A0A096NDX2_PAPAN Loading...

Inter-alpha-trypsin inhibitor heavy chain H3

May act as a carrier of hyaluronan in serum or as a binding protein between hyaluronan and other matrix protein, including those on cell surfaces in tissues to regulate the localization, synthesis and degradation of hyaluronan which are essential to cells undergoing biological processes.

AlphaFold DB , UniProt , Accession A0A096NDX2, Species PAPAN (Papio anubis, Olive baboon), Gene ITIH3, Length 891 aa.

						>A0A096NDX2_PAPAN|A0A096NDX2|ITIH3
MASAWWPCLILALLSGLAASGFPRSPFLLLGKRSLPEGVANGVEVYSTKINSKVTSRFAHNVVTTRAVNRADTAKEVSFDVELPKTAFITNFTLTIDGVTYPGNVKEKEVAKKQYEKAVSQGKTAGLVKASGRKLEKFTVSVNVAAGSKVTFELTYEELLKRHKGKYEMYLKVQPKQLIKHFEIDVDIFEPQGISMLDAEASFITNDLLGSALTKSFSGKKGHVSFKPSLDQQRSCPTCTDSLLNGDFTITYDVNRESPGNVQIVNGYFVHFFAPQGLPVVPKNVAFVIDISGSMAGRKLEQTKEALLRILEDMKEEDYLNFILFSGDVSTWKEHLVQATPENLQEARTFVKSMEDKGMTNINDGLLRGISMLNKAREEHRVPERSTSIVIMLTDGDANVGESRPEKIQENVRNAIGGKFPLYNLGFGNNLNYNFLENMALENHGFARRIYEDSDADLQLQGFYEEVANPLLTGVEMEYPENAILGLTQNTYQHFYDGSEIVVAGHLVGEDVNSFKADVKGHGAANDLTFTEEVDMKEMEKALQERDYIFGNYIERLWAYLTIEQLLEKRKNAHGEEKENLTAQALDLSLKYHFVTPLTSMVVTKPEDNEDERAIADKPGEDAEATPVSPAMSYLTSYQPPQNPYYYVDGDPHFIIQVPEKDDALCFNINEAPGTVLRLIQDPVTGLTVNGQIVGDKRSSPDSKTRKTYFGKLGIANAQMDFQVEVTTEKITLWNRAVPSTFSWLDTVTVTQDGLSMMINRKKNMVVSFGDGVTFVVVLHQVWKKHPVHRDFLGFYVVDSHRMSAQTHGLLGQFFQPFDFKVFDIRPGSDPTKPDATLMVKNHQLTVTRGSQKDYRKDASIGMKVVCWFVHNNGEGLIDGVHTDYIVPNLF
					

Structure Viewer

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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	35.5	Very low	33.2	Very low	242 Å²	242	149.5 Å²	149.5	100%	1.192	80%	0.801	S	S	*	*				0	76.2	0	-71.9	-177.3	-92.9	0	0	105.9
2	A	31.2	Very low	32.9	Very low	97 Å²	97	143.3 Å²	143.3	80%	0.802	79%	0.786	S	S	*	*				77.4	127.8	88.6	0	0	0	0	0	110.2
3	S	30.5	Very low	32.5	Very low	108 Å²	108	143.6 Å²	143.6	76%	0.755	79%	0.785	S	S	*	*			cis	-177.6	150.9	-8.2	34	0	0	0	0	104.7
4	A	37.2	Very low	32.2	Very low	88 Å²	88	144.3 Å²	144.3	73%	0.727	79%	0.786	S	S	*	*			trans	-51.9	164.8	166.8	0	0	0	0	0	112.2
5	W	29.2	Very low	32	Very low	261 Å²	261	142 Å²	142	99%	0.989	79%	0.785	S	S	*	*			trans	-164.3	148.8	134.4	-94.6	18.4	0	0	0	111.4
6	W	28	Very low	31.7	Very low	243 Å²	243	137.2 Å²	137.2	92%	0.92	78%	0.778	S	S	*	*			trans	-107.4	-162.9	-169.5	-133.4	28.2	0	0	0	106.6
7	P	56.3	Low	31.6	Very low	88 Å²	88	139.9 Å²	139.9	57%	0.571	79%	0.789	S	S	*	*				-136.1	-145.2	-67.7	35.4	-12.3	0	0	0	110.2
8	C	27.9	Very low	31.4	Very low	103 Å²	103	137.2 Å²	137.2	70%	0.696	79%	0.787	S	S	*	*			trans	89.1	144.7	153.6	-73.4	0	0	0	0	118.7
9	L	29.8	Very low	31.3	Very low	136 Å²	136	135.3 Å²	135.3	71%	0.712	79%	0.789	S	S	*	*			cis	174.4	142	-12.1	-138.5	114.7	0	0	0	102.1
10	I	31.5	Very low	31.3	Very low	134 Å²	134	134.8 Å²	134.8	69%	0.687	79%	0.793	S	S	*	*				153.5	129.1	100	-93.5	160.3	0	0	0	112
11	L	28.2	Very low	31.1	Very low	144 Å²	144	131.9 Å²	131.9	75%	0.754	79%	0.792	S	S	*	*			trans	53.4	153	138.5	-77.7	83.8	0	0	0	121.2
12	A	29.8	Very low	30.9	Very low	76 Å²	76	130.1 Å²	130.1	63%	0.628	78%	0.778	S	S	*	*			cis	-165.6	136.6	13.7	0	0	0	0	0	108.1
13	L	27.1	Very low	30.7	Very low	147 Å²	147	131.2 Å²	131.2	77%	0.77	78%	0.777	S	S	*	*				66.3	114.1	97.2	-81.8	160.4	0	0	0	117
14	L	29	Very low	30.6	Very low	153 Å²	153	137.7 Å²	137.7	80%	0.801	79%	0.785	S	S	*	*				166.7	127.1	112.8	-92	151.6	0	0	0	114.6
15	S	28.6	Very low	30.4	Very low	110 Å²	110	138.3 Å²	138.3	77%	0.769	78%	0.783	S	S	*	*			trans	21.4	145.3	139.4	57.6	0	0	0	0	121.4
16	G	27.4	Very low	30.6	Very low	65 Å²	65	131.6 Å²	131.6	67%	0.67	77%	0.774	S	S	*	*			cis	157.6	156.8	9.1	0	0	0	0	0	110.4
17	L	29.5	Very low	30.6	Very low	184 Å²	184	129.7 Å²	129.7	96%	0.963	77%	0.772	S	S	*	*			trans	64.5	143.3	168	-65.5	127	0	0	0	118.9
18	A	28.3	Very low	29.5	Very low	91 Å²	91	132.8 Å²	132.8	75%	0.752	78%	0.783	S	S	*	*			cis	-175.9	132.5	-22.9	0	0	0	0	0	105.7
19	A	28.8	Very low	29.6	Very low	100 Å²	100	136.3 Å²	136.3	83%	0.826	79%	0.794	S	S	*	*			trans	-161.9	116.7	157.4	0	0	0	0	0	112
20	S	31.6	Very low	29.6	Very low	125 Å²	125	137.7 Å²	137.7	87%	0.874	80%	0.801	S	S	*	*			trans	-12.1	131.7	162.3	52.9	0	0	0	0	120.4
21	G	28.7	Very low	29.4	Very low	74 Å²	74	134.1 Å²	134.1	76%	0.763	80%	0.797	S	S	*	*			trans	176.8	125	157.9	0	0	0	0	0	112.5
22	F	30.3	Very low	29.6	Very low	205 Å²	205	137.3 Å²	137.3	90%	0.899	81%	0.805	S	S	*	*			trans	-52.5	157.5	-178.5	-80.7	-95.3	0	0	0	115.3	R24	F22-R24 PolarHBondContact O-N 3.32Å
23	P	28	Very low	29.7	Very low	120 Å²	120	145.3 Å²	145.3	78%	0.779	82%	0.819	S	S	*	*			trans	-74.3	120.1	-166.7	30.1	-32.7	0	0	0	112
24	R	28.3	Very low	30.3	Very low	245 Å²	245	143.4 Å²	143.4	93%	0.925	82%	0.818	S	S	*	*			trans	-92.7	114.1	157.6	-88.2	-176.3	172.6	175.5	-1.6	108.7	F22	F22-R24 PolarHBondContact O-N 3.32Å
25	S	31.8	Very low	30.8	Very low	100 Å²	100	142.5 Å²	142.5	70%	0.699	81%	0.813	S	S	*	*			trans	-57.4	156.3	168.8	-20.6	0	0	0	0	111.3
26	P	32.9	Very low	31.8	Very low	121 Å²	121	140 Å²	140	79%	0.786	80%	0.795	S	S	*	*			trans	-72.8	132.6	-172.8	2.2	12.6	0	0	0	111.1	L28	P26-L28 PolarHBondContact O-N 2.88Å; P26-L28 VanDerWaalsContact O-N 3.1Å
27	F	29.2	Very low	33.2	Very low	203 Å²	203	143.2 Å²	143.2	89%	0.89	79%	0.792	S	S	*	*			trans	-60.6	109.3	161	-94.3	-97.8	0	0	0	108.6	L29	F27-L29 PolarHBondContact O-N 3.12Å
28	L	32	Very low	34.5	Very low	153 Å²	153	135.4 Å²	135.4	80%	0.801	76%	0.755	S	S	*	*			trans	-58	119.2	156.3	-100.3	119.2	0	0	0	107.7	P26 L30	P26-L28 PolarHBondContact O-N 2.88Å; P26-L28 VanDerWaalsContact O-N 3.1Å; L28-L30 VanDerWaalsContact C-N 3.31Å; L28-L30 PolarHBondContact O-N 2.72Å
29	L	29.8	Very low	36.3	Very low	176 Å²	176	132.2 Å²	132.2	92%	0.921	73%	0.727	S	S	*	*			trans	-59	97.6	160.1	-83.4	150.4	0	0	0	107.7	F27 G31	F27-L29 PolarHBondContact O-N 3.12Å; L29-G31 VanDerWaalsContact C-N 3.33Å; L29-G31 PolarHBondContact O-N 2.66Å
30	L	31	Very low	38.4	Very low	166 Å²	166	129.5 Å²	129.5	87%	0.869	70%	0.704	S	S	*	*			trans	-62.3	97.9	163.6	-96.3	138.3	0	0	0	107.3	L28 K32	L28-L30 VanDerWaalsContact C-N 3.31Å; L28-L30 PolarHBondContact O-N 2.72Å; L30-K32 PolarHBondContact O-N 2.63Å
31	G	27.8	Very low	40.4	Very low	58 Å²	58	130.9 Å²	130.9	60%	0.598	70%	0.702	S	S	*	*			trans	-51.7	128.7	161	0	0	0	0	0	108.3	L29 R33	L29-G31 VanDerWaalsContact C-N 3.33Å; L29-G31 PolarHBondContact O-N 2.66Å; G31-R33 PolarHBondContact O-N 3.18Å
32	K	30.9	Very low	42.9	Very low	211 Å²	211	128.1 Å²	128.1	92%	0.917	67%	0.674	S	S	*	*			trans	-49.7	109.8	165.7	-79.7	179.1	173.4	-179.9	0	107.1	L30 S34	L30-K32 PolarHBondContact O-N 2.63Å; K32-S34 PolarHBondContact O-N 3.47Å; K32-S34 VanDerWaalsContact O-N 3.07Å
33	R	32.4	Very low	45.7	Very low	245 Å²	245	119 Å²	119	93%	0.925	64%	0.635	S	S	*	*			trans	-56.3	115.6	165.2	-86.5	178.5	170.1	172.1	-3.4	106	G31 L35	G31-R33 PolarHBondContact O-N 3.18Å; R33-L35 PolarHBondContact O-N 3.28Å
34	S	39.3	Very low	48.7	Very low	106 Å²	106	113.5 Å²	113.5	74%	0.741	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-49.4	136.3	159.9	41	0	0	0	0	107.9	K32	K32-S34 PolarHBondContact O-N 3.47Å; K32-S34 VanDerWaalsContact O-N 3.07Å
35	L	40.6	Very low	51.7	Low	134 Å²	134	102.7 Å²	102.7	70%	0.702	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-52.5	133.4	170.3	-76.8	160.8	0	0	0	107.8	R33 E37 V39	R33-L35 PolarHBondContact O-N 3.28Å; L35-E37 PolarHBondContact O-N 3.01Å; L35-V39 HydrophobicContact CD2-CG1 4.49Å
36	P	49.9	Very low	54.6	Low	59 Å²	59	100.5 Å²	100.5	38%	0.383	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-53.5	140.1	173.9	-19.3	27.6	0	0	0	110	G38 V39	P36-G38 PolarHBondContact O-N 3.07Å; P36-V39 HydrophobicContact CB-CG2 3.89Å; P36-V39 HydrophobicContact CG-CG2 4.08Å; P36-V39 VanDerWaalsContact O-CG2 3.3Å; P36-V39 WeakPolarHBondContact O-CG2 3.18Å; P36-V39 PolarHBondContact O-N 3.17Å
37	E	55.4	Low	57.6	Low	132 Å²	132	95.8 Å²	95.8	62%	0.617	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	131.3	172.8	-70.8	-179	129.3	0	0	110.2	L35 R234	L35-E37 PolarHBondContact O-N 3.01Å; E37-R234 IonicContact OE1-CZ 2.66Å; E37-R234 IonicContact OE1-NH1 3.13Å; E37-R234 IonicContact OE1-NH2 2.76Å; E37-R234 PolarHBondContact OE1-NH2 2.9Å; E37-R234 IonicContact OE2-NH2 3.12Å
38	G	58.3	Low	60.8	Low	19 Å²	19	86.9 Å²	86.9	20%	0.196	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.7	16.6	-179.1	0	0	0	0	0	116	P36 E44 Q177	P36-G38 PolarHBondContact O-N 3.07Å; G38-E44 WeakPolarHBondContact O-CG 3.43Å; G38-Q177 PolarHBondContact O-OE1 3.3Å
39	V	66.3	Low	63.9	Low	24 Å²	24	82.8 Å²	82.8	15%	0.145	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	110.3	174.3	-176.4	0	0	0	0	110.3	L35 P36 E44	L35-V39 HydrophobicContact CD2-CG1 4.49Å; P36-V39 HydrophobicContact CB-CG2 3.89Å; P36-V39 HydrophobicContact CG-CG2 4.08Å; P36-V39 VanDerWaalsContact O-CG2 3.3Å; P36-V39 WeakPolarHBondContact O-CG2 3.18Å; P36-V39 PolarHBondContact O-N 3.17Å; V39-E44 HydrophobicContact CG2-CB 4.05Å; V39-E44 HydrophobicContact CG2-CG 4.26Å
40	A	71.5	Confident	67.1	Low	44 Å²	44	75 Å²	75	36%	0.364	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	126.1	172.2	0	0	0	0	0	110.7	G42 V43 Q177	A40-G42 PolarHBondContact O-N 2.72Å; A40-V43 PolarHBondContact N-O 3.3Å; A40-V43 PolarHBondContact O-N 2.65Å; A40-V43 VanDerWaalsContact O-O 3.05Å; A40-Q177 HydrophobicContact CB-CB 4.36Å
41	N	74.9	Confident	70.2	Confident	153 Å²	153	68.8 Å²	68.8	82%	0.818	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	29.4	178.4	-68.3	-21.3	0	0	0	115.4	V43	N41-V43 VanDerWaalsContact C-N 3.32Å
42	G	81.1	Confident	73.5	Confident	17 Å²	17	66 Å²	66	18%	0.175	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	-0.7	-177.9	0	0	0	0	0	114.6	A40 N69 R70 A71	A40-G42 PolarHBondContact O-N 2.72Å; G42-N69 PolarHBondContact O-OD1 2.87Å; G42-R70 CarbonylContact O-C 3.53Å; G42-R70 WeakPolarHBondContact O-CA 3.38Å; G42-R70 WeakPolarHBondContact O-CB 3.3Å; G42-R70 PolarHBondContact O-N 2.9Å; G42-A71 PolarHBondContact O-N 2.87Å; G42-A71 VanDerWaalsContact O-N 3.14Å
43	V	87.6	Confident	76.5	Confident	14 Å²	14	58.6 Å²	58.6	9%	0.085	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	132	175.2	179.8	0	0	0	0	109.3	A40 N41 A67 K75 V77 Q177	A40-V43 PolarHBondContact N-O 3.3Å; A40-V43 PolarHBondContact O-N 2.65Å; A40-V43 VanDerWaalsContact O-O 3.05Å; N41-V43 VanDerWaalsContact C-N 3.32Å; V43-A67 HydrophobicContact CG1-CB 4.24Å; V43-K75 HydrophobicContact CG2-CB 3.94Å; V43-V77 HydrophobicContact CG1-CG1 4.16Å; V43-V77 HydrophobicContact CG1-CG2 3.83Å; V43-V77 HydrophobicContact CG2-CG2 3.96Å; V43-Q177 PolarHBondContact O-OE1 2.91Å
44	E	91.8	Very high	79.5	Confident	3 Å²	3	47 Å²	47	1%	0.014	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	119.4	173.9	-171.9	-167.9	-172	0	0	109.6	G38 V39 A67 V68 R70 K180	G38-E44 WeakPolarHBondContact O-CG 3.43Å; V39-E44 HydrophobicContact CG2-CB 4.05Å; V39-E44 HydrophobicContact CG2-CG 4.26Å; E44-A67 CarbonylContact O-C 3.56Å; E44-A67 WeakPolarHBondContact O-CA 3.41Å; E44-V68 HydrophobicContact CB-CG1 3.82Å; E44-V68 PolarHBondContact N-O 3.07Å; E44-V68 PolarHBondContact O-N 3.39Å; E44-R70 IonicContact OE1-NH2 3.25Å; E44-R70 IonicContact OE2-CZ 2.78Å; E44-R70 IonicContact OE2-NE 3.4Å; E44-R70 PolarHBondContact OE2-NE 3.03Å; E44-R70 IonicContact OE2-NH2 3.72Å; E44-R70 PolarHBondContact OE2-NH2 2.85Å; E44-K180 WeakPolarHBondContact OE1-CE 3.31Å; E44-K180 IonicContact OE1-NZ 2.67Å; E44-K180 PolarHBondContact OE1-NZ 3.44Å
45	V	92.3	Very high	82	Confident	18 Å²	18	42 Å²	42	11%	0.109	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	105.3	163.7	174.4	0	0	0	0	107.3	T65 A67 Q177 I179	V45-T65 HydrophobicContact CG1-CG2 3.82Å; V45-T65 HydrophobicContact CG2-CG2 4.38Å; V45-A67 HydrophobicContact CG2-CB 3.9Å; V45-Q177 HydrophobicContact CB-CG 4.23Å; V45-I179 HydrophobicContact CG1-CD1 4.04Å; V45-I179 HydrophobicContact CG1-CG1 4.09Å
46	Y	92.8	Very high	84.4	Confident	54 Å²	54	35.6 Å²	35.6	21%	0.212	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-15.8	-174.8	65.5	-90.9	0	0	0	112.9	R66 V68 K180 H181	Y46-R66 HydrophobicContact CD1-CB 4.44Å; Y46-R66 WeakPolarHBondContact CD1-O 3.19Å; Y46-R66 HydrophobicContact CE1-CB 3.75Å; Y46-R66 HydrophobicContact CE2-CB 3.83Å; Y46-R66 VanDerWaalsContact CZ-CB 3.41Å; Y46-R66 PolarHBondContact N-O 3.3Å; Y46-R66 VanDerWaalsContact N-O 3.07Å; Y46-R66 WeakPolarHBondContact OH-CB 3.14Å; Y46-V68 HydrophobicContact CD1-CG1 4.26Å; Y46-K180 WeakPolarHBondContact O-CB 3.46Å; Y46-H181 PolarHBondContact O-N 3.33Å; Y46-H181 VanDerWaalsContact O-N 3.09Å
47	S	95.4	Very high	86.6	Confident	22 Å²	22	32.8 Å²	32.8	15%	0.154	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	135.3	176.7	-179.2	0	0	0	0	112.2	T65 R66 H181	S47-T65 CarbonylContact O-C 3.51Å; S47-T65 WeakPolarHBondContact O-CA 3.32Å; S47-R66 PolarHBondContact N-O 3.36Å; S47-R66 PolarHBondContact O-N 2.91Å; S47-H181 VanDerWaalsContact CA-O 3.28Å; S47-H181 WeakPolarHBondContact CA-O 3.35Å; S47-H181 PolarHBondContact OG-O 3.36Å
48	T	96	Very high	88.5	Confident	16 Å²	16	26.5 Å²	26.5	10%	0.098	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	123.3	166.8	-69.3	0	0	0	0	108.2	T64 T65 I179 H181 F182 E183	T48-T64 CarbonylContact C-O 3.55Å; T48-T64 VanDerWaalsContact CA-O 3.27Å; T48-T64 WeakPolarHBondContact CA-O 3.33Å; T48-T65 PolarHBondContact OG1-OG1 3.07Å; T48-I179 WeakPolarHBondContact OG1-CD1 3.29Å; T48-H181 PolarHBondContact N-O 2.85Å; T48-F182 HydrophobicContact CG2-CD2 4.26Å; T48-F182 HydrophobicContact CG2-CE2 4.05Å; T48-F182 WeakPolarHBondContact O-CA 2.97Å; T48-E183 PolarHBondContact O-N 3.5Å
