CB 3.47Å; K552-N556 PolarHBondContact O-N 3.32Å; K552-N556 PolarHBondContact O-OD1 2.88Å
553	A	83.1	Confident	72.3	Confident	47 Å²	47	98.7 Å²	98.7	39%	0.388	51%	0.508	S	S	.	.	H	α-helix	trans	-62.7	-42.6	173.4	0	0	0	0	0	112.1	S549 A550 N556 Q557	S549-A553 WeakPolarHBondContact O-CB 3.28Å; S549-A553 PolarHBondContact O-N 3.29Å; A550-A553 PolarHBondContact O-N 3.09Å; A553-N556 PolarHBondContact O-N 3.37Å; A553-Q557 WeakPolarHBondContact O-CG 3.46Å; A553-Q557 PolarHBondContact O-N 2.88Å
554	L	80.6	Confident	69.5	Low	31 Å²	31	109.3 Å²	109.3	16%	0.162	55%	0.547	C	S	.	.	H	α-helix	trans	-64.4	-42.9	176.3	-177.4	64.1	0	0	0	112.3	A550 S551 Q557 S558 A640 Q641 V644	A550-L554 PolarHBondContact O-N 2.98Å; S551-L554 PolarHBondContact O-N 2.69Å; L554-Q557 PolarHBondContact O-N 3.08Å; L554-S558 PolarHBondContact O-OG 2.73Å; L554-A640 HydrophobicContact CD1-CB 4.05Å; L554-Q641 HydrophobicContact CD2-CG 4.11Å; L554-V644 HydrophobicContact CD2-CG2 4.19Å
555	N	73.1	Confident	66.6	Low	103 Å²	103	109.5 Å²	109.5	55%	0.551	56%	0.56	S	S	*	*	H	α-helix	trans	-65.7	-39.4	175.8	-76.3	-14	0	0	0	112.2	S551 K552 Q557 S558	S551-N555 PolarHBondContact O-N 3.14Å; K552-N555 PolarHBondContact O-N 3.19Å; N555-Q557 PolarHBondContact O-N 2.73Å; N555-S558 WeakPolarHBondContact O-CA 3.5Å; N555-S558 WeakPolarHBondContact O-CB 3.29Å; N555-S558 PolarHBondContact O-N 3.22Å
556	N	66.5	Low	63.9	Low	122 Å²	122	112.4 Å²	112.4	65%	0.652	57%	0.573	S	S	*	*	H	α-helix	trans	-65.5	-25	176.4	-74.3	-4.8	0	0	0	113.2	K552 A553 S558	K552-N556 WeakPolarHBondContact O-CB 3.47Å; K552-N556 PolarHBondContact O-N 3.32Å; K552-N556 PolarHBondContact O-OD1 2.88Å; A553-N556 PolarHBondContact O-N 3.37Å; N556-S558 PolarHBondContact O-N 2.95Å
557	Q	59.6	Low	61.1	Low	128 Å²	128	115 Å²	115	60%	0.598	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-3.1	171.5	-70.3	174.2	18.1	0	0	113.2	A553 L554 N555 N637	A553-Q557 WeakPolarHBondContact O-CG 3.46Å; A553-Q557 PolarHBondContact O-N 2.88Å; L554-Q557 PolarHBondContact O-N 3.08Å; N555-Q557 PolarHBondContact O-N 2.73Å; Q557-N637 PolarHBondContact OE1-ND2 3.23Å
558	S	52.3	Low	58.2	Low	77 Å²	77	116.2 Å²	116.2	54%	0.538	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-117.6	19.4	-163.9	-56.3	0	0	0	0	115.4	L554 N555 N556	L554-S558 PolarHBondContact O-OG 2.73Å; N555-S558 WeakPolarHBondContact O-CA 3.5Å; N555-S558 WeakPolarHBondContact O-CB 3.29Å; N555-S558 PolarHBondContact O-N 3.22Å; N556-S558 PolarHBondContact O-N 2.95Å
559	S	38.3	Very low	55.6	Low	103 Å²	103	121 Å²	121	72%	0.72	63%	0.625	S	S	*	*			trans	-153.5	125.9	179.6	-75	0	0	0	0	115.3
560	P	37.7	Very low	52.8	Low	133 Å²	133	123.1 Å²	123.1	86%	0.864	64%	0.635	S	S	*	*			trans	-87.2	154	170.7	34.2	-33.1	0	0	0	113.4
561	N	35.4	Very low	50.4	Low	157 Å²	157	130.2 Å²	130.2	84%	0.84	67%	0.666	S	S	*	*			trans	-60.9	147.3	-168.3	-76.8	-42.8	0	0	0	117.6
562	R	35.7	Very low	47.9	Very low	250 Å²	250	135.5 Å²	135.5	94%	0.943	69%	0.692	S	S	*	*			trans	-152.6	134.3	136.7	-107.9	177.2	-173.3	-163.6	0.8	111.7
563	H	34.2	Very low	46.1	Very low	172 Å²	172	135.6 Å²	135.6	80%	0.796	71%	0.705	S	S	*	*			trans	-99.4	155.7	171.1	-79	-32	0	0	0	111.4
564	Y	35.1	Very low	43.8	Very low	237 Å²	237	137.4 Å²	137.4	93%	0.929	72%	0.72	S	S	*	*			trans	-163.9	167.4	131.3	-111	-72.9	0	0	0	110.4
565	T	33.3	Very low	41.8	Very low	116 Å²	116	143.5 Å²	143.5	71%	0.712	75%	0.748	S	S	*	*			trans	-141.9	148.7	-161.9	-42.6	0	0	0	0	112.7
566	Q	37.4	Very low	40	Very low	192 Å²	192	144 Å²	144	90%	0.897	75%	0.75	S	S	*	*			trans	-157.8	172.8	160.4	-116.8	172.7	54.8	0	0	113.3
567	Q	35.1	Very low	38.5	Very low	173 Å²	173	146.2 Å²	146.2	81%	0.808	75%	0.754	S	S	*	*			trans	-145.9	177	-167.4	-37.1	178.3	4.5	0	0	110.2
568	S	35.2	Very low	37.3	Very low	88 Å²	88	145.2 Å²	145.2	62%	0.615	76%	0.761	S	S	*	*			cis	-159	163.5	5.6	43.2	0	0	0	0	108.7
569	K	36.7	Very low	36.2	Very low	179 Å²	179	153 Å²	153	78%	0.778	78%	0.779	S	S	*	*				171.3	127.7	101.8	-90.9	174.3	-174.9	177.3	0	110
570	T	33.9	Very low	36	Very low	119 Å²	119	154.8 Å²	154.8	73%	0.73	79%	0.785	S	S	*	*				51.7	134.4	98.9	72.8	0	0	0	0	115.5
571	Q	38.8	Very low	35.7	Very low	162 Å²	162	158.8 Å²	158.8	76%	0.757	78%	0.783	S	S	*	*			cis	-157.5	-179.8	32.6	-77	-167.9	32.7	0	0	109.9
572	N	36.8	Very low	35.6	Very low	137 Å²	137	157.4 Å²	157.4	73%	0.733	78%	0.775	S	S	*	*			cis	-163.2	176.3	-21.4	-98	4.9	0	0	0	110.2
573	P	48.5	Very low	35.5	Very low	121 Å²	121	151.7 Å²	151.7	79%	0.786	76%	0.764	S	S	*	*			trans	-130.1	-160.9	-162.8	45.4	-31.4	0	0	0	117.2
574	A	36.6	Very low	35.5	Very low	86 Å²	86	148.2 Å²	148.2	71%	0.711	76%	0.759	S	S	*	*			trans	101.2	150.4	162.9	0	0	0	0	0	117.6
575	Q	37.5	Very low	35.5	Very low	159 Å²	159	142.6 Å²	142.6	74%	0.743	75%	0.754	S	S	*	*			cis	-168.8	159.5	-12.4	-115.8	-176.8	28.9	0	0	113.1
576	N	35	Very low	35.6	Very low	113 Å²	113	142.9 Å²	142.9	60%	0.604	76%	0.758	S	S	*	*			trans	66.3	156.1	150.9	-64.5	-29	0	0	0	120.1
577	K	35.8	Very low	35.2	Very low	169 Å²	169	140.1 Å²	140.1	74%	0.735	76%	0.758	S	S	*	*			cis	-164.7	157.8	-12.8	-112.2	170.5	-174.2	177	0	111.5
578	S	34.2	Very low	35.1	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	76%	0.758	S	S	*	*			trans	39.3	117.2	155.5	54.3	0	0	0	0	120.8
579	R	29.6	Very low	35.2	Very low	241 Å²	241	138.7 Å²	138.7	91%	0.909	77%	0.765	S	S	*	*				75	106.1	65.2	-172.5	-165.8	-170.1	-172	5.5	115.2
580	V	34.4	Very low	34.8	Very low	141 Å²	141	141.5 Å²	141.5	86%	0.855	77%	0.77	S	S	*	*				-168.9	164.8	129.7	140.2	0	0	0	0	110.7
581	R	31.6	Very low	34.7	Very low	216 Å²	216	141 Å²	141	82%	0.815	77%	0.772	S	S	*	*			trans	-69.5	160	-166.8	-81.6	177.6	174.7	165.4	-5.9	118
582	N	32.4	Very low	34.2	Very low	128 Å²	128	138.8 Å²	138.8	68%	0.684	77%	0.774	S	S	*	*			trans	64.7	151.8	143.5	-75.4	55.3	0	0	0	117.8
583	D	32.8	Very low	34	Very low	131 Å²	131	138.1 Å²	138.1	70%	0.701	78%	0.78	S	S	*	*			cis	-146.3	170.4	10.9	-100.7	-40.8	0	0	0	113.1
584	S	34	Very low	33.1	Very low	99 Å²	99	138 Å²	138	69%	0.692	78%	0.777	S	S	*	*			trans	58.6	122.7	146.4	66.5	0	0	0	0	123.9
585	S	36	Very low	32.9	Very low	118 Å²	118	141.3 Å²	141.3	83%	0.825	78%	0.778	S	S	*	*			trans	84.6	151.5	134.6	-58.5	0	0	0	0	121.7
586	P	34.7	Very low	32.7	Very low	123 Å²	123	140.5 Å²	140.5	80%	0.799	78%	0.778	S	S	*	*			trans	-116.1	170.1	-161.1	42.3	-31.2	0	0	0	115.8
587	C	30.1	Very low	32.5	Very low	134 Å²	134	142.7 Å²	142.7	91%	0.905	79%	0.79	S	S	*	*			trans	-136.8	134.9	168.3	-90.7	0	0	0	0	112.9
588	S	32.4	Very low	32.3	Very low	113 Å²	113	138.5 Å²	138.5	79%	0.79	79%	0.794	S	S	*	*			trans	-76.2	177.4	156	-35.7	0	0	0	0	109.7
589	P	38	Very low	32	Very low	118 Å²	118	142.9 Å²	142.9	77%	0.766	80%	0.8	S	S	*	*			cis	-116.4	174.9	33	10	16.8	0	0	0	113.2
590	R	28	Very low	32	Very low	238 Å²	238	138.7 Å²	138.7	90%	0.898	80%	0.795	S	S	*	*			cis	83.8	141.7	36.1	-144.5	-174.8	-165.9	-164.7	5.1	114.2
591	S	31.5	Very low	31.7	Very low	109 Å²	109	137.6 Å²	137.6	76%	0.762	79%	0.788	S	S	*	*			trans	61.6	147.8	179.9	47.3	0	0	0	0	117.8
592	S	28.9	Very low	31.7	Very low	114 Å²	114	134 Å²	134	80%	0.797	78%	0.784	S	S	*	*			cis	149.3	127.8	-30.2	54.2	0	0	0	0	109
593	S	31.7	Very low	31.5	Very low	123 Å²	123	136.4 Å²	136.4	86%	0.86	79%	0.791	S	S	*	*			trans	-154.1	133.1	168.4	56.5	0	0	0	0	110.8
594	T	30.1	Very low	31.2	Very low	118 Å²	118	135.7 Å²	135.7	72%	0.724	80%	0.796	S	S	*	*			trans	-100.9	-165.5	-170.3	30.5	0	0	0	0	112.9
595	E	31.1	Very low	31	Very low	157 Å²	157	135.9 Å²	135.9	73%	0.734	80%	0.804	S	S	*	*			trans	75.8	146.8	172.7	-59.7	114	-95.8	0	0	117.7
596	L	34.5	Very low	30.7	Very low	142 Å²	142	136.1 Å²	136.1	74%	0.743	81%	0.805	S	S	*	*			cis	-158.1	152.5	-12.9	-115.9	169.3	0	0	0	111.5
597	D	30.1	Very low	30.5	Very low	159 Å²	159	135.5 Å²	135.5	85%	0.85	80%	0.804	S	S	*	*			trans	38.1	143.4	152.1	-79.9	-13	0	0	0	125.1
598	G	32.8	Very low	30.4	Very low	80 Å²	80	137 Å²	137	83%	0.825	80%	0.803	S	S	*	*			trans	175.6	67.3	168.4	0	0	0	0	0	117
599	K	28	Very low	30.3	Very low	198 Å²	198	135.4 Å²	135.4	86%	0.861	81%	0.805	S	S	*	*			trans	-70.1	134.6	-179.6	-102.6	178.6	177.1	170.7	0	115
600	L	29.4	Very low	29.9	Very low	153 Å²	153	135.2 Å²	135.2	80%	0.801	81%	0.806	S	S	*	*			trans	175.7	111.2	148.4	-97	150	0	0	0	106.9
601	V	27.3	Very low	29.9	Very low	118 Å²	118	133 Å²	133	72%	0.715	81%	0.806	S	S	*	*				59.2	106.1	55.8	-170.5	0	0	0	0	113.2
602	I	31.4	Very low	29.8	Very low	142 Å²	142	138 Å²	138	73%	0.728	81%	0.814	S	S	*	*			trans	-173.9	118.7	130	-94.2	155.3	0	0	0	111
603	E	29.1	Very low	29.8	Very low	177 Å²	177	137.6 Å²	137.6	83%	0.827	81%	0.811	S	S	*	*			trans	36.3	136.7	142.9	-51.6	-177.6	144.3	0	0	124.1
604	S	26.1	Very low	29.8	Very low	117 Å²	117	137.2 Å²	137.2	82%	0.818	80%	0.804	S	S	*	*			trans	-64.7	146	163.8	52.3	0	0	0	0	115.2
605	A	30.4	Very low	29.7	Very low	103 Å²	103	138.5 Å²	138.5	85%	0.851	81%	0.806	S	S	*	*			trans	-154.1	128.3	148.3	0	0	0	0	0	112.1
606	S	28.2	Very low	29.7	Very low	122 Å²	122	138.2 Å²	138.2	85%	0.853	81%	0.81	S	S	*	*			trans	-104.3	125.4	172	57.4	0	0	0	0	111.1
607	S	30.7	Very low	29.6	Very low	110 Å²	110	138.5 Å²	138.5	77%	0.769	81%	0.812	S	S	*	*			trans	-156.2	118.9	164.9	51.7	0	0	0	0	115.5
608	N	28	Very low	29.8	Very low	165 Å²	165	136.8 Å²	136.8	88%	0.882	81%	0.809	S	S	*	*			trans	18	128.1	140.8	-56.6	-24.2	0	0	0	120.5
609	G	30.9	Very low	29.7	Very low	81 Å²	81	139.5 Å²	139.5	84%	0.835	81%	0.809	S	S	*	*			trans	-151.2	66	169.8	0	0	0	0	0	113.2
610	S	28.8	Very low	29.9	Very low	113 Å²	113	141.3 Å²	141.3	79%	0.79	81%	0.811	S	S	*	*			trans	-67.8	156.3	-172.2	-59.5	0	0	0	0	115.4
611	Q	28.7	Very low	30	Very low	192 Å²	192	141 Å²	141	90%	0.897	81%	0.809	S	S	*	*			trans	-17.9	130.6	164.4	-61.5	172.4	-24.6	0	0	116.9
612	K	30.4	Very low	30.1	Very low	213 Å²	213	140.1 Å²	140.1	93%	0.926	81%	0.809	S	S	*	*			trans	-134.7	147.2	139.5	-85	-168.8	175.9	174.7	0	110.5
613	S	27.6	Very low	30.1	Very low	106 Å²	106	138.1 Å²	138.1	74%	0.741	81%	0.807	S	S	*	*			trans	-122.6	166.8	-175.1	65.9	0	0	0	0	111.1
614	V	31.2	Very low	30.4	Very low	116 Å²	116	134.9 Å²	134.9	70%	0.703	80%	0.804	S	S	*	*			trans	54	115.3	158.4	-179.4	0	0	0	0	117.4
615	N	29.2	Very low	30.8	Very low	145 Å²	145	136 Å²	136	78%	0.775	81%	0.806	S	S	*	*				-160.1	129.8	115.6	-105.6	-39.2	0	0	0	113.2
616	N	31.9	Very low	30.9	Very low	151 Å²	151	137.3 Å²	137.3	81%	0.807	80%	0.799	S	S	*	*			trans	-77.1	143.2	159.1	-70.8	-45.9	0	0	0	108.2
617	N	31.6	Very low	31.2	Very low	148 Å²	148	138.2 Å²	138.2	79%	0.791	79%	0.792	S	S	*	*			trans	-140.5	110.1	169.4	-108	-29	0	0	0	110.8
618	P	34.8	Very low	31.4	Very low	123 Å²	123	137.8 Å²	137.8	80%	0.799	79%	0.789	S	S	*	*			trans	-87.1	135.5	174.3	33.9	-31.4	0	0	0	110.9
619	V	30.1	Very low	31.9	Very low	136 Å²	136	139.2 Å²	139.2	82%	0.824	79%	0.791	S	S	*	*			trans	-126.3	141.1	173.6	-177.8	0	0	0	0	110
620	R	32.3	Very low	31.9	Very low	236 Å²	236	147.2 Å²	147.2	89%	0.891	80%	0.796	S	S	*	*			trans	-145.5	112.8	-160.1	180	-164.3	-166.4	-163.8	7.5	111.2
621	L	30.4	Very low	32.6	Very low	147 Å²	147	147.4 Å²	147.4	77%	0.77	79%	0.794	S	S	*	*			trans	-140.2	129.1	160.7	-75.6	100.8	0	0	0	106.2
622	S	31.3	Very low	33.3	Very low	100 Å²	100	143.7 Å²	143.7	70%	0.699	79%	0.789	S	S	*	*				64	122.9	56.2	77	0	0	0	0	112.7
623	S	30.2	Very low	33.9	Very low	100 Å²	100	140.7 Å²	140.7	70%	0.699	78%	0.783	S	S	*	*			cis	-163.7	142.8	5.9	45.6	0	0	0	0	113.3
624	S	35.8	Very low	35	Very low	108 Å²	108	139.6 Å²	139.6	76%	0.755	77%	0.773	S	S	*	*			trans	31.8	112.2	149.6	58.3	0	0	0	0	120.8
625	T	33.9	Very low	36	Very low	140 Å²	140	141.1 Å²	141.1	86%	0.859	78%	0.783	S	S	*	*			trans	-156.4	173.2	141.3	-10.3	0	0	0	0	111
626	D	32.9	Very low	37.4	Very low	132 Å²	132	140.3 Å²	140.3	71%	0.706	77%	0.772	S	S	*	*			trans	-74	142.1	-150	-78	-73	0	0	0	120.6
627	I	33.6	Very low	39.2	Very low	140 Å²	140	136.2 Å²	136.2	72%	0.718	75%	0.75	S	S	*	*				47.4	112.9	127	-58	174.4	0	0	0	120.1
628	S	36.4	Very low	41.5	Very low	101 Å²	101	134.4 Å²	134.4	71%	0.706	74%	0.744	S	S	*	*			trans	52.5	98.1	149.6	74.6	0	0	0	0	120.7
629	Q	37.3	Very low	43.7	Very low	196 Å²	196	133 Å²	133	92%	0.916	74%	0.737	S	S	*	*				-154.5	110.9	116.4	-105	171.1	49.6	0	0	108	P631	Q629-P631 WeakPolarHBondContact O-CD 3.43Å
630	R	32.7	Very low	46.2	Very low	248 Å²	248	127.1 Å²	127.1	94%	0.936	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-94.8	119.5	179.5	-96.1	-170.9	178	-178.4	0.6	110.7
631	P	41.7	Very low	48.6	Very low	117 Å²	117	119 Å²	119	76%	0.76	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-61.7	149.8	155	-15.5	30.4	0	0	0	109.6	Q629	Q629-P631 WeakPolarHBondContact O-CD 3.43Å
632	S	44.6	Very low	51.4	Low	114 Å²	114	118.2 Å²	118.2	80%	0.797	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-64.8	138.4	169.8	38.6	0	0	0	0	110.6
633	L	43.5	Very low	54.2	Low	150 Å²	150	118.3 Å²	118.3	79%	0.785	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-60.6	144.4	165.7	-78.5	163.8	0	0	0	109.2	V635	L633-V635 PolarHBondContact O-N 3.47Å
634	P	50.4	Low	57	Low	84 Å²	84	114.6 Å²	114.6	55%	0.545	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-56.2	127.8	170.2	-22.3	33	0	0	0	110	F636	P634-F636 VanDerWaalsContact C-N 3.28Å; P634-F636 HydrophobicContact CB-CD2 4.42Å; P634-F636 HydrophobicContact CB-CE1 4.3Å; P634-F636 HydrophobicContact CB-CE2 4.02Å; P634-F636 HydrophobicContact CB-CZ 3.96Å; P634-F636 HydrophobicContact CG-CE2 4.34Å; P634-F636 HydrophobicContact CG-CZ 4.2Å; P634-F636 VanDerWaalsContact O-CD2 3.28Å; P634-F636 WeakPolarHBondContact O-CD2 3.49Å; P634-F636 PolarHBondContact O-N 2.81Å
635	V	52	Low	59.7	Low	148 Å²	148	117.9 Å²	117.9	90%	0.897	63%	0.625	S	S	*	*			trans	-76	86.2	175.5	-178.9	0	0	0	0	107.8	L633 N637	L633-V635 PolarHBondContact O-N 3.47Å; V635-N637 PolarHBondContact O-N 3.17Å
636	F	57.5	Low	62.5	Low	127 Å²	127	115.5 Å²	115.5	56%	0.557	60%	0.604	S	S	*	*			trans	-65.3	115.5	179.1	-68.8	-72	0	0	0	110.5	P634 V638	P634-F636 VanDerWaalsContact C-N 3.28Å; P634-F636 HydrophobicContact CB-CD2 4.42Å; P634-F636 HydrophobicContact CB-CE1 4.3Å; P634-F636 HydrophobicContact CB-CE2 4.02Å; P634-F636 HydrophobicContact CB-CZ 3.96Å; P634-F636 HydrophobicContact CG-CE2 4.34Å; P634-F636 HydrophobicContact CG-CZ 4.2Å; P634-F636 VanDerWaalsContact O-CD2 3.28Å; P634-F636 WeakPolarHBondContact O-CD2 3.49Å; P634-F636 PolarHBondContact O-N 2.81Å; F636-V638 VanDerWaalsContact C-N 3.32Å; F636-V638 PolarHBondContact O-N 3.5Å
637	N	70.7	Confident	65.4	Low	65 Å²	65	110.4 Å²	110.4	35%	0.348	58%	0.577	S	S	.	*			trans	-70.2	88.8	170	-175.8	-13.8	0	0	0	109.3	Q557 V635 S639 A640 Q641	Q557-N637 PolarHBondContact OE1-ND2 3.23Å; V635-N637 PolarHBondContact O-N 3.17Å; N637-S639 PolarHBondContact O-N 2.87Å; N637-S639 PolarHBondContact OD1-N 3.34Å; N637-A640 HydrophobicContact CB-CB 4.06Å; N637-A640 VanDerWaalsContact CG-CB 3.47Å; N637-A640 WeakPolarHBondContact ND2-CB 3.23Å; N637-A640 PolarHBondContact O-N 3.48Å; N637-A640 PolarHBondContact OD1-N 2.88Å; N637-A640 VanDerWaalsContact OD1-N 3.07Å; N637-Q641 PolarHBondContact O-N 2.65Å
638	V	80	Confident	68.2	Low	110 Å²	110	106.8 Å²	106.8	67%	0.667	56%	0.558	S	S	*	*	H	α-helix	trans	-57.6	-38.6	-176.8	-180	0	0	0	0	111.4	F636 Q641 F642	F636-V638 VanDerWaalsContact C-N 3.32Å; F636-V638 PolarHBondContact O-N 3.5Å; V638-Q641 PolarHBondContact O-N 2.91Å; V638-F642 WeakPolarHBondContact O-CB 3.38Å; V638-F642 PolarHBondContact O-N 2.86Å
639	S	81.6	Confident	71	Confident	93 Å²	93	105.4 Å²	105.4	65%	0.65	55%	0.548	S	S	*	.	H	α-helix	trans	-63.9	-46.3	177.9	-53.2	0	0	0	0	112.1	N637 Q641 F642 E643	N637-S639 PolarHBondContact O-N 2.87Å; N637-S639 PolarHBondContact OD1-N 3.34Å; S639-Q641 PolarHBondContact O-N 2.78Å; S639-F642 WeakPolarHBondContact O-CB 3.47Å; S639-F642 PolarHBondContact O-N 2.82Å; S639-E643 PolarHBondContact O-N 3.01Å
640	A	81.1	Confident	73.6	Confident	14 Å²	14	99.9 Å²	99.9	12%	0.116	52%	0.522	C	S	.	.	H	α-helix	trans	-67.7	-34.2	176.3	0	0	0	0	0	112.5	L554 N637 V644	L554-A640 HydrophobicContact CD1-CB 4.05Å; N637-A640 HydrophobicContact CB-CB 4.06Å; N637-A640 VanDerWaalsContact CG-CB 3.47Å; N637-A640 WeakPolarHBondContact ND2-CB 3.23Å; N637-A640 PolarHBondContact O-N 3.48Å; N637-A640 PolarHBondContact OD1-N 2.88Å; N637-A640 VanDerWaalsContact OD1-N 3.07Å; A640-V644 WeakPolarHBondContact O-CB 3.5Å; A640-V644 VanDerWaalsContact O-CG2 3.3Å; A640-V644 WeakPolarHBondContact O-CG2 3.49Å; A640-V644 PolarHBondContact O-N 3.23Å
641	Q	83.4	Confident	76.5	Confident	64 Å²	64	89.3 Å²	89.3	30%	0.299	49%	0.485	S	S	.	.	H	α-helix	trans	-67.3	-36.5	171.3	-74	-160.2	2.6	0	0	112.7	L554 N637 V638 S639 R645	L554-Q641 HydrophobicContact CD2-CG 4.11Å; N637-Q641 PolarHBondContact O-N 2.65Å; V638-Q641 PolarHBondContact O-N 2.91Å; S639-Q641 PolarHBondContact O-N 2.78Å; Q641-R645 WeakPolarHBondContact O-CB 3.23Å; Q641-R645 VanDerWaalsContact O-CG 3.27Å; Q641-R645 WeakPolarHBondContact O-CG 3.28Å; Q641-R645 PolarHBondContact O-N 3.27Å; Q641-R645 VanDerWaalsContact O-N 3.08Å
642	F	89.6	Confident	78.9	Confident	132 Å²	132	89.5 Å²	89.5	58%	0.579	48%	0.475	S	S	*	.	H	α-helix	trans	-65.5	-47.1	174.3	178.9	-90.6	0	0	0	111	V638 S639 V644 R645 Q646	V638-F642 WeakPolarHBondContact O-CB 3.38Å; V638-F642 PolarHBondContact O-N 2.86Å; S639-F642 WeakPolarHBondContact O-CB 3.47Å; S639-F642 PolarHBondContact O-N 2.82Å; F642-V644 PolarHBondContact O-N 2.82Å; F642-R645 CarbonylContact O-C 3.58Å; F642-R645 PolarHBondContact O-N 2.79Å; F642-R645 VanDerWaalsContact O-N 3.13Å; F642-Q646 HydrophobicContact CE1-CB 4.44Å; F642-Q646 WeakPolarHBondContact O-CB 3.41Å; F642-Q646 PolarHBondContact O-N 2.94Å
643	E	89.7	Confident	81.2	Confident	102 Å²	102	88.8 Å²	88.8	48%	0.477	46%	0.459	S	S	.	.	H	α-helix	trans	-57.3	-48.7	176.1	-177.9	178.6	-168.1	0	0	111.8	S639 R645 Q646 L647	S639-E643 PolarHBondContact O-N 3.01Å; E643-R645 VanDerWaalsContact C-N 3.29Å; E643-R645 PolarHBondContact O-N 2.7Å; E643-Q646 PolarHBondContact O-N 3.4Å; E643-L647 HydrophobicContact CG-CD1 3.9Å; E643-L647 HydrophobicContact CG-CG 4.44Å; E643-L647 WeakPolarHBondContact O-CB 3.3Å; E643-L647 WeakPolarHBondContact O-CG 3.4Å; E643-L647 PolarHBondContact O-N 2.78Å
644	V	89.4	Confident	83.4	Confident	22 Å²	22	82.1 Å²	82.1	13%	0.133	43%	0.425	C	S	.	.	H	α-helix	trans	-60.5	-37.3	176.3	170.5	0	0	0	0	111.8	A550 L554 A640 F642 L648	A550-V644 HydrophobicContact CB-CG2 3.78Å; L554-V644 HydrophobicContact CD2-CG2 4.19Å; A640-V644 WeakPolarHBondContact O-CB 3.5Å; A640-V644 VanDerWaalsContact O-CG2 3.3Å; A640-V644 WeakPolarHBondContact O-CG2 3.49Å; A640-V644 PolarHBondContact O-N 3.23Å; F642-V644 PolarHBondContact O-N 2.82Å; V644-L648 VanDerWaalsContact O-CB 3.26Å; V644-L648 WeakPolarHBondContact O-CB 3.27Å; V644-L648 PolarHBondContact O-N 2.86Å
645	R	91.8	Very high	85.4	Confident	176 Å²	176	84.5 Å²	84.5	66%	0.664	42%	0.424	S	S	*	.	H	α-helix	trans	-71.2	-37.9	174.8	-73.3	175.6	-174.1	-145.6	4.5	112.8	Q641 F642 E643 L648 S649	Q641-R645 WeakPolarHBondContact O-CB 3.23Å; Q641-R645 VanDerWaalsContact O-CG 3.27Å; Q641-R645 WeakPolarHBondContact O-CG 3.28Å; Q641-R645 PolarHBondContact O-N 3.27Å; Q641-R645 VanDerWaalsContact O-N 3.08Å; F642-R645 CarbonylContact O-C 3.58Å; F642-R645 PolarHBondContact O-N 2.79Å; F642-R645 VanDerWaalsContact O-N 3.13Å; E643-R645 VanDerWaalsContact C-N 3.29Å; E643-R645 PolarHBondContact O-N 2.7Å; R645-L648 PolarHBondContact O-N 2.89Å; R645-S649 PolarHBondContact O-N 3.13Å
646	Q	92.3	Very high	87.4	Confident	90 Å²	90	85.1 Å²	85.1	42%	0.421	41%	0.414	S	S	.	.	H	α-helix	trans	-66.7	-46.5	177.3	-174.1	-177.6	3.7	0	0	111	F642 E643 L648 S649 H650	F642-Q646 HydrophobicContact CE1-CB 4.44Å; F642-Q646 WeakPolarHBondContact O-CB 3.41Å; F642-Q646 PolarHBondContact O-N 2.94Å; E643-Q646 PolarHBondContact O-N 3.4Å; Q646-L648 VanDerWaalsContact C-N 3.3Å; Q646-L648 PolarHBondContact O-N 3.03Å; Q646-S649 WeakPolarHBondContact O-CA 3.25Å; Q646-S649 VanDerWaalsContact O-CB 3.31Å; Q646-S649 WeakPolarHBondContact O-CB 3.14Å; Q646-S649 PolarHBondContact O-N 3.42Å; Q646-H650 PolarHBondContact O-N 3.05Å
647	L	94.1	Very high	89.1	Confident	26 Å²	26	83.5 Å²	83.5	14%	0.136	41%	0.407	C	S	.	.	H	α-helix	trans	-64.2	-35.5	175.7	-66.3	172.2	0	0	0	111.8	K546 W547 A550 E643 S649 H650 L651	K546-L647 HydrophobicContact CB-CD1 4.36Å; K546-L647 HydrophobicContact CB-CD2 3.96Å; W547-L647 HydrophobicContact CB-CB 3.95Å; A550-L647 HydrophobicContact CB-CD1 3.68Å; E643-L647 HydrophobicContact CG-CD1 3.9Å; E643-L647 HydrophobicContact CG-CG 4.44Å; E643-L647 WeakPolarHBondContact O-CB 3.3Å; E643-L647 WeakPolarHBondContact O-CG 3.4Å; E643-L647 PolarHBondContact O-N 2.78Å; L647-S649 VanDerWaalsContact C-N 3.32Å; L647-S649 PolarHBondContact O-N 2.88Å; L647-H650 PolarHBondContact O-N 3.31Å; L647-L651 PolarHBondContact O-N 3.49Å
648	L	93.4	Very high	90.2	Very high	63 Å²	63	82 Å²	82	33%	0.33	40%	0.397	S	S	.	.	H	α-helix	trans	-63.8	-36.5	170.5	-174.7	60.8	0	0	0	111.9	V644 R645 Q646 L651 H652	V644-L648 VanDerWaalsContact O-CB 3.26Å; V644-L648 WeakPolarHBondContact O-CB 3.27Å; V644-L648 PolarHBondContact O-N 2.86Å; R645-L648 PolarHBondContact O-N 2.89Å; Q646-L648 VanDerWaalsContact C-N 3.3Å; Q646-L648 PolarHBondContact O-N 3.03Å; L648-L651 PolarHBondContact O-N 3.13Å; L648-H652 PolarHBondContact O-N 2.7Å; L648-H652 PolarHBondContact O-ND1 3.24Å
649	S	93.3	Very high	90.8	Very high	72 Å²	72	81.9 Å²	81.9	50%	0.503	39%	0.389	S	S	.	.	H	α-helix	trans	-66.7	-42.7	174.2	-165.5	0	0	0	0	112.1	R645 Q646 L647 L651 H652 E653	R645-S649 PolarHBondContact O-N 3.13Å; Q646-S649 WeakPolarHBondContact O-CA 3.25Å; Q646-S649 VanDerWaalsContact O-CB 3.31Å; Q646-S649 WeakPolarHBondContact O-CB 3.14Å; Q646-S649 PolarHBondContact O-N 3.42Å; L647-S649 VanDerWaalsContact C-N 3.32Å; L647-S649 PolarHBondContact O-N 2.88Å; S649-L651 VanDerWaalsContact C-N 3.29Å; S649-L651 PolarHBondContact O-N 2.99Å; S649-H652 PolarHBondContact O-N 3.07Å; S649-E653 PolarHBondContact O-N 2.95Å
650	H	92.4	Very high	91.4	Very high	80 Å²	80	81.1 Å²	81.1	37%	0.37	38%	0.383	S	S	.	.	H	α-helix	trans	-61.8	-37.9	174.9	-59.5	158.5	0	0	0	111.7	Q646 L647 E653 A654	Q646-H650 PolarHBondContact O-N 3.05Å; L647-H650 PolarHBondContact O-N 3.31Å; H650-E653 PolarHBondContact O-N 3.26Å; H650-A654 PolarHBondContact O-N 2.88Å
651	L	93.5	Very high	92.1	Very high	27 Å²	27	81.5 Å²	81.5	14%	0.141	38%	0.383	C	S	.	.	H	α-helix	trans	-64.7	-41.6	174.9	-178.8	60	0	0	0	112.2	I540 A543 Y544 W547 L647 L648 S649 W655	I540-L651 HydrophobicContact CG2-CD1 4.01Å; A543-L651 HydrophobicContact CB-CB 4.19Å; A543-L651 HydrophobicContact CB-CD1 4.03Å; Y544-L651 HydrophobicContact CD2-CD2 4.3Å; W547-L651 HydrophobicContact CE3-CD2 4.44Å; L647-L651 PolarHBondContact O-N 3.49Å; L648-L651 PolarHBondContact O-N 3.13Å; S649-L651 VanDerWaalsContact C-N 3.29Å; S649-L651 PolarHBondContact O-N 2.99Å; L651-W655 PolarHBondContact O-N 3.4Å
652	H	93.4	Very high	92.6	Very high	120 Å²	120	83.2 Å²	83.2	56%	0.556	39%	0.391	S	S	*	.	H	α-helix	trans	-65.7	-35.8	173	-77.6	80.7	0	0	0	112.6	L648 S649 W655 K656	L648-H652 PolarHBondContact O-N 2.7Å; L648-H652 PolarHBondContact O-ND1 3.24Å; S649-H652 PolarHBondContact O-N 3.07Å; H652-W655 PolarHBondContact O-N 2.96Å; H652-K656 WeakPolarHBondContact O-CB 3.28Å; H652-K656 PolarHBondContact O-N 2.84Å
653	E	91.8	Very high	92.9	Very high	100 Å²	100	81.4 Å²	81.4	47%	0.467	39%	0.39	S	S	.	.	H	α-helix	trans	-67	-43.6	177.2	-164.3	-165	134.9	0	0	111.7	S649 H650 K656 K657	S649-E653 PolarHBondContact O-N 2.95Å; H650-E653 PolarHBondContact O-N 3.26Å; E653-K656 WeakPolarHBondContact O-CB 3.25Å; E653-K656 PolarHBondContact O-N 3.27Å; E653-K657 PolarHBondContact O-N 2.85Å; E653-K657 WeakPolarHBondContact OE1-CE 3.49Å; E653-K657 IonicContact OE1-NZ 3.47Å; E653-K657 PolarHBondContact OE1-NZ 2.71Å
654	A	90.3	Very high	93.2	Very high	9 Å²	9	78 Å²	78	7%	0.074	38%	0.38	C	S	.	.	H	α-helix	trans	-61.5	-43.8	174.1	0	0	0	0	0	111.5	N539 I540 H650 K656 K657 F658	N539-A654 HydrophobicContact CB-CB 4.39Å; I540-A654 HydrophobicContact CG1-CB 3.67Å; H650-A654 PolarHBondContact O-N 2.88Å; A654-K656 VanDerWaalsContact C-N 3.31Å; A654-K656 PolarHBondContact O-N 2.87Å; A654-K657 PolarHBondContact O-N 2.88Å; A654-K657 VanDerWaalsContact O-N 3.15Å; A654-F658 PolarHBondContact O-N 3.01Å
655	W	92.4	Very high	93.5	Very high	135 Å²	135	78.1 Å²	78.1	51%	0.511	38%	0.38	S	S	.	.	H	α-helix	trans	-59.3	-40.2	173.9	-172.7	-93.6	0	0	0	112.8	I540 L651 H652 K657 F658 Q659	I540-W655 HydrophobicContact CD1-CE3 4.03Å; L651-W655 PolarHBondContact O-N 3.4Å; H652-W655 PolarHBondContact O-N 2.96Å; W655-K657 PolarHBondContact O-N 2.89Å; W655-F658 PolarHBondContact O-N 2.62Å; W655-F658 VanDerWaalsContact O-N 3.14Å; W655-Q659 PolarHBondContact O-N 2.94Å; W655-Q659 VanDerWaalsContact O-N 3.08Å
656	K	94.3	Very high	93.7	Very high	160 Å²	160	73.5 Å²	73.5	70%	0.696	37%	0.374	S	S	*	.	H	α-helix	trans	-64.8	-24.8	178.1	-169.7	178.9	178.3	-174.3	0	113.2	H652 E653 A654 P660	H652-K656 WeakPolarHBondContact O-CB 3.28Å; H652-K656 PolarHBondContact O-N 2.84Å; E653-K656 WeakPolarHBondContact O-CB 3.25Å; E653-K656 PolarHBondContact O-N 3.27Å; A654-K656 VanDerWaalsContact C-N 3.31Å; A654-K656 PolarHBondContact O-N 2.87Å; K656-P660 WeakPolarHBondContact O-CD 3.48Å
657	K	92.4	Very high	93.9	Very high	94 Å²	94	74.2 Å²	74.2	41%	0.409	38%	0.377	S	S	.	.	H	α-helix	trans	-79.8	-34.3	172.3	-64.7	175.5	-169.7	169.9	0	112.4	E536 E653 A654 W655	E536-K657 HydrophobicContact CG-CB 4.04Å; E536-K657 WeakPolarHBondContact OE1-CD 3.5Å; E653-K657 PolarHBondContact O-N 2.85Å; E653-K657 WeakPolarHBondContact OE1-CE 3.49Å; E653-K657 IonicContact OE1-NZ 3.47Å; E653-K657 PolarHBondContact OE1-NZ 2.71Å; A654-K657 PolarHBondContact O-N 2.88Å; A654-K657 VanDerWaalsContact O-N 3.15Å; W655-K657 PolarHBondContact O-N 2.89Å
658	F	94.2	Very high	94	Very high	32 Å²	32	73.4 Å²	73.4	14%	0.14	37%	0.374	C	S	.	.	H	α-helix	trans	-72.6	-38.8	179.8	-173.8	-91.5	0	0	0	113.5	M533 E536 R537 I540 A654 W655 L661 Q662	M533-F658 HydrophobicContact CB-CE2 3.98Å; M533-F658 HydrophobicContact CE-CE1 3.94Å; M533-F658 HydrophobicContact CE-CE2 3.75Å; M533-F658 HydrophobicContact CE-CZ 3.37Å; M533-F658 HydrophobicContact CG-CE2 4.2Å; E536-F658 HydrophobicContact CB-CB 4.43Å; E536-F658 HydrophobicContact CB-CD2 4.3Å; R537-F658 HydrophobicContact CB-CE2 4.32Å; I540-F658 HydrophobicContact CD1-CB 3.68Å; I540-F658 HydrophobicContact CD1-CD2 4.14Å; I540-F658 HydrophobicContact CD1-CG 3.91Å; A654-F658 PolarHBondContact O-N 3.01Å; W655-F658 PolarHBondContact O-N 2.62Å; W655-F658 VanDerWaalsContact O-N 3.14Å; F658-L661 WeakPolarHBondContact O-CB 3.26Å; F658-L661 PolarHBondContact O-N 2.96Å; F658-L661 VanDerWaalsContact O-N 3.15Å; F658-Q662 HydrophobicContact CE1-CB 4.34Å; F658-Q662 PolarHBondContact O-N 3.05Å
659	Q	92.1	Very high	94.1	Very high	108 Å²	108	72.6 Å²	72.6	51%	0.505	37%	0.37	S	S	.	.	H	α-helix	trans	-57.2	-46.4	-175.2	179.7	-179.8	-1.3	0	0	114.3	W655 L661 Q662 T663	W655-Q659 PolarHBondContact O-N 2.94Å; W655-Q659 VanDerWaalsContact O-N 3.08Å; Q659-L661 VanDerWaalsContact C-N 3.32Å; Q659-L661 PolarHBondContact O-N 3.36Å; Q659-Q662 PolarHBondContact O-N 3.24Å; Q659-T663 PolarHBondContact O-N 2.96Å; Q659-T663 VanDerWaalsContact O-N 3.09Å; Q659-T663 PolarHBondContact O-OG1 3.42Å
660	P	94.9	Very high	94.3	Very high	78 Å²	78	75.3 Å²	75.3	51%	0.506	37%	0.372	S	S	.	.	H	α-helix	trans	-61.8	-35.8	176	-24.7	35.2	0	0	0	113.8	K656 T663 A664	K656-P660 WeakPolarHBondContact O-CD 3.48Å; P660-T663 PolarHBondContact O-N 3.22Å; P660-A664 WeakPolarHBondContact O-CB 3.43Å; P660-A664 PolarHBondContact O-N 3.36Å
661	L	95.7	Very high	94.4	Very high	22 Å²	22	75.4 Å²	75.4	12%	0.115	37%	0.373	C	S	.	.	H	α-helix	trans	-65.7	-41.5	176.8	-59.9	172.5	0	0	0	111	L529 Q532 M533 E536 F658 Q659 T663 A664 L665	L529-L661 HydrophobicContact CD2-CD2 4.02Å; Q532-L661 HydrophobicContact CB-CD1 3.83Å; Q532-L661 HydrophobicContact CB-CD2 3.98Å; M533-L661 HydrophobicContact CG-CB 3.49Å; M533-L661 VanDerWaalsContact CG-CB 3.49Å; M533-L661 HydrophobicContact CG-CD1 4.02Å; M533-L661 HydrophobicContact CG-CG 4.38Å; M533-L661 HydrophobicContact SD-CB 4.09Å; E536-L661 HydrophobicContact CB-CD1 4.46Å; E536-L661 HydrophobicContact CG-CD1 4.14Å; F658-L661 WeakPolarHBondContact O-CB 3.26Å; F658-L661 PolarHBondContact O-N 2.96Å; F658-L661 VanDerWaalsContact O-N 3.15Å; Q659-L661 VanDerWaalsContact C-N 3.32Å; Q659-L661 PolarHBondContact O-N 3.36Å; L661-T663 VanDerWaalsContact C-N 3.35Å; L661-T663 PolarHBondContact O-N 3.41Å; L661-A664 PolarHBondContact O-N 3.43Å; L661-L665 WeakPolarHBondContact O-CB 3.41Å; L661-L665 PolarHBondContact O-N 3.44Å
662	Q	94.4	Very high	94.5	Very high	100 Å²	100	74.5 Å²	74.5	47%	0.467	37%	0.369	S	S	.	.	H	α-helix	trans	-61.8	-41	174.7	-170.3	-179.2	13.2	0	0	112	M533 F658 Q659 S666	M533-Q662 HydrophobicContact CE-CB 4.01Å; M533-Q662 HydrophobicContact CE-CG 4.33Å; F658-Q662 HydrophobicContact CE1-CB 4.34Å; F658-Q662 PolarHBondContact O-N 3.05Å; Q659-Q662 PolarHBondContact O-N 3.24Å; Q662-S666 WeakPolarHBondContact O-CB 3.25Å; Q662-S666 PolarHBondContact O-N 3.24Å; Q662-S666 VanDerWaalsContact O-N 3.07Å
663	T	95	Very high	94.5	Very high	93 Å²	93	72.7 Å²	72.7	57%	0.571	36%	0.363	S	S	*	.	H	α-helix	trans	-65.1	-44	174.2	-55.7	0	0	0	0	111.8	Q659 P660 L661 S666 Q667	Q659-T663 PolarHBondContact O-N 2.96Å; Q659-T663 VanDerWaalsContact O-N 3.09Å; Q659-T663 PolarHBondContact O-OG1 3.42Å; P660-T663 PolarHBondContact O-N 3.22Å; L661-T663 VanDerWaalsContact C-N 3.35Å; L661-T663 PolarHBondContact O-N 3.41Å; T663-S666 WeakPolarHBondContact O-CB 3.27Å; T663-S666 PolarHBondContact O-N 2.88Å; T663-Q667 PolarHBondContact O-N 2.66Å
664	A	96.1	Very high	94.6	Very high	32 Å²	32	71.6 Å²	71.6	26%	0.264	36%	0.36	S	S	.	.	H	α-helix	trans	-64	-41.7	177.7	0	0	0	0	0	112.4	L529 P660 L661 S666 Q667 V668	L529-A664 HydrophobicContact CD1-CB 3.94Å; L529-A664 HydrophobicContact CD2-CB 3.81Å; P660-A664 WeakPolarHBondContact O-CB 3.43Å; P660-A664 PolarHBondContact O-N 3.36Å; L661-A664 PolarHBondContact O-N 3.43Å; A664-S666 VanDerWaalsContact C-N 3.33Å; A664-S666 PolarHBondContact O-N 3.36Å; A664-Q667 PolarHBondContact O-N 3.06Å; A664-V668 WeakPolarHBondContact O-CG2 3.32Å; A664-V668 PolarHBondContact O-N 2.88Å
665	L	96.4	Very high	94.7	Very high	24 Å²	24	72.9 Å²	72.9	13%	0.126	37%	0.365	C	S	.	.	H	α-helix	trans	-62.5	-40.4	175.3	178.5	62.7	0	0	0	111.5	K526 L530 M533 L661 V668 N669	K526-L665 HydrophobicContact CG-CD1 3.93Å; L530-L665 HydrophobicContact CD2-CD1 4.26Å; L530-L665 HydrophobicContact CD2-CD2 3.74Å; L530-L665 HydrophobicContact CG-CD1 4.25Å; M533-L665 HydrophobicContact CE-CD2 4.15Å; M533-L665 HydrophobicContact SD-CB 4.03Å; M533-L665 HydrophobicContact SD-CD2 3.58Å; M533-L665 VanDerWaalsContact SD-CD2 3.58Å; M533-L665 HydrophobicContact SD-CG 4.43Å; L661-L665 WeakPolarHBondContact O-CB 3.41Å; L661-L665 PolarHBondContact O-N 3.44Å; L665-V668 PolarHBondContact O-N 3.29Å; L665-N669 WeakPolarHBondContact O-CB 3.42Å; L665-N669 VanDerWaalsContact O-CG 3.27Å; L665-N669 PolarHBondContact O-N 3.12Å; L665-N669 PolarHBondContact O-ND2 2.85Å; L665-N669 VanDerWaalsContact O-ND2 3.16Å
666	S	95.6	Very high	94.7	Very high	79 Å²	79	71.5 Å²	71.5	55%	0.552	37%	0.367	S	S	*	.	H	α-helix	trans	-60.5	-44.7	174.5	-166	0	0	0	0	111.9	Q662 T663 A664 N669 K670	Q662-S666 WeakPolarHBondContact O-CB 3.25Å; Q662-S666 PolarHBondContact O-N 3.24Å; Q662-S666 VanDerWaalsContact O-N 3.07Å; T663-S666 WeakPolarHBondContact O-CB 3.27Å; T663-S666 PolarHBondContact O-N 2.88Å; A664-S666 VanDerWaalsContact C-N 3.33Å; A664-S666 PolarHBondContact O-N 3.36Å; S666-N669 PolarHBondContact O-N 2.9Å; S666-K670 PolarHBondContact O-N 2.92Å
667	Q	96	Very high	94.7	Very high	104 Å²	104	71 Å²	71	49%	0.486	37%	0.367	S	S	.	.	H	α-helix	trans	-64.9	-44.6	177.4	-178.8	63.5	15.6	0	0	112.4	T663 A664 K670 Q671	T663-Q667 PolarHBondContact O-N 2.66Å; A664-Q667 PolarHBondContact O-N 3.06Å; Q667-K670 PolarHBondContact O-N 2.83Å; Q667-Q671 WeakPolarHBondContact O-CG 3.27Å; Q667-Q671 PolarHBondContact O-N 2.72Å
668	V	96.6	Very high	94.4	Very high	10 Å²	10	73.5 Å²	73.5	6%	0.061	38%	0.38	C	S	.	.	H	α-helix	trans	-66.5	-38.4	178.9	171.9	0	0	0	0	111.5	L522 R525 K526 L529 A664 L665 Q671 L672	L522-V668 HydrophobicContact CB-CG1 4.38Å; L522-V668 HydrophobicContact CD2-CG1 4.35Å; L522-V668 WeakPolarHBondContact O-CG1 3.48Å; R525-V668 HydrophobicContact CG-CG2 3.98Å; K526-V668 HydrophobicContact CB-CG1 3.9Å; L529-V668 HydrophobicContact CD1-CB 4.44Å; L529-V668 HydrophobicContact CD1-CG2 3.87Å; A664-V668 WeakPolarHBondContact O-CG2 3.32Å; A664-V668 PolarHBondContact O-N 2.88Å; L665-V668 PolarHBondContact O-N 3.29Å; V668-Q671 PolarHBondContact O-N 3.49Å; V668-L672 WeakPolarHBondContact O-CB 3.36Å; V668-L672 PolarHBondContact O-N 3.18Å
669	N	96.1	Very high	94.2	Very high	46 Å²	46	76.1 Å²	76.1	25%	0.246	40%	0.401	C	S	.	.	H	α-helix	trans	-58.9	-50	170.5	-74	-33.3	0	0	0	110.7	K526 L665 S666 Q671 L672 D673	K526-N669 WeakPolarHBondContact CE-OD1 3.5Å; K526-N669 PolarHBondContact NZ-OD1 2.69Å; L665-N669 WeakPolarHBondContact O-CB 3.42Å; L665-N669 VanDerWaalsContact O-CG 3.27Å; L665-N669 PolarHBondContact O-N 3.12Å; L665-N669 PolarHBondContact O-ND2 2.85Å; L665-N669 VanDerWaalsContact O-ND2 3.16Å; S666-N669 PolarHBondContact O-N 2.9Å; N669-Q671 VanDerWaalsContact C-N 3.29Å; N669-Q671 PolarHBondContact O-N 2.8Å; N669-L672 CarbonylContact O-C 3.52Å; N669-L672 WeakPolarHBondContact O-CB 3.25Å; N669-L672 PolarHBondContact O-N 3.13Å; N669-D673 PolarHBondContact O-N 3.46Å
670	K	95.7	Very high	94.1	Very high	128 Å²	128	73 Å²	73	56%	0.557	39%	0.389	S	S	*	.	H	α-helix	trans	-57.7	-39.7	178.3	-173.4	-176.8	177.3	-173.4	0	112.9	S666 Q667 D673 I674	S666-K670 PolarHBondContact O-N 2.92Å; Q667-K670 PolarHBondContact O-N 2.83Å; K670-D673 PolarHBondContact O-N 3.43Å; K670-I674 HydrophobicContact CG-CD1 4.35Å; K670-I674 WeakPolarHBondContact O-CD1 3.45Å; K670-I674 WeakPolarHBondContact O-CG1 3.33Å; K670-I674 PolarHBondContact O-N 3.34Å
671	Q	95.7	Very high	93.7	Very high	82 Å²	82	75.2 Å²	75.2	38%	0.383	39%	0.391	S	S	.	.	H	α-helix	trans	-66.9	-39.5	176.6	-69.8	177.5	-84.8	0	0	112.1	L522 Q667 V668 N669 L675	L522-Q671 HydrophobicContact CD1-CB 3.8Å; L522-Q671 HydrophobicContact CD2-CB 4.2Å; Q667-Q671 WeakPolarHBondContact O-CG 3.27Å; Q667-Q671 PolarHBondContact O-N 2.72Å; V668-Q671 PolarHBondContact O-N 3.49Å; N669-Q671 VanDerWaalsContact C-N 3.29Å; N669-Q671 PolarHBondContact O-N 2.8Å; Q671-L675 PolarHBondContact O-N 3.01Å
672	L	95	Very high	93.2	Very high	9 Å²	9	79.9 Å²	79.9	5%	0.047	42%	0.416	C	S	.	.	H	α-helix	trans	-66.4	-41.8	175.1	-177.2	67	0	0	0	111.4	I519 L523 K526 V668 N669 I674 L675 L676	I519-L672 HydrophobicContact CG1-CD1 4.44Å; I519-L672 HydrophobicContact CG2-CD1 3.99Å; L523-L672 HydrophobicContact CD2-CD1 4.3Å; L523-L672 HydrophobicContact CD2-CD2 3.76Å; L523-L672 HydrophobicContact CG-CD1 4.36Å; K526-L672 HydrophobicContact CD-CD2 4.3Å; V668-L672 WeakPolarHBondContact O-CB 3.36Å; V668-L672 PolarHBondContact O-N 3.18Å; N669-L672 CarbonylContact O-C 3.52Å; N669-L672 WeakPolarHBondContact O-CB 3.25Å; N669-L672 PolarHBondContact O-N 3.13Å; L672-I674 VanDerWaalsContact C-N 3.31Å; L672-I674 PolarHBondContact O-N 2.93Å; L672-L675 PolarHBondContact O-N 3.41Å; L672-L676 HydrophobicContact CD1-CD1 4.15Å; L672-L676 HydrophobicContact CD1-CG 4.35Å; L672-L676 HydrophobicContact CG-CD1 3.86Å; L672-L676 HydrophobicContact CG-CG 4.43Å; L672-L676 WeakPolarHBondContact O-CB 3.43Å; L672-L676 VanDerWaalsContact O-CG 3.27Å; L672-L676 WeakPolarHBondContact O-CG 3.38Å; L672-L676 PolarHBondContact O-N 2.83Å
673	D	94.6	Very high	93	Very high	81 Å²	81	80 Å²	80	43%	0.433	42%	0.418	S	S	.	.	H	α-helix	trans	-61.5	-37.5	178.9	-63.4	-30.6	0	0	0	111.9	N669 K670 Q677	N669-D673 PolarHBondContact O-N 3.46Å; K670-D673 PolarHBondContact O-N 3.43Å; D673-Q677 VanDerWaalsContact O-CG 3.26Å; D673-Q677 WeakPolarHBondContact O-CG 3.41Å; D673-Q677 PolarHBondContact O-N 2.89Å; D673-Q677 PolarHBondContact O-NE2 2.91Å
674	I	93.9	Very high	93	Very high	78 Å²	78	76.1 Å²	76.1	40%	0.4	39%	0.393	S	S	.	.	H	α-helix	trans	-65	-53.1	174.9	-68.8	162.9	0	0	0	110.6	K670 L672 L676 Q677 E678	K670-I674 HydrophobicContact CG-CD1 4.35Å; K670-I674 WeakPolarHBondContact O-CD1 3.45Å; K670-I674 WeakPolarHBondContact O-CG1 3.33Å; K670-I674 PolarHBondContact O-N 3.34Å; L672-I674 VanDerWaalsContact C-N 3.31Å; L672-I674 PolarHBondContact O-N 2.93Å; I674-L676 PolarHBondContact O-N 3.48Å; I674-Q677 PolarHBondContact O-N 3.38Å; I674-E678 PolarHBondContact O-N 2.94Å; I674-E678 VanDerWaalsContact O-N 3.16Å
675	L	92.5	Very high	93	Very high	36 Å²	36	75.7 Å²	75.7	19%	0.188	39%	0.386	C	S	.	.	H	α-helix	trans	-64.8	-25.8	-178.3	-65.4	174.9	0	0	0	113.4	H515 L518 I519 L522 Q671 L672	H515-L675 PolarHBondContact CE1-O 2.91Å; H515-L675 PolarHBondContact NE2-O 3.46Å; L518-L675 HydrophobicContact CB-CD1 4.33Å; L518-L675 HydrophobicContact CD2-CD1 3.57Å; L518-L675 HydrophobicContact CD2-CD2 3.96Å; L518-L675 HydrophobicContact CD2-CG 4.42Å; L518-L675 HydrophobicContact CG-CD1 3.63Å; I519-L675 HydrophobicContact CD1-CB 4.25Å; I519-L675 HydrophobicContact CG1-CB 4.01Å; I519-L675 HydrophobicContact CG1-CD1 4.16Å; L522-L675 HydrophobicContact CD1-CD1 3.64Å; Q671-L675 PolarHBondContact O-N 3.01Å; L672-L675 PolarHBondContact O-N 3.41Å
676	L	92.2	Very high	92.9	Very high	106 Å²	106	77 Å²	77	56%	0.555	40%	0.395	S	S	*	.	H	α-helix	trans	-80.6	-17.7	174	-69.8	174	0	0	0	113.6	I519 L672 I674	I519-L676 HydrophobicContact CD1-CD2 4.01Å; L672-L676 HydrophobicContact CD1-CD1 4.15Å; L672-L676 HydrophobicContact CD1-CG 4.35Å; L672-L676 HydrophobicContact CG-CD1 3.86Å; L672-L676 HydrophobicContact CG-CG 4.43Å; L672-L676 WeakPolarHBondContact O-CB 3.43Å; L672-L676 VanDerWaalsContact O-CG 3.27Å; L672-L676 WeakPolarHBondContact O-CG 3.38Å; L672-L676 PolarHBondContact O-N 2.83Å; I674-L676 PolarHBondContact O-N 3.48Å
677	Q	92.7	Very high	92.9	Very high	150 Å²	150	79.5 Å²	79.5	70%	0.701	40%	0.396	S	S	*	.	H	α-helix	trans	-84.9	-30.5	173.3	-75.6	165	50.9	0	0	112.2	D673 I674 P679	D673-Q677 VanDerWaalsContact O-CG 3.26Å; D673-Q677 WeakPolarHBondContact O-CG 3.41Å; D673-Q677 PolarHBondContact O-N 2.89Å; D673-Q677 PolarHBondContact O-NE2 2.91Å; I674-Q677 PolarHBondContact O-N 3.38Å; Q677-P679 VanDerWaalsContact O-CD 3.24Å; Q677-P679 WeakPolarHBondContact O-CD 3.45Å
678	E	86.9	Confident	92.8	Very high	146 Å²	146	80.3 Å²	80.3	68%	0.682	40%	0.4	S	S	*	.	S	Bend	trans	-119.3	70.9	-176.3	-66.2	171.2	-175.6	0	0	111.9	H515 I674	H515-E678 PolarHBondContact NE2-O 3.49Å; I674-E678 PolarHBondContact O-N 2.94Å; I674-E678 VanDerWaalsContact O-N 3.16Å