49	K	97.1	Very high	90.3	Very high	68 Å²	68	25.6 Å²	25.6	30%	0.296	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	130.1	-180	-177.5	167.4	-178.5	144.5	0	110	V63 T64 E183	K49-V63 CarbonylContact O-C 3.6Å; K49-V63 WeakPolarHBondContact O-CA 3.45Å; K49-T64 PolarHBondContact N-O 3.31Å; K49-T64 PolarHBondContact O-N 2.79Å; K49-E183 CarbonylContact C-O 3.5Å; K49-E183 VanDerWaalsContact CA-O 3.3Å; K49-E183 WeakPolarHBondContact CA-O 3.35Å; K49-E183 HydrophobicContact CD-CG 4.39Å; K49-E183 WeakPolarHBondContact CD-OE2 3.42Å; K49-E183 VanDerWaalsContact CE-CD 3.5Å; K49-E183 WeakPolarHBondContact CE-OE2 3.46Å; K49-E183 HydrophobicContact CG-CB 4.22Å; K49-E183 HydrophobicContact CG-CG 4.19Å; K49-E183 IonicContact NZ-OE1 3.47Å; K49-E183 PolarHBondContact NZ-OE1 2.89Å; K49-E183 IonicContact NZ-OE2 3.7Å; K49-E183 PolarHBondContact NZ-OE2 2.9Å
50	I	97.1	Very high	91.6	Very high	11 Å²	11	26.2 Å²	26.2	6%	0.056	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	104.8	171.1	-54.1	178.8	0	0	0	106.4	V62 V63 L171 E183 I184 D185	I50-V62 WeakPolarHBondContact CA-O 3.36Å; I50-V63 HydrophobicContact CG1-CG1 4.34Å; I50-V63 HydrophobicContact CG1-CG2 4.27Å; I50-V63 HydrophobicContact CG2-CG2 4.27Å; I50-L171 HydrophobicContact CG2-CD1 4.1Å; I50-L171 HydrophobicContact CG2-CD2 4.31Å; I50-E183 PolarHBondContact N-O 2.89Å; I50-I184 HydrophobicContact CB-CG1 4.27Å; I50-I184 HydrophobicContact CB-CG2 4.36Å; I50-I184 HydrophobicContact CD1-CD1 4.39Å; I50-I184 HydrophobicContact CD1-CG1 4.19Å; I50-I184 HydrophobicContact CG1-CG1 4.48Å; I50-I184 WeakPolarHBondContact O-CA 3.47Å; I50-D185 PolarHBondContact O-N 2.78Å
51	N	96.6	Very high	92.8	Very high	37 Å²	37	24.1 Å²	24.1	20%	0.198	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	128.1	174.1	-174.6	-110	0	0	0	109.3	V62 D185	N51-V62 PolarHBondContact N-O 3.05Å; N51-V62 PolarHBondContact O-N 2.77Å; N51-D185 CarbonylContact C-O 3.53Å; N51-D185 VanDerWaalsContact CA-O 3.29Å; N51-D185 WeakPolarHBondContact CA-O 3.41Å; N51-D185 PolarHBondContact ND2-O 2.81Å; N51-D185 PolarHBondContact ND2-OD1 3.1Å
52	S	95.9	Very high	93.8	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	133.2	-177.7	-45.9	0	0	0	0	110.2	H60 N61 M169 D185 V186 D187	S52-H60 CarbonylContact C-O 3.48Å; S52-H60 WeakPolarHBondContact CA-O 3.4Å; S52-N61 VanDerWaalsContact CB-OD1 3.23Å; S52-N61 WeakPolarHBondContact CB-OD1 3.33Å; S52-N61 PolarHBondContact OG-OD1 2.83Å; S52-M169 WeakPolarHBondContact OG-CE 3.4Å; S52-D185 PolarHBondContact N-O 3.29Å; S52-V186 CarbonylContact O-C 3.47Å; S52-V186 VanDerWaalsContact O-CA 3.3Å; S52-V186 WeakPolarHBondContact O-CA 3.46Å; S52-D187 PolarHBondContact O-N 3.24Å
53	K	94.6	Very high	94.6	Very high	55 Å²	55	17.6 Å²	17.6	24%	0.239	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	115.4	174.7	-65.5	-170.5	176.1	-163.6	0	108.9	H60 D187 F550	K53-H60 PolarHBondContact N-O 2.83Å; K53-H60 PolarHBondContact O-N 2.95Å; K53-D187 CarbonylContact C-O 3.59Å; K53-D187 WeakPolarHBondContact CA-O 3.39Å; K53-F550 HydrophobicContact CB-CD1 4.27Å
54	V	95.1	Very high	95	Very high	1 Å²	1	18 Å²	18	1%	0.006	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	119	176.2	-174.1	0	0	0	0	108	F58 A59 L160 M169 V186 D187 I188 F189 Y252	V54-F58 WeakPolarHBondContact CA-O 3.47Å; V54-A59 HydrophobicContact CG2-CB 4.02Å; V54-L160 HydrophobicContact CG1-CD1 3.82Å; V54-L160 HydrophobicContact CG2-CD1 4.4Å; V54-M169 HydrophobicContact CG2-SD 4.04Å; V54-V186 HydrophobicContact CG2-CG1 4.45Å; V54-D187 PolarHBondContact N-O 3.1Å; V54-I188 HydrophobicContact CB-CB 4.41Å; V54-I188 HydrophobicContact CB-CG1 4.15Å; V54-I188 HydrophobicContact CB-CG2 4.22Å; V54-I188 HydrophobicContact CG1-CG2 4.39Å; V54-I188 HydrophobicContact CG2-CG1 4.27Å; V54-I188 CarbonylContact O-C 3.54Å; V54-I188 WeakPolarHBondContact O-CA 3.43Å; V54-F189 PolarHBondContact O-N 3.03Å; V54-Y252 HydrophobicContact CG1-CE1 4.35Å; V54-Y252 VanDerWaalsContact CG1-OH 3.31Å; V54-Y252 WeakPolarHBondContact CG1-OH 3.43Å
55	T	91.9	Very high	95.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	117.3	177.8	-53.3	0	0	0	0	108.7	R57 F58 F189 Y548 I549 Y553	T55-R57 PolarHBondContact O-N 3.35Å; T55-F58 PolarHBondContact N-O 3.42Å; T55-F58 WeakPolarHBondContact O-CB 3.34Å; T55-F58 PolarHBondContact O-N 3.21Å; T55-F189 WeakPolarHBondContact CA-O 3.29Å; T55-F189 HydrophobicContact CG2-CD1 4.11Å; T55-Y548 PolarHBondContact OG1-O 2.74Å; T55-I549 HydrophobicContact CG2-CG1 4.18Å; T55-I549 HydrophobicContact CG2-CG2 4.28Å; T55-Y553 HydrophobicContact CG2-CD1 4.02Å; T55-Y553 HydrophobicContact CG2-CD2 3.83Å; T55-Y553 HydrophobicContact CG2-CE1 3.92Å; T55-Y553 HydrophobicContact CG2-CE2 3.71Å; T55-Y553 HydrophobicContact CG2-CG 3.98Å
56	S	91.8	Very high	95.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.8	57.3	-177.3	-60.8	0	0	0	0	112.3	F58 F189 E190 P191 Q263 F272	S56-F58 PolarHBondContact O-N 3.1Å; S56-F189 PolarHBondContact N-O 2.89Å; S56-E190 WeakPolarHBondContact CA-OE2 3.32Å; S56-P191 VanDerWaalsContact OG-CD 3.24Å; S56-P191 WeakPolarHBondContact OG-CD 3.31Å; S56-P191 WeakPolarHBondContact OG-CG 3.36Å; S56-Q263 PolarHBondContact OG-NE2 3Å; S56-Q263 PolarHBondContact OG-OE1 3.09Å; S56-F272 WeakPolarHBondContact O-CZ 3.43Å
57	R	94.8	Very high	95.4	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	-7.5	-177.2	-60.8	66	157.7	175.3	-13.7	116	T55 L159 L160 Y167 E190 V254 F272 E500	T55-R57 PolarHBondContact O-N 3.35Å; R57-L159 HydrophobicContact CB-CD1 3.92Å; R57-L160 HydrophobicContact CB-CB 4.49Å; R57-L160 WeakPolarHBondContact O-CB 3.44Å; R57-L160 WeakPolarHBondContact O-CG 3.3Å; R57-L160 PolarHBondContact O-N 3.29Å; R57-Y167 HydrophobicContact CB-CE1 4.38Å; R57-Y167 HydrophobicContact CG-CD1 3.93Å; R57-Y167 HydrophobicContact CG-CE1 3.35Å; R57-Y167 HydrophobicContact CG-CE2 4.17Å; R57-Y167 PolarHBondContact NE-OH 3.49Å; R57-Y167 PolarHBondContact NH2-OH 2.94Å; R57-E190 WeakPolarHBondContact CD-OE2 3.37Å; R57-E190 IonicContact CZ-OE2 2.72Å; R57-E190 PolarHBondContact N-OE1 3.5Å; R57-E190 IonicContact NE-OE2 2.67Å; R57-E190 IonicContact NH1-OE2 2.7Å; R57-E190 PolarHBondContact NH1-OE2 3.42Å; R57-V254 VanDerWaalsContact NH2-CG2 3.32Å; R57-F272 HydrophobicContact CB-CE1 4.3Å; R57-F272 HydrophobicContact CG-CE1 4.23Å; R57-E500 IonicContact NE-OE2 3.81Å; R57-E500 IonicContact NH2-OE1 3.77Å; R57-E500 PolarHBondContact NH2-OE1 3.41Å
58	F	95.4	Very high	95.3	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	113.9	178.8	-162.6	-127.3	0	0	0	109.7	V54 T55 S56 E157 E158 L159 F550 R556 L557 Y560	V54-F58 WeakPolarHBondContact CA-O 3.47Å; T55-F58 PolarHBondContact N-O 3.42Å; T55-F58 WeakPolarHBondContact O-CB 3.34Å; T55-F58 PolarHBondContact O-N 3.21Å; S56-F58 PolarHBondContact O-N 3.1Å; F58-E157 HydrophobicContact CE1-CB 4.34Å; F58-E157 HydrophobicContact CE2-CB 4.33Å; F58-E157 HydrophobicContact CZ-CB 3.75Å; F58-E157 HydrophobicContact CZ-CG 4.43Å; F58-E158 VanDerWaalsContact CD2-O 3.31Å; F58-E158 WeakPolarHBondContact CD2-O 3.33Å; F58-L159 HydrophobicContact CD2-CB 4.2Å; F58-L159 HydrophobicContact CD2-CD1 4.44Å; F58-F550 HydrophobicContact CB-CZ 4.49Å; F58-F550 HydrophobicContact CD1-CE1 4.42Å; F58-F550 AromaticContact CD1-CE2 3.84Å; F58-F550 HydrophobicContact CD1-CE2 3.84Å; F58-F550 AromaticContact CD1-CZ 3.32Å; F58-F550 HydrophobicContact CD1-CZ 3.32Å; F58-F550 AromaticContact CE1-CE2 3.92Å; F58-F550 HydrophobicContact CE1-CE2 3.92Å; F58-F550 AromaticContact CE1-CZ 3.82Å; F58-F550 HydrophobicContact CE1-CZ 3.82Å; F58-F550 HydrophobicContact CG-CZ 4.24Å; F58-R556 HydrophobicContact CE1-CB 3.67Å; F58-R556 HydrophobicContact CZ-CB 4.14Å; F58-L557 HydrophobicContact CB-CD1 4.19Å; F58-L557 HydrophobicContact CD1-CB 4.38Å; F58-L557 HydrophobicContact CD2-CB 4.3Å; F58-L557 HydrophobicContact CD2-CG 4.46Å; F58-L557 HydrophobicContact CG-CB 4.17Å; F58-Y560 HydrophobicContact CE2-CD2 4.28Å; F58-Y560 HydrophobicContact CE2-CG 4.07Å
59	A	95.5	Very high	95	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	126.1	-176.4	0	0	0	0	0	110.7	V54 E157 E158 L160	V54-A59 HydrophobicContact CG2-CB 4.02Å; A59-E157 WeakPolarHBondContact O-CA 3.49Å; A59-E158 HydrophobicContact CB-CG 4.02Å; A59-E158 PolarHBondContact N-O 3.34Å; A59-E158 PolarHBondContact O-N 3.47Å; A59-L160 HydrophobicContact CB-CD1 4.43Å; A59-L160 HydrophobicContact CB-CD2 4.24Å; A59-L160 HydrophobicContact CB-CG 4.19Å
60	H	94.9	Very high	94.8	Very high	38 Å²	38	22.5 Å²	22.5	18%	0.176	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	112.5	173.3	178	93.1	0	0	0	109.3	S52 K53 T155 E157 F550	S52-H60 CarbonylContact C-O 3.48Å; S52-H60 WeakPolarHBondContact CA-O 3.4Å; K53-H60 PolarHBondContact N-O 2.83Å; K53-H60 PolarHBondContact O-N 2.95Å; H60-T155 WeakPolarHBondContact CE1-CG2 3.36Å; H60-E157 HydrophobicContact CB-CG 4.41Å; H60-E157 IonicContact CE1-OE1 3.93Å; H60-E157 IonicContact CG-OE1 2.64Å; H60-E157 IonicContact ND1-OE1 2.64Å; H60-E157 PolarHBondContact ND1-OE1 3.02Å; H60-F550 HydrophobicContact CB-CD1 4.04Å; H60-F550 HydrophobicContact CB-CD2 4.2Å; H60-F550 HydrophobicContact CB-CE1 3.79Å; H60-F550 HydrophobicContact CB-CE2 3.96Å; H60-F550 HydrophobicContact CB-CG 4.21Å; H60-F550 HydrophobicContact CB-CZ 3.69Å
61	N	95.8	Very high	94.4	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.9	-170.1	-56.3	-60	0	0	0	110.7	S52 T155 Y156 M169	S52-N61 VanDerWaalsContact CB-OD1 3.23Å; S52-N61 WeakPolarHBondContact CB-OD1 3.33Å; S52-N61 PolarHBondContact OG-OD1 2.83Å; N61-T155 CarbonylContact O-C 3.57Å; N61-T155 VanDerWaalsContact O-CA 3.26Å; N61-T155 WeakPolarHBondContact O-CA 3.3Å; N61-Y156 HydrophobicContact CB-CD1 4.14Å; N61-Y156 HydrophobicContact CB-CD2 3.81Å; N61-Y156 HydrophobicContact CB-CE1 3.79Å; N61-Y156 HydrophobicContact CB-CE2 3.42Å; N61-Y156 VanDerWaalsContact CB-CE2 3.42Å; N61-Y156 HydrophobicContact CB-CG 4.16Å; N61-Y156 WeakPolarHBondContact CB-O 3.2Å; N61-Y156 PolarHBondContact N-O 3.17Å; N61-Y156 WeakPolarHBondContact ND2-CE2 3.44Å; N61-Y156 PolarHBondContact O-N 3.06Å; N61-M169 WeakPolarHBondContact OD1-CE 3.13Å
62	V	96.5	Very high	94	Very high	26 Å²	26	27.9 Å²	27.9	16%	0.158	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	114.3	178.7	-175.3	0	0	0	0	109.5	I50 N51 E153 L154 T155	I50-V62 WeakPolarHBondContact CA-O 3.36Å; N51-V62 PolarHBondContact N-O 3.05Å; N51-V62 PolarHBondContact O-N 2.77Å; V62-E153 HydrophobicContact CG1-CG 3.82Å; V62-L154 CarbonylContact C-O 3.58Å; V62-L154 WeakPolarHBondContact CA-O 3.44Å; V62-T155 HydrophobicContact CG2-CG2 4.13Å
63	V	96.9	Very high	93.5	Very high	7 Å²	7	31.2 Å²	31.2	4%	0.042	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	112.4	176.6	-176.8	0	0	0	0	109.2	K49 I50 F79 V81 E153 L154 Y156	K49-V63 CarbonylContact O-C 3.6Å; K49-V63 WeakPolarHBondContact O-CA 3.45Å; I50-V63 HydrophobicContact CG1-CG1 4.34Å; I50-V63 HydrophobicContact CG1-CG2 4.27Å; I50-V63 HydrophobicContact CG2-CG2 4.27Å; V63-F79 HydrophobicContact CB-CZ 4.44Å; V63-F79 HydrophobicContact CG1-CE2 4.2Å; V63-F79 HydrophobicContact CG1-CZ 4.06Å; V63-V81 HydrophobicContact CB-CG2 4.39Å; V63-V81 HydrophobicContact CG1-CG2 3.83Å; V63-V81 HydrophobicContact CG2-CG1 4.27Å; V63-E153 CarbonylContact O-C 3.49Å; V63-E153 VanDerWaalsContact O-CA 3.32Å; V63-E153 WeakPolarHBondContact O-CA 3.31Å; V63-L154 PolarHBondContact N-O 2.83Å; V63-L154 PolarHBondContact O-N 3.08Å; V63-Y156 HydrophobicContact CG2-CE1 3.86Å
64	T	96.9	Very high	92.8	Very high	21 Å²	21	31.2 Å²	31.2	13%	0.129	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	122.3	178	-52.1	0	0	0	0	110.6	T48 K49 R66 T151 F152	T48-T64 CarbonylContact C-O 3.55Å; T48-T64 VanDerWaalsContact CA-O 3.27Å; T48-T64 WeakPolarHBondContact CA-O 3.33Å; K49-T64 PolarHBondContact N-O 3.31Å; K49-T64 PolarHBondContact O-N 2.79Å; T64-R66 HydrophobicContact CG2-CG 4.44Å; T64-T151 HydrophobicContact CG2-CG2 3.98Å; T64-F152 CarbonylContact C-O 3.56Å; T64-F152 VanDerWaalsContact CA-O 3.3Å; T64-F152 WeakPolarHBondContact CA-O 3.34Å
65	T	95.6	Very high	92.1	Very high	16 Å²	16	35.1 Å²	35.1	10%	0.098	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.6	173.5	-71.4	0	0	0	0	110.4	V45 S47 T48 F79 T151 F152	V45-T65 HydrophobicContact CG1-CG2 3.82Å; V45-T65 HydrophobicContact CG2-CG2 4.38Å; S47-T65 CarbonylContact O-C 3.51Å; S47-T65 WeakPolarHBondContact O-CA 3.32Å; T48-T65 PolarHBondContact OG1-OG1 3.07Å; T65-F79 HydrophobicContact CG2-CD2 4.28Å; T65-F79 WeakPolarHBondContact OG1-CE2 3.32Å; T65-T151 CarbonylContact O-C 3.57Å; T65-T151 WeakPolarHBondContact O-CA 3.46Å; T65-F152 PolarHBondContact N-O 2.95Å; T65-F152 PolarHBondContact O-N 2.98Å
66	R	95.4	Very high	91.6	Very high	115 Å²	115	41.6 Å²	41.6	43%	0.434	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.4	178.2	-56.9	-176.3	174.4	-179.7	-1	110.8	Y46 S47 T64 V150 T151	Y46-R66 HydrophobicContact CD1-CB 4.44Å; Y46-R66 WeakPolarHBondContact CD1-O 3.19Å; Y46-R66 HydrophobicContact CE1-CB 3.75Å; Y46-R66 HydrophobicContact CE2-CB 3.83Å; Y46-R66 VanDerWaalsContact CZ-CB 3.41Å; Y46-R66 PolarHBondContact N-O 3.3Å; Y46-R66 VanDerWaalsContact N-O 3.07Å; Y46-R66 WeakPolarHBondContact OH-CB 3.14Å; S47-R66 PolarHBondContact N-O 3.36Å; S47-R66 PolarHBondContact O-N 2.91Å; T64-R66 HydrophobicContact CG2-CG 4.44Å; R66-V150 WeakPolarHBondContact CA-O 3.35Å; R66-T151 HydrophobicContact CG-CG2 3.86Å
67	A	93.5	Very high	91.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	159.6	179.8	0	0	0	0	0	112.2	V43 E44 V45 V77 K149 V150	V43-A67 HydrophobicContact CG1-CB 4.24Å; E44-A67 CarbonylContact O-C 3.56Å; E44-A67 WeakPolarHBondContact O-CA 3.41Å; V45-A67 HydrophobicContact CG2-CB 3.9Å; A67-V77 HydrophobicContact CB-CG1 4.03Å; A67-K149 WeakPolarHBondContact O-CA 3.25Å; A67-V150 HydrophobicContact CB-CG1 3.83Å; A67-V150 PolarHBondContact N-O 2.79Å; A67-V150 PolarHBondContact O-N 2.91Å