679	P	90.2	Very high	92.8	Very high	87 Å²	87	81 Å²	81	57%	0.565	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-75.2	143.6	170.3	32	-34.1	0	0	0	111.6	Q677	Q677-P679 VanDerWaalsContact O-CD 3.24Å; Q677-P679 WeakPolarHBondContact O-CD 3.45Å
680	P	89.5	Confident	92.8	Very high	41 Å²	41	81 Å²	81	27%	0.266	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-58.9	149.5	171.9	-23.4	33	0	0	0	112.7	L511 K512 H515 D682	L511-P680 HydrophobicContact CB-CB 4.44Å; K512-P680 HydrophobicContact CG-CB 4.08Å; K512-P680 HydrophobicContact CG-CG 4.49Å; H515-P680 HydrophobicContact CB-CG 3.9Å; P680-D682 PolarHBondContact O-N 3.45Å
681	K	86.7	Confident	92.9	Very high	126 Å²	126	75.7 Å²	75.7	55%	0.548	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-46.8	132.3	172.3	-89.4	-161.1	174.7	-167.3	0	110	M683 E689	K681-M683 PolarHBondContact O-N 3.37Å; K681-E689 IonicContact NZ-OE1 3.46Å; K681-E689 PolarHBondContact NZ-OE1 3.06Å
682	D	84.6	Confident	93	Very high	120 Å²	120	71.9 Å²	71.9	64%	0.642	36%	0.36	S	S	*	.	S	Bend	trans	-66.7	-26.7	-171.4	-116	-34.9	0	0	0	113.3	K512 P680	K512-D682 PolarHBondContact NZ-O 3.28Å; K512-D682 IonicContact NZ-OD1 3.93Å; K512-D682 PolarHBondContact NZ-OD1 2.91Å; P680-D682 PolarHBondContact O-N 3.45Å
683	M	91.5	Very high	93.2	Very high	101 Å²	101	71.5 Å²	71.5	50%	0.498	36%	0.358	S	S	.	.	S	Bend	trans	-145.5	167.3	174.8	57.1	-164.8	72.2	0	0	109.1	K681 T686	K681-M683 PolarHBondContact O-N 3.37Å; M683-T686 HydrophobicContact CG-CG2 4.26Å; M683-T686 HydrophobicContact SD-CG2 3.83Å
684	Y	94.9	Very high	93.3	Very high	13 Å²	13	67.8 Å²	67.8	5%	0.051	34%	0.338	C	S	.	.	S	Bend	trans	-71	-54.6	176.6	166.2	-134	0	0	0	111.3	E461 I501 Q504 E505	E461-Y684 WeakPolarHBondContact OE1-CE2 3.44Å; E461-Y684 VanDerWaalsContact OE1-CZ 3.25Å; E461-Y684 PolarHBondContact OE1-OH 3.3Å; I501-Y684 HydrophobicContact CB-CE1 4.3Å; I501-Y684 HydrophobicContact CG1-CE1 4.29Å; I501-Y684 HydrophobicContact CG2-CD1 4.36Å; I501-Y684 HydrophobicContact CG2-CE1 4.06Å; Q504-Y684 HydrophobicContact CB-CD1 3.68Å; Q504-Y684 HydrophobicContact CB-CD2 3.76Å; Q504-Y684 HydrophobicContact CB-CE1 3.63Å; Q504-Y684 HydrophobicContact CB-CE2 3.71Å; Q504-Y684 HydrophobicContact CB-CG 3.73Å; Q504-Y684 HydrophobicContact CG-CE1 4.29Å; Q504-Y684 HydrophobicContact CG-CE2 4.06Å; E505-Y684 HydrophobicContact CG-CD1 3.95Å
685	L	95.4	Very high	93.5	Very high	22 Å²	22	64.4 Å²	64.4	12%	0.115	32%	0.32	C	S	.	.	S	Bend	trans	-130.2	137.7	173.7	-59.5	169.2	0	0	0	108.7	I458 E689 R690 L693	I458-L685 HydrophobicContact CD1-CD2 4.07Å; L685-E689 HydrophobicContact CB-CB 4.11Å; L685-E689 HydrophobicContact CD2-CB 3.97Å; L685-R690 HydrophobicContact CB-CB 4.34Å; L685-L693 HydrophobicContact CD1-CD2 3.53Å
686	T	94.6	Very high	93.8	Very high	53 Å²	53	62.9 Å²	62.9	33%	0.325	31%	0.312	S	S	.	.			trans	-71.9	169.4	165.1	58.2	0	0	0	0	111.2	M683 E688 E689 R690	M683-T686 HydrophobicContact CG-CG2 4.26Å; M683-T686 HydrophobicContact SD-CG2 3.83Å; T686-E688 PolarHBondContact O-N 2.92Å; T686-E689 VanDerWaalsContact CB-OE2 3.23Å; T686-E689 WeakPolarHBondContact CB-OE2 3.3Å; T686-E689 WeakPolarHBondContact CG2-OE2 3.41Å; T686-E689 PolarHBondContact N-OE2 2.95Å; T686-E689 PolarHBondContact O-N 3.26Å; T686-E689 WeakPolarHBondContact OG1-CG 3.39Å; T686-E689 PolarHBondContact OG1-N 2.94Å; T686-E689 PolarHBondContact OG1-OE2 2.65Å; T686-R690 WeakPolarHBondContact O-CB 3.39Å; T686-R690 PolarHBondContact O-N 3.03Å
687	K	94.7	Very high	94.1	Very high	130 Å²	130	58 Å²	58	57%	0.565	29%	0.286	S	S	*	.	H	α-helix	trans	-57.7	-34.1	173.7	-167	-159.5	166.4	-163.5	0	111.7	S691 E911	K687-S691 WeakPolarHBondContact O-CB 3.23Å; K687-S691 PolarHBondContact O-N 2.85Å; K687-S691 PolarHBondContact O-OG 2.83Å; K687-E911 IonicContact NZ-OE2 3.62Å; K687-E911 PolarHBondContact NZ-OE2 3.17Å
688	E	94.6	Very high	94.3	Very high	121 Å²	121	50.8 Å²	50.8	57%	0.565	25%	0.253	S	S	*	.	H	α-helix	trans	-70	-55.9	178.1	-170	170.8	173.3	0	0	110.7	T686 R690 S691 I692	T686-E688 PolarHBondContact O-N 2.92Å; E688-R690 VanDerWaalsContact C-N 3.31Å; E688-R690 PolarHBondContact O-N 2.87Å; E688-S691 WeakPolarHBondContact O-CB 3.47Å; E688-S691 PolarHBondContact O-N 3.2Å; E688-I692 WeakPolarHBondContact O-CG1 3.21Å; E688-I692 PolarHBondContact O-N 2.87Å
689	E	96.8	Very high	94.8	Very high	26 Å²	26	44 Å²	44	12%	0.121	22%	0.221	C	C	.	.	H	α-helix	trans	-54.3	-43.1	174.8	-71.1	160.9	125.8	0	0	112	L454 I458 K681 L685 T686 S691 I692 L693	L454-E689 HydrophobicContact CD1-CG 4.02Å; I458-E689 HydrophobicContact CD1-CB 3.82Å; I458-E689 HydrophobicContact CD1-CG 4.02Å; K681-E689 IonicContact NZ-OE1 3.46Å; K681-E689 PolarHBondContact NZ-OE1 3.06Å; L685-E689 HydrophobicContact CB-CB 4.11Å; L685-E689 HydrophobicContact CD2-CB 3.97Å; T686-E689 VanDerWaalsContact CB-OE2 3.23Å; T686-E689 WeakPolarHBondContact CB-OE2 3.3Å; T686-E689 WeakPolarHBondContact CG2-OE2 3.41Å; T686-E689 PolarHBondContact N-OE2 2.95Å; T686-E689 PolarHBondContact O-N 3.26Å; T686-E689 WeakPolarHBondContact OG1-CG 3.39Å; T686-E689 PolarHBondContact OG1-N 2.94Å; T686-E689 PolarHBondContact OG1-OE2 2.65Å; E689-S691 PolarHBondContact O-N 2.85Å; E689-I692 PolarHBondContact O-N 3.38Å; E689-L693 PolarHBondContact O-N 2.96Å
690	R	97	Very high	95.1	Very high	46 Å²	46	39.9 Å²	39.9	17%	0.174	20%	0.195	C	C	.	.	H	α-helix	trans	-65.7	-34.4	175.3	174.1	63.6	-158	-138.2	17	112.8	E498 L685 T686 E688 L693 D694	E498-R690 IonicContact OE1-CZ 2.78Å; E498-R690 IonicContact OE1-NH1 2.74Å; E498-R690 PolarHBondContact OE1-NH1 3.16Å; E498-R690 IonicContact OE1-NH2 3.68Å; E498-R690 PolarHBondContact OE1-NH2 3.08Å; E498-R690 IonicContact OE2-NH1 3.77Å; L685-R690 HydrophobicContact CB-CB 4.34Å; T686-R690 WeakPolarHBondContact O-CB 3.39Å; T686-R690 PolarHBondContact O-N 3.03Å; E688-R690 VanDerWaalsContact C-N 3.31Å; E688-R690 PolarHBondContact O-N 2.87Å; R690-L693 PolarHBondContact O-N 3.39Å; R690-D694 IonicContact CZ-OD1 2.83Å; R690-D694 IonicContact CZ-OD2 3.65Å; R690-D694 IonicContact NE-OD1 2.72Å; R690-D694 IonicContact NE-OD2 2.81Å; R690-D694 PolarHBondContact NE-OD2 2.94Å; R690-D694 IonicContact NH2-OD1 3.29Å; R690-D694 PolarHBondContact NH2-OD1 3.31Å; R690-D694 IonicContact NH2-OD2 2.66Å; R690-D694 PolarHBondContact NH2-OD2 2.65Å; R690-D694 VanDerWaalsContact NH2-OD2 3.16Å; R690-D694 WeakPolarHBondContact O-CB 3.36Å; R690-D694 PolarHBondContact O-N 2.74Å
691	S	97.5	Very high	95.6	Very high	15 Å²	15	38.2 Å²	38.2	11%	0.105	18%	0.183	C	C	.	.	H	α-helix	trans	-69.4	-39.8	177.4	-57.8	0	0	0	0	110.9	K687 E688 E689 D694 W695 V909	K687-S691 WeakPolarHBondContact O-CB 3.23Å; K687-S691 PolarHBondContact O-N 2.85Å; K687-S691 PolarHBondContact O-OG 2.83Å; E688-S691 WeakPolarHBondContact O-CB 3.47Å; E688-S691 PolarHBondContact O-N 3.2Å; E689-S691 PolarHBondContact O-N 2.85Å; S691-D694 PolarHBondContact O-N 3.2Å; S691-W695 PolarHBondContact O-N 2.86Å; S691-W695 VanDerWaalsContact O-N 3.12Å; S691-V909 VanDerWaalsContact C-CG1 3.47Å; S691-V909 WeakPolarHBondContact O-CG1 3.34Å
692	I	97.9	Very high	96	Very high	2 Å²	2	33 Å²	33	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-64	-46.7	173.2	-59.1	168.4	0	0	0	109.7	L442 I450 L454 I458 E688 E689 D694 W695 H696 V909	L442-I692 HydrophobicContact CD1-CG2 4.14Å; I450-I692 HydrophobicContact CD1-CD1 4.41Å; I450-I692 HydrophobicContact CD1-CG1 4.18Å; I450-I692 HydrophobicContact CG2-CD1 3.86Å; L454-I692 HydrophobicContact CD2-CD1 3.75Å; L454-I692 HydrophobicContact CG-CD1 3.89Å; I458-I692 HydrophobicContact CB-CB 4.43Å; I458-I692 HydrophobicContact CB-CG2 3.83Å; I458-I692 HydrophobicContact CG1-CB 4.49Å; I458-I692 HydrophobicContact CG1-CG2 4.31Å; I458-I692 HydrophobicContact CG2-CB 4.01Å; I458-I692 HydrophobicContact CG2-CG2 3.63Å; E688-I692 WeakPolarHBondContact O-CG1 3.21Å; E688-I692 PolarHBondContact O-N 2.87Å; E689-I692 PolarHBondContact O-N 3.38Å; I692-D694 VanDerWaalsContact C-N 3.28Å; I692-D694 PolarHBondContact O-N 3.23Å; I692-W695 WeakPolarHBondContact O-CA 3.34Å; I692-W695 WeakPolarHBondContact O-CB 3.33Å; I692-W695 PolarHBondContact O-N 3.38Å; I692-H696 PolarHBondContact O-CD2 2.93Å; I692-H696 VanDerWaalsContact O-CD2 3.25Å; I692-H696 PolarHBondContact O-N 3.14Å; I692-V909 HydrophobicContact CG1-CG1 4.45Å
693	L	97.9	Very high	96.5	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-57.8	-40.7	175.3	179.1	60.8	0	0	0	112.1	I458 F462 L465 I501 L685 E689 R690 W695 H696 L697	I458-L693 HydrophobicContact CG2-CB 3.93Å; F462-L693 HydrophobicContact CB-CD1 3.75Å; F462-L693 HydrophobicContact CD2-CD1 3.91Å; F462-L693 HydrophobicContact CG-CD1 4.33Å; L465-L693 HydrophobicContact CD1-CD1 4.22Å; L465-L693 HydrophobicContact CD1-CD2 3.92Å; I501-L693 HydrophobicContact CD1-CD2 4.05Å; L685-L693 HydrophobicContact CD1-CD2 3.53Å; E689-L693 PolarHBondContact O-N 2.96Å; R690-L693 PolarHBondContact O-N 3.39Å; L693-W695 PolarHBondContact O-N 3.42Å; L693-H696 PolarHBondContact O-N 2.7Å; L693-L697 HydrophobicContact CG-CD1 4.03Å; L693-L697 WeakPolarHBondContact O-CG 3.23Å; L693-L697 PolarHBondContact O-N 3.03Å
694	D	98.3	Very high	96.7	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.016	12%	0.122	C	C	.	.	H	α-helix	trans	-64.8	-22.4	173.5	-90.3	-42.2	0	0	0	113.2	R690 S691 I692 A698 T913 R916	R690-D694 IonicContact CZ-OD1 2.83Å; R690-D694 IonicContact CZ-OD2 3.65Å; R690-D694 IonicContact NE-OD1 2.72Å; R690-D694 IonicContact NE-OD2 2.81Å; R690-D694 PolarHBondContact NE-OD2 2.94Å; R690-D694 IonicContact NH2-OD1 3.29Å; R690-D694 PolarHBondContact NH2-OD1 3.31Å; R690-D694 IonicContact NH2-OD2 2.66Å; R690-D694 PolarHBondContact NH2-OD2 2.65Å; R690-D694 VanDerWaalsContact NH2-OD2 3.16Å; R690-D694 WeakPolarHBondContact O-CB 3.36Å; R690-D694 PolarHBondContact O-N 2.74Å; S691-D694 PolarHBondContact O-N 3.2Å; I692-D694 VanDerWaalsContact C-N 3.28Å; I692-D694 PolarHBondContact O-N 3.23Å; D694-A698 VanDerWaalsContact O-CB 3.28Å; D694-A698 WeakPolarHBondContact O-CB 3.44Å; D694-A698 PolarHBondContact O-N 2.74Å; D694-T913 WeakPolarHBondContact OD1-CG2 3.12Å; D694-T913 WeakPolarHBondContact OD2-CA 3.18Å; D694-T913 WeakPolarHBondContact OD2-CB 3.25Å; D694-T913 PolarHBondContact OD2-OG1 2.79Å; D694-R916 HydrophobicContact CB-CB 4Å; D694-R916 WeakPolarHBondContact O-CB 3.43Å; D694-R916 WeakPolarHBondContact O-CD 3.49Å; D694-R916 WeakPolarHBondContact OD1-CD 3.45Å; D694-R916 IonicContact OD1-CZ 3.62Å; D694-R916 IonicContact OD1-NE 3.63Å; D694-R916 IonicContact OD1-NH1 3.9Å; D694-R916 PolarHBondContact OD1-NH1 2.92Å
695	W	98.2	Very high	96.9	Very high	7 Å²	7	24.1 Å²	24.1	3%	0.027	12%	0.119	C	C	.	.	H	α-helix	trans	-71	-43.5	169.3	-177	92.9	0	0	0	112.3	L442 S691 I692 L693 L697 A698 N699 V909 F920 L921	L442-W695 HydrophobicContact CD1-CD2 4.08Å; L442-W695 HydrophobicContact CD1-CE3 3.88Å; L442-W695 HydrophobicContact CD1-CZ3 4.35Å; L442-W695 HydrophobicContact CD2-CD2 3.67Å; L442-W695 VanDerWaalsContact CD2-CE2 3.44Å; L442-W695 HydrophobicContact CD2-CE3 3.88Å; L442-W695 HydrophobicContact CD2-CG 4.39Å; L442-W695 HydrophobicContact CD2-CH2 3.77Å; L442-W695 HydrophobicContact CD2-CZ2 3.52Å; L442-W695 HydrophobicContact CD2-CZ3 3.93Å; S691-W695 PolarHBondContact O-N 2.86Å; S691-W695 VanDerWaalsContact O-N 3.12Å; I692-W695 WeakPolarHBondContact O-CA 3.34Å; I692-W695 WeakPolarHBondContact O-CB 3.33Å; I692-W695 PolarHBondContact O-N 3.38Å; L693-W695 PolarHBondContact O-N 3.42Å; W695-L697 VanDerWaalsContact C-N 3.35Å; W695-L697 PolarHBondContact O-N 2.9Å; W695-A698 WeakPolarHBondContact O-CB 3.19Å; W695-A698 PolarHBondContact O-N 3.37Å; W695-N699 PolarHBondContact O-N 3.5Å; W695-V909 HydrophobicContact CB-CG2 4.1Å; W695-V909 HydrophobicContact CG-CG2 4.19Å; W695-F920 AromaticContact CD1-CD2 3.86Å; W695-F920 AromaticContact NE1-CD2 3.54Å; W695-F920 PolarHBondContact NE1-O 2.56Å; W695-L921 HydrophobicContact CZ2-CD1 4.2Å
696	H	97.8	Very high	97	Very high	5 Å²	5	23.4 Å²	23.4	2%	0.023	12%	0.116	C	C	.	.	H	α-helix	trans	-63.8	-41.7	173.6	-62.9	-93.8	0	0	0	111.2	F462 I692 L693 A698 N699 L700	F462-H696 HydrophobicContact CB-CB 4.12Å; F462-H696 HydrophobicContact CD1-CB 3.93Å; F462-H696 HydrophobicContact CD2-CB 3.47Å; F462-H696 VanDerWaalsContact CD2-CB 3.47Å; F462-H696 HydrophobicContact CE1-CB 4.17Å; F462-H696 HydrophobicContact CE2-CB 3.73Å; F462-H696 HydrophobicContact CG-CB 3.56Å; F462-H696 HydrophobicContact CZ-CB 4.07Å; I692-H696 PolarHBondContact O-CD2 2.93Å; I692-H696 VanDerWaalsContact O-CD2 3.25Å; I692-H696 PolarHBondContact O-N 3.14Å; L693-H696 PolarHBondContact O-N 2.7Å; H696-A698 VanDerWaalsContact C-N 3.32Å; H696-A698 PolarHBondContact O-N 3.19Å; H696-N699 WeakPolarHBondContact O-CB 3.26Å; H696-N699 PolarHBondContact O-N 3.44Å; H696-L700 PolarHBondContact O-N 3.03Å
697	L	98.1	Very high	97.2	Very high	2 Å²	2	23 Å²	23	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-61.6	-39.3	173.4	-65.1	165.5	0	0	0	111.5	F462 I497 L693 W695 N699 L700 E701 L708	F462-L697 HydrophobicContact CD2-CD2 4.22Å; F462-L697 HydrophobicContact CD2-CG 4.35Å; F462-L697 HydrophobicContact CE2-CD2 3.85Å; F462-L697 HydrophobicContact CE2-CG 4.19Å; I497-L697 HydrophobicContact CD1-CD2 3.92Å; I497-L697 HydrophobicContact CG2-CD2 4.01Å; L693-L697 HydrophobicContact CG-CD1 4.03Å; L693-L697 WeakPolarHBondContact O-CG 3.23Å; L693-L697 PolarHBondContact O-N 3.03Å; W695-L697 VanDerWaalsContact C-N 3.35Å; W695-L697 PolarHBondContact O-N 2.9Å; L697-N699 VanDerWaalsContact C-N 3.28Å; L697-N699 PolarHBondContact O-N 2.98Å; L697-L700 PolarHBondContact O-N 3.1Å; L697-E701 WeakPolarHBondContact O-CG 3.36Å; L697-E701 PolarHBondContact O-N 3.31Å; L697-L708 HydrophobicContact CB-CD1 4.13Å; L697-L708 HydrophobicContact CD2-CD1 3.47Å; L697-L708 VanDerWaalsContact CD2-CD1 3.47Å; L697-L708 HydrophobicContact CG-CD1 4.38Å
698	A	98	Very high	97.3	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62.7	-32.8	172.3	0	0	0	0	0	113	D694 W695 H696 E701 F702 R916 F920	D694-A698 VanDerWaalsContact O-CB 3.28Å; D694-A698 WeakPolarHBondContact O-CB 3.44Å; D694-A698 PolarHBondContact O-N 2.74Å; W695-A698 WeakPolarHBondContact O-CB 3.19Å; W695-A698 PolarHBondContact O-N 3.37Å; H696-A698 VanDerWaalsContact C-N 3.32Å; H696-A698 PolarHBondContact O-N 3.19Å; A698-E701 PolarHBondContact O-N 3.12Å; A698-F702 PolarHBondContact O-N 2.96Å; A698-R916 HydrophobicContact CB-CB 4.09Å; A698-R916 HydrophobicContact CB-CG 3.87Å; A698-F920 HydrophobicContact CB-CD2 3.81Å; A698-F920 HydrophobicContact CB-CE2 4.23Å; A698-F920 HydrophobicContact CB-CG 4.1Å
699	N	96.7	Very high	97.4	Very high	3 Å²	3	15.6 Å²	15.6	2%	0.016	8%	0.078	C	C	.	.	H	α-helix	trans	-72.8	-37.2	178.4	-146.6	22.2	0	0	0	111.9	Q19 T20 W695 H696 L697 F702 A703 F920	Q19-N699 PolarHBondContact O-ND2 3.09Å; Q19-N699 VanDerWaalsContact O-ND2 3.1Å; T20-N699 WeakPolarHBondContact CG2-OD1 3.26Å; T20-N699 PolarHBondContact OG1-ND2 3.4Å; W695-N699 PolarHBondContact O-N 3.5Å; H696-N699 WeakPolarHBondContact O-CB 3.26Å; H696-N699 PolarHBondContact O-N 3.44Å; L697-N699 VanDerWaalsContact C-N 3.28Å; L697-N699 PolarHBondContact O-N 2.98Å; N699-F702 VanDerWaalsContact O-CB 3.3Å; N699-F702 WeakPolarHBondContact O-CB 3.13Å; N699-F702 PolarHBondContact O-N 2.95Å; N699-A703 PolarHBondContact O-N 3.34Å; N699-F920 HydrophobicContact CB-CE2 3.91Å; N699-F920 WeakPolarHBondContact OD1-CE2 3.19Å
700	L	97.1	Very high	97.5	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-66.6	-37.8	170	179.6	62.5	0	0	0	112.2	V23 F462 L466 L493 H696 L697 F702 A703 N704 L708 W716	V23-L700 HydrophobicContact CB-CD1 4.38Å; V23-L700 HydrophobicContact CG2-CD1 3.98Å; F462-L700 HydrophobicContact CZ-CB 4.23Å; F462-L700 HydrophobicContact CZ-CD2 4.31Å; L466-L700 HydrophobicContact CD1-CD2 4.33Å; L466-L700 HydrophobicContact CD2-CD2 4.25Å; L493-L700 HydrophobicContact CD2-CD2 3.96Å; H696-L700 PolarHBondContact O-N 3.03Å; L697-L700 PolarHBondContact O-N 3.1Å; L700-F702 VanDerWaalsContact C-N 3.29Å; L700-F702 PolarHBondContact O-N 2.75Å; L700-A703 PolarHBondContact O-N 3.35Å; L700-N704 WeakPolarHBondContact CD1-ND2 3.48Å; L700-N704 PolarHBondContact O-N 3.01Å; L700-N704 VanDerWaalsContact O-N 3.15Å; L700-N704 PolarHBondContact O-ND2 3.28Å; L700-L708 HydrophobicContact CB-CD2 4.18Å; L700-L708 HydrophobicContact CD2-CD1 4.25Å; L700-L708 HydrophobicContact CD2-CD2 3.7Å; L700-L708 HydrophobicContact CG-CD2 3.64Å; L700-W716 HydrophobicContact CD1-CE3 4.14Å; L700-W716 HydrophobicContact CD1-CH2 3.93Å; L700-W716 HydrophobicContact CD1-CZ3 3.48Å; L700-W716 VanDerWaalsContact CD1-CZ3 3.48Å
701	E	98.2	Very high	97.5	Very high	5 Å²	5	15.1 Å²	15.1	2%	0.023	8%	0.079	C	C	.	.	H	α-helix	trans	-67.1	-27.7	170.7	-69.8	-173.9	148.5	0	0	113	L697 A698 A705 T706 E707 L708 R916	L697-E701 WeakPolarHBondContact O-CG 3.36Å; L697-E701 PolarHBondContact O-N 3.31Å; A698-E701 PolarHBondContact O-N 3.12Å; E701-A705 CarbonylContact O-C 3.54Å; E701-A705 VanDerWaalsContact O-CA 3.23Å; E701-A705 WeakPolarHBondContact O-CA 3.13Å; E701-A705 PolarHBondContact O-N 3.29Å; E701-T706 WeakPolarHBondContact CA-O 3.47Å; E701-T706 VanDerWaalsContact CB-O 3.28Å; E701-T706 WeakPolarHBondContact CB-O 3.28Å; E701-T706 VanDerWaalsContact CG-O 3.31Å; E701-T706 WeakPolarHBondContact CG-O 3.3Å; E701-T706 PolarHBondContact O-N 3.39Å; E701-T706 VanDerWaalsContact O-N 3.09Å; E701-E707 VanDerWaalsContact OE1-CA 3.32Å; E701-E707 WeakPolarHBondContact OE1-CA 3.36Å; E701-L708 HydrophobicContact CG-CD1 4.45Å; E701-L708 HydrophobicContact CG-CD2 3.51Å; E701-L708 HydrophobicContact CG-CG 3.54Å; E701-L708 PolarHBondContact OE1-N 3.4Å; E701-R916 IonicContact OE1-CZ 2.73Å; E701-R916 IonicContact OE1-NE 3.58Å; E701-R916 IonicContact OE1-NH2 3.2Å; E701-R916 PolarHBondContact OE1-NH2 2.92Å; E701-R916 IonicContact OE2-CZ 2.72Å; E701-R916 IonicContact OE2-NE 3.54Å; E701-R916 PolarHBondContact OE2-NE 2.71Å; E701-R916 IonicContact OE2-NH2 2.72Å; E701-R916 PolarHBondContact OE2-NH2 3.34Å
702	F	96.7	Very high	97.5	Very high	18 Å²	18	14.8 Å²	14.8	8%	0.079	8%	0.077	C	C	.	.	H	α-helix	trans	-68.8	-51.4	169.5	154.7	-86.9	0	0	0	110.9	T20 A698 N699 L700 N704 A705 L887 F920 L934 A936 Y1053	T20-F702 HydrophobicContact CG2-CD1 3.69Å; T20-F702 HydrophobicContact CG2-CE1 3.37Å; T20-F702 HydrophobicContact CG2-CZ 4.08Å; T20-F702 WeakPolarHBondContact O-CE1 3.35Å; A698-F702 PolarHBondContact O-N 2.96Å; N699-F702 VanDerWaalsContact O-CB 3.3Å; N699-F702 WeakPolarHBondContact O-CB 3.13Å; N699-F702 PolarHBondContact O-N 2.95Å; L700-F702 VanDerWaalsContact C-N 3.29Å; L700-F702 PolarHBondContact O-N 2.75Å; F702-N704 VanDerWaalsContact C-N 3.32Å; F702-N704 PolarHBondContact O-N 2.92Å; F702-A705 PolarHBondContact O-N 2.8Å; F702-L887 HydrophobicContact CD2-CD1 3.52Å; F702-L887 HydrophobicContact CD2-CD2 3.66Å; F702-L887 HydrophobicContact CD2-CG 4.25Å; F702-L887 HydrophobicContact CE2-CD1 4.02Å; F702-L887 HydrophobicContact CE2-CD2 3.54Å; F702-L887 HydrophobicContact CE2-CG 4.41Å; F702-L887 HydrophobicContact CZ-CD2 4.37Å; F702-F920 HydrophobicContact CB-CE1 4.02Å; F702-F920 HydrophobicContact CB-CZ 3.56Å; F702-F920 HydrophobicContact CD2-CZ 4.49Å; F702-F920 HydrophobicContact CG-CZ 4.08Å; F702-L934 HydrophobicContact CD2-CB 4.43Å; F702-L934 HydrophobicContact CD2-CD1 3.62Å; F702-L934 HydrophobicContact CD2-CD2 4.36Å; F702-L934 HydrophobicContact CD2-CG 4.35Å; F702-L934 HydrophobicContact CE2-CD1 3.43Å; F702-L934 VanDerWaalsContact CE2-CD1 3.43Å; F702-L934 HydrophobicContact CE2-CD2 3.91Å; F702-L934 HydrophobicContact CE2-CG 4.21Å; F702-L934 HydrophobicContact CG-CD1 4.45Å; F702-L934 HydrophobicContact CZ-CD1 4.15Å; F702-A936 HydrophobicContact CB-CB 3.75Å; F702-Y1053 PolarHBondContact O-OH 2.73Å; F702-Y1053 VanDerWaalsContact O-OH 3.13Å
703	A	94.1	Very high	97.4	Very high	25 Å²	25	14.9 Å²	14.9	21%	0.207	8%	0.077	C	C	.	.	H	α-helix	trans	-57.1	-49.2	-175.7	0	0	0	0	0	110.4	N699 L700 A705 Y1053	N699-A703 PolarHBondContact O-N 3.34Å; L700-A703 PolarHBondContact O-N 3.35Å; A703-A705 VanDerWaalsContact C-N 3.33Å; A703-A705 PolarHBondContact O-N 3.26Å; A703-Y1053 VanDerWaalsContact O-CE2 3.28Å; A703-Y1053 WeakPolarHBondContact O-CE2 3.32Å; A703-Y1053 PolarHBondContact O-OH 2.81Å
704	N	97	Very high	97.3	Very high	21 Å²	21	19.2 Å²	19.2	11%	0.112	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-7.7	177.8	-71.6	-87.2	0	0	0	115	L700 F702 T706 L711	L700-N704 WeakPolarHBondContact CD1-ND2 3.48Å; L700-N704 PolarHBondContact O-N 3.01Å; L700-N704 VanDerWaalsContact O-N 3.15Å; L700-N704 PolarHBondContact O-ND2 3.28Å; F702-N704 VanDerWaalsContact C-N 3.32Å; F702-N704 PolarHBondContact O-N 2.92Å; N704-T706 HydrophobicContact CB-CG2 4.03Å; N704-T706 PolarHBondContact O-N 3.02Å; N704-L711 HydrophobicContact CB-CD1 3.93Å; N704-L711 HydrophobicContact CB-CD2 3.96Å; N704-L711 HydrophobicContact CB-CG 4.47Å; N704-L711 WeakPolarHBondContact OD1-CD2 3.36Å
705	A	97.6	Very high	97.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	35.5	-171.5	0	0	0	0	0	114.8	E701 F702 A703 G885 V886 L887 Y1053	E701-A705 CarbonylContact O-C 3.54Å; E701-A705 VanDerWaalsContact O-CA 3.23Å; E701-A705 WeakPolarHBondContact O-CA 3.13Å; E701-A705 PolarHBondContact O-N 3.29Å; F702-A705 PolarHBondContact O-N 2.8Å; A703-A705 VanDerWaalsContact C-N 3.33Å; A703-A705 PolarHBondContact O-N 3.26Å; A705-G885 CarbonylContact O-C 3.6Å; A705-G885 WeakPolarHBondContact O-CA 3.34Å; A705-V886 CarbonylContact O-C 3.15Å; A705-V886 PolarHBondContact O-N 2.83Å; A705-L887 HydrophobicContact CB-CB 3.58Å; A705-Y1053 HydrophobicContact CB-CD2 4.03Å; A705-Y1053 HydrophobicContact CB-CE1 4.12Å; A705-Y1053 HydrophobicContact CB-CE2 3.45Å; A705-Y1053 VanDerWaalsContact CB-CE2 3.45Å
706	T	98.2	Very high	97	Very high	8 Å²	8	22.3 Å²	22.3	5%	0.049	11%	0.107	C	C	.	.	S	Bend	trans	-153.7	161.4	-177.1	-162.5	0	0	0	0	111.7	E701 N704 N710 L711 Y1055	E701-T706 WeakPolarHBondContact CA-O 3.47Å; E701-T706 VanDerWaalsContact CB-O 3.28Å; E701-T706 WeakPolarHBondContact CB-O 3.28Å; E701-T706 VanDerWaalsContact CG-O 3.31Å; E701-T706 WeakPolarHBondContact CG-O 3.3Å; E701-T706 PolarHBondContact O-N 3.39Å; E701-T706 VanDerWaalsContact O-N 3.09Å; N704-T706 HydrophobicContact CB-CG2 4.03Å; N704-T706 PolarHBondContact O-N 3.02Å; T706-N710 HydrophobicContact CG2-CB 4.34Å; T706-N710 PolarHBondContact OG1-ND2 2.81Å; T706-L711 HydrophobicContact CG2-CD1 4.38Å; T706-L711 HydrophobicContact CG2-CD2 3.59Å; T706-L711 HydrophobicContact CG2-CG 3.75Å; T706-Y1055 HydrophobicContact CG2-CD1 3.9Å; T706-Y1055 HydrophobicContact CG2-CD2 3.91Å; T706-Y1055 HydrophobicContact CG2-CE1 4.03Å; T706-Y1055 HydrophobicContact CG2-CE2 4.04Å; T706-Y1055 HydrophobicContact CG2-CG 3.85Å; T706-Y1055 VanDerWaalsContact OG1-CE1 3.28Å; T706-Y1055 WeakPolarHBondContact OG1-CE1 3.49Å; T706-Y1055 VanDerWaalsContact OG1-CZ 3.27Å; T706-Y1055 PolarHBondContact OG1-OH 3.38Å
707	E	98	Very high	96.8	Very high	43 Å²	43	23.4 Å²	23.4	20%	0.201	11%	0.114	C	C	.	.			trans	-67.7	137.7	171.7	-65.1	169.7	-115.5	0	0	110.2	E701 H709 N710 R938	E701-E707 VanDerWaalsContact OE1-CA 3.32Å; E701-E707 WeakPolarHBondContact OE1-CA 3.36Å; E707-H709 PolarHBondContact O-N 3.24Å; E707-N710 WeakPolarHBondContact O-CB 3.45Å; E707-N710 PolarHBondContact O-N 3.29Å; E707-R938 HydrophobicContact CG-CB 4.08Å; E707-R938 IonicContact OE1-NH1 3.28Å; E707-R938 WeakPolarHBondContact OE2-CD 3.32Å
708	L	97.6	Very high	96.6	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.01	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-59.2	-24	-174.2	-56.4	-177	0	0	0	113.8	G494 I497 L697 L700 E701 N710 L711	G494-L708 PolarHBondContact N-O 2.89Å; I497-L708 HydrophobicContact CD1-CD1 4.02Å; L697-L708 HydrophobicContact CB-CD1 4.13Å; L697-L708 HydrophobicContact CD2-CD1 3.47Å; L697-L708 VanDerWaalsContact CD2-CD1 3.47Å; L697-L708 HydrophobicContact CG-CD1 4.38Å; L700-L708 HydrophobicContact CB-CD2 4.18Å; L700-L708 HydrophobicContact CD2-CD1 4.25Å; L700-L708 HydrophobicContact CD2-CD2 3.7Å; L700-L708 HydrophobicContact CG-CD2 3.64Å; E701-L708 HydrophobicContact CG-CD1 4.45Å; E701-L708 HydrophobicContact CG-CD2 3.51Å; E701-L708 HydrophobicContact CG-CG 3.54Å; E701-L708 PolarHBondContact OE1-N 3.4Å; L708-N710 PolarHBondContact O-N 3.22Å; L708-L711 HydrophobicContact CD2-CD1 3.97Å; L708-L711 PolarHBondContact O-N 2.93Å
709	H	97.1	Very high	96.2	Very high	95 Å²	95	26.6 Å²	26.6	44%	0.44	13%	0.13	S	C	.	.	G	3₁₀ helix	trans	-66.3	-12.2	174.3	-70.8	89.9	0	0	0	114	S492 E707	S492-H709 WeakPolarHBondContact CB-O 3.43Å; S492-H709 PolarHBondContact OG-O 3.38Å; E707-H709 PolarHBondContact O-N 3.24Å
710	N	97.7	Very high	95.9	Very high	61 Å²	61	28.6 Å²	28.6	33%	0.326	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-95.7	-16.7	176.9	-60.5	-35.5	0	0	0	113.3	T706 E707 L708 Y1055 A1057 V1058	T706-N710 HydrophobicContact CG2-CB 4.34Å; T706-N710 PolarHBondContact OG1-ND2 2.81Å; E707-N710 WeakPolarHBondContact O-CB 3.45Å; E707-N710 PolarHBondContact O-N 3.29Å; L708-N710 PolarHBondContact O-N 3.22Å; N710-Y1055 HydrophobicContact CB-CE2 3.78Å; N710-A1057 CarbonylContact O-C 3.59Å; N710-A1057 WeakPolarHBondContact O-CA 3.5Å; N710-V1058 PolarHBondContact O-N 3.42Å
711	L	97.7	Very high	95.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-82.2	134	-174.7	-69	175	0	0	0	111.8	S492 L493 N704 T706 L708 L713 W716 Y1055	S492-L711 CarbonylContact C-O 3.59Å; S492-L711 WeakPolarHBondContact CA-O 3.45Å; S492-L711 WeakPolarHBondContact CB-O 3.5Å; L493-L711 HydrophobicContact CB-CB 4.17Å; L493-L711 HydrophobicContact CD2-CD1 4.23Å; L493-L711 PolarHBondContact N-O 2.94Å; N704-L711 HydrophobicContact CB-CD1 3.93Å; N704-L711 HydrophobicContact CB-CD2 3.96Å; N704-L711 HydrophobicContact CB-CG 4.47Å; N704-L711 WeakPolarHBondContact OD1-CD2 3.36Å; T706-L711 HydrophobicContact CG2-CD1 4.38Å; T706-L711 HydrophobicContact CG2-CD2 3.59Å; T706-L711 HydrophobicContact CG2-CG 3.75Å; L708-L711 HydrophobicContact CD2-CD1 3.97Å; L708-L711 PolarHBondContact O-N 2.93Å; L711-L713 PolarHBondContact O-N 2.86Å; L711-W716 HydrophobicContact CB-CB 4.03Å; L711-W716 HydrophobicContact CD1-CB 4.45Å; L711-W716 HydrophobicContact CD2-CB 4.2Å; L711-W716 HydrophobicContact CG-CB 4.46Å; L711-Y1055 HydrophobicContact CD2-CD2 3.81Å; L711-Y1055 HydrophobicContact CD2-CG 4.23Å
712	S	97.1	Very high	95	Very high	8 Å²	8	39.5 Å²	39.5	6%	0.056	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-65.4	124	173.4	-174.2	0	0	0	0	111	R714 H715 W716 V1056 A1057	S712-R714 PolarHBondContact O-N 3.27Å; S712-R714 VanDerWaalsContact O-N 3.13Å; S712-H715 PolarHBondContact O-N 2.76Å; S712-W716 WeakPolarHBondContact O-CB 3.21Å; S712-W716 PolarHBondContact O-N 2.75Å; S712-V1056 PolarHBondContact N-O 2.71Å; S712-A1057 WeakPolarHBondContact CB-O 3.43Å
713	L	96.6	Very high	94.4	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.021	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-36.8	-179.8	-178.1	71	0	0	0	113.2	A469 C473 L478 L491 L493 V496 L711	A469-L713 HydrophobicContact CB-CD1 4.31Å; C473-L713 HydrophobicContact CB-CD2 3.76Å; C473-L713 HydrophobicContact CB-CG 3.94Å; L478-L713 VanDerWaalsContact O-CD2 3.25Å; L478-L713 WeakPolarHBondContact O-CD2 3.31Å; L491-L713 HydrophobicContact CB-CB 4.47Å; L491-L713 HydrophobicContact CB-CD2 4.34Å; L491-L713 WeakPolarHBondContact O-CB 3.44Å; L491-L713 PolarHBondContact O-N 3.33Å; L491-L713 VanDerWaalsContact O-N 3.13Å; L493-L713 HydrophobicContact CD1-CD1 3.95Å; V496-L713 HydrophobicContact CB-CD1 3.81Å; V496-L713 HydrophobicContact CG1-CD1 4.14Å; V496-L713 HydrophobicContact CG2-CD1 3.71Å; V496-L713 HydrophobicContact CG2-CD2 3.73Å; V496-L713 HydrophobicContact CG2-CG 4.29Å; L711-L713 PolarHBondContact O-N 2.86Å
714	R	94.7	Very high	94.1	Very high	92 Å²	92	42.3 Å²	42.3	35%	0.347	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-12.3	-170.3	-164.3	173.1	-161.9	149.3	14.9	114.8	D479 S712	D479-R714 HydrophobicContact CB-CB 4.17Å; D479-R714 IonicContact OD1-CZ 3.72Å; D479-R714 IonicContact OD1-NH1 2.77Å; D479-R714 PolarHBondContact OD1-NH1 3.25Å; D479-R714 VanDerWaalsContact OD2-CD 3.28Å; D479-R714 WeakPolarHBondContact OD2-CD 3.43Å; D479-R714 IonicContact OD2-CZ 3.8Å; D479-R714 IonicContact OD2-NE 2.63Å; D479-R714 IonicContact OD2-NH1 3.9Å; D479-R714 PolarHBondContact OD2-NH1 2.87Å; S712-R714 PolarHBondContact O-N 3.27Å; S712-R714 VanDerWaalsContact O-N 3.13Å
715	H	95.4	Very high	93.6	Very high	53 Å²	53	44.9 Å²	44.9	25%	0.245	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-144.3	8.5	-162.2	-57.3	-38.4	0	0	0	114.7	S712 D717 Q718 V1056	S712-H715 PolarHBondContact O-N 2.76Å; H715-D717 VanDerWaalsContact C-N 3.27Å; H715-Q718 WeakPolarHBondContact O-CG 3.41Å; H715-V1056 HydrophobicContact CB-CB 4.49Å; H715-V1056 HydrophobicContact CB-CG1 3.69Å; H715-V1056 VanDerWaalsContact O-CB 3.23Å; H715-V1056 WeakPolarHBondContact O-CB 3.22Å; H715-V1056 VanDerWaalsContact O-CG2 3.3Å; H715-V1056 WeakPolarHBondContact O-CG2 3.49Å
716	W	95.8	Very high	93.1	Very high	22 Å²	22	47 Å²	47	8%	0.083	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-25.4	178.7	72.7	-78.2	0	0	0	112.6	V23 L493 L700 L711 S712	V23-W716 HydrophobicContact CB-CH2 4.13Å; V23-W716 HydrophobicContact CG1-CH2 4.38Å; L493-W716 HydrophobicContact CD2-CD2 3.77Å; L493-W716 HydrophobicContact CD2-CE3 4.39Å; L493-W716 HydrophobicContact CD2-CG 3.99Å; L493-W716 HydrophobicContact CD2-CZ2 4.25Å; L700-W716 HydrophobicContact CD1-CE3 4.14Å; L700-W716 HydrophobicContact CD1-CH2 3.93Å; L700-W716 HydrophobicContact CD1-CZ3 3.48Å; L700-W716 VanDerWaalsContact CD1-CZ3 3.48Å; L711-W716 HydrophobicContact CB-CB 4.03Å; L711-W716 HydrophobicContact CD1-CB 4.45Å; L711-W716 HydrophobicContact CD2-CB 4.2Å; L711-W716 HydrophobicContact CG-CB 4.46Å; S712-W716 WeakPolarHBondContact O-CB 3.21Å; S712-W716 PolarHBondContact O-N 2.75Å
717	D	93.8	Very high	92.6	Very high	29 Å²	29	51.6 Å²	51.6	16%	0.155	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105	9.4	-175.1	43.5	7.6	0	0	0	112.7	H715 D719 D720	H715-D717 VanDerWaalsContact C-N 3.27Å; D717-D719 PolarHBondContact O-N 2.87Å; D717-D720 WeakPolarHBondContact O-CB 3.49Å; D717-D720 PolarHBondContact O-N 3.5Å; D717-D720 VanDerWaalsContact O-N 3.11Å
718	Q	92.7	Very high	92.3	Very high	28 Å²	28	51.7 Å²	51.7	13%	0.131	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-8.7	-171.1	68	85.5	68.6	0	0	115.2	H715 V1056 R1116	H715-Q718 WeakPolarHBondContact O-CG 3.41Å; Q718-V1056 HydrophobicContact CG-CG2 4.15Å; Q718-R1116 PolarHBondContact NE2-O 2.89Å
719	D	91.1	Very high	92.1	Very high	41 Å²	41	51.7 Å²	51.7	22%	0.219	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-5.7	175.3	38.6	-69.1	0	0	0	115	D717 L721 F722 P1119	D717-D719 PolarHBondContact O-N 2.87Å; D719-L721 PolarHBondContact O-N 3.17Å; D719-F722 PolarHBondContact O-N 3.44Å; D719-P1119 HydrophobicContact CB-CG 4.14Å; D719-P1119 VanDerWaalsContact OD1-CG 3.26Å; D719-P1119 WeakPolarHBondContact OD1-CG 3.35Å; D719-P1119 VanDerWaalsContact OD2-CD 3.26Å; D719-P1119 WeakPolarHBondContact OD2-CD 3.5Å; D719-P1119 WeakPolarHBondContact OD2-CG 3.35Å
720	D	89.5	Confident	92	Very high	44 Å²	44	47.7 Å²	47.7	24%	0.235	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-59.5	-30.4	174.6	-72.4	39.8	0	0	0	111.7	L22 D717 F722 E723	L22-D720 HydrophobicContact CD2-CB 4.21Å; D717-D720 WeakPolarHBondContact O-CB 3.49Å; D717-D720 PolarHBondContact O-N 3.5Å; D717-D720 VanDerWaalsContact O-N 3.11Å; D720-F722 PolarHBondContact O-N 2.92Å; D720-E723 PolarHBondContact O-N 3.21Å; D720-E723 VanDerWaalsContact O-N 3.08Å
721	L	88	Confident	91.8	Very high	154 Å²	154	45.3 Å²	45.3	81%	0.806	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-57.5	-13	171.1	-66.2	175.4	0	0	0	114.5	D719	D719-L721 PolarHBondContact O-N 3.17Å
722	F	87.8	Confident	91.5	Very high	81 Å²	81	48.4 Å²	48.4	36%	0.355	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-118.4	17.7	180	-52.2	-79.1	0	0	0	112.8	D719 D720 L724 C1117 Y1118	D719-F722 PolarHBondContact O-N 3.44Å; D720-F722 PolarHBondContact O-N 2.92Å; F722-L724 PolarHBondContact O-N 3.01Å; F722-C1117 HydrophobicContact CB-CB 4.29Å; F722-C1117 WeakPolarHBondContact CB-O 3.5Å; F722-C1117 HydrophobicContact CD1-CB 3.96Å; F722-C1117 HydrophobicContact CD2-CB 3.67Å; F722-C1117 HydrophobicContact CE1-CB 4.2Å; F722-C1117 HydrophobicContact CE2-CB 3.94Å; F722-C1117 HydrophobicContact CG-CB 3.7Å; F722-C1117 HydrophobicContact CZ-CB 4.19Å; F722-C1117 VanDerWaalsContact CZ-SG 3.58Å; F722-Y1118 HydrophobicContact CB-CE1 3.94Å; F722-Y1118 WeakPolarHBondContact O-CE1 3.28Å
723	E	85.6	Confident	91.1	Very high	87 Å²	87	51.2 Å²	51.2	41%	0.407	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-52.6	133.7	-180	-172	-179.8	178.1	0	0	112.2	L22 D720	L22-E723 HydrophobicContact CD1-CG 3.91Å; L22-E723 HydrophobicContact CD2-CB 3.9Å; L22-E723 HydrophobicContact CD2-CG 3.85Å; D720-E723 PolarHBondContact O-N 3.21Å; D720-E723 VanDerWaalsContact O-N 3.08Å
724	L	88.1	Confident	90.9	Very high	16 Å²	16	51 Å²	51	8%	0.084	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-90.9	116.4	179.8	-59.5	-175.3	0	0	0	110.3	G416 A419 N420 F722 Y1118	G416-L724 WeakPolarHBondContact CA-O 3.32Å; A419-L724 HydrophobicContact CB-CD2 4.17Å; N420-L724 HydrophobicContact CB-CD1 3.74Å; F722-L724 PolarHBondContact O-N 3.01Å; L724-Y1118 HydrophobicContact CD1-CE1 4.16Å; L724-Y1118 HydrophobicContact CD2-CE1 3.74Å; L724-Y1118 HydrophobicContact CG-CE1 3.96Å
725	S	86.2	Confident	90.9	Very high	74 Å²	74	46.9 Å²	46.9	52%	0.517	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-74.2	157.6	-172.7	59.5	0	0	0	0	115.2	L417 S418	L417-S725 PolarHBondContact N-O 2.95Å; L417-S725 VanDerWaalsContact N-O 3.12Å; S418-S725 WeakPolarHBondContact CB-O 3.39Å; S418-S725 VanDerWaalsContact CB-OG 3.27Å; S418-S725 WeakPolarHBondContact CB-OG 3.44Å; S418-S725 PolarHBondContact N-O 3.4Å
726	G	86.6	Confident	91	Very high	46 Å²	46	44.6 Å²	44.6	47%	0.474	24%	0.243	S	C	.	.	S	Bend	trans	91.8	165.9	178.7	0	0	0	0	0	114.6	G416 H728	G416-G726 WeakPolarHBondContact CA-O 3.2Å; G726-H728 PolarHBondContact O-N 3.32Å
727	D	87.8	Confident	91	Very high	104 Å²	104	44 Å²	44	56%	0.556	24%	0.242	S	C	*	.			trans	-45.4	124.7	-166.8	-51.8	-3.6	0	0	0	114.5	L417 P435 C729	L417-D727 WeakPolarHBondContact CG-O 3.48Å; P435-D727 HydrophobicContact CB-CB 4.06Å; D727-C729 PolarHBondContact O-N 3.17Å; D727-C729 PolarHBondContact O-SG 2.9Å
728	H	91.1	Very high	91.1	Very high	44 Å²	44	42.8 Å²	42.8	20%	0.204	24%	0.236	C	C	.	.			trans	-63.7	128.9	166.2	-62.9	-4.1	0	0	0	110.1	M21 V413 I436 G726	M21-H728 WeakPolarHBondContact CB-NE2 3.37Å; M21-H728 HydrophobicContact CE-CB 4.36Å; M21-H728 HydrophobicContact SD-CB 4.2Å; M21-H728 PolarHBondContact SD-CD2 3.42Å; V413-H728 HydrophobicContact CG1-CB 4.01Å; I436-H728 HydrophobicContact CD1-CB 4.11Å; I436-H728 PolarHBondContact N-O 2.79Å; G726-H728 PolarHBondContact O-N 3.32Å
729	C	94.2	Very high	91.3	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.02	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	150.6	-169.3	-72.2	0	0	0	0	114.7	V413 V414 L417 L433 L434 P435 D727	V413-C729 CarbonylContact C-O 3.57Å; V413-C729 WeakPolarHBondContact CG1-O 3.33Å; V414-C729 PolarHBondContact N-O 3.05Å; V414-C729 PolarHBondContact O-N 2.91Å; L417-C729 HydrophobicContact CD2-CB 4.18Å; L433-C729 HydrophobicContact CB-CB 4.06Å; L433-C729 HydrophobicContact CD2-CB 3.92Å; L433-C729 HydrophobicContact CG-CB 4.41Å; L434-C729 CarbonylContact O-C 3.3Å; L434-C729 VanDerWaalsContact O-CA 3.23Å; L434-C729 WeakPolarHBondContact O-CA 3.39Å; L434-C729 WeakPolarHBondContact O-CB 3.19Å; P435-C729 VanDerWaalsContact CA-SG 3.56Å; D727-C729 PolarHBondContact O-N 3.17Å; D727-C729 PolarHBondContact O-SG 2.9Å
730	V	94.1	Very high	91.6	Very high	10 Å²	10	43.2 Å²	43.2	6%	0.061	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	150.3	170.9	-57.1	0	0	0	0	111.1	L433 L434 I436 I925	L433-V730 CarbonylContact C-O 3.57Å; L433-V730 WeakPolarHBondContact CA-O 3.37Å; L434-V730 HydrophobicContact CB-CG2 4.02Å; L434-V730 PolarHBondContact N-O 2.89Å; L434-V730 PolarHBondContact O-N 3.03Å; I436-V730 HydrophobicContact CD1-CG1 3.88Å; I436-V730 HydrophobicContact CG1-CG1 3.88Å; V730-I925 HydrophobicContact CG1-CB 4.04Å; V730-I925 HydrophobicContact CG1-CD1 3.87Å; V730-I925 HydrophobicContact CG1-CG2 4.02Å; V730-I925 HydrophobicContact CG2-CB 4.31Å
731	L	93.7	Very high	91.9	Very high	11 Å²	11	44 Å²	44	6%	0.058	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	122.5	173.3	-76.2	82.7	0	0	0	110.1	V414 V426 L431 N432 L433 D733 G734 Y735 V738	V414-L731 HydrophobicContact CG2-CD1 3.52Å; V426-L731 HydrophobicContact CG2-CD2 3.99Å; V426-L731 HydrophobicContact CG2-CG 4.37Å; L431-L731 HydrophobicContact CD1-CD2 4.02Å; N432-L731 WeakPolarHBondContact O-CA 3.25Å; L433-L731 HydrophobicContact CD2-CD1 3.73Å; L433-L731 HydrophobicContact CD2-CG 3.84Å; L731-D733 VanDerWaalsContact C-N 3.29Å; L731-D733 PolarHBondContact O-N 2.88Å; L731-G734 WeakPolarHBondContact O-CA 3.41Å; L731-G734 PolarHBondContact O-N 3.03Å; L731-Y735 HydrophobicContact CD1-CD1 3.83Å; L731-Y735 HydrophobicContact CD1-CE1 3.98Å; L731-Y735 HydrophobicContact CD1-CG 4.11Å; L731-Y735 HydrophobicContact CD2-CD1 4.39Å; L731-V738 HydrophobicContact CD2-CG2 3.6Å
732	Q	91.7	Very high	92.2	Very high	66 Å²	66	36.7 Å²	36.7	31%	0.308	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-35	-176.5	-172.5	179.2	19.9	0	0	113.5	H406 N432 L434 G734	H406-Q732 PolarHBondContact CE1-O 2.83Å; H406-Q732 VanDerWaalsContact CE1-O 3.27Å; H406-Q732 PolarHBondContact NE2-O 2.94Å; N432-Q732 HydrophobicContact CB-CB 3.94Å; N432-Q732 PolarHBondContact ND2-OE1 3.05Å; N432-Q732 PolarHBondContact O-N 2.8Å; L434-Q732 HydrophobicContact CD1-CB 4.01Å; L434-Q732 HydrophobicContact CD1-CG 4.02Å; L434-Q732 HydrophobicContact CG-CB 4.25Å; Q732-G734 VanDerWaalsContact C-N 3.28Å
733	D	87.9	Confident	92.6	Very high	66 Å²	66	33.4 Å²	33.4	35%	0.353	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	3.9	177.2	-67.2	-72.2	0	0	0	113	R401 L431 L731 S737	R401-D733 VanDerWaalsContact CZ-O 3.29Å; R401-D733 PolarHBondContact NH1-O 2.71Å; R401-D733 PolarHBondContact NH2-O 2.86Å; L431-D733 HydrophobicContact CD2-CB 4.37Å; L731-D733 VanDerWaalsContact C-N 3.29Å; L731-D733 PolarHBondContact O-N 2.88Å; D733-S737 PolarHBondContact O-OG 3.13Å