68	V	93.4	Very high	90.7	Very high	14 Å²	14	44.3 Å²	44.3	9%	0.085	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	133.3	172.8	58.9	0	0	0	0	109.6	E44 Y46 R70 S148 K149	E44-V68 HydrophobicContact CB-CG1 3.82Å; E44-V68 PolarHBondContact N-O 3.07Å; E44-V68 PolarHBondContact O-N 3.39Å; Y46-V68 HydrophobicContact CD1-CG1 4.26Å; V68-R70 HydrophobicContact CG1-CG 4.08Å; V68-R70 PolarHBondContact O-N 3.28Å; V68-S148 WeakPolarHBondContact CA-O 3.25Å; V68-K149 HydrophobicContact CB-CG 4.2Å; V68-K149 HydrophobicContact CG2-CG 4.02Å
69	N	90.9	Very high	90.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	108.5	170.4	-179.8	11	0	0	0	109	G42 A71 T73 K75 V144 A145 G147 S148	G42-N69 PolarHBondContact O-OD1 2.87Å; N69-A71 VanDerWaalsContact OD1-CB 3.28Å; N69-A71 WeakPolarHBondContact OD1-CB 3.4Å; N69-A71 PolarHBondContact OD1-N 3.45Å; N69-T73 PolarHBondContact ND2-O 2.91Å; N69-K75 PolarHBondContact ND2-N 2.96Å; N69-V144 HydrophobicContact CB-CB 4.34Å; N69-V144 HydrophobicContact CB-CG1 3.95Å; N69-V144 PolarHBondContact ND2-O 2.96Å; N69-A145 WeakPolarHBondContact CB-O 3.24Å; N69-A145 PolarHBondContact ND2-O 2.91Å; N69-A145 VanDerWaalsContact ND2-O 3.13Å; N69-G147 WeakPolarHBondContact O-CA 3.36Å; N69-G147 PolarHBondContact O-N 2.95Å; N69-S148 PolarHBondContact N-O 2.77Å
70	R	91.5	Very high	89.9	Confident	131 Å²	131	46.8 Å²	46.8	49%	0.494	24%	0.242	S	C	.	.			trans	-92.6	-3.5	176.3	-63.5	-162.3	176.7	-92.2	-0.5	113.7	G42 E44 V68	G42-R70 CarbonylContact O-C 3.53Å; G42-R70 WeakPolarHBondContact O-CA 3.38Å; G42-R70 WeakPolarHBondContact O-CB 3.3Å; G42-R70 PolarHBondContact O-N 2.9Å; E44-R70 IonicContact OE1-NH2 3.25Å; E44-R70 IonicContact OE2-CZ 2.78Å; E44-R70 IonicContact OE2-NE 3.4Å; E44-R70 PolarHBondContact OE2-NE 3.03Å; E44-R70 IonicContact OE2-NH2 3.72Å; E44-R70 PolarHBondContact OE2-NH2 2.85Å; V68-R70 HydrophobicContact CG1-CG 4.08Å; V68-R70 PolarHBondContact O-N 3.28Å
71	A	88.6	Confident	89.7	Confident	17 Å²	17	45.8 Å²	45.8	14%	0.14	24%	0.238	C	C	.	.	S	Bend	trans	-68.9	159.9	172.3	0	0	0	0	0	110.8	G42 N69 T73 K75 A146	G42-A71 PolarHBondContact O-N 2.87Å; G42-A71 VanDerWaalsContact O-N 3.14Å; N69-A71 VanDerWaalsContact OD1-CB 3.28Å; N69-A71 WeakPolarHBondContact OD1-CB 3.4Å; N69-A71 PolarHBondContact OD1-N 3.45Å; A71-T73 PolarHBondContact O-N 2.91Å; A71-K75 HydrophobicContact CB-CG 3.81Å; A71-A146 VanDerWaalsContact O-CB 3.28Å; A71-A146 WeakPolarHBondContact O-CB 3.47Å
72	D	88.2	Confident	89.4	Confident	145 Å²	145	47.5 Å²	47.5	78%	0.775	25%	0.246	S	C	*	.	S	Bend	trans	-78.3	-4.5	170.9	58.1	-9	0	0	0	113.1	A146	D72-A146 VanDerWaalsContact C-CB 3.49Å
73	T	86.8	Confident	89.1	Confident	70 Å²	70	46.2 Å²	46.2	43%	0.429	24%	0.239	S	C	.	.	S	Bend	trans	-125.3	157.5	-177.4	45.6	0	0	0	0	110.6	N69 A71 K75	N69-T73 PolarHBondContact ND2-O 2.91Å; A71-T73 PolarHBondContact O-N 2.91Å; T73-K75 PolarHBondContact O-N 3.34Å
74	A	80.1	Confident	88.9	Confident	55 Å²	55	46.3 Å²	46.3	46%	0.455	24%	0.239	S	C	.	.			trans	-62.1	135.8	171.6	0	0	0	0	0	110	N143 V144	A74-N143 WeakPolarHBondContact CB-OD1 3.25Å; A74-V144 CarbonylContact C-O 3.57Å; A74-V144 VanDerWaalsContact CA-O 3.28Å; A74-V144 WeakPolarHBondContact CA-O 3.41Å
75	K	80.9	Confident	88.4	Confident	83 Å²	83	47.9 Å²	47.9	36%	0.361	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	141.6	-178.2	-71.6	-66.5	-175.7	-177.8	0	110.4	V43 N69 A71 T73 V77 N143 V144	V43-K75 HydrophobicContact CG2-CB 3.94Å; N69-K75 PolarHBondContact ND2-N 2.96Å; A71-K75 HydrophobicContact CB-CG 3.81Å; T73-K75 PolarHBondContact O-N 3.34Å; K75-V77 PolarHBondContact O-N 3.22Å; K75-N143 PolarHBondContact N-OD1 3.23Å; K75-N143 PolarHBondContact O-OD1 3.15Å; K75-V144 PolarHBondContact N-O 2.78Å; K75-V144 PolarHBondContact O-N 3Å
76	E	80.4	Confident	88.1	Confident	135 Å²	135	49.4 Å²	49.4	63%	0.631	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	127.6	170.3	-168.6	-178.5	-174.7	0	0	110.2	S141 V142	E76-S141 WeakPolarHBondContact OE1-CB 3.42Å; E76-S141 PolarHBondContact OE1-OG 2.85Å; E76-V142 CarbonylContact C-O 3.59Å; E76-V142 WeakPolarHBondContact CA-O 3.3Å
77	V	84	Confident	88	Confident	6 Å²	6	44 Å²	44	4%	0.036	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.3	174	-176.4	0	0	0	0	107.8	V43 A67 K75 S141 V142 V144 V150 F152	V43-V77 HydrophobicContact CG1-CG1 4.16Å; V43-V77 HydrophobicContact CG1-CG2 3.83Å; V43-V77 HydrophobicContact CG2-CG2 3.96Å; A67-V77 HydrophobicContact CB-CG1 4.03Å; K75-V77 PolarHBondContact O-N 3.22Å; V77-S141 CarbonylContact O-C 3.59Å; V77-S141 WeakPolarHBondContact O-CA 3.5Å; V77-V142 PolarHBondContact N-O 2.95Å; V77-V142 PolarHBondContact O-N 2.86Å; V77-V144 HydrophobicContact CB-CG2 3.98Å; V77-V144 HydrophobicContact CG2-CB 3.92Å; V77-V144 HydrophobicContact CG2-CG2 3.53Å; V77-V150 HydrophobicContact CB-CG1 4.35Å; V77-V150 HydrophobicContact CG1-CG1 3.98Å; V77-V150 HydrophobicContact CG2-CG1 4.4Å; V77-F152 HydrophobicContact CB-CZ 4.41Å; V77-F152 HydrophobicContact CG1-CE2 3.8Å; V77-F152 HydrophobicContact CG1-CZ 4Å
78	S	83.6	Confident	88	Confident	51 Å²	51	44 Å²	44	36%	0.357	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	140	177.2	52.7	0	0	0	0	111.8	V140	S78-V140 CarbonylContact C-O 3.57Å; S78-V140 WeakPolarHBondContact CA-O 3.42Å
79	F	87.3	Confident	88	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.018	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	114.1	170.3	176.5	-105.8	0	0	0	108.2	V63 T65 V81 F92 F138 T139 V140 F152 L154	V63-F79 HydrophobicContact CB-CZ 4.44Å; V63-F79 HydrophobicContact CG1-CE2 4.2Å; V63-F79 HydrophobicContact CG1-CZ 4.06Å; T65-F79 HydrophobicContact CG2-CD2 4.28Å; T65-F79 WeakPolarHBondContact OG1-CE2 3.32Å; F79-V81 HydrophobicContact CD1-CG2 4.27Å; F79-V81 HydrophobicContact CD2-CG2 4.47Å; F79-V81 HydrophobicContact CE1-CB 4.45Å; F79-V81 HydrophobicContact CE1-CG2 3.51Å; F79-V81 HydrophobicContact CE2-CG2 3.75Å; F79-V81 HydrophobicContact CZ-CG2 3.22Å; F79-F92 AromaticContact CD1-CE2 3.95Å; F79-F92 HydrophobicContact CD1-CE2 3.95Å; F79-F92 AromaticContact CE1-CE2 3.96Å; F79-F92 HydrophobicContact CE1-CE2 3.96Å; F79-F138 AromaticContact CD1-CD1 3.94Å; F79-F138 HydrophobicContact CD1-CD1 3.94Å; F79-F138 AromaticContact CD1-CE1 3.87Å; F79-F138 HydrophobicContact CD1-CE1 3.87Å; F79-F138 AromaticContact CE1-CD1 3.91Å; F79-F138 HydrophobicContact CE1-CD1 3.91Å; F79-F138 AromaticContact CE1-CE1 3.93Å; F79-F138 HydrophobicContact CE1-CE1 3.93Å; F79-T139 CarbonylContact O-C 3.52Å; F79-T139 VanDerWaalsContact O-CA 3.29Å; F79-T139 WeakPolarHBondContact O-CA 3.47Å; F79-V140 PolarHBondContact N-O 2.86Å; F79-V140 PolarHBondContact O-N 3.29Å; F79-F152 HydrophobicContact CB-CB 4.1Å; F79-F152 HydrophobicContact CB-CD1 3.64Å; F79-F152 HydrophobicContact CB-CD2 3.92Å; F79-F152 HydrophobicContact CB-CE1 3.93Å; F79-F152 HydrophobicContact CB-CE2 4.2Å; F79-F152 HydrophobicContact CB-CG 3.62Å; F79-F152 HydrophobicContact CB-CZ 4.19Å; F79-F152 HydrophobicContact CD1-CB 4.11Å; F79-F152 HydrophobicContact CD1-CG 4.49Å; F79-F152 HydrophobicContact CD2-CB 3.5Å; F79-F152 HydrophobicContact CD2-CD2 4.14Å; F79-F152 AromaticContact CD2-CG 3.88Å; F79-F152 HydrophobicContact CD2-CG 3.88Å; F79-F152 HydrophobicContact CE1-CB 4.39Å; F79-F152 HydrophobicContact CE2-CB 3.81Å; F79-F152 HydrophobicContact CG-CB 3.64Å; F79-F152 HydrophobicContact CG-CD1 4.07Å; F79-F152 HydrophobicContact CG-CD2 4.28Å; F79-F152 AromaticContact CG-CG 3.76Å; F79-F152 HydrophobicContact CG-CG 3.76Å; F79-F152 HydrophobicContact CZ-CB 4.22Å; F79-L154 HydrophobicContact CE1-CB 3.8Å; F79-L154 HydrophobicContact CE1-CD2 4.23Å; F79-L154 HydrophobicContact CZ-CB 3.9Å
80	D	87.5	Confident	88	Confident	49 Å²	49	44.3 Å²	44.3	26%	0.262	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124.6	-179.6	-74.8	-11.1	0	0	0	109.1	K137 F138 T139 K176	D80-K137 VanDerWaalsContact CG-CE 3.44Å; D80-K137 WeakPolarHBondContact OD2-CE 3.37Å; D80-K137 IonicContact OD2-NZ 3.16Å; D80-K137 PolarHBondContact OD2-NZ 3.06Å; D80-K137 VanDerWaalsContact OD2-NZ 3.1Å; D80-F138 WeakPolarHBondContact CA-O 3.35Å; D80-T139 WeakPolarHBondContact OD1-CB 3.48Å; D80-T139 WeakPolarHBondContact OD1-CG2 3.37Å; D80-T139 PolarHBondContact OD1-OG1 2.81Å; D80-K176 WeakPolarHBondContact OD2-CE 3.44Å; D80-K176 IonicContact OD2-NZ 3.76Å; D80-K176 PolarHBondContact OD2-NZ 3.25Å
81	V	89.4	Confident	88	Confident	17 Å²	17	40.8 Å²	40.8	10%	0.103	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	131.9	173.2	178.9	0	0	0	0	108.8	V63 F79 K137 F138 L154	V63-V81 HydrophobicContact CB-CG2 4.39Å; V63-V81 HydrophobicContact CG1-CG2 3.83Å; V63-V81 HydrophobicContact CG2-CG1 4.27Å; F79-V81 HydrophobicContact CD1-CG2 4.27Å; F79-V81 HydrophobicContact CD2-CG2 4.47Å; F79-V81 HydrophobicContact CE1-CB 4.45Å; F79-V81 HydrophobicContact CE1-CG2 3.51Å; F79-V81 HydrophobicContact CE2-CG2 3.75Å; F79-V81 HydrophobicContact CZ-CG2 3.22Å; V81-K137 CarbonylContact O-C 3.55Å; V81-K137 WeakPolarHBondContact O-CA 3.39Å; V81-F138 PolarHBondContact N-O 2.87Å; V81-F138 PolarHBondContact O-N 2.77Å; V81-L154 HydrophobicContact CB-CD2 3.95Å; V81-L154 HydrophobicContact CG1-CD2 4.01Å; V81-L154 HydrophobicContact CG2-CD2 4.24Å
82	E	90.4	Very high	88.1	Confident	35 Å²	35	40.1 Å²	40.1	16%	0.164	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124.1	168.9	-56.7	-168.4	160.4	0	0	109	S131 L135 E136 K137 K172	E82-S131 PolarHBondContact OE1-OG 3.29Å; E82-L135 HydrophobicContact CB-CB 4.3Å; E82-L135 HydrophobicContact CB-CD1 4.05Å; E82-E136 CarbonylContact C-O 3.5Å; E82-E136 VanDerWaalsContact CA-O 3.27Å; E82-E136 WeakPolarHBondContact CA-O 3.33Å; E82-K137 HydrophobicContact CG-CB 4.15Å; E82-K137 HydrophobicContact CG-CG 4.3Å; E82-K172 HydrophobicContact CB-CB 3.83Å; E82-K172 HydrophobicContact CB-CG 4.07Å; E82-K172 HydrophobicContact CG-CG 4.39Å; E82-K172 WeakPolarHBondContact OE2-CG 3.4Å
83	L	90.7	Very high	88.1	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	156.2	-178	59.4	123.6	0	0	0	111.1	A87 I89 L135 E136 F138 L154 Y156	L83-A87 HydrophobicContact CD1-CB 3.92Å; L83-I89 HydrophobicContact CD1-CG1 4.23Å; L83-I89 HydrophobicContact CD2-CD1 4.36Å; L83-I89 HydrophobicContact CD2-CG1 4.43Å; L83-L135 CarbonylContact O-C 3.52Å; L83-L135 WeakPolarHBondContact O-CA 3.42Å; L83-E136 PolarHBondContact N-O 2.83Å; L83-E136 PolarHBondContact O-N 3.42Å; L83-F138 HydrophobicContact CD2-CB 3.91Å; L83-L154 HydrophobicContact CD2-CD2 4.29Å; L83-Y156 HydrophobicContact CB-CD1 4.45Å; L83-Y156 HydrophobicContact CB-CD2 4.28Å; L83-Y156 HydrophobicContact CB-CE1 4.32Å; L83-Y156 HydrophobicContact CB-CE2 4.14Å; L83-Y156 HydrophobicContact CB-CG 4.42Å
84	P	91	Very high	88.1	Confident	9 Å²	9	31.5 Å²	31.5	6%	0.058	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	141.1	176.4	-26.3	37.5	0	0	0	113.3	T86 A87 E158	P84-T86 WeakPolarHBondContact CB-OG1 3.38Å; P84-T86 PolarHBondContact O-N 2.92Å; P84-T86 VanDerWaalsContact O-N 3.16Å; P84-A87 WeakPolarHBondContact O-CB 3.5Å; P84-A87 PolarHBondContact O-N 3.37Å; P84-E158 WeakPolarHBondContact CB-OE2 3.08Å
85	K	87.8	Confident	88.5	Confident	54 Å²	54	30.1 Å²	30.1	24%	0.235	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-25.9	172.5	-77.4	176.6	173.9	178.9	0	113.1	A87 R133 K134 E136 K618	K85-A87 VanDerWaalsContact C-N 3.26Å; K85-R133 WeakPolarHBondContact CE-O 3.47Å; K85-R133 PolarHBondContact NZ-O 3.38Å; K85-K134 PolarHBondContact N-O 3.49Å; K85-E136 HydrophobicContact CB-CG 4.43Å; K85-E136 HydrophobicContact CG-CG 3.62Å; K85-K618 WeakPolarHBondContact O-CE 3.34Å; K85-K618 PolarHBondContact O-NZ 3.49Å
86	T	89.1	Confident	88.6	Confident	48 Å²	48	27 Å²	27	29%	0.294	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-22.8	174.2	41.3	0	0	0	0	112.4	P84 E158 Y560	P84-T86 WeakPolarHBondContact CB-OG1 3.38Å; P84-T86 PolarHBondContact O-N 2.92Å; P84-T86 VanDerWaalsContact O-N 3.16Å; T86-E158 PolarHBondContact OG1-OE2 3.47Å; T86-Y560 WeakPolarHBondContact O-CE2 3.4Å; T86-Y560 PolarHBondContact O-OH 3.43Å
87	A	92.8	Very high	88.7	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.008	14%	0.14	C	C	.	.			trans	-76.7	152.6	-179.1	0	0	0	0	0	112.6	L83 P84 K85 Y156 E157 E158 K618	L83-A87 HydrophobicContact CD1-CB 3.92Å; P84-A87 WeakPolarHBondContact O-CB 3.5Å; P84-A87 PolarHBondContact O-N 3.37Å; K85-A87 VanDerWaalsContact C-N 3.26Å; A87-Y156 HydrophobicContact CB-CD2 3.74Å; A87-Y156 HydrophobicContact CB-CG 4.47Å; A87-E157 CarbonylContact C-O 3.57Å; A87-E157 VanDerWaalsContact CA-O 3.29Å; A87-E157 WeakPolarHBondContact CA-O 3.41Å; A87-E158 HydrophobicContact CB-CB 3.98Å; A87-K618 PolarHBondContact O-NZ 3.16Å; A87-K618 VanDerWaalsContact O-NZ 3.13Å
88	F	93.6	Very high	88.5	Confident	1 Å²	1	28.1 Å²	28.1	0%	0.004	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	130.4	164.2	-65.8	-41	0	0	0	109.3	Y156 E157 Y560 I563 E564 F594 V595 T596 K618	F88-Y156 CarbonylContact O-C 3.45Å; F88-Y156 VanDerWaalsContact O-CA 3.28Å; F88-Y156 WeakPolarHBondContact O-CA 3.46Å; F88-Y156 WeakPolarHBondContact O-CB 3.47Å; F88-E157 PolarHBondContact N-O 2.74Å; F88-E157 PolarHBondContact O-N 3.2Å; F88-Y560 AromaticContact CD2-CD2 3.38Å; F88-Y560 HydrophobicContact CD2-CD2 3.38Å; F88-Y560 AromaticContact CD2-CE2 3.61Å; F88-Y560 HydrophobicContact CD2-CE2 3.61Å; F88-Y560 HydrophobicContact CD2-CG 4.41Å; F88-Y560 AromaticContact CE2-CD2 3.6Å; F88-Y560 HydrophobicContact CE2-CD2 3.6Å; F88-Y560 AromaticContact CE2-CE2 3.72Å; F88-Y560 HydrophobicContact CE2-CE2 3.72Å; F88-Y560 HydrophobicContact CE2-CG 4.34Å; F88-Y560 HydrophobicContact CG-CD2 4.35Å; F88-Y560 HydrophobicContact CG-CE2 4.27Å; F88-Y560 HydrophobicContact CZ-CE2 4.5Å; F88-I563 HydrophobicContact CE2-CB 4.5Å; F88-I563 HydrophobicContact CE2-CG2 4.05Å; F88-I563 HydrophobicContact CZ-CG2 4.07Å; F88-E564 HydrophobicContact CE2-CG 4.3Å; F88-E564 HydrophobicContact CZ-CG 4.14Å; F88-F594 HydrophobicContact CB-CB 4.06Å; F88-F594 HydrophobicContact CB-CD1 3.43Å; F88-F594 VanDerWaalsContact CB-CD1 3.43Å; F88-F594 HydrophobicContact CB-CE1 4.16Å; F88-F594 HydrophobicContact CB-CG 4.04Å; F88-F594 HydrophobicContact CD2-CB 4.14Å; F88-F594 AromaticContact CD2-CD1 3.92Å; F88-F594 HydrophobicContact CD2-CD1 3.92Å; F88-F594 HydrophobicContact CD2-CD2 4.43Å; F88-F594 HydrophobicContact CD2-CE1 4.4Å; F88-F594 AromaticContact CD2-CG 3.93Å; F88-F594 HydrophobicContact CD2-CG 3.93Å; F88-F594 HydrophobicContact CG-CB 4.22Å; F88-F594 HydrophobicContact CG-CD1 4.11Å; F88-F594 HydrophobicContact CG-CG 4.32Å; F88-V595 VanDerWaalsContact CD1-O 3.29Å; F88-V595 WeakPolarHBondContact CD1-O 3.49Å; F88-T596 HydrophobicContact CD1-CG2 4.15Å; F88-T596 HydrophobicContact CE1-CG2 4.01Å; F88-T596 HydrophobicContact CE2-CG2 4.47Å; F88-T596 HydrophobicContact CG-CG2 4.45Å; F88-T596 HydrophobicContact CZ-CG2 4.22Å; F88-K618 HydrophobicContact CD1-CD 3.89Å; F88-K618 VanDerWaalsContact CD1-NZ 3.34Å; F88-K618 HydrophobicContact CE1-CD 3.79Å
89	I	92.7	Very high	88.2	Confident	5 Å²	5	29.4 Å²	29.4	3%	0.026	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	133.8	170.2	-59.7	168.7	0	0	0	107.8	L83 V128 F138 L154 V595 M601	L83-I89 HydrophobicContact CD1-CG1 4.23Å; L83-I89 HydrophobicContact CD2-CD1 4.36Å; L83-I89 HydrophobicContact CD2-CG1 4.43Å; I89-V128 HydrophobicContact CD1-CG2 4.19Å; I89-F138 HydrophobicContact CD1-CD2 3.51Å; I89-F138 HydrophobicContact CD1-CE2 3.99Å; I89-F138 HydrophobicContact CD1-CG 4.5Å; I89-L154 HydrophobicContact CG1-CD1 4.43Å; I89-L154 HydrophobicContact CG2-CD1 3.67Å; I89-V595 HydrophobicContact CB-CB 4Å; I89-V595 HydrophobicContact CB-CG2 3.94Å; I89-V595 HydrophobicContact CG2-CG2 4.22Å; I89-V595 WeakPolarHBondContact O-CG2 3.4Å; I89-V595 PolarHBondContact O-N 2.95Å; I89-M601 HydrophobicContact CG2-CE 3.85Å; I89-M601 HydrophobicContact CG2-SD 4.27Å
90	T	91.6	Very high	88	Confident	15 Å²	15	32.9 Å²	32.9	9%	0.092	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	-32.9	-176.3	54.4	0	0	0	0	113.4	T155 E157 R556 H593 F594	T90-T155 PolarHBondContact N-O 3.44Å; T90-T155 VanDerWaalsContact OG1-CG2 3.27Å; T90-T155 WeakPolarHBondContact OG1-CG2 3.37Å; T90-T155 PolarHBondContact OG1-O 3.06Å; T90-E157 HydrophobicContact CG2-CB 4.21Å; T90-E157 HydrophobicContact CG2-CG 3.86Å; T90-E157 WeakPolarHBondContact CG2-OE2 3.46Å; T90-R556 VanDerWaalsContact CG2-NH2 3.29Å; T90-H593 VanDerWaalsContact CA-O 3.31Å; T90-H593 WeakPolarHBondContact CA-O 3.47Å; T90-F594 HydrophobicContact CG2-CD1 3.44Å; T90-F594 VanDerWaalsContact CG2-CD1 3.44Å; T90-F594 HydrophobicContact CG2-CE1 3.4Å; T90-F594 VanDerWaalsContact CG2-CE1 3.4Å
91	N	91.2	Very high	87.7	Confident	57 Å²	57	31.3 Å²	31.3	31%	0.305	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	149.6	178.2	-167.5	13.3	0	0	0	110.7	T155	N91-T155 PolarHBondContact N-O 3.15Å; N91-T155 PolarHBondContact O-N 2.95Å
92	F	90.3	Very high	87.3	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.009	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	131.3	166.5	174.4	-100.9	0	0	0	109	F79 L94 G103 F138 V140 F152 E153 L154 M601 V603	F79-F92 AromaticContact CD1-CE2 3.95Å; F79-F92 HydrophobicContact CD1-CE2 3.95Å; F79-F92 AromaticContact CE1-CE2 3.96Å; F79-F92 HydrophobicContact CE1-CE2 3.96Å; F92-L94 HydrophobicContact CE1-CB 4.17Å; F92-G103 WeakPolarHBondContact O-CA 3.3Å; F92-G103 PolarHBondContact O-N 2.7Å; F92-F138 HydrophobicContact CB-CZ 4.39Å; F92-F138 HydrophobicContact CD1-CZ 4.35Å; F92-F138 AromaticContact CD2-CE1 3.72Å; F92-F138 HydrophobicContact CD2-CE1 3.72Å; F92-F138 AromaticContact CD2-CZ 3.67Å; F92-F138 HydrophobicContact CD2-CZ 3.67Å; F92-F138 AromaticContact CE2-CE1 3.61Å; F92-F138 HydrophobicContact CE2-CE1 3.61Å; F92-F138 AromaticContact CE2-CZ 3.92Å; F92-F138 HydrophobicContact CE2-CZ 3.92Å; F92-F138 HydrophobicContact CG-CE1 4.38Å; F92-F138 AromaticContact CG-CZ 3.88Å; F92-F138 HydrophobicContact CG-CZ 3.88Å; F92-F138 HydrophobicContact CZ-CE1 4.18Å; F92-F138 HydrophobicContact CZ-CZ 4.34Å; F92-V140 HydrophobicContact CE1-CG1 4.34Å; F92-V140 HydrophobicContact CE1-CG2 4.12Å; F92-V140 HydrophobicContact CE2-CG2 4.38Å; F92-V140 HydrophobicContact CZ-CB 4.05Å; F92-V140 HydrophobicContact CZ-CG1 4.05Å; F92-V140 HydrophobicContact CZ-CG2 3.79Å; F92-F152 HydrophobicContact CE2-CB 4.33Å; F92-F152 HydrophobicContact CE2-CD1 4.44Å; F92-F152 HydrophobicContact CZ-CD1 4Å; F92-E153 CarbonylContact C-O 3.54Å; F92-E153 VanDerWaalsContact CA-O 3.23Å; F92-E153 WeakPolarHBondContact CA-O 3.33Å; F92-E153 VanDerWaalsContact CD2-O 3.28Å; F92-E153 WeakPolarHBondContact CD2-O 3.49Å; F92-L154 HydrophobicContact CB-CD1 4.21Å; F92-L154 HydrophobicContact CD2-CB 4.1Å; F92-L154 HydrophobicContact CD2-CD1 4.06Å; F92-M601 HydrophobicContact CB-SD 3.48Å; F92-M601 WeakPolarHBondContact CB-SD 3.32Å; F92-V603 HydrophobicContact CD1-CG2 3.42Å; F92-V603 VanDerWaalsContact CD1-CG2 3.42Å; F92-V603 HydrophobicContact CE1-CG2 3.77Å
93	T	89.4	Confident	86.8	Confident	20 Å²	20	32.4 Å²	32.4	12%	0.123	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	136.1	175.7	75.5	0	0	0	0	110.8	E153	T93-E153 PolarHBondContact N-O 3.19Å; T93-E153 PolarHBondContact O-N 3.31Å; T93-E153 WeakPolarHBondContact OG1-CB 3.25Å
94	L	86.5	Confident	86.2	Confident	14 Å²	14	36 Å²	36	7%	0.073	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	118.5	175.1	172.2	64	0	0	0	108.1	F92 I96 Y101 V142 V150 F152 V603	F92-L94 HydrophobicContact CE1-CB 4.17Å; L94-I96 HydrophobicContact CD1-CG1 4.23Å; L94-I96 HydrophobicContact CD2-CD1 4.23Å; L94-I96 HydrophobicContact CG-CD1 4.37Å; L94-I96 HydrophobicContact CG-CG1 4.19Å; L94-Y101 HydrophobicContact CB-CD2 4.45Å; L94-Y101 HydrophobicContact CD2-CD2 4.31Å; L94-Y101 HydrophobicContact CG-CD2 4.14Å; L94-Y101 PolarHBondContact N-O 3.24Å; L94-Y101 WeakPolarHBondContact O-CB 2.95Å; L94-Y101 WeakPolarHBondContact O-CD2 3.41Å; L94-Y101 PolarHBondContact O-N 2.59Å; L94-V142 HydrophobicContact CD1-CG1 4.31Å; L94-V142 HydrophobicContact CD2-CG2 4.38Å; L94-V150 HydrophobicContact CD1-CG2 3.48Å; L94-V150 VanDerWaalsContact CD1-CG2 3.48Å; L94-F152 HydrophobicContact CD1-CD1 3.63Å; L94-F152 HydrophobicContact CD1-CE1 3.5Å; L94-F152 VanDerWaalsContact CD1-CE1 3.5Å; L94-F152 HydrophobicContact CD1-CG 4.48Å; L94-F152 HydrophobicContact CD1-CZ 4.26Å; L94-V603 HydrophobicContact CB-CG1 4.3Å
95	T	88.6	Confident	85.8	Confident	26 Å²	26	36.4 Å²	36.4	16%	0.16	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.7	177.2	-57.9	0	0	0	0	110.4	V99 T100 V150 T151	T95-V99 CarbonylContact C-O 3.3Å; T95-V99 VanDerWaalsContact CA-O 3.23Å; T95-V99 WeakPolarHBondContact CA-O 3.17Å; T95-T100 PolarHBondContact OG1-OG1 3.32Å; T95-V150 CarbonylContact O-C 3.51Å; T95-V150 VanDerWaalsContact O-CA 3.27Å; T95-V150 WeakPolarHBondContact O-CA 3.49Å; T95-T151 PolarHBondContact N-O 2.86Å; T95-T151 PolarHBondContact O-N 3.35Å
96	I	83.9	Confident	85.4	Confident	19 Å²	19	36.5 Å²	36.5	10%	0.097	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	122.3	177.2	-53.1	175.4	0	0	0	108.3	L94 G98 V99 Y101 V142 K149 V150	L94-I96 HydrophobicContact CD1-CG1 4.23Å; L94-I96 HydrophobicContact CD2-CD1 4.23Å; L94-I96 HydrophobicContact CG-CD1 4.37Å; L94-I96 HydrophobicContact CG-CG1 4.19Å; I96-G98 PolarHBondContact O-N 3.03Å; I96-V99 PolarHBondContact N-O 3.23Å; I96-V99 PolarHBondContact O-N 3.35Å; I96-Y101 HydrophobicContact CB-CE2 4.13Å; I96-Y101 HydrophobicContact CD1-CE2 4.05Å; I96-Y101 HydrophobicContact CG1-CE2 4.04Å; I96-V142 HydrophobicContact CD1-CG2 3.92Å; I96-K149 WeakPolarHBondContact CA-O 3.11Å; I96-V150 HydrophobicContact CG1-CG2 4.09Å
97	D	82.2	Confident	85.1	Confident	97 Å²	97	38.3 Å²	38.3	52%	0.519	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	35.6	180	-65.5	-29.2	0	0	0	114.7	S148 K149	D97-S148 VanDerWaalsContact OD1-CA 3.25Å; D97-S148 WeakPolarHBondContact OD1-CA 3.45Å; D97-S148 VanDerWaalsContact OD1-CB 3.31Å; D97-S148 WeakPolarHBondContact OD1-CB 3.48Å; D97-S148 WeakPolarHBondContact OD2-CB 3.5Å; D97-S148 PolarHBondContact OD2-OG 3.42Å; D97-K149 PolarHBondContact N-O 3.14Å; D97-K149 PolarHBondContact OD1-N 3.46Å
98	G	79.8	Confident	84.5	Confident	67 Å²	67	40.6 Å²	40.6	69%	0.691	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.5	-2.8	178.5	0	0	0	0	0	115.1	I96	I96-G98 PolarHBondContact O-N 3.03Å
99	V	77.4	Confident	83.6	Confident	78 Å²	78	45.5 Å²	45.5	47%	0.473	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	121.1	171.9	-173.7	0	0	0	0	109.4	T95 I96 Y101	T95-V99 CarbonylContact C-O 3.3Å; T95-V99 VanDerWaalsContact CA-O 3.23Å; T95-V99 WeakPolarHBondContact CA-O 3.17Å; I96-V99 PolarHBondContact N-O 3.23Å; I96-V99 PolarHBondContact O-N 3.35Å; V99-Y101 HydrophobicContact CB-CE1 4.41Å; V99-Y101 HydrophobicContact CB-CE2 4.47Å; V99-Y101 HydrophobicContact CG1-CD1 4.37Å; V99-Y101 HydrophobicContact CG1-CE1 3.51Å; V99-Y101 HydrophobicContact CG1-CE2 4.37Å; V99-Y101 WeakPolarHBondContact CG1-OH 3.38Å
100	T	83.3	Confident	82.8	Confident	76 Å²	76	48.2 Å²	48.2	47%	0.466	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130	-178.4	-58.2	0	0	0	0	111.6	T95	T95-T100 PolarHBondContact OG1-OG1 3.32Å
101	Y	80.4	Confident	81.7	Confident	17 Å²	17	47.5 Å²	47.5	7%	0.067	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	105	177.4	-50	-65.3	0	0	0	108.9	L94 I96 V99 T604 K605 P606	L94-Y101 HydrophobicContact CB-CD2 4.45Å; L94-Y101 HydrophobicContact CD2-CD2 4.31Å; L94-Y101 HydrophobicContact CG-CD2 4.14Å; L94-Y101 PolarHBondContact N-O 3.24Å; L94-Y101 WeakPolarHBondContact O-CB 2.95Å; L94-Y101 WeakPolarHBondContact O-CD2 3.41Å; L94-Y101 PolarHBondContact O-N 2.59Å; I96-Y101 HydrophobicContact CB-CE2 4.13Å; I96-Y101 HydrophobicContact CD1-CE2 4.05Å; I96-Y101 HydrophobicContact CG1-CE2 4.04Å; V99-Y101 HydrophobicContact CB-CE1 4.41Å; V99-Y101 HydrophobicContact CB-CE2 4.47Å; V99-Y101 HydrophobicContact CG1-CD1 4.37Å; V99-Y101 HydrophobicContact CG1-CE1 3.51Å; V99-Y101 HydrophobicContact CG1-CE2 4.37Å; V99-Y101 WeakPolarHBondContact CG1-OH 3.38Å; Y101-T604 WeakPolarHBondContact CD1-O 3.41Å; Y101-K605 HydrophobicContact CD1-CB 4.15Å; Y101-K605 HydrophobicContact CD1-CG 4.35Å; Y101-K605 HydrophobicContact CE1-CB 4.04Å; Y101-K605 HydrophobicContact CE1-CG 3.72Å; Y101-K605 HydrophobicContact CE2-CD 4.34Å; Y101-K605 HydrophobicContact CE2-CG 4.21Å; Y101-K605 HydrophobicContact CG-CB 4.46Å; Y101-P606 HydrophobicContact CD1-CG 4.47Å; Y101-P606 HydrophobicContact CE1-CG 4.3Å
102	P	81.1	Confident	80.6	Confident	65 Å²	65	49.2 Å²	49.2	42%	0.422	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	143.9	177.7	31	-33.5	0	0	0	111.6
103	G	78.6	Confident	79.6	Confident	10 Å²	10	56.1 Å²	56.1	10%	0.103	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	133.8	167.7	0	0	0	0	0	110.9	F92 V602	F92-G103 WeakPolarHBondContact O-CA 3.3Å; F92-G103 PolarHBondContact O-N 2.7Å; G103-V602 WeakPolarHBondContact CA-O 3.27Å
104	N	79.1	Confident	78.5	Confident	74 Å²	74	56.8 Å²	56.8	40%	0.396	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	122	178.5	-65.3	-68	0	0	0	109.9	M601 V602	N104-M601 CarbonylContact O-C 3.6Å; N104-M601 WeakPolarHBondContact O-CA 3.1Å; N104-V602 PolarHBondContact N-O 3.05Å; N104-V602 PolarHBondContact O-N 2.89Å
105	V	81.9	Confident	77.3	Confident	19 Å²	19	59.4 Å²	59.4	12%	0.115	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	130.6	174.5	-175.8	0	0	0	0	109.7	L590 H593 V595 T599 S600 M601	V105-L590 HydrophobicContact CG1-CD2 4.43Å; V105-H593 HydrophobicContact CB-CB 4.47Å; V105-H593 HydrophobicContact CG2-CB 4.1Å; V105-H593 WeakPolarHBondContact CG2-O 3.21Å; V105-V595 HydrophobicContact CG2-CG2 4.1Å; V105-T599 HydrophobicContact CG1-CG2 4.27Å; V105-S600 CarbonylContact C-O 3.54Å; V105-S600 WeakPolarHBondContact CA-O 3.36Å; V105-M601 HydrophobicContact CG2-CB 4.23Å; V105-M601 HydrophobicContact CG2-CE 3.58Å; V105-M601 HydrophobicContact CG2-CG 4.37Å
106	K	79.9	Confident	76.1	Confident	56 Å²	56	63.1 Å²	63.1	24%	0.243	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	167	-179.5	-60.8	-173.4	-173.5	178.5	0	109.6	V110 T599 S600 V602	K106-V110 HydrophobicContact CD-CG1 4.49Å; K106-T599 CarbonylContact O-C 3.45Å; K106-T599 VanDerWaalsContact O-CA 3.24Å; K106-T599 WeakPolarHBondContact O-CA 3.28Å; K106-T599 WeakPolarHBondContact O-CB 3.25Å; K106-S600 PolarHBondContact N-O 2.92Å; K106-S600 PolarHBondContact O-N 3.43Å; K106-V602 HydrophobicContact CD-CG2 4.32Å
107	E	83.7	Confident	75.1	Confident	85 Å²	85	66.6 Å²	66.6	40%	0.397	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	139.7	168.4	-173.3	-175.3	159.2	0	0	110.4	E109 V110 A111 L586	E107-E109 PolarHBondContact O-N 2.88Å; E107-V110 HydrophobicContact CB-CB 4.35Å; E107-V110 HydrophobicContact CB-CG2 4.11Å; E107-V110 WeakPolarHBondContact O-CB 3.37Å; E107-V110 PolarHBondContact O-N 2.85Å; E107-V110 VanDerWaalsContact O-N 3.09Å; E107-A111 PolarHBondContact O-N 3.43Å; E107-L586 HydrophobicContact CB-CD1 4.3Å; E107-L586 HydrophobicContact CG-CD1 4.11Å; E107-L586 HydrophobicContact CG-CD2 4.06Å
108	K	78.8	Confident	73.6	Confident	50 Å²	50	62 Å²	62	22%	0.217	33%	0.325	C	S	.	.	H	α-helix	trans	-56.8	-45	-172.2	-177	162.8	-173.5	167.9	0	113.7	V110 A111 K112 P597 L598 S600 K618	K108-V110 VanDerWaalsContact C-N 3.32Å; K108-V110 PolarHBondContact O-N 2.77Å; K108-A111 PolarHBondContact O-N 2.74Å; K108-K112 WeakPolarHBondContact O-CB 3.43Å; K108-K112 PolarHBondContact O-N 3.32Å; K108-P597 WeakPolarHBondContact CD-O 3.44Å; K108-P597 PolarHBondContact NZ-O 3.49Å; K108-L598 WeakPolarHBondContact CB-O 3.21Å; K108-L598 PolarHBondContact N-O 2.77Å; K108-S600 WeakPolarHBondContact CA-OG 3.3Å; K108-K618 PolarHBondContact NZ-O 2.82Å