734	G	93.1	Very high	93	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.01	20%	0.197	C	C	.	.			trans	81.5	147.6	-171.6	0	0	0	0	0	113.4	E408 L731 Q732 G736 S737	E408-G734 WeakPolarHBondContact OE1-CA 3.29Å; L731-G734 WeakPolarHBondContact O-CA 3.41Å; L731-G734 PolarHBondContact O-N 3.03Å; Q732-G734 VanDerWaalsContact C-N 3.28Å; G734-G736 PolarHBondContact O-N 3.18Å; G734-S737 VanDerWaalsContact O-CB 3.23Å; G734-S737 WeakPolarHBondContact O-CB 3.44Å; G734-S737 PolarHBondContact O-N 2.87Å; G734-S737 PolarHBondContact O-OG 2.94Å
735	Y	95.7	Very high	93.2	Very high	5 Å²	5	33.9 Å²	33.9	2%	0.02	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-34.4	-168.4	-145.6	-24.7	0	0	0	112.9	I397 T399 E408 A411 V413 V414 V422 L731 S737 V738 V1122	I397-Y735 HydrophobicContact CG2-CD1 4.3Å; I397-Y735 HydrophobicContact CG2-CG 4.06Å; T399-Y735 PolarHBondContact OG1-N 2.92Å; E408-Y735 PolarHBondContact OE1-N 2.95Å; A411-Y735 HydrophobicContact CB-CD2 4.1Å; A411-Y735 HydrophobicContact CB-CE2 4.05Å; A411-Y735 WeakPolarHBondContact O-CD2 3.44Å; V413-Y735 VanDerWaalsContact O-CE2 3.29Å; V413-Y735 WeakPolarHBondContact O-CE2 3.5Å; V413-Y735 PolarHBondContact O-OH 3.27Å; V414-Y735 HydrophobicContact CG2-CE1 4.4Å; V422-Y735 HydrophobicContact CG1-CE1 4.03Å; L731-Y735 HydrophobicContact CD1-CD1 3.83Å; L731-Y735 HydrophobicContact CD1-CE1 3.98Å; L731-Y735 HydrophobicContact CD1-CG 4.11Å; L731-Y735 HydrophobicContact CD2-CD1 4.39Å; Y735-S737 PolarHBondContact O-N 2.68Å; Y735-V738 PolarHBondContact O-N 3.11Å; Y735-V1122 HydrophobicContact CE1-CG1 3.93Å; Y735-V1122 HydrophobicContact CE2-CG2 4.1Å; Y735-V1122 WeakPolarHBondContact OH-CB 3.48Å
736	G	96	Very high	93.5	Very high	4 Å²	4	30.7 Å²	30.7	4%	0.041	17%	0.171	C	C	.	.	H	α-helix	trans	-57	-22.4	176.4	0	0	0	0	0	113.8	T399 G734 V738 T739 D740	T399-G736 WeakPolarHBondContact OG1-CA 3.26Å; T399-G736 PolarHBondContact OG1-N 3.09Å; G734-G736 PolarHBondContact O-N 3.18Å; G736-V738 PolarHBondContact O-N 3.03Å; G736-V738 VanDerWaalsContact O-N 3.13Å; G736-T739 PolarHBondContact O-N 2.86Å; G736-T739 PolarHBondContact O-OG1 3.27Å; G736-D740 WeakPolarHBondContact O-CB 3.47Å; G736-D740 PolarHBondContact O-N 3.09Å
737	S	95.7	Very high	93.7	Very high	10 Å²	10	31.9 Å²	31.9	7%	0.07	17%	0.169	C	C	.	.	H	α-helix	trans	-54.8	-31.1	174	-48.4	0	0	0	0	113	R401 D733 G734 Y735 N741	R401-S737 PolarHBondContact NH2-OG 2.99Å; D733-S737 PolarHBondContact O-OG 3.13Å; G734-S737 VanDerWaalsContact O-CB 3.23Å; G734-S737 WeakPolarHBondContact O-CB 3.44Å; G734-S737 PolarHBondContact O-N 2.87Å; G734-S737 PolarHBondContact O-OG 2.94Å; Y735-S737 PolarHBondContact O-N 2.68Å; S737-N741 WeakPolarHBondContact O-CB 3.47Å; S737-N741 PolarHBondContact O-N 3.15Å; S737-N741 PolarHBondContact O-ND2 3.16Å
738	V	96.8	Very high	93.6	Very high	3 Å²	3	29 Å²	29	2%	0.018	16%	0.157	C	C	.	.	H	α-helix	trans	-69.2	-47.1	176	180	0	0	0	0	110.8	I368 L425 L431 L731 Y735 G736 L742	I368-V738 HydrophobicContact CD1-CG1 4.34Å; L425-V738 HydrophobicContact CB-CG1 4.11Å; L425-V738 HydrophobicContact CD1-CG1 3.65Å; L431-V738 HydrophobicContact CD1-CG2 3.98Å; L731-V738 HydrophobicContact CD2-CG2 3.6Å; Y735-V738 PolarHBondContact O-N 3.11Å; G736-V738 PolarHBondContact O-N 3.03Å; G736-V738 VanDerWaalsContact O-N 3.13Å; V738-L742 HydrophobicContact CG1-CD1 4.24Å; V738-L742 WeakPolarHBondContact O-CG 3.4Å; V738-L742 PolarHBondContact O-N 3.33Å; V738-L742 VanDerWaalsContact O-N 3.09Å
739	T	97.4	Very high	92.4	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-72.4	-36	-178.6	47.8	0	0	0	0	112.7	I368 L371 I397 G736 L742 A743	I368-T739 HydrophobicContact CB-CG2 4.36Å; I368-T739 HydrophobicContact CD1-CG2 4.03Å; L371-T739 HydrophobicContact CD1-CG2 3.84Å; I397-T739 HydrophobicContact CB-CG2 4.47Å; I397-T739 HydrophobicContact CD1-CG2 3.89Å; G736-T739 PolarHBondContact O-N 2.86Å; G736-T739 PolarHBondContact O-OG1 3.27Å; T739-L742 PolarHBondContact O-N 2.88Å; T739-A743 WeakPolarHBondContact O-CB 3.38Å; T739-A743 PolarHBondContact O-N 3.02Å
740	D	96.2	Very high	90.7	Very high	78 Å²	78	34.9 Å²	34.9	42%	0.417	20%	0.196	S	C	.	.	H	α-helix	trans	-62.5	-44.8	176.4	-65.5	-21.7	0	0	0	110.9	G736 A743 H744	G736-D740 WeakPolarHBondContact O-CB 3.47Å; G736-D740 PolarHBondContact O-N 3.09Å; D740-A743 PolarHBondContact O-N 2.81Å; D740-H744 WeakPolarHBondContact O-CB 3.45Å; D740-H744 PolarHBondContact O-N 3.47Å
741	N	95.6	Very high	88.6	Confident	61 Å²	61	36.7 Å²	36.7	33%	0.326	21%	0.208	S	C	.	.	H	α-helix	trans	-71.4	-37.4	177.9	-80.5	-78.2	0	0	0	113.1	I284 L429 S737 H744 Y745	I284-N741 HydrophobicContact CD1-CB 4.15Å; L429-N741 HydrophobicContact CD1-CB 3.85Å; L429-N741 HydrophobicContact CD2-CB 3.57Å; L429-N741 HydrophobicContact CG-CB 4.39Å; S737-N741 WeakPolarHBondContact O-CB 3.47Å; S737-N741 PolarHBondContact O-N 3.15Å; S737-N741 PolarHBondContact O-ND2 3.16Å; N741-H744 PolarHBondContact O-N 3.12Å; N741-Y745 PolarHBondContact O-N 2.72Å
742	L	95.6	Very high	86.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.9	-48.1	172.2	-79.4	168.7	0	0	0	111	I284 I368 L371 I372 R375 L425 V738 T739 H744 Y745 I746	I284-L742 HydrophobicContact CD1-CD2 3.97Å; I284-L742 HydrophobicContact CD1-CG 4.22Å; I284-L742 HydrophobicContact CG1-CD2 4.05Å; I368-L742 HydrophobicContact CD1-CD1 3.51Å; L371-L742 HydrophobicContact CB-CB 4.33Å; L371-L742 HydrophobicContact CB-CD1 4.47Å; I372-L742 HydrophobicContact CD1-CD2 4.1Å; R375-L742 HydrophobicContact CG-CD2 4.34Å; L425-L742 HydrophobicContact CD1-CD1 4.13Å; V738-L742 HydrophobicContact CG1-CD1 4.24Å; V738-L742 WeakPolarHBondContact O-CG 3.4Å; V738-L742 PolarHBondContact O-N 3.33Å; V738-L742 VanDerWaalsContact O-N 3.09Å; T739-L742 PolarHBondContact O-N 2.88Å; L742-H744 VanDerWaalsContact C-N 3.31Å; L742-H744 PolarHBondContact O-N 3.19Å; L742-Y745 PolarHBondContact O-N 3.11Å; L742-I746 VanDerWaalsContact O-CD1 3.26Å; L742-I746 WeakPolarHBondContact O-CD1 3.2Å; L742-I746 WeakPolarHBondContact O-CG1 3.43Å; L742-I746 PolarHBondContact O-N 3.35Å
743	A	96.4	Very high	83.5	Confident	11 Å²	11	43.4 Å²	43.4	9%	0.091	25%	0.251	C	S	.	.	H	α-helix	trans	-59.2	-41	176.9	0	0	0	0	0	112.3	L371 V393 T739 D740 T747 I785	L371-A743 HydrophobicContact CD2-CB 3.96Å; V393-A743 HydrophobicContact CB-CB 4.41Å; V393-A743 HydrophobicContact CG1-CB 3.89Å; V393-A743 HydrophobicContact CG2-CB 4.06Å; T739-A743 WeakPolarHBondContact O-CB 3.38Å; T739-A743 PolarHBondContact O-N 3.02Å; D740-A743 PolarHBondContact O-N 2.81Å; A743-T747 WeakPolarHBondContact O-CG2 3.33Å; A743-T747 PolarHBondContact O-N 2.87Å; A743-T747 PolarHBondContact O-OG1 3.31Å; A743-I785 HydrophobicContact CB-CD1 3.7Å
744	H	94.2	Very high	80.9	Confident	107 Å²	107	45.6 Å²	45.6	50%	0.495	27%	0.266	S	S	.	.	H	α-helix	trans	-66	-40.1	175.7	-174.3	62.9	0	0	0	112.7	D740 N741 L742 T747 S748	D740-H744 WeakPolarHBondContact O-CB 3.45Å; D740-H744 PolarHBondContact O-N 3.47Å; N741-H744 PolarHBondContact O-N 3.12Å; L742-H744 VanDerWaalsContact C-N 3.31Å; L742-H744 PolarHBondContact O-N 3.19Å; H744-T747 PolarHBondContact O-OG1 3.01Å; H744-S748 WeakPolarHBondContact O-CB 3.32Å; H744-S748 PolarHBondContact O-N 3.02Å; H744-S748 PolarHBondContact O-OG 2.97Å
745	Y	90.6	Very high	77.9	Confident	6 Å²	6	48.6 Å²	48.6	2%	0.024	30%	0.297	C	S	.	.	H	α-helix	trans	-65.8	-44.2	178	-164.7	-70.9	0	0	0	111.5	I284 F285 N741 L742 T747 S748 G749 L752 L780	I284-Y745 HydrophobicContact CB-CD2 4.23Å; I284-Y745 HydrophobicContact CB-CE2 4.44Å; I284-Y745 HydrophobicContact CD1-CD2 4.5Å; I284-Y745 HydrophobicContact CG1-CD2 3.86Å; I284-Y745 HydrophobicContact CG1-CE2 4.47Å; I284-Y745 HydrophobicContact CG1-CG 4.13Å; I284-Y745 HydrophobicContact CG2-CD2 3.72Å; I284-Y745 HydrophobicContact CG2-CE2 3.88Å; F285-Y745 PolarHBondContact O-OH 2.91Å; N741-Y745 PolarHBondContact O-N 2.72Å; L742-Y745 PolarHBondContact O-N 3.11Å; Y745-T747 VanDerWaalsContact C-N 3.32Å; Y745-T747 PolarHBondContact O-N 3.13Å; Y745-S748 PolarHBondContact O-OG 2.96Å; Y745-G749 PolarHBondContact O-N 3.04Å; Y745-L752 HydrophobicContact CD2-CD1 4.19Å; Y745-L780 HydrophobicContact CE1-CD2 4.14Å
746	I	93	Very high	75.1	Confident	7 Å²	7	54 Å²	54	4%	0.036	33%	0.326	C	S	.	.	H	α-helix	trans	-60.5	-41	179.4	-67	157.9	0	0	0	111.5	L371 A374 R375 L742 I785	L371-I746 HydrophobicContact CB-CD1 4.3Å; L371-I746 HydrophobicContact CD2-CD1 3.79Å; L371-I746 VanDerWaalsContact O-CD1 3.26Å; L371-I746 WeakPolarHBondContact O-CD1 3.28Å; A374-I746 HydrophobicContact CB-CD1 4.13Å; A374-I746 HydrophobicContact CB-CG2 4.39Å; R375-I746 HydrophobicContact CB-CD1 4.19Å; R375-I746 HydrophobicContact CB-CG1 3.99Å; L742-I746 VanDerWaalsContact O-CD1 3.26Å; L742-I746 WeakPolarHBondContact O-CD1 3.2Å; L742-I746 WeakPolarHBondContact O-CG1 3.43Å; L742-I746 PolarHBondContact O-N 3.35Å; I746-I785 HydrophobicContact CG2-CD1 4.39Å; I746-I785 HydrophobicContact CG2-CG1 4.44Å
747	T	91.4	Very high	71.9	Confident	71 Å²	71	62.6 Å²	62.6	44%	0.436	36%	0.362	S	S	.	.	H	α-helix	trans	-88.9	-30.1	-173.7	51.5	0	0	0	0	114.1	A743 H744 Y745 I785	A743-T747 WeakPolarHBondContact O-CG2 3.33Å; A743-T747 PolarHBondContact O-N 2.87Å; A743-T747 PolarHBondContact O-OG1 3.31Å; H744-T747 PolarHBondContact O-OG1 3.01Å; Y745-T747 VanDerWaalsContact C-N 3.32Å; Y745-T747 PolarHBondContact O-N 3.13Å; T747-I785 HydrophobicContact CG2-CB 4.12Å; T747-I785 HydrophobicContact CG2-CD1 3.94Å; T747-I785 HydrophobicContact CG2-CG1 3.75Å
748	S	84.7	Confident	68.8	Low	44 Å²	44	66.8 Å²	66.8	31%	0.308	39%	0.39	S	S	.	.	H	α-helix	trans	-77.2	-28.3	177.3	61.3	0	0	0	0	113.3	H744 Y745 Q750	H744-S748 WeakPolarHBondContact O-CB 3.32Å; H744-S748 PolarHBondContact O-N 3.02Å; H744-S748 PolarHBondContact O-OG 2.97Å; Y745-S748 PolarHBondContact O-OG 2.96Å; S748-Q750 PolarHBondContact O-N 3.5Å
749	G	66.5	Low	65.6	Low	41 Å²	41	78 Å²	78	42%	0.423	43%	0.431	S	S	.	.			trans	64.9	14.6	178.4	0	0	0	0	0	114.9	Y745	Y745-G749 PolarHBondContact O-N 3.04Å
750	Q	59.2	Low	62.5	Low	130 Å²	130	84.4 Å²	84.4	61%	0.607	47%	0.466	S	S	*	.			trans	-108.3	140	-176.8	-68.7	-176.8	24.9	0	0	111.8	S748 L752	S748-Q750 PolarHBondContact O-N 3.5Å; Q750-L752 PolarHBondContact O-N 3.47Å
751	S	49.7	Very low	59.4	Low	47 Å²	47	88 Å²	88	33%	0.329	49%	0.485	S	S	.	.			trans	-63.9	126.7	157	176.9	0	0	0	0	108.2	T753	S751-T753 VanDerWaalsContact C-N 3.35Å; S751-T753 PolarHBondContact O-N 2.92Å
752	L	44.3	Very low	56.5	Low	86 Å²	86	93.6 Å²	93.6	45%	0.45	51%	0.509	S	S	.	.			trans	-63.4	88	179.8	-78.9	163.2	0	0	0	112	I284 Y745 Q750 V754	I284-L752 HydrophobicContact CG2-CD1 3.97Å; Y745-L752 HydrophobicContact CD2-CD1 4.19Å; Q750-L752 PolarHBondContact O-N 3.47Å; L752-V754 PolarHBondContact O-N 3.33Å
753	T	33	Very low	53.2	Low	132 Å²	132	100.6 Å²	100.6	81%	0.81	55%	0.545	S	S	*	.			trans	-86	29.8	162.2	46	0	0	0	0	111.9	S751	S751-T753 VanDerWaalsContact C-N 3.35Å; S751-T753 PolarHBondContact O-N 2.92Å
754	V	33.9	Very low	50.1	Low	112 Å²	112	106.4 Å²	106.4	68%	0.679	58%	0.58	S	S	*	*	S	Bend	trans	-94.1	108.9	157.4	-178	0	0	0	0	106.3	L752 L756	L752-V754 PolarHBondContact O-N 3.33Å; V754-L756 PolarHBondContact O-N 3.16Å
755	G	30.1	Very low	46.9	Very low	64 Å²	64	106.9 Å²	106.9	66%	0.66	60%	0.595	S	S	*	*			trans	-62	122.7	177.2	0	0	0	0	0	110.4	K757	G755-K757 PolarHBondContact O-N 2.86Å
756	L	36	Very low	44	Very low	120 Å²	120	113.1 Å²	113.1	63%	0.628	63%	0.634	S	S	*	*			trans	-64.3	78.5	166.4	-69.5	168.5	0	0	0	108.7	V754	V754-L756 PolarHBondContact O-N 3.16Å
757	K	30.3	Very low	40.8	Very low	183 Å²	183	118.8 Å²	118.8	80%	0.796	67%	0.669	S	S	*	*			trans	-66.2	128.8	169.3	-78.9	-165.3	171.9	-168.3	0	107.9	G755	G755-K757 PolarHBondContact O-N 2.86Å
758	P	30.6	Very low	37.8	Very low	99 Å²	99	121.7 Å²	121.7	64%	0.643	69%	0.686	S	S	*	*			trans	-50.8	147.5	164.4	-26.1	35.5	0	0	0	110.4	D760	P758-D760 WeakPolarHBondContact CB-OD2 3.39Å; P758-D760 PolarHBondContact O-N 3.46Å
759	R	28.6	Very low	35.2	Very low	238 Å²	238	125.7 Å²	125.7	90%	0.898	71%	0.709	S	S	*	*	S	Bend	trans	-79.6	39.3	-176.7	-128.6	177.7	-176.2	168	1	112.4
760	D	33.4	Very low	33.4	Very low	136 Å²	136	130.6 Å²	130.6	73%	0.727	73%	0.731	S	S	*	*			trans	-89.2	117.8	-180	-71.9	-52.7	0	0	0	111.1	P758 H762	P758-D760 WeakPolarHBondContact CB-OD2 3.39Å; P758-D760 PolarHBondContact O-N 3.46Å; D760-H762 PolarHBondContact O-N 3.36Å
761	N	30	Very low	32.1	Very low	153 Å²	153	129.6 Å²	129.6	82%	0.818	74%	0.738	S	S	*	*			trans	-74	106.1	170.9	-70.2	-52.8	0	0	0	109.6
762	H	34.6	Very low	31.2	Very low	179 Å²	179	133 Å²	133	83%	0.829	76%	0.763	S	S	*	*			trans	-171.1	173.5	134.5	-98.4	-57.3	0	0	0	112.5	D760	D760-H762 PolarHBondContact O-N 3.36Å
763	L	27.8	Very low	30.8	Very low	147 Å²	147	134.1 Å²	134.1	77%	0.77	78%	0.778	S	S	*	*			trans	-73	137.6	-163	-67	67.3	0	0	0	113.1
764	T	31.1	Very low	30.6	Very low	132 Å²	132	135 Å²	135	81%	0.81	78%	0.783	S	S	*	*				-178	153.3	111	25.9	0	0	0	0	111.8
765	S	25.4	Very low	30.9	Very low	117 Å²	117	135.3 Å²	135.3	82%	0.818	78%	0.78	S	S	*	*			trans	-89.2	131.5	175.8	54.5	0	0	0	0	111.6
766	V	30.1	Very low	31.6	Very low	137 Å²	137	137 Å²	137	83%	0.83	78%	0.782	S	S	*	*			trans	-127.5	129.7	168.6	-178.6	0	0	0	0	109.2
767	T	27.1	Very low	32.4	Very low	126 Å²	126	137.9 Å²	137.9	77%	0.773	79%	0.793	S	S	*	*			trans	-73.5	135.3	-173.1	-45.3	0	0	0	0	112.1	T769	T767-T769 PolarHBondContact O-N 3.08Å
768	T	27.3	Very low	34.1	Very low	132 Å²	132	131.1 Å²	131.1	81%	0.81	76%	0.762	S	S	*	*			trans	-78.3	106.6	172.6	33.4	0	0	0	0	111.6
769	T	29.4	Very low	36.1	Very low	128 Å²	128	134.7 Å²	134.7	79%	0.785	77%	0.768	S	S	*	*			trans	-86.9	115.9	165.1	38.4	0	0	0	0	110.3	T767 S771	T767-T769 PolarHBondContact O-N 3.08Å; T769-S771 PolarHBondContact O-N 3Å
770	T	29.2	Very low	38.6	Very low	144 Å²	144	124.7 Å²	124.7	88%	0.883	73%	0.732	S	S	*	*			trans	-79.6	94.8	178.4	50.1	0	0	0	0	111.3
771	S	33.3	Very low	41	Very low	109 Å²	109	118.7 Å²	118.7	76%	0.762	70%	0.702	S	S	*	*			trans	-93.2	115.6	165.4	45.8	0	0	0	0	110.4	T769 S773	T769-S771 PolarHBondContact O-N 3Å; S771-S773 PolarHBondContact O-N 2.9Å
772	S	29.5	Very low	43.8	Very low	120 Å²	120	115 Å²	115	84%	0.839	69%	0.689	S	S	*	*			trans	-79	97.7	179.3	55.7	0	0	0	0	111.3
773	S	35.6	Very low	46.6	Very low	109 Å²	109	107.2 Å²	107.2	76%	0.762	66%	0.656	S	S	*	*			trans	-82.5	130.7	167.9	51.6	0	0	0	0	111	S771 L775	S771-S773 PolarHBondContact O-N 2.9Å; S773-L775 VanDerWaalsContact C-N 3.28Å; S773-L775 PolarHBondContact O-N 2.86Å
774	T	30.3	Very low	49.8	Very low	149 Å²	149	104.8 Å²	104.8	91%	0.914	64%	0.641	S	S	*	*			trans	-79.3	70.2	-177.9	47.8	0	0	0	0	111.7
775	L	39.8	Very low	52.9	Low	119 Å²	119	99.6 Å²	99.6	62%	0.623	61%	0.608	S	S	*	*			trans	-80.1	118.5	167.5	-157.3	75.9	0	0	0	108.8	S773 T777	S773-L775 VanDerWaalsContact C-N 3.28Å; S773-L775 PolarHBondContact O-N 2.86Å; L775-T777 PolarHBondContact O-N 2.94Å
776	S	43.4	Very low	56.3	Low	101 Å²	101	95 Å²	95	71%	0.706	57%	0.574	S	S	*	*			trans	-56	112.9	174.7	53.1	0	0	0	0	109.2	Y778	S776-Y778 PolarHBondContact O-N 2.87Å
777	T	54.7	Low	59.5	Low	138 Å²	138	91.7 Å²	91.7	85%	0.847	55%	0.551	S	S	*	*			trans	-71.8	89.9	-164	-43.2	0	0	0	0	111.4	L775 K779	L775-T777 PolarHBondContact O-N 2.94Å; T777-K779 PolarHBondContact O-N 2.88Å
778	Y	65.4	Low	62.8	Low	41 Å²	41	87.3 Å²	87.3	16%	0.161	52%	0.521	C	S	.	.			trans	-57.7	125.1	168.1	176.4	-119.5	0	0	0	109.4	I287 P290 H294 Y379 S776 L780	I287-Y778 HydrophobicContact CG2-CD1 4.05Å; P290-Y778 HydrophobicContact CB-CD2 3.66Å; P290-Y778 HydrophobicContact CB-CE2 3.98Å; P290-Y778 HydrophobicContact CB-CG 4.19Å; P290-Y778 HydrophobicContact CG-CD2 3.68Å; P290-Y778 HydrophobicContact CG-CE2 4.47Å; P290-Y778 HydrophobicContact CG-CG 4.02Å; H294-Y778 AromaticContact CD2-CE2 3.45Å; H294-Y778 VanDerWaalsContact CD2-CE2 3.45Å; H294-Y778 WeakPolarHBondContact CD2-CE2 3.39Å; H294-Y778 AromaticContact CD2-CZ 3.77Å; H294-Y778 PolarHBondContact CD2-OH 3.03Å; H294-Y778 AromaticContact CG-CE2 3.95Å; H294-Y778 AromaticContact NE2-CE2 3.56Å; Y379-Y778 PolarHBondContact O-OH 3.38Å; S776-Y778 PolarHBondContact O-N 2.87Å; Y778-L780 HydrophobicContact CD1-CD1 3.95Å; Y778-L780 HydrophobicContact CE1-CD1 3.74Å; Y778-L780 HydrophobicContact CE1-CG 3.97Å
779	K	72.6	Confident	66.1	Low	174 Å²	174	81 Å²	81	76%	0.757	48%	0.483	S	S	*	.			trans	-106.2	118.3	176.5	-171.1	-174.1	175.6	-173.5	0	108.5	T777	T777-K779 PolarHBondContact O-N 2.88Å
780	L	81.8	Confident	69.3	Low	28 Å²	28	76 Å²	76	15%	0.147	45%	0.452	C	S	.	.			trans	-62	155.9	171.8	-74.6	71.2	0	0	0	110.5	I287 Y745 Y778	I287-L780 HydrophobicContact CD1-CD1 3.95Å; I287-L780 HydrophobicContact CD1-CD2 4.12Å; I287-L780 HydrophobicContact CD1-CG 4.28Å; Y745-L780 HydrophobicContact CE1-CD2 4.14Å; Y778-L780 HydrophobicContact CD1-CD1 3.95Å; Y778-L780 HydrophobicContact CE1-CD1 3.74Å; Y778-L780 HydrophobicContact CE1-CG 3.97Å
781	G	82.8	Confident	72.5	Confident	10 Å²	10	69.4 Å²	69.4	10%	0.103	41%	0.411	C	S	.	.			trans	-59.9	148.4	167.4	0	0	0	0	0	111	T378 A382 G783	T378-G781 WeakPolarHBondContact CB-O 3.2Å; T378-G781 PolarHBondContact O-N 3.1Å; A382-G781 CarbonylContact O-C 3.25Å; A382-G781 WeakPolarHBondContact O-CA 3.31Å; G781-G783 PolarHBondContact O-N 3.42Å
782	S	89.7	Confident	75.5	Confident	76 Å²	76	65 Å²	65	53%	0.531	38%	0.378	S	S	.	.			trans	-81.4	115.4	-176.5	58.3	0	0	0	0	111.2	K383 V384	K383-S782 WeakPolarHBondContact CA-O 3.43Å; V384-S782 PolarHBondContact N-O 3.24Å
783	G	92.8	Very high	78.7	Confident	15 Å²	15	62 Å²	62	16%	0.155	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	130.3	168.8	0	0	0	0	0	112.2	V384 G781	V384-G783 WeakPolarHBondContact O-CA 3.48Å; G781-G783 PolarHBondContact O-N 3.42Å
784	H	94.8	Very high	81.6	Confident	96 Å²	96	56.8 Å²	56.8	44%	0.444	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143.8	169.8	-173.9	-104.7	0	0	0	109.6	V384 I386 E786	V384-H784 PolarHBondContact O-N 3.27Å; I386-H784 PolarHBondContact N-O 2.94Å; H784-E786 IonicContact CE1-OE2 2.83Å
785	I	97	Very high	84.8	Confident	22 Å²	22	50.5 Å²	50.5	11%	0.113	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	115.1	175	-55.4	-179	0	0	0	107.3	A366 L371 I386 V393 A743 I746 T747 L787	A366-I785 HydrophobicContact CB-CG2 4.28Å; L371-I785 HydrophobicContact CD2-CD1 3.8Å; I386-I785 HydrophobicContact CB-CB 4.5Å; I386-I785 HydrophobicContact CB-CG1 4.2Å; I386-I785 HydrophobicContact CB-CG2 4.35Å; I386-I785 HydrophobicContact CD1-CD1 4.01Å; I386-I785 HydrophobicContact CD1-CG1 3.82Å; I386-I785 HydrophobicContact CG1-CG1 4.09Å; V393-I785 HydrophobicContact CG1-CG2 4.22Å; A743-I785 HydrophobicContact CB-CD1 3.7Å; I746-I785 HydrophobicContact CG2-CD1 4.39Å; I746-I785 HydrophobicContact CG2-CG1 4.44Å; T747-I785 HydrophobicContact CG2-CB 4.12Å; T747-I785 HydrophobicContact CG2-CD1 3.94Å; T747-I785 HydrophobicContact CG2-CG1 3.75Å; I785-L787 HydrophobicContact CG2-CD2 4.19Å
786	E	96.5	Very high	87.4	Confident	22 Å²	22	45.3 Å²	45.3	10%	0.103	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	110.6	179	-150.6	-178.7	111.7	0	0	110	I386 L387 E388 H784 S789 N807 Y818	I386-E786 PolarHBondContact O-N 3.14Å; L387-E786 HydrophobicContact CD2-CB 4.34Å; E388-E786 PolarHBondContact N-O 3.4Å; H784-E786 IonicContact CE1-OE2 2.83Å; E786-S789 PolarHBondContact OE1-OG 3.19Å; E786-N807 PolarHBondContact OE1-ND2 3.31Å; E786-Y818 PolarHBondContact OE1-OH 3.28Å; E786-Y818 PolarHBondContact OE2-OH 3.13Å
787	L	97	Very high	89.9	Confident	66 Å²	66	42.4 Å²	42.4	35%	0.346	23%	0.226	S	C	.	.	S	Bend	trans	-83.9	161.3	176.9	-58.1	176.9	0	0	0	110.6	E388 V393 I785 S789	E388-L787 HydrophobicContact CB-CD2 4.02Å; E388-L787 HydrophobicContact CG-CD2 3.86Å; E388-L787 CarbonylContact O-C 3.54Å; E388-L787 VanDerWaalsContact O-C 3.29Å; E388-L787 WeakPolarHBondContact O-CA 3.42Å; V393-L787 HydrophobicContact CG1-CD2 4.09Å; I785-L787 HydrophobicContact CG2-CD2 4.19Å; L787-S789 PolarHBondContact O-N 3.41Å
788	K	96	Very high	91.6	Very high	35 Å²	35	39.2 Å²	39.2	15%	0.152	20%	0.204	C	C	.	.	S	Bend	trans	64.3	14.6	-178.6	-65.3	178.9	169.2	-177.9	0	114.9	E388 R390 D391 S808 A809 T970	E388-K788 PolarHBondContact O-N 2.92Å; R390-K788 PolarHBondContact O-N 2.95Å; D391-K788 HydrophobicContact CB-CD 4.47Å; D391-K788 HydrophobicContact CB-CG 4.09Å; K788-S808 PolarHBondContact O-N 2.95Å; K788-S808 PolarHBondContact O-OG 3.37Å; K788-S808 VanDerWaalsContact O-OG 3.09Å; K788-A809 HydrophobicContact CB-CB 4.41Å; K788-A809 HydrophobicContact CD-CB 4.04Å; K788-T970 WeakPolarHBondContact CE-OG1 3.46Å; K788-T970 PolarHBondContact NZ-OG1 3.22Å
789	S	96.4	Very high	92.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	102	-175.4	-74.2	0	0	0	0	111.3	E388 S389 E786 L787 V805 N807	E388-S789 CarbonylContact C-O 3.52Å; E388-S789 PolarHBondContact O-N 2.87Å; S389-S789 VanDerWaalsContact CA-O 3.25Å; S389-S789 WeakPolarHBondContact CA-O 3.5Å; S389-S789 PolarHBondContact N-O 3Å; S389-S789 PolarHBondContact OG-O 3.33Å; E786-S789 PolarHBondContact OE1-OG 3.19Å; L787-S789 PolarHBondContact O-N 3.41Å; S789-V805 VanDerWaalsContact CB-CG1 3.48Å; S789-N807 PolarHBondContact OG-ND2 3.11Å
790	T	96.3	Very high	93.8	Very high	22 Å²	22	35.3 Å²	35.3	14%	0.135	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	112.2	180	-53.4	0	0	0	0	110	S389 K792 L806	S389-T790 WeakPolarHBondContact OG-CA 3.44Å; T790-K792 PolarHBondContact O-N 3.38Å; T790-L806 PolarHBondContact N-O 3.33Å; T790-L806 PolarHBondContact O-N 3.32Å
791	V	97	Very high	94.5	Very high	5 Å²	5	34.1 Å²	34.1	3%	0.03	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	131.3	175	-177.5	0	0	0	0	109.5	I364 L387 I794 V803 D804 V805 P865	I364-V791 HydrophobicContact CD1-CB 4.47Å; I364-V791 HydrophobicContact CD1-CG1 4.17Å; I364-V791 HydrophobicContact CD1-CG2 4.06Å; I364-V791 HydrophobicContact CG1-CG2 4.14Å; I364-V791 HydrophobicContact CG2-CG2 3.97Å; L387-V791 HydrophobicContact CB-CG2 4.3Å; L387-V791 HydrophobicContact CD1-CG2 4.05Å; V791-I794 HydrophobicContact CG1-CD1 4.39Å; V791-I794 HydrophobicContact CG1-CG1 3.75Å; V791-V803 HydrophobicContact CB-CG1 4.35Å; V791-V803 HydrophobicContact CG1-CG1 3.48Å; V791-V803 VanDerWaalsContact CG1-CG1 3.48Å; V791-V803 HydrophobicContact CG2-CG1 3.94Å; V791-D804 WeakPolarHBondContact CA-O 3.24Å; V791-V805 HydrophobicContact CG2-CG2 4.39Å; V791-P865 HydrophobicContact CB-CB 4.26Å; V791-P865 HydrophobicContact CG1-CB 3.89Å
792	K	95.6	Very high	95.2	Very high	18 Å²	18	37.3 Å²	37.3	8%	0.078	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	-35.9	179.6	-59.8	-63.9	178.6	158	0	112	T790 D804 L806 L815 L859 T860 L862 P865 R866	T790-K792 PolarHBondContact O-N 3.38Å; K792-D804 PolarHBondContact N-O 3.5Å; K792-L806 HydrophobicContact CD-CB 4.5Å; K792-L806 HydrophobicContact CG-CB 4.14Å; K792-L815 HydrophobicContact CB-CD2 4.33Å; K792-L815 HydrophobicContact CG-CD2 3.85Å; K792-L859 WeakPolarHBondContact CD-O 3.38Å; K792-T860 WeakPolarHBondContact CE-O 3.35Å; K792-T860 PolarHBondContact NZ-O 2.74Å; K792-L862 HydrophobicContact CD-CB 4.24Å; K792-L862 WeakPolarHBondContact CD-O 3.35Å; K792-L862 PolarHBondContact NZ-O 3.46Å; K792-L862 VanDerWaalsContact O-CD1 3.3Å; K792-L862 WeakPolarHBondContact O-CD1 3.02Å; K792-P865 WeakPolarHBondContact O-CA 3.23Å; K792-R866 PolarHBondContact O-N 3.33Å
793	R	96.4	Very high	95.6	Very high	55 Å²	55	33.7 Å²	33.7	21%	0.208	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	144.8	176.7	176.5	172.9	57	148	7.8	111.5	V803 D804 L859 R866 E868	R793-V803 WeakPolarHBondContact O-CA 3.3Å; R793-D804 HydrophobicContact CB-CB 4.12Å; R793-D804 IonicContact CZ-OD2 3.66Å; R793-D804 IonicContact NE-OD2 2.67Å; R793-D804 PolarHBondContact NE-OD2 3.44Å; R793-D804 IonicContact NH2-OD2 3.67Å; R793-D804 PolarHBondContact NH2-OD2 2.98Å; R793-D804 PolarHBondContact O-N 3.47Å; R793-L859 HydrophobicContact CB-CD2 4.34Å; R793-R866 CarbonylContact C-O 3.6Å; R793-R866 WeakPolarHBondContact CA-O 3.37Å; R793-E868 WeakPolarHBondContact CD-OE1 3.28Å; R793-E868 WeakPolarHBondContact CD-OE2 3.37Å; R793-E868 HydrophobicContact CG-CG 4.33Å; R793-E868 IonicContact CZ-OE2 3.89Å; R793-E868 IonicContact NE-OE2 2.72Å; R793-E868 IonicContact NH1-OE2 3.79Å; R793-E868 PolarHBondContact NH1-OE2 3.16Å
794	I	97.5	Very high	95.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	99	175.2	-56.8	164	0	0	0	107	I364 V791 L823 P865 R866 F867 E868 I1107	I364-I794 HydrophobicContact CD1-CD1 3.38Å; I364-I794 HydrophobicContact CD1-CG1 3.77Å; V791-I794 HydrophobicContact CG1-CD1 4.39Å; V791-I794 HydrophobicContact CG1-CG1 3.75Å; I794-L823 HydrophobicContact CG2-CD1 4.27Å; I794-P865 HydrophobicContact CD1-CB 4.04Å; I794-P865 HydrophobicContact CD1-CG 4.29Å; I794-P865 HydrophobicContact CG1-CB 4.31Å; I794-R866 PolarHBondContact N-O 2.74Å; I794-F867 HydrophobicContact CB-CD1 4.1Å; I794-F867 HydrophobicContact CB-CE1 4.34Å; I794-F867 HydrophobicContact CD1-CD1 4.11Å; I794-F867 HydrophobicContact CD1-CE1 3.53Å; I794-F867 HydrophobicContact CD1-CE2 4.4Å; I794-F867 HydrophobicContact CD1-CZ 3.7Å; I794-F867 HydrophobicContact CG2-CD1 4.25Å; I794-F867 HydrophobicContact CG2-CE1 4.37Å; I794-E868 PolarHBondContact O-N 3.21Å; I794-I1107 HydrophobicContact CG2-CD1 3.77Å
795	S	96.9	Very high	95.9	Very high	17 Å²	17	29 Å²	29	12%	0.119	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	134.4	175.7	-61.2	0	0	0	0	109.8	V801 Q802 E868	S795-V801 WeakPolarHBondContact O-CA 3.18Å; S795-Q802 WeakPolarHBondContact CA-O 3.36Å; S795-Q802 PolarHBondContact N-O 3.09Å; S795-Q802 PolarHBondContact O-N 2.97Å; S795-Q802 VanDerWaalsContact O-O 3.12Å; S795-E868 CarbonylContact C-O 3.59Å; S795-E868 VanDerWaalsContact CA-O 3.25Å; S795-E868 WeakPolarHBondContact CA-O 3.22Å
796	Y	95.8	Very high	95.8	Very high	11 Å²	11	28.9 Å²	28.9	4%	0.043	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	145.1	178.6	65.3	-81.9	0	0	0	113.1	E868 P869 R870 V1072 H1074 R1106 I1107	Y796-E868 PolarHBondContact N-O 3.43Å; Y796-P869 HydrophobicContact CE1-CG 4.15Å; Y796-P869 WeakPolarHBondContact CE1-O 3.46Å; Y796-P869 HydrophobicContact CE2-CG 4.06Å; Y796-P869 WeakPolarHBondContact O-CD 3.25Å; Y796-P869 PolarHBondContact OH-O 2.97Å; Y796-R870 PolarHBondContact OH-O 3.18Å; Y796-V1072 HydrophobicContact CE2-CG1 3.72Å; Y796-V1072 WeakPolarHBondContact OH-CG1 3.38Å; Y796-H1074 HydrophobicContact CD2-CB 4.14Å; Y796-H1074 HydrophobicContact CE2-CB 4.49Å; Y796-H1074 PolarHBondContact O-CD2 3.01Å; Y796-H1074 VanDerWaalsContact O-CD2 3.29Å; Y796-R1106 HydrophobicContact CD2-CB 4.45Å; Y796-I1107 HydrophobicContact CD1-CD1 3.44Å; Y796-I1107 VanDerWaalsContact CD1-CD1 3.44Å; Y796-I1107 HydrophobicContact CD1-CG1 4.31Å; Y796-I1107 HydrophobicContact CE1-CD1 3.72Å; Y796-I1107 HydrophobicContact CG-CD1 3.87Å; Y796-I1107 HydrophobicContact CG-CG1 4.25Å
797	S	94	Very high	95.6	Very high	40 Å²	40	28 Å²	28	28%	0.28	15%	0.152	S	C	.	.			trans	-144.1	171.3	-168.1	67.1	0	0	0	0	112	T799 G800 R1106	S797-T799 PolarHBondContact O-N 3.03Å; S797-T799 VanDerWaalsContact O-N 3.12Å; S797-T799 PolarHBondContact OG-N 2.82Å; S797-T799 PolarHBondContact OG-OG1 3.12Å; S797-G800 PolarHBondContact N-O 3.28Å; S797-G800 PolarHBondContact OG-N 2.87Å; S797-G800 VanDerWaalsContact OG-N 3.13Å; S797-G800 PolarHBondContact OG-O 3.17Å; S797-R1106 WeakPolarHBondContact O-CG 3.45Å; S797-R1106 PolarHBondContact O-NE 2.9Å
798	N	90.5	Very high	95.3	Very high	70 Å²	70	26.7 Å²	26.7	37%	0.374	15%	0.148	S	C	.	.	S	Bend	trans	-61.2	-16.2	171.6	-73.4	-18	0	0	0	113.5	H1074 N1103 R1106	N798-H1074 VanDerWaalsContact CG-ND1 3.33Å; N798-H1074 WeakPolarHBondContact OD1-CB 3.45Å; N798-H1074 PolarHBondContact OD1-ND1 3.37Å; N798-N1103 PolarHBondContact OD1-ND2 3.14Å; N798-R1106 PolarHBondContact O-NH2 2.9Å
799	T	90.4	Very high	95	Very high	123 Å²	123	28 Å²	28	76%	0.755	17%	0.166	S	C	*	.	S	Bend	trans	-99.5	-31.4	-179.4	46.1	0	0	0	0	114.3	S797 R1106	S797-T799 PolarHBondContact O-N 3.03Å; S797-T799 VanDerWaalsContact O-N 3.12Å; S797-T799 PolarHBondContact OG-N 2.82Å; S797-T799 PolarHBondContact OG-OG1 3.12Å; T799-R1106 VanDerWaalsContact C-CZ 3.45Å; T799-R1106 VanDerWaalsContact C-NH2 3.29Å; T799-R1106 PolarHBondContact O-NH1 2.99Å; T799-R1106 PolarHBondContact O-NH2 3.16Å; T799-R1106 VanDerWaalsContact O-NH2 3.15Å
800	G	94.3	Very high	94.5	Very high	10 Å²	10	35.7 Å²	35.7	10%	0.103	20%	0.2	C	C	.	.			trans	174.6	-164	-176.3	0	0	0	0	0	113.5	S797	S797-G800 PolarHBondContact N-O 3.28Å; S797-G800 PolarHBondContact OG-N 2.87Å; S797-G800 VanDerWaalsContact OG-N 3.13Å; S797-G800 PolarHBondContact OG-O 3.17Å
801	V	97.3	Very high	93.8	Very high	4 Å²	4	35.9 Å²	35.9	2%	0.024	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	146.9	175.6	-62	0	0	0	0	111.3	S795 E819 A820 L823 R1106	S795-V801 WeakPolarHBondContact O-CA 3.18Å; V801-E819 WeakPolarHBondContact O-CA 3.49Å; V801-A820 HydrophobicContact CG2-CB 3.65Å; V801-A820 WeakPolarHBondContact CG2-O 3.32Å; V801-A820 PolarHBondContact N-O 3.47Å; V801-A820 PolarHBondContact O-N 3.38Å; V801-L823 HydrophobicContact CG1-CB 4.2Å; V801-L823 HydrophobicContact CG2-CB 4.2Å; V801-R1106 HydrophobicContact CG1-CB 4.08Å; V801-R1106 WeakPolarHBondContact CG1-O 3.38Å
802	Q	97.7	Very high	92.9	Very high	77 Å²	77	42.8 Å²	42.8	36%	0.36	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	132.3	175.1	-89.5	168.3	-13.5	0	0	108.3	S795 Y818 E819	S795-Q802 WeakPolarHBondContact CA-O 3.36Å; S795-Q802 PolarHBondContact N-O 3.09Å; S795-Q802 PolarHBondContact O-N 2.97Å; S795-Q802 VanDerWaalsContact O-O 3.12Å; Q802-Y818 CarbonylContact C-O 3.58Å; Q802-Y818 WeakPolarHBondContact CA-O 3.28Å; Q802-E819 HydrophobicContact CG-CG 3.94Å; Q802-E819 PolarHBondContact NE2-OE1 2.94Å
803	V	97.7	Very high	92.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	117.3	-173.3	-172.8	0	0	0	0	110.1	I362 L387 V791 R793 V805 E817 Y818 L823	I362-V803 HydrophobicContact CD1-CB 4.21Å; I362-V803 HydrophobicContact CD1-CG2 3.69Å; I362-V803 HydrophobicContact CG2-CG2 4.3Å; L387-V803 HydrophobicContact CD1-CG1 3.92Å; V791-V803 HydrophobicContact CB-CG1 4.35Å; V791-V803 HydrophobicContact CG1-CG1 3.48Å; V791-V803 VanDerWaalsContact CG1-CG1 3.48Å; V791-V803 HydrophobicContact CG2-CG1 3.94Å; R793-V803 WeakPolarHBondContact O-CA 3.3Å; V803-V805 HydrophobicContact CG1-CG2 4Å; V803-E817 WeakPolarHBondContact O-CA 3.41Å; V803-Y818 PolarHBondContact N-O 3.04Å; V803-Y818 PolarHBondContact O-N 2.92Å; V803-L823 HydrophobicContact CG2-CD1 3.46Å; V803-L823 VanDerWaalsContact CG2-CD1 3.46Å
804	D	96.8	Very high	92	Very high	12 Å²	12	50 Å²	50	6%	0.064	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	125.6	173.7	-72.4	-51.3	0	0	0	110.2	V791 K792 R793 L815	V791-D804 WeakPolarHBondContact CA-O 3.24Å; K792-D804 PolarHBondContact N-O 3.5Å; R793-D804 HydrophobicContact CB-CB 4.12Å; R793-D804 IonicContact CZ-OD2 3.66Å; R793-D804 IonicContact NE-OD2 2.67Å; R793-D804 PolarHBondContact NE-OD2 3.44Å; R793-D804 IonicContact NH2-OD2 3.67Å; R793-D804 PolarHBondContact NH2-OD2 2.98Å; R793-D804 PolarHBondContact O-N 3.47Å; D804-L815 HydrophobicContact CB-CD1 4.35Å
805	V	96.2	Very high	91.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	128	-174.4	-177.3	0	0	0	0	110.4	L387 S789 V791 V803 I816 Y818	L387-V805 HydrophobicContact CD1-CG2 3.63Å; L387-V805 HydrophobicContact CD2-CG2 4.17Å; L387-V805 HydrophobicContact CG-CG2 4.48Å; S789-V805 VanDerWaalsContact CB-CG1 3.48Å; V791-V805 HydrophobicContact CG2-CG2 4.39Å; V803-V805 HydrophobicContact CG1-CG2 4Å; V805-I816 WeakPolarHBondContact CB-O 3.14Å; V805-I816 PolarHBondContact N-O 3Å; V805-I816 PolarHBondContact O-N 3.14Å; V805-Y818 HydrophobicContact CB-CD2 4.1Å; V805-Y818 HydrophobicContact CB-CE2 3.79Å; V805-Y818 HydrophobicContact CG1-CE2 4.34Å; V805-Y818 HydrophobicContact CG2-CD2 3.51Å; V805-Y818 HydrophobicContact CG2-CE2 3.66Å
806	L	94.6	Very high	91.6	Very high	19 Å²	19	54.1 Å²	54.1	10%	0.099	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	105.3	164.8	-177.7	62.7	0	0	0	109.4	T790 K792 D814 L815	T790-L806 PolarHBondContact N-O 3.33Å; T790-L806 PolarHBondContact O-N 3.32Å; K792-L806 HydrophobicContact CD-CB 4.5Å; K792-L806 HydrophobicContact CG-CB 4.14Å; L806-D814 WeakPolarHBondContact CD1-O 3.49Å; L806-L815 HydrophobicContact CB-CD2 4.14Å
807	N	93.8	Very high	91.6	Very high	4 Å²	4	58.8 Å²	58.8	2%	0.021	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	103.4	173.6	-171.7	-28.2	0	0	0	111.2	E786 S789 A809 F810 S811 I816	E786-N807 PolarHBondContact OE1-ND2 3.31Å; S789-N807 PolarHBondContact OG-ND2 3.11Å; N807-A809 PolarHBondContact O-N 3.22Å; N807-A809 VanDerWaalsContact OD1-CB 3.28Å; N807-A809 WeakPolarHBondContact OD1-CB 3.22Å; N807-A809 PolarHBondContact OD1-N 2.76Å; N807-F810 HydrophobicContact CB-CD2 3.91Å; N807-F810 WeakPolarHBondContact ND2-CD2 3.26Å; N807-F810 WeakPolarHBondContact ND2-CE2 3.47Å; N807-F810 PolarHBondContact O-N 3.42Å; N807-S811 CarbonylContact C-O 3.37Å; N807-S811 PolarHBondContact O-N 3.06Å; N807-I816 HydrophobicContact CB-CD1 4.05Å
808	S	90.8	Very high	91.7	Very high	38 Å²	38	58.7 Å²	58.7	27%	0.266	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	0.9	-177.8	61.9	0	0	0	0	115.6	K788 S811	K788-S808 PolarHBondContact O-N 2.95Å; K788-S808 PolarHBondContact O-OG 3.37Å; K788-S808 VanDerWaalsContact O-OG 3.09Å; S808-S811 WeakPolarHBondContact CA-O 3.42Å
809	A	88.4	Confident	92	Very high	64 Å²	64	61 Å²	61	53%	0.529	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-20.4	166.3	0	0	0	0	0	113.7	K788 N807	K788-A809 HydrophobicContact CB-CB 4.41Å; K788-A809 HydrophobicContact CD-CB 4.04Å; N807-A809 PolarHBondContact O-N 3.22Å; N807-A809 VanDerWaalsContact OD1-CB 3.28Å; N807-A809 WeakPolarHBondContact OD1-CB 3.22Å; N807-A809 PolarHBondContact OD1-N 2.76Å
810	F	85.5	Confident	92.3	Very high	161 Å²	161	55.7 Å²	55.7	71%	0.706	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	-45.2	-178.5	-62.5	-58.1	0	0	0	113	N807 I816	N807-F810 HydrophobicContact CB-CD2 3.91Å; N807-F810 WeakPolarHBondContact ND2-CD2 3.26Å; N807-F810 WeakPolarHBondContact ND2-CE2 3.47Å; N807-F810 PolarHBondContact O-N 3.42Å; F810-I816 HydrophobicContact CD2-CD1 4.27Å
811	S	83.2	Confident	92.4	Very high	26 Å²	26	57.6 Å²	57.6	18%	0.182	30%	0.299	C	S	.	.			trans	-149.1	163	177.7	-170.8	0	0	0	0	111.8	N807 S808 D813 D814	N807-S811 CarbonylContact C-O 3.37Å; N807-S811 PolarHBondContact O-N 3.06Å; S808-S811 WeakPolarHBondContact CA-O 3.42Å; S811-D813 PolarHBondContact OG-N 3.43Å; S811-D814 VanDerWaalsContact CB-OD2 3.23Å; S811-D814 WeakPolarHBondContact CB-OD2 3.4Å; S811-D814 PolarHBondContact OG-N 3.31Å; S811-D814 VanDerWaalsContact OG-N 3.09Å; S811-D814 PolarHBondContact OG-OD2 2.85Å
812	Q	77.2	Confident	92.4	Very high	150 Å²	150	57.5 Å²	57.5	70%	0.701	30%	0.298	S	S	*	.	S	Bend	trans	-106.7	-11.8	170.5	-64.5	-168.3	-16.5	0	0	112.8
813	D	84.1	Confident	92.4	Very high	115 Å²	115	53.8 Å²	53.8	62%	0.615	28%	0.281	S	S	*	.	S	Bend	trans	-127.5	-19.1	-174.6	-58	-69.1	0	0	0	113.5	S811 T860	S811-D813 PolarHBondContact OG-N 3.43Å; D813-T860 WeakPolarHBondContact O-CG2 3.39Å
814	D	88.9	Confident	92.4	Very high	109 Å²	109	53.8 Å²	53.8	58%	0.583	28%	0.281	S	S	*	.			trans	-89.4	129.8	178.4	-54.2	-73.2	0	0	0	111.7	L806 S811	L806-D814 WeakPolarHBondContact CD1-O 3.49Å; S811-D814 VanDerWaalsContact CB-OD2 3.23Å; S811-D814 WeakPolarHBondContact CB-OD2 3.4Å; S811-D814 PolarHBondContact OG-N 3.31Å; S811-D814 VanDerWaalsContact OG-N 3.09Å; S811-D814 PolarHBondContact OG-OD2 2.85Å
815	L	92	Very high	92.5	Very high	45 Å²	45	53.3 Å²	53.3	24%	0.236	28%	0.278	C	S	.	.			trans	-89.7	138.6	172	-62	173.7	0	0	0	110.5	K792 D804 L806 L859 T860	K792-L815 HydrophobicContact CB-CD2 4.33Å; K792-L815 HydrophobicContact CG-CD2 3.85Å; D804-L815 HydrophobicContact CB-CD1 4.35Å; L806-L815 HydrophobicContact CB-CD2 4.14Å; L815-L859 HydrophobicContact CD1-CB 3.8Å; L815-L859 HydrophobicContact CD1-CD1 4.13Å; L815-T860 HydrophobicContact CD1-CG2 4.42Å; L815-T860 HydrophobicContact CD2-CG2 4.08Å; L815-T860 HydrophobicContact CG-CG2 4.04Å
816	I	94	Very high	92.6	Very high	58 Å²	58	53.8 Å²	53.8	30%	0.297	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.3	171.9	-50.6	173.8	0	0	0	107.4	V805 N807 F810 Y818	V805-I816 WeakPolarHBondContact CB-O 3.14Å; V805-I816 PolarHBondContact N-O 3Å; V805-I816 PolarHBondContact O-N 3.14Å; N807-I816 HydrophobicContact CB-CD1 4.05Å; F810-I816 HydrophobicContact CD2-CD1 4.27Å; I816-Y818 HydrophobicContact CB-CE2 3.76Å; I816-Y818 HydrophobicContact CG2-CD2 4.16Å; I816-Y818 HydrophobicContact CG2-CE2 3.38Å
817	E	95.3	Very high	92.8	Very high	110 Å²	110	53.8 Å²	53.8	51%	0.514	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	132	179.2	-172.3	177.4	66	0	0	110.6	V803	V803-E817 WeakPolarHBondContact O-CA 3.41Å
818	Y	96.5	Very high	93	Very high	37 Å²	37	54.5 Å²	54.5	15%	0.145	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122.1	176.3	-64.8	-107.3	0	0	0	110.3	I362 T385 L387 E786 Q802 V803 V805 I816	I362-Y818 WeakPolarHBondContact CD1-O 3.46Å; T385-Y818 HydrophobicContact CG2-CD1 4.12Å; T385-Y818 HydrophobicContact CG2-CE1 4.2Å; L387-Y818 HydrophobicContact CD2-CD1 4.47Å; L387-Y818 HydrophobicContact CD2-CE1 4.22Å; L387-Y818 HydrophobicContact CD2-CE2 4.3Å; E786-Y818 PolarHBondContact OE1-OH 3.28Å; E786-Y818 PolarHBondContact OE2-OH 3.13Å; Q802-Y818 CarbonylContact C-O 3.58Å; Q802-Y818 WeakPolarHBondContact CA-O 3.28Å; V803-Y818 PolarHBondContact N-O 3.04Å; V803-Y818 PolarHBondContact O-N 2.92Å; V805-Y818 HydrophobicContact CB-CD2 4.1Å; V805-Y818 HydrophobicContact CB-CE2 3.79Å; V805-Y818 HydrophobicContact CG1-CE2 4.34Å; V805-Y818 HydrophobicContact CG2-CD2 3.51Å; V805-Y818 HydrophobicContact CG2-CE2 3.66Å; I816-Y818 HydrophobicContact CB-CE2 3.76Å; I816-Y818 HydrophobicContact CG2-CD2 4.16Å; I816-Y818 HydrophobicContact CG2-CE2 3.38Å
819	E	97.3	Very high	93.4	Very high	118 Å²	118	52.7 Å²	52.7	55%	0.551	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	148.1	172.3	-56	-161.3	126	0	0	111.9	H360 V801 Q802	H360-E819 PolarHBondContact CE1-O 3.12Å; H360-E819 PolarHBondContact ND1-O 3.29Å; V801-E819 WeakPolarHBondContact O-CA 3.49Å; Q802-E819 HydrophobicContact CG-CG 3.94Å; Q802-E819 PolarHBondContact NE2-OE1 2.94Å
820	A	96.9	Very high	93.9	Very high	13 Å²	13	49.9 Å²	49.9	11%	0.107	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	168.1	172.7	0	0	0	0	0	112.1	H360 I362 V801	H360-A820 VanDerWaalsContact O-CB 3.23Å; H360-A820 WeakPolarHBondContact O-CB 3.26Å; I362-A820 HydrophobicContact CB-CB 4.34Å; I362-A820 HydrophobicContact CD1-CB 3.72Å; I362-A820 HydrophobicContact CG1-CB 3.66Å; V801-A820 HydrophobicContact CG2-CB 3.65Å; V801-A820 WeakPolarHBondContact CG2-O 3.32Å; V801-A820 PolarHBondContact N-O 3.47Å; V801-A820 PolarHBondContact O-N 3.38Å