109	E	75.1	Confident	72.4	Confident	104 Å²	104	62.2 Å²	62.2	49%	0.486	31%	0.312	S	S	.	.	H	α-helix	trans	-66	-35.8	178.6	-68.1	-56.7	135.7	0	0	112.4	E107 K113	E107-E109 PolarHBondContact O-N 2.88Å; E109-K113 WeakPolarHBondContact O-CG 3.25Å; E109-K113 PolarHBondContact O-N 2.84Å
110	V	76.9	Confident	71.1	Confident	62 Å²	62	63.1 Å²	63.1	38%	0.376	32%	0.322	S	S	.	.	H	α-helix	trans	-68.1	-44.5	176	177.7	0	0	0	0	110.2	K106 E107 K108 Q114	K106-V110 HydrophobicContact CD-CG1 4.49Å; E107-V110 HydrophobicContact CB-CB 4.35Å; E107-V110 HydrophobicContact CB-CG2 4.11Å; E107-V110 WeakPolarHBondContact O-CB 3.37Å; E107-V110 PolarHBondContact O-N 2.85Å; E107-V110 VanDerWaalsContact O-N 3.09Å; K108-V110 VanDerWaalsContact C-N 3.32Å; K108-V110 PolarHBondContact O-N 2.77Å; V110-Q114 VanDerWaalsContact O-CG 3.24Å; V110-Q114 WeakPolarHBondContact O-CG 3.43Å; V110-Q114 PolarHBondContact O-N 3.48Å
111	A	67.9	Low	69.4	Low	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-62.9	-49.3	175	0	0	0	0	0	111.1	E107 K108 K113 Q114 Y115 V602 I615	E107-A111 PolarHBondContact O-N 3.43Å; K108-A111 PolarHBondContact O-N 2.74Å; A111-K113 VanDerWaalsContact C-N 3.34Å; A111-K113 PolarHBondContact O-N 3.05Å; A111-Q114 CarbonylContact O-C 3.56Å; A111-Q114 VanDerWaalsContact O-CA 3.26Å; A111-Q114 WeakPolarHBondContact O-CA 3.06Å; A111-Q114 VanDerWaalsContact O-CB 3.23Å; A111-Q114 WeakPolarHBondContact O-CB 3.42Å; A111-Q114 PolarHBondContact O-N 3.4Å; A111-Y115 PolarHBondContact O-N 2.94Å; A111-V602 HydrophobicContact CB-CG2 3.64Å; A111-I615 HydrophobicContact CB-CD1 4.12Å; A111-I615 HydrophobicContact CB-CG2 4.16Å; A111-I615 WeakPolarHBondContact O-CD1 3.13Å
112	K	67.1	Low	67.6	Low	93 Å²	93	66.4 Å²	66.4	40%	0.404	35%	0.353	S	S	.	.	H	α-helix	trans	-54.1	-45.6	-179.4	-174.4	-179.9	175.6	-173.6	0	113.1	K108 Q114 Y115 E116	K108-K112 WeakPolarHBondContact O-CB 3.43Å; K108-K112 PolarHBondContact O-N 3.32Å; K112-Q114 PolarHBondContact O-N 2.92Å; K112-Y115 WeakPolarHBondContact O-CB 3.24Å; K112-Y115 PolarHBondContact O-N 2.94Å; K112-E116 WeakPolarHBondContact CE-OE1 3.41Å; K112-E116 WeakPolarHBondContact O-CG 3.41Å; K112-E116 PolarHBondContact O-N 2.82Å
113	K	71.1	Confident	66	Low	147 Å²	147	66 Å²	66	64%	0.639	35%	0.345	S	S	*	.	H	α-helix	trans	-59.3	-36.2	173.5	-71.6	174.9	-175.9	175.2	0	112.5	E109 A111 Y115 K117	E109-K113 WeakPolarHBondContact O-CG 3.25Å; E109-K113 PolarHBondContact O-N 2.84Å; A111-K113 VanDerWaalsContact C-N 3.34Å; A111-K113 PolarHBondContact O-N 3.05Å; K113-Y115 VanDerWaalsContact C-N 3.35Å; K113-K117 WeakPolarHBondContact O-CB 3.4Å; K113-K117 PolarHBondContact O-N 3.19Å
114	Q	64.4	Low	64.5	Low	34 Å²	34	68.1 Å²	68.1	16%	0.159	36%	0.356	C	S	.	.	H	α-helix	trans	-71.3	-30	175.3	-64.6	178.4	10.2	0	0	112.4	V110 A111 K112 A118 R613 I615	V110-Q114 VanDerWaalsContact O-CG 3.24Å; V110-Q114 WeakPolarHBondContact O-CG 3.43Å; V110-Q114 PolarHBondContact O-N 3.48Å; A111-Q114 CarbonylContact O-C 3.56Å; A111-Q114 VanDerWaalsContact O-CA 3.26Å; A111-Q114 WeakPolarHBondContact O-CA 3.06Å; A111-Q114 VanDerWaalsContact O-CB 3.23Å; A111-Q114 WeakPolarHBondContact O-CB 3.42Å; A111-Q114 PolarHBondContact O-N 3.4Å; K112-Q114 PolarHBondContact O-N 2.92Å; Q114-A118 PolarHBondContact O-N 2.87Å; Q114-R613 VanDerWaalsContact CD-NH1 3.33Å; Q114-I615 HydrophobicContact CB-CD1 4.1Å
115	Y	61.4	Low	63.1	Low	69 Å²	69	65.8 Å²	65.8	27%	0.271	35%	0.347	S	S	.	.	H	α-helix	trans	-72.3	-52	177.8	175.4	-99.6	0	0	0	110.7	A111 K112 K113 K117 A118 V119 A125 I615	A111-Y115 PolarHBondContact O-N 2.94Å; K112-Y115 WeakPolarHBondContact O-CB 3.24Å; K112-Y115 PolarHBondContact O-N 2.94Å; K113-Y115 VanDerWaalsContact C-N 3.35Å; Y115-K117 PolarHBondContact O-N 2.72Å; Y115-A118 WeakPolarHBondContact O-CA 3.23Å; Y115-A118 WeakPolarHBondContact O-CB 3.35Å; Y115-A118 PolarHBondContact O-N 2.81Å; Y115-V119 HydrophobicContact CD1-CG2 4.03Å; Y115-V119 HydrophobicContact CD2-CG2 4.15Å; Y115-V119 HydrophobicContact CE1-CG2 3.63Å; Y115-V119 HydrophobicContact CE2-CG2 3.8Å; Y115-V119 HydrophobicContact CG-CG2 4.27Å; Y115-V119 WeakPolarHBondContact O-CG2 3.36Å; Y115-V119 PolarHBondContact O-N 2.61Å; Y115-A125 HydrophobicContact CD2-CB 3.81Å; Y115-A125 HydrophobicContact CE2-CB 3.4Å; Y115-A125 VanDerWaalsContact CE2-CB 3.4Å; Y115-I615 HydrophobicContact CD2-CB 3.84Å; Y115-I615 HydrophobicContact CD2-CD1 4.48Å; Y115-I615 HydrophobicContact CD2-CG1 4.08Å; Y115-I615 HydrophobicContact CG-CB 4.42Å; Y115-I615 HydrophobicContact CG-CD1 4.42Å; Y115-I615 HydrophobicContact CG-CG1 4.49Å; Y115-I615 VanDerWaalsContact N-CD1 3.29Å
116	E	64.3	Low	61.6	Low	103 Å²	103	65 Å²	65	48%	0.481	34%	0.342	S	S	.	.	H	α-helix	trans	-58.7	-37.2	-179.6	-69	171.1	174.2	0	0	110.8	K112 S120	K112-E116 WeakPolarHBondContact CE-OE1 3.41Å; K112-E116 WeakPolarHBondContact O-CG 3.41Å; K112-E116 PolarHBondContact O-N 2.82Å; E116-S120 WeakPolarHBondContact O-CB 3.48Å; E116-S120 PolarHBondContact O-N 3.16Å; E116-S120 VanDerWaalsContact O-N 3.09Å; E116-S120 PolarHBondContact O-OG 3.29Å
117	K	62	Low	60.4	Low	92 Å²	92	65.2 Å²	65.2	40%	0.4	35%	0.346	S	S	.	.	H	α-helix	trans	-65.2	-38	172.1	-168.9	179	-177.4	-174.8	0	113	K113 Y115 S120 Q121 D611	K113-K117 WeakPolarHBondContact O-CB 3.4Å; K113-K117 PolarHBondContact O-N 3.19Å; Y115-K117 PolarHBondContact O-N 2.72Å; K117-S120 PolarHBondContact O-OG 2.87Å; K117-Q121 VanDerWaalsContact O-CG 3.25Å; K117-Q121 WeakPolarHBondContact O-CG 3.47Å; K117-D611 WeakPolarHBondContact CE-OD2 3.25Å; K117-D611 IonicContact NZ-OD2 2.89Å; K117-D611 PolarHBondContact NZ-OD2 2.97Å
118	A	52.2	Low	59	Low	2 Å²	2	61.7 Å²	61.7	2%	0.017	33%	0.33	C	S	.	.	H	α-helix	trans	-75.1	-40.4	179.7	0	0	0	0	0	112.7	Q114 Y115 Q121 K123 R613	Q114-A118 PolarHBondContact O-N 2.87Å; Y115-A118 WeakPolarHBondContact O-CA 3.23Å; Y115-A118 WeakPolarHBondContact O-CB 3.35Å; Y115-A118 PolarHBondContact O-N 2.81Å; A118-Q121 PolarHBondContact O-N 3.37Å; A118-K123 WeakPolarHBondContact O-CB 3.27Å; A118-K123 PolarHBondContact O-N 3.37Å; A118-R613 HydrophobicContact CB-CB 4.13Å; A118-R613 VanDerWaalsContact CB-O 3.29Å; A118-R613 WeakPolarHBondContact CB-O 3.28Å
119	V	53.4	Low	57.7	Low	70 Å²	70	65.5 Å²	65.5	42%	0.424	35%	0.347	S	S	.	.	H	α-helix	trans	-67.5	-41.4	178.1	174.3	0	0	0	0	111.5	Y115 Q121 G122 A125	Y115-V119 HydrophobicContact CD1-CG2 4.03Å; Y115-V119 HydrophobicContact CD2-CG2 4.15Å; Y115-V119 HydrophobicContact CE1-CG2 3.63Å; Y115-V119 HydrophobicContact CE2-CG2 3.8Å; Y115-V119 HydrophobicContact CG-CG2 4.27Å; Y115-V119 WeakPolarHBondContact O-CG2 3.36Å; Y115-V119 PolarHBondContact O-N 2.61Å; V119-Q121 PolarHBondContact O-N 3.32Å; V119-Q121 VanDerWaalsContact O-N 3.15Å; V119-G122 PolarHBondContact O-N 2.83Å; V119-A125 HydrophobicContact CG2-CB 4.24Å
120	S	50.4	Low	56.3	Low	98 Å²	98	63.6 Å²	63.6	69%	0.685	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-16.9	175.2	53.8	0	0	0	0	113.6	E116 K117	E116-S120 WeakPolarHBondContact O-CB 3.48Å; E116-S120 PolarHBondContact O-N 3.16Å; E116-S120 VanDerWaalsContact O-N 3.09Å; E116-S120 PolarHBondContact O-OG 3.29Å; K117-S120 PolarHBondContact O-OG 2.87Å
121	Q	47.3	Very low	54.6	Low	85 Å²	85	62 Å²	62	40%	0.397	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	6.2	173.8	-66.2	176.5	-5.7	0	0	113.3	K117 A118 V119 K123 D611	K117-Q121 VanDerWaalsContact O-CG 3.25Å; K117-Q121 WeakPolarHBondContact O-CG 3.47Å; A118-Q121 PolarHBondContact O-N 3.37Å; V119-Q121 PolarHBondContact O-N 3.32Å; V119-Q121 VanDerWaalsContact O-N 3.15Å; Q121-K123 VanDerWaalsContact C-N 3.3Å; Q121-K123 HydrophobicContact CB-CD 3.96Å; Q121-K123 HydrophobicContact CB-CG 3.94Å; Q121-K123 PolarHBondContact O-N 2.82Å; Q121-D611 PolarHBondContact OE1-O 3.47Å
122	G	42.7	Very low	54.2	Low	76 Å²	76	65.1 Å²	65.1	78%	0.784	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	21.1	179.8	0	0	0	0	0	114.4	V119	V119-G122 PolarHBondContact O-N 2.83Å
123	K	48.8	Very low	54.5	Low	57 Å²	57	64 Å²	64	25%	0.248	37%	0.365	C	S	.	.			trans	-93.9	163.3	-171.9	-60	-179.2	176.2	176.3	0	112.5	A118 Q121 A125 D611 E612	A118-K123 WeakPolarHBondContact O-CB 3.27Å; A118-K123 PolarHBondContact O-N 3.37Å; Q121-K123 VanDerWaalsContact C-N 3.3Å; Q121-K123 HydrophobicContact CB-CD 3.96Å; Q121-K123 HydrophobicContact CB-CG 3.94Å; Q121-K123 PolarHBondContact O-N 2.82Å; K123-A125 PolarHBondContact O-N 2.78Å; K123-D611 WeakPolarHBondContact CD-O 3.47Å; K123-D611 PolarHBondContact NZ-O 3.3Å; K123-E612 HydrophobicContact CD-CB 4.34Å; K123-E612 HydrophobicContact CD-CG 4.12Å
124	T	46.1	Very low	54.6	Low	55 Å²	55	64 Å²	64	34%	0.337	37%	0.365	S	S	.	.			trans	-65.4	126.3	179.7	-66.4	0	0	0	0	112.3	S141 V142	T124-S141 WeakPolarHBondContact CG2-O 3.21Å; T124-V142 HydrophobicContact CG2-CB 3.97Å; T124-V142 HydrophobicContact CG2-CG2 4.18Å
125	A	49.9	Very low	55.5	Low	25 Å²	25	62.9 Å²	62.9	21%	0.207	36%	0.36	C	S	.	.			trans	-131.3	139	172.7	0	0	0	0	0	113.7	Y115 V119 K123	Y115-A125 HydrophobicContact CD2-CB 3.81Å; Y115-A125 HydrophobicContact CE2-CB 3.4Å; Y115-A125 VanDerWaalsContact CE2-CB 3.4Å; V119-A125 HydrophobicContact CG2-CB 4.24Å; K123-A125 PolarHBondContact O-N 2.78Å
126	G	49.8	Very low	56.4	Low	1 Å²	1	60 Å²	60	1%	0.01	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	159.9	164.9	0	0	0	0	0	110.7	T139 I615	G126-T139 CarbonylContact C-O 3.39Å; G126-T139 WeakPolarHBondContact CA-O 3.38Å; G126-I615 CarbonylContact C-O 3.59Å
127	L	55.4	Low	57.2	Low	62 Å²	62	58.2 Å²	58.2	33%	0.325	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	129.4	175.3	-172.8	60.5	0	0	0	109.8	K129 T139 I615	L127-K129 HydrophobicContact CD2-CD 3.86Å; L127-K129 HydrophobicContact CD2-CG 4.2Å; L127-K129 VanDerWaalsContact CD2-NZ 3.33Å; L127-K129 HydrophobicContact CG-CD 4.26Å; L127-K129 HydrophobicContact CG-CG 4.09Å; L127-T139 PolarHBondContact N-O 2.71Å; L127-T139 PolarHBondContact O-N 3.37Å; L127-T139 VanDerWaalsContact O-O 3.12Å; L127-I615 PolarHBondContact N-O 3.03Å
128	V	53.4	Low	58.2	Low	11 Å²	11	54 Å²	54	7%	0.067	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	130.1	169.4	-178.2	0	0	0	0	108.2	I89 E136 K137 F138 A616 D617	I89-V128 HydrophobicContact CD1-CG2 4.19Å; V128-E136 HydrophobicContact CG1-CB 4.39Å; V128-K137 CarbonylContact C-O 3.55Å; V128-K137 WeakPolarHBondContact CA-O 3.23Å; V128-F138 HydrophobicContact CG2-CB 4.4Å; V128-F138 HydrophobicContact CG2-CD2 3.41Å; V128-F138 VanDerWaalsContact CG2-CD2 3.41Å; V128-F138 HydrophobicContact CG2-CE2 4.05Å; V128-F138 HydrophobicContact CG2-CG 4.26Å; V128-A616 HydrophobicContact CG2-CB 3.55Å; V128-D617 WeakPolarHBondContact CB-O 3.34Å; V128-D617 VanDerWaalsContact CG1-O 3.3Å; V128-D617 WeakPolarHBondContact CG1-O 3.28Å
129	K	51.7	Low	59.4	Low	130 Å²	130	55.5 Å²	55.5	57%	0.565	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.2	144.8	178.9	-80.5	171	164.5	163	0	108.7	L127 S131 K137	L127-K129 HydrophobicContact CD2-CD 3.86Å; L127-K129 HydrophobicContact CD2-CG 4.2Å; L127-K129 VanDerWaalsContact CD2-NZ 3.33Å; L127-K129 HydrophobicContact CG-CD 4.26Å; L127-K129 HydrophobicContact CG-CG 4.09Å; K129-S131 PolarHBondContact O-N 2.93Å; K129-K137 PolarHBondContact N-O 2.9Å; K129-K137 WeakPolarHBondContact O-CA 3.36Å; K129-K137 PolarHBondContact O-N 3.16Å; K129-K137 VanDerWaalsContact O-O 3.12Å
130	A	45.1	Very low	60.5	Low	64 Å²	64	52.4 Å²	52.4	53%	0.529	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	139.5	169.4	0	0	0	0	0	110.5
131	S	43	Very low	61.6	Low	29 Å²	29	49 Å²	49	20%	0.203	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	108.7	175.6	-169.1	0	0	0	0	109.9	E82 K129 L135 K137	E82-S131 PolarHBondContact OE1-OG 3.29Å; K129-S131 PolarHBondContact O-N 2.93Å; S131-L135 CarbonylContact C-O 3.53Å; S131-L135 PolarHBondContact N-O 2.85Å; S131-L135 VanDerWaalsContact N-O 3.09Å; S131-L135 CarbonylContact O-C 3.51Å; S131-L135 VanDerWaalsContact O-C 3.3Å; S131-L135 VanDerWaalsContact O-CB 3.29Å; S131-L135 WeakPolarHBondContact O-CB 3.43Å; S131-K137 VanDerWaalsContact CB-CB 3.49Å
132	G	58.9	Low	63	Low	64 Å²	64	45.4 Å²	45.4	66%	0.66	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	-163.7	-177.6	0	0	0	0	0	114.8
133	R	72.4	Confident	64.5	Low	69 Å²	69	46.5 Å²	46.5	26%	0.26	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-50.6	-170.8	-57.4	-179.9	-176.2	172.5	4.7	112.6	K85 Y451 D453 D455 Q459	K85-R133 WeakPolarHBondContact CE-O 3.47Å; K85-R133 PolarHBondContact NZ-O 3.38Å; R133-Y451 HydrophobicContact CB-CD2 4.29Å; R133-Y451 HydrophobicContact CB-CE1 4.49Å; R133-Y451 HydrophobicContact CB-CE2 3.7Å; R133-Y451 HydrophobicContact CG-CD1 4Å; R133-Y451 HydrophobicContact CG-CD2 3.66Å; R133-Y451 HydrophobicContact CG-CE1 3.9Å; R133-Y451 HydrophobicContact CG-CE2 3.54Å; R133-Y451 HydrophobicContact CG-CG 3.88Å; R133-D453 IonicContact NH2-OD2 3.6Å; R133-D453 PolarHBondContact NH2-OD2 3.21Å; R133-D455 IonicContact CZ-OD1 3.65Å; R133-D455 IonicContact CZ-OD2 3.72Å; R133-D455 IonicContact NH1-OD1 3.82Å; R133-D455 PolarHBondContact NH1-OD1 3.19Å; R133-D455 VanDerWaalsContact NH1-OD1 3.13Å; R133-D455 IonicContact NH1-OD2 2.97Å; R133-D455 PolarHBondContact NH1-OD2 3.43Å; R133-D455 IonicContact NH2-OD1 2.77Å; R133-D455 PolarHBondContact NH2-OD1 3.31Å; R133-D455 IonicContact NH2-OD2 2.64Å; R133-Q459 VanDerWaalsContact NH1-CD 3.27Å
134	K	74.3	Confident	66	Low	148 Å²	148	43.8 Å²	43.8	64%	0.643	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102	-9.7	-172.6	-64.2	-175	178.3	-176.1	0	114.6	K85	K85-K134 PolarHBondContact N-O 3.49Å