821	D	95.8	Very high	94.4	Very high	50 Å²	50	42.6 Å²	42.6	27%	0.267	22%	0.219	S	C	.	.	S	Bend	trans	-67.7	-44.7	172.7	-65.7	-72.1	0	0	0	111.2	P359 H360 F361 R1106 Y1140	P359-D821 WeakPolarHBondContact CA-OD2 3.32Å; H360-D821 PolarHBondContact N-OD2 3.18Å; H360-D821 PolarHBondContact O-N 2.96Å; F361-D821 HydrophobicContact CE1-CB 4.22Å; D821-R1106 WeakPolarHBondContact O-CD 3.47Å; D821-R1106 PolarHBondContact O-NH1 3.38Å; D821-Y1140 HydrophobicContact CB-CD1 4.17Å; D821-Y1140 HydrophobicContact CB-CE1 4Å
822	A	97.2	Very high	95.1	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.008	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	168.7	177.7	0	0	0	0	0	112.4	F361 I362 R1106 F1108 Y1140	F361-A822 WeakPolarHBondContact CA-O 3.32Å; F361-A822 HydrophobicContact CD1-CB 3.96Å; F361-A822 HydrophobicContact CE1-CB 4.15Å; I362-A822 PolarHBondContact N-O 2.79Å; I362-A822 VanDerWaalsContact N-O 3.13Å; A822-R1106 WeakPolarHBondContact CA-O 3.45Å; A822-F1108 HydrophobicContact CB-CD2 4.26Å; A822-F1108 HydrophobicContact CB-CE2 3.85Å; A822-Y1140 HydrophobicContact CB-CE2 3.9Å
823	L	98	Very high	96.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.4	-176.7	-169.6	130.6	0	0	0	112	I362 I364 I794 V801 V803 C825 R1106 I1107 F1108	I362-L823 HydrophobicContact CB-CD1 4.02Å; I362-L823 HydrophobicContact CB-CG 4.45Å; I362-L823 HydrophobicContact CG2-CD1 3.7Å; I362-L823 HydrophobicContact CG2-CG 4.35Å; I362-L823 CarbonylContact O-C 3.53Å; I362-L823 VanDerWaalsContact O-CA 3.3Å; I362-L823 WeakPolarHBondContact O-CA 3.34Å; I364-L823 HydrophobicContact CD1-CD1 3.81Å; I364-L823 HydrophobicContact CD1-CD2 3.79Å; I364-L823 HydrophobicContact CD1-CG 4.3Å; I364-L823 HydrophobicContact CG1-CD1 3.95Å; I364-L823 HydrophobicContact CG1-CD2 4.06Å; I364-L823 HydrophobicContact CG1-CG 4.28Å; I794-L823 HydrophobicContact CG2-CD1 4.27Å; V801-L823 HydrophobicContact CG1-CB 4.2Å; V801-L823 HydrophobicContact CG2-CB 4.2Å; V803-L823 HydrophobicContact CG2-CD1 3.46Å; V803-L823 VanDerWaalsContact CG2-CD1 3.46Å; L823-C825 HydrophobicContact CD2-CB 3.89Å; L823-R1106 PolarHBondContact N-O 2.8Å; L823-I1107 HydrophobicContact CD2-CG2 4.08Å; L823-I1107 CarbonylContact O-C 3.59Å; L823-I1107 WeakPolarHBondContact O-CA 3.48Å; L823-F1108 PolarHBondContact O-N 2.9Å
824	I	98.6	Very high	96.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	114.7	162.6	-51.3	-178.8	0	0	0	108.5	I362 I363 I364 A373 L377 T826 F1108 A1110 E1132 V1136	I362-I824 PolarHBondContact O-N 2.71Å; I363-I824 WeakPolarHBondContact CA-O 3.48Å; I363-I824 HydrophobicContact CD1-CB 4.49Å; I363-I824 HydrophobicContact CD1-CD1 4.07Å; I363-I824 HydrophobicContact CG1-CB 4.11Å; I363-I824 HydrophobicContact CG1-CD1 4.42Å; I363-I824 HydrophobicContact CG1-CG1 4.41Å; I363-I824 HydrophobicContact CG2-CB 4.41Å; I364-I824 PolarHBondContact N-O 3.39Å; A373-I824 HydrophobicContact CB-CD1 4Å; L377-I824 HydrophobicContact CD1-CD1 3.83Å; I824-T826 HydrophobicContact CG2-CG2 3.97Å; I824-F1108 HydrophobicContact CG1-CB 4.19Å; I824-A1110 HydrophobicContact CG2-CB 4.06Å; I824-E1132 HydrophobicContact CD1-CB 4.12Å; I824-E1132 HydrophobicContact CG2-CB 4.21Å; I824-E1132 HydrophobicContact CG2-CG 4.46Å; I824-V1136 HydrophobicContact CD1-CG2 4.25Å; I824-V1136 HydrophobicContact CG1-CG2 4.3Å
825	C	98.6	Very high	96.9	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.007	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	120.4	175	178.2	0	0	0	0	109.5	L823 I1107 F1108 F1109 A1110	L823-C825 HydrophobicContact CD2-CB 3.89Å; C825-I1107 HydrophobicContact CB-CG2 4.12Å; C825-F1108 PolarHBondContact N-O 3.45Å; C825-F1109 HydrophobicContact CB-CD1 3.97Å; C825-F1109 HydrophobicContact CB-CE1 3.98Å; C825-A1110 PolarHBondContact O-N 3.29Å
826	T	98.7	Very high	96.9	Very high	10 Å²	10	25.7 Å²	25.7	6%	0.061	13%	0.128	C	C	.	.			trans	-121.9	22.4	173.1	82.5	0	0	0	0	113.9	I363 I364 G365 I824 A1110	I363-T826 HydrophobicContact CG2-CG2 4.18Å; I364-T826 WeakPolarHBondContact O-CA 3.47Å; I364-T826 WeakPolarHBondContact O-CB 3.46Å; I364-T826 PolarHBondContact O-N 3.32Å; I364-T826 PolarHBondContact O-OG1 2.83Å; G365-T826 PolarHBondContact O-OG1 2.66Å; I824-T826 HydrophobicContact CG2-CG2 3.97Å; T826-A1110 VanDerWaalsContact CA-O 3.23Å; T826-A1110 WeakPolarHBondContact CA-O 3.31Å; T826-A1110 WeakPolarHBondContact CB-O 3.19Å; T826-A1110 HydrophobicContact CG2-CB 4.04Å
827	L	98.4	Very high	96.6	Very high	19 Å²	19	28.4 Å²	28.4	10%	0.099	14%	0.14	C	C	.	.			trans	-55.3	131.6	171.4	-64.6	172.5	0	0	0	110.7	I364 I831 L832 P865 H1113	I364-L827 HydrophobicContact CG2-CD2 3.53Å; I364-L827 HydrophobicContact CG2-CG 3.91Å; L827-I831 HydrophobicContact CB-CB 4.43Å; L827-I831 HydrophobicContact CB-CG2 4.34Å; L827-I831 HydrophobicContact CD1-CG2 4.36Å; L827-I831 HydrophobicContact CD2-CG2 4.16Å; L827-L832 HydrophobicContact CB-CD2 4.03Å; L827-L832 HydrophobicContact CB-CG 4.25Å; L827-L832 HydrophobicContact CD1-CD2 4.05Å; L827-P865 HydrophobicContact CD1-CG 3.42Å; L827-P865 VanDerWaalsContact CD1-CG 3.42Å; L827-P865 HydrophobicContact CD2-CG 4.43Å; L827-H1113 PolarHBondContact O-CE1 2.67Å
828	P	98.5	Very high	95.9	Very high	19 Å²	19	25.4 Å²	25.4	12%	0.123	13%	0.126	C	C	.	.			trans	-56.2	147.8	172.9	-27.3	36.9	0	0	0	112.7	G830 I831 L832 F884	P828-G830 PolarHBondContact O-N 2.77Å; P828-G830 VanDerWaalsContact O-N 3.14Å; P828-I831 HydrophobicContact CB-CG1 4.43Å; P828-I831 WeakPolarHBondContact O-CA 3.19Å; P828-I831 WeakPolarHBondContact O-CB 3.26Å; P828-I831 PolarHBondContact O-N 2.84Å; P828-L832 PolarHBondContact O-N 3.2Å; P828-F884 HydrophobicContact CB-CZ 3.97Å
829	L	98.5	Very high	94.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-55.2	-34.7	-178.4	172.6	61.8	0	0	0	113.1	I831 L832 K833 I879 L882 G883 F884 L1068 H1113	L829-I831 VanDerWaalsContact C-N 3.3Å; L829-I831 PolarHBondContact O-N 2.95Å; L829-L832 PolarHBondContact O-N 2.83Å; L829-K833 HydrophobicContact CD1-CG 4.26Å; L829-K833 HydrophobicContact CG-CD 4.45Å; L829-K833 HydrophobicContact CG-CG 4.48Å; L829-K833 WeakPolarHBondContact O-CG 3.49Å; L829-K833 PolarHBondContact O-N 2.81Å; L829-I879 HydrophobicContact CD1-CB 4.39Å; L829-I879 HydrophobicContact CD1-CG1 4.4Å; L829-I879 HydrophobicContact CD1-CG2 4.01Å; L829-L882 HydrophobicContact CD2-CB 3.69Å; L829-L882 HydrophobicContact CD2-CD1 4.43Å; L829-G883 WeakPolarHBondContact CD2-O 3.39Å; L829-F884 HydrophobicContact CB-CD2 3.62Å; L829-F884 HydrophobicContact CB-CE2 3.87Å; L829-F884 HydrophobicContact CB-CG 4.18Å; L829-F884 HydrophobicContact CD2-CB 4.24Å; L829-F884 HydrophobicContact CD2-CD2 4.04Å; L829-F884 HydrophobicContact CD2-CG 4.49Å; L829-F884 HydrophobicContact CG-CB 4.3Å; L829-F884 HydrophobicContact CG-CD2 4.08Å; L829-F884 HydrophobicContact CG-CG 4.34Å; L829-L1068 HydrophobicContact CD1-CD2 3.81Å; L829-H1113 HydrophobicContact CB-CB 3.87Å; L829-H1113 HydrophobicContact CD2-CB 4.19Å
830	G	97.8	Very high	93.4	Very high	6 Å²	6	22.8 Å²	22.8	6%	0.062	12%	0.118	C	C	.	.	H	α-helix	trans	-60.3	-35.1	173.3	0	0	0	0	0	114.1	P828 E834 F884	P828-G830 PolarHBondContact O-N 2.77Å; P828-G830 VanDerWaalsContact O-N 3.14Å; G830-E834 PolarHBondContact O-N 3.48Å; G830-F884 VanDerWaalsContact CA-CD1 3.44Å; G830-F884 VanDerWaalsContact N-CD1 3.31Å
831	I	97.8	Very high	91.9	Very high	7 Å²	7	28.2 Å²	28.2	4%	0.036	14%	0.141	C	C	.	.	H	α-helix	trans	-70.7	-43.3	173.5	-58.5	-68.6	0	0	0	110.2	L827 P828 L829 K833 E834 S835 V864 P1047 R1050	L827-I831 HydrophobicContact CB-CB 4.43Å; L827-I831 HydrophobicContact CB-CG2 4.34Å; L827-I831 HydrophobicContact CD1-CG2 4.36Å; L827-I831 HydrophobicContact CD2-CG2 4.16Å; P828-I831 HydrophobicContact CB-CG1 4.43Å; P828-I831 WeakPolarHBondContact O-CA 3.19Å; P828-I831 WeakPolarHBondContact O-CB 3.26Å; P828-I831 PolarHBondContact O-N 2.84Å; L829-I831 VanDerWaalsContact C-N 3.3Å; L829-I831 PolarHBondContact O-N 2.95Å; I831-K833 VanDerWaalsContact C-N 3.3Å; I831-K833 PolarHBondContact O-N 2.86Å; I831-E834 PolarHBondContact O-N 2.99Å; I831-S835 PolarHBondContact O-N 3.49Å; I831-S835 PolarHBondContact O-OG 2.9Å; I831-V864 HydrophobicContact CD1-CG1 4.15Å; I831-V864 HydrophobicContact CG2-CB 4.08Å; I831-V864 HydrophobicContact CG2-CG1 3.89Å; I831-P1047 VanDerWaalsContact CD1-O 3.24Å; I831-P1047 WeakPolarHBondContact CD1-O 2.84Å; I831-R1050 HydrophobicContact CD1-CB 4.47Å; I831-R1050 HydrophobicContact CD1-CG 3.68Å
832	L	98	Very high	90.1	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-61.3	-38.4	176.8	-63.9	177.3	0	0	0	112	L827 P828 L829 S835 I836 F867 I879	L827-L832 HydrophobicContact CB-CD2 4.03Å; L827-L832 HydrophobicContact CB-CG 4.25Å; L827-L832 HydrophobicContact CD1-CD2 4.05Å; P828-L832 PolarHBondContact O-N 3.2Å; L829-L832 PolarHBondContact O-N 2.83Å; L832-S835 PolarHBondContact O-N 2.91Å; L832-I836 PolarHBondContact O-N 3.27Å; L832-I836 VanDerWaalsContact O-N 3.15Å; L832-F867 HydrophobicContact CD2-CE2 4.44Å; L832-F867 HydrophobicContact CD2-CZ 4.26Å; L832-I879 HydrophobicContact CB-CD1 4.21Å; L832-I879 HydrophobicContact CB-CG1 4.49Å; L832-I879 HydrophobicContact CB-CG2 4.07Å
833	K	97.5	Very high	88.2	Confident	44 Å²	44	32.5 Å²	32.5	19%	0.191	17%	0.17	C	C	.	.	H	α-helix	trans	-61.4	-42.2	173.9	-78	178	178.8	-66.7	0	112.6	L829 I831 I836 Q837 I879 Q880 L882 F884	L829-K833 HydrophobicContact CD1-CG 4.26Å; L829-K833 HydrophobicContact CG-CD 4.45Å; L829-K833 HydrophobicContact CG-CG 4.48Å; L829-K833 WeakPolarHBondContact O-CG 3.49Å; L829-K833 PolarHBondContact O-N 2.81Å; I831-K833 VanDerWaalsContact C-N 3.3Å; I831-K833 PolarHBondContact O-N 2.86Å; K833-I836 WeakPolarHBondContact O-CG1 3.27Å; K833-Q837 VanDerWaalsContact O-CG 3.29Å; K833-Q837 WeakPolarHBondContact O-CG 3Å; K833-Q837 PolarHBondContact O-N 3.17Å; K833-I879 WeakPolarHBondContact CE-O 3.46Å; K833-I879 HydrophobicContact CG-CG2 3.92Å; K833-I879 WeakPolarHBondContact CG-O 3.42Å; K833-I879 PolarHBondContact NZ-O 2.97Å; K833-Q880 PolarHBondContact NZ-O 2.82Å; K833-L882 WeakPolarHBondContact CE-O 3.48Å; K833-L882 PolarHBondContact NZ-O 3.37Å; K833-F884 HydrophobicContact CD-CB 4.4Å
834	E	95.2	Very high	85.7	Confident	33 Å²	33	39.5 Å²	39.5	15%	0.154	20%	0.204	C	C	.	.	H	α-helix	trans	-70.5	-39.3	176.2	-170.1	178.7	172.8	0	0	111.5	G830 I831 I836 Q837 Q838 V864 R1050	G830-E834 PolarHBondContact O-N 3.48Å; I831-E834 PolarHBondContact O-N 2.99Å; E834-I836 PolarHBondContact O-N 2.86Å; E834-Q837 WeakPolarHBondContact O-CB 3.44Å; E834-Q837 PolarHBondContact O-N 3.42Å; E834-Q837 VanDerWaalsContact O-N 3.15Å; E834-Q838 PolarHBondContact O-N 2.89Å; E834-V864 HydrophobicContact CB-CG1 4.07Å; E834-V864 HydrophobicContact CB-CG2 4.09Å; E834-V864 HydrophobicContact CG-CG1 3.98Å; E834-V864 HydrophobicContact CG-CG2 3.81Å; E834-V864 WeakPolarHBondContact OE2-CG1 3.33Å; E834-R1050 VanDerWaalsContact CD-NH2 3.34Å; E834-R1050 IonicContact OE1-CZ 2.88Å; E834-R1050 IonicContact OE1-NE 2.73Å; E834-R1050 IonicContact OE1-NH2 3.16Å; E834-R1050 PolarHBondContact OE1-NH2 3.26Å; E834-R1050 IonicContact OE2-CZ 2.95Å; E834-R1050 VanDerWaalsContact OE2-CZ 3.27Å; E834-R1050 IonicContact OE2-NE 2.87Å; E834-R1050 PolarHBondContact OE2-NE 3.1Å; E834-R1050 IonicContact OE2-NH2 2.9Å; E834-R1050 PolarHBondContact OE2-NH2 2.94Å
835	S	94.4	Very high	83.4	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-57.3	-46.6	176.3	-75.4	0	0	0	0	112.3	I831 L832 Q837 Q838 D839 P865	I831-S835 PolarHBondContact O-N 3.49Å; I831-S835 PolarHBondContact O-OG 2.9Å; L832-S835 PolarHBondContact O-N 2.91Å; S835-Q837 VanDerWaalsContact C-N 3.28Å; S835-Q837 PolarHBondContact O-N 2.93Å; S835-Q838 PolarHBondContact O-N 2.92Å; S835-D839 PolarHBondContact O-N 3.14Å; S835-P865 WeakPolarHBondContact CB-O 3.33Å; S835-P865 PolarHBondContact OG-O 2.88Å
836	I	92.9	Very high	81	Confident	8 Å²	8	52.3 Å²	52.3	4%	0.041	26%	0.264	C	S	.	.	H	α-helix	trans	-71.7	-20.5	179.5	63.5	163.1	0	0	0	113.3	L832 K833 E834 N840 I876 I879 Q880	L832-I836 PolarHBondContact O-N 3.27Å; L832-I836 VanDerWaalsContact O-N 3.15Å; K833-I836 WeakPolarHBondContact O-CG1 3.27Å; E834-I836 PolarHBondContact O-N 2.86Å; I836-N840 PolarHBondContact O-ND2 3.1Å; I836-I876 HydrophobicContact CB-CG2 4.31Å; I836-I876 HydrophobicContact CD1-CG2 3.89Å; I836-I876 HydrophobicContact CG2-CG1 3.98Å; I836-I876 HydrophobicContact CG2-CG2 4.39Å; I836-I879 HydrophobicContact CD1-CB 4.17Å; I836-I879 HydrophobicContact CD1-CG2 3.6Å; I836-I879 HydrophobicContact CG1-CG2 4.16Å; I836-I879 HydrophobicContact CG2-CD1 4.47Å; I836-Q880 HydrophobicContact CD1-CG 3.49Å; I836-Q880 VanDerWaalsContact CD1-CG 3.49Å
837	Q	87.5	Confident	78.3	Confident	116 Å²	116	56.4 Å²	56.4	54%	0.542	29%	0.293	S	S	.	.	H	α-helix	trans	-72.5	-44.1	173.7	-73.7	166.6	-7.3	0	0	110.5	K833 E834 S835 D839 N840 E841	K833-Q837 VanDerWaalsContact O-CG 3.29Å; K833-Q837 WeakPolarHBondContact O-CG 3Å; K833-Q837 PolarHBondContact O-N 3.17Å; E834-Q837 WeakPolarHBondContact O-CB 3.44Å; E834-Q837 PolarHBondContact O-N 3.42Å; E834-Q837 VanDerWaalsContact O-N 3.15Å; S835-Q837 VanDerWaalsContact C-N 3.28Å; S835-Q837 PolarHBondContact O-N 2.93Å; Q837-D839 PolarHBondContact O-N 3.26Å; Q837-N840 WeakPolarHBondContact O-CB 3.2Å; Q837-N840 PolarHBondContact O-N 2.68Å; Q837-N840 VanDerWaalsContact O-N 3.14Å; Q837-E841 PolarHBondContact O-N 3.14Å; Q837-E841 VanDerWaalsContact O-N 3.07Å
838	Q	79.4	Confident	75.4	Confident	46 Å²	46	64 Å²	64	22%	0.215	33%	0.327	C	S	.	.	H	α-helix	trans	-64.4	-35.8	-180	-67.7	-178.1	6.1	0	0	113.2	E834 S835 T842	E834-Q838 PolarHBondContact O-N 2.89Å; S835-Q838 PolarHBondContact O-N 2.92Å; Q838-T842 WeakPolarHBondContact O-CB 3.33Å; Q838-T842 PolarHBondContact O-N 2.9Å; Q838-T842 PolarHBondContact O-OG1 3.28Å
839	D	73.9	Confident	72.5	Confident	18 Å²	18	68.5 Å²	68.5	10%	0.096	35%	0.35	C	S	.	.	H	α-helix	trans	-68	-33.1	174.4	-86.9	-36.6	0	0	0	112.5	S835 Q837 T843 R866	S835-D839 PolarHBondContact O-N 3.14Å; Q837-D839 PolarHBondContact O-N 3.26Å; D839-T843 WeakPolarHBondContact O-CB 3.37Å; D839-T843 PolarHBondContact O-N 2.98Å; D839-T843 PolarHBondContact O-OG1 3.04Å; D839-R866 IonicContact OD1-CZ 3.81Å; D839-R866 IonicContact OD1-NE 3.16Å; D839-R866 PolarHBondContact OD1-NE 2.81Å; D839-R866 IonicContact OD1-NH2 2.79Å; D839-R866 PolarHBondContact OD1-NH2 2.98Å
840	N	67.8	Low	69.4	Low	83 Å²	83	75.4 Å²	75.4	44%	0.444	39%	0.392	S	S	.	.	H	α-helix	trans	-69.2	-45.2	174.9	-74.2	-39.7	0	0	0	112	I836 Q837 T842 T843 M844	I836-N840 PolarHBondContact O-ND2 3.1Å; Q837-N840 WeakPolarHBondContact O-CB 3.2Å; Q837-N840 PolarHBondContact O-N 2.68Å; Q837-N840 VanDerWaalsContact O-N 3.14Å; N840-T842 VanDerWaalsContact C-N 3.34Å; N840-T842 PolarHBondContact O-N 3.2Å; N840-T843 PolarHBondContact O-N 3.43Å; N840-M844 PolarHBondContact O-N 2.91Å
841	E	65.4	Low	66.7	Low	126 Å²	126	80 Å²	80	59%	0.589	42%	0.419	S	S	*	.	H	α-helix	trans	-60.8	-43.4	174.8	-68.7	179.7	167.8	0	0	111.6	Q837 T843 M844 H845	Q837-E841 PolarHBondContact O-N 3.14Å; Q837-E841 VanDerWaalsContact O-N 3.07Å; E841-T843 VanDerWaalsContact C-N 3.32Å; E841-T843 PolarHBondContact O-N 2.87Å; E841-M844 PolarHBondContact O-N 3.45Å; E841-H845 PolarHBondContact O-CD2 2.89Å; E841-H845 PolarHBondContact O-N 2.95Å; E841-H845 VanDerWaalsContact O-N 3.15Å
842	T	59	Low	63.8	Low	49 Å²	49	88.1 Å²	88.1	30%	0.301	46%	0.462	S	S	.	.	H	α-helix	trans	-61.1	-41.7	176.5	-58.5	0	0	0	0	111.5	Q838 N840 M844 H845 Q846	Q838-T842 WeakPolarHBondContact O-CB 3.33Å; Q838-T842 PolarHBondContact O-N 2.9Å; Q838-T842 PolarHBondContact O-OG1 3.28Å; N840-T842 VanDerWaalsContact C-N 3.34Å; N840-T842 PolarHBondContact O-N 3.2Å; T842-M844 VanDerWaalsContact C-N 3.3Å; T842-M844 PolarHBondContact O-N 3.29Å; T842-H845 PolarHBondContact O-N 2.81Å; T842-Q846 HydrophobicContact CG2-CG 4.17Å; T842-Q846 WeakPolarHBondContact O-CG 3.22Å; T842-Q846 PolarHBondContact O-N 3.08Å
843	T	56	Low	61	Low	93 Å²	93	94.6 Å²	94.6	57%	0.571	49%	0.493	S	S	*	.	H	α-helix	trans	-64	-34.2	179.3	-58.6	0	0	0	0	112.2	D839 N840 E841	D839-T843 WeakPolarHBondContact O-CB 3.37Å; D839-T843 PolarHBondContact O-N 2.98Å; D839-T843 PolarHBondContact O-OG1 3.04Å; N840-T843 PolarHBondContact O-N 3.43Å; E841-T843 VanDerWaalsContact C-N 3.32Å; E841-T843 PolarHBondContact O-N 2.87Å
844	M	45.6	Very low	58.5	Low	147 Å²	147	95.4 Å²	95.4	72%	0.724	50%	0.504	S	S	*	.	H	α-helix	trans	-67.8	-48.3	173.1	-72.1	-72.4	171.6	0	0	112	N840 E841 T842 S847	N840-M844 PolarHBondContact O-N 2.91Å; E841-M844 PolarHBondContact O-N 3.45Å; T842-M844 VanDerWaalsContact C-N 3.3Å; T842-M844 PolarHBondContact O-N 3.29Å; M844-S847 PolarHBondContact O-OG 2.76Å
845	H	50.4	Low	56.7	Low	132 Å²	132	98.2 Å²	98.2	61%	0.611	53%	0.527	S	S	*	.	H	α-helix	trans	-78.3	-21.9	-172.4	-75.5	-63.1	0	0	0	115.4	E841 T842 S847 Q848	E841-H845 PolarHBondContact O-CD2 2.89Å; E841-H845 PolarHBondContact O-N 2.95Å; E841-H845 VanDerWaalsContact O-N 3.15Å; T842-H845 PolarHBondContact O-N 2.81Å; H845-S847 PolarHBondContact O-N 3.3Å; H845-Q848 PolarHBondContact O-N 2.9Å
846	Q	48	Very low	55	Low	138 Å²	138	101.9 Å²	101.9	65%	0.645	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-10.1	174.7	-79.4	-173.7	-2	0	0	114.1	T842 Q848	T842-Q846 HydrophobicContact CG2-CG 4.17Å; T842-Q846 WeakPolarHBondContact O-CG 3.22Å; T842-Q846 PolarHBondContact O-N 3.08Å; Q846-Q848 VanDerWaalsContact C-N 3.31Å; Q846-Q848 PolarHBondContact O-N 2.76Å
847	S	43	Very low	53.4	Low	96 Å²	96	105.1 Å²	105.1	67%	0.671	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-13.4	174.4	63.3	0	0	0	0	115.3	M844 H845	M844-S847 PolarHBondContact O-OG 2.76Å; H845-S847 PolarHBondContact O-N 3.3Å
848	Q	36.8	Very low	52.8	Low	177 Å²	177	103.3 Å²	103.3	83%	0.827	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.6	-5.4	-171.9	-68.2	-166.5	-5.1	0	0	117.9	H845 Q846	H845-Q848 PolarHBondContact O-N 2.9Å; Q846-Q848 VanDerWaalsContact C-N 3.31Å; Q846-Q848 PolarHBondContact O-N 2.76Å
849	I	37.4	Very low	53	Low	115 Å²	115	102.2 Å²	102.2	59%	0.59	56%	0.561	S	S	*	*			trans	-106.5	113.7	-173.6	-58.5	-179	0	0	0	112.1	T851	I849-T851 WeakPolarHBondContact CG2-OG1 3.36Å
850	T	33	Very low	53.5	Low	145 Å²	145	102.1 Å²	102.1	89%	0.89	56%	0.561	S	S	*	*			trans	-119.4	65.2	175.2	40.4	0	0	0	0	111.5
851	T	42	Very low	54.4	Low	102 Å²	102	104.6 Å²	104.6	63%	0.626	57%	0.568	S	S	*	*			trans	-134.5	128.5	177.6	48.2	0	0	0	0	111.7	I849 E853	I849-T851 WeakPolarHBondContact CG2-OG1 3.36Å; T851-E853 VanDerWaalsContact C-N 3.29Å; T851-E853 PolarHBondContact O-N 2.74Å
852	N	36.2	Very low	55.4	Low	177 Å²	177	100.1 Å²	100.1	95%	0.947	55%	0.548	S	S	*	.			trans	-74.5	72.5	178.1	-69.3	-19.7	0	0	0	111.9
853	E	39.6	Very low	56.8	Low	139 Å²	139	101.3 Å²	101.3	65%	0.65	56%	0.555	S	S	*	*			trans	-69.9	139.6	153.2	-69.5	-149.9	163.2	0	0	109.1	T851 S855	T851-E853 VanDerWaalsContact C-N 3.29Å; T851-E853 PolarHBondContact O-N 2.74Å; E853-S855 PolarHBondContact O-N 3.39Å
854	S	45.9	Very low	58.6	Low	61 Å²	61	97 Å²	97	43%	0.427	53%	0.529	S	S	.	.			trans	-61.6	118.2	176.1	53.6	0	0	0	0	110.1	T856 N857	S854-T856 PolarHBondContact O-N 3.15Å; S854-N857 WeakPolarHBondContact O-CB 3.45Å; S854-N857 PolarHBondContact O-N 3.44Å; S854-N857 PolarHBondContact OG-ND2 2.84Å
855	S	57.4	Low	61	Low	91 Å²	91	90.2 Å²	90.2	64%	0.636	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-34.1	-172.3	49.6	0	0	0	0	114.6	E853 N857 C858 L859	E853-S855 PolarHBondContact O-N 3.39Å; S855-N857 PolarHBondContact O-N 2.87Å; S855-C858 VanDerWaalsContact O-CB 3.31Å; S855-C858 WeakPolarHBondContact O-CB 3.48Å; S855-C858 PolarHBondContact O-N 2.87Å; S855-L859 PolarHBondContact O-N 2.92Å
856	T	58.2	Low	63.1	Low	80 Å²	80	87.1 Å²	87.1	49%	0.491	48%	0.479	S	S	.	.	H	α-helix	trans	-57.2	-44.2	174.8	49.5	0	0	0	0	113.1	S854 C858 L859 T860	S854-T856 PolarHBondContact O-N 3.15Å; T856-C858 PolarHBondContact O-N 3.03Å; T856-L859 PolarHBondContact O-N 2.8Å; T856-L859 VanDerWaalsContact O-N 3.1Å; T856-T860 PolarHBondContact O-N 3.06Å; T856-T860 VanDerWaalsContact O-N 3.15Å
857	N	58.2	Low	65.4	Low	77 Å²	77	80.8 Å²	80.8	41%	0.412	45%	0.449	S	S	.	.	H	α-helix	trans	-69.6	-6.5	176.7	-80.6	-42.4	0	0	0	113.8	S854 S855 K861	S854-N857 WeakPolarHBondContact O-CB 3.45Å; S854-N857 PolarHBondContact O-N 3.44Å; S854-N857 PolarHBondContact OG-ND2 2.84Å; S855-N857 PolarHBondContact O-N 2.87Å; N857-K861 WeakPolarHBondContact O-CD 3.43Å; N857-K861 WeakPolarHBondContact O-CE 3.5Å; N857-K861 PolarHBondContact O-NZ 2.92Å
858	C	75.9	Confident	67.8	Low	78 Å²	78	78.7 Å²	78.7	53%	0.527	43%	0.429	S	S	.	.	H	α-helix	trans	-88.8	-42.2	167.7	-167.1	0	0	0	0	110.9	S855 T856	S855-C858 VanDerWaalsContact O-CB 3.31Å; S855-C858 WeakPolarHBondContact O-CB 3.48Å; S855-C858 PolarHBondContact O-N 2.87Å; T856-C858 PolarHBondContact O-N 3.03Å
859	L	82.6	Confident	70.5	Confident	22 Å²	22	72.6 Å²	72.6	12%	0.115	40%	0.404	C	S	.	.	H	α-helix	trans	-69.8	-40.4	-176.1	-66.7	176.6	0	0	0	113.2	K792 R793 L815 S855 T856 K861 L862	K792-L859 WeakPolarHBondContact CD-O 3.38Å; R793-L859 HydrophobicContact CB-CD2 4.34Å; L815-L859 HydrophobicContact CD1-CB 3.8Å; L815-L859 HydrophobicContact CD1-CD1 4.13Å; S855-L859 PolarHBondContact O-N 2.92Å; T856-L859 PolarHBondContact O-N 2.8Å; T856-L859 VanDerWaalsContact O-N 3.1Å; L859-K861 PolarHBondContact O-N 3.15Å; L859-L862 HydrophobicContact CD2-CD1 3.86Å; L859-L862 WeakPolarHBondContact O-CB 3.35Å; L859-L862 PolarHBondContact O-N 2.82Å; L859-L862 VanDerWaalsContact O-N 3.16Å
860	T	85.2	Confident	73.2	Confident	16 Å²	16	72.7 Å²	72.7	10%	0.098	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-32.3	-179.9	54.4	0	0	0	0	112.8	K792 D813 L815 T856 L862	K792-T860 WeakPolarHBondContact CE-O 3.35Å; K792-T860 PolarHBondContact NZ-O 2.74Å; D813-T860 WeakPolarHBondContact O-CG2 3.39Å; L815-T860 HydrophobicContact CD1-CG2 4.42Å; L815-T860 HydrophobicContact CD2-CG2 4.08Å; L815-T860 HydrophobicContact CG-CG2 4.04Å; T856-T860 PolarHBondContact O-N 3.06Å; T856-T860 VanDerWaalsContact O-N 3.15Å; T860-L862 VanDerWaalsContact C-N 3.34Å; T860-L862 PolarHBondContact O-N 3.27Å
861	K	86.2	Confident	76.2	Confident	135 Å²	135	66 Å²	66	59%	0.587	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-16.4	180	-62.5	173.5	-173.6	148.4	0	114.2	N857 L859 V863	N857-K861 WeakPolarHBondContact O-CD 3.43Å; N857-K861 WeakPolarHBondContact O-CE 3.5Å; N857-K861 PolarHBondContact O-NZ 2.92Å; L859-K861 PolarHBondContact O-N 3.15Å; K861-V863 PolarHBondContact O-N 3.27Å
862	L	87.1	Confident	78.8	Confident	33 Å²	33	62.7 Å²	62.7	17%	0.173	34%	0.337	C	S	.	.			trans	-61.6	131	-178.1	-65.7	175.7	0	0	0	111.2	K792 L859 T860 R866	K792-L862 HydrophobicContact CD-CB 4.24Å; K792-L862 WeakPolarHBondContact CD-O 3.35Å; K792-L862 PolarHBondContact NZ-O 3.46Å; K792-L862 VanDerWaalsContact O-CD1 3.3Å; K792-L862 WeakPolarHBondContact O-CD1 3.02Å; L859-L862 HydrophobicContact CD2-CD1 3.86Å; L859-L862 WeakPolarHBondContact O-CB 3.35Å; L859-L862 PolarHBondContact O-N 2.82Å; L859-L862 VanDerWaalsContact O-N 3.16Å; T860-L862 VanDerWaalsContact C-N 3.34Å; T860-L862 PolarHBondContact O-N 3.27Å; L862-R866 HydrophobicContact CD1-CB 4.08Å
863	V	88.1	Confident	81.6	Confident	73 Å²	73	58.7 Å²	58.7	44%	0.442	32%	0.315	S	S	.	.	S	Bend	trans	-83.3	-33.5	-179.9	-178.2	0	0	0	0	111.2	K861	K861-V863 PolarHBondContact O-N 3.27Å
864	V	93.5	Very high	84.3	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.012	31%	0.305	C	S	.	.	S	Bend	trans	-128.7	157.6	179.4	-64	0	0	0	0	109.3	I831 E834	I831-V864 HydrophobicContact CD1-CG1 4.15Å; I831-V864 HydrophobicContact CG2-CB 4.08Å; I831-V864 HydrophobicContact CG2-CG1 3.89Å; E834-V864 HydrophobicContact CB-CG1 4.07Å; E834-V864 HydrophobicContact CB-CG2 4.09Å; E834-V864 HydrophobicContact CG-CG1 3.98Å; E834-V864 HydrophobicContact CG-CG2 3.81Å; E834-V864 WeakPolarHBondContact OE2-CG1 3.33Å
865	P	95.2	Very high	86.7	Confident	6 Å²	6	54.7 Å²	54.7	4%	0.039	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-76.2	138.8	-172.3	27.9	-32.8	0	0	0	112.5	V791 K792 I794 L827 S835	V791-P865 HydrophobicContact CB-CB 4.26Å; V791-P865 HydrophobicContact CG1-CB 3.89Å; K792-P865 WeakPolarHBondContact O-CA 3.23Å; I794-P865 HydrophobicContact CD1-CB 4.04Å; I794-P865 HydrophobicContact CD1-CG 4.29Å; I794-P865 HydrophobicContact CG1-CB 4.31Å; L827-P865 HydrophobicContact CD1-CG 3.42Å; L827-P865 VanDerWaalsContact CD1-CG 3.42Å; L827-P865 HydrophobicContact CD2-CG 4.43Å; S835-P865 WeakPolarHBondContact CB-O 3.33Å; S835-P865 PolarHBondContact OG-O 2.88Å
866	R	95	Very high	88.6	Confident	67 Å²	67	51.2 Å²	51.2	25%	0.253	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	145.7	170.8	-169.1	178.4	-167.3	-146.7	7.2	111.6	K792 R793 I794 D839 L862 E868	K792-R866 PolarHBondContact O-N 3.33Å; R793-R866 CarbonylContact C-O 3.6Å; R793-R866 WeakPolarHBondContact CA-O 3.37Å; I794-R866 PolarHBondContact N-O 2.74Å; D839-R866 IonicContact OD1-CZ 3.81Å; D839-R866 IonicContact OD1-NE 3.16Å; D839-R866 PolarHBondContact OD1-NE 2.81Å; D839-R866 IonicContact OD1-NH2 2.79Å; D839-R866 PolarHBondContact OD1-NH2 2.98Å; L862-R866 HydrophobicContact CD1-CB 4.08Å; R866-E868 IonicContact CZ-OE1 3.54Å; R866-E868 IonicContact NE-OE1 3.74Å; R866-E868 IonicContact NH1-OE1 2.88Å; R866-E868 PolarHBondContact NH1-OE1 3.45Å
867	F	95.8	Very high	90.5	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.018	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.7	173.7	-66.8	-95.8	0	0	0	110.7	I794 L832 P869 R870 L871 I1107	I794-F867 HydrophobicContact CB-CD1 4.1Å; I794-F867 HydrophobicContact CB-CE1 4.34Å; I794-F867 HydrophobicContact CD1-CD1 4.11Å; I794-F867 HydrophobicContact CD1-CE1 3.53Å; I794-F867 HydrophobicContact CD1-CE2 4.4Å; I794-F867 HydrophobicContact CD1-CZ 3.7Å; I794-F867 HydrophobicContact CG2-CD1 4.25Å; I794-F867 HydrophobicContact CG2-CE1 4.37Å; L832-F867 HydrophobicContact CD2-CE2 4.44Å; L832-F867 HydrophobicContact CD2-CZ 4.26Å; F867-P869 CarbonylContact C-O 3.57Å; F867-P869 CarbonylContact O-C 3.57Å; F867-P869 VanDerWaalsContact O-C 3.25Å; F867-R870 PolarHBondContact O-N 3.33Å; F867-L871 HydrophobicContact CB-CD2 4.45Å; F867-L871 HydrophobicContact CB-CG 4.19Å; F867-L871 HydrophobicContact CD1-CD1 4.44Å; F867-L871 HydrophobicContact CD1-CD2 3.65Å; F867-L871 HydrophobicContact CD1-CG 4Å; F867-L871 HydrophobicContact CD2-CD1 4Å; F867-L871 HydrophobicContact CD2-CG 3.99Å; F867-L871 HydrophobicContact CE1-CD1 4.35Å; F867-L871 HydrophobicContact CE1-CD2 3.94Å; F867-L871 HydrophobicContact CE1-CG 4.37Å; F867-L871 HydrophobicContact CE2-CD1 3.93Å; F867-L871 HydrophobicContact CE2-CG 4.37Å; F867-L871 HydrophobicContact CG-CD1 4.26Å; F867-L871 HydrophobicContact CG-CD2 3.97Å; F867-L871 HydrophobicContact CG-CG 3.79Å; F867-L871 HydrophobicContact CZ-CD1 4.1Å; F867-I1107 HydrophobicContact CD1-CD1 3.96Å; F867-I1107 HydrophobicContact CE1-CD1 4.13Å
868	E	94	Very high	92.4	Very high	53 Å²	53	45.9 Å²	45.9	25%	0.248	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	107.6	177.3	-71.1	-174.7	-172.2	0	0	110.8	R793 I794 S795 Y796 R866	R793-E868 WeakPolarHBondContact CD-OE1 3.28Å; R793-E868 WeakPolarHBondContact CD-OE2 3.37Å; R793-E868 HydrophobicContact CG-CG 4.33Å; R793-E868 IonicContact CZ-OE2 3.89Å; R793-E868 IonicContact NE-OE2 2.72Å; R793-E868 IonicContact NH1-OE2 3.79Å; R793-E868 PolarHBondContact NH1-OE2 3.16Å; I794-E868 PolarHBondContact O-N 3.21Å; S795-E868 CarbonylContact C-O 3.59Å; S795-E868 VanDerWaalsContact CA-O 3.25Å; S795-E868 WeakPolarHBondContact CA-O 3.22Å; Y796-E868 PolarHBondContact N-O 3.43Å; R866-E868 IonicContact CZ-OE1 3.54Å; R866-E868 IonicContact NE-OE1 3.74Å; R866-E868 IonicContact NH1-OE1 2.88Å; R866-E868 PolarHBondContact NH1-OE1 3.45Å
869	P	94.5	Very high	93.4	Very high	48 Å²	48	42.1 Å²	42.1	31%	0.312	21%	0.206	S	C	.	.	S	Bend	cis	-66.5	167.3	-3.2	30.3	-35.7	0	0	0	113.1	Y796 F867 P1075	Y796-P869 HydrophobicContact CE1-CG 4.15Å; Y796-P869 WeakPolarHBondContact CE1-O 3.46Å; Y796-P869 HydrophobicContact CE2-CG 4.06Å; Y796-P869 WeakPolarHBondContact O-CD 3.25Å; Y796-P869 PolarHBondContact OH-O 2.97Å; F867-P869 CarbonylContact C-O 3.57Å; F867-P869 CarbonylContact O-C 3.57Å; F867-P869 VanDerWaalsContact O-C 3.25Å; P869-P1075 HydrophobicContact CG-CG 4.27Å
870	R	94.3	Very high	94.1	Very high	117 Å²	117	46 Å²	46	44%	0.442	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-58.6	153.8	176.6	72.2	176.2	-171	87.3	-10.4	111.7	Y796 F867 D873	Y796-R870 PolarHBondContact OH-O 3.18Å; F867-R870 PolarHBondContact O-N 3.33Å; R870-D873 IonicContact CZ-OD1 3.77Å; R870-D873 VanDerWaalsContact CZ-OD1 3.24Å; R870-D873 IonicContact CZ-OD2 2.82Å; R870-D873 IonicContact NH1-OD1 3.27Å; R870-D873 PolarHBondContact NH1-OD1 3.39Å; R870-D873 IonicContact NH1-OD2 3.99Å; R870-D873 VanDerWaalsContact NH2-CG 3.27Å; R870-D873 IonicContact NH2-OD1 2.74Å; R870-D873 PolarHBondContact NH2-OD1 2.88Å; R870-D873 IonicContact NH2-OD2 3.75Å; R870-D873 PolarHBondContact NH2-OD2 3.24Å
871	L	95.6	Very high	94.7	Very high	4 Å²	4	50 Å²	50	2%	0.021	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-60.3	149.2	174	-65.4	178.1	0	0	0	111.8	F867 K875 I876 I879 V1072 F1109	F867-L871 HydrophobicContact CB-CD2 4.45Å; F867-L871 HydrophobicContact CB-CG 4.19Å; F867-L871 HydrophobicContact CD1-CD1 4.44Å; F867-L871 HydrophobicContact CD1-CD2 3.65Å; F867-L871 HydrophobicContact CD1-CG 4Å; F867-L871 HydrophobicContact CD2-CD1 4Å; F867-L871 HydrophobicContact CD2-CG 3.99Å; F867-L871 HydrophobicContact CE1-CD1 4.35Å; F867-L871 HydrophobicContact CE1-CD2 3.94Å; F867-L871 HydrophobicContact CE1-CG 4.37Å; F867-L871 HydrophobicContact CE2-CD1 3.93Å; F867-L871 HydrophobicContact CE2-CG 4.37Å; F867-L871 HydrophobicContact CG-CD1 4.26Å; F867-L871 HydrophobicContact CG-CD2 3.97Å; F867-L871 HydrophobicContact CG-CG 3.79Å; F867-L871 HydrophobicContact CZ-CD1 4.1Å; L871-K875 HydrophobicContact CD1-CG 4.29Å; L871-I876 HydrophobicContact CB-CG1 4.13Å; L871-I876 VanDerWaalsContact O-CD1 3.3Å; L871-I876 WeakPolarHBondContact O-CD1 3.33Å; L871-I879 HydrophobicContact CD1-CD1 4.19Å; L871-V1072 HydrophobicContact CD2-CG2 4.42Å; L871-F1109 HydrophobicContact CD2-CZ 4.08Å
872	P	95.3	Very high	95.3	Very high	34 Å²	34	43.6 Å²	43.6	22%	0.221	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-61.6	149.6	177	-23.9	34.6	0	0	0	113.3	W874 K875 I876 V1072	P872-W874 VanDerWaalsContact C-N 3.28Å; P872-W874 HydrophobicContact CB-CD2 4.19Å; P872-W874 HydrophobicContact CB-CG 4.18Å; P872-W874 HydrophobicContact CB-CZ2 4.26Å; P872-W874 VanDerWaalsContact CB-NE1 3.3Å; P872-W874 HydrophobicContact CG-CZ2 4.11Å; P872-W874 PolarHBondContact O-N 3.29Å; P872-K875 WeakPolarHBondContact O-CB 3.49Å; P872-K875 PolarHBondContact O-N 3.33Å; P872-I876 PolarHBondContact O-N 2.97Å; P872-V1072 HydrophobicContact CG-CG1 4.17Å; P872-V1072 HydrophobicContact CG-CG2 4.29Å
873	D	95.9	Very high	95.8	Very high	92 Å²	92	42.2 Å²	42.2	49%	0.492	20%	0.202	S	C	.	.	H	α-helix	trans	-59	-36.1	-175.8	-64.2	-54	0	0	0	113.4	R870 K875 I876 S877	R870-D873 IonicContact CZ-OD1 3.77Å; R870-D873 VanDerWaalsContact CZ-OD1 3.24Å; R870-D873 IonicContact CZ-OD2 2.82Å; R870-D873 IonicContact NH1-OD1 3.27Å; R870-D873 PolarHBondContact NH1-OD1 3.39Å; R870-D873 IonicContact NH1-OD2 3.99Å; R870-D873 VanDerWaalsContact NH2-CG 3.27Å; R870-D873 IonicContact NH2-OD1 2.74Å; R870-D873 PolarHBondContact NH2-OD1 2.88Å; R870-D873 IonicContact NH2-OD2 3.75Å; R870-D873 PolarHBondContact NH2-OD2 3.24Å; D873-K875 VanDerWaalsContact C-N 3.3Å; D873-K875 PolarHBondContact O-N 2.92Å; D873-I876 PolarHBondContact O-N 3.46Å; D873-S877 PolarHBondContact O-N 3.35Å; D873-S877 PolarHBondContact O-OG 2.87Å
874	W	96.5	Very high	96.3	Very high	116 Å²	116	40 Å²	40	44%	0.439	19%	0.187	S	C	.	.	H	α-helix	trans	-60.2	-37.8	174.4	57.2	-104	0	0	0	113.1	P872 A878 I1067 E1070 V1072	P872-W874 VanDerWaalsContact C-N 3.28Å; P872-W874 HydrophobicContact CB-CD2 4.19Å; P872-W874 HydrophobicContact CB-CG 4.18Å; P872-W874 HydrophobicContact CB-CZ2 4.26Å; P872-W874 VanDerWaalsContact CB-NE1 3.3Å; P872-W874 HydrophobicContact CG-CZ2 4.11Å; P872-W874 PolarHBondContact O-N 3.29Å; W874-A878 PolarHBondContact O-N 2.86Å; W874-I1067 HydrophobicContact CE3-CG2 3.75Å; W874-I1067 HydrophobicContact CZ3-CG2 4.23Å; W874-I1067 WeakPolarHBondContact CZ3-O 3.46Å; W874-E1070 HydrophobicContact CH2-CB 3.92Å; W874-E1070 HydrophobicContact CZ3-CB 3.96Å; W874-V1072 HydrophobicContact CH2-CG2 4.18Å; W874-V1072 HydrophobicContact CZ2-CG2 4.39Å
875	K	97.2	Very high	96.4	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-71.9	-43.6	176.8	-177	71.3	77.6	-175.2	0	110.1	L871 P872 D873 A878 I879 I1067 L1068 E1070	L871-K875 HydrophobicContact CD1-CG 4.29Å; P872-K875 WeakPolarHBondContact O-CB 3.49Å; P872-K875 PolarHBondContact O-N 3.33Å; D873-K875 VanDerWaalsContact C-N 3.3Å; D873-K875 PolarHBondContact O-N 2.92Å; K875-A878 PolarHBondContact O-N 2.64Å; K875-I879 HydrophobicContact CD-CD1 4.33Å; K875-I879 HydrophobicContact CG-CD1 3.85Å; K875-I879 WeakPolarHBondContact O-CD1 3.46Å; K875-I879 VanDerWaalsContact O-CG1 3.25Å; K875-I879 WeakPolarHBondContact O-CG1 3.43Å; K875-I879 PolarHBondContact O-N 2.99Å; K875-I1067 PolarHBondContact NZ-O 3.01Å; K875-L1068 PolarHBondContact NZ-O 3.21Å; K875-E1070 WeakPolarHBondContact CE-O 3.18Å; K875-E1070 PolarHBondContact NZ-O 3.36Å
876	I	97.3	Very high	96.5	Very high	19 Å²	19	40.3 Å²	40.3	10%	0.097	19%	0.189	C	C	.	.	H	α-helix	trans	-60.2	-46.3	177.2	-65	-179.9	0	0	0	110.8	I836 L871 P872 D873 A878 I879 Q880	I836-I876 HydrophobicContact CB-CG2 4.31Å; I836-I876 HydrophobicContact CD1-CG2 3.89Å; I836-I876 HydrophobicContact CG2-CG1 3.98Å; I836-I876 HydrophobicContact CG2-CG2 4.39Å; L871-I876 HydrophobicContact CB-CG1 4.13Å; L871-I876 VanDerWaalsContact O-CD1 3.3Å; L871-I876 WeakPolarHBondContact O-CD1 3.33Å; P872-I876 PolarHBondContact O-N 2.97Å; D873-I876 PolarHBondContact O-N 3.46Å; I876-A878 PolarHBondContact O-N 3.26Å; I876-I879 PolarHBondContact O-N 3.11Å; I876-Q880 HydrophobicContact CG2-CG 4.47Å; I876-Q880 WeakPolarHBondContact O-CG 3.21Å; I876-Q880 PolarHBondContact O-N 2.82Å
877	S	96.9	Very high	96.6	Very high	44 Å²	44	37.6 Å²	37.6	31%	0.308	18%	0.18	S	C	.	.	H	α-helix	trans	-61.3	-41	-179.7	-60.1	0	0	0	0	113.1	D873 Q880 R881	D873-S877 PolarHBondContact O-N 3.35Å; D873-S877 PolarHBondContact O-OG 2.87Å; S877-Q880 WeakPolarHBondContact O-CB 3.3Å; S877-Q880 PolarHBondContact O-N 2.73Å; S877-R881 PolarHBondContact O-N 3.31Å
878	A	97.8	Very high	96.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-72	-35.8	176.7	0	0	0	0	0	112.2	W874 K875 I876 Q880 R881 L882 D1064 I1067 L1068	W874-A878 PolarHBondContact O-N 2.86Å; K875-A878 PolarHBondContact O-N 2.64Å; I876-A878 PolarHBondContact O-N 3.26Å; A878-Q880 PolarHBondContact O-N 3.45Å; A878-R881 PolarHBondContact O-N 2.93Å; A878-L882 PolarHBondContact O-N 2.75Å; A878-L882 VanDerWaalsContact O-N 3.12Å; A878-D1064 HydrophobicContact CB-CB 4.2Å; A878-D1064 VanDerWaalsContact CB-OD1 3.27Å; A878-D1064 WeakPolarHBondContact CB-OD1 3.48Å; A878-I1067 HydrophobicContact CB-CB 4.02Å; A878-I1067 HydrophobicContact CB-CG2 3.58Å; A878-L1068 HydrophobicContact CB-CD1 3.26Å
879	I	98.1	Very high	96.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.3	-33.6	170.7	-70.2	165.2	0	0	0	110.7	L829 L832 K833 I836 L871 K875 I876 L1068	L829-I879 HydrophobicContact CD1-CB 4.39Å; L829-I879 HydrophobicContact CD1-CG1 4.4Å; L829-I879 HydrophobicContact CD1-CG2 4.01Å; L832-I879 HydrophobicContact CB-CD1 4.21Å; L832-I879 HydrophobicContact CB-CG1 4.49Å; L832-I879 HydrophobicContact CB-CG2 4.07Å; K833-I879 WeakPolarHBondContact CE-O 3.46Å; K833-I879 HydrophobicContact CG-CG2 3.92Å; K833-I879 WeakPolarHBondContact CG-O 3.42Å; K833-I879 PolarHBondContact NZ-O 2.97Å; I836-I879 HydrophobicContact CD1-CB 4.17Å; I836-I879 HydrophobicContact CD1-CG2 3.6Å; I836-I879 HydrophobicContact CG1-CG2 4.16Å; I836-I879 HydrophobicContact CG2-CD1 4.47Å; L871-I879 HydrophobicContact CD1-CD1 4.19Å; K875-I879 HydrophobicContact CD-CD1 4.33Å; K875-I879 HydrophobicContact CG-CD1 3.85Å; K875-I879 WeakPolarHBondContact O-CD1 3.46Å; K875-I879 VanDerWaalsContact O-CG1 3.25Å; K875-I879 WeakPolarHBondContact O-CG1 3.43Å; K875-I879 PolarHBondContact O-N 2.99Å; I876-I879 PolarHBondContact O-N 3.11Å; I879-L1068 HydrophobicContact CG1-CD1 4.11Å; I879-L1068 HydrophobicContact CG1-CD2 4.07Å; I879-L1068 HydrophobicContact CG1-CG 4.15Å
880	Q	97.5	Very high	96.9	Very high	102 Å²	102	33.3 Å²	33.3	48%	0.477	16%	0.155	S	C	.	.	H	α-helix	trans	-70.1	-51.1	174.2	-72.5	171.4	-21.7	0	0	111.6	K833 I836 I876 S877 A878	K833-Q880 PolarHBondContact NZ-O 2.82Å; I836-Q880 HydrophobicContact CD1-CG 3.49Å; I836-Q880 VanDerWaalsContact CD1-CG 3.49Å; I876-Q880 HydrophobicContact CG2-CG 4.47Å; I876-Q880 WeakPolarHBondContact O-CG 3.21Å; I876-Q880 PolarHBondContact O-N 2.82Å; S877-Q880 WeakPolarHBondContact O-CB 3.3Å; S877-Q880 PolarHBondContact O-N 2.73Å; A878-Q880 PolarHBondContact O-N 3.45Å
881	R	97.4	Very high	97	Very high	100 Å²	100	27.7 Å²	27.7	38%	0.377	13%	0.134	S	C	.	.	H	α-helix	trans	-60.2	-54	-176.6	-79.1	-170.7	-64.9	-96.2	2	114.1	S877 A878 A1057 G1059 A1060 D1064	S877-R881 PolarHBondContact O-N 3.31Å; A878-R881 PolarHBondContact O-N 2.93Å; R881-A1057 WeakPolarHBondContact O-CB 3.31Å; R881-G1059 VanDerWaalsContact CD-O 3.27Å; R881-G1059 WeakPolarHBondContact CD-O 3.33Å; R881-A1060 HydrophobicContact CB-CB 3.94Å; R881-D1064 IonicContact CZ-OD1 2.82Å; R881-D1064 VanDerWaalsContact NE-CG 3.33Å; R881-D1064 IonicContact NE-OD1 3.95Å; R881-D1064 PolarHBondContact NE-OD1 2.99Å; R881-D1064 IonicContact NE-OD2 2.86Å; R881-D1064 PolarHBondContact NE-OD2 3.45Å; R881-D1064 IonicContact NH2-OD1 3.85Å; R881-D1064 PolarHBondContact NH2-OD1 2.76Å
882	L	97.9	Very high	97.1	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	13%	0.133	C	C	.	.	S	Bend	trans	-57.6	140.7	-173.4	-79.1	170.1	0	0	0	112.5	L829 K833 A878 A1060 D1064 Y1065 L1068	L829-L882 HydrophobicContact CD2-CB 3.69Å; L829-L882 HydrophobicContact CD2-CD1 4.43Å; K833-L882 WeakPolarHBondContact CE-O 3.48Å; K833-L882 PolarHBondContact NZ-O 3.37Å; A878-L882 PolarHBondContact O-N 2.75Å; A878-L882 VanDerWaalsContact O-N 3.12Å; L882-A1060 HydrophobicContact CD2-CB 4.42Å; L882-D1064 HydrophobicContact CD1-CB 3.91Å; L882-D1064 HydrophobicContact CD2-CB 3.84Å; L882-D1064 HydrophobicContact CG-CB 3.61Å; L882-Y1065 HydrophobicContact CD1-CD1 3.73Å; L882-Y1065 HydrophobicContact CD1-CE1 3.92Å; L882-Y1065 HydrophobicContact CD1-CG 4.49Å; L882-Y1065 HydrophobicContact CD2-CD1 4.04Å; L882-Y1065 HydrophobicContact CD2-CE1 3.7Å; L882-Y1065 HydrophobicContact CD2-CE2 4.24Å; L882-Y1065 HydrophobicContact CD2-CG 4.44Å; L882-Y1065 HydrophobicContact CG-CE1 4.44Å; L882-L1068 HydrophobicContact CD1-CD1 4.08Å; L882-L1068 HydrophobicContact CD1-CD2 3.76Å; L882-L1068 HydrophobicContact CD1-CG 4.39Å
883	G	98	Very high	97	Very high	4 Å²	4	26.1 Å²	26.1	4%	0.041	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	152.6	173.3	0	0	0	0	0	112	L829 S1054 Y1055	L829-G883 WeakPolarHBondContact CD2-O 3.39Å; G883-S1054 VanDerWaalsContact O-CA 3.26Å; G883-S1054 WeakPolarHBondContact O-CA 3.25Å; G883-Y1055 VanDerWaalsContact CA-CZ 3.46Å; G883-Y1055 VanDerWaalsContact CA-O 3.24Å; G883-Y1055 WeakPolarHBondContact CA-O 3.44Å; G883-Y1055 PolarHBondContact N-O 2.99Å; G883-Y1055 PolarHBondContact O-N 3.16Å
884	F	98.1	Very high	97	Very high	28 Å²	28	21.7 Å²	21.7	12%	0.123	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	109.8	165	-158.2	-115.2	0	0	0	109.2	P828 L829 G830 K833 S1049 R1050 G1051 Y1053	P828-F884 HydrophobicContact CB-CZ 3.97Å; L829-F884 HydrophobicContact CB-CD2 3.62Å; L829-F884 HydrophobicContact CB-CE2 3.87Å; L829-F884 HydrophobicContact CB-CG 4.18Å; L829-F884 HydrophobicContact CD2-CB 4.24Å; L829-F884 HydrophobicContact CD2-CD2 4.04Å; L829-F884 HydrophobicContact CD2-CG 4.49Å; L829-F884 HydrophobicContact CG-CB 4.3Å; L829-F884 HydrophobicContact CG-CD2 4.08Å; L829-F884 HydrophobicContact CG-CG 4.34Å; G830-F884 VanDerWaalsContact CA-CD1 3.44Å; G830-F884 VanDerWaalsContact N-CD1 3.31Å; K833-F884 HydrophobicContact CD-CB 4.4Å; F884-S1049 VanDerWaalsContact CE1-O 3.31Å; F884-S1049 WeakPolarHBondContact CE1-O 3.4Å; F884-R1050 WeakPolarHBondContact CD1-O 3.24Å; F884-G1051 VanDerWaalsContact CE1-C 3.46Å; F884-Y1053 CarbonylContact C-O 3.55Å; F884-Y1053 WeakPolarHBondContact CD2-O 3.41Å; F884-Y1053 VanDerWaalsContact CE2-C 3.45Å
885	G	96.9	Very high	96.8	Very high	4 Å²	4	23.2 Å²	23.2	4%	0.041	11%	0.112	C	C	.	.			trans	-83.8	177.7	-166.1	0	0	0	0	0	114.7	A705 G1051 S1052 Y1053	A705-G885 CarbonylContact O-C 3.6Å; A705-G885 WeakPolarHBondContact O-CA 3.34Å; G885-G1051 CarbonylContact O-C 3.54Å; G885-G1051 VanDerWaalsContact O-CA 3.23Å; G885-G1051 WeakPolarHBondContact O-CA 3.49Å; G885-S1052 PolarHBondContact O-N 3.17Å; G885-Y1053 PolarHBondContact N-O 2.91Å
886	V	97.1	Very high	96.6	Very high	10 Å²	10	30 Å²	30	6%	0.061	14%	0.138	C	C	.	.			trans	-136.9	124.8	170.6	59.3	0	0	0	0	110.5	A705 N888 A940 E944 R1044	A705-V886 CarbonylContact O-C 3.15Å; A705-V886 PolarHBondContact O-N 2.83Å; V886-N888 WeakPolarHBondContact CG2-ND2 3.4Å; V886-A940 HydrophobicContact CG1-CB 4.07Å; V886-A940 HydrophobicContact CG2-CB 4.27Å; V886-A940 VanDerWaalsContact O-CB 3.26Å; V886-A940 WeakPolarHBondContact O-CB 3.44Å; V886-E944 VanDerWaalsContact CG2-OE1 3.29Å; V886-E944 WeakPolarHBondContact CG2-OE1 3.37Å; V886-R1044 HydrophobicContact CB-CB 4.24Å; V886-R1044 HydrophobicContact CG2-CB 3.9Å
887	L	96.7	Very high	96.4	Very high	10 Å²	10	30.8 Å²	30.8	5%	0.052	15%	0.145	C	C	.	.			trans	-138.2	125.1	175.4	160.6	62	0	0	0	106.9	F702 A705 A936 S1052 Y1053	F702-L887 HydrophobicContact CD2-CD1 3.52Å; F702-L887 HydrophobicContact CD2-CD2 3.66Å; F702-L887 HydrophobicContact CD2-CG 4.25Å; F702-L887 HydrophobicContact CE2-CD1 4.02Å; F702-L887 HydrophobicContact CE2-CD2 3.54Å; F702-L887 HydrophobicContact CE2-CG 4.41Å; F702-L887 HydrophobicContact CZ-CD2 4.37Å; A705-L887 HydrophobicContact CB-CB 3.58Å; L887-A936 HydrophobicContact CD1-CB 4.28Å; L887-S1052 PolarHBondContact N-OG 3.09Å; L887-S1052 PolarHBondContact O-OG 2.98Å; L887-Y1053 HydrophobicContact CD2-CE1 4.19Å
888	N	97.6	Very high	96.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	158.3	-176.7	-77.9	-54.3	0	0	0	113.1	V886 V935 L943 E944 T1041 R1042 W1043	V886-N888 WeakPolarHBondContact CG2-ND2 3.4Å; N888-V935 PolarHBondContact N-O 3.23Å; N888-V935 PolarHBondContact O-N 3.15Å; N888-L943 HydrophobicContact CB-CD2 4.11Å; N888-E944 PolarHBondContact ND2-OE1 2.93Å; N888-T1041 VanDerWaalsContact CA-OG1 3.29Å; N888-T1041 WeakPolarHBondContact CA-OG1 3.3Å; N888-T1041 WeakPolarHBondContact CB-OG1 3.42Å; N888-T1041 VanDerWaalsContact CG-O 3.26Å; N888-T1041 PolarHBondContact OD1-O 3.06Å; N888-T1041 PolarHBondContact OD1-OG1 3.37Å; N888-R1042 WeakPolarHBondContact OD1-CA 3.23Å; N888-R1042 PolarHBondContact OD1-N 3.33Å; N888-W1043 PolarHBondContact OD1-N 3.31Å
889	K	97.3	Very high	96	Very high	14 Å²	14	31 Å²	31	6%	0.061	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	137.4	-173.8	-60.7	-170.9	172.9	-176.8	0	111.1	G410 M412 I932 A933 L934 V1040 T1041	G410-K889 PolarHBondContact O-NZ 3.21Å; M412-K889 PolarHBondContact SD-NZ 3.18Å; K889-I932 HydrophobicContact CB-CG2 4.03Å; K889-I932 HydrophobicContact CD-CG2 4.07Å; K889-I932 HydrophobicContact CG-CG2 4.32Å; K889-A933 WeakPolarHBondContact CA-O 3.33Å; K889-L934 HydrophobicContact CD-CD2 4.39Å; K889-L934 HydrophobicContact CG-CD2 4Å; K889-V1040 WeakPolarHBondContact O-CA 2.91Å; K889-T1041 HydrophobicContact CB-CG2 4.2Å; K889-T1041 PolarHBondContact N-OG1 3.44Å; K889-T1041 PolarHBondContact O-N 3.17Å
890	V	96.4	Very high	95.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	96.6	173.6	-178.2	0	0	0	0	107.9	L892 L919 A933 V935 I984 I985 Y1039 V1040	V890-L892 HydrophobicContact CG1-CD2 3.97Å; V890-L892 HydrophobicContact CG1-CG 4.31Å; V890-L919 HydrophobicContact CB-CD2 4.41Å; V890-L919 HydrophobicContact CG2-CD2 4.17Å; V890-A933 HydrophobicContact CB-CB 4.27Å; V890-A933 PolarHBondContact N-O 3.35Å; V890-A933 PolarHBondContact O-N 3.01Å; V890-V935 HydrophobicContact CG2-CG2 4.18Å; V890-I984 HydrophobicContact CG2-CG1 3.71Å; V890-I984 HydrophobicContact CG2-CG2 4.26Å; V890-I985 HydrophobicContact CG1-CG1 4.21Å; V890-Y1039 CarbonylContact C-O 3.51Å; V890-Y1039 WeakPolarHBondContact CA-O 3.27Å; V890-V1040 HydrophobicContact CG1-CG2 4.31Å; V890-V1040 HydrophobicContact CG2-CG1 4.41Å; V890-V1040 HydrophobicContact CG2-CG2 4.32Å
891	V	96.2	Very high	94.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	127.5	176	-176.7	0	0	0	0	109.1	A407 L409 I893 V930 L931 I932 A1038 Y1039	A407-V891 HydrophobicContact CB-CB 4.44Å; A407-V891 HydrophobicContact CB-CG1 3.45Å; A407-V891 VanDerWaalsContact CB-CG1 3.45Å; A407-V891 HydrophobicContact CB-CG2 4.11Å; L409-V891 HydrophobicContact CD2-CG2 3.74Å; V891-I893 HydrophobicContact CG1-CG1 4.14Å; V891-V930 HydrophobicContact CG1-CG1 3.61Å; V891-L931 WeakPolarHBondContact CA-O 3.41Å; V891-I932 HydrophobicContact CG2-CG1 4.24Å; V891-I932 HydrophobicContact CG2-CG2 4.31Å; V891-A1038 CarbonylContact O-C 3.57Å; V891-A1038 WeakPolarHBondContact O-CA 3.2Å; V891-Y1039 HydrophobicContact CB-CD2 4.41Å; V891-Y1039 PolarHBondContact N-O 3.17Å; V891-Y1039 PolarHBondContact O-N 3.34Å
892	L	96.1	Very high	94.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	113.9	176.6	-56.3	176.1	0	0	0	108.9	V890 F894 V930 L931 I985 A988 M989 L992 P1035 A1038	V890-L892 HydrophobicContact CG1-CD2 3.97Å; V890-L892 HydrophobicContact CG1-CG 4.31Å; L892-F894 HydrophobicContact CB-CD2 4.43Å; L892-F894 HydrophobicContact CB-CE2 3.54Å; L892-F894 HydrophobicContact CB-CZ 3.8Å; L892-F894 HydrophobicContact CD1-CZ 4.24Å; L892-V930 WeakPolarHBondContact O-CA 3.21Å; L892-L931 PolarHBondContact N-O 3.18Å; L892-L931 PolarHBondContact O-N 3.24Å; L892-I985 HydrophobicContact CD2-CG1 4.46Å; L892-I985 HydrophobicContact CD2-CG2 3.98Å; L892-A988 HydrophobicContact CD1-CB 4.03Å; L892-M989 HydrophobicContact CD1-SD 4.36Å; L892-L992 HydrophobicContact CD1-CD1 3.62Å; L892-P1035 HydrophobicContact CB-CG 4.38Å; L892-P1035 HydrophobicContact CD2-CG 4.06Å; L892-A1038 HydrophobicContact CD2-CB 4.08Å
893	I	95.1	Very high	93.7	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.021	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	127.6	178.8	-52.6	-172.3	0	0	0	108.3	Y405 V891 V930 P1035 I1036 D1037 Y1039	Y405-I893 HydrophobicContact CD1-CG2 3.38Å; Y405-I893 HydrophobicContact CD2-CG2 4.22Å; Y405-I893 HydrophobicContact CE1-CG2 3.65Å; Y405-I893 HydrophobicContact CE2-CG2 4.46Å; Y405-I893 HydrophobicContact CG-CG2 3.69Å; V891-I893 HydrophobicContact CG1-CG1 4.14Å; I893-V930 HydrophobicContact CG1-CG1 4.43Å; I893-V930 HydrophobicContact CG1-CG2 4.21Å; I893-V930 HydrophobicContact CG2-CG2 4.23Å; I893-P1035 CarbonylContact O-C 3.58Å; I893-P1035 WeakPolarHBondContact O-CA 3.35Å; I893-P1035 VanDerWaalsContact O-CB 3.29Å; I893-P1035 WeakPolarHBondContact O-CB 3.25Å; I893-I1036 HydrophobicContact CB-CG1 4.26Å; I893-I1036 HydrophobicContact CG2-CD1 4Å; I893-I1036 HydrophobicContact CG2-CG1 3.83Å; I893-I1036 WeakPolarHBondContact O-CG1 3.16Å; I893-I1036 PolarHBondContact O-N 3.08Å; I893-D1037 HydrophobicContact CB-CB 4.19Å; I893-D1037 HydrophobicContact CD1-CB 4.24Å; I893-D1037 HydrophobicContact CG1-CB 4.43Å; I893-D1037 PolarHBondContact N-O 3.44Å; I893-D1037 PolarHBondContact O-N 3.1Å; I893-Y1039 HydrophobicContact CD1-CD2 4.45Å; I893-Y1039 HydrophobicContact CD1-CE2 3.92Å
894	F	95	Very high	93.4	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.187	C	C	.	.			trans	-115.2	170.5	180	-61.2	-85.4	0	0	0	111.8	Y405 L892 F898 W899 P929 L931 M989 L992 P1033 P1035	Y405-F894 PolarHBondContact OH-O 2.86Å; L892-F894 HydrophobicContact CB-CD2 4.43Å; L892-F894 HydrophobicContact CB-CE2 3.54Å; L892-F894 HydrophobicContact CB-CZ 3.8Å; L892-F894 HydrophobicContact CD1-CZ 4.24Å; F894-F898 AromaticContact CD1-CE1 3.78Å; F894-F898 HydrophobicContact CD1-CE1 3.78Å; F894-F898 HydrophobicContact CD2-CE1 4.1Å; F894-F898 AromaticContact CE1-CE1 3.69Å; F894-F898 HydrophobicContact CE1-CE1 3.69Å; F894-F898 HydrophobicContact CE1-CZ 4.14Å; F894-F898 HydrophobicContact CE2-CE1 4.01Å; F894-F898 HydrophobicContact CE2-CZ 4.14Å; F894-F898 AromaticContact CG-CE1 3.98Å; F894-F898 HydrophobicContact CG-CE1 3.98Å; F894-F898 AromaticContact CZ-CE1 3.8Å; F894-F898 HydrophobicContact CZ-CE1 3.8Å; F894-F898 AromaticContact CZ-CZ 3.87Å; F894-F898 HydrophobicContact CZ-CZ 3.87Å; F894-W899 AromaticContact CD2-CH2 3.78Å; F894-W899 HydrophobicContact CD2-CH2 3.78Å; F894-W899 AromaticContact CD2-CZ3 3.7Å; F894-W899 HydrophobicContact CD2-CZ3 3.7Å; F894-W899 HydrophobicContact CE2-CH2 4.41Å; F894-W899 HydrophobicContact CE2-CZ3 4.12Å; F894-W899 HydrophobicContact CG-CZ3 4.3Å; F894-P929 HydrophobicContact CB-CB 4.47Å; F894-P929 PolarHBondContact N-O 3.43Å; F894-P929 WeakPolarHBondContact O-CG 3.36Å; F894-L931 HydrophobicContact CE2-CB 4.41Å; F894-L931 HydrophobicContact CE2-CD1 4.17Å; F894-L931 HydrophobicContact CE2-CG 4.38Å; F894-M989 HydrophobicContact CE1-CE 4.14Å; F894-M989 HydrophobicContact CE1-SD 3.86Å; F894-M989 HydrophobicContact CZ-SD 3.8Å; F894-L992 HydrophobicContact CZ-CD1 4.25Å; F894-P1033 HydrophobicContact CD1-CG 4.19Å; F894-P1033 WeakPolarHBondContact CE1-O 3.22Å; F894-P1035 HydrophobicContact CD1-CB 4.25Å; F894-P1035 HydrophobicContact CD1-CG 4.4Å; F894-P1035 HydrophobicContact CE1-CB 4.03Å; F894-P1035 HydrophobicContact CE1-CG 3.71Å; F894-P1035 HydrophobicContact CZ-CB 4.42Å; F894-P1035 HydrophobicContact CZ-CG 4Å
895	E	92.4	Very high	93.2	Very high	148 Å²	148	37.9 Å²	37.9	69%	0.692	18%	0.182	S	C	*	.	S	Bend	trans	-78.1	-31	171.9	-176.5	178.5	-152.2	0	0	112.1	I1036	E895-I1036 HydrophobicContact CB-CG2 4.23Å
896	R	92.7	Very high	93.1	Very high	143 Å²	143	38.4 Å²	38.4	54%	0.54	18%	0.183	S	C	.	.	S	Bend	trans	-148.8	152.5	180	68	-176.2	-175	-145.1	-2.4	110.3
897	S	92.8	Very high	93.1	Very high	35 Å²	35	37.9 Å²	37.9	25%	0.245	18%	0.18	C	C	.	.			trans	-71.5	145.9	168.6	-64.6	0	0	0	0	110	W899 P929	S897-W899 VanDerWaalsContact OG-CZ2 3.28Å; S897-W899 WeakPolarHBondContact OG-CZ2 3.24Å; S897-P929 VanDerWaalsContact N-CB 3.33Å; S897-P929 WeakPolarHBondContact OG-CB 3.47Å
898	F	93.1	Very high	93.2	Very high	35 Å²	35	38.1 Å²	38.1	15%	0.154	18%	0.181	C	C	.	.			trans	-127.5	-5	171.1	54.4	-99.3	0	0	0	112.3	F894 L931 L992 F996 I1032 P1033	F894-F898 AromaticContact CD1-CE1 3.78Å; F894-F898 HydrophobicContact CD1-CE1 3.78Å; F894-F898 HydrophobicContact CD2-CE1 4.1Å; F894-F898 AromaticContact CE1-CE1 3.69Å; F894-F898 HydrophobicContact CE1-CE1 3.69Å; F894-F898 HydrophobicContact CE1-CZ 4.14Å; F894-F898 HydrophobicContact CE2-CE1 4.01Å; F894-F898 HydrophobicContact CE2-CZ 4.14Å; F894-F898 AromaticContact CG-CE1 3.98Å; F894-F898 HydrophobicContact CG-CE1 3.98Å; F894-F898 AromaticContact CZ-CE1 3.8Å; F894-F898 HydrophobicContact CZ-CE1 3.8Å; F894-F898 AromaticContact CZ-CZ 3.87Å; F894-F898 HydrophobicContact CZ-CZ 3.87Å; F898-L931 HydrophobicContact CZ-CD1 4.29Å; F898-L992 HydrophobicContact CZ-CD1 4.4Å; F898-F996 HydrophobicContact CD2-CB 4.03Å; F898-F996 AromaticContact CD2-CD2 3.93Å; F898-F996 HydrophobicContact CD2-CD2 3.93Å; F898-F996 AromaticContact CD2-CG 3.9Å; F898-F996 HydrophobicContact CD2-CG 3.9Å; F898-F996 HydrophobicContact CE2-CB 4.4Å; F898-F996 AromaticContact CE2-CD2 3.66Å; F898-F996 HydrophobicContact CE2-CD2 3.66Å; F898-F996 HydrophobicContact CE2-CE2 4.19Å; F898-F996 HydrophobicContact CE2-CG 4.11Å; F898-I1032 HydrophobicContact CB-CD1 4Å; F898-I1032 HydrophobicContact CD1-CG2 4.01Å; F898-I1032 HydrophobicContact CD2-CD1 3.69Å; F898-I1032 HydrophobicContact CD2-CG2 4.06Å; F898-I1032 HydrophobicContact CE1-CG2 3.72Å; F898-I1032 HydrophobicContact CE2-CD1 4.35Å; F898-I1032 HydrophobicContact CE2-CG2 3.79Å; F898-I1032 HydrophobicContact CG-CD1 3.86Å; F898-I1032 HydrophobicContact CG-CG2 4.16Å; F898-I1032 HydrophobicContact CZ-CG2 3.61Å; F898-P1033 HydrophobicContact CD1-CG 4.11Å; F898-P1033 HydrophobicContact CE1-CG 4.42Å
899	W	92.6	Very high	93.2	Very high	13 Å²	13	38.4 Å²	38.4	5%	0.049	18%	0.183	C	C	.	.	S	Bend	trans	-96	158.1	168.3	60.4	101.6	0	0	0	109.1	F894 S897 S924 P929 L931 F996	F894-W899 AromaticContact CD2-CH2 3.78Å; F894-W899 HydrophobicContact CD2-CH2 3.78Å; F894-W899 AromaticContact CD2-CZ3 3.7Å; F894-W899 HydrophobicContact CD2-CZ3 3.7Å; F894-W899 HydrophobicContact CE2-CH2 4.41Å; F894-W899 HydrophobicContact CE2-CZ3 4.12Å; F894-W899 HydrophobicContact CG-CZ3 4.3Å; S897-W899 VanDerWaalsContact OG-CZ2 3.28Å; S897-W899 WeakPolarHBondContact OG-CZ2 3.24Å; W899-S924 PolarHBondContact NE1-OG 3.09Å; W899-P929 HydrophobicContact CH2-CB 3.96Å; W899-P929 HydrophobicContact CZ2-CB 4.4Å; W899-L931 HydrophobicContact CD2-CD1 4.1Å; W899-L931 HydrophobicContact CD2-CD2 3.84Å; W899-L931 HydrophobicContact CD2-CG 4.02Å; W899-L931 HydrophobicContact CE3-CD1 3.83Å; W899-L931 HydrophobicContact CE3-CD2 4.37Å; W899-L931 HydrophobicContact CE3-CG 4.04Å; W899-L931 HydrophobicContact CG-CD2 4.16Å; W899-L931 HydrophobicContact CH2-CD1 4.42Å; W899-L931 HydrophobicContact CH2-CD2 4.45Å; W899-L931 HydrophobicContact CH2-CG 3.87Å; W899-L931 HydrophobicContact CZ2-CD2 3.91Å; W899-L931 HydrophobicContact CZ2-CG 3.82Å; W899-L931 HydrophobicContact CZ3-CD1 4.01Å; W899-L931 HydrophobicContact CZ3-CG 3.98Å; W899-F996 HydrophobicContact CB-CD1 4.49Å; W899-F996 HydrophobicContact CB-CE1 3.71Å; W899-F996 HydrophobicContact CB-CE2 4.21Å; W899-F996 HydrophobicContact CB-CZ 3.55Å
900	D	86.5	Confident	93.2	Very high	99 Å²	99	39 Å²	39	53%	0.529	19%	0.186	S	C	.	.			trans	-70.9	144.3	169	-171	17	0	0	0	110.4	S902 H903	D900-S902 PolarHBondContact OD1-N 3.26Å; D900-S902 WeakPolarHBondContact OD2-CB 3.31Å; D900-S902 PolarHBondContact OD2-OG 2.71Å; D900-H903 IonicContact OD2-CD2 3.04Å
901	R	87.3	Confident	93	Very high	117 Å²	117	43.8 Å²	43.8	44%	0.442	21%	0.209	S	C	.	.	S	Bend	trans	-103.2	0.9	-176.8	-55.4	-175.7	66	-165.2	-0.3	113	T926 D927	R901-T926 PolarHBondContact NH2-O 2.98Å; R901-D927 VanDerWaalsContact NH2-CA 3.32Å; R901-D927 PolarHBondContact NH2-O 3.5Å
902	S	85.1	Confident	92.9	Very high	66 Å²	66	46.2 Å²	46.2	46%	0.462	23%	0.226	S	C	.	.	S	Bend	trans	-75.2	-35.5	171.9	76.9	0	0	0	0	112	N437 D900	N437-S902 PolarHBondContact ND2-O 3.3Å; D900-S902 PolarHBondContact OD1-N 3.26Å; D900-S902 WeakPolarHBondContact OD2-CB 3.31Å; D900-S902 PolarHBondContact OD2-OG 2.71Å
903	H	85.3	Confident	92.9	Very high	64 Å²	64	48.7 Å²	48.7	30%	0.296	24%	0.241	S	C	.	.	S	Bend	trans	-83.2	131.5	168.1	-53.2	-91.6	0	0	0	109.1	D439 D900	D439-H903 IonicContact OD2-CE1 2.83Å; D439-H903 PolarHBondContact OD2-CE1 2.88Å; D439-H903 IonicContact OD2-ND1 3.65Å; D439-H903 PolarHBondContact OD2-ND1 2.95Å; D900-H903 IonicContact OD2-CD2 3.04Å
904	N	91.3	Very high	92.8	Very high	30 Å²	30	54.6 Å²	54.6	16%	0.16	27%	0.273	C	S	.	.	S	Bend	trans	-87.7	-11.6	177.2	-74.4	126.3	0	0	0	113.2	I436 N437 W923 S924 I925	I436-N904 HydrophobicContact CG2-CB 4.21Å; N437-N904 HydrophobicContact CB-CB 4.48Å; N437-N904 WeakPolarHBondContact CB-OD1 3.49Å; N437-N904 PolarHBondContact N-OD1 3.05Å; N904-W923 CarbonylContact O-C 3.51Å; N904-W923 WeakPolarHBondContact O-CA 3.15Å; N904-S924 PolarHBondContact ND2-O 3.36Å; N904-S924 PolarHBondContact O-N 3.25Å; N904-I925 HydrophobicContact CB-CG2 4.24Å
905	L	93.8	Very high	92.8	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.016	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	156.7	-173	55.5	87.9	0	0	0	112.6	V18 I436 C440 L921 F922 W923	V18-L905 HydrophobicContact CG1-CD1 3.93Å; I436-L905 HydrophobicContact CG2-CD2 4.28Å; C440-L905 HydrophobicContact CB-CD1 3.35Å; L905-L921 HydrophobicContact CB-CD1 4.25Å; L905-L921 HydrophobicContact CD1-CD1 4.37Å; L905-F922 CarbonylContact C-O 3.6Å; L905-F922 WeakPolarHBondContact CA-O 3.4Å; L905-W923 HydrophobicContact CB-CD2 4.46Å; L905-W923 HydrophobicContact CD2-CH2 4.06Å; L905-W923 HydrophobicContact CD2-CZ2 4.05Å; L905-W923 HydrophobicContact CD2-CZ3 4.39Å
906	F	95.6	Very high	93.1	Very high	15 Å²	15	50.1 Å²	50.1	7%	0.066	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	143.1	175	58.9	-89.5	0	0	0	111.9	Y443 L921 F922 L931 L992 I995 F996	Y443-F906 HydrophobicContact CD2-CD2 4.43Å; Y443-F906 HydrophobicContact CE2-CB 4.15Å; Y443-F906 HydrophobicContact CE2-CD2 4.39Å; F906-L921 WeakPolarHBondContact O-CD1 3.34Å; F906-F922 HydrophobicContact CD1-CB 4.2Å; F906-F922 HydrophobicContact CD2-CB 4Å; F906-F922 HydrophobicContact CD2-CD2 4.25Å; F906-F922 HydrophobicContact CD2-CG 4.36Å; F906-F922 HydrophobicContact CE1-CB 3.77Å; F906-F922 HydrophobicContact CE2-CB 3.55Å; F906-F922 HydrophobicContact CE2-CD1 4.35Å; F906-F922 AromaticContact CE2-CD2 3.75Å; F906-F922 HydrophobicContact CE2-CD2 3.75Å; F906-F922 AromaticContact CE2-CG 3.64Å; F906-F922 HydrophobicContact CE2-CG 3.64Å; F906-F922 HydrophobicContact CG-CB 4.3Å; F906-F922 HydrophobicContact CZ-CB 3.42Å; F906-F922 VanDerWaalsContact CZ-CB 3.42Å; F906-F922 HydrophobicContact CZ-CD1 4.21Å; F906-F922 HydrophobicContact CZ-CD2 4.36Å; F906-F922 AromaticContact CZ-CG 3.77Å; F906-F922 HydrophobicContact CZ-CG 3.77Å; F906-F922 PolarHBondContact N-O 2.82Å; F906-F922 PolarHBondContact O-N 2.83Å; F906-L931 HydrophobicContact CE1-CD2 4.1Å; F906-L931 HydrophobicContact CZ-CD1 4.33Å; F906-L931 HydrophobicContact CZ-CD2 4.43Å; F906-L992 HydrophobicContact CE2-CD2 4.03Å; F906-L992 HydrophobicContact CZ-CD2 3.79Å; F906-I995 HydrophobicContact CD2-CD1 4.19Å; F906-I995 HydrophobicContact CE2-CD1 4.04Å; F906-F996 HydrophobicContact CE1-CE2 4.38Å; F906-F996 HydrophobicContact CE1-CZ 4.11Å; F906-F996 AromaticContact CE2-CE2 3.92Å; F906-F996 HydrophobicContact CE2-CE2 3.92Å; F906-F996 HydrophobicContact CE2-CZ 4.16Å; F906-F996 AromaticContact CZ-CE2 3.69Å; F906-F996 HydrophobicContact CZ-CE2 3.69Å; F906-F996 AromaticContact CZ-CZ 3.85Å; F906-F996 HydrophobicContact CZ-CZ 3.85Å
907	G	96.9	Very high	93.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	156.4	-173.7	0	0	0	0	0	114.3	C440 S441 Y443 F920	C440-G907 PolarHBondContact SG-N 3.13Å; C440-G907 VanDerWaalsContact SG-N 3.37Å; S441-G907 PolarHBondContact O-N 3.33Å; Y443-G907 WeakPolarHBondContact CD2-O 3.33Å; Y443-G907 PolarHBondContact N-O 3.26Å; G907-F920 CarbonylContact C-O 3.59Å; G907-F920 WeakPolarHBondContact CA-O 3.33Å
908	H	97.8	Very high	93.6	Very high	14 Å²	14	43.8 Å²	43.8	7%	0.065	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	119.3	173.6	165.7	-97	0	0	0	109.3	Y443 N910 F920 F922 V991	Y443-H908 WeakPolarHBondContact O-CA 3.3Å; H908-N910 PolarHBondContact CE1-OD1 3.39Å; H908-F920 PolarHBondContact N-O 2.86Å; H908-F920 WeakPolarHBondContact O-CA 3.36Å; H908-F922 HydrophobicContact CB-CE2 4.45Å; H908-V991 HydrophobicContact CB-CG1 3.9Å; H908-V991 VanDerWaalsContact CD2-CG1 3.48Å; H908-V991 WeakPolarHBondContact CD2-CG1 3.48Å
909	V	98	Very high	93.8	Very high	7 Å²	7	42.4 Å²	42.4	4%	0.042	22%	0.222	C	C	.	.			trans	-91	114.5	-173.9	178.9	0	0	0	0	109.9	L442 Y443 S445 I450 S691 I692 W695	L442-V909 HydrophobicContact CB-CG2 4.28Å; L442-V909 HydrophobicContact CD1-CG2 4.31Å; Y443-V909 PolarHBondContact O-N 3.09Å; S445-V909 PolarHBondContact N-O 2.77Å; I450-V909 HydrophobicContact CD1-CB 4.12Å; I450-V909 HydrophobicContact CD1-CG2 3.54Å; S691-V909 VanDerWaalsContact C-CG1 3.47Å; S691-V909 WeakPolarHBondContact O-CG1 3.34Å; I692-V909 HydrophobicContact CG1-CG1 4.45Å; W695-V909 HydrophobicContact CB-CG2 4.1Å; W695-V909 HydrophobicContact CG-CG2 4.19Å
910	N	97	Very high	94.1	Very high	26 Å²	26	41.8 Å²	41.8	14%	0.139	22%	0.22	C	C	.	.			trans	-84.4	140.7	177.8	-72.9	-74.7	0	0	0	111.3	H908 S912 S915 R916 E918	H908-N910 PolarHBondContact CE1-OD1 3.39Å; N910-S912 PolarHBondContact O-N 3.17Å; N910-S912 VanDerWaalsContact O-N 3.08Å; N910-S915 PolarHBondContact ND2-O 2.88Å; N910-R916 PolarHBondContact ND2-O 3.08Å; N910-E918 PolarHBondContact ND2-O 3.5Å
911	E	92.4	Very high	94.6	Very high	100 Å²	100	37 Å²	37	47%	0.467	20%	0.195	S	C	.	.	S	Bend	trans	-73	3	-178	-60.9	-174.2	-143.3	0	0	115.8	S445 K687	S445-E911 WeakPolarHBondContact CB-OE1 3.47Å; S445-E911 WeakPolarHBondContact OG-CG 3.42Å; S445-E911 PolarHBondContact OG-OE1 3.01Å; K687-E911 IonicContact NZ-OE2 3.62Å; K687-E911 PolarHBondContact NZ-OE2 3.17Å
912	S	94	Very high	95.1	Very high	52 Å²	52	31.5 Å²	31.5	36%	0.364	17%	0.174	S	C	.	.			trans	-142.2	128.1	-175.2	-172.6	0	0	0	0	111.7	N910 N914 S915 R916	N910-S912 PolarHBondContact O-N 3.17Å; N910-S912 VanDerWaalsContact O-N 3.08Å; S912-N914 PolarHBondContact O-N 3.15Å; S912-N914 VanDerWaalsContact O-N 3.11Å; S912-S915 CarbonylContact O-C 3.59Å; S912-S915 PolarHBondContact O-N 3.06Å; S912-S915 PolarHBondContact O-OG 3.19Å; S912-R916 PolarHBondContact O-N 3.31Å
913	T	95.5	Very high	95.6	Very high	52 Å²	52	28.5 Å²	28.5	32%	0.319	15%	0.152	S	C	.	.	G	3₁₀ helix	trans	-45.2	-39.2	170.5	-47.1	0	0	0	0	112.9	D694 S915 R916	D694-T913 WeakPolarHBondContact OD1-CG2 3.12Å; D694-T913 WeakPolarHBondContact OD2-CA 3.18Å; D694-T913 WeakPolarHBondContact OD2-CB 3.25Å; D694-T913 PolarHBondContact OD2-OG1 2.79Å; T913-S915 VanDerWaalsContact C-N 3.33Å; T913-S915 PolarHBondContact O-N 3.26Å; T913-R916 WeakPolarHBondContact O-CB 3.39Å; T913-R916 WeakPolarHBondContact O-CD 2.9Å; T913-R916 WeakPolarHBondContact O-CG 3.26Å; T913-R916 PolarHBondContact O-N 3.46Å
914	N	94	Very high	96	Very high	127 Å²	127	25.7 Å²	25.7	68%	0.679	14%	0.14	S	C	*	.	G	3₁₀ helix	trans	-69.6	-27.8	-178.9	-69.9	-25.4	0	0	0	113.6	S912	S912-N914 PolarHBondContact O-N 3.15Å; S912-N914 VanDerWaalsContact O-N 3.11Å
915	S	95.6	Very high	95.9	Very high	36 Å²	36	25.1 Å²	25.1	25%	0.252	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	-108.8	12.4	178	67.8	0	0	0	0	112.6	N910 S912 T913 G917 E918	N910-S915 PolarHBondContact ND2-O 2.88Å; S912-S915 CarbonylContact O-C 3.59Å; S912-S915 PolarHBondContact O-N 3.06Å; S912-S915 PolarHBondContact O-OG 3.19Å; T913-S915 VanDerWaalsContact C-N 3.33Å; T913-S915 PolarHBondContact O-N 3.26Å; S915-G917 VanDerWaalsContact C-N 3.27Å; S915-G917 PolarHBondContact O-N 2.8Å; S915-E918 PolarHBondContact O-N 3.28Å
916	R	97.6	Very high	95.7	Very high	19 Å²	19	25.7 Å²	25.7	7%	0.072	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-43.4	-173.3	69.2	-172.7	178.7	-168.9	-1.8	113.1	D694 A698 E701 N910 S912 T913 E918 F920	D694-R916 HydrophobicContact CB-CB 4Å; D694-R916 WeakPolarHBondContact O-CB 3.43Å; D694-R916 WeakPolarHBondContact O-CD 3.49Å; D694-R916 WeakPolarHBondContact OD1-CD 3.45Å; D694-R916 IonicContact OD1-CZ 3.62Å; D694-R916 IonicContact OD1-NE 3.63Å; D694-R916 IonicContact OD1-NH1 3.9Å; D694-R916 PolarHBondContact OD1-NH1 2.92Å; A698-R916 HydrophobicContact CB-CB 4.09Å; A698-R916 HydrophobicContact CB-CG 3.87Å; E701-R916 IonicContact OE1-CZ 2.73Å; E701-R916 IonicContact OE1-NE 3.58Å; E701-R916 IonicContact OE1-NH2 3.2Å; E701-R916 PolarHBondContact OE1-NH2 2.92Å; E701-R916 IonicContact OE2-CZ 2.72Å; E701-R916 IonicContact OE2-NE 3.54Å; E701-R916 PolarHBondContact OE2-NE 2.71Å; E701-R916 IonicContact OE2-NH2 2.72Å; E701-R916 PolarHBondContact OE2-NH2 3.34Å; N910-R916 PolarHBondContact ND2-O 3.08Å; S912-R916 PolarHBondContact O-N 3.31Å; T913-R916 WeakPolarHBondContact O-CB 3.39Å; T913-R916 WeakPolarHBondContact O-CD 2.9Å; T913-R916 WeakPolarHBondContact O-CG 3.26Å; T913-R916 PolarHBondContact O-N 3.46Å; R916-E918 PolarHBondContact O-N 3.44Å; R916-F920 WeakPolarHBondContact O-CB 3.28Å
917	G	97.7	Very high	95.3	Very high	2 Å²	2	28.1 Å²	28.1	2%	0.021	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	4.7	176.8	0	0	0	0	0	116.4	S915 L919 V935 A936	S915-G917 VanDerWaalsContact C-N 3.27Å; S915-G917 PolarHBondContact O-N 2.8Å; G917-L919 PolarHBondContact O-N 3.31Å; G917-V935 CarbonylContact O-C 3.46Å; G917-V935 VanDerWaalsContact O-CA 3.31Å; G917-V935 WeakPolarHBondContact O-CA 3.31Å; G917-A936 PolarHBondContact O-N 3.08Å
918	E	98.1	Very high	95	Very high	43 Å²	43	31.1 Å²	31.1	20%	0.201	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	114.2	176.4	-171.4	167.1	-178.4	0	0	111.4	N910 S915 R916 F920 A939 I984 R987	N910-E918 PolarHBondContact ND2-O 3.5Å; S915-E918 PolarHBondContact O-N 3.28Å; R916-E918 PolarHBondContact O-N 3.44Å; E918-F920 PolarHBondContact O-N 3.1Å; E918-A939 HydrophobicContact CB-CB 3.7Å; E918-I984 HydrophobicContact CG-CD1 4.02Å; E918-I984 WeakPolarHBondContact OE1-CD1 3.18Å; E918-R987 IonicContact OE1-CZ 2.85Å; E918-R987 IonicContact OE1-NE 3.53Å; E918-R987 PolarHBondContact OE1-NE 3.07Å; E918-R987 IonicContact OE1-NH2 3.78Å; E918-R987 PolarHBondContact OE1-NH2 3.41Å
919	L	98	Very high	94.8	Very high	5 Å²	5	31.3 Å²	31.3	3%	0.026	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	55.7	27	175.1	-60.4	167.8	0	0	0	113.3	V890 G917 L921 F922 A933 L934 V935 I984 R987 A988	V890-L919 HydrophobicContact CB-CD2 4.41Å; V890-L919 HydrophobicContact CG2-CD2 4.17Å; G917-L919 PolarHBondContact O-N 3.31Å; L919-L921 VanDerWaalsContact C-N 3.3Å; L919-L921 PolarHBondContact O-N 2.78Å; L919-F922 WeakPolarHBondContact O-CE2 3.21Å; L919-A933 HydrophobicContact CD2-CB 3.67Å; L919-L934 WeakPolarHBondContact CA-O 3.27Å; L919-L934 PolarHBondContact N-O 2.94Å; L919-L934 VanDerWaalsContact N-O 3.11Å; L919-V935 HydrophobicContact CD2-CG2 4.08Å; L919-V935 HydrophobicContact CG-CG2 4.42Å; L919-I984 HydrophobicContact CD1-CD1 3.75Å; L919-I984 HydrophobicContact CD1-CG1 4.41Å; L919-I984 HydrophobicContact CD2-CD1 4.05Å; L919-I984 HydrophobicContact CD2-CG1 4.19Å; L919-I984 HydrophobicContact CG-CD1 3.82Å; L919-I984 HydrophobicContact CG-CG1 4.48Å; L919-R987 HydrophobicContact CD1-CB 3.83Å; L919-A988 HydrophobicContact CD1-CB 3.92Å; L919-A988 HydrophobicContact CD2-CB 3.9Å
920	F	98.2	Very high	94.7	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	-18.5	-167.2	83.4	-73.8	0	0	0	113.8	W695 A698 N699 F702 G907 H908 R916 E918 L934 A936	W695-F920 AromaticContact CD1-CD2 3.86Å; W695-F920 AromaticContact NE1-CD2 3.54Å; W695-F920 PolarHBondContact NE1-O 2.56Å; A698-F920 HydrophobicContact CB-CD2 3.81Å; A698-F920 HydrophobicContact CB-CE2 4.23Å; A698-F920 HydrophobicContact CB-CG 4.1Å; N699-F920 HydrophobicContact CB-CE2 3.91Å; N699-F920 WeakPolarHBondContact OD1-CE2 3.19Å; F702-F920 HydrophobicContact CB-CE1 4.02Å; F702-F920 HydrophobicContact CB-CZ 3.56Å; F702-F920 HydrophobicContact CD2-CZ 4.49Å; F702-F920 HydrophobicContact CG-CZ 4.08Å; G907-F920 CarbonylContact C-O 3.59Å; G907-F920 WeakPolarHBondContact CA-O 3.33Å; H908-F920 PolarHBondContact N-O 2.86Å; H908-F920 WeakPolarHBondContact O-CA 3.36Å; R916-F920 WeakPolarHBondContact O-CB 3.28Å; E918-F920 PolarHBondContact O-N 3.1Å; F920-L934 HydrophobicContact CD1-CB 4.35Å; F920-L934 HydrophobicContact CE1-CB 3.78Å; F920-A936 HydrophobicContact CD1-CB 4.44Å; F920-A936 HydrophobicContact CE1-CB 3.85Å
921	L	97.7	Very high	94.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	132	-177.6	178.5	61.7	0	0	0	110.9	T20 W695 L905 F906 L919 A933 L934	T20-L921 HydrophobicContact CG2-CD2 3.64Å; W695-L921 HydrophobicContact CZ2-CD1 4.2Å; L905-L921 HydrophobicContact CB-CD1 4.25Å; L905-L921 HydrophobicContact CD1-CD1 4.37Å; F906-L921 WeakPolarHBondContact O-CD1 3.34Å; L919-L921 VanDerWaalsContact C-N 3.3Å; L919-L921 PolarHBondContact O-N 2.78Å; L921-A933 WeakPolarHBondContact O-CA 3.04Å; L921-L934 HydrophobicContact CB-CD1 4.13Å; L921-L934 HydrophobicContact CD2-CD1 3.87Å; L921-L934 HydrophobicContact CG-CD1 4.05Å; L921-L934 PolarHBondContact O-N 2.73Å
922	F	97.3	Very high	94.9	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	139.2	179.8	-70.6	-104.2	0	0	0	110.8	L905 F906 H908 L919 I932 A933 V991 L992	L905-F922 CarbonylContact C-O 3.6Å; L905-F922 WeakPolarHBondContact CA-O 3.4Å; F906-F922 HydrophobicContact CD1-CB 4.2Å; F906-F922 HydrophobicContact CD2-CB 4Å; F906-F922 HydrophobicContact CD2-CD2 4.25Å; F906-F922 HydrophobicContact CD2-CG 4.36Å; F906-F922 HydrophobicContact CE1-CB 3.77Å; F906-F922 HydrophobicContact CE2-CB 3.55Å; F906-F922 HydrophobicContact CE2-CD1 4.35Å; F906-F922 AromaticContact CE2-CD2 3.75Å; F906-F922 HydrophobicContact CE2-CD2 3.75Å; F906-F922 AromaticContact CE2-CG 3.64Å; F906-F922 HydrophobicContact CE2-CG 3.64Å; F906-F922 HydrophobicContact CG-CB 4.3Å; F906-F922 HydrophobicContact CZ-CB 3.42Å; F906-F922 VanDerWaalsContact CZ-CB 3.42Å; F906-F922 HydrophobicContact CZ-CD1 4.21Å; F906-F922 HydrophobicContact CZ-CD2 4.36Å; F906-F922 AromaticContact CZ-CG 3.77Å; F906-F922 HydrophobicContact CZ-CG 3.77Å; F906-F922 PolarHBondContact N-O 2.82Å; F906-F922 PolarHBondContact O-N 2.83Å; H908-F922 HydrophobicContact CB-CE2 4.45Å; L919-F922 WeakPolarHBondContact O-CE2 3.21Å; F922-I932 CarbonylContact C-O 3.58Å; F922-I932 WeakPolarHBondContact CA-O 3.49Å; F922-A933 HydrophobicContact CD1-CB 3.6Å; F922-A933 HydrophobicContact CE1-CB 3.49Å; F922-A933 VanDerWaalsContact CE1-CB 3.49Å; F922-A933 HydrophobicContact CE2-CB 4.46Å; F922-A933 HydrophobicContact CG-CB 4.16Å; F922-A933 HydrophobicContact CZ-CB 3.95Å; F922-V991 HydrophobicContact CE2-CG1 3.73Å; F922-V991 HydrophobicContact CZ-CB 4.23Å; F922-V991 HydrophobicContact CZ-CG1 3.91Å; F922-L992 HydrophobicContact CD1-CD1 4.48Å; F922-L992 HydrophobicContact CD1-CD2 3.89Å; F922-L992 HydrophobicContact CD1-CG 4.36Å; F922-L992 HydrophobicContact CE1-CD1 3.88Å; F922-L992 HydrophobicContact CE1-CD2 3.72Å; F922-L992 HydrophobicContact CE1-CG 3.71Å; F922-L992 HydrophobicContact CZ-CD2 4.24Å; F922-L992 HydrophobicContact CZ-CG 4.14Å
923	W	95.2	Very high	95.1	Very high	3 Å²	3	22.7 Å²	22.7	1%	0.011	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	135.7	-177.6	-75	66.2	0	0	0	112.4	T20 M21 M412 V413 I436 N904 L905 I925 L931 I932 L934	T20-W923 HydrophobicContact CG2-CZ2 3.77Å; M21-W923 HydrophobicContact CE-CH2 4.02Å; M412-W923 HydrophobicContact CE-CD2 3.51Å; M412-W923 HydrophobicContact CE-CE3 3.66Å; M412-W923 HydrophobicContact CE-CG 4.1Å; M412-W923 HydrophobicContact CE-CH2 3.99Å; M412-W923 HydrophobicContact CE-CZ2 3.83Å; M412-W923 HydrophobicContact CE-CZ3 3.9Å; V413-W923 HydrophobicContact CG2-CZ3 4.4Å; I436-W923 HydrophobicContact CD1-CH2 4.41Å; I436-W923 HydrophobicContact CD1-CZ3 3.96Å; I436-W923 HydrophobicContact CG1-CZ3 4.44Å; I436-W923 HydrophobicContact CG2-CH2 4.42Å; I436-W923 HydrophobicContact CG2-CZ3 4.06Å; N904-W923 CarbonylContact O-C 3.51Å; N904-W923 WeakPolarHBondContact O-CA 3.15Å; L905-W923 HydrophobicContact CB-CD2 4.46Å; L905-W923 HydrophobicContact CD2-CH2 4.06Å; L905-W923 HydrophobicContact CD2-CZ2 4.05Å; L905-W923 HydrophobicContact CD2-CZ3 4.39Å; W923-I925 HydrophobicContact CE3-CD1 4.24Å; W923-I925 HydrophobicContact CE3-CG1 4.46Å; W923-I925 HydrophobicContact CE3-CG2 3.6Å; W923-I925 HydrophobicContact CZ3-CG2 4.06Å; W923-L931 CarbonylContact O-C 3.56Å; W923-L931 WeakPolarHBondContact O-CA 3.2Å; W923-I932 HydrophobicContact CB-CB 4.3Å; W923-I932 PolarHBondContact N-O 2.94Å; W923-I932 PolarHBondContact O-N 2.97Å; W923-L934 VanDerWaalsContact NE1-CD1 3.3Å
924	S	94	Very high	95.2	Very high	5 Å²	5	20.2 Å²	20.2	4%	0.035	11%	0.107	C	C	.	.			trans	-125	69.1	177.5	174.8	0	0	0	0	110.5	W899 N904	W899-S924 PolarHBondContact NE1-OG 3.09Å; N904-S924 PolarHBondContact ND2-O 3.36Å; N904-S924 PolarHBondContact O-N 3.25Å
925	I	89.8	Confident	95.4	Very high	19 Å²	19	14.2 Å²	14.2	10%	0.097	8%	0.075	C	C	.	.			trans	-104.7	1.2	-174	47.5	165.6	0	0	0	115.5	M412 V730 N904 W923	M412-I925 HydrophobicContact CB-CD1 4.25Å; M412-I925 HydrophobicContact CG-CD1 4.18Å; M412-I925 HydrophobicContact SD-CD1 4.05Å; V730-I925 HydrophobicContact CG1-CB 4.04Å; V730-I925 HydrophobicContact CG1-CD1 3.87Å; V730-I925 HydrophobicContact CG1-CG2 4.02Å; V730-I925 HydrophobicContact CG2-CB 4.31Å; N904-I925 HydrophobicContact CB-CG2 4.24Å; W923-I925 HydrophobicContact CE3-CD1 4.24Å; W923-I925 HydrophobicContact CE3-CG1 4.46Å; W923-I925 HydrophobicContact CE3-CG2 3.6Å; W923-I925 HydrophobicContact CZ3-CG2 4.06Å
926	T	88.8	Confident	95.5	Very high	14 Å²	14	12.5 Å²	12.5	9%	0.086	6%	0.063	C	C	.	.	S	Bend	trans	-101.9	157.1	179.5	83.8	0	0	0	0	112.1	R901 K928 V930	R901-T926 PolarHBondContact NH2-O 2.98Å; T926-K928 PolarHBondContact O-N 3.06Å; T926-K928 PolarHBondContact OG1-N 3Å; T926-K928 VanDerWaalsContact OG1-N 3.16Å; T926-K928 PolarHBondContact OG1-O 3.37Å; T926-V930 HydrophobicContact CG2-CB 4.38Å
927	D	87.1	Confident	95.5	Very high	67 Å²	67	11.6 Å²	11.6	36%	0.358	6%	0.06	S	C	.	.	S	Bend	trans	-71	-4.3	172.3	92.9	-48.3	0	0	0	113	H406 R901	H406-D927 IonicContact CE1-OD1 3.41Å; R901-D927 VanDerWaalsContact NH2-CA 3.32Å; R901-D927 PolarHBondContact NH2-O 3.5Å
928	K	91.3	Very high	95.4	Very high	62 Å²	62	16.5 Å²	16.5	27%	0.27	8%	0.078	S	C	.	.	S	Bend	trans	-106.1	164.1	178.7	-52.5	-48.6	-178.9	-136.9	0	112.2	G404 Y405 T926 V930	G404-K928 WeakPolarHBondContact O-CE 3.28Å; Y405-K928 HydrophobicContact CD1-CB 3.8Å; Y405-K928 HydrophobicContact CD1-CG 4.23Å; Y405-K928 HydrophobicContact CE1-CB 4.19Å; T926-K928 PolarHBondContact O-N 3.06Å; T926-K928 PolarHBondContact OG1-N 3Å; T926-K928 VanDerWaalsContact OG1-N 3.16Å; T926-K928 PolarHBondContact OG1-O 3.37Å; K928-V930 HydrophobicContact CB-CG2 4.13Å; K928-V930 PolarHBondContact O-N 3.41Å
929	P	94.4	Very high	95.4	Very high	19 Å²	19	14.9 Å²	14.9	12%	0.123	7%	0.072	C	C	.	.	S	Bend	trans	-74.5	76.7	172.2	30.9	-35.8	0	0	0	111.5	Y405 F894 S897 W899	Y405-P929 HydrophobicContact CE1-CG 3.99Å; F894-P929 HydrophobicContact CB-CB 4.47Å; F894-P929 PolarHBondContact N-O 3.43Å; F894-P929 WeakPolarHBondContact O-CG 3.36Å; S897-P929 VanDerWaalsContact N-CB 3.33Å; S897-P929 WeakPolarHBondContact OG-CB 3.47Å; W899-P929 HydrophobicContact CH2-CB 3.96Å; W899-P929 HydrophobicContact CZ2-CB 4.4Å
930	V	95.2	Very high	95.4	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.006	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	133.3	175.2	-179.3	0	0	0	0	108.8	Y405 A407 V891 L892 I893 T926 K928 I932	Y405-V930 HydrophobicContact CD1-CG2 4.07Å; A407-V930 HydrophobicContact CB-CG1 4Å; V891-V930 HydrophobicContact CG1-CG1 3.61Å; L892-V930 WeakPolarHBondContact O-CA 3.21Å; I893-V930 HydrophobicContact CG1-CG1 4.43Å; I893-V930 HydrophobicContact CG1-CG2 4.21Å; I893-V930 HydrophobicContact CG2-CG2 4.23Å; T926-V930 HydrophobicContact CG2-CB 4.38Å; K928-V930 HydrophobicContact CB-CG2 4.13Å; K928-V930 PolarHBondContact O-N 3.41Å; V930-I932 HydrophobicContact CG1-CG1 4.37Å
931	L	96.8	Very high	95.2	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	147.5	164.7	-70	176	0	0	0	109.9	V891 L892 F894 F898 W899 F906 W923 L992	V891-L931 WeakPolarHBondContact CA-O 3.41Å; L892-L931 PolarHBondContact N-O 3.18Å; L892-L931 PolarHBondContact O-N 3.24Å; F894-L931 HydrophobicContact CE2-CB 4.41Å; F894-L931 HydrophobicContact CE2-CD1 4.17Å; F894-L931 HydrophobicContact CE2-CG 4.38Å; F898-L931 HydrophobicContact CZ-CD1 4.29Å; W899-L931 HydrophobicContact CD2-CD1 4.1Å; W899-L931 HydrophobicContact CD2-CD2 3.84Å; W899-L931 HydrophobicContact CD2-CG 4.02Å; W899-L931 HydrophobicContact CE3-CD1 3.83Å; W899-L931 HydrophobicContact CE3-CD2 4.37Å; W899-L931 HydrophobicContact CE3-CG 4.04Å; W899-L931 HydrophobicContact CG-CD2 4.16Å; W899-L931 HydrophobicContact CH2-CD1 4.42Å; W899-L931 HydrophobicContact CH2-CD2 4.45Å; W899-L931 HydrophobicContact CH2-CG 3.87Å; W899-L931 HydrophobicContact CZ2-CD2 3.91Å; W899-L931 HydrophobicContact CZ2-CG 3.82Å; W899-L931 HydrophobicContact CZ3-CD1 4.01Å; W899-L931 HydrophobicContact CZ3-CG 3.98Å; F906-L931 HydrophobicContact CE1-CD2 4.1Å; F906-L931 HydrophobicContact CZ-CD1 4.33Å; F906-L931 HydrophobicContact CZ-CD2 4.43Å; W923-L931 CarbonylContact O-C 3.56Å; W923-L931 WeakPolarHBondContact O-CA 3.2Å; L931-L992 HydrophobicContact CD1-CD1 3.93Å; L931-L992 HydrophobicContact CD1-CD2 3.71Å
932	I	97	Very high	95.1	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.01	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	107.5	172.1	-51.5	-179.3	0	0	0	107.7	A407 K889 V891 F922 W923 V930	A407-I932 HydrophobicContact CB-CD1 4.36Å; K889-I932 HydrophobicContact CB-CG2 4.03Å; K889-I932 HydrophobicContact CD-CG2 4.07Å; K889-I932 HydrophobicContact CG-CG2 4.32Å; V891-I932 HydrophobicContact CG2-CG1 4.24Å; V891-I932 HydrophobicContact CG2-CG2 4.31Å; F922-I932 CarbonylContact C-O 3.58Å; F922-I932 WeakPolarHBondContact CA-O 3.49Å; W923-I932 HydrophobicContact CB-CB 4.3Å; W923-I932 PolarHBondContact N-O 2.94Å; W923-I932 PolarHBondContact O-N 2.97Å; V930-I932 HydrophobicContact CG1-CG1 4.37Å
933	A	97.8	Very high	94.9	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	145.1	173.2	0	0	0	0	0	110.6	K889 V890 L919 L921 F922	K889-A933 WeakPolarHBondContact CA-O 3.33Å; V890-A933 HydrophobicContact CB-CB 4.27Å; V890-A933 PolarHBondContact N-O 3.35Å; V890-A933 PolarHBondContact O-N 3.01Å; L919-A933 HydrophobicContact CD2-CB 3.67Å; L921-A933 WeakPolarHBondContact O-CA 3.04Å; F922-A933 HydrophobicContact CD1-CB 3.6Å; F922-A933 HydrophobicContact CE1-CB 3.49Å; F922-A933 VanDerWaalsContact CE1-CB 3.49Å; F922-A933 HydrophobicContact CE2-CB 4.46Å; F922-A933 HydrophobicContact CG-CB 4.16Å; F922-A933 HydrophobicContact CZ-CB 3.95Å