135	L	83.6	Confident	67.7	Low	11 Å²	11	43.8 Å²	43.8	6%	0.058	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	159.8	-168.2	-51	168.4	0	0	0	113.1	E82 L83 S131 Y170 K172	E82-L135 HydrophobicContact CB-CB 4.3Å; E82-L135 HydrophobicContact CB-CD1 4.05Å; L83-L135 CarbonylContact O-C 3.52Å; L83-L135 WeakPolarHBondContact O-CA 3.42Å; S131-L135 CarbonylContact C-O 3.53Å; S131-L135 PolarHBondContact N-O 2.85Å; S131-L135 VanDerWaalsContact N-O 3.09Å; S131-L135 CarbonylContact O-C 3.51Å; S131-L135 VanDerWaalsContact O-C 3.3Å; S131-L135 VanDerWaalsContact O-CB 3.29Å; S131-L135 WeakPolarHBondContact O-CB 3.43Å; L135-Y170 HydrophobicContact CD1-CE1 3.58Å; L135-Y170 HydrophobicContact CD2-CD1 3.63Å; L135-Y170 HydrophobicContact CD2-CE1 3.51Å; L135-Y170 HydrophobicContact CG-CE1 3.98Å; L135-K172 HydrophobicContact CD1-CB 4.23Å; L135-K172 HydrophobicContact CD1-CD 4.18Å; L135-K172 HydrophobicContact CD1-CG 4.45Å
136	E	80.1	Confident	69.5	Low	9 Å²	9	44.9 Å²	44.9	4%	0.042	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	135.5	167.5	-60.2	-178.4	172.6	0	0	107.9	E82 L83 K85 V128 P619	E82-E136 CarbonylContact C-O 3.5Å; E82-E136 VanDerWaalsContact CA-O 3.27Å; E82-E136 WeakPolarHBondContact CA-O 3.33Å; L83-E136 PolarHBondContact N-O 2.83Å; L83-E136 PolarHBondContact O-N 3.42Å; K85-E136 HydrophobicContact CB-CG 4.43Å; K85-E136 HydrophobicContact CG-CG 3.62Å; V128-E136 HydrophobicContact CG1-CB 4.39Å; E136-P619 HydrophobicContact CG-CG 4.08Å; E136-P619 WeakPolarHBondContact OE2-CD 3.28Å
137	K	80.2	Confident	71.3	Confident	65 Å²	65	47.5 Å²	47.5	28%	0.283	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	118.1	175.2	179.9	170.1	-174.5	174.1	0	110.3	D80 V81 E82 V128 K129 S131 T139	D80-K137 VanDerWaalsContact CG-CE 3.44Å; D80-K137 WeakPolarHBondContact OD2-CE 3.37Å; D80-K137 IonicContact OD2-NZ 3.16Å; D80-K137 PolarHBondContact OD2-NZ 3.06Å; D80-K137 VanDerWaalsContact OD2-NZ 3.1Å; V81-K137 CarbonylContact O-C 3.55Å; V81-K137 WeakPolarHBondContact O-CA 3.39Å; E82-K137 HydrophobicContact CG-CB 4.15Å; E82-K137 HydrophobicContact CG-CG 4.3Å; V128-K137 CarbonylContact C-O 3.55Å; V128-K137 WeakPolarHBondContact CA-O 3.23Å; K129-K137 PolarHBondContact N-O 2.9Å; K129-K137 WeakPolarHBondContact O-CA 3.36Å; K129-K137 PolarHBondContact O-N 3.16Å; K129-K137 VanDerWaalsContact O-O 3.12Å; S131-K137 VanDerWaalsContact CB-CB 3.49Å; K137-T139 VanDerWaalsContact CE-OG1 3.25Å; K137-T139 WeakPolarHBondContact CE-OG1 3.38Å
138	F	82.9	Confident	72.9	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.009	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	119.1	167.4	-177	-87.4	0	0	0	109.2	F79 D80 V81 L83 I89 F92 V128 V140 L154 A616	F79-F138 AromaticContact CD1-CD1 3.94Å; F79-F138 HydrophobicContact CD1-CD1 3.94Å; F79-F138 AromaticContact CD1-CE1 3.87Å; F79-F138 HydrophobicContact CD1-CE1 3.87Å; F79-F138 AromaticContact CE1-CD1 3.91Å; F79-F138 HydrophobicContact CE1-CD1 3.91Å; F79-F138 AromaticContact CE1-CE1 3.93Å; F79-F138 HydrophobicContact CE1-CE1 3.93Å; D80-F138 WeakPolarHBondContact CA-O 3.35Å; V81-F138 PolarHBondContact N-O 2.87Å; V81-F138 PolarHBondContact O-N 2.77Å; L83-F138 HydrophobicContact CD2-CB 3.91Å; I89-F138 HydrophobicContact CD1-CD2 3.51Å; I89-F138 HydrophobicContact CD1-CE2 3.99Å; I89-F138 HydrophobicContact CD1-CG 4.5Å; F92-F138 HydrophobicContact CB-CZ 4.39Å; F92-F138 HydrophobicContact CD1-CZ 4.35Å; F92-F138 AromaticContact CD2-CE1 3.72Å; F92-F138 HydrophobicContact CD2-CE1 3.72Å; F92-F138 AromaticContact CD2-CZ 3.67Å; F92-F138 HydrophobicContact CD2-CZ 3.67Å; F92-F138 AromaticContact CE2-CE1 3.61Å; F92-F138 HydrophobicContact CE2-CE1 3.61Å; F92-F138 AromaticContact CE2-CZ 3.92Å; F92-F138 HydrophobicContact CE2-CZ 3.92Å; F92-F138 HydrophobicContact CG-CE1 4.38Å; F92-F138 AromaticContact CG-CZ 3.88Å; F92-F138 HydrophobicContact CG-CZ 3.88Å; F92-F138 HydrophobicContact CZ-CE1 4.18Å; F92-F138 HydrophobicContact CZ-CZ 4.34Å; V128-F138 HydrophobicContact CG2-CB 4.4Å; V128-F138 HydrophobicContact CG2-CD2 3.41Å; V128-F138 VanDerWaalsContact CG2-CD2 3.41Å; V128-F138 HydrophobicContact CG2-CE2 4.05Å; V128-F138 HydrophobicContact CG2-CG 4.26Å; F138-V140 HydrophobicContact CD1-CG2 4.22Å; F138-V140 HydrophobicContact CE1-CB 4.34Å; F138-V140 HydrophobicContact CE1-CG2 3.34Å; F138-V140 HydrophobicContact CZ-CG2 3.54Å; F138-L154 HydrophobicContact CB-CD2 4.19Å; F138-L154 HydrophobicContact CD1-CD1 4.32Å; F138-L154 HydrophobicContact CD1-CD2 3.92Å; F138-L154 HydrophobicContact CD2-CD1 4.16Å; F138-L154 HydrophobicContact CD2-CD2 4.48Å; F138-L154 HydrophobicContact CE1-CD1 4.1Å; F138-L154 HydrophobicContact CE1-CD2 4.42Å; F138-L154 HydrophobicContact CE2-CD1 3.94Å; F138-L154 HydrophobicContact CG-CD1 4.36Å; F138-L154 HydrophobicContact CG-CD2 3.97Å; F138-L154 HydrophobicContact CZ-CD1 3.92Å; F138-A616 HydrophobicContact CD2-CB 4.14Å; F138-A616 HydrophobicContact CE2-CB 3.47Å; F138-A616 VanDerWaalsContact CE2-CB 3.47Å; F138-A616 HydrophobicContact CZ-CB 4.4Å
139	T	77	Confident	74.7	Confident	35 Å²	35	50.4 Å²	50.4	22%	0.215	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	129.9	175.5	-71.2	0	0	0	0	110.8	F79 D80 G126 L127 K137	F79-T139 CarbonylContact O-C 3.52Å; F79-T139 VanDerWaalsContact O-CA 3.29Å; F79-T139 WeakPolarHBondContact O-CA 3.47Å; D80-T139 WeakPolarHBondContact OD1-CB 3.48Å; D80-T139 WeakPolarHBondContact OD1-CG2 3.37Å; D80-T139 PolarHBondContact OD1-OG1 2.81Å; G126-T139 CarbonylContact C-O 3.39Å; G126-T139 WeakPolarHBondContact CA-O 3.38Å; L127-T139 PolarHBondContact N-O 2.71Å; L127-T139 PolarHBondContact O-N 3.37Å; L127-T139 VanDerWaalsContact O-O 3.12Å; K137-T139 VanDerWaalsContact CE-OG1 3.25Å; K137-T139 WeakPolarHBondContact CE-OG1 3.38Å
140	V	77.5	Confident	76.6	Confident	4 Å²	4	44.2 Å²	44.2	2%	0.024	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	117.7	168.4	177.2	0	0	0	0	108.2	S78 F79 F92 F138 F152	S78-V140 CarbonylContact C-O 3.57Å; S78-V140 WeakPolarHBondContact CA-O 3.42Å; F79-V140 PolarHBondContact N-O 2.86Å; F79-V140 PolarHBondContact O-N 3.29Å; F92-V140 HydrophobicContact CE1-CG1 4.34Å; F92-V140 HydrophobicContact CE1-CG2 4.12Å; F92-V140 HydrophobicContact CE2-CG2 4.38Å; F92-V140 HydrophobicContact CZ-CB 4.05Å; F92-V140 HydrophobicContact CZ-CG1 4.05Å; F92-V140 HydrophobicContact CZ-CG2 3.79Å; F138-V140 HydrophobicContact CD1-CG2 4.22Å; F138-V140 HydrophobicContact CE1-CB 4.34Å; F138-V140 HydrophobicContact CE1-CG2 3.34Å; F138-V140 HydrophobicContact CZ-CG2 3.54Å; V140-F152 HydrophobicContact CG1-CE1 4.45Å
141	S	73	Confident	78.9	Confident	26 Å²	26	42.5 Å²	42.5	18%	0.182	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	155.2	165.4	-77.8	0	0	0	0	109.8	E76 V77 T124	E76-S141 WeakPolarHBondContact OE1-CB 3.42Å; E76-S141 PolarHBondContact OE1-OG 2.85Å; V77-S141 CarbonylContact O-C 3.59Å; V77-S141 WeakPolarHBondContact O-CA 3.5Å; T124-S141 WeakPolarHBondContact CG2-O 3.21Å
142	V	76.3	Confident	81.3	Confident	11 Å²	11	41.1 Å²	41.1	7%	0.067	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	141.8	166.6	61.8	0	0	0	0	110.7	E76 V77 L94 I96 T124 V144 V150 F152	E76-V142 CarbonylContact C-O 3.59Å; E76-V142 WeakPolarHBondContact CA-O 3.3Å; V77-V142 PolarHBondContact N-O 2.95Å; V77-V142 PolarHBondContact O-N 2.86Å; L94-V142 HydrophobicContact CD1-CG1 4.31Å; L94-V142 HydrophobicContact CD2-CG2 4.38Å; I96-V142 HydrophobicContact CD1-CG2 3.92Å; T124-V142 HydrophobicContact CG2-CB 3.97Å; T124-V142 HydrophobicContact CG2-CG2 4.18Å; V142-V144 HydrophobicContact CG1-CG2 3.92Å; V142-V150 HydrophobicContact CG1-CG2 4.27Å; V142-F152 HydrophobicContact CG1-CE1 3.83Å; V142-F152 HydrophobicContact CG1-CZ 3.68Å
143	N	74.6	Confident	83	Confident	98 Å²	98	41.2 Å²	41.2	52%	0.524	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	118.9	174.9	-164.6	7.9	0	0	0	110.3	A74 K75	A74-N143 WeakPolarHBondContact CB-OD1 3.25Å; K75-N143 PolarHBondContact N-OD1 3.23Å; K75-N143 PolarHBondContact O-OD1 3.15Å
144	V	80	Confident	84.1	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.4	-174.9	-178.6	0	0	0	0	109	N69 A74 K75 V77 V142 V150	N69-V144 HydrophobicContact CB-CB 4.34Å; N69-V144 HydrophobicContact CB-CG1 3.95Å; N69-V144 PolarHBondContact ND2-O 2.96Å; A74-V144 CarbonylContact C-O 3.57Å; A74-V144 VanDerWaalsContact CA-O 3.28Å; A74-V144 WeakPolarHBondContact CA-O 3.41Å; K75-V144 PolarHBondContact N-O 2.78Å; K75-V144 PolarHBondContact O-N 3Å; V77-V144 HydrophobicContact CB-CG2 3.98Å; V77-V144 HydrophobicContact CG2-CB 3.92Å; V77-V144 HydrophobicContact CG2-CG2 3.53Å; V142-V144 HydrophobicContact CG1-CG2 3.92Å; V144-V150 HydrophobicContact CG2-CB 4.09Å; V144-V150 HydrophobicContact CG2-CG1 4.02Å
145	A	82.9	Confident	85	Confident	54 Å²	54	31.3 Å²	31.3	45%	0.446	19%	0.19	S	C	.	.			trans	-62.2	160	179.3	0	0	0	0	0	112.4	N69 G147 S148	N69-A145 WeakPolarHBondContact CB-O 3.24Å; N69-A145 PolarHBondContact ND2-O 2.91Å; N69-A145 VanDerWaalsContact ND2-O 3.13Å; A145-G147 PolarHBondContact O-N 3.25Å; A145-S148 WeakPolarHBondContact O-CB 3.44Å; A145-S148 PolarHBondContact O-N 2.76Å; A145-S148 VanDerWaalsContact O-N 3.17Å
146	A	88.2	Confident	85.6	Confident	49 Å²	49	31 Å²	31	41%	0.405	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	128.3	179.6	0	0	0	0	0	111.2	A71 D72 S148	A71-A146 VanDerWaalsContact O-CB 3.28Å; A71-A146 WeakPolarHBondContact O-CB 3.47Å; D72-A146 VanDerWaalsContact C-CB 3.49Å; A146-S148 PolarHBondContact O-N 2.79Å
147	G	87.4	Confident	86.3	Confident	55 Å²	55	30.8 Å²	30.8	57%	0.567	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.1	-9.4	-178.7	0	0	0	0	0	115.5	N69 A145	N69-G147 WeakPolarHBondContact O-CA 3.36Å; N69-G147 PolarHBondContact O-N 2.95Å; A145-G147 PolarHBondContact O-N 3.25Å
148	S	88.1	Confident	87	Confident	13 Å²	13	28.1 Å²	28.1	9%	0.091	18%	0.175	C	C	.	.			trans	-75.3	152.6	-177.4	-67.5	0	0	0	0	113	V68 N69 D97 A145 A146	V68-S148 WeakPolarHBondContact CA-O 3.25Å; N69-S148 PolarHBondContact N-O 2.77Å; D97-S148 VanDerWaalsContact OD1-CA 3.25Å; D97-S148 WeakPolarHBondContact OD1-CA 3.45Å; D97-S148 VanDerWaalsContact OD1-CB 3.31Å; D97-S148 WeakPolarHBondContact OD1-CB 3.48Å; D97-S148 WeakPolarHBondContact OD2-CB 3.5Å; D97-S148 PolarHBondContact OD2-OG 3.42Å; A145-S148 WeakPolarHBondContact O-CB 3.44Å; A145-S148 PolarHBondContact O-N 2.76Å; A145-S148 VanDerWaalsContact O-N 3.17Å; A146-S148 PolarHBondContact O-N 2.79Å
149	K	91.3	Very high	87.6	Confident	122 Å²	122	28.3 Å²	28.3	53%	0.53	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	141.7	176.8	-64.8	179.1	-176.1	175.2	0	110.5	A67 V68 I96 D97	A67-K149 WeakPolarHBondContact O-CA 3.25Å; V68-K149 HydrophobicContact CB-CG 4.2Å; V68-K149 HydrophobicContact CG2-CG 4.02Å; I96-K149 WeakPolarHBondContact CA-O 3.11Å; D97-K149 PolarHBondContact N-O 3.14Å; D97-K149 PolarHBondContact OD1-N 3.46Å
150	V	91	Very high	88.5	Confident	0 Å²	0	27 Å²	27	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	139.5	174.5	64	0	0	0	0	110.6	R66 A67 V77 L94 T95 I96 V142 V144 F152	R66-V150 WeakPolarHBondContact CA-O 3.35Å; A67-V150 HydrophobicContact CB-CG1 3.83Å; A67-V150 PolarHBondContact N-O 2.79Å; A67-V150 PolarHBondContact O-N 2.91Å; V77-V150 HydrophobicContact CB-CG1 4.35Å; V77-V150 HydrophobicContact CG1-CG1 3.98Å; V77-V150 HydrophobicContact CG2-CG1 4.4Å; L94-V150 HydrophobicContact CD1-CG2 3.48Å; L94-V150 VanDerWaalsContact CD1-CG2 3.48Å; T95-V150 CarbonylContact O-C 3.51Å; T95-V150 VanDerWaalsContact O-CA 3.27Å; T95-V150 WeakPolarHBondContact O-CA 3.49Å; I96-V150 HydrophobicContact CG1-CG2 4.09Å; V142-V150 HydrophobicContact CG1-CG2 4.27Å; V144-V150 HydrophobicContact CG2-CB 4.09Å; V144-V150 HydrophobicContact CG2-CG1 4.02Å; V150-F152 HydrophobicContact CB-CE2 4.31Å; V150-F152 HydrophobicContact CG1-CE2 3.65Å; V150-F152 HydrophobicContact CG1-CZ 4.09Å; V150-F152 HydrophobicContact CG2-CD2 4.23Å; V150-F152 HydrophobicContact CG2-CE1 4.08Å; V150-F152 HydrophobicContact CG2-CE2 3.67Å; V150-F152 HydrophobicContact CG2-CZ 3.6Å
151	T	94.5	Very high	89.3	Confident	28 Å²	28	31.4 Å²	31.4	17%	0.172	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.3	171.3	-57.5	0	0	0	0	108.8	T64 T65 R66 T95	T64-T151 HydrophobicContact CG2-CG2 3.98Å; T65-T151 CarbonylContact O-C 3.57Å; T65-T151 WeakPolarHBondContact O-CA 3.46Å; R66-T151 HydrophobicContact CG-CG2 3.86Å; T95-T151 PolarHBondContact N-O 2.86Å; T95-T151 PolarHBondContact O-N 3.35Å
152	F	92.9	Very high	90.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.4	172.3	-53.9	-89.8	0	0	0	108	T64 T65 V77 F79 F92 L94 V140 V142 V150	T64-F152 CarbonylContact C-O 3.56Å; T64-F152 VanDerWaalsContact CA-O 3.3Å; T64-F152 WeakPolarHBondContact CA-O 3.34Å; T65-F152 PolarHBondContact N-O 2.95Å; T65-F152 PolarHBondContact O-N 2.98Å; V77-F152 HydrophobicContact CB-CZ 4.41Å; V77-F152 HydrophobicContact CG1-CE2 3.8Å; V77-F152 HydrophobicContact CG1-CZ 4Å; F79-F152 HydrophobicContact CB-CB 4.1Å; F79-F152 HydrophobicContact CB-CD1 3.64Å; F79-F152 HydrophobicContact CB-CD2 3.92Å; F79-F152 HydrophobicContact CB-CE1 3.93Å; F79-F152 HydrophobicContact CB-CE2 4.2Å; F79-F152 HydrophobicContact CB-CG 3.62Å; F79-F152 HydrophobicContact CB-CZ 4.19Å; F79-F152 HydrophobicContact CD1-CB 4.11Å; F79-F152 HydrophobicContact CD1-CG 4.49Å; F79-F152 HydrophobicContact CD2-CB 3.5Å; F79-F152 HydrophobicContact CD2-CD2 4.14Å; F79-F152 AromaticContact CD2-CG 3.88Å; F79-F152 HydrophobicContact CD2-CG 3.88Å; F79-F152 HydrophobicContact CE1-CB 4.39Å; F79-F152 HydrophobicContact CE2-CB 3.81Å; F79-F152 HydrophobicContact CG-CB 3.64Å; F79-F152 HydrophobicContact CG-CD1 4.07Å; F79-F152 HydrophobicContact CG-CD2 4.28Å; F79-F152 AromaticContact CG-CG 3.76Å; F79-F152 HydrophobicContact CG-CG 3.76Å; F79-F152 HydrophobicContact CZ-CB 4.22Å; F92-F152 HydrophobicContact CE2-CB 4.33Å; F92-F152 HydrophobicContact CE2-CD1 4.44Å; F92-F152 HydrophobicContact CZ-CD1 4Å; L94-F152 HydrophobicContact CD1-CD1 3.63Å; L94-F152 HydrophobicContact CD1-CE1 3.5Å; L94-F152 VanDerWaalsContact CD1-CE1 3.5Å; L94-F152 HydrophobicContact CD1-CG 4.48Å; L94-F152 HydrophobicContact CD1-CZ 4.26Å; V140-F152 HydrophobicContact CG1-CE1 4.45Å; V142-F152 HydrophobicContact CG1-CE1 3.83Å; V142-F152 HydrophobicContact CG1-CZ 3.68Å; V150-F152 HydrophobicContact CB-CE2 4.31Å; V150-F152 HydrophobicContact CG1-CE2 3.65Å; V150-F152 HydrophobicContact CG1-CZ 4.09Å; V150-F152 HydrophobicContact CG2-CD2 4.23Å; V150-F152 HydrophobicContact CG2-CE1 4.08Å; V150-F152 HydrophobicContact CG2-CE2 3.67Å; V150-F152 HydrophobicContact CG2-CZ 3.6Å