934	L	98.2	Very high	94.7	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	144.5	-176.8	-61.5	173	0	0	0	111.6	F702 K889 L919 F920 L921 W923	F702-L934 HydrophobicContact CD2-CB 4.43Å; F702-L934 HydrophobicContact CD2-CD1 3.62Å; F702-L934 HydrophobicContact CD2-CD2 4.36Å; F702-L934 HydrophobicContact CD2-CG 4.35Å; F702-L934 HydrophobicContact CE2-CD1 3.43Å; F702-L934 VanDerWaalsContact CE2-CD1 3.43Å; F702-L934 HydrophobicContact CE2-CD2 3.91Å; F702-L934 HydrophobicContact CE2-CG 4.21Å; F702-L934 HydrophobicContact CG-CD1 4.45Å; F702-L934 HydrophobicContact CZ-CD1 4.15Å; K889-L934 HydrophobicContact CD-CD2 4.39Å; K889-L934 HydrophobicContact CG-CD2 4Å; L919-L934 WeakPolarHBondContact CA-O 3.27Å; L919-L934 PolarHBondContact N-O 2.94Å; L919-L934 VanDerWaalsContact N-O 3.11Å; F920-L934 HydrophobicContact CD1-CB 4.35Å; F920-L934 HydrophobicContact CE1-CB 3.78Å; L921-L934 HydrophobicContact CB-CD1 4.13Å; L921-L934 HydrophobicContact CD2-CD1 3.87Å; L921-L934 HydrophobicContact CG-CD1 4.05Å; L921-L934 PolarHBondContact O-N 2.73Å; W923-L934 VanDerWaalsContact NE1-CD1 3.3Å
935	V	98.2	Very high	94.5	Very high	1 Å²	1	24 Å²	24	1%	0.006	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	112.4	174.4	-172.9	0	0	0	0	108.2	N888 V890 G917 L919 A939 A940 L943 I984	N888-V935 PolarHBondContact N-O 3.23Å; N888-V935 PolarHBondContact O-N 3.15Å; V890-V935 HydrophobicContact CG2-CG2 4.18Å; G917-V935 CarbonylContact O-C 3.46Å; G917-V935 VanDerWaalsContact O-CA 3.31Å; G917-V935 WeakPolarHBondContact O-CA 3.31Å; L919-V935 HydrophobicContact CD2-CG2 4.08Å; L919-V935 HydrophobicContact CG-CG2 4.42Å; V935-A939 HydrophobicContact CG1-CB 3.83Å; V935-A940 WeakPolarHBondContact O-CB 3.32Å; V935-L943 HydrophobicContact CB-CD2 4.05Å; V935-L943 HydrophobicContact CG1-CB 4.32Å; V935-L943 HydrophobicContact CG1-CD2 3.97Å; V935-L943 HydrophobicContact CG2-CD2 4.04Å; V935-I984 HydrophobicContact CG2-CD1 4.28Å
936	A	98.1	Very high	94.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.129	C	C	.	.			trans	-125.8	173.5	-166.5	0	0	0	0	0	112.8	F702 L887 G917 F920 R938 A939 A940	F702-A936 HydrophobicContact CB-CB 3.75Å; L887-A936 HydrophobicContact CD1-CB 4.28Å; G917-A936 PolarHBondContact O-N 3.08Å; F920-A936 HydrophobicContact CD1-CB 4.44Å; F920-A936 HydrophobicContact CE1-CB 3.85Å; A936-R938 PolarHBondContact O-N 3.03Å; A936-A939 PolarHBondContact O-N 2.8Å; A936-A940 PolarHBondContact O-N 2.96Å; A936-A940 VanDerWaalsContact O-N 3.13Å
937	G	96.9	Very high	93	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	49.2	-134.6	176.6	0	0	0	0	0	113.3	A939 A940 C941	G937-A939 VanDerWaalsContact C-N 3.3Å; G937-A939 PolarHBondContact O-N 3.1Å; G937-A940 WeakPolarHBondContact O-CB 3.46Å; G937-A940 PolarHBondContact O-N 3.32Å; G937-A940 VanDerWaalsContact O-N 3.17Å; G937-C941 PolarHBondContact O-N 2.91Å
938	R	96.2	Very high	91.8	Very high	104 Å²	104	34.6 Å²	34.6	39%	0.392	17%	0.169	S	C	.	.	H	α-helix	trans	-58.3	-38.9	179.7	-176.2	67.1	-146.1	-173.1	2.5	113.3	E707 A936 A940 C941 D942	E707-R938 HydrophobicContact CG-CB 4.08Å; E707-R938 IonicContact OE1-NH1 3.28Å; E707-R938 WeakPolarHBondContact OE2-CD 3.32Å; A936-R938 PolarHBondContact O-N 3.03Å; R938-A940 VanDerWaalsContact C-N 3.29Å; R938-A940 PolarHBondContact O-N 2.79Å; R938-C941 VanDerWaalsContact O-CB 3.29Å; R938-C941 WeakPolarHBondContact O-CB 3.16Å; R938-C941 PolarHBondContact O-N 3.04Å; R938-C941 VanDerWaalsContact O-N 3.11Å; R938-D942 IonicContact CZ-OD1 2.73Å; R938-D942 IonicContact CZ-OD2 3.66Å; R938-D942 IonicContact NE-OD1 2.77Å; R938-D942 IonicContact NE-OD2 2.69Å; R938-D942 PolarHBondContact NE-OD2 2.97Å; R938-D942 IonicContact NH2-OD1 3Å; R938-D942 PolarHBondContact NH2-OD1 3.42Å; R938-D942 IonicContact NH2-OD2 3.1Å; R938-D942 PolarHBondContact NH2-OD2 2.9Å; R938-D942 PolarHBondContact O-N 3.49Å; R938-D942 VanDerWaalsContact O-N 3.1Å
939	A	97.4	Very high	89.3	Confident	10 Å²	10	36.9 Å²	36.9	8%	0.083	19%	0.193	C	C	.	.	H	α-helix	trans	-64.7	-32.6	-180	0	0	0	0	0	112.5	E918 V935 A936 G937 C941 D942 L943	E918-A939 HydrophobicContact CB-CB 3.7Å; V935-A939 HydrophobicContact CG1-CB 3.83Å; A936-A939 PolarHBondContact O-N 2.8Å; G937-A939 VanDerWaalsContact C-N 3.3Å; G937-A939 PolarHBondContact O-N 3.1Å; A939-C941 VanDerWaalsContact C-N 3.31Å; A939-C941 PolarHBondContact O-N 3.27Å; A939-D942 PolarHBondContact O-N 3.11Å; A939-L943 WeakPolarHBondContact O-CB 3.29Å; A939-L943 PolarHBondContact O-N 2.63Å
940	A	97	Very high	86.8	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65	-37.9	174.3	0	0	0	0	0	111.7	V886 V935 A936 G937 R938	V886-A940 HydrophobicContact CG1-CB 4.07Å; V886-A940 HydrophobicContact CG2-CB 4.27Å; V886-A940 VanDerWaalsContact O-CB 3.26Å; V886-A940 WeakPolarHBondContact O-CB 3.44Å; V935-A940 WeakPolarHBondContact O-CB 3.32Å; A936-A940 PolarHBondContact O-N 2.96Å; A936-A940 VanDerWaalsContact O-N 3.13Å; G937-A940 WeakPolarHBondContact O-CB 3.46Å; G937-A940 PolarHBondContact O-N 3.32Å; G937-A940 VanDerWaalsContact O-N 3.17Å; R938-A940 VanDerWaalsContact C-N 3.29Å; R938-A940 PolarHBondContact O-N 2.79Å
941	C	94.6	Very high	84	Confident	21 Å²	21	47.7 Å²	47.7	14%	0.142	26%	0.261	C	S	.	.	H	α-helix	trans	-64.5	-41.9	174.1	-76.4	0	0	0	0	112.5	G937 R938 A939 N945 R1044	G937-C941 PolarHBondContact O-N 2.91Å; R938-C941 VanDerWaalsContact O-CB 3.29Å; R938-C941 WeakPolarHBondContact O-CB 3.16Å; R938-C941 PolarHBondContact O-N 3.04Å; R938-C941 VanDerWaalsContact O-N 3.11Å; A939-C941 VanDerWaalsContact C-N 3.31Å; A939-C941 PolarHBondContact O-N 3.27Å; C941-N945 PolarHBondContact O-ND2 2.94Å; C941-N945 VanDerWaalsContact O-ND2 3.15Å; C941-R1044 VanDerWaalsContact CA-NH1 3.33Å; C941-R1044 PolarHBondContact O-NH2 3.48Å; C941-R1044 PolarHBondContact SG-NH1 2.83Å
942	D	95	Very high	80.7	Confident	66 Å²	66	58.6 Å²	58.6	35%	0.353	30%	0.302	S	S	.	.	H	α-helix	trans	-84.5	-28.2	-174.1	-67.9	-36.7	0	0	0	113.4	R938 A939 E944 N945 E946	R938-D942 IonicContact CZ-OD1 2.73Å; R938-D942 IonicContact CZ-OD2 3.66Å; R938-D942 IonicContact NE-OD1 2.77Å; R938-D942 IonicContact NE-OD2 2.69Å; R938-D942 PolarHBondContact NE-OD2 2.97Å; R938-D942 IonicContact NH2-OD1 3Å; R938-D942 PolarHBondContact NH2-OD1 3.42Å; R938-D942 IonicContact NH2-OD2 3.1Å; R938-D942 PolarHBondContact NH2-OD2 2.9Å; R938-D942 PolarHBondContact O-N 3.49Å; R938-D942 VanDerWaalsContact O-N 3.1Å; A939-D942 PolarHBondContact O-N 3.11Å; D942-E944 PolarHBondContact O-N 2.61Å; D942-N945 CarbonylContact O-C 3.54Å; D942-N945 WeakPolarHBondContact O-CA 3.41Å; D942-N945 WeakPolarHBondContact O-CB 3.21Å; D942-N945 PolarHBondContact O-N 3.25Å; D942-N945 PolarHBondContact OD1-ND2 3.06Å; D942-E946 PolarHBondContact O-N 3.38Å
943	L	94.2	Very high	77.5	Confident	5 Å²	5	69.7 Å²	69.7	3%	0.026	34%	0.344	C	S	.	.	H	α-helix	trans	-59	-32.2	170.4	173.8	62	0	0	0	113.5	N888 V935 A939 N945 I984 V1040 R1042	N888-L943 HydrophobicContact CB-CD2 4.11Å; V935-L943 HydrophobicContact CB-CD2 4.05Å; V935-L943 HydrophobicContact CG1-CB 4.32Å; V935-L943 HydrophobicContact CG1-CD2 3.97Å; V935-L943 HydrophobicContact CG2-CD2 4.04Å; A939-L943 WeakPolarHBondContact O-CB 3.29Å; A939-L943 PolarHBondContact O-N 2.63Å; L943-N945 VanDerWaalsContact C-N 3.34Å; L943-I984 HydrophobicContact CD1-CB 3.78Å; L943-I984 HydrophobicContact CD1-CD1 4.23Å; L943-I984 HydrophobicContact CD1-CG1 3.93Å; L943-I984 HydrophobicContact CD1-CG2 3.95Å; L943-I984 HydrophobicContact CD2-CG1 4.43Å; L943-V1040 HydrophobicContact CD2-CG1 4.21Å; L943-R1042 PolarHBondContact O-NE 2.77Å
944	E	91.1	Very high	74.3	Confident	17 Å²	17	77.5 Å²	77.5	8%	0.079	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-12.9	175.2	-66.6	-154.7	-138	0	0	113.3	V886 N888 D942 R1042 W1043 R1044 T1045	V886-E944 VanDerWaalsContact CG2-OE1 3.29Å; V886-E944 WeakPolarHBondContact CG2-OE1 3.37Å; N888-E944 PolarHBondContact ND2-OE1 2.93Å; D942-E944 PolarHBondContact O-N 2.61Å; E944-R1042 VanDerWaalsContact CD-C 3.46Å; E944-R1042 VanDerWaalsContact CD-CA 3.44Å; E944-R1042 HydrophobicContact CG-CB 3.93Å; E944-R1042 HydrophobicContact CG-CG 3.98Å; E944-R1042 WeakPolarHBondContact OE1-CA 3.35Å; E944-R1042 WeakPolarHBondContact OE2-CB 3.07Å; E944-W1043 PolarHBondContact OE1-N 3.2Å; E944-R1044 WeakPolarHBondContact OE1-CB 3.48Å; E944-R1044 PolarHBondContact OE1-N 2.98Å; E944-R1044 PolarHBondContact OE2-N 3.04Å; E944-T1045 HydrophobicContact CB-CG2 4.44Å; E944-T1045 WeakPolarHBondContact OE2-CB 3.47Å; E944-T1045 WeakPolarHBondContact OE2-CG2 3.32Å; E944-T1045 PolarHBondContact OE2-N 2.96Å; E944-T1045 PolarHBondContact OE2-OG1 3.41Å
945	N	89	Confident	71	Confident	94 Å²	94	82.9 Å²	82.9	50%	0.503	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-18.8	172.2	-63.2	-26.4	0	0	0	112.2	C941 D942 L943 K947 R1044	C941-N945 PolarHBondContact O-ND2 2.94Å; C941-N945 VanDerWaalsContact O-ND2 3.15Å; D942-N945 CarbonylContact O-C 3.54Å; D942-N945 WeakPolarHBondContact O-CA 3.41Å; D942-N945 WeakPolarHBondContact O-CB 3.21Å; D942-N945 PolarHBondContact O-N 3.25Å; D942-N945 PolarHBondContact OD1-ND2 3.06Å; L943-N945 VanDerWaalsContact C-N 3.34Å; N945-K947 PolarHBondContact O-N 3.39Å; N945-K947 VanDerWaalsContact O-N 3.08Å; N945-R1044 PolarHBondContact OD1-NH2 3.38Å
946	E	84.7	Confident	68	Low	56 Å²	56	89.6 Å²	89.6	26%	0.262	47%	0.466	S	S	.	.	S	Bend	trans	-65	103.7	178.7	-170.6	170.8	-158.6	0	0	111.5	D942 T948 P983 R987	D942-E946 PolarHBondContact O-N 3.38Å; E946-T948 PolarHBondContact O-N 2.98Å; E946-P983 WeakPolarHBondContact OE1-CB 3.28Å; E946-P983 WeakPolarHBondContact OE1-CG 3.33Å; E946-R987 IonicContact OE1-CZ 3.43Å; E946-R987 IonicContact OE1-NH1 2.76Å; E946-R987 PolarHBondContact OE1-NH1 3.36Å; E946-R987 IonicContact OE1-NH2 2.74Å; E946-R987 IonicContact OE2-CZ 3.76Å; E946-R987 IonicContact OE2-NH1 3.26Å; E946-R987 PolarHBondContact OE2-NH1 2.81Å; E946-R987 IonicContact OE2-NH2 3.54Å; E946-R987 PolarHBondContact OE2-NH2 2.84Å
947	K	63.5	Low	64.9	Low	201 Å²	201	92.5 Å²	92.5	87%	0.874	50%	0.496	S	S	*	.			trans	-64.7	100.9	-177.1	-69.9	-180	-178.8	172.6	0	111.8	N945 S949	N945-K947 PolarHBondContact O-N 3.39Å; N945-K947 VanDerWaalsContact O-N 3.08Å; K947-S949 PolarHBondContact O-N 3.45Å
948	T	61.4	Low	62	Low	66 Å²	66	98.1 Å²	98.1	41%	0.405	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-63.6	132.4	172.3	55	0	0	0	0	110.8	E946 P950 E982	E946-T948 PolarHBondContact O-N 2.98Å; T948-P950 WeakPolarHBondContact O-CD 3.45Å; T948-E982 HydrophobicContact CG2-CG 4.44Å
949	S	38.7	Very low	59	Low	110 Å²	110	103.6 Å²	103.6	77%	0.769	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-67	122.5	179	-75	0	0	0	0	110.4	K947 T951	K947-S949 PolarHBondContact O-N 3.45Å; S949-T951 PolarHBondContact O-N 3.41Å; S949-T951 VanDerWaalsContact O-N 3.14Å
950	P	41.2	Very low	55.9	Low	126 Å²	126	106.7 Å²	106.7	82%	0.818	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-58.7	119.8	-175	-27.4	35.5	0	0	0	112.6	T948 R952	T948-P950 WeakPolarHBondContact O-CD 3.45Å; P950-R952 PolarHBondContact O-N 2.82Å
951	T	37.2	Very low	52.8	Low	122 Å²	122	116.1 Å²	116.1	75%	0.748	64%	0.639	S	S	*	*			trans	-65.9	96.4	-179.3	-51.9	0	0	0	0	110.4	S949 R953	S949-T951 PolarHBondContact O-N 3.41Å; S949-T951 VanDerWaalsContact O-N 3.14Å; T951-R953 PolarHBondContact O-N 3.1Å
952	R	28.2	Very low	49.8	Very low	229 Å²	229	123.4 Å²	123.4	86%	0.864	68%	0.677	S	S	*	*			trans	-53.2	107.6	-176.1	-162	-179.1	-163	-176.7	6.3	110.6	P950 L954	P950-R952 PolarHBondContact O-N 2.82Å; R952-L954 PolarHBondContact O-N 3.44Å; R952-L954 VanDerWaalsContact O-N 3.13Å
953	R	29.8	Very low	46.7	Very low	235 Å²	235	124.4 Å²	124.4	89%	0.887	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-60.1	116.6	176.4	-60.9	-171.7	-165.7	-152.9	5.7	108.8	T951	T951-R953 PolarHBondContact O-N 3.1Å
954	L	29.7	Very low	43.5	Very low	164 Å²	164	132 Å²	132	86%	0.859	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-73.2	127.6	169.3	-74	168.1	0	0	0	108.8	R952	R952-L954 PolarHBondContact O-N 3.44Å; R952-L954 VanDerWaalsContact O-N 3.13Å
955	S	28.4	Very low	40.6	Very low	113 Å²	113	139.5 Å²	139.5	79%	0.79	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-66	130.5	179.4	-50.8	0	0	0	0	110.6	G957	S955-G957 PolarHBondContact O-N 2.96Å
956	P	36	Very low	37.7	Very low	141 Å²	141	142.2 Å²	142.2	92%	0.916	79%	0.787	S	S	*	*			trans	-75.3	90.3	-179.5	30	-34.4	0	0	0	111.1
957	G	32.7	Very low	34.9	Very low	62 Å²	62	146.7 Å²	146.7	64%	0.639	81%	0.813	S	S	*	*			trans	-103.2	147.4	170.1	0	0	0	0	0	112.2	S955	S955-G957 PolarHBondContact O-N 2.96Å
958	S	36.8	Very low	33.1	Very low	119 Å²	119	141.7 Å²	141.7	83%	0.832	80%	0.802	S	S	*	*	S	Bend	trans	84.3	85.5	172	-49.8	0	0	0	0	118.4
959	K	33	Very low	31.6	Very low	218 Å²	218	143.4 Å²	143.4	95%	0.948	82%	0.823	S	S	*	*			trans	48.9	92.6	133.9	-59.6	179.4	-178.8	179.4	0	118.2
960	G	31.7	Very low	31.3	Very low	76 Å²	76	140 Å²	140	78%	0.784	80%	0.798	S	S	*	*			trans	-153.4	112.4	156.4	0	0	0	0	0	110.3	N962	G960-N962 PolarHBondContact O-N 2.93Å
961	Q	31.3	Very low	31	Very low	197 Å²	197	136.6 Å²	136.6	92%	0.921	78%	0.777	S	S	*	*			trans	-86.1	106.1	-179.3	-72.6	171.2	-65.9	0	0	110.8
962	N	32.7	Very low	31.2	Very low	175 Å²	175	133.3 Å²	133.3	94%	0.936	76%	0.757	S	S	*	*			trans	-153.9	152.2	145.1	-102.1	-33.5	0	0	0	109.3	G960	G960-N962 PolarHBondContact O-N 2.93Å
963	A	29.4	Very low	31.7	Very low	86 Å²	86	126.8 Å²	126.8	71%	0.711	75%	0.746	S	S	*	*			trans	-106.3	154.2	-151.8	0	0	0	0	0	115
964	L	26.5	Very low	32.4	Very low	166 Å²	166	122.9 Å²	122.9	87%	0.869	74%	0.737	S	S	*	*			trans	58.2	85.4	153.8	-63.7	164	0	0	0	117.7
965	I	29.9	Very low	33.1	Very low	174 Å²	174	115.6 Å²	115.6	89%	0.892	70%	0.7	S	S	*	*				-162.7	125.3	120	-91.6	145	0	0	0	106
966	N	28.2	Very low	34.1	Very low	150 Å²	150	111.6 Å²	111.6	80%	0.802	67%	0.669	S	S	*	*			trans	-146.6	151	-176.2	-119.2	-11.4	0	0	0	110.8
967	N	27.2	Very low	34.7	Very low	150 Å²	150	105.3 Å²	105.3	80%	0.802	63%	0.63	S	S	*	*			trans	60	81.4	165.9	-59.5	-11.6	0	0	0	118
968	C	25.9	Very low	35.7	Very low	97 Å²	97	110 Å²	110	66%	0.655	63%	0.629	S	S	*	*			trans	-141.7	64.3	149.7	-163.7	0	0	0	0	110.2	T970	C968-T970 PolarHBondContact O-N 2.63Å
969	A	28.3	Very low	36.8	Very low	102 Å²	102	105.6 Å²	105.6	84%	0.843	60%	0.601	S	S	*	*			trans	-88.4	71.2	178.5	0	0	0	0	0	110.5
970	T	32.4	Very low	38.8	Very low	38 Å²	38	99.2 Å²	99.2	23%	0.233	58%	0.577	C	S	.	*			trans	-102.5	125.4	-170	51.3	0	0	0	0	114.1	K788 C968 T972	K788-T970 WeakPolarHBondContact CE-OG1 3.46Å; K788-T970 PolarHBondContact NZ-OG1 3.22Å; C968-T970 PolarHBondContact O-N 2.63Å; T970-T972 VanDerWaalsContact C-N 3.27Å; T970-T972 PolarHBondContact O-N 2.86Å; T970-T972 PolarHBondContact O-OG1 2.8Å
971	S	36.5	Very low	41.1	Very low	54 Å²	54	104.4 Å²	104.4	38%	0.378	58%	0.578	S	S	.	*	S	Bend	trans	50.2	-35.8	167.1	-72	0	0	0	0	121.5	S973 Y1048	S971-S973 PolarHBondContact O-N 2.97Å; S971-Y1048 PolarHBondContact OG-OH 3.32Å
972	T	41.8	Very low	43.8	Very low	54 Å²	54	95.9 Å²	95.9	33%	0.331	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-4.7	-171.9	34.5	0	0	0	0	115.3	D391 T970 H974	D391-T972 WeakPolarHBondContact OD1-CG2 3.17Å; D391-T972 WeakPolarHBondContact OD2-CG2 3.35Å; D391-T972 PolarHBondContact OD2-OG1 2.72Å; T970-T972 VanDerWaalsContact C-N 3.27Å; T970-T972 PolarHBondContact O-N 2.86Å; T970-T972 PolarHBondContact O-OG1 2.8Å; T972-H974 PolarHBondContact O-N 3.13Å
973	S	37.8	Very low	46.6	Very low	92 Å²	92	89.9 Å²	89.9	64%	0.643	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-13.7	-178.9	56.6	0	0	0	0	115.9	S971	S971-S973 PolarHBondContact O-N 2.97Å
974	H	44.5	Very low	49.7	Very low	152 Å²	152	85.8 Å²	85.8	70%	0.704	48%	0.475	S	S	*	.	S	Bend	trans	-86.4	-24.8	178.6	-72.9	-84	0	0	0	113.5	T972	T972-H974 PolarHBondContact O-N 3.13Å
975	L	44.3	Very low	52.9	Low	12 Å²	12	78.1 Å²	78.1	6%	0.063	44%	0.435	C	S	.	.	S	Bend	trans	-88.8	-15.5	-171.9	-106.7	168.2	0	0	0	114.7	W398 D1046	W398-L975 HydrophobicContact CH2-CB 4.02Å; W398-L975 HydrophobicContact CH2-CD1 4.05Å; W398-L975 HydrophobicContact CZ3-CB 4.15Å; W398-L975 HydrophobicContact CZ3-CD1 3.85Å; W398-L975 HydrophobicContact CZ3-CD2 4.12Å; W398-L975 HydrophobicContact CZ3-CG 4.28Å; L975-D1046 HydrophobicContact CD2-CB 3.67Å; L975-D1046 HydrophobicContact CG-CB 4.15Å
976	L	49.4	Very low	55.9	Low	29 Å²	29	73.4 Å²	73.4	15%	0.152	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-133.6	112	-168.3	-77.4	178.5	0	0	0	112.2	W398 L409 R978 Y1039	W398-L976 HydrophobicContact CH2-CD1 3.72Å; W398-L976 HydrophobicContact CH2-CD2 4.39Å; W398-L976 HydrophobicContact CH2-CG 3.83Å; W398-L976 HydrophobicContact CZ2-CD1 3.8Å; W398-L976 HydrophobicContact CZ2-CG 4.41Å; L409-L976 HydrophobicContact CD1-CD1 4.33Å; L409-L976 HydrophobicContact CD1-CD2 3.86Å; L409-L976 HydrophobicContact CD2-CD2 4.34Å; L976-R978 PolarHBondContact O-N 3.02Å; L976-Y1039 HydrophobicContact CD1-CD1 3.85Å; L976-Y1039 HydrophobicContact CD1-CE1 4.17Å; L976-Y1039 HydrophobicContact CD2-CD1 3.76Å; L976-Y1039 HydrophobicContact CD2-CG 4.4Å; L976-Y1039 HydrophobicContact CG-CD1 4.33Å
977	G	48.8	Very low	59.1	Low	9 Å²	9	69.6 Å²	69.6	9%	0.093	39%	0.389	C	S	.	.			trans	-64.8	66	164.3	0	0	0	0	0	112.9	G979 E982 V1040	G977-G979 PolarHBondContact O-N 3.43Å; G977-E982 WeakPolarHBondContact CA-OE1 3.42Å; G977-V1040 PolarHBondContact N-O 3.43Å
978	R	53.7	Low	62.4	Low	161 Å²	161	62.4 Å²	62.4	61%	0.608	35%	0.35	S	S	*	.			trans	-75.7	90.2	-178.2	-107.9	-168	170.8	174.9	4.9	111.2	L976 Y1039	L976-R978 PolarHBondContact O-N 3.02Å; R978-Y1039 HydrophobicContact CG-CD1 4.37Å; R978-Y1039 HydrophobicContact CG-CE1 4.04Å; R978-Y1039 PolarHBondContact NE-OH 3.49Å; R978-Y1039 VanDerWaalsContact NE-OH 3.16Å; R978-Y1039 PolarHBondContact NH2-OH 2.88Å
979	G	59.6	Low	65.8	Low	25 Å²	25	58.1 Å²	58.1	26%	0.258	32%	0.321	S	S	.	.	S	Bend	trans	159	150.9	165.8	0	0	0	0	0	113.5	G977 K981 I985	G977-G979 PolarHBondContact O-N 3.43Å; G979-K981 PolarHBondContact O-N 3.21Å; G979-I985 WeakPolarHBondContact O-CD1 3.05Å
980	L	75.4	Confident	68.9	Low	85 Å²	85	58.9 Å²	58.9	45%	0.445	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	34.2	179.6	-49.7	172.2	0	0	0	113.6	P1035 A1038	L980-P1035 WeakPolarHBondContact CD1-O 3.35Å; L980-P1035 HydrophobicContact CD2-CB 3.76Å; L980-P1035 HydrophobicContact CD2-CG 4.09Å; L980-P1035 WeakPolarHBondContact CD2-O 3.4Å; L980-A1038 HydrophobicContact CD2-CB 3.99Å
981	K	79.9	Confident	72	Confident	184 Å²	184	58 Å²	58	80%	0.8	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.8	-3.2	-171.8	-67	-168.7	176.8	-172.7	0	113.9	G979	G979-K981 PolarHBondContact O-N 3.21Å
982	E	86.8	Confident	74.8	Confident	18 Å²	18	55.4 Å²	55.4	8%	0.084	28%	0.283	C	S	.	.	S	Bend	trans	-72.1	141.9	171.6	-59.3	-145.8	160.9	0	0	110.8	T948 G977 I984 I985 T986 V1040 R1042	T948-E982 HydrophobicContact CG2-CG 4.44Å; G977-E982 WeakPolarHBondContact CA-OE1 3.42Å; E982-I984 VanDerWaalsContact C-N 3.31Å; E982-I984 HydrophobicContact CB-CG2 4.07Å; E982-I984 PolarHBondContact O-N 3.4Å; E982-I985 HydrophobicContact CB-CD1 3.92Å; E982-I985 HydrophobicContact CB-CG1 4.27Å; E982-I985 HydrophobicContact CG-CD1 4.26Å; E982-I985 PolarHBondContact O-N 2.93Å; E982-I985 VanDerWaalsContact O-N 3.14Å; E982-T986 PolarHBondContact O-N 3.46Å; E982-V1040 WeakPolarHBondContact OE2-CB 3.09Å; E982-V1040 WeakPolarHBondContact OE2-CG2 3.41Å; E982-R1042 VanDerWaalsContact CD-NH1 3.33Å; E982-R1042 IonicContact OE1-CZ 2.63Å; E982-R1042 IonicContact OE1-NH1 3.61Å; E982-R1042 PolarHBondContact OE1-NH1 3.45Å; E982-R1042 IonicContact OE1-NH2 2.81Å; E982-R1042 IonicContact OE2-CZ 2.69Å; E982-R1042 VanDerWaalsContact OE2-CZ 3.29Å; E982-R1042 IonicContact OE2-NH1 3.38Å; E982-R1042 PolarHBondContact OE2-NH1 3.01Å; E982-R1042 IonicContact OE2-NH2 3.88Å; E982-R1042 PolarHBondContact OE2-NH2 3.36Å
983	P	92.1	Very high	77.3	Confident	49 Å²	49	57.2 Å²	57.2	32%	0.318	28%	0.284	S	S	.	.	H	α-helix	trans	-54.7	-44.2	177.7	-29	37.3	0	0	0	113.1	E946 I985 T986 R987	E946-P983 WeakPolarHBondContact OE1-CB 3.28Å; E946-P983 WeakPolarHBondContact OE1-CG 3.33Å; P983-I985 VanDerWaalsContact C-N 3.27Å; P983-I985 PolarHBondContact O-N 3.06Å; P983-T986 WeakPolarHBondContact O-CA 3.45Å; P983-T986 VanDerWaalsContact O-CB 3.25Å; P983-T986 WeakPolarHBondContact O-CB 3.48Å; P983-T986 PolarHBondContact O-N 2.85Å; P983-R987 VanDerWaalsContact CB-NH1 3.27Å; P983-R987 PolarHBondContact O-N 3.17Å
984	I	94.4	Very high	80	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-57.6	-34.1	178.2	-167.2	69.2	0	0	0	113.4	V890 E918 L919 V935 L943 E982 T986 R987 A988 V1040	V890-I984 HydrophobicContact CG2-CG1 3.71Å; V890-I984 HydrophobicContact CG2-CG2 4.26Å; E918-I984 HydrophobicContact CG-CD1 4.02Å; E918-I984 WeakPolarHBondContact OE1-CD1 3.18Å; L919-I984 HydrophobicContact CD1-CD1 3.75Å; L919-I984 HydrophobicContact CD1-CG1 4.41Å; L919-I984 HydrophobicContact CD2-CD1 4.05Å; L919-I984 HydrophobicContact CD2-CG1 4.19Å; L919-I984 HydrophobicContact CG-CD1 3.82Å; L919-I984 HydrophobicContact CG-CG1 4.48Å; V935-I984 HydrophobicContact CG2-CD1 4.28Å; L943-I984 HydrophobicContact CD1-CB 3.78Å; L943-I984 HydrophobicContact CD1-CD1 4.23Å; L943-I984 HydrophobicContact CD1-CG1 3.93Å; L943-I984 HydrophobicContact CD1-CG2 3.95Å; L943-I984 HydrophobicContact CD2-CG1 4.43Å; E982-I984 VanDerWaalsContact C-N 3.31Å; E982-I984 HydrophobicContact CB-CG2 4.07Å; E982-I984 PolarHBondContact O-N 3.4Å; I984-T986 VanDerWaalsContact C-N 3.32Å; I984-R987 PolarHBondContact O-N 2.82Å; I984-A988 WeakPolarHBondContact O-CB 3.24Å; I984-A988 PolarHBondContact O-N 3.15Å; I984-V1040 HydrophobicContact CG2-CG1 4.07Å; I984-V1040 HydrophobicContact CG2-CG2 3.65Å
985	I	94.1	Very high	82.3	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.026	23%	0.234	C	C	.	.	H	α-helix	trans	-70	-34.2	175.2	-63.8	163.2	0	0	0	110.3	V890 L892 G979 E982 P983 M989 A1038 V1040	V890-I985 HydrophobicContact CG1-CG1 4.21Å; L892-I985 HydrophobicContact CD2-CG1 4.46Å; L892-I985 HydrophobicContact CD2-CG2 3.98Å; G979-I985 WeakPolarHBondContact O-CD1 3.05Å; E982-I985 HydrophobicContact CB-CD1 3.92Å; E982-I985 HydrophobicContact CB-CG1 4.27Å; E982-I985 HydrophobicContact CG-CD1 4.26Å; E982-I985 PolarHBondContact O-N 2.93Å; E982-I985 VanDerWaalsContact O-N 3.14Å; P983-I985 VanDerWaalsContact C-N 3.27Å; P983-I985 PolarHBondContact O-N 3.06Å; I985-M989 WeakPolarHBondContact O-CB 3.4Å; I985-M989 VanDerWaalsContact O-CG 3.28Å; I985-M989 WeakPolarHBondContact O-CG 3.37Å; I985-M989 PolarHBondContact O-N 2.97Å; I985-A1038 HydrophobicContact CD1-CB 3.57Å; I985-A1038 HydrophobicContact CG1-CB 4.15Å; I985-A1038 HydrophobicContact CG2-CB 4.42Å; I985-V1040 HydrophobicContact CD1-CG2 4.04Å; I985-V1040 HydrophobicContact CG1-CG2 3.99Å
986	T	93.7	Very high	84.6	Confident	75 Å²	75	48.9 Å²	48.9	46%	0.46	24%	0.24	S	C	.	.	H	α-helix	trans	-67.4	-44.1	174.5	-53.2	0	0	0	0	110.5	E982 P983 I984 M989 Q990	E982-T986 PolarHBondContact O-N 3.46Å; P983-T986 WeakPolarHBondContact O-CA 3.45Å; P983-T986 VanDerWaalsContact O-CB 3.25Å; P983-T986 WeakPolarHBondContact O-CB 3.48Å; P983-T986 PolarHBondContact O-N 2.85Å; I984-T986 VanDerWaalsContact C-N 3.32Å; T986-M989 CarbonylContact O-C 3.49Å; T986-M989 PolarHBondContact O-N 3Å; T986-Q990 WeakPolarHBondContact O-CG 3.27Å; T986-Q990 PolarHBondContact O-N 3.28Å; T986-Q990 PolarHBondContact O-OE1 2.86Å
987	R	95.4	Very high	86.2	Confident	70 Å²	70	50.1 Å²	50.1	26%	0.264	25%	0.249	S	C	.	.	H	α-helix	trans	-62.5	-45.5	176	-61.7	-169	-63	-100.8	7.6	111.7	E918 L919 E946 P983 I984 M989 Q990 V991	E918-R987 IonicContact OE1-CZ 2.85Å; E918-R987 IonicContact OE1-NE 3.53Å; E918-R987 PolarHBondContact OE1-NE 3.07Å; E918-R987 IonicContact OE1-NH2 3.78Å; E918-R987 PolarHBondContact OE1-NH2 3.41Å; L919-R987 HydrophobicContact CD1-CB 3.83Å; E946-R987 IonicContact OE1-CZ 3.43Å; E946-R987 IonicContact OE1-NH1 2.76Å; E946-R987 PolarHBondContact OE1-NH1 3.36Å; E946-R987 IonicContact OE1-NH2 2.74Å; E946-R987 IonicContact OE2-CZ 3.76Å; E946-R987 IonicContact OE2-NH1 3.26Å; E946-R987 PolarHBondContact OE2-NH1 2.81Å; E946-R987 IonicContact OE2-NH2 3.54Å; E946-R987 PolarHBondContact OE2-NH2 2.84Å; P983-R987 VanDerWaalsContact CB-NH1 3.27Å; P983-R987 PolarHBondContact O-N 3.17Å; I984-R987 PolarHBondContact O-N 2.82Å; R987-M989 VanDerWaalsContact C-N 3.32Å; R987-M989 PolarHBondContact O-N 3.03Å; R987-Q990 WeakPolarHBondContact O-CA 3.34Å; R987-Q990 WeakPolarHBondContact O-CB 3.14Å; R987-Q990 PolarHBondContact O-N 3.46Å; R987-V991 PolarHBondContact O-N 3.49Å
988	A	96.6	Very high	86.8	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.6	-39.1	173.8	0	0	0	0	0	112.8	L892 L919 I984 Q990 V991 L992	L892-A988 HydrophobicContact CD1-CB 4.03Å; L919-A988 HydrophobicContact CD1-CB 3.92Å; L919-A988 HydrophobicContact CD2-CB 3.9Å; I984-A988 WeakPolarHBondContact O-CB 3.24Å; I984-A988 PolarHBondContact O-N 3.15Å; A988-Q990 VanDerWaalsContact C-N 3.27Å; A988-Q990 PolarHBondContact O-N 2.61Å; A988-V991 PolarHBondContact O-N 3.01Å; A988-L992 WeakPolarHBondContact O-CB 3.42Å; A988-L992 VanDerWaalsContact O-CG 3.3Å; A988-L992 WeakPolarHBondContact O-CG 3.42Å; A988-L992 PolarHBondContact O-N 3.26Å
989	M	95.4	Very high	86.5	Confident	7 Å²	7	53.9 Å²	53.9	3%	0.034	27%	0.271	C	S	.	.	H	α-helix	trans	-75.7	-8	173.5	-70.1	-57.1	-52.8	0	0	114.2	L892 F894 I985 T986 R987 L992 R993 I1032 P1033 P1035	L892-M989 HydrophobicContact CD1-SD 4.36Å; F894-M989 HydrophobicContact CE1-CE 4.14Å; F894-M989 HydrophobicContact CE1-SD 3.86Å; F894-M989 HydrophobicContact CZ-SD 3.8Å; I985-M989 WeakPolarHBondContact O-CB 3.4Å; I985-M989 VanDerWaalsContact O-CG 3.28Å; I985-M989 WeakPolarHBondContact O-CG 3.37Å; I985-M989 PolarHBondContact O-N 2.97Å; T986-M989 CarbonylContact O-C 3.49Å; T986-M989 PolarHBondContact O-N 3Å; R987-M989 VanDerWaalsContact C-N 3.32Å; R987-M989 PolarHBondContact O-N 3.03Å; M989-L992 HydrophobicContact SD-CD1 4.13Å; M989-R993 WeakPolarHBondContact O-CD 3.45Å; M989-R993 WeakPolarHBondContact O-CG 3.43Å; M989-R993 PolarHBondContact O-NH1 3.43Å; M989-I1032 HydrophobicContact CE-CG2 4.12Å; M989-P1033 WeakPolarHBondContact CE-O 3.35Å; M989-P1035 HydrophobicContact CG-CG 4.27Å; M989-P1035 HydrophobicContact SD-CG 3.8Å
990	Q	94.9	Very high	85.3	Confident	117 Å²	117	56.4 Å²	56.4	55%	0.547	30%	0.297	S	S	.	.	H	α-helix	trans	-83.1	-50.7	166.7	-72	166.6	-75.1	0	0	109.6	T986 R987 A988 L992 R993 G994	T986-Q990 WeakPolarHBondContact O-CG 3.27Å; T986-Q990 PolarHBondContact O-N 3.28Å; T986-Q990 PolarHBondContact O-OE1 2.86Å; R987-Q990 WeakPolarHBondContact O-CA 3.34Å; R987-Q990 WeakPolarHBondContact O-CB 3.14Å; R987-Q990 PolarHBondContact O-N 3.46Å; A988-Q990 VanDerWaalsContact C-N 3.27Å; A988-Q990 PolarHBondContact O-N 2.61Å; Q990-L992 PolarHBondContact O-N 2.82Å; Q990-R993 PolarHBondContact O-N 3.26Å; Q990-G994 PolarHBondContact O-N 3.36Å
991	V	96.1	Very high	83.2	Confident	20 Å²	20	56.6 Å²	56.6	12%	0.121	31%	0.306	C	S	.	.	H	α-helix	trans	-52.9	-53.1	175	175.1	0	0	0	0	111.5	H908 F922 R987 A988 R993 G994 I995	H908-V991 HydrophobicContact CB-CG1 3.9Å; H908-V991 VanDerWaalsContact CD2-CG1 3.48Å; H908-V991 WeakPolarHBondContact CD2-CG1 3.48Å; F922-V991 HydrophobicContact CE2-CG1 3.73Å; F922-V991 HydrophobicContact CZ-CB 4.23Å; F922-V991 HydrophobicContact CZ-CG1 3.91Å; R987-V991 PolarHBondContact O-N 3.49Å; A988-V991 PolarHBondContact O-N 3.01Å; V991-R993 PolarHBondContact O-N 3.1Å; V991-R993 VanDerWaalsContact O-N 3.13Å; V991-G994 PolarHBondContact O-N 2.92Å; V991-G994 VanDerWaalsContact O-N 3.08Å; V991-I995 HydrophobicContact CG1-CD1 3.89Å; V991-I995 PolarHBondContact O-N 3.07Å; V991-I995 VanDerWaalsContact O-N 3.09Å
992	L	95.9	Very high	80.9	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.2	-20.7	178.8	-68.1	171.7	0	0	0	113.9	L892 F894 F898 F906 F922 L931 A988 M989 Q990 F996	L892-L992 HydrophobicContact CD1-CD1 3.62Å; F894-L992 HydrophobicContact CZ-CD1 4.25Å; F898-L992 HydrophobicContact CZ-CD1 4.4Å; F906-L992 HydrophobicContact CE2-CD2 4.03Å; F906-L992 HydrophobicContact CZ-CD2 3.79Å; F922-L992 HydrophobicContact CD1-CD1 4.48Å; F922-L992 HydrophobicContact CD1-CD2 3.89Å; F922-L992 HydrophobicContact CD1-CG 4.36Å; F922-L992 HydrophobicContact CE1-CD1 3.88Å; F922-L992 HydrophobicContact CE1-CD2 3.72Å; F922-L992 HydrophobicContact CE1-CG 3.71Å; F922-L992 HydrophobicContact CZ-CD2 4.24Å; F922-L992 HydrophobicContact CZ-CG 4.14Å; L931-L992 HydrophobicContact CD1-CD1 3.93Å; L931-L992 HydrophobicContact CD1-CD2 3.71Å; A988-L992 WeakPolarHBondContact O-CB 3.42Å; A988-L992 VanDerWaalsContact O-CG 3.3Å; A988-L992 WeakPolarHBondContact O-CG 3.42Å; A988-L992 PolarHBondContact O-N 3.26Å; M989-L992 HydrophobicContact SD-CD1 4.13Å; Q990-L992 PolarHBondContact O-N 2.82Å; L992-F996 HydrophobicContact CD2-CD2 4.16Å; L992-F996 HydrophobicContact CD2-CE2 3.83Å; L992-F996 WeakPolarHBondContact O-CB 3.4Å; L992-F996 WeakPolarHBondContact O-CD2 3.32Å; L992-F996 PolarHBondContact O-N 2.87Å
993	R	94.6	Very high	78.2	Confident	92 Å²	92	60.7 Å²	60.7	35%	0.347	35%	0.346	S	S	.	.	H	α-helix	trans	-87.7	-31.4	173.9	-75.2	175.8	-173	136	-1.8	112.6	M989 Q990 V991 T997 I1032 N1034	M989-R993 WeakPolarHBondContact O-CD 3.45Å; M989-R993 WeakPolarHBondContact O-CG 3.43Å; M989-R993 PolarHBondContact O-NH1 3.43Å; Q990-R993 PolarHBondContact O-N 3.26Å; V991-R993 PolarHBondContact O-N 3.1Å; V991-R993 VanDerWaalsContact O-N 3.13Å; R993-T997 WeakPolarHBondContact O-CB 3.04Å; R993-T997 WeakPolarHBondContact O-CG2 3.25Å; R993-T997 PolarHBondContact O-N 3.29Å; R993-T997 PolarHBondContact O-OG1 3.28Å; R993-I1032 HydrophobicContact CG-CB 4.34Å; R993-N1034 PolarHBondContact NH2-OD1 3.2Å
994	G	93.8	Very high	75.2	Confident	22 Å²	22	64.1 Å²	64.1	23%	0.227	37%	0.371	C	S	.	.	H	α-helix	trans	-57	-61.9	168.7	0	0	0	0	0	109.5	Q990 V991 Q998	Q990-G994 PolarHBondContact O-N 3.36Å; V991-G994 PolarHBondContact O-N 2.92Å; V991-G994 VanDerWaalsContact O-N 3.08Å; G994-Q998 WeakPolarHBondContact O-CG 3.34Å
995	I	93.8	Very high	72.3	Confident	13 Å²	13	69.8 Å²	69.8	7%	0.067	41%	0.411	C	S	.	.	H	α-helix	trans	-56.1	-59.5	-178.1	-61	170.7	0	0	0	111.9	Y443 F906 V991 T997	Y443-I995 HydrophobicContact CD1-CB 4.5Å; Y443-I995 HydrophobicContact CD1-CG1 4.11Å; Y443-I995 HydrophobicContact CD1-CG2 3.91Å; Y443-I995 HydrophobicContact CD2-CD1 3.93Å; Y443-I995 HydrophobicContact CD2-CG1 4.27Å; Y443-I995 HydrophobicContact CD2-CG2 4.18Å; Y443-I995 HydrophobicContact CE1-CG2 3.75Å; Y443-I995 HydrophobicContact CE2-CG2 4.01Å; Y443-I995 HydrophobicContact CG-CD1 3.94Å; Y443-I995 HydrophobicContact CG-CG1 3.83Å; Y443-I995 HydrophobicContact CG-CG2 4.14Å; F906-I995 HydrophobicContact CD2-CD1 4.19Å; F906-I995 HydrophobicContact CE2-CD1 4.04Å; V991-I995 HydrophobicContact CG1-CD1 3.89Å; V991-I995 PolarHBondContact O-N 3.07Å; V991-I995 VanDerWaalsContact O-N 3.09Å; I995-T997 PolarHBondContact O-N 3.49Å
996	F	92	Very high	69.5	Low	45 Å²	45	78 Å²	78	20%	0.197	45%	0.453	C	S	.	.	H	α-helix	trans	-91.5	11.6	-165.5	-61.7	-74.6	0	0	0	115.8	F898 W899 F906 L992 I1032	F898-F996 HydrophobicContact CD2-CB 4.03Å; F898-F996 AromaticContact CD2-CD2 3.93Å; F898-F996 HydrophobicContact CD2-CD2 3.93Å; F898-F996 AromaticContact CD2-CG 3.9Å; F898-F996 HydrophobicContact CD2-CG 3.9Å; F898-F996 HydrophobicContact CE2-CB 4.4Å; F898-F996 AromaticContact CE2-CD2 3.66Å; F898-F996 HydrophobicContact CE2-CD2 3.66Å; F898-F996 HydrophobicContact CE2-CE2 4.19Å; F898-F996 HydrophobicContact CE2-CG 4.11Å; W899-F996 HydrophobicContact CB-CD1 4.49Å; W899-F996 HydrophobicContact CB-CE1 3.71Å; W899-F996 HydrophobicContact CB-CE2 4.21Å; W899-F996 HydrophobicContact CB-CZ 3.55Å; F906-F996 HydrophobicContact CE1-CE2 4.38Å; F906-F996 HydrophobicContact CE1-CZ 4.11Å; F906-F996 AromaticContact CE2-CE2 3.92Å; F906-F996 HydrophobicContact CE2-CE2 3.92Å; F906-F996 HydrophobicContact CE2-CZ 4.16Å; F906-F996 AromaticContact CZ-CE2 3.69Å; F906-F996 HydrophobicContact CZ-CE2 3.69Å; F906-F996 AromaticContact CZ-CZ 3.85Å; F906-F996 HydrophobicContact CZ-CZ 3.85Å; L992-F996 HydrophobicContact CD2-CD2 4.16Å; L992-F996 HydrophobicContact CD2-CE2 3.83Å; L992-F996 WeakPolarHBondContact O-CB 3.4Å; L992-F996 WeakPolarHBondContact O-CD2 3.32Å; L992-F996 PolarHBondContact O-N 2.87Å; F996-I1032 HydrophobicContact CB-CD1 3.59Å; F996-I1032 HydrophobicContact CB-CG1 4.24Å
997	T	82.4	Confident	66.7	Low	55 Å²	55	79.1 Å²	79.1	34%	0.337	46%	0.464	S	S	.	.	H	α-helix	trans	-111.7	-3.5	173.5	70.5	0	0	0	0	115.5	R993 I995 E999 I1032	R993-T997 WeakPolarHBondContact O-CB 3.04Å; R993-T997 WeakPolarHBondContact O-CG2 3.25Å; R993-T997 PolarHBondContact O-N 3.29Å; R993-T997 PolarHBondContact O-OG1 3.28Å; I995-T997 PolarHBondContact O-N 3.49Å; T997-E999 VanDerWaalsContact C-N 3.29Å; T997-E999 PolarHBondContact O-N 2.75Å; T997-I1032 HydrophobicContact CG2-CG1 3.7Å
998	Q	61.9	Low	63.8	Low	85 Å²	85	82.5 Å²	82.5	40%	0.397	49%	0.487	S	S	.	.			trans	-81.8	51.5	-175.9	-65.8	-104.7	39.4	0	0	113.9	Q446 H448 G994	Q446-Q998 PolarHBondContact O-NE2 3.43Å; H448-Q998 PolarHBondContact CD2-NE2 3.2Å; H448-Q998 VanDerWaalsContact CD2-NE2 3.33Å; H448-Q998 PolarHBondContact NE2-NE2 2.86Å; G994-Q998 WeakPolarHBondContact O-CG 3.34Å
999	E	46.8	Very low	60.9	Low	164 Å²	164	89.4 Å²	89.4	77%	0.766	52%	0.524	S	S	*	.			trans	-108.9	92.8	166.2	-77	-155.3	154.4	0	0	111.2	T997	T997-E999 VanDerWaalsContact C-N 3.29Å; T997-E999 PolarHBondContact O-N 2.75Å
1000	G	36.4	Very low	58.3	Low	78 Å²	78	96.8 Å²	96.8	80%	0.804	56%	0.564	S	S	*	*	S	Bend	trans	-176.2	-16.9	176.4	0	0	0	0	0	117.4
1001	S	30.8	Very low	55.7	Low	89 Å²	89	98.3 Å²	98.3	62%	0.622	58%	0.576	S	S	*	*			trans	-128	75.6	-167.8	47.5	0	0	0	0	113.2
1002	N	31.1	Very low	53.1	Low	171 Å²	171	104.4 Å²	104.4	91%	0.914	61%	0.608	S	S	*	*	S	Bend	trans	-159.8	56.5	163.1	-110.8	-22.1	0	0	0	113.7
1003	S	29.5	Very low	50.6	Low	118 Å²	118	108.8 Å²	108.8	83%	0.825	64%	0.638	S	S	*	*	S	Bend	trans	-162.8	46.5	172.7	69.3	0	0	0	0	115.1
1004	S	30.5	Very low	48	Very low	120 Å²	120	111.3 Å²	111.3	84%	0.839	66%	0.658	S	S	*	*			trans	-158.7	64.7	-178.9	62.6	0	0	0	0	116.7
1005	S	32.2	Very low	45.4	Very low	119 Å²	119	115.6 Å²	115.6	83%	0.832	69%	0.685	S	S	*	*			trans	-156.2	48	169.1	64.7	0	0	0	0	115.1
1006	I	35.4	Very low	43.2	Very low	178 Å²	178	120 Å²	120	91%	0.913	72%	0.717	S	S	*	*			trans	-124.2	116.8	162.4	-60.9	179.1	0	0	0	107.6
1007	S	36.2	Very low	40.5	Very low	98 Å²	98	125.4 Å²	125.4	69%	0.685	75%	0.748	S	S	*	*			trans	-133.6	125.4	-176.9	59.7	0	0	0	0	111.7
1008	N	33.7	Very low	38.4	Very low	142 Å²	142	128.9 Å²	128.9	76%	0.759	77%	0.773	S	S	*	*			trans	56.3	107.1	162.4	-53.8	-17.9	0	0	0	115.6
1009	N	36.5	Very low	37.1	Very low	144 Å²	144	132.9 Å²	132.9	77%	0.77	80%	0.797	S	S	*	*				-169.2	134.8	69.2	-83	-51	0	0	0	112.3
1010	N	40.9	Very low	36.6	Very low	162 Å²	162	128.4 Å²	128.4	87%	0.866	80%	0.795	S	S	*	*				-178	139.7	113.6	-96.4	-38	0	0	0	111.8
1011	N	38.8	Very low	36.6	Very low	149 Å²	149	133.6 Å²	133.6	80%	0.797	80%	0.801	S	S	*	*			trans	-87.1	133.2	169.4	-64.9	-57.7	0	0	0	109.5
1012	N	42.3	Very low	36.8	Very low	149 Å²	149	138.4 Å²	138.4	80%	0.797	81%	0.813	S	S	*	*				-178.6	136.5	113.9	-95.5	-30.2	0	0	0	115.7
1013	S	42.6	Very low	37.1	Very low	91 Å²	91	135.2 Å²	135.2	64%	0.636	80%	0.804	S	S	*	*			trans	57.1	116.3	141.8	67.8	0	0	0	0	122.4
1014	N	40	Very low	37.4	Very low	145 Å²	145	137.1 Å²	137.1	78%	0.775	81%	0.805	S	S	*	*			trans	89.7	119.9	131.7	-59.5	-10.6	0	0	0	121.5
1015	S	39.7	Very low	37.7	Very low	113 Å²	113	140 Å²	140	79%	0.79	81%	0.805	S	S	*	*			trans	63.4	140.4	146.5	51	0	0	0	0	119.8
1016	S	47.1	Very low	38.1	Very low	106 Å²	106	143.1 Å²	143.1	74%	0.741	81%	0.807	S	S	*	*			cis	-168.9	143.3	-10.3	47.3	0	0	0	0	111.7
1017	N	36.2	Very low	38.4	Very low	157 Å²	157	144 Å²	144	84%	0.84	80%	0.804	S	S	*	*			trans	26.3	107.7	159.1	-75.7	-2	0	0	0	120
1018	C	36.9	Very low	39	Very low	129 Å²	129	148.6 Å²	148.6	87%	0.872	81%	0.812	S	S	*	*			trans	-143.3	110.2	140.8	48.2	0	0	0	0	110.4
1019	N	36.2	Very low	40.2	Very low	168 Å²	168	149.9 Å²	149.9	90%	0.898	81%	0.81	S	S	*	*			trans	-84.8	128.7	176.1	-78.4	-33.5	0	0	0	110
1020	G	35.5	Very low	41.7	Very low	70 Å²	70	146.4 Å²	146.4	72%	0.722	79%	0.794	S	S	*	*			trans	-157.8	64.1	-172.6	0	0	0	0	0	115.5
1021	M	35.8	Very low	43.6	Very low	187 Å²	187	143.8 Å²	143.8	92%	0.921	78%	0.784	S	S	*	*			trans	41.3	82.4	157.6	-64.4	174.3	62.2	0	0	117.7
1022	H	35	Very low	46	Very low	191 Å²	191	137.2 Å²	137.2	88%	0.884	75%	0.749	S	S	*	*			trans	-72.2	126.9	159.7	-79.8	-71.3	0	0	0	111.2
1023	S	38.7	Very low	48.4	Very low	104 Å²	104	131.4 Å²	131.4	73%	0.727	72%	0.719	S	S	*	*			trans	-98.2	119.5	161.5	46.1	0	0	0	0	109.5	Q1025	S1023-Q1025 PolarHBondContact O-N 3.31Å
1024	N	34.6	Very low	50.7	Low	158 Å²	158	132.1 Å²	132.1	85%	0.845	72%	0.716	S	S	*	*			trans	-73.5	110.6	175.4	-74.7	-6.4	0	0	0	109.9
1025	Q	37.4	Very low	53.2	Low	179 Å²	179	125.6 Å²	125.6	84%	0.836	68%	0.681	S	S	*	*			trans	-98.6	106.9	161.5	-75	-170.4	-17.1	0	0	109.4	S1023 K1027	S1023-Q1025 PolarHBondContact O-N 3.31Å; Q1025-K1027 PolarHBondContact O-N 2.88Å
1026	E	40.6	Very low	55.7	Low	185 Å²	185	124.3 Å²	124.3	86%	0.864	67%	0.665	S	S	*	*			trans	-66.6	118.4	168.4	-63.4	179.4	132.8	0	0	109.4	K1028	E1026-K1028 PolarHBondContact O-N 2.89Å
1027	K	41.9	Very low	57.9	Low	197 Å²	197	120 Å²	120	86%	0.857	63%	0.634	S	S	*	*			trans	-64.3	105.4	170.8	-76.5	-168.2	172.8	-166.3	0	109.2	Q1025 K1029	Q1025-K1027 PolarHBondContact O-N 2.88Å; K1027-K1029 PolarHBondContact O-N 3.47Å
1028	K	48.1	Very low	60.6	Low	194 Å²	194	112.6 Å²	112.6	84%	0.843	59%	0.594	S	S	*	*			trans	-66.4	114.8	174.4	-79.1	-177.3	175.3	175.9	0	110.1	E1026 V1030	E1026-K1028 PolarHBondContact O-N 2.89Å; K1028-V1030 PolarHBondContact O-N 2.97Å
1029	K	59.2	Low	63.3	Low	169 Å²	169	106.5 Å²	106.5	74%	0.735	55%	0.553	S	S	*	*			trans	-52.2	121.9	170.2	-175.3	168.7	-173.8	166.7	0	110.2	K1027 V1031	K1027-K1029 PolarHBondContact O-N 3.47Å; K1029-V1031 PolarHBondContact O-N 3.41Å
1030	V	68.6	Low	66.1	Low	72 Å²	72	98.5 Å²	98.5	44%	0.436	51%	0.51	S	S	.	.			trans	-69.4	124	-179.2	-177.9	0	0	0	0	109.3	K1028 I1032	K1028-V1030 PolarHBondContact O-N 2.97Å; V1030-I1032 HydrophobicContact CG1-CD1 4.1Å
1031	V	81.1	Confident	68.9	Low	106 Å²	106	95.2 Å²	95.2	64%	0.642	48%	0.475	S	S	*	.			trans	-100.1	112.6	174.7	-179.3	0	0	0	0	108.7	K1029	K1029-V1031 PolarHBondContact O-N 3.41Å
1032	I	89.5	Confident	71.8	Confident	11 Å²	11	87.4 Å²	87.4	6%	0.056	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-69.6	118.3	176.6	-51.3	-54.5	0	0	0	109	F898 M989 R993 F996 T997 V1030	F898-I1032 HydrophobicContact CB-CD1 4Å; F898-I1032 HydrophobicContact CD1-CG2 4.01Å; F898-I1032 HydrophobicContact CD2-CD1 3.69Å; F898-I1032 HydrophobicContact CD2-CG2 4.06Å; F898-I1032 HydrophobicContact CE1-CG2 3.72Å; F898-I1032 HydrophobicContact CE2-CD1 4.35Å; F898-I1032 HydrophobicContact CE2-CG2 3.79Å; F898-I1032 HydrophobicContact CG-CD1 3.86Å; F898-I1032 HydrophobicContact CG-CG2 4.16Å; F898-I1032 HydrophobicContact CZ-CG2 3.61Å; M989-I1032 HydrophobicContact CE-CG2 4.12Å; R993-I1032 HydrophobicContact CG-CB 4.34Å; F996-I1032 HydrophobicContact CB-CD1 3.59Å; F996-I1032 HydrophobicContact CB-CG1 4.24Å; T997-I1032 HydrophobicContact CG2-CG1 3.7Å; V1030-I1032 HydrophobicContact CG1-CD1 4.1Å
1033	P	91	Very high	74.7	Confident	28 Å²	28	78.8 Å²	78.8	18%	0.182	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-68.5	156.2	-179.7	30	-34.9	0	0	0	111.2	F894 F898 M989	F894-P1033 HydrophobicContact CD1-CG 4.19Å; F894-P1033 WeakPolarHBondContact CE1-O 3.22Å; F898-P1033 HydrophobicContact CD1-CG 4.11Å; F898-P1033 HydrophobicContact CE1-CG 4.42Å; M989-P1033 WeakPolarHBondContact CE-O 3.35Å
1034	N	91.2	Very high	77.4	Confident	105 Å²	105	77.3 Å²	77.3	56%	0.561	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-68.8	154.3	163.1	-68.1	-30.7	0	0	0	109.6	R993	R993-N1034 PolarHBondContact NH2-OD1 3.2Å
1035	P	93.9	Very high	80.2	Confident	8 Å²	8	73 Å²	73	5%	0.052	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-62.7	145.9	171.9	-11.8	24.8	0	0	0	110.7	L892 I893 F894 L980 M989 D1037	L892-P1035 HydrophobicContact CB-CG 4.38Å; L892-P1035 HydrophobicContact CD2-CG 4.06Å; I893-P1035 CarbonylContact O-C 3.58Å; I893-P1035 WeakPolarHBondContact O-CA 3.35Å; I893-P1035 VanDerWaalsContact O-CB 3.29Å; I893-P1035 WeakPolarHBondContact O-CB 3.25Å; F894-P1035 HydrophobicContact CD1-CB 4.25Å; F894-P1035 HydrophobicContact CD1-CG 4.4Å; F894-P1035 HydrophobicContact CE1-CB 4.03Å; F894-P1035 HydrophobicContact CE1-CG 3.71Å; F894-P1035 HydrophobicContact CZ-CB 4.42Å; F894-P1035 HydrophobicContact CZ-CG 4Å; L980-P1035 WeakPolarHBondContact CD1-O 3.35Å; L980-P1035 HydrophobicContact CD2-CB 3.76Å; L980-P1035 HydrophobicContact CD2-CG 4.09Å; L980-P1035 WeakPolarHBondContact CD2-O 3.4Å; M989-P1035 HydrophobicContact CG-CG 4.27Å; M989-P1035 HydrophobicContact SD-CG 3.8Å; P1035-D1037 WeakPolarHBondContact CB-O 3.35Å
1036	I	92.2	Very high	82.9	Confident	86 Å²	86	64.6 Å²	64.6	44%	0.441	31%	0.314	S	S	.	.	S	Bend	trans	-81.9	-18.5	171.3	62.4	167.6	0	0	0	112.1	Y405 I893 E895	Y405-I1036 HydrophobicContact CE2-CD1 3.83Å; I893-I1036 HydrophobicContact CB-CG1 4.26Å; I893-I1036 HydrophobicContact CG2-CD1 4Å; I893-I1036 HydrophobicContact CG2-CG1 3.83Å; I893-I1036 WeakPolarHBondContact O-CG1 3.16Å; I893-I1036 PolarHBondContact O-N 3.08Å; E895-I1036 HydrophobicContact CB-CG2 4.23Å
1037	D	92.1	Very high	85.4	Confident	17 Å²	17	57.7 Å²	57.7	9%	0.091	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	159.2	170.6	-154.2	26.3	0	0	0	110.2	K402 I893 P1035 Y1039	K402-D1037 HydrophobicContact CD-CB 4.43Å; K402-D1037 WeakPolarHBondContact CD-OD2 3.42Å; K402-D1037 WeakPolarHBondContact CE-OD2 3.48Å; K402-D1037 IonicContact NZ-OD1 3.72Å; K402-D1037 PolarHBondContact NZ-OD1 3.39Å; K402-D1037 IonicContact NZ-OD2 3.83Å; K402-D1037 PolarHBondContact NZ-OD2 2.84Å; I893-D1037 HydrophobicContact CB-CB 4.19Å; I893-D1037 HydrophobicContact CD1-CB 4.24Å; I893-D1037 HydrophobicContact CG1-CB 4.43Å; I893-D1037 PolarHBondContact N-O 3.44Å; I893-D1037 PolarHBondContact O-N 3.1Å; P1035-D1037 WeakPolarHBondContact CB-O 3.35Å; D1037-Y1039 HydrophobicContact CB-CE2 4.29Å; D1037-Y1039 WeakPolarHBondContact OD2-CE2 3.38Å; D1037-Y1039 VanDerWaalsContact OD2-CZ 3.23Å; D1037-Y1039 PolarHBondContact OD2-OH 2.91Å
1038	A	93.4	Very high	88	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	151.3	175.1	0	0	0	0	0	112.1	V891 L892 L980 I985	V891-A1038 CarbonylContact O-C 3.57Å; V891-A1038 WeakPolarHBondContact O-CA 3.2Å; L892-A1038 HydrophobicContact CD2-CB 4.08Å; L980-A1038 HydrophobicContact CD2-CB 3.99Å; I985-A1038 HydrophobicContact CD1-CB 3.57Å; I985-A1038 HydrophobicContact CG1-CB 4.15Å; I985-A1038 HydrophobicContact CG2-CB 4.42Å
1039	Y	93.4	Very high	90.3	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.008	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	131.7	178.9	-59.6	-105.4	0	0	0	108.9	C400 L409 V890 V891 I893 L976 R978 D1037	C400-Y1039 HydrophobicContact CB-CE1 4.49Å; L409-Y1039 HydrophobicContact CD2-CG 4.4Å; V890-Y1039 CarbonylContact C-O 3.51Å; V890-Y1039 WeakPolarHBondContact CA-O 3.27Å; V891-Y1039 HydrophobicContact CB-CD2 4.41Å; V891-Y1039 PolarHBondContact N-O 3.17Å; V891-Y1039 PolarHBondContact O-N 3.34Å; I893-Y1039 HydrophobicContact CD1-CD2 4.45Å; I893-Y1039 HydrophobicContact CD1-CE2 3.92Å; L976-Y1039 HydrophobicContact CD1-CD1 3.85Å; L976-Y1039 HydrophobicContact CD1-CE1 4.17Å; L976-Y1039 HydrophobicContact CD2-CD1 3.76Å; L976-Y1039 HydrophobicContact CD2-CG 4.4Å; L976-Y1039 HydrophobicContact CG-CD1 4.33Å; R978-Y1039 HydrophobicContact CG-CD1 4.37Å; R978-Y1039 HydrophobicContact CG-CE1 4.04Å; R978-Y1039 PolarHBondContact NE-OH 3.49Å; R978-Y1039 VanDerWaalsContact NE-OH 3.16Å; R978-Y1039 PolarHBondContact NH2-OH 2.88Å; D1037-Y1039 HydrophobicContact CB-CE2 4.29Å; D1037-Y1039 WeakPolarHBondContact OD2-CE2 3.38Å; D1037-Y1039 VanDerWaalsContact OD2-CZ 3.23Å; D1037-Y1039 PolarHBondContact OD2-OH 2.91Å
1040	V	95	Very high	92	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	122.9	171.8	-178.2	0	0	0	0	107.1	K889 V890 L943 G977 E982 I984 I985	K889-V1040 WeakPolarHBondContact O-CA 2.91Å; V890-V1040 HydrophobicContact CG1-CG2 4.31Å; V890-V1040 HydrophobicContact CG2-CG1 4.41Å; V890-V1040 HydrophobicContact CG2-CG2 4.32Å; L943-V1040 HydrophobicContact CD2-CG1 4.21Å; G977-V1040 PolarHBondContact N-O 3.43Å; E982-V1040 WeakPolarHBondContact OE2-CB 3.09Å; E982-V1040 WeakPolarHBondContact OE2-CG2 3.41Å; I984-V1040 HydrophobicContact CG2-CG1 4.07Å; I984-V1040 HydrophobicContact CG2-CG2 3.65Å; I985-V1040 HydrophobicContact CD1-CG2 4.04Å; I985-V1040 HydrophobicContact CG1-CG2 3.99Å
1041	T	95.1	Very high	93.4	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-80.8	152.6	173.9	68.1	0	0	0	0	110.7	L409 N888 K889	L409-T1041 HydrophobicContact CB-CG2 3.84Å; L409-T1041 HydrophobicContact CD2-CG2 3.87Å; L409-T1041 HydrophobicContact CG-CG2 4.4Å; N888-T1041 VanDerWaalsContact CA-OG1 3.29Å; N888-T1041 WeakPolarHBondContact CA-OG1 3.3Å; N888-T1041 WeakPolarHBondContact CB-OG1 3.42Å; N888-T1041 VanDerWaalsContact CG-O 3.26Å; N888-T1041 PolarHBondContact OD1-O 3.06Å; N888-T1041 PolarHBondContact OD1-OG1 3.37Å; K889-T1041 HydrophobicContact CB-CG2 4.2Å; K889-T1041 PolarHBondContact N-OG1 3.44Å; K889-T1041 PolarHBondContact O-N 3.17Å
1042	R	96	Very high	94.2	Very high	24 Å²	24	28.4 Å²	28.4	9%	0.091	14%	0.142	C	C	.	.			trans	-141	78.3	171.5	-66.3	-164.6	167.7	77.8	6.5	109.3	N888 L943 E944 E982 T1045 D1046	N888-R1042 WeakPolarHBondContact OD1-CA 3.23Å; N888-R1042 PolarHBondContact OD1-N 3.33Å; L943-R1042 PolarHBondContact O-NE 2.77Å; E944-R1042 VanDerWaalsContact CD-C 3.46Å; E944-R1042 VanDerWaalsContact CD-CA 3.44Å; E944-R1042 HydrophobicContact CG-CB 3.93Å; E944-R1042 HydrophobicContact CG-CG 3.98Å; E944-R1042 WeakPolarHBondContact OE1-CA 3.35Å; E944-R1042 WeakPolarHBondContact OE2-CB 3.07Å; E982-R1042 VanDerWaalsContact CD-NH1 3.33Å; E982-R1042 IonicContact OE1-CZ 2.63Å; E982-R1042 IonicContact OE1-NH1 3.61Å; E982-R1042 PolarHBondContact OE1-NH1 3.45Å; E982-R1042 IonicContact OE1-NH2 2.81Å; E982-R1042 IonicContact OE2-CZ 2.69Å; E982-R1042 VanDerWaalsContact OE2-CZ 3.29Å; E982-R1042 IonicContact OE2-NH1 3.38Å; E982-R1042 PolarHBondContact OE2-NH1 3.01Å; E982-R1042 IonicContact OE2-NH2 3.88Å; E982-R1042 PolarHBondContact OE2-NH2 3.36Å; R1042-T1045 WeakPolarHBondContact CB-OG1 3.38Å; R1042-T1045 PolarHBondContact O-OG1 2.81Å; R1042-D1046 PolarHBondContact O-N 3Å
1043	W	96.2	Very high	94.6	Very high	9 Å²	9	30 Å²	30	3%	0.034	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-27.8	-170.4	-75.5	109.5	0	0	0	114.3	R396 W398 L409 N888 E944 D1046 R1050 G1051	R396-W1043 HydrophobicContact CG-CE3 4.31Å; R396-W1043 HydrophobicContact CG-CH2 4.29Å; R396-W1043 HydrophobicContact CG-CZ3 3.83Å; W398-W1043 HydrophobicContact CE3-CH2 4.05Å; W398-W1043 HydrophobicContact CE3-CZ2 4.25Å; L409-W1043 WeakPolarHBondContact O-CZ2 3.37Å; L409-W1043 PolarHBondContact O-NE1 3.14Å; L409-W1043 VanDerWaalsContact O-NE1 3.1Å; N888-W1043 PolarHBondContact OD1-N 3.31Å; E944-W1043 PolarHBondContact OE1-N 3.2Å; W1043-D1046 WeakPolarHBondContact O-CB 3.5Å; W1043-R1050 PolarHBondContact O-N 3.22Å; W1043-G1051 PolarHBondContact O-N 2.88Å
1044	R	95	Very high	94.9	Very high	74 Å²	74	28.9 Å²	28.9	28%	0.279	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-36.2	177.4	-170.2	178.8	67.7	-161.3	-2.7	112.5	V886 C941 E944 N945 R1050	V886-R1044 HydrophobicContact CB-CB 4.24Å; V886-R1044 HydrophobicContact CG2-CB 3.9Å; C941-R1044 VanDerWaalsContact CA-NH1 3.33Å; C941-R1044 PolarHBondContact O-NH2 3.48Å; C941-R1044 PolarHBondContact SG-NH1 2.83Å; E944-R1044 WeakPolarHBondContact OE1-CB 3.48Å; E944-R1044 PolarHBondContact OE1-N 2.98Å; E944-R1044 PolarHBondContact OE2-N 3.04Å; N945-R1044 PolarHBondContact OD1-NH2 3.38Å; R1044-R1050 WeakPolarHBondContact O-CA 3.29Å; R1044-R1050 WeakPolarHBondContact O-CD 3.5Å
1045	T	93.4	Very high	95.3	Very high	67 Å²	67	25.3 Å²	25.3	41%	0.411	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-14.8	177.3	49.9	0	0	0	0	113.3	E944 R1042 P1047 R1050	E944-T1045 HydrophobicContact CB-CG2 4.44Å; E944-T1045 WeakPolarHBondContact OE2-CB 3.47Å; E944-T1045 WeakPolarHBondContact OE2-CG2 3.32Å; E944-T1045 PolarHBondContact OE2-N 2.96Å; E944-T1045 PolarHBondContact OE2-OG1 3.41Å; R1042-T1045 WeakPolarHBondContact CB-OG1 3.38Å; R1042-T1045 PolarHBondContact O-OG1 2.81Å; T1045-P1047 WeakPolarHBondContact O-CD 3.43Å; T1045-P1047 VanDerWaalsContact O-N 3.15Å; T1045-R1050 PolarHBondContact O-NH1 3.22Å
1046	D	93.6	Very high	95.4	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.011	12%	0.118	C	C	.	.			trans	-52.5	113.2	170.6	-175.5	-4.5	0	0	0	111.5	R390 L975 R1042 W1043 Y1048 S1049 R1050	R390-D1046 IonicContact CZ-OD1 3.8Å; R390-D1046 IonicContact CZ-OD2 2.73Å; R390-D1046 IonicContact NH1-OD1 3.24Å; R390-D1046 IonicContact NH1-OD2 3.8Å; R390-D1046 PolarHBondContact NH1-OD2 3.45Å; R390-D1046 IonicContact NH2-OD1 3.72Å; R390-D1046 IonicContact NH2-OD2 3.47Å; R390-D1046 PolarHBondContact NH2-OD2 3.03Å; L975-D1046 HydrophobicContact CD2-CB 3.67Å; L975-D1046 HydrophobicContact CG-CB 4.15Å; R1042-D1046 PolarHBondContact O-N 3Å; W1043-D1046 WeakPolarHBondContact O-CB 3.5Å; D1046-Y1048 PolarHBondContact O-N 3.36Å; D1046-Y1048 PolarHBondContact OD1-N 3.17Å; D1046-S1049 PolarHBondContact O-N 3.45Å; D1046-S1049 VanDerWaalsContact O-N 3.1Å; D1046-S1049 WeakPolarHBondContact OD2-CB 3.29Å; D1046-R1050 WeakPolarHBondContact O-CD 3.35Å; D1046-R1050 PolarHBondContact O-N 3.22Å
1047	P	94.6	Very high	95.7	Very high	40 Å²	40	21.6 Å²	21.6	26%	0.26	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-5.9	179.8	31	-36.8	0	0	0	113.5	I831 T1045	I831-P1047 VanDerWaalsContact CD1-O 3.24Å; I831-P1047 WeakPolarHBondContact CD1-O 2.84Å; T1045-P1047 WeakPolarHBondContact O-CD 3.43Å; T1045-P1047 VanDerWaalsContact O-N 3.15Å
1048	Y	95.4	Very high	96	Very high	46 Å²	46	23.3 Å²	23.3	18%	0.18	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	15.2	177.1	-43.7	-63.4	0	0	0	112.3	S389 R390 S971 D1046	S389-Y1048 VanDerWaalsContact CB-CD1 3.44Å; S389-Y1048 VanDerWaalsContact CB-CE1 3.47Å; R390-Y1048 HydrophobicContact CG-CD2 3.79Å; R390-Y1048 HydrophobicContact CG-CE2 4.44Å; R390-Y1048 HydrophobicContact CG-CG 4.03Å; R390-Y1048 PolarHBondContact NH2-O 3.37Å; S971-Y1048 PolarHBondContact OG-OH 3.32Å; D1046-Y1048 PolarHBondContact O-N 3.36Å; D1046-Y1048 PolarHBondContact OD1-N 3.17Å
1049	S	95.8	Very high	96	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-143.5	-49.5	174.3	-153.1	0	0	0	0	113.9	R396 F884 D1046 G1051	R396-S1049 WeakPolarHBondContact CD-OG 3.43Å; F884-S1049 VanDerWaalsContact CE1-O 3.31Å; F884-S1049 WeakPolarHBondContact CE1-O 3.4Å; D1046-S1049 PolarHBondContact O-N 3.45Å; D1046-S1049 VanDerWaalsContact O-N 3.1Å; D1046-S1049 WeakPolarHBondContact OD2-CB 3.29Å; S1049-G1051 WeakPolarHBondContact CB-O 3.42Å; S1049-G1051 PolarHBondContact O-N 3.49Å; S1049-G1051 PolarHBondContact OG-O 3.33Å
1050	R	96.5	Very high	96.1	Very high	68 Å²	68	25.2 Å²	25.2	26%	0.257	13%	0.132	S	C	.	.	S	Bend	trans	57.5	30.2	-174.7	-60	-60.9	-155.1	-146.4	3.1	115.6	I831 E834 F884 W1043 R1044 T1045 D1046	I831-R1050 HydrophobicContact CD1-CB 4.47Å; I831-R1050 HydrophobicContact CD1-CG 3.68Å; E834-R1050 VanDerWaalsContact CD-NH2 3.34Å; E834-R1050 IonicContact OE1-CZ 2.88Å; E834-R1050 IonicContact OE1-NE 2.73Å; E834-R1050 IonicContact OE1-NH2 3.16Å; E834-R1050 PolarHBondContact OE1-NH2 3.26Å; E834-R1050 IonicContact OE2-CZ 2.95Å; E834-R1050 VanDerWaalsContact OE2-CZ 3.27Å; E834-R1050 IonicContact OE2-NE 2.87Å; E834-R1050 PolarHBondContact OE2-NE 3.1Å; E834-R1050 IonicContact OE2-NH2 2.9Å; E834-R1050 PolarHBondContact OE2-NH2 2.94Å; F884-R1050 WeakPolarHBondContact CD1-O 3.24Å; W1043-R1050 PolarHBondContact O-N 3.22Å; R1044-R1050 WeakPolarHBondContact O-CA 3.29Å; R1044-R1050 WeakPolarHBondContact O-CD 3.5Å; T1045-R1050 PolarHBondContact O-NH1 3.22Å; D1046-R1050 WeakPolarHBondContact O-CD 3.35Å; D1046-R1050 PolarHBondContact O-N 3.22Å
1051	G	96.7	Very high	96.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	146.1	177.5	-179.4	0	0	0	0	0	111.5	F884 G885 W1043 S1049	F884-G1051 VanDerWaalsContact CE1-C 3.46Å; G885-G1051 CarbonylContact O-C 3.54Å; G885-G1051 VanDerWaalsContact O-CA 3.23Å; G885-G1051 WeakPolarHBondContact O-CA 3.49Å; W1043-G1051 PolarHBondContact O-N 2.88Å; S1049-G1051 WeakPolarHBondContact CB-O 3.42Å; S1049-G1051 PolarHBondContact O-N 3.49Å; S1049-G1051 PolarHBondContact OG-O 3.33Å
1052	S	97.4	Very high	96.1	Very high	9 Å²	9	28 Å²	28	6%	0.063	15%	0.15	C	C	.	.	S	Bend	trans	-89.9	-59	-176.7	-59.7	0	0	0	0	111.8	R396 G885 L887	R396-S1052 WeakPolarHBondContact CD-O 3.4Å; R396-S1052 PolarHBondContact NH1-O 3.15Å; G885-S1052 PolarHBondContact O-N 3.17Å; L887-S1052 PolarHBondContact N-OG 3.09Å; L887-S1052 PolarHBondContact O-OG 2.98Å
1053	Y	98	Very high	96.2	Very high	45 Å²	45	28.6 Å²	28.6	18%	0.176	16%	0.16	C	C	.	.			trans	-162.7	169.1	179.4	42.2	-102.1	0	0	0	112.8	F702 A703 A705 F884 G885 L887 E1112 A1120	F702-Y1053 PolarHBondContact O-OH 2.73Å; F702-Y1053 VanDerWaalsContact O-OH 3.13Å; A703-Y1053 VanDerWaalsContact O-CE2 3.28Å; A703-Y1053 WeakPolarHBondContact O-CE2 3.32Å; A703-Y1053 PolarHBondContact O-OH 2.81Å; A705-Y1053 HydrophobicContact CB-CD2 4.03Å; A705-Y1053 HydrophobicContact CB-CE1 4.12Å; A705-Y1053 HydrophobicContact CB-CE2 3.45Å; A705-Y1053 VanDerWaalsContact CB-CE2 3.45Å; F884-Y1053 CarbonylContact C-O 3.55Å; F884-Y1053 WeakPolarHBondContact CD2-O 3.41Å; F884-Y1053 VanDerWaalsContact CE2-C 3.45Å; G885-Y1053 PolarHBondContact N-O 2.91Å; L887-Y1053 HydrophobicContact CD2-CE1 4.19Å; Y1053-E1112 WeakPolarHBondContact CA-OE2 3.44Å; Y1053-A1120 HydrophobicContact CD2-CB 3.39Å; Y1053-A1120 HydrophobicContact CE2-CB 4.01Å; Y1053-A1120 HydrophobicContact CG-CB 3.72Å
1054	S	98.3	Very high	96.3	Very high	4 Å²	4	28.2 Å²	28.2	3%	0.028	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	152.7	178.5	57.9	0	0	0	0	113.7	G883 Y1065 E1112	G883-S1054 VanDerWaalsContact O-CA 3.26Å; G883-S1054 WeakPolarHBondContact O-CA 3.25Å; S1054-Y1065 WeakPolarHBondContact OG-CE1 3.44Å; S1054-Y1065 PolarHBondContact OG-OH 3.3Å; S1054-E1112 PolarHBondContact N-OE2 3.44Å
1055	Y	98.4	Very high	96.4	Very high	31 Å²	31	24.8 Å²	24.8	12%	0.122	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	159.6	167.6	64.6	-96.8	0	0	0	109.6	T706 N710 L711 G883 A1057	T706-Y1055 HydrophobicContact CG2-CD1 3.9Å; T706-Y1055 HydrophobicContact CG2-CD2 3.91Å; T706-Y1055 HydrophobicContact CG2-CE1 4.03Å; T706-Y1055 HydrophobicContact CG2-CE2 4.04Å; T706-Y1055 HydrophobicContact CG2-CG 3.85Å; T706-Y1055 VanDerWaalsContact OG1-CE1 3.28Å; T706-Y1055 WeakPolarHBondContact OG1-CE1 3.49Å; T706-Y1055 VanDerWaalsContact OG1-CZ 3.27Å; T706-Y1055 PolarHBondContact OG1-OH 3.38Å; N710-Y1055 HydrophobicContact CB-CE2 3.78Å; L711-Y1055 HydrophobicContact CD2-CD2 3.81Å; L711-Y1055 HydrophobicContact CD2-CG 4.23Å; G883-Y1055 VanDerWaalsContact CA-CZ 3.46Å; G883-Y1055 VanDerWaalsContact CA-O 3.24Å; G883-Y1055 WeakPolarHBondContact CA-O 3.44Å; G883-Y1055 PolarHBondContact N-O 2.99Å; G883-Y1055 PolarHBondContact O-N 3.16Å; Y1055-A1057 HydrophobicContact CD2-CB 4.13Å; Y1055-A1057 HydrophobicContact CE2-CB 3.6Å; Y1055-A1057 PolarHBondContact O-N 3.31Å
1056	V	98	Very high	96.6	Very high	4 Å²	4	24.7 Å²	24.7	2%	0.024	14%	0.143	C	C	.	.			trans	-83.3	99.8	176.6	-170.2	0	0	0	0	109.5	S712 H715 Q718 A1060 Y1065	S712-V1056 PolarHBondContact N-O 2.71Å; H715-V1056 HydrophobicContact CB-CB 4.49Å; H715-V1056 HydrophobicContact CB-CG1 3.69Å; H715-V1056 VanDerWaalsContact O-CB 3.23Å; H715-V1056 WeakPolarHBondContact O-CB 3.22Å; H715-V1056 VanDerWaalsContact O-CG2 3.3Å; H715-V1056 WeakPolarHBondContact O-CG2 3.49Å; Q718-V1056 HydrophobicContact CG-CG2 4.15Å; V1056-A1060 HydrophobicContact CG1-CB 4.18Å; V1056-A1060 WeakPolarHBondContact CG1-O 3.34Å; V1056-Y1065 HydrophobicContact CG2-CE2 3.79Å
1057	A	98.1	Very high	96.8	Very high	12 Å²	12	27.1 Å²	27.1	10%	0.099	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-74.2	159.7	-177.6	0	0	0	0	0	112.5	N710 S712 R881 Y1055 G1059 A1060	N710-A1057 CarbonylContact O-C 3.59Å; N710-A1057 WeakPolarHBondContact O-CA 3.5Å; S712-A1057 WeakPolarHBondContact CB-O 3.43Å; R881-A1057 WeakPolarHBondContact O-CB 3.31Å; Y1055-A1057 HydrophobicContact CD2-CB 4.13Å; Y1055-A1057 HydrophobicContact CE2-CB 3.6Å; Y1055-A1057 PolarHBondContact O-N 3.31Å; A1057-G1059 PolarHBondContact O-N 3.41Å; A1057-G1059 VanDerWaalsContact O-N 3.17Å; A1057-A1060 HydrophobicContact CB-CB 4.41Å; A1057-A1060 WeakPolarHBondContact O-CA 3.5Å; A1057-A1060 VanDerWaalsContact O-CB 3.29Å; A1057-A1060 WeakPolarHBondContact O-CB 3.27Å; A1057-A1060 PolarHBondContact O-N 3.03Å
1058	V	96.9	Very high	97	Very high	53 Å²	53	25.3 Å²	25.3	32%	0.321	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	120.5	168.3	174	0	0	0	0	110.6	P490 N710 A1060	P490-V1058 HydrophobicContact CB-CG1 4.11Å; P490-V1058 HydrophobicContact CG-CG1 3.75Å; P490-V1058 WeakPolarHBondContact O-CG1 3.34Å; N710-V1058 PolarHBondContact O-N 3.42Å; V1058-A1060 VanDerWaalsContact C-N 3.34Å
1059	G	93.2	Very high	97.1	Very high	40 Å²	40	23.3 Å²	23.3	41%	0.412	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.1	2	-177.1	0	0	0	0	0	115.8	R881 A1057	R881-G1059 VanDerWaalsContact CD-O 3.27Å; R881-G1059 WeakPolarHBondContact CD-O 3.33Å; A1057-G1059 PolarHBondContact O-N 3.41Å; A1057-G1059 VanDerWaalsContact O-N 3.17Å
1060	A	96.5	Very high	97.2	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.008	16%	0.156	C	C	.	.			trans	-98.4	161	165.3	0	0	0	0	0	110.9	R881 L882 V1056 A1057 V1058 D1064	R881-A1060 HydrophobicContact CB-CB 3.94Å; L882-A1060 HydrophobicContact CD2-CB 4.42Å; V1056-A1060 HydrophobicContact CG1-CB 4.18Å; V1056-A1060 WeakPolarHBondContact CG1-O 3.34Å; A1057-A1060 HydrophobicContact CB-CB 4.41Å; A1057-A1060 WeakPolarHBondContact O-CA 3.5Å; A1057-A1060 VanDerWaalsContact O-CB 3.29Å; A1057-A1060 WeakPolarHBondContact O-CB 3.27Å; A1057-A1060 PolarHBondContact O-N 3.03Å; V1058-A1060 VanDerWaalsContact C-N 3.34Å; A1060-D1064 WeakPolarHBondContact CA-OD2 3.26Å
1061	T	96.2	Very high	97.2	Very high	53 Å²	53	24.3 Å²	24.3	33%	0.325	15%	0.145	S	C	.	.			trans	-136.3	168.9	176.6	75.4	0	0	0	0	111.2	A1063 D1064	T1061-A1063 PolarHBondContact O-N 2.83Å; T1061-A1063 PolarHBondContact OG1-N 2.97Å; T1061-D1064 PolarHBondContact N-OD2 2.92Å; T1061-D1064 WeakPolarHBondContact O-CB 3.49Å; T1061-D1064 PolarHBondContact O-N 3.08Å
1062	G	93.8	Very high	97.2	Very high	5 Å²	5	24.4 Å²	24.4	5%	0.052	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-34.4	172.8	0	0	0	0	0	113.7	D1064 Y1065 R1116	G1062-D1064 PolarHBondContact O-N 2.98Å; G1062-Y1065 WeakPolarHBondContact O-CB 3.26Å; G1062-Y1065 PolarHBondContact O-N 3.12Å; G1062-R1116 VanDerWaalsContact O-CD 3.31Å; G1062-R1116 WeakPolarHBondContact O-CD 3.36Å; G1062-R1116 WeakPolarHBondContact O-CG 3.49Å
1063	A	97.1	Very high	97.1	Very high	37 Å²	37	27.2 Å²	27.2	31%	0.306	16%	0.155	S	C	.	.	H	α-helix	trans	-63.8	-19.8	178.6	0	0	0	0	0	113.5	T1061 Y1065 D1066 I1067	T1061-A1063 PolarHBondContact O-N 2.83Å; T1061-A1063 PolarHBondContact OG1-N 2.97Å; A1063-Y1065 VanDerWaalsContact C-N 3.26Å; A1063-Y1065 PolarHBondContact O-N 3.24Å; A1063-D1066 PolarHBondContact O-N 2.78Å; A1063-I1067 VanDerWaalsContact O-CG1 3.26Å; A1063-I1067 WeakPolarHBondContact O-CG1 3.37Å; A1063-I1067 PolarHBondContact O-N 3.14Å
1064	D	98.3	Very high	96.7	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.011	16%	0.158	C	C	.	.	H	α-helix	trans	-65.3	-29.5	172.7	-75.8	-52.2	0	0	0	112.4	A878 R881 L882 A1060 T1061 G1062 I1067 L1068	A878-D1064 HydrophobicContact CB-CB 4.2Å; A878-D1064 VanDerWaalsContact CB-OD1 3.27Å; A878-D1064 WeakPolarHBondContact CB-OD1 3.48Å; R881-D1064 IonicContact CZ-OD1 2.82Å; R881-D1064 VanDerWaalsContact NE-CG 3.33Å; R881-D1064 IonicContact NE-OD1 3.95Å; R881-D1064 PolarHBondContact NE-OD1 2.99Å; R881-D1064 IonicContact NE-OD2 2.86Å; R881-D1064 PolarHBondContact NE-OD2 3.45Å; R881-D1064 IonicContact NH2-OD1 3.85Å; R881-D1064 PolarHBondContact NH2-OD1 2.76Å; L882-D1064 HydrophobicContact CD1-CB 3.91Å; L882-D1064 HydrophobicContact CD2-CB 3.84Å; L882-D1064 HydrophobicContact CG-CB 3.61Å; A1060-D1064 WeakPolarHBondContact CA-OD2 3.26Å; T1061-D1064 PolarHBondContact N-OD2 2.92Å; T1061-D1064 WeakPolarHBondContact O-CB 3.49Å; T1061-D1064 PolarHBondContact O-N 3.08Å; G1062-D1064 PolarHBondContact O-N 2.98Å; D1064-I1067 PolarHBondContact O-N 2.92Å; D1064-L1068 WeakPolarHBondContact O-CB 3.38Å; D1064-L1068 VanDerWaalsContact O-CD1 3.26Å; D1064-L1068 WeakPolarHBondContact O-CD1 3.33Å; D1064-L1068 PolarHBondContact O-N 2.82Å
1065	Y	98.3	Very high	96	Very high	2 Å²	2	31 Å²	31	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-67.4	-38.3	172.6	-65.9	-58	0	0	0	112	L882 S1054 V1056 G1062 A1063 L1068 A1069 R1116 P1119	L882-Y1065 HydrophobicContact CD1-CD1 3.73Å; L882-Y1065 HydrophobicContact CD1-CE1 3.92Å; L882-Y1065 HydrophobicContact CD1-CG 4.49Å; L882-Y1065 HydrophobicContact CD2-CD1 4.04Å; L882-Y1065 HydrophobicContact CD2-CE1 3.7Å; L882-Y1065 HydrophobicContact CD2-CE2 4.24Å; L882-Y1065 HydrophobicContact CD2-CG 4.44Å; L882-Y1065 HydrophobicContact CG-CE1 4.44Å; S1054-Y1065 WeakPolarHBondContact OG-CE1 3.44Å; S1054-Y1065 PolarHBondContact OG-OH 3.3Å; V1056-Y1065 HydrophobicContact CG2-CE2 3.79Å; G1062-Y1065 WeakPolarHBondContact O-CB 3.26Å; G1062-Y1065 PolarHBondContact O-N 3.12Å; A1063-Y1065 VanDerWaalsContact C-N 3.26Å; A1063-Y1065 PolarHBondContact O-N 3.24Å; Y1065-L1068 PolarHBondContact O-N 3.23Å; Y1065-A1069 PolarHBondContact O-N 2.9Å; Y1065-R1116 HydrophobicContact CD2-CB 4.37Å; Y1065-R1116 HydrophobicContact CD2-CG 4.45Å; Y1065-P1119 HydrophobicContact CD2-CB 4.42Å; Y1065-P1119 HydrophobicContact CE1-CB 3.94Å; Y1065-P1119 HydrophobicContact CE2-CB 3.73Å; Y1065-P1119 HydrophobicContact CE2-CG 4.02Å; Y1065-P1119 VanDerWaalsContact CZ-CB 3.45Å; Y1065-P1119 WeakPolarHBondContact OH-CB 3.25Å
1066	D	97.9	Very high	94.5	Very high	64 Å²	64	32.7 Å²	32.7	34%	0.342	20%	0.196	S	C	.	.	H	α-helix	trans	-67.6	-44.4	176	-56	-34.5	0	0	0	110.1	A1063 L1068 A1069 E1070 R1116	A1063-D1066 PolarHBondContact O-N 2.78Å; D1066-L1068 VanDerWaalsContact C-N 3.27Å; D1066-L1068 PolarHBondContact O-N 3.49Å; D1066-A1069 WeakPolarHBondContact O-CB 3.28Å; D1066-A1069 PolarHBondContact O-N 3.4Å; D1066-E1070 PolarHBondContact O-N 3.41Å; D1066-R1116 WeakPolarHBondContact OD1-CB 3.43Å; D1066-R1116 WeakPolarHBondContact OD2-CD 3.3Å; D1066-R1116 IonicContact OD2-CZ 2.86Å; D1066-R1116 IonicContact OD2-NE 3.96Å; D1066-R1116 IonicContact OD2-NH1 3.7Å; D1066-R1116 PolarHBondContact OD2-NH1 2.82Å
1067	I	97.9	Very high	92.5	Very high	53 Å²	53	38.8 Å²	38.8	27%	0.272	24%	0.24	S	C	.	.	H	α-helix	trans	-59.9	-36.7	172.2	-64.4	165.5	0	0	0	110.9	W874 K875 A878 A1063 D1064 E1070	W874-I1067 HydrophobicContact CE3-CG2 3.75Å; W874-I1067 HydrophobicContact CZ3-CG2 4.23Å; W874-I1067 WeakPolarHBondContact CZ3-O 3.46Å; K875-I1067 PolarHBondContact NZ-O 3.01Å; A878-I1067 HydrophobicContact CB-CB 4.02Å; A878-I1067 HydrophobicContact CB-CG2 3.58Å; A1063-I1067 VanDerWaalsContact O-CG1 3.26Å; A1063-I1067 WeakPolarHBondContact O-CG1 3.37Å; A1063-I1067 PolarHBondContact O-N 3.14Å; D1064-I1067 PolarHBondContact O-N 2.92Å; I1067-E1070 PolarHBondContact O-N 2.64Å
1068	L	97.7	Very high	89.9	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-72.3	-28	174.6	-98.2	69	0	0	0	113.2	L829 K875 A878 I879 L882 D1064 Y1065 D1066 F1109 H1113 T1114	L829-L1068 HydrophobicContact CD1-CD2 3.81Å; K875-L1068 PolarHBondContact NZ-O 3.21Å; A878-L1068 HydrophobicContact CB-CD1 3.26Å; I879-L1068 HydrophobicContact CG1-CD1 4.11Å; I879-L1068 HydrophobicContact CG1-CD2 4.07Å; I879-L1068 HydrophobicContact CG1-CG 4.15Å; L882-L1068 HydrophobicContact CD1-CD1 4.08Å; L882-L1068 HydrophobicContact CD1-CD2 3.76Å; L882-L1068 HydrophobicContact CD1-CG 4.39Å; D1064-L1068 WeakPolarHBondContact O-CB 3.38Å; D1064-L1068 VanDerWaalsContact O-CD1 3.26Å; D1064-L1068 WeakPolarHBondContact O-CD1 3.33Å; D1064-L1068 PolarHBondContact O-N 2.82Å; Y1065-L1068 PolarHBondContact O-N 3.23Å; D1066-L1068 VanDerWaalsContact C-N 3.27Å; D1066-L1068 PolarHBondContact O-N 3.49Å; L1068-F1109 WeakPolarHBondContact O-CB 3.25Å; L1068-H1113 WeakPolarHBondContact CB-O 3.47Å; L1068-T1114 HydrophobicContact CB-CG2 4.43Å
1069	A	98.2	Very high	87	Confident	4 Å²	4	45.1 Å²	45.1	3%	0.033	29%	0.285	C	S	.	.	H	α-helix	trans	-68.7	-28.6	172.3	0	0	0	0	0	113.8	Y1065 D1066 R1135	Y1065-A1069 PolarHBondContact O-N 2.9Å; D1066-A1069 WeakPolarHBondContact O-CB 3.28Å; D1066-A1069 PolarHBondContact O-N 3.4Å; A1069-R1135 PolarHBondContact O-NH1 3.44Å
1070	E	97.6	Very high	84.1	Confident	86 Å²	86	47.3 Å²	47.3	40%	0.402	31%	0.308	S	S	.	.	S	Bend	trans	-64.3	138.8	-170.8	-80.5	-55.3	93.8	0	0	115.1	W874 K875 D1066 I1067 R1135	W874-E1070 HydrophobicContact CH2-CB 3.92Å; W874-E1070 HydrophobicContact CZ3-CB 3.96Å; K875-E1070 WeakPolarHBondContact CE-O 3.18Å; K875-E1070 PolarHBondContact NZ-O 3.36Å; D1066-E1070 PolarHBondContact O-N 3.41Å; I1067-E1070 PolarHBondContact O-N 2.64Å; E1070-R1135 IonicContact OE1-CZ 2.67Å; E1070-R1135 IonicContact OE1-NH2 3.49Å; E1070-R1135 PolarHBondContact OE1-NH2 3.13Å
1071	P	97.4	Very high	81	Confident	4 Å²	4	56 Å²	56	3%	0.026	35%	0.348	C	S	.	.			trans	-77.9	153.5	-175.6	35.4	-35.7	0	0	0	111.5	Y1073 P1105 I1107 F1108	P1071-Y1073 HydrophobicContact CG-CE2 4.26Å; P1071-P1105 HydrophobicContact CB-CB 3.71Å; P1071-P1105 HydrophobicContact CB-CG 4.29Å; P1071-P1105 HydrophobicContact CG-CB 4.08Å; P1071-P1105 HydrophobicContact CG-CG 4.27Å; P1071-I1107 CarbonylContact C-O 3.58Å; P1071-I1107 WeakPolarHBondContact CA-O 3.27Å; P1071-F1108 HydrophobicContact CB-CD1 3.96Å; P1071-F1108 HydrophobicContact CB-CE1 4.2Å; P1071-F1108 HydrophobicContact CB-CG 4.49Å
1072	V	96.3	Very high	77.9	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.006	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-105	130.1	179.9	172.2	0	0	0	0	110.7	Y796 L871 P872 W874 R1106 I1107 F1109	Y796-V1072 HydrophobicContact CE2-CG1 3.72Å; Y796-V1072 WeakPolarHBondContact OH-CG1 3.38Å; L871-V1072 HydrophobicContact CD2-CG2 4.42Å; P872-V1072 HydrophobicContact CG-CG1 4.17Å; P872-V1072 HydrophobicContact CG-CG2 4.29Å; W874-V1072 HydrophobicContact CH2-CG2 4.18Å; W874-V1072 HydrophobicContact CZ2-CG2 4.39Å; V1072-R1106 PolarHBondContact O-N 3.03Å; V1072-I1107 HydrophobicContact CB-CB 4.37Å; V1072-I1107 PolarHBondContact N-O 2.92Å; V1072-I1107 PolarHBondContact O-N 2.89Å; V1072-F1109 HydrophobicContact CB-CE2 4.33Å; V1072-F1109 HydrophobicContact CG2-CE2 3.78Å; V1072-F1109 HydrophobicContact CG2-CZ 4.46Å
1073	Y	94.6	Very high	74.9	Confident	68 Å²	68	72.3 Å²	72.3	27%	0.267	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-97.4	151.1	175.8	-58.3	-100.3	0	0	0	109.4	P1071 P1101 N1103 P1105 Y1139	P1071-Y1073 HydrophobicContact CG-CE2 4.26Å; Y1073-P1101 HydrophobicContact CD1-CB 4.29Å; Y1073-P1101 HydrophobicContact CD1-CG 4.02Å; Y1073-P1101 HydrophobicContact CE1-CB 4.25Å; Y1073-P1101 HydrophobicContact CE1-CG 3.51Å; Y1073-N1103 WeakPolarHBondContact CD1-O 3.25Å; Y1073-N1103 WeakPolarHBondContact CE1-O 3.48Å; Y1073-P1105 HydrophobicContact CD1-CB 3.98Å; Y1073-P1105 HydrophobicContact CD1-CG 4.39Å; Y1073-P1105 HydrophobicContact CD2-CB 4.48Å; Y1073-P1105 HydrophobicContact CE1-CB 3.71Å; Y1073-P1105 HydrophobicContact CE1-CG 3.67Å; Y1073-P1105 HydrophobicContact CE2-CB 4.23Å; Y1073-P1105 HydrophobicContact CG-CB 4.35Å; Y1073-Y1139 PolarHBondContact OH-OH 3.24Å
1074	H	90.7	Very high	71.7	Confident	53 Å²	53	76.5 Å²	76.5	25%	0.245	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-70.2	135.3	168.1	171.8	-87.4	0	0	0	109.8	Y796 N798 S1076	Y796-H1074 HydrophobicContact CD2-CB 4.14Å; Y796-H1074 HydrophobicContact CE2-CB 4.49Å; Y796-H1074 PolarHBondContact O-CD2 3.01Å; Y796-H1074 VanDerWaalsContact O-CD2 3.29Å; N798-H1074 VanDerWaalsContact CG-ND1 3.33Å; N798-H1074 WeakPolarHBondContact OD1-CB 3.45Å; N798-H1074 PolarHBondContact OD1-ND1 3.37Å; H1074-S1076 PolarHBondContact O-N 3.06Å
1075	P	83.1	Confident	68.3	Low	76 Å²	76	83.2 Å²	83.2	49%	0.494	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-56	126.9	-177.7	-27.2	35.6	0	0	0	113.5	P869	P869-P1075 HydrophobicContact CG-CG 4.27Å
1076	S	67.6	Low	65	Low	66 Å²	66	88.9 Å²	88.9	46%	0.462	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-72.9	132.6	165.4	45.1	0	0	0	0	109.5	H1074 S1078	H1074-S1076 PolarHBondContact O-N 3.06Å; S1076-S1078 PolarHBondContact O-N 3.4Å
1077	S	54.5	Low	61.7	Low	133 Å²	133	95.4 Å²	95.4	93%	0.93	54%	0.543	S	S	*	.	S	Bend	trans	-79.2	46.8	-176.6	57.1	0	0	0	0	112.6
1078	S	44.5	Very low	58.6	Low	97 Å²	97	98.7 Å²	98.7	68%	0.678	57%	0.565	S	S	*	*			trans	-151	38.8	-165.3	66.2	0	0	0	0	114.9	S1076	S1076-S1078 PolarHBondContact O-N 3.4Å
1079	S	36	Very low	55.2	Low	100 Å²	100	103 Å²	103	70%	0.699	60%	0.595	S	S	*	*			trans	-150.1	46	171.6	50.9	0	0	0	0	112.4	E1081	S1079-E1081 VanDerWaalsContact C-N 3.28Å; S1079-E1081 PolarHBondContact O-N 3.04Å
1080	G	31.2	Very low	52.2	Low	87 Å²	87	112.2 Å²	112.2	90%	0.897	64%	0.637	S	S	*	*			trans	-80.9	46.5	-176	0	0	0	0	0	116
1081	E	32.5	Very low	49	Very low	182 Å²	182	115.7 Å²	115.7	85%	0.85	65%	0.654	S	S	*	*			trans	-122.4	141.5	172.9	-71.5	-160.4	139.1	0	0	112.5	S1079 Q1083	S1079-E1081 VanDerWaalsContact C-N 3.28Å; S1079-E1081 PolarHBondContact O-N 3.04Å; E1081-Q1083 PolarHBondContact O-N 3.13Å
1082	K	30	Very low	45.7	Very low	205 Å²	205	118.8 Å²	118.8	89%	0.891	68%	0.675	S	S	*	*			trans	-81.5	111	-178.7	-60.3	176.6	-174.2	178.5	0	109.9
1083	Q	31.4	Very low	42.6	Very low	197 Å²	197	126.8 Å²	126.8	92%	0.921	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-92.5	121.7	159.1	-70	-166.6	-5.3	0	0	109.8	E1081	E1081-Q1083 PolarHBondContact O-N 3.13Å
1084	T	29.6	Very low	39.3	Very low	125 Å²	125	127 Å²	127	77%	0.767	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-79.6	149.9	179.2	42.3	0	0	0	0	111.7	T1086	T1084-T1086 PolarHBondContact O-N 3.01Å
1085	T	26.8	Very low	36.5	Very low	142 Å²	142	130.7 Å²	130.7	87%	0.871	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-51.6	122.1	177.8	49.1	0	0	0	0	114.4
1086	T	30.5	Very low	33.8	Very low	122 Å²	122	135.3 Å²	135.3	75%	0.748	78%	0.775	S	S	*	*			trans	-140.8	128.8	155.8	45.8	0	0	0	0	109.1	T1084 V1088	T1084-T1086 PolarHBondContact O-N 3.01Å; T1086-V1088 PolarHBondContact O-N 3.24Å
1087	H	28.6	Very low	31.9	Very low	201 Å²	201	135.6 Å²	135.6	93%	0.931	79%	0.789	S	S	*	*			trans	-63	128.4	172.3	-79.3	-117.7	0	0	0	110.3
1088	V	31.7	Very low	30.7	Very low	122 Å²	122	135.1 Å²	135.1	74%	0.739	77%	0.774	S	S	*	*			trans	-139.8	132.8	160.8	-174.1	0	0	0	0	107.9	T1086	T1086-V1088 PolarHBondContact O-N 3.24Å
1089	S	27.1	Very low	30	Very low	92 Å²	92	135.4 Å²	135.4	64%	0.643	78%	0.776	S	S	*	*			trans	-67.9	131.1	172.6	47.8	0	0	0	0	110.9	Q1091	S1089-Q1091 PolarHBondContact O-N 2.71Å
1090	H	34	Very low	30	Very low	197 Å²	197	136.4 Å²	136.4	91%	0.912	77%	0.772	S	S	*	*			trans	-73.5	78.8	168	-83.2	-67.9	0	0	0	110.9
1091	Q	31.1	Very low	30.8	Very low	160 Å²	160	135.4 Å²	135.4	75%	0.748	75%	0.749	S	S	*	*			trans	-67.8	155.3	142.6	-73.4	-178.4	-37.9	0	0	108.6	S1089	S1089-Q1091 PolarHBondContact O-N 2.71Å
1092	S	27.1	Very low	31.9	Very low	69 Å²	69	133.2 Å²	133.2	48%	0.483	75%	0.748	S	S	.	*			trans	-62.1	144.3	-179.9	37	0	0	0	0	111.7	N39	N39-S1092 WeakPolarHBondContact CB-OG 2.84Å; N39-S1092 VanDerWaalsContact CG-O 3.29Å; N39-S1092 PolarHBondContact ND2-O 3.07Å; N39-S1092 PolarHBondContact OD1-O 3.12Å
1093	H	31.7	Very low	34.2	Very low	169 Å²	169	125.6 Å²	125.6	78%	0.782	72%	0.718	S	S	*	*			trans	-142.8	134.4	165.7	-94.4	12	0	0	0	107.9
1094	G	25.4	Very low	36.9	Very low	71 Å²	71	119 Å²	119	73%	0.732	69%	0.688	S	S	*	*			trans	-63.1	136.4	-174.7	0	0	0	0	0	112.3	D1096	G1094-D1096 VanDerWaalsContact C-N 3.32Å; G1094-D1096 PolarHBondContact O-N 2.61Å
1095	I	31.7	Very low	40	Very low	132 Å²	132	113 Å²	113	68%	0.677	65%	0.652	S	S	*	*			trans	-85.7	78	-178.9	-60	178.4	0	0	0	109.7	G1097 I1098	I1095-G1097 PolarHBondContact O-N 2.89Å; I1095-I1098 HydrophobicContact CD1-CD1 4.23Å; I1095-I1098 HydrophobicContact CG2-CB 3.87Å; I1095-I1098 HydrophobicContact CG2-CD1 3.59Å; I1095-I1098 HydrophobicContact CG2-CG1 3.6Å
1096	D	26.8	Very low	43.3	Very low	172 Å²	172	107.5 Å²	107.5	92%	0.92	62%	0.615	S	S	*	*			trans	-74	103.7	162.6	-117.4	-22.1	0	0	0	109	G1094	G1094-D1096 VanDerWaalsContact C-N 3.32Å; G1094-D1096 PolarHBondContact O-N 2.61Å
1097	G	27.2	Very low	46.5	Very low	72 Å²	72	101.7 Å²	101.7	74%	0.742	58%	0.58	S	S	*	*			trans	78.2	38.2	160.1	0	0	0	0	0	118.2	I1095 S1099	I1095-G1097 PolarHBondContact O-N 2.89Å; G1097-S1099 PolarHBondContact O-N 3.28Å
1098	I	30.7	Very low	49.8	Very low	123 Å²	123	92.1 Å²	92.1	63%	0.631	54%	0.535	S	S	*	.			trans	-61.3	109	157.9	-75.7	175	0	0	0	108.5	I1095 M1100	I1095-I1098 HydrophobicContact CD1-CD1 4.23Å; I1095-I1098 HydrophobicContact CG2-CB 3.87Å; I1095-I1098 HydrophobicContact CG2-CD1 3.59Å; I1095-I1098 HydrophobicContact CG2-CG1 3.6Å; I1098-M1100 PolarHBondContact O-N 3.22Å; I1098-M1100 VanDerWaalsContact O-N 3.08Å
1099	S	28.9	Very low	53	Low	103 Å²	103	86.5 Å²	86.5	72%	0.72	50%	0.501	S	S	*	.			trans	-58.9	111.1	165.6	174.4	0	0	0	0	108.5	G1097	G1097-S1099 PolarHBondContact O-N 3.28Å
1100	M	36.5	Very low	56.4	Low	122 Å²	122	82.1 Å²	82.1	60%	0.601	47%	0.47	S	S	*	.			trans	-45.5	130.5	170.3	-76.2	-67.7	-67.7	0	0	109.8	I1098 T1102 Y1139	I1098-M1100 PolarHBondContact O-N 3.22Å; I1098-M1100 VanDerWaalsContact O-N 3.08Å; M1100-T1102 PolarHBondContact O-N 3.44Å; M1100-Y1139 HydrophobicContact CE-CE1 4.5Å
1101	P	47.5	Very low	59.5	Low	65 Å²	65	72.8 Å²	72.8	42%	0.422	43%	0.428	S	S	.	.			trans	-58.4	129.1	178	23.8	-32.7	0	0	0	108.9	Y1073 N1103	Y1073-P1101 HydrophobicContact CD1-CB 4.29Å; Y1073-P1101 HydrophobicContact CD1-CG 4.02Å; Y1073-P1101 HydrophobicContact CE1-CB 4.25Å; Y1073-P1101 HydrophobicContact CE1-CG 3.51Å; P1101-N1103 PolarHBondContact O-N 3.01Å
1102	T	54.9	Low	62.7	Low	136 Å²	136	65.5 Å²	65.5	83%	0.834	39%	0.394	S	S	*	.	S	Bend	trans	-69.1	-3.1	-175.1	48.6	0	0	0	0	114	M1100	M1100-T1102 PolarHBondContact O-N 3.44Å
1103	N	79.4	Confident	66.1	Low	46 Å²	46	62.3 Å²	62.3	25%	0.246	37%	0.371	C	S	.	.	S	Bend	trans	-112.9	134.4	179	-59.3	-24.4	0	0	0	109.3	N798 Y1073 P1101	N798-N1103 PolarHBondContact OD1-ND2 3.14Å; Y1073-N1103 WeakPolarHBondContact CD1-O 3.25Å; Y1073-N1103 WeakPolarHBondContact CE1-O 3.48Å; P1101-N1103 PolarHBondContact O-N 3.01Å
1104	N	88.7	Confident	69.3	Low	57 Å²	57	54.3 Å²	54.3	31%	0.305	33%	0.334	S	S	.	.			trans	-61	147.9	171.4	-76	8.2	0	0	0	111.3	Y1139 Y1140	N1104-Y1139 PolarHBondContact ND2-O 3.1Å; N1104-Y1140 HydrophobicContact CB-CE1 4.23Å; N1104-Y1140 HydrophobicContact CB-CE2 4.12Å; N1104-Y1140 WeakPolarHBondContact CB-OH 3.33Å
1105	P	94.3	Very high	72.7	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	30%	0.303	C	S	.	.			trans	-64.3	146	169.6	12.3	-9	0	0	0	110.9	P1071 Y1073 F1108 Y1139 Y1140	P1071-P1105 HydrophobicContact CB-CB 3.71Å; P1071-P1105 HydrophobicContact CB-CG 4.29Å; P1071-P1105 HydrophobicContact CG-CB 4.08Å; P1071-P1105 HydrophobicContact CG-CG 4.27Å; Y1073-P1105 HydrophobicContact CD1-CB 3.98Å; Y1073-P1105 HydrophobicContact CD1-CG 4.39Å; Y1073-P1105 HydrophobicContact CD2-CB 4.48Å; Y1073-P1105 HydrophobicContact CE1-CB 3.71Å; Y1073-P1105 HydrophobicContact CE1-CG 3.67Å; Y1073-P1105 HydrophobicContact CE2-CB 4.23Å; Y1073-P1105 HydrophobicContact CG-CB 4.35Å; P1105-F1108 HydrophobicContact CB-CE1 4.3Å; P1105-F1108 HydrophobicContact CB-CE2 4.36Å; P1105-F1108 HydrophobicContact CB-CZ 3.93Å; P1105-F1108 HydrophobicContact CG-CE1 4Å; P1105-F1108 HydrophobicContact CG-CZ 3.71Å; P1105-F1108 WeakPolarHBondContact O-CE2 3.38Å; P1105-Y1139 HydrophobicContact CG-CD1 4.26Å; P1105-Y1139 HydrophobicContact CG-CD2 3.64Å; P1105-Y1139 HydrophobicContact CG-CE1 4.1Å; P1105-Y1139 HydrophobicContact CG-CE2 3.47Å; P1105-Y1139 VanDerWaalsContact CG-CE2 3.47Å; P1105-Y1139 HydrophobicContact CG-CG 4.06Å; P1105-Y1140 PolarHBondContact O-OH 2.99Å
1106	R	95.8	Very high	75.8	Confident	27 Å²	27	50.3 Å²	50.3	10%	0.102	29%	0.29	C	S	.	.			trans	-114.3	-28.9	-171.3	-66.8	-69.8	-179.6	-169.3	-0.3	113.6	Y796 S797 N798 T799 V801 D821 A822 L823 V1072 Y1140	Y796-R1106 HydrophobicContact CD2-CB 4.45Å; S797-R1106 WeakPolarHBondContact O-CG 3.45Å; S797-R1106 PolarHBondContact O-NE 2.9Å; N798-R1106 PolarHBondContact O-NH2 2.9Å; T799-R1106 VanDerWaalsContact C-CZ 3.45Å; T799-R1106 VanDerWaalsContact C-NH2 3.29Å; T799-R1106 PolarHBondContact O-NH1 2.99Å; T799-R1106 PolarHBondContact O-NH2 3.16Å; T799-R1106 VanDerWaalsContact O-NH2 3.15Å; V801-R1106 HydrophobicContact CG1-CB 4.08Å; V801-R1106 WeakPolarHBondContact CG1-O 3.38Å; D821-R1106 WeakPolarHBondContact O-CD 3.47Å; D821-R1106 PolarHBondContact O-NH1 3.38Å; A822-R1106 WeakPolarHBondContact CA-O 3.45Å; L823-R1106 PolarHBondContact N-O 2.8Å; V1072-R1106 PolarHBondContact O-N 3.03Å; R1106-Y1140 PolarHBondContact NH1-OH 2.84Å