153	E	95.1	Very high	90.8	Very high	65 Å²	65	34.5 Å²	34.5	30%	0.304	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	118.2	174.9	-173.5	-178.6	84	0	0	108.6	V62 V63 F92 T93	V62-E153 HydrophobicContact CG1-CG 3.82Å; V63-E153 CarbonylContact O-C 3.49Å; V63-E153 VanDerWaalsContact O-CA 3.32Å; V63-E153 WeakPolarHBondContact O-CA 3.31Å; F92-E153 CarbonylContact C-O 3.54Å; F92-E153 VanDerWaalsContact CA-O 3.23Å; F92-E153 WeakPolarHBondContact CA-O 3.33Å; F92-E153 VanDerWaalsContact CD2-O 3.28Å; F92-E153 WeakPolarHBondContact CD2-O 3.49Å; T93-E153 PolarHBondContact N-O 3.19Å; T93-E153 PolarHBondContact O-N 3.31Å; T93-E153 WeakPolarHBondContact OG1-CB 3.25Å
154	L	94.4	Very high	91.4	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	128.4	177.9	177.8	68.2	0	0	0	109.1	V62 V63 F79 V81 L83 I89 F92 F138 Y156	V62-L154 CarbonylContact C-O 3.58Å; V62-L154 WeakPolarHBondContact CA-O 3.44Å; V63-L154 PolarHBondContact N-O 2.83Å; V63-L154 PolarHBondContact O-N 3.08Å; F79-L154 HydrophobicContact CE1-CB 3.8Å; F79-L154 HydrophobicContact CE1-CD2 4.23Å; F79-L154 HydrophobicContact CZ-CB 3.9Å; V81-L154 HydrophobicContact CB-CD2 3.95Å; V81-L154 HydrophobicContact CG1-CD2 4.01Å; V81-L154 HydrophobicContact CG2-CD2 4.24Å; L83-L154 HydrophobicContact CD2-CD2 4.29Å; I89-L154 HydrophobicContact CG1-CD1 4.43Å; I89-L154 HydrophobicContact CG2-CD1 3.67Å; F92-L154 HydrophobicContact CB-CD1 4.21Å; F92-L154 HydrophobicContact CD2-CB 4.1Å; F92-L154 HydrophobicContact CD2-CD1 4.06Å; F138-L154 HydrophobicContact CB-CD2 4.19Å; F138-L154 HydrophobicContact CD1-CD1 4.32Å; F138-L154 HydrophobicContact CD1-CD2 3.92Å; F138-L154 HydrophobicContact CD2-CD1 4.16Å; F138-L154 HydrophobicContact CD2-CD2 4.48Å; F138-L154 HydrophobicContact CE1-CD1 4.1Å; F138-L154 HydrophobicContact CE1-CD2 4.42Å; F138-L154 HydrophobicContact CE2-CD1 3.94Å; F138-L154 HydrophobicContact CG-CD1 4.36Å; F138-L154 HydrophobicContact CG-CD2 3.97Å; F138-L154 HydrophobicContact CZ-CD1 3.92Å; L154-Y156 HydrophobicContact CD2-CD1 4.3Å; L154-Y156 HydrophobicContact CG-CD1 4.32Å
155	T	94.6	Very high	91.9	Very high	10 Å²	10	36.6 Å²	36.6	6%	0.061	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.9	173.4	-48.6	0	0	0	0	109.9	H60 N61 V62 T90 N91	H60-T155 WeakPolarHBondContact CE1-CG2 3.36Å; N61-T155 CarbonylContact O-C 3.57Å; N61-T155 VanDerWaalsContact O-CA 3.26Å; N61-T155 WeakPolarHBondContact O-CA 3.3Å; V62-T155 HydrophobicContact CG2-CG2 4.13Å; T90-T155 PolarHBondContact N-O 3.44Å; T90-T155 VanDerWaalsContact OG1-CG2 3.27Å; T90-T155 WeakPolarHBondContact OG1-CG2 3.37Å; T90-T155 PolarHBondContact OG1-O 3.06Å; N91-T155 PolarHBondContact N-O 3.15Å; N91-T155 PolarHBondContact O-N 2.95Å
156	Y	95.2	Very high	92.5	Very high	3 Å²	3	38.1 Å²	38.1	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	151.1	173.1	61	-88.9	0	0	0	110.8	N61 V63 L83 A87 F88 L154 L171	N61-Y156 HydrophobicContact CB-CD1 4.14Å; N61-Y156 HydrophobicContact CB-CD2 3.81Å; N61-Y156 HydrophobicContact CB-CE1 3.79Å; N61-Y156 HydrophobicContact CB-CE2 3.42Å; N61-Y156 VanDerWaalsContact CB-CE2 3.42Å; N61-Y156 HydrophobicContact CB-CG 4.16Å; N61-Y156 WeakPolarHBondContact CB-O 3.2Å; N61-Y156 PolarHBondContact N-O 3.17Å; N61-Y156 WeakPolarHBondContact ND2-CE2 3.44Å; N61-Y156 PolarHBondContact O-N 3.06Å; V63-Y156 HydrophobicContact CG2-CE1 3.86Å; L83-Y156 HydrophobicContact CB-CD1 4.45Å; L83-Y156 HydrophobicContact CB-CD2 4.28Å; L83-Y156 HydrophobicContact CB-CE1 4.32Å; L83-Y156 HydrophobicContact CB-CE2 4.14Å; L83-Y156 HydrophobicContact CB-CG 4.42Å; A87-Y156 HydrophobicContact CB-CD2 3.74Å; A87-Y156 HydrophobicContact CB-CG 4.47Å; F88-Y156 CarbonylContact O-C 3.45Å; F88-Y156 VanDerWaalsContact O-CA 3.28Å; F88-Y156 WeakPolarHBondContact O-CA 3.46Å; F88-Y156 WeakPolarHBondContact O-CB 3.47Å; L154-Y156 HydrophobicContact CD2-CD1 4.3Å; L154-Y156 HydrophobicContact CG-CD1 4.32Å; Y156-L171 WeakPolarHBondContact OH-CD2 3.24Å
157	E	95.3	Very high	92.9	Very high	5 Å²	5	35.8 Å²	35.8	2%	0.023	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	145.1	-175.3	-62	178.6	158.7	0	0	110.8	F58 A59 H60 A87 F88 T90 R556 F594	F58-E157 HydrophobicContact CE1-CB 4.34Å; F58-E157 HydrophobicContact CE2-CB 4.33Å; F58-E157 HydrophobicContact CZ-CB 3.75Å; F58-E157 HydrophobicContact CZ-CG 4.43Å; A59-E157 WeakPolarHBondContact O-CA 3.49Å; H60-E157 HydrophobicContact CB-CG 4.41Å; H60-E157 IonicContact CE1-OE1 3.93Å; H60-E157 IonicContact CG-OE1 2.64Å; H60-E157 IonicContact ND1-OE1 2.64Å; H60-E157 PolarHBondContact ND1-OE1 3.02Å; A87-E157 CarbonylContact C-O 3.57Å; A87-E157 VanDerWaalsContact CA-O 3.29Å; A87-E157 WeakPolarHBondContact CA-O 3.41Å; F88-E157 PolarHBondContact N-O 2.74Å; F88-E157 PolarHBondContact O-N 3.2Å; T90-E157 HydrophobicContact CG2-CB 4.21Å; T90-E157 HydrophobicContact CG2-CG 3.86Å; T90-E157 WeakPolarHBondContact CG2-OE2 3.46Å; E157-R556 VanDerWaalsContact CD-NE 3.34Å; E157-R556 IonicContact OE1-CZ 3.06Å; E157-R556 IonicContact OE1-NE 3.76Å; E157-R556 PolarHBondContact OE1-NE 2.73Å; E157-R556 VanDerWaalsContact OE1-NE 3.12Å; E157-R556 IonicContact OE1-NH2 3.97Å; E157-R556 IonicContact OE2-CZ 3.76Å; E157-R556 IonicContact OE2-NE 3.23Å; E157-R556 PolarHBondContact OE2-NE 2.89Å; E157-R556 IonicContact OE2-NH2 3.58Å; E157-R556 PolarHBondContact OE2-NH2 2.83Å; E157-F594 HydrophobicContact CB-CE1 4.36Å; E157-F594 VanDerWaalsContact OE2-CE1 3.31Å; E157-F594 WeakPolarHBondContact OE2-CE1 3.26Å
158	E	94.7	Very high	93.2	Very high	9 Å²	9	38.3 Å²	38.3	4%	0.042	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	152.6	175.1	68.4	-177.3	143.2	0	0	111.8	F58 A59 P84 T86 A87 L160	F58-E158 VanDerWaalsContact CD2-O 3.31Å; F58-E158 WeakPolarHBondContact CD2-O 3.33Å; A59-E158 HydrophobicContact CB-CG 4.02Å; A59-E158 PolarHBondContact N-O 3.34Å; A59-E158 PolarHBondContact O-N 3.47Å; P84-E158 WeakPolarHBondContact CB-OE2 3.08Å; T86-E158 PolarHBondContact OG1-OE2 3.47Å; A87-E158 HydrophobicContact CB-CB 3.98Å; E158-L160 HydrophobicContact CG-CD2 4.09Å
159	L	95.8	Very high	93.5	Very high	6 Å²	6	37.8 Å²	37.8	3%	0.031	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	117.2	166.1	-178.8	65.2	0	0	0	109.1	R57 F58 K161 V502 L557 Y560 L561	R57-L159 HydrophobicContact CB-CD1 3.92Å; F58-L159 HydrophobicContact CD2-CB 4.2Å; F58-L159 HydrophobicContact CD2-CD1 4.44Å; L159-K161 PolarHBondContact O-N 2.85Å; L159-V502 HydrophobicContact CD2-CG1 4.42Å; L159-L557 HydrophobicContact CD1-CD1 3.89Å; L159-L557 HydrophobicContact CD1-CG 4.08Å; L159-Y560 HydrophobicContact CB-CD1 3.79Å; L159-Y560 HydrophobicContact CB-CE1 3.53Å; L159-L561 HydrophobicContact CD2-CD1 3.86Å; L159-L561 HydrophobicContact CD2-CD2 3.44Å; L159-L561 VanDerWaalsContact CD2-CD2 3.44Å; L159-L561 HydrophobicContact CD2-CG 3.69Å
160	L	96.2	Very high	93.6	Very high	7 Å²	7	34.3 Å²	34.3	4%	0.037	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-67.1	125.4	177.7	-59.2	178.8	0	0	0	109.9	V54 R57 A59 E158 Y167 M169 Y252	V54-L160 HydrophobicContact CG1-CD1 3.82Å; V54-L160 HydrophobicContact CG2-CD1 4.4Å; R57-L160 HydrophobicContact CB-CB 4.49Å; R57-L160 WeakPolarHBondContact O-CB 3.44Å; R57-L160 WeakPolarHBondContact O-CG 3.3Å; R57-L160 PolarHBondContact O-N 3.29Å; A59-L160 HydrophobicContact CB-CD1 4.43Å; A59-L160 HydrophobicContact CB-CD2 4.24Å; A59-L160 HydrophobicContact CB-CG 4.19Å; E158-L160 HydrophobicContact CG-CD2 4.09Å; L160-Y167 HydrophobicContact CB-CD1 4.15Å; L160-M169 HydrophobicContact CD1-CB 4.3Å; L160-M169 HydrophobicContact CD2-CB 4.07Å; L160-M169 HydrophobicContact CD2-CG 4.36Å; L160-Y252 HydrophobicContact CD1-CE1 3.67Å
161	K	93.1	Very high	93.7	Very high	97 Å²	97	34.4 Å²	34.4	42%	0.422	16%	0.16	S	C	.	.	P	Polyproline II helix	trans	-93.2	135.1	178.3	-64.6	-176.6	-178	177.9	0	109.9	L159 H163 E564	L159-K161 PolarHBondContact O-N 2.85Å; K161-H163 WeakPolarHBondContact CB-NE2 3.34Å; K161-H163 PolarHBondContact O-CD2 3.07Å; K161-E564 IonicContact NZ-OE2 3.36Å
162	R	93.6	Very high	93.6	Very high	25 Å²	25	35.7 Å²	35.7	9%	0.094	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	121.5	177.3	-163.5	174.3	179.3	-108.7	1.8	110	G165 K166 Y167 D253 R256 S499 E500	R162-G165 VanDerWaalsContact CZ-CA 3.5Å; R162-G165 PolarHBondContact NE-O 3.09Å; R162-G165 PolarHBondContact NH2-O 2.89Å; R162-K166 WeakPolarHBondContact CA-O 3.46Å; R162-Y167 HydrophobicContact CB-CD1 3.92Å; R162-Y167 HydrophobicContact CB-CE1 3.55Å; R162-Y167 HydrophobicContact CG-CD1 4.4Å; R162-Y167 HydrophobicContact CG-CE1 4.1Å; R162-D253 IonicContact CZ-OD1 2.84Å; R162-D253 IonicContact CZ-OD2 3.6Å; R162-D253 IonicContact NE-OD1 3.74Å; R162-D253 PolarHBondContact NE-OD1 3.27Å; R162-D253 VanDerWaalsContact NE-OD1 3.17Å; R162-D253 IonicContact NE-OD2 3.83Å; R162-D253 PolarHBondContact NE-OD2 3.46Å; R162-D253 IonicContact NH2-OD1 3.13Å; R162-D253 IonicContact NH2-OD2 2.71Å; R162-D253 PolarHBondContact NH2-OD2 2.82Å; R162-R256 VanDerWaalsContact NE-NH2 3.1Å; R162-S499 PolarHBondContact NH1-O 2.97Å; R162-E500 HydrophobicContact CB-CB 3.92Å
163	H	87.9	Confident	93.5	Very high	78 Å²	78	35.8 Å²	35.8	36%	0.361	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	138.8	175.9	-65	-75.4	0	0	0	109.4	K161 G165 K166 E466	K161-H163 WeakPolarHBondContact CB-NE2 3.34Å; K161-H163 PolarHBondContact O-CD2 3.07Å; H163-G165 PolarHBondContact O-N 2.93Å; H163-K166 PolarHBondContact N-O 2.69Å; H163-K166 PolarHBondContact O-N 3.04Å; H163-E466 IonicContact CE1-OE1 3Å; H163-E466 IonicContact ND1-OE1 3.16Å
164	K	87.6	Confident	93.3	Very high	128 Å²	128	37.7 Å²	37.7	56%	0.557	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	35.3	-179.9	-53.3	-172.4	-176.3	-167.9	0	113.3	E465 G498	K164-E465 WeakPolarHBondContact CE-OE2 3.47Å; K164-E465 IonicContact NZ-OE2 2.98Å; K164-E465 PolarHBondContact NZ-OE2 3.11Å; K164-G498 PolarHBondContact N-O 2.77Å
165	G	91.1	Very high	92.9	Very high	15 Å²	15	38.9 Å²	38.9	16%	0.155	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	9.2	177.2	0	0	0	0	0	115.6	R162 H163 D253 G498	R162-G165 VanDerWaalsContact CZ-CA 3.5Å; R162-G165 PolarHBondContact NE-O 3.09Å; R162-G165 PolarHBondContact NH2-O 2.89Å; H163-G165 PolarHBondContact O-N 2.93Å; G165-D253 VanDerWaalsContact O-CG 3.29Å; G165-G498 VanDerWaalsContact N-CA 3.33Å; G165-G498 PolarHBondContact N-O 3.09Å
166	K	94.9	Very high	92.4	Very high	86 Å²	86	45.4 Å²	45.4	37%	0.374	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	154.1	-177.9	-57.7	179	-175.6	178.9	0	111.4	R162 H163 M196	R162-K166 WeakPolarHBondContact CA-O 3.46Å; H163-K166 PolarHBondContact N-O 2.69Å; H163-K166 PolarHBondContact O-N 3.04Å; K166-M196 HydrophobicContact CD-CE 3.77Å; K166-M196 HydrophobicContact CD-SD 4.09Å; K166-M196 HydrophobicContact CG-CE 4.34Å; K166-M196 HydrophobicContact CG-SD 4.16Å
167	Y	96.6	Very high	92	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	137.8	162.8	-52.6	-81.2	0	0	0	108.6	R57 L160 R162 T251 Y252 D253 V254 R256 E500	R57-Y167 HydrophobicContact CB-CE1 4.38Å; R57-Y167 HydrophobicContact CG-CD1 3.93Å; R57-Y167 HydrophobicContact CG-CE1 3.35Å; R57-Y167 HydrophobicContact CG-CE2 4.17Å; R57-Y167 PolarHBondContact NE-OH 3.49Å; R57-Y167 PolarHBondContact NH2-OH 2.94Å; L160-Y167 HydrophobicContact CB-CD1 4.15Å; R162-Y167 HydrophobicContact CB-CD1 3.92Å; R162-Y167 HydrophobicContact CB-CE1 3.55Å; R162-Y167 HydrophobicContact CG-CD1 4.4Å; R162-Y167 HydrophobicContact CG-CE1 4.1Å; Y167-T251 VanDerWaalsContact O-CA 3.3Å; Y167-T251 WeakPolarHBondContact O-CA 3.22Å; Y167-Y252 HydrophobicContact CD2-CD2 4.06Å; Y167-Y252 HydrophobicContact CD2-CE1 4.22Å; Y167-Y252 AromaticContact CD2-CE2 3.7Å; Y167-Y252 HydrophobicContact CD2-CE2 3.7Å; Y167-Y252 HydrophobicContact CD2-CG 4.46Å; Y167-Y252 AromaticContact CD2-CZ 3.8Å; Y167-Y252 WeakPolarHBondContact CD2-O 3.42Å; Y167-Y252 HydrophobicContact CE2-CE2 4.24Å; Y167-Y252 HydrophobicContact CG-CE1 4.21Å; Y167-Y252 HydrophobicContact CG-CE2 4.42Å; Y167-Y252 PolarHBondContact N-O 2.84Å; Y167-Y252 PolarHBondContact O-N 2.91Å; Y167-Y252 VanDerWaalsContact O-N 3.1Å; Y167-D253 WeakPolarHBondContact CE2-OD1 3.43Å; Y167-V254 HydrophobicContact CE2-CG1 4.37Å; Y167-R256 PolarHBondContact OH-NH2 3.16Å; Y167-E500 PolarHBondContact OH-OE1 3.34Å; Y167-E500 PolarHBondContact OH-OE2 2.97Å
168	E	94.3	Very high	91.7	Very high	107 Å²	107	46.6 Å²	46.6	50%	0.5	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119.8	174.7	-60	-170.4	162.5	0	0	109	T251	E168-T251 HydrophobicContact CG-CG2 4Å
169	M	94.4	Very high	91.6	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	122.9	168.8	-178.6	-174.7	170.8	0	0	108.3	S52 V54 N61 L160 L171 V186 T249 I250	S52-M169 WeakPolarHBondContact OG-CE 3.4Å; V54-M169 HydrophobicContact CG2-SD 4.04Å; N61-M169 WeakPolarHBondContact OD1-CE 3.13Å; L160-M169 HydrophobicContact CD1-CB 4.3Å; L160-M169 HydrophobicContact CD2-CB 4.07Å; L160-M169 HydrophobicContact CD2-CG 4.36Å; M169-L171 HydrophobicContact CE-CD1 4.04Å; M169-L171 HydrophobicContact CE-CD2 3.77Å; M169-L171 HydrophobicContact CE-CG 4Å; M169-V186 HydrophobicContact SD-CG1 4.28Å; M169-T249 WeakPolarHBondContact O-CA 3.31Å; M169-I250 HydrophobicContact CB-CB 4.31Å; M169-I250 PolarHBondContact N-O 2.84Å; M169-I250 PolarHBondContact O-N 2.76Å; M169-I250 HydrophobicContact SD-CD1 4.35Å