1107	I	97.8	Very high	79	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.9	172.1	-55.4	180	0	0	0	109.2	I794 Y796 L823 C825 F867 P1071 V1072 F1109	I794-I1107 HydrophobicContact CG2-CD1 3.77Å; Y796-I1107 HydrophobicContact CD1-CD1 3.44Å; Y796-I1107 VanDerWaalsContact CD1-CD1 3.44Å; Y796-I1107 HydrophobicContact CD1-CG1 4.31Å; Y796-I1107 HydrophobicContact CE1-CD1 3.72Å; Y796-I1107 HydrophobicContact CG-CD1 3.87Å; Y796-I1107 HydrophobicContact CG-CG1 4.25Å; L823-I1107 HydrophobicContact CD2-CG2 4.08Å; L823-I1107 CarbonylContact O-C 3.59Å; L823-I1107 WeakPolarHBondContact O-CA 3.48Å; C825-I1107 HydrophobicContact CB-CG2 4.12Å; F867-I1107 HydrophobicContact CD1-CD1 3.96Å; F867-I1107 HydrophobicContact CE1-CD1 4.13Å; P1071-I1107 CarbonylContact C-O 3.58Å; P1071-I1107 WeakPolarHBondContact CA-O 3.27Å; V1072-I1107 HydrophobicContact CB-CB 4.37Å; V1072-I1107 PolarHBondContact N-O 2.92Å; V1072-I1107 PolarHBondContact O-N 2.89Å; I1107-F1109 HydrophobicContact CB-CE2 4.27Å; I1107-F1109 HydrophobicContact CG2-CD2 4.25Å; I1107-F1109 HydrophobicContact CG2-CE1 4.43Å; I1107-F1109 HydrophobicContact CG2-CE2 3.58Å; I1107-F1109 HydrophobicContact CG2-CZ 3.69Å
1108	F	98.6	Very high	82.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	153.6	175.8	-64	-96.9	0	0	0	108.8	A822 L823 I824 C825 P1071 P1105 E1132 R1135 V1136 Y1139 Y1140	A822-F1108 HydrophobicContact CB-CD2 4.26Å; A822-F1108 HydrophobicContact CB-CE2 3.85Å; L823-F1108 PolarHBondContact O-N 2.9Å; I824-F1108 HydrophobicContact CG1-CB 4.19Å; C825-F1108 PolarHBondContact N-O 3.45Å; P1071-F1108 HydrophobicContact CB-CD1 3.96Å; P1071-F1108 HydrophobicContact CB-CE1 4.2Å; P1071-F1108 HydrophobicContact CB-CG 4.49Å; P1105-F1108 HydrophobicContact CB-CE1 4.3Å; P1105-F1108 HydrophobicContact CB-CE2 4.36Å; P1105-F1108 HydrophobicContact CB-CZ 3.93Å; P1105-F1108 HydrophobicContact CG-CE1 4Å; P1105-F1108 HydrophobicContact CG-CZ 3.71Å; P1105-F1108 WeakPolarHBondContact O-CE2 3.38Å; F1108-E1132 HydrophobicContact CB-CB 4.38Å; F1108-E1132 HydrophobicContact CB-CG 4.33Å; F1108-E1132 WeakPolarHBondContact CB-OE2 3.44Å; F1108-E1132 WeakPolarHBondContact CD1-OE2 3.46Å; F1108-R1135 HydrophobicContact CD1-CB 4.47Å; F1108-R1135 HydrophobicContact CD1-CG 4.27Å; F1108-R1135 HydrophobicContact CE1-CB 4.37Å; F1108-R1135 HydrophobicContact CE1-CG 3.96Å; F1108-V1136 HydrophobicContact CB-CG2 4.46Å; F1108-V1136 HydrophobicContact CD1-CG2 3.83Å; F1108-V1136 HydrophobicContact CD2-CG2 3.61Å; F1108-V1136 HydrophobicContact CE1-CG2 3.87Å; F1108-V1136 HydrophobicContact CE2-CG2 3.67Å; F1108-V1136 HydrophobicContact CG-CG2 3.7Å; F1108-V1136 HydrophobicContact CZ-CG2 3.78Å; F1108-Y1139 HydrophobicContact CE1-CD2 4.16Å; F1108-Y1139 HydrophobicContact CZ-CD2 4.16Å; F1108-Y1140 HydrophobicContact CE2-CE2 4.01Å; F1108-Y1140 HydrophobicContact CZ-CE2 4.04Å
1109	F	98.7	Very high	85.4	Confident	3 Å²	3	36.6 Å²	36.6	1%	0.013	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	124	-172.8	-72.1	-92.7	0	0	0	111.8	C825 L871 L1068 V1072 I1107 T1114 R1131 E1132	C825-F1109 HydrophobicContact CB-CD1 3.97Å; C825-F1109 HydrophobicContact CB-CE1 3.98Å; L871-F1109 HydrophobicContact CD2-CZ 4.08Å; L1068-F1109 WeakPolarHBondContact O-CB 3.25Å; V1072-F1109 HydrophobicContact CB-CE2 4.33Å; V1072-F1109 HydrophobicContact CG2-CE2 3.78Å; V1072-F1109 HydrophobicContact CG2-CZ 4.46Å; I1107-F1109 HydrophobicContact CB-CE2 4.27Å; I1107-F1109 HydrophobicContact CG2-CD2 4.25Å; I1107-F1109 HydrophobicContact CG2-CE1 4.43Å; I1107-F1109 HydrophobicContact CG2-CE2 3.58Å; I1107-F1109 HydrophobicContact CG2-CZ 3.69Å; F1109-T1114 HydrophobicContact CB-CG2 4.24Å; F1109-R1131 PolarHBondContact O-NH2 3.11Å; F1109-R1131 VanDerWaalsContact O-NH2 3.09Å; F1109-E1132 VanDerWaalsContact O-CD 3.3Å; F1109-E1132 WeakPolarHBondContact O-CG 3.35Å
1110	A	98.7	Very high	88.6	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.181	C	C	.	.			trans	-137.7	150.1	177.9	0	0	0	0	0	112.2	I824 C825 T826 E1132	I824-A1110 HydrophobicContact CG2-CB 4.06Å; C825-A1110 PolarHBondContact O-N 3.29Å; T826-A1110 VanDerWaalsContact CA-O 3.23Å; T826-A1110 WeakPolarHBondContact CA-O 3.31Å; T826-A1110 WeakPolarHBondContact CB-O 3.19Å; T826-A1110 HydrophobicContact CG2-CB 4.04Å; A1110-E1132 HydrophobicContact CB-CB 4.39Å; A1110-E1132 HydrophobicContact CB-CG 3.76Å
1111	G	98.5	Very high	91.6	Very high	2 Å²	2	29.2 Å²	29.2	2%	0.021	16%	0.163	C	C	.	.	S	Bend	trans	145.1	168.4	-171.6	0	0	0	0	0	110.7	H1113 T1114 S1128	G1111-H1113 VanDerWaalsContact C-N 3.3Å; G1111-H1113 PolarHBondContact O-N 3.45Å; G1111-T1114 PolarHBondContact N-OG1 3.23Å; G1111-T1114 PolarHBondContact O-N 3.39Å; G1111-T1114 PolarHBondContact O-OG1 3.41Å; G1111-S1128 PolarHBondContact N-OG 3.1Å; G1111-S1128 PolarHBondContact O-OG 2.99Å
1112	E	98.3	Very high	94	Very high	7 Å²	7	27 Å²	27	3%	0.033	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-59.5	-40.9	179.1	33	61.1	-92.2	0	0	112.3	R396 Y1053 S1054 T1114 C1115 A1125	R396-E1112 IonicContact CZ-OE1 3.73Å; R396-E1112 IonicContact CZ-OE2 3.73Å; R396-E1112 IonicContact NH1-OE1 3.62Å; R396-E1112 PolarHBondContact NH1-OE1 3.24Å; R396-E1112 IonicContact NH1-OE2 2.95Å; R396-E1112 PolarHBondContact NH1-OE2 3.4Å; R396-E1112 IonicContact NH2-OE1 3Å; R396-E1112 PolarHBondContact NH2-OE1 3.3Å; R396-E1112 IonicContact NH2-OE2 2.84Å; Y1053-E1112 WeakPolarHBondContact CA-OE2 3.44Å; S1054-E1112 PolarHBondContact N-OE2 3.44Å; E1112-T1114 PolarHBondContact O-N 2.85Å; E1112-C1115 PolarHBondContact O-N 2.87Å; E1112-C1115 VanDerWaalsContact O-N 3.08Å; E1112-A1125 HydrophobicContact CB-CB 4.35Å
1113	H	98.4	Very high	96	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.009	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-66.5	13.5	172.6	65.1	-90.1	0	0	0	115	L827 L829 L1068 G1111	L827-H1113 PolarHBondContact O-CE1 2.67Å; L829-H1113 HydrophobicContact CB-CB 3.87Å; L829-H1113 HydrophobicContact CD2-CB 4.19Å; L1068-H1113 WeakPolarHBondContact CB-O 3.47Å; G1111-H1113 VanDerWaalsContact C-N 3.3Å; G1111-H1113 PolarHBondContact O-N 3.45Å
1114	T	98.6	Very high	96.8	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-126.4	10.1	173.3	74.4	0	0	0	0	112.2	L1068 F1109 G1111 E1112 S1128 R1131	L1068-T1114 HydrophobicContact CB-CG2 4.43Å; F1109-T1114 HydrophobicContact CB-CG2 4.24Å; G1111-T1114 PolarHBondContact N-OG1 3.23Å; G1111-T1114 PolarHBondContact O-N 3.39Å; G1111-T1114 PolarHBondContact O-OG1 3.41Å; E1112-T1114 PolarHBondContact O-N 2.85Å; T1114-S1128 VanDerWaalsContact OG1-CB 3.25Å; T1114-S1128 WeakPolarHBondContact OG1-CB 3.32Å; T1114-R1131 PolarHBondContact O-NH1 3.35Å; T1114-R1131 PolarHBondContact OG1-NH2 3.4Å; T1114-R1131 VanDerWaalsContact OG1-NH2 3.15Å
1115	C	96.9	Very high	97.3	Very high	14 Å²	14	16.4 Å²	16.4	10%	0.095	9%	0.087	C	C	.	.			trans	-126.3	93.3	-174.1	-166.2	0	0	0	0	110.4	E1112 C1117 Y1118 P1119	E1112-C1115 PolarHBondContact O-N 2.87Å; E1112-C1115 VanDerWaalsContact O-N 3.08Å; C1115-C1117 VanDerWaalsContact C-N 3.35Å; C1115-C1117 PolarHBondContact O-N 2.95Å; C1115-Y1118 CarbonylContact O-C 3.59Å; C1115-Y1118 VanDerWaalsContact O-C 3.3Å; C1115-Y1118 PolarHBondContact O-N 3.36Å; C1115-Y1118 VanDerWaalsContact O-N 3.16Å; C1115-P1119 WeakPolarHBondContact O-CA 3.49Å; C1115-P1119 WeakPolarHBondContact O-CD 3.32Å
1116	R	96.9	Very high	97.5	Very high	105 Å²	105	16.4 Å²	16.4	40%	0.396	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-38.1	-174	-179.8	174.1	170.1	-170.8	-10.4	115.1	Q718 G1062 Y1065 D1066 Y1118 P1119	Q718-R1116 PolarHBondContact NE2-O 2.89Å; G1062-R1116 VanDerWaalsContact O-CD 3.31Å; G1062-R1116 WeakPolarHBondContact O-CD 3.36Å; G1062-R1116 WeakPolarHBondContact O-CG 3.49Å; Y1065-R1116 HydrophobicContact CD2-CB 4.37Å; Y1065-R1116 HydrophobicContact CD2-CG 4.45Å; D1066-R1116 WeakPolarHBondContact OD1-CB 3.43Å; D1066-R1116 WeakPolarHBondContact OD2-CD 3.3Å; D1066-R1116 IonicContact OD2-CZ 2.86Å; D1066-R1116 IonicContact OD2-NE 3.96Å; D1066-R1116 IonicContact OD2-NH1 3.7Å; D1066-R1116 PolarHBondContact OD2-NH1 2.82Å; R1116-Y1118 VanDerWaalsContact C-N 3.34Å; R1116-P1119 WeakPolarHBondContact O-CD 3.39Å
1117	C	93.5	Very high	97.6	Very high	43 Å²	43	16.4 Å²	16.4	29%	0.291	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-14.5	-179.2	-53	0	0	0	0	113.6	F722 C1115	F722-C1117 HydrophobicContact CB-CB 4.29Å; F722-C1117 WeakPolarHBondContact CB-O 3.5Å; F722-C1117 HydrophobicContact CD1-CB 3.96Å; F722-C1117 HydrophobicContact CD2-CB 3.67Å; F722-C1117 HydrophobicContact CE1-CB 4.2Å; F722-C1117 HydrophobicContact CE2-CB 3.94Å; F722-C1117 HydrophobicContact CG-CB 3.7Å; F722-C1117 HydrophobicContact CZ-CB 4.19Å; F722-C1117 VanDerWaalsContact CZ-SG 3.58Å; C1115-C1117 VanDerWaalsContact C-N 3.35Å; C1115-C1117 PolarHBondContact O-N 2.95Å
1118	Y	95.6	Very high	97.6	Very high	33 Å²	33	16.4 Å²	16.4	13%	0.129	9%	0.089	C	C	.	.	S	Bend	trans	-147.1	49	-175	-54.2	-75.2	0	0	0	111.8	F722 L724 C1115 R1116 T1121 H1123 G1124 L1127	F722-Y1118 HydrophobicContact CB-CE1 3.94Å; F722-Y1118 WeakPolarHBondContact O-CE1 3.28Å; L724-Y1118 HydrophobicContact CD1-CE1 4.16Å; L724-Y1118 HydrophobicContact CD2-CE1 3.74Å; L724-Y1118 HydrophobicContact CG-CE1 3.96Å; C1115-Y1118 CarbonylContact O-C 3.59Å; C1115-Y1118 VanDerWaalsContact O-C 3.3Å; C1115-Y1118 PolarHBondContact O-N 3.36Å; C1115-Y1118 VanDerWaalsContact O-N 3.16Å; R1116-Y1118 VanDerWaalsContact C-N 3.34Å; Y1118-T1121 PolarHBondContact O-OG1 3.38Å; Y1118-H1123 AromaticContact CD1-CD2 3.52Å; Y1118-H1123 AromaticContact CD1-NE2 3.14Å; Y1118-H1123 WeakPolarHBondContact CD1-NE2 3.47Å; Y1118-H1123 AromaticContact CG-CD2 3.71Å; Y1118-H1123 AromaticContact CG-NE2 3.68Å; Y1118-G1124 WeakPolarHBondContact O-CA 3.45Å; Y1118-L1127 HydrophobicContact CD2-CD1 3.73Å; Y1118-L1127 HydrophobicContact CE2-CD1 3.92Å; Y1118-L1127 HydrophobicContact CG-CD1 4.46Å
1119	P	96.6	Very high	97.6	Very high	4 Å²	4	16.4 Å²	16.4	3%	0.026	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	170.4	-179	32.9	-37	0	0	0	110.5	D719 Y1065 C1115 R1116 T1121	D719-P1119 HydrophobicContact CB-CG 4.14Å; D719-P1119 VanDerWaalsContact OD1-CG 3.26Å; D719-P1119 WeakPolarHBondContact OD1-CG 3.35Å; D719-P1119 VanDerWaalsContact OD2-CD 3.26Å; D719-P1119 WeakPolarHBondContact OD2-CD 3.5Å; D719-P1119 WeakPolarHBondContact OD2-CG 3.35Å; Y1065-P1119 HydrophobicContact CD2-CB 4.42Å; Y1065-P1119 HydrophobicContact CE1-CB 3.94Å; Y1065-P1119 HydrophobicContact CE2-CB 3.73Å; Y1065-P1119 HydrophobicContact CE2-CG 4.02Å; Y1065-P1119 VanDerWaalsContact CZ-CB 3.45Å; Y1065-P1119 WeakPolarHBondContact OH-CB 3.25Å; C1115-P1119 WeakPolarHBondContact O-CA 3.49Å; C1115-P1119 WeakPolarHBondContact O-CD 3.32Å; R1116-P1119 WeakPolarHBondContact O-CD 3.39Å; P1119-T1121 WeakPolarHBondContact O-CG2 3.35Å; P1119-T1121 PolarHBondContact O-N 3.15Å
1120	A	97.6	Very high	97.5	Very high	34 Å²	34	16.6 Å²	16.6	28%	0.281	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	-16.4	-174.9	0	0	0	0	0	118.5	Y1053	Y1053-A1120 HydrophobicContact CD2-CB 3.39Å; Y1053-A1120 HydrophobicContact CE2-CB 4.01Å; Y1053-A1120 HydrophobicContact CG-CB 3.72Å
1121	T	97.6	Very high	97.5	Very high	35 Å²	35	20 Å²	20	22%	0.215	10%	0.103	C	C	.	.	S	Bend	trans	-94.7	159.2	-164	71.3	0	0	0	0	115	Y1118 P1119 H1123 G1124 A1125	Y1118-T1121 PolarHBondContact O-OG1 3.38Å; P1119-T1121 WeakPolarHBondContact O-CG2 3.35Å; P1119-T1121 PolarHBondContact O-N 3.15Å; T1121-H1123 VanDerWaalsContact C-N 3.31Å; T1121-H1123 VanDerWaalsContact CB-CE1 3.48Å; T1121-H1123 WeakPolarHBondContact CB-CE1 3.41Å; T1121-H1123 VanDerWaalsContact CG2-CE1 3.47Å; T1121-H1123 WeakPolarHBondContact CG2-CE1 3.27Å; T1121-H1123 PolarHBondContact OG1-CE1 3.12Å; T1121-H1123 PolarHBondContact OG1-NE2 3.01Å; T1121-G1124 PolarHBondContact OG1-N 3.23Å; T1121-A1125 WeakPolarHBondContact O-CB 3.38Å; T1121-A1125 PolarHBondContact O-N 3.24Å; T1121-A1125 VanDerWaalsContact O-N 3.14Å
1122	V	98	Very high	97.5	Very high	18 Å²	18	20 Å²	20	11%	0.109	10%	0.102	C	C	.	.	H	α-helix	trans	-64.2	-36.2	169.9	170.4	0	0	0	0	111.9	I368 I397 A411 V422 Y735 L1126	I368-V1122 HydrophobicContact CG1-CG1 4.47Å; I368-V1122 HydrophobicContact CG2-CG1 4.38Å; I397-V1122 HydrophobicContact CD1-CB 4.45Å; I397-V1122 HydrophobicContact CD1-CG1 3.72Å; I397-V1122 HydrophobicContact CD1-CG2 3.87Å; I397-V1122 HydrophobicContact CG1-CG2 3.99Å; A411-V1122 HydrophobicContact CB-CG2 3.46Å; A411-V1122 VanDerWaalsContact CB-CG2 3.46Å; V422-V1122 HydrophobicContact CG2-CG1 3.97Å; Y735-V1122 HydrophobicContact CE1-CG1 3.93Å; Y735-V1122 HydrophobicContact CE2-CG2 4.1Å; Y735-V1122 WeakPolarHBondContact OH-CB 3.48Å; V1122-L1126 WeakPolarHBondContact O-CB 3.37Å; V1122-L1126 PolarHBondContact O-N 3.09Å
1123	H	96.7	Very high	97.4	Very high	9 Å²	9	19.6 Å²	19.6	4%	0.042	10%	0.101	C	C	.	.	H	α-helix	trans	-79.3	-36.7	-175.3	61.6	-98.5	0	0	0	112.1	T415 P421 V422 Y1118 T1121 L1126 L1127	T415-H1123 PolarHBondContact OG1-CE1 3.34Å; T415-H1123 PolarHBondContact OG1-ND1 3.28Å; P421-H1123 HydrophobicContact CG-CB 4.14Å; V422-H1123 HydrophobicContact CG2-CB 4.02Å; Y1118-H1123 AromaticContact CD1-CD2 3.52Å; Y1118-H1123 AromaticContact CD1-NE2 3.14Å; Y1118-H1123 WeakPolarHBondContact CD1-NE2 3.47Å; Y1118-H1123 AromaticContact CG-CD2 3.71Å; Y1118-H1123 AromaticContact CG-NE2 3.68Å; T1121-H1123 VanDerWaalsContact C-N 3.31Å; T1121-H1123 VanDerWaalsContact CB-CE1 3.48Å; T1121-H1123 WeakPolarHBondContact CB-CE1 3.41Å; T1121-H1123 VanDerWaalsContact CG2-CE1 3.47Å; T1121-H1123 WeakPolarHBondContact CG2-CE1 3.27Å; T1121-H1123 PolarHBondContact OG1-CE1 3.12Å; T1121-H1123 PolarHBondContact OG1-NE2 3.01Å; H1123-L1126 WeakPolarHBondContact O-CB 3.28Å; H1123-L1126 PolarHBondContact O-N 2.81Å; H1123-L1127 VanDerWaalsContact O-CG 3.3Å; H1123-L1127 WeakPolarHBondContact O-CG 3.44Å; H1123-L1127 PolarHBondContact O-N 3.33Å
1124	G	97.3	Very high	97.2	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-66.1	-37.5	168.8	0	0	0	0	0	113.3	Y1118 T1121 L1126 L1127 S1128	Y1118-G1124 WeakPolarHBondContact O-CA 3.45Å; T1121-G1124 PolarHBondContact OG1-N 3.23Å; G1124-L1126 VanDerWaalsContact C-N 3.33Å; G1124-L1126 PolarHBondContact O-N 3.27Å; G1124-L1127 PolarHBondContact O-N 3.43Å; G1124-S1128 PolarHBondContact O-N 3.33Å; G1124-S1128 PolarHBondContact O-OG 3.08Å; G1124-S1128 VanDerWaalsContact O-OG 3.04Å
1125	A	98.5	Very high	97	Very high	8 Å²	8	21.9 Å²	21.9	7%	0.066	11%	0.109	C	C	.	.	H	α-helix	trans	-61.4	-39.7	169.4	0	0	0	0	0	112.1	I368 S369 E1112 T1121 S1128 G1129	I368-A1125 HydrophobicContact CG2-CB 3.54Å; S369-A1125 WeakPolarHBondContact CA-O 3.42Å; S369-A1125 WeakPolarHBondContact CB-O 3.38Å; E1112-A1125 HydrophobicContact CB-CB 4.35Å; T1121-A1125 WeakPolarHBondContact O-CB 3.38Å; T1121-A1125 PolarHBondContact O-N 3.24Å; T1121-A1125 VanDerWaalsContact O-N 3.14Å; A1125-S1128 PolarHBondContact O-OG 3.2Å; A1125-G1129 PolarHBondContact O-N 3.33Å
1126	L	98.4	Very high	96.8	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-63.5	-49.2	173	-173.1	170.5	0	0	0	111.1	I368 I372 P421 V422 L425 V1122 H1123 G1124 S1128 G1129 L1130	I368-L1126 HydrophobicContact CG1-CB 4.1Å; I368-L1126 HydrophobicContact CG1-CG 4.42Å; I372-L1126 HydrophobicContact CG1-CD2 4.29Å; I372-L1126 HydrophobicContact CG1-CG 4.36Å; I372-L1126 HydrophobicContact CG2-CG 4.3Å; I372-L1126 VanDerWaalsContact CG2-O 3.26Å; I372-L1126 WeakPolarHBondContact CG2-O 3.41Å; P421-L1126 HydrophobicContact CB-CD1 4.23Å; P421-L1126 HydrophobicContact CB-CD2 3.97Å; P421-L1126 HydrophobicContact CG-CD1 4.29Å; P421-L1126 HydrophobicContact CG-CD2 4.09Å; V422-L1126 HydrophobicContact CG2-CD1 4.16Å; L425-L1126 HydrophobicContact CD1-CD1 3.57Å; L425-L1126 HydrophobicContact CG-CD1 4.29Å; V1122-L1126 WeakPolarHBondContact O-CB 3.37Å; V1122-L1126 PolarHBondContact O-N 3.09Å; H1123-L1126 WeakPolarHBondContact O-CB 3.28Å; H1123-L1126 PolarHBondContact O-N 2.81Å; G1124-L1126 VanDerWaalsContact C-N 3.33Å; G1124-L1126 PolarHBondContact O-N 3.27Å; L1126-S1128 PolarHBondContact O-N 3.49Å; L1126-G1129 PolarHBondContact O-N 3.4Å; L1126-G1129 VanDerWaalsContact O-N 3.13Å; L1126-L1130 HydrophobicContact CD2-CD1 3.65Å; L1126-L1130 HydrophobicContact CD2-CG 4.19Å; L1126-L1130 PolarHBondContact O-N 3.16Å; L1126-L1130 VanDerWaalsContact O-N 3.16Å
1127	L	97.5	Very high	96.5	Very high	28 Å²	28	16.2 Å²	16.2	15%	0.147	9%	0.086	C	C	.	.	H	α-helix	trans	-62.3	-43	-178	-70.9	170	0	0	0	112.6	P421 Y1118 H1123 G1124 G1129 L1130 R1131	P421-L1127 HydrophobicContact CG-CD1 4.45Å; P421-L1127 HydrophobicContact CG-CD2 4.04Å; P421-L1127 HydrophobicContact CG-CG 4.05Å; Y1118-L1127 HydrophobicContact CD2-CD1 3.73Å; Y1118-L1127 HydrophobicContact CE2-CD1 3.92Å; Y1118-L1127 HydrophobicContact CG-CD1 4.46Å; H1123-L1127 VanDerWaalsContact O-CG 3.3Å; H1123-L1127 WeakPolarHBondContact O-CG 3.44Å; H1123-L1127 PolarHBondContact O-N 3.33Å; G1124-L1127 PolarHBondContact O-N 3.43Å; L1127-G1129 VanDerWaalsContact C-N 3.27Å; L1127-G1129 PolarHBondContact O-N 2.88Å; L1127-L1130 PolarHBondContact O-N 2.98Å; L1127-L1130 VanDerWaalsContact O-N 3.14Å; L1127-R1131 PolarHBondContact O-N 3.4Å
1128	S	98.5	Very high	96.3	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-61.4	-33.6	174.2	57.2	0	0	0	0	113	G1111 T1114 G1124 A1125 L1126 R1131 E1132	G1111-S1128 PolarHBondContact N-OG 3.1Å; G1111-S1128 PolarHBondContact O-OG 2.99Å; T1114-S1128 VanDerWaalsContact OG1-CB 3.25Å; T1114-S1128 WeakPolarHBondContact OG1-CB 3.32Å; G1124-S1128 PolarHBondContact O-N 3.33Å; G1124-S1128 PolarHBondContact O-OG 3.08Å; G1124-S1128 VanDerWaalsContact O-OG 3.04Å; A1125-S1128 PolarHBondContact O-OG 3.2Å; L1126-S1128 PolarHBondContact O-N 3.49Å; S1128-R1131 PolarHBondContact O-N 2.93Å; S1128-E1132 PolarHBondContact O-N 3.07Å
1129	G	98.5	Very high	96	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-65.7	-38.5	173	0	0	0	0	0	113.5	S369 A373 A1125 L1126 L1127 A1133	S369-G1129 WeakPolarHBondContact O-CA 3.4Å; A373-G1129 WeakPolarHBondContact CA-O 3.44Å; A373-G1129 WeakPolarHBondContact CB-O 3.24Å; A1125-G1129 PolarHBondContact O-N 3.33Å; L1126-G1129 PolarHBondContact O-N 3.4Å; L1126-G1129 VanDerWaalsContact O-N 3.13Å; L1127-G1129 VanDerWaalsContact C-N 3.27Å; L1127-G1129 PolarHBondContact O-N 2.88Å; G1129-A1133 WeakPolarHBondContact O-CB 3.31Å; G1129-A1133 PolarHBondContact O-N 3.27Å; G1129-A1133 VanDerWaalsContact O-N 3.17Å
1130	L	97.9	Very high	95.6	Very high	7 Å²	7	19 Å²	19	4%	0.037	9%	0.093	C	C	.	.	H	α-helix	trans	-68.2	-43.1	172.7	-67.4	174.5	0	0	0	111.6	F282 I372 Q376 L1126 L1127 A1133 A1134	F282-L1130 HydrophobicContact CB-CD1 4.34Å; F282-L1130 HydrophobicContact CB-CD2 3.94Å; F282-L1130 HydrophobicContact CD2-CD1 4.31Å; F282-L1130 HydrophobicContact CG-CD1 4.22Å; I372-L1130 HydrophobicContact CG1-CD2 3.72Å; I372-L1130 HydrophobicContact CG1-CG 4.08Å; I372-L1130 HydrophobicContact CG2-CG 4.39Å; Q376-L1130 HydrophobicContact CB-CD2 4.36Å; Q376-L1130 HydrophobicContact CG-CD2 4.29Å; L1126-L1130 HydrophobicContact CD2-CD1 3.65Å; L1126-L1130 HydrophobicContact CD2-CG 4.19Å; L1126-L1130 PolarHBondContact O-N 3.16Å; L1126-L1130 VanDerWaalsContact O-N 3.16Å; L1127-L1130 PolarHBondContact O-N 2.98Å; L1127-L1130 VanDerWaalsContact O-N 3.14Å; L1130-A1133 PolarHBondContact O-N 3.16Å; L1130-A1134 WeakPolarHBondContact O-CB 3.3Å; L1130-A1134 PolarHBondContact O-N 3.49Å
1131	R	97.5	Very high	95	Very high	72 Å²	72	18.1 Å²	18.1	27%	0.272	8%	0.083	S	C	.	.	H	α-helix	trans	-56.9	-50.7	176.4	-173.7	-168.1	66.6	-138.6	-8.3	112	F1109 T1114 L1127 S1128 A1133 A1134 R1135	F1109-R1131 PolarHBondContact O-NH2 3.11Å; F1109-R1131 VanDerWaalsContact O-NH2 3.09Å; T1114-R1131 PolarHBondContact O-NH1 3.35Å; T1114-R1131 PolarHBondContact OG1-NH2 3.4Å; T1114-R1131 VanDerWaalsContact OG1-NH2 3.15Å; L1127-R1131 PolarHBondContact O-N 3.4Å; S1128-R1131 PolarHBondContact O-N 2.93Å; R1131-A1133 PolarHBondContact O-N 3.24Å; R1131-A1134 WeakPolarHBondContact O-CB 3.33Å; R1131-A1134 PolarHBondContact O-N 3.05Å; R1131-R1135 WeakPolarHBondContact O-CB 3.49Å; R1131-R1135 PolarHBondContact O-N 3.22Å
1132	E	98.1	Very high	93.5	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-69.2	-33.1	178.9	-62.3	-41.9	119.3	0	0	112.6	I824 F1108 F1109 A1110 S1128 A1134 R1135 V1136	I824-E1132 HydrophobicContact CD1-CB 4.12Å; I824-E1132 HydrophobicContact CG2-CB 4.21Å; I824-E1132 HydrophobicContact CG2-CG 4.46Å; F1108-E1132 HydrophobicContact CB-CB 4.38Å; F1108-E1132 HydrophobicContact CB-CG 4.33Å; F1108-E1132 WeakPolarHBondContact CB-OE2 3.44Å; F1108-E1132 WeakPolarHBondContact CD1-OE2 3.46Å; F1109-E1132 VanDerWaalsContact O-CD 3.3Å; F1109-E1132 WeakPolarHBondContact O-CG 3.35Å; A1110-E1132 HydrophobicContact CB-CB 4.39Å; A1110-E1132 HydrophobicContact CB-CG 3.76Å; S1128-E1132 PolarHBondContact O-N 3.07Å; E1132-A1134 VanDerWaalsContact C-N 3.33Å; E1132-A1134 PolarHBondContact O-N 3.2Å; E1132-R1135 VanDerWaalsContact CD-NH1 3.27Å; E1132-R1135 PolarHBondContact O-N 2.8Å; E1132-R1135 IonicContact OE1-CZ 2.99Å; E1132-R1135 IonicContact OE1-NH1 3.63Å; E1132-R1135 PolarHBondContact OE1-NH1 3.16Å; E1132-R1135 IonicContact OE2-CZ 3.27Å; E1132-R1135 IonicContact OE2-NE 2.91Å; E1132-R1135 IonicContact OE2-NH1 2.73Å; E1132-R1135 PolarHBondContact OE2-NH1 3.09Å; E1132-V1136 VanDerWaalsContact O-CB 3.28Å; E1132-V1136 WeakPolarHBondContact O-CB 3.36Å; E1132-V1136 VanDerWaalsContact O-CG2 3.22Å; E1132-V1136 WeakPolarHBondContact O-CG2 3.49Å; E1132-V1136 PolarHBondContact O-N 3.11Å
1133	A	96.9	Very high	92	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.1	-39.7	172.3	0	0	0	0	0	112.1	Q376 L377 G1129 L1130 R1131 A1137	Q376-A1133 HydrophobicContact CB-CB 3.89Å; Q376-A1133 HydrophobicContact CG-CB 4.36Å; L377-A1133 HydrophobicContact CD2-CB 4.3Å; L377-A1133 HydrophobicContact CG-CB 4.03Å; G1129-A1133 WeakPolarHBondContact O-CB 3.31Å; G1129-A1133 PolarHBondContact O-N 3.27Å; G1129-A1133 VanDerWaalsContact O-N 3.17Å; L1130-A1133 PolarHBondContact O-N 3.16Å; R1131-A1133 PolarHBondContact O-N 3.24Å; A1133-A1137 VanDerWaalsContact O-CB 3.25Å; A1133-A1137 WeakPolarHBondContact O-CB 3.49Å; A1133-A1137 PolarHBondContact O-N 3.04Å
1134	A	94.2	Very high	90.2	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-66.2	-44.5	174	0	0	0	0	0	112.1	R276 Y277 L1130 R1131 E1132 A1137 N1138	R276-A1134 WeakPolarHBondContact O-CA 3.48Å; R276-A1134 WeakPolarHBondContact O-CB 3.39Å; Y277-A1134 HydrophobicContact CD1-CB 3.59Å; Y277-A1134 HydrophobicContact CE1-CB 4.11Å; Y277-A1134 HydrophobicContact CG-CB 4.25Å; L1130-A1134 WeakPolarHBondContact O-CB 3.3Å; L1130-A1134 PolarHBondContact O-N 3.49Å; R1131-A1134 WeakPolarHBondContact O-CB 3.33Å; R1131-A1134 PolarHBondContact O-N 3.05Å; E1132-A1134 VanDerWaalsContact C-N 3.33Å; E1132-A1134 PolarHBondContact O-N 3.2Å; A1134-A1137 CarbonylContact O-C 3.34Å; A1134-A1137 WeakPolarHBondContact O-CA 3.35Å; A1134-A1137 WeakPolarHBondContact O-CB 3.33Å; A1134-A1137 PolarHBondContact O-N 3.33Å; A1134-A1137 VanDerWaalsContact O-N 3.16Å; A1134-N1138 PolarHBondContact O-N 3.14Å; A1134-N1138 PolarHBondContact O-OD1 3.47Å
1135	R	93.8	Very high	88.9	Confident	48 Å²	48	30.4 Å²	30.4	18%	0.181	16%	0.162	C	C	.	.	H	α-helix	trans	-65.2	-44.4	179	-163.8	-169.8	-87.7	170.1	-24	111.6	A1069 E1070 F1108 R1131 E1132 A1137 N1138 Y1139	A1069-R1135 PolarHBondContact O-NH1 3.44Å; E1070-R1135 IonicContact OE1-CZ 2.67Å; E1070-R1135 IonicContact OE1-NH2 3.49Å; E1070-R1135 PolarHBondContact OE1-NH2 3.13Å; F1108-R1135 HydrophobicContact CD1-CB 4.47Å; F1108-R1135 HydrophobicContact CD1-CG 4.27Å; F1108-R1135 HydrophobicContact CE1-CB 4.37Å; F1108-R1135 HydrophobicContact CE1-CG 3.96Å; R1131-R1135 WeakPolarHBondContact O-CB 3.49Å; R1131-R1135 PolarHBondContact O-N 3.22Å; E1132-R1135 VanDerWaalsContact CD-NH1 3.27Å; E1132-R1135 PolarHBondContact O-N 2.8Å; E1132-R1135 IonicContact OE1-CZ 2.99Å; E1132-R1135 IonicContact OE1-NH1 3.63Å; E1132-R1135 PolarHBondContact OE1-NH1 3.16Å; E1132-R1135 IonicContact OE2-CZ 3.27Å; E1132-R1135 IonicContact OE2-NE 2.91Å; E1132-R1135 IonicContact OE2-NH1 2.73Å; E1132-R1135 PolarHBondContact OE2-NH1 3.09Å; R1135-A1137 VanDerWaalsContact C-N 3.3Å; R1135-A1137 PolarHBondContact O-N 3.31Å; R1135-N1138 WeakPolarHBondContact O-CB 3.46Å; R1135-N1138 PolarHBondContact O-N 3.2Å; R1135-Y1139 HydrophobicContact CG-CD2 4.48Å; R1135-Y1139 HydrophobicContact CG-CE2 4.25Å; R1135-Y1139 VanDerWaalsContact O-CD2 3.3Å; R1135-Y1139 WeakPolarHBondContact O-CD2 3.31Å; R1135-Y1139 PolarHBondContact O-N 2.95Å
1136	V	93.7	Very high	87.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.5	-41.3	170.5	168.8	0	0	0	0	110.7	F361 L377 I824 F1108 E1132 N1138 Y1139 Y1140 F1141	F361-V1136 HydrophobicContact CD1-CG1 3.88Å; F361-V1136 HydrophobicContact CD2-CG1 4.16Å; F361-V1136 HydrophobicContact CE1-CG1 3.45Å; F361-V1136 VanDerWaalsContact CE1-CG1 3.45Å; F361-V1136 HydrophobicContact CE2-CG1 3.76Å; F361-V1136 HydrophobicContact CG-CG1 4.21Å; F361-V1136 HydrophobicContact CZ-CG1 3.38Å; L377-V1136 HydrophobicContact CD1-CG1 4.41Å; L377-V1136 HydrophobicContact CD2-CB 4.2Å; L377-V1136 HydrophobicContact CD2-CG1 3.79Å; I824-V1136 HydrophobicContact CD1-CG2 4.25Å; I824-V1136 HydrophobicContact CG1-CG2 4.3Å; F1108-V1136 HydrophobicContact CB-CG2 4.46Å; F1108-V1136 HydrophobicContact CD1-CG2 3.83Å; F1108-V1136 HydrophobicContact CD2-CG2 3.61Å; F1108-V1136 HydrophobicContact CE1-CG2 3.87Å; F1108-V1136 HydrophobicContact CE2-CG2 3.67Å; F1108-V1136 HydrophobicContact CG-CG2 3.7Å; F1108-V1136 HydrophobicContact CZ-CG2 3.78Å; E1132-V1136 VanDerWaalsContact O-CB 3.28Å; E1132-V1136 WeakPolarHBondContact O-CB 3.36Å; E1132-V1136 VanDerWaalsContact O-CG2 3.22Å; E1132-V1136 WeakPolarHBondContact O-CG2 3.49Å; E1132-V1136 PolarHBondContact O-N 3.11Å; V1136-N1138 VanDerWaalsContact C-N 3.32Å; V1136-N1138 PolarHBondContact O-N 3.15Å; V1136-Y1139 PolarHBondContact O-N 3.2Å; V1136-Y1140 HydrophobicContact CG1-CD2 4.26Å; V1136-Y1140 PolarHBondContact O-N 3.5Å; V1136-F1141 HydrophobicContact CG1-CE2 4.28Å
1137	A	90.2	Very high	87.1	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.1	-31.5	175.9	0	0	0	0	0	113.8	F380 A1133 A1134 R1135 Y1139 F1141	F380-A1137 HydrophobicContact CD2-CB 3.86Å; F380-A1137 HydrophobicContact CE2-CB 3.79Å; A1133-A1137 VanDerWaalsContact O-CB 3.25Å; A1133-A1137 WeakPolarHBondContact O-CB 3.49Å; A1133-A1137 PolarHBondContact O-N 3.04Å; A1134-A1137 CarbonylContact O-C 3.34Å; A1134-A1137 WeakPolarHBondContact O-CA 3.35Å; A1134-A1137 WeakPolarHBondContact O-CB 3.33Å; A1134-A1137 PolarHBondContact O-N 3.33Å; A1134-A1137 VanDerWaalsContact O-N 3.16Å; R1135-A1137 VanDerWaalsContact C-N 3.3Å; R1135-A1137 PolarHBondContact O-N 3.31Å; A1137-Y1139 VanDerWaalsContact C-N 3.34Å; A1137-F1141 VanDerWaalsContact CA-CD2 3.5Å; A1137-F1141 HydrophobicContact CB-CD2 4.1Å; A1137-F1141 HydrophobicContact CB-CE2 4.35Å; A1137-F1141 HydrophobicContact CB-CG 4.34Å; A1137-F1141 WeakPolarHBondContact O-CB 3.37Å
1138	N	88.8	Confident	86.5	Confident	35 Å²	35	40.9 Å²	40.9	19%	0.187	21%	0.205	C	C	.	.	H	α-helix	trans	-67.8	-30.2	173.8	-70.9	-8.5	0	0	0	112.8	R276 Y277 A1134 R1135 V1136 T1145	R276-N1138 WeakPolarHBondContact CD-OD1 3.45Å; R276-N1138 PolarHBondContact NH1-OD1 2.63Å; Y277-N1138 PolarHBondContact OH-ND2 2.97Å; Y277-N1138 VanDerWaalsContact OH-ND2 3.13Å; A1134-N1138 PolarHBondContact O-N 3.14Å; A1134-N1138 PolarHBondContact O-OD1 3.47Å; R1135-N1138 WeakPolarHBondContact O-CB 3.46Å; R1135-N1138 PolarHBondContact O-N 3.2Å; V1136-N1138 VanDerWaalsContact C-N 3.32Å; V1136-N1138 PolarHBondContact O-N 3.15Å; N1138-T1145 HydrophobicContact CB-CG2 4.31Å
1139	Y	89	Confident	85.8	Confident	68 Å²	68	43.7 Å²	43.7	27%	0.267	23%	0.228	S	C	.	.	H	α-helix	trans	-95.4	-31.9	-177.6	-78.1	-70.8	0	0	0	115.4	Y1073 M1100 N1104 P1105 F1108 R1135 V1136 A1137	Y1073-Y1139 PolarHBondContact OH-OH 3.24Å; M1100-Y1139 HydrophobicContact CE-CE1 4.5Å; N1104-Y1139 PolarHBondContact ND2-O 3.1Å; P1105-Y1139 HydrophobicContact CG-CD1 4.26Å; P1105-Y1139 HydrophobicContact CG-CD2 3.64Å; P1105-Y1139 HydrophobicContact CG-CE1 4.1Å; P1105-Y1139 HydrophobicContact CG-CE2 3.47Å; P1105-Y1139 VanDerWaalsContact CG-CE2 3.47Å; P1105-Y1139 HydrophobicContact CG-CG 4.06Å; F1108-Y1139 HydrophobicContact CE1-CD2 4.16Å; F1108-Y1139 HydrophobicContact CZ-CD2 4.16Å; R1135-Y1139 HydrophobicContact CG-CD2 4.48Å; R1135-Y1139 HydrophobicContact CG-CE2 4.25Å; R1135-Y1139 VanDerWaalsContact O-CD2 3.3Å; R1135-Y1139 WeakPolarHBondContact O-CD2 3.31Å; R1135-Y1139 PolarHBondContact O-N 2.95Å; V1136-Y1139 PolarHBondContact O-N 3.2Å; A1137-Y1139 VanDerWaalsContact C-N 3.34Å
1140	Y	89.9	Confident	85.2	Confident	37 Å²	37	45.2 Å²	45.2	15%	0.145	24%	0.239	C	C	.	.	H	α-helix	trans	-117.8	-7	-165.8	-71.8	-87	0	0	0	115.6	F361 D821 A822 N1104 P1105 R1106 F1108 V1136	F361-Y1140 HydrophobicContact CE1-CD1 4.3Å; F361-Y1140 HydrophobicContact CE1-CD2 4.08Å; F361-Y1140 AromaticContact CE1-CG 3.91Å; F361-Y1140 HydrophobicContact CE1-CG 3.91Å; F361-Y1140 HydrophobicContact CZ-CD2 4.45Å; F361-Y1140 HydrophobicContact CZ-CG 4.03Å; D821-Y1140 HydrophobicContact CB-CD1 4.17Å; D821-Y1140 HydrophobicContact CB-CE1 4Å; A822-Y1140 HydrophobicContact CB-CE2 3.9Å; N1104-Y1140 HydrophobicContact CB-CE1 4.23Å; N1104-Y1140 HydrophobicContact CB-CE2 4.12Å; N1104-Y1140 WeakPolarHBondContact CB-OH 3.33Å; P1105-Y1140 PolarHBondContact O-OH 2.99Å; R1106-Y1140 PolarHBondContact NH1-OH 2.84Å; F1108-Y1140 HydrophobicContact CE2-CE2 4.01Å; F1108-Y1140 HydrophobicContact CZ-CE2 4.04Å; V1136-Y1140 HydrophobicContact CG1-CD2 4.26Å; V1136-Y1140 PolarHBondContact O-N 3.5Å
1141	F	84.5	Confident	84.6	Confident	14 Å²	14	47.6 Å²	47.6	6%	0.061	27%	0.265	C	S	.	.	S	Bend	trans	-108.5	139.9	-174.9	-70.1	-122.7	0	0	0	110.9	V295 F361 L377 F380 A382 V1136 A1137 G1143	V295-F1141 HydrophobicContact CG2-CB 4.49Å; V295-F1141 HydrophobicContact CG2-CD1 3.22Å; V295-F1141 HydrophobicContact CG2-CE1 3.55Å; V295-F1141 HydrophobicContact CG2-CG 3.98Å; F361-F1141 AromaticContact CE2-CE2 3.57Å; F361-F1141 HydrophobicContact CE2-CE2 3.57Å; F361-F1141 AromaticContact CE2-CZ 3.92Å; F361-F1141 HydrophobicContact CE2-CZ 3.92Å; F361-F1141 AromaticContact CZ-CE2 3.83Å; F361-F1141 HydrophobicContact CZ-CE2 3.83Å; L377-F1141 HydrophobicContact CD2-CE2 3.94Å; L377-F1141 HydrophobicContact CD2-CZ 3.83Å; F380-F1141 HydrophobicContact CB-CD1 4Å; F380-F1141 HydrophobicContact CB-CE1 3.33Å; F380-F1141 HydrophobicContact CB-CZ 4Å; F380-F1141 HydrophobicContact CD2-CE1 4.36Å; F380-F1141 HydrophobicContact CD2-CZ 4.48Å; F380-F1141 HydrophobicContact CG-CE1 4.36Å; A382-F1141 HydrophobicContact CB-CE1 4.18Å; A382-F1141 HydrophobicContact CB-CZ 3.62Å; V1136-F1141 HydrophobicContact CG1-CE2 4.28Å; A1137-F1141 VanDerWaalsContact CA-CD2 3.5Å; A1137-F1141 HydrophobicContact CB-CD2 4.1Å; A1137-F1141 HydrophobicContact CB-CE2 4.35Å; A1137-F1141 HydrophobicContact CB-CG 4.34Å; A1137-F1141 WeakPolarHBondContact O-CB 3.37Å; F1141-G1143 PolarHBondContact O-N 3.44Å
1142	P	65.7	Low	84.2	Confident	72 Å²	72	45.2 Å²	45.2	47%	0.468	26%	0.257	S	S	.	.	S	Bend	trans	-73	119.2	-170.7	28.8	-34.4	0	0	0	112.4	V295	V295-P1142 HydrophobicContact CG1-CG 4.23Å
1143	G	66.1	Low	83.8	Confident	58 Å²	58	52.6 Å²	52.6	60%	0.598	29%	0.289	S	S	*	.	S	Bend	trans	-179.2	170.2	173.1	0	0	0	0	0	111.9	F1141 T1145	F1141-G1143 PolarHBondContact O-N 3.44Å; G1143-T1145 PolarHBondContact O-N 2.88Å
1144	Q	59.7	Low	83.3	Confident	137 Å²	137	55.6 Å²	55.6	64%	0.64	30%	0.304	S	S	*	.			trans	-75.5	115.7	163.8	-72.3	-177.3	-7.5	0	0	108.1	V1147	Q1144-V1147 VanDerWaalsContact O-CG2 3.25Å; Q1144-V1147 WeakPolarHBondContact O-CG2 3.5Å
1145	T	69.3	Low	82.5	Confident	53 Å²	53	58.1 Å²	58.1	33%	0.325	32%	0.318	S	S	.	.	S	Bend	trans	-142.9	114.6	172.7	-67	0	0	0	0	106	L140 R276 N1138 G1143	L140-T1145 HydrophobicContact CD1-CG2 3.97Å; R276-T1145 PolarHBondContact NH1-OG1 2.96Å; N1138-T1145 HydrophobicContact CB-CG2 4.31Å; G1143-T1145 PolarHBondContact O-N 2.88Å
1146	P	77.3	Confident	80.8	Confident	44 Å²	44	62.3 Å²	62.3	29%	0.286	35%	0.349	S	S	.	.	S	Bend	cis	-65.1	153.5	-5.8	28.5	-36.5	0	0	0	113.9	Q139 P142 R1148	Q139-P1146 WeakPolarHBondContact O-CB 3.21Å; P142-P1146 HydrophobicContact CG-CB 3.69Å; P142-P1146 HydrophobicContact CG-CG 4.36Å; P1146-R1148 HydrophobicContact CG-CG 4.12Å; P1146-R1148 PolarHBondContact O-N 3.44Å
1147	V	82.7	Confident	78.5	Confident	10 Å²	10	66.3 Å²	66.3	6%	0.061	38%	0.377	C	S	.	.			trans	-83.1	97	169.3	-174.9	0	0	0	0	108.4	L140 F141 F143 Q1144 A1149	L140-V1147 PolarHBondContact O-N 2.98Å; F141-V1147 HydrophobicContact CD1-CB 4Å; F141-V1147 HydrophobicContact CD1-CG2 4.2Å; F141-V1147 HydrophobicContact CE1-CB 4.39Å; F141-V1147 HydrophobicContact CE1-CG2 4.12Å; F143-V1147 WeakPolarHBondContact CD1-O 3.34Å; Q1144-V1147 VanDerWaalsContact O-CG2 3.25Å; Q1144-V1147 WeakPolarHBondContact O-CG2 3.5Å; V1147-A1149 VanDerWaalsContact C-N 3.3Å; V1147-A1149 PolarHBondContact O-N 2.92Å
1148	R	84.2	Confident	76.2	Confident	202 Å²	202	70.4 Å²	70.4	76%	0.762	40%	0.396	S	S	*	.			trans	-77.8	-3.8	-171.2	-59.4	-173.4	-178.2	-158.7	-2.3	115.8	P1146	P1146-R1148 HydrophobicContact CG-CG 4.12Å; P1146-R1148 PolarHBondContact O-N 3.44Å
1149	A	84.2	Confident	73.6	Confident	60 Å²	60	74.4 Å²	74.4	50%	0.496	43%	0.427	S	S	.	.			trans	-139.8	132.5	-175.2	0	0	0	0	0	112.2	R265 V1147	R265-A1149 PolarHBondContact NH2-O 3.48Å; V1147-A1149 VanDerWaalsContact C-N 3.3Å; V1147-A1149 PolarHBondContact O-N 2.92Å
1150	S	84.7	Confident	70.9	Confident	32 Å²	32	76.2 Å²	76.2	22%	0.224	45%	0.445	C	S	.	.			trans	-62.3	-50	-178.8	72	0	0	0	0	112	R265 F1152	R265-S1150 VanDerWaalsContact CZ-O 3.3Å; R265-S1150 PolarHBondContact NE-O 3.36Å; R265-S1150 PolarHBondContact NH2-O 3.35Å; S1150-F1152 VanDerWaalsContact C-N 3.25Å; S1150-F1152 PolarHBondContact OG-N 3.15Å
1151	G	85.3	Confident	68.1	Low	57 Å²	57	82 Å²	82	59%	0.588	48%	0.478	S	S	*	.			trans	77	4.8	-173.1	0	0	0	0	0	114.4
1152	F	90.9	Very high	65.5	Low	21 Å²	21	88.8 Å²	88.8	9%	0.092	52%	0.515	C	S	.	.			trans	-71.6	147.5	174.7	-59.9	-58.3	0	0	0	111.6	F143 L151 L200 N262 R265 M266 L269 S1150 L1154	F143-F1152 HydrophobicContact CE2-CE2 4.22Å; F143-F1152 HydrophobicContact CZ-CE2 4.48Å; L151-F1152 HydrophobicContact CD1-CD2 4.02Å; L151-F1152 HydrophobicContact CD1-CE2 3.92Å; L151-F1152 HydrophobicContact CD2-CD2 4.03Å; L151-F1152 HydrophobicContact CD2-CE2 4.36Å; L200-F1152 HydrophobicContact CD2-CB 4.25Å; L200-F1152 HydrophobicContact CD2-CD1 3.77Å; L200-F1152 HydrophobicContact CD2-CD2 4.36Å; L200-F1152 HydrophobicContact CD2-CE1 4.18Å; L200-F1152 HydrophobicContact CD2-CG 3.89Å; N262-F1152 HydrophobicContact CB-CD1 4.47Å; N262-F1152 WeakPolarHBondContact O-CE1 3.33Å; R265-F1152 HydrophobicContact CB-CD1 4.11Å; R265-F1152 HydrophobicContact CB-CE1 3.85Å; R265-F1152 HydrophobicContact CG-CD1 3.83Å; R265-F1152 HydrophobicContact CG-CE1 3.58Å; R265-F1152 HydrophobicContact CG-CZ 4.34Å; M266-F1152 HydrophobicContact CB-CE1 4.05Å; M266-F1152 HydrophobicContact CB-CZ 4.24Å; M266-F1152 HydrophobicContact CE-CE1 4.23Å; M266-F1152 HydrophobicContact CE-CE2 4.03Å; M266-F1152 HydrophobicContact CE-CZ 3.57Å; M266-F1152 HydrophobicContact SD-CE1 4.47Å; M266-F1152 HydrophobicContact SD-CZ 3.75Å; L269-F1152 HydrophobicContact CD1-CZ 3.99Å; S1150-F1152 VanDerWaalsContact C-N 3.25Å; S1150-F1152 PolarHBondContact OG-N 3.15Å; F1152-L1154 HydrophobicContact CB-CD2 3.57Å; F1152-L1154 HydrophobicContact CB-CG 4.17Å; F1152-L1154 HydrophobicContact CG-CD2 4.31Å
1153	K	89.8	Confident	63.7	Low	155 Å²	155	94 Å²	94	67%	0.674	53%	0.533	S	S	*	.			trans	-108.4	86.5	170.5	-69.2	-179	-178.3	178.5	0	108.2	T258 N262	T258-K1153 HydrophobicContact CG2-CB 3.65Å; N262-K1153 PolarHBondContact ND2-O 3.27Å; N262-K1153 PolarHBondContact OD1-N 3.48Å
1154	L	86	Confident	62	Low	63 Å²	63	103.4 Å²	103.4	33%	0.33	56%	0.557	S	S	.	*			trans	-77.9	142.9	-177.2	-49	-178.2	0	0	0	110.7	L151 S198 G199 L200 F1152 T1156	L151-L1154 HydrophobicContact CD2-CD1 4.15Å; S198-L1154 WeakPolarHBondContact O-CD2 3.42Å; G199-L1154 WeakPolarHBondContact O-CA 3.3Å; L200-L1154 HydrophobicContact CD2-CD2 3.58Å; L200-L1154 HydrophobicContact CG-CD2 4.17Å; F1152-L1154 HydrophobicContact CB-CD2 3.57Å; F1152-L1154 HydrophobicContact CB-CG 4.17Å; F1152-L1154 HydrophobicContact CG-CD2 4.31Å; L1154-T1156 PolarHBondContact O-N 3.03Å
1155	N	77.2	Confident	62.1	Low	55 Å²	55	101.7 Å²	101.7	29%	0.294	55%	0.553	S	S	.	*			trans	-79.1	98.7	177.2	-67.7	-61.5	0	0	0	111.3	G199 T201 P203 S1157	G199-N1155 PolarHBondContact O-N 2.98Å; G199-N1155 VanDerWaalsContact O-N 3.08Å; G199-N1155 PolarHBondContact O-ND2 3.15Å; T201-N1155 PolarHBondContact O-ND2 3.21Å; P203-N1155 HydrophobicContact CG-CB 4.29Å; N1155-S1157 PolarHBondContact O-N 2.92Å
1156	T	57.5	Low	61.8	Low	135 Å²	135	104.3 Å²	104.3	83%	0.828	57%	0.565	S	S	*	*			trans	-77.2	34.1	-174.5	62.4	0	0	0	0	114.5	L1154	L1154-T1156 PolarHBondContact O-N 3.03Å
1157	S	44.7	Very low	60.9	Low	84 Å²	84	107.6 Å²	107.6	59%	0.587	58%	0.581	S	S	*	*			trans	-145	55.5	-162.4	68	0	0	0	0	115.3	N1155	N1155-S1157 PolarHBondContact O-N 2.92Å
1158	Q	43.1	Very low	59.6	Low	86 Å²	86	113.4 Å²	113.4	40%	0.402	61%	0.611	S	S	.	*			trans	-155.1	-2.2	161.2	-117.3	158.7	28.7	0	0	116.1	L204 T1160	L204-Q1158 PolarHBondContact O-NE2 3Å; Q1158-T1160 PolarHBondContact O-N 3.33Å
1159	S	34.4	Very low	58.1	Low	119 Å²	119	107.8 Å²	107.8	83%	0.832	60%	0.602	S	S	*	*	S	Bend	trans	-75.3	13.6	-177.8	63	0	0	0	0	115.8
1160	T	31.8	Very low	56.3	Low	107 Å²	107	111 Å²	111	66%	0.656	61%	0.609	S	S	*	*	S	Bend	trans	-140.2	122.6	174.3	54.1	0	0	0	0	109	Q1158	Q1158-T1160 PolarHBondContact O-N 3.33Å
1161	N	30.8	Very low	54.3	Low	157 Å²	157	116.6 Å²	116.6	84%	0.84	64%	0.636	S	S	*	*			trans	112.3	2.4	175.3	-58.8	-20.8	0	0	0	118	H1163	N1161-H1163 PolarHBondContact O-N 2.94Å
1162	L	30.5	Very low	51.9	Low	158 Å²	158	121.2 Å²	121.2	83%	0.827	64%	0.64	S	S	*	*			trans	-79.8	68.9	162	-85.1	167.7	0	0	0	110.9
1163	H	27.3	Very low	48.7	Very low	182 Å²	182	129.6 Å²	129.6	84%	0.843	69%	0.686	S	S	*	*			trans	-105.9	99.7	167	-125.1	-54.9	0	0	0	107.8	N1161	N1161-H1163 PolarHBondContact O-N 2.94Å
1164	F	31.1	Very low	44.9	Very low	254 Å²	254	127.3 Å²	127.3	100%	1.114	69%	0.687	S	S	*	*			trans	-150.8	0	171.9	-103	-75.2	0	0	0	109.4

Retrieved 1,164 of 1,164 residues in 355.1 ms (Link to these results)

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