170	Y	92.1	Very high	91.4	Very high	50 Å²	50	50.1 Å²	50.1	20%	0.196	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	125.1	-171.8	-179.3	-81.2	0	0	0	111.2	L135 K172 D247	L135-Y170 HydrophobicContact CD1-CE1 3.58Å; L135-Y170 HydrophobicContact CD2-CD1 3.63Å; L135-Y170 HydrophobicContact CD2-CE1 3.51Å; L135-Y170 HydrophobicContact CG-CE1 3.98Å; Y170-K172 HydrophobicContact CE1-CB 4.44Å; Y170-D247 HydrophobicContact CE2-CB 3.73Å; Y170-D247 WeakPolarHBondContact CE2-OD2 3.28Å; Y170-D247 PolarHBondContact OH-OD1 2.63Å; Y170-D247 PolarHBondContact OH-OD2 2.96Å
171	L	93.1	Very high	91.3	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	124.3	178.5	-63.4	174.4	0	0	0	110.2	I50 Y156 M169 I184 F248	I50-L171 HydrophobicContact CG2-CD1 4.1Å; I50-L171 HydrophobicContact CG2-CD2 4.31Å; Y156-L171 WeakPolarHBondContact OH-CD2 3.24Å; M169-L171 HydrophobicContact CE-CD1 4.04Å; M169-L171 HydrophobicContact CE-CD2 3.77Å; M169-L171 HydrophobicContact CE-CG 4Å; L171-I184 HydrophobicContact CD1-CG2 3.94Å; L171-F248 HydrophobicContact CB-CB 4.25Å; L171-F248 HydrophobicContact CD1-CD1 4.35Å; L171-F248 PolarHBondContact N-O 3.37Å; L171-F248 PolarHBondContact O-N 3.48Å
172	K	92.4	Very high	91.5	Very high	54 Å²	54	51.5 Å²	51.5	24%	0.235	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	126.4	172.7	-168.5	75.1	177.7	-179.9	0	110.8	E82 L135 Y170 D247	E82-K172 HydrophobicContact CB-CB 3.83Å; E82-K172 HydrophobicContact CB-CG 4.07Å; E82-K172 HydrophobicContact CG-CG 4.39Å; E82-K172 WeakPolarHBondContact OE2-CG 3.4Å; L135-K172 HydrophobicContact CD1-CB 4.23Å; L135-K172 HydrophobicContact CD1-CD 4.18Å; L135-K172 HydrophobicContact CD1-CG 4.45Å; Y170-K172 HydrophobicContact CE1-CB 4.44Å; K172-D247 WeakPolarHBondContact CD-OD1 3.39Å; K172-D247 IonicContact NZ-OD1 3.21Å; K172-D247 PolarHBondContact NZ-OD1 3.14Å
173	V	92.3	Very high	91.6	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	108.9	179.7	-179.1	0	0	0	0	109.6	F182 I184 F203 L244 N245 G246 F248	V173-F182 HydrophobicContact CG1-CE1 4.29Å; V173-F182 HydrophobicContact CG1-CE2 4.19Å; V173-F182 HydrophobicContact CG1-CZ 3.54Å; V173-F182 HydrophobicContact CG2-CZ 4.49Å; V173-I184 HydrophobicContact CG2-CD1 3.72Å; V173-F203 HydrophobicContact CB-CE1 3.72Å; V173-F203 HydrophobicContact CB-CZ 3.99Å; V173-F203 HydrophobicContact CG1-CE1 4.2Å; V173-F203 HydrophobicContact CG1-CZ 4.08Å; V173-F203 HydrophobicContact CG2-CE1 4.12Å; V173-F203 HydrophobicContact CG2-CZ 4.16Å; V173-L244 HydrophobicContact CG1-CB 4.01Å; V173-N245 CarbonylContact O-C 3.57Å; V173-N245 VanDerWaalsContact O-CA 3.25Å; V173-N245 WeakPolarHBondContact O-CA 3.27Å; V173-G246 PolarHBondContact N-O 2.95Å; V173-G246 PolarHBondContact O-N 2.91Å; V173-F248 HydrophobicContact CG2-CB 3.88Å
174	Q	89	Confident	92.1	Very high	106 Å²	106	48.5 Å²	48.5	50%	0.495	22%	0.223	S	C	.	.			trans	-147.8	62.9	178.7	-165.8	177	-13.6	0	0	113	K176 N245	Q174-K176 PolarHBondContact O-N 3.38Å; Q174-N245 WeakPolarHBondContact CG-OD1 3.38Å
175	P	86.8	Confident	92.6	Very high	25 Å²	25	43.2 Å²	43.2	16%	0.162	20%	0.201	C	C	.	.			trans	-59.8	130.8	169.8	27.7	-38.8	0	0	0	111.9	Q177 I179 L244	P175-Q177 PolarHBondContact O-N 3.14Å; P175-I179 HydrophobicContact CB-CD1 3.41Å; P175-I179 VanDerWaalsContact CB-CD1 3.41Å; P175-I179 HydrophobicContact CB-CG1 4.21Å; P175-I179 HydrophobicContact CG-CD1 4.37Å; P175-L244 WeakPolarHBondContact CD-O 3.46Å; P175-L244 HydrophobicContact CG-CB 3.56Å; P175-L244 HydrophobicContact CG-CD1 4.1Å; P175-L244 HydrophobicContact CG-CG 4.44Å
176	K	83.7	Confident	92.9	Very high	146 Å²	146	42.5 Å²	42.5	64%	0.635	19%	0.194	S	C	*	.	S	Bend	trans	-76	-4.6	179.7	-61.4	179.6	-175.3	169.4	0	114.1	D80 Q174	D80-K176 WeakPolarHBondContact OD2-CE 3.44Å; D80-K176 IonicContact OD2-NZ 3.76Å; D80-K176 PolarHBondContact OD2-NZ 3.25Å; Q174-K176 PolarHBondContact O-N 3.38Å
177	Q	87	Confident	92.9	Very high	25 Å²	25	39.6 Å²	39.6	12%	0.117	18%	0.182	C	C	.	.	S	Bend	trans	-153.5	166.3	-179.9	64.1	-170	-36.6	0	0	110.4	G38 A40 V43 V45 P175	G38-Q177 PolarHBondContact O-OE1 3.3Å; A40-Q177 HydrophobicContact CB-CB 4.36Å; V43-Q177 PolarHBondContact O-OE1 2.91Å; V45-Q177 HydrophobicContact CB-CG 4.23Å; P175-Q177 PolarHBondContact O-N 3.14Å
178	L	90.1	Very high	92.8	Very high	9 Å²	9	39.6 Å²	39.6	5%	0.047	18%	0.183	C	C	.	.			trans	-65.6	136.2	171.5	-64.7	170.3	0	0	0	110.7	L230 Q233 R234 T240	L178-L230 HydrophobicContact CB-CD2 4.03Å; L178-Q233 HydrophobicContact CD2-CB 3.77Å; L178-R234 HydrophobicContact CD1-CG 3.99Å; L178-R234 HydrophobicContact CD2-CG 4.16Å; L178-T240 WeakPolarHBondContact CG-O 3.43Å
179	I	92.3	Very high	92.7	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.021	16%	0.159	C	C	.	.			trans	-119.6	124.5	-173.8	-61.5	173.8	0	0	0	109.7	V45 T48 P175 H181 F182 L230 Q233	V45-I179 HydrophobicContact CG1-CD1 4.04Å; V45-I179 HydrophobicContact CG1-CG1 4.09Å; T48-I179 WeakPolarHBondContact OG1-CD1 3.29Å; P175-I179 HydrophobicContact CB-CD1 3.41Å; P175-I179 VanDerWaalsContact CB-CD1 3.41Å; P175-I179 HydrophobicContact CB-CG1 4.21Å; P175-I179 HydrophobicContact CG-CD1 4.37Å; I179-H181 VanDerWaalsContact C-N 3.3Å; I179-H181 PolarHBondContact O-N 3.21Å; I179-F182 HydrophobicContact CB-CB 4.29Å; I179-F182 HydrophobicContact CD1-CD2 4.04Å; I179-F182 HydrophobicContact CG2-CB 4.27Å; I179-L230 WeakPolarHBondContact O-CD2 3.26Å; I179-Q233 VanDerWaalsContact N-OE1 3.07Å; I179-Q233 PolarHBondContact O-NE2 3.39Å; I179-Q233 PolarHBondContact O-OE1 3.05Å
180	K	91.1	Very high	92.6	Very high	84 Å²	84	34.5 Å²	34.5	37%	0.365	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-40.6	-177.4	-59.5	-173	165.2	159.3	0	112.8	E44 Y46 L230	E44-K180 WeakPolarHBondContact OE1-CE 3.31Å; E44-K180 IonicContact OE1-NZ 2.67Å; E44-K180 PolarHBondContact OE1-NZ 3.44Å; Y46-K180 WeakPolarHBondContact O-CB 3.46Å; K180-L230 HydrophobicContact CG-CD1 4.16Å; K180-L230 HydrophobicContact CG-CD2 4.46Å
181	H	94.8	Very high	92.4	Very high	123 Å²	123	32.9 Å²	32.9	57%	0.569	15%	0.154	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-125.9	83.2	179.3	-57.2	-61.4	0	0	0	109.9	Y46 S47 T48 I179	Y46-H181 PolarHBondContact O-N 3.33Å; Y46-H181 VanDerWaalsContact O-N 3.09Å; S47-H181 VanDerWaalsContact CA-O 3.28Å; S47-H181 WeakPolarHBondContact CA-O 3.35Å; S47-H181 PolarHBondContact OG-O 3.36Å; T48-H181 PolarHBondContact N-O 2.85Å; I179-H181 VanDerWaalsContact C-N 3.3Å; I179-H181 PolarHBondContact O-N 3.21Å
182	F	95.9	Very high	92.2	Very high	10 Å²	10	34.5 Å²	34.5	4%	0.044	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	130.3	170.7	-171.3	-90.2	0	0	0	110	T48 V173 I179 I184 F226 P228 L244	T48-F182 HydrophobicContact CG2-CD2 4.26Å; T48-F182 HydrophobicContact CG2-CE2 4.05Å; T48-F182 WeakPolarHBondContact O-CA 2.97Å; V173-F182 HydrophobicContact CG1-CE1 4.29Å; V173-F182 HydrophobicContact CG1-CE2 4.19Å; V173-F182 HydrophobicContact CG1-CZ 3.54Å; V173-F182 HydrophobicContact CG2-CZ 4.49Å; I179-F182 HydrophobicContact CB-CB 4.29Å; I179-F182 HydrophobicContact CD1-CD2 4.04Å; I179-F182 HydrophobicContact CG2-CB 4.27Å; F182-I184 HydrophobicContact CE1-CD1 3.97Å; F182-I184 HydrophobicContact CE1-CG1 3.77Å; F182-I184 HydrophobicContact CZ-CD1 4.15Å; F182-I184 HydrophobicContact CZ-CG1 4.07Å; F182-F226 HydrophobicContact CD1-CD1 4.28Å; F182-F226 HydrophobicContact CD1-CE1 4.17Å; F182-F226 AromaticContact CE1-CD1 3.89Å; F182-F226 HydrophobicContact CE1-CD1 3.89Å; F182-F226 AromaticContact CE1-CE1 3.86Å; F182-F226 HydrophobicContact CE1-CE1 3.86Å; F182-P228 HydrophobicContact CB-CG 4.43Å; F182-P228 HydrophobicContact CD1-CG 3.88Å; F182-L244 HydrophobicContact CB-CD1 4.47Å; F182-L244 HydrophobicContact CD1-CD1 3.75Å; F182-L244 HydrophobicContact CD2-CD1 4.07Å; F182-L244 HydrophobicContact CE1-CD1 3.95Å; F182-L244 HydrophobicContact CE2-CD1 4.26Å; F182-L244 HydrophobicContact CG-CD1 3.81Å; F182-L244 HydrophobicContact CZ-CD1 4.22Å
183	E	96.8	Very high	92.2	Very high	40 Å²	40	32.1 Å²	32.1	19%	0.187	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	130.6	-177.4	173.8	173	-170.3	0	0	110.9	T48 K49 I50 D185 F226 K227	T48-E183 PolarHBondContact O-N 3.5Å; K49-E183 CarbonylContact C-O 3.5Å; K49-E183 VanDerWaalsContact CA-O 3.3Å; K49-E183 WeakPolarHBondContact CA-O 3.35Å; K49-E183 HydrophobicContact CD-CG 4.39Å; K49-E183 WeakPolarHBondContact CD-OE2 3.42Å; K49-E183 VanDerWaalsContact CE-CD 3.5Å; K49-E183 WeakPolarHBondContact CE-OE2 3.46Å; K49-E183 HydrophobicContact CG-CB 4.22Å; K49-E183 HydrophobicContact CG-CG 4.19Å; K49-E183 IonicContact NZ-OE1 3.47Å; K49-E183 PolarHBondContact NZ-OE1 2.89Å; K49-E183 IonicContact NZ-OE2 3.7Å; K49-E183 PolarHBondContact NZ-OE2 2.9Å; I50-E183 PolarHBondContact N-O 2.89Å; E183-D185 HydrophobicContact CG-CB 4.09Å; E183-F226 WeakPolarHBondContact CA-O 3.35Å; E183-K227 HydrophobicContact CB-CG 4.3Å; E183-K227 HydrophobicContact CG-CD 4.08Å; E183-K227 HydrophobicContact CG-CG 3.94Å; E183-K227 WeakPolarHBondContact OE1-CE 3.21Å; E183-K227 IonicContact OE1-NZ 2.74Å; E183-K227 PolarHBondContact OE1-NZ 3.05Å
184	I	97.6	Very high	92.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	127.4	160.9	-53.1	177.3	0	0	0	106.5	I50 L171 V173 F182 V186 S225 F226 F248	I50-I184 HydrophobicContact CB-CG1 4.27Å; I50-I184 HydrophobicContact CB-CG2 4.36Å; I50-I184 HydrophobicContact CD1-CD1 4.39Å; I50-I184 HydrophobicContact CD1-CG1 4.19Å; I50-I184 HydrophobicContact CG1-CG1 4.48Å; I50-I184 WeakPolarHBondContact O-CA 3.47Å; L171-I184 HydrophobicContact CD1-CG2 3.94Å; V173-I184 HydrophobicContact CG2-CD1 3.72Å; F182-I184 HydrophobicContact CE1-CD1 3.97Å; F182-I184 HydrophobicContact CE1-CG1 3.77Å; F182-I184 HydrophobicContact CZ-CD1 4.15Å; F182-I184 HydrophobicContact CZ-CG1 4.07Å; I184-V186 HydrophobicContact CG2-CG2 4.05Å; I184-S225 CarbonylContact O-C 3.49Å; I184-S225 WeakPolarHBondContact O-CA 3.31Å; I184-F226 HydrophobicContact CB-CB 4.21Å; I184-F226 HydrophobicContact CD1-CD1 4.06Å; I184-F226 HydrophobicContact CG1-CD1 4.3Å; I184-F226 PolarHBondContact N-O 3.33Å; I184-F226 PolarHBondContact O-N 3.35Å; I184-F248 HydrophobicContact CD1-CB 4.42Å; I184-F248 HydrophobicContact CD1-CD1 4.34Å; I184-F248 HydrophobicContact CD1-CD2 3.85Å; I184-F248 HydrophobicContact CD1-CE2 4.17Å; I184-F248 HydrophobicContact CD1-CG 3.95Å; I184-F248 HydrophobicContact CG2-CE1 4.27Å
185	D	97.5	Very high	92.7	Very high	18 Å²	18	29.7 Å²	29.7	10%	0.096	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	111.9	-173.8	-164.1	-99.8	0	0	0	108.1	I50 N51 S52 E183 H223 K227	I50-D185 PolarHBondContact O-N 2.78Å; N51-D185 CarbonylContact C-O 3.53Å; N51-D185 VanDerWaalsContact CA-O 3.29Å; N51-D185 WeakPolarHBondContact CA-O 3.41Å; N51-D185 PolarHBondContact ND2-O 2.81Å; N51-D185 PolarHBondContact ND2-OD1 3.1Å; S52-D185 PolarHBondContact N-O 3.29Å; E183-D185 HydrophobicContact CG-CB 4.09Å; D185-H223 IonicContact OD1-CE1 2.7Å; D185-H223 IonicContact OD2-CE1 2.75Å; D185-H223 PolarHBondContact OD2-CE1 3.06Å; D185-H223 IonicContact OD2-NE2 2.78Å; D185-K227 WeakPolarHBondContact OD2-CE 3.48Å; D185-K227 IonicContact OD2-NZ 2.68Å; D185-K227 PolarHBondContact OD2-NZ 2.79Å
186	V	97.4	Very high	93.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	120.4	-172.2	-177.3	0	0	0	0	110.1	S52 V54 M169 I184 I188 H223 V224 I250	S52-V186 CarbonylContact O-C 3.47Å; S52-V186 VanDerWaalsContact O-CA 3.3Å; S52-V186 WeakPolarHBondContact O-CA 3.46Å; V54-V186 HydrophobicContact CG2-CG1 4.45Å; M169-V186 HydrophobicContact SD-CG1 4.28Å; I184-V186 HydrophobicContact CG2-CG2 4.05Å; V186-I188 HydrophobicContact CG1-CG1 4.05Å; V186-H223 CarbonylContact O-C 3.48Å; V186-H223 WeakPolarHBondContact O-CA 3.35Å; V186-V224 HydrophobicContact CB-CB 4.28Å; V186-V224 PolarHBondContact N-O 3.26Å; V186-V224 PolarHBondContact O-N 2.78Å; V186-I250 HydrophobicContact CB-CD1 3.84Å; V186-I250 HydrophobicContact CG1-CD1 3.87Å; V186-I250 HydrophobicContact CG2-CD1 3.45Å; V186-I250 VanDerWaalsContact CG2-CD1 3.45Å
187	D	95.8	Very high	93.8	Very high	24 Å²	24	25 Å²	25	13%	0.128	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	124.7	174.9	-69.8	-44.2	0	0	0	109.6	S52 K53 V54 H223 Y548	S52-D187 PolarHBondContact O-N 3.24Å; K53-D187 CarbonylContact C-O 3.59Å; K53-D187 WeakPolarHBondContact CA-O 3.39Å; V54-D187 PolarHBondContact N-O 3.1Å; D187-H223 IonicContact OD1-CE1 2.66Å; D187-H223 IonicContact OD1-CG 3.7Å; D187-H223 IonicContact OD1-ND1 2.74Å; D187-H223 PolarHBondContact OD1-ND1 3.34Å; D187-Y548 HydrophobicContact CB-CD1 4.03Å; D187-Y548 HydrophobicContact CB-CE1 4.21Å
188	I	95.5	Very high	94.3	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	128.4	-179.5	-54.1	175.7	0	0	0	108.6	V54 V186 E190 I194 L197 K221 G222 I250 Y252	V54-I188 HydrophobicContact CB-CB 4.41Å; V54-I188 HydrophobicContact CB-CG1 4.15Å; V54-I188 HydrophobicContact CB-CG2 4.22Å; V54-I188 HydrophobicContact CG1-CG2 4.39Å; V54-I188 HydrophobicContact CG2-CG1 4.27Å; V54-I188 CarbonylContact O-C 3.54Å; V54-I188 WeakPolarHBondContact O-CA 3.43Å; V186-I188 HydrophobicContact CG1-CG1 4.05Å; I188-E190 HydrophobicContact CG2-CG 4.08Å; I188-I194 HydrophobicContact CB-CD1 4.13Å; I188-I194 HydrophobicContact CG2-CD1 3.84Å; I188-L197 HydrophobicContact CD1-CD1 3.64Å; I188-K221 CarbonylContact O-C 3.54Å; I188-K221 WeakPolarHBondContact O-CA 3.33Å; I188-G222 PolarHBondContact N-O 3.07Å; I188-G222 PolarHBondContact O-N 3.4Å; I188-I250 HydrophobicContact CD1-CG2 4.2Å; I188-Y252 HydrophobicContact CD1-CD1 4.14Å; I188-Y252 HydrophobicContact CD1-CG 4.38Å; I188-Y252 HydrophobicContact CG2-CD2 4.35Å; I188-Y252 HydrophobicContact CG2-CE2 4.1Å
189	F	92.1	Very high	94.5	Very high	1 Å²	1	25.9 Å²	25.9	0%	0.004	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	118.7	174	-178.4	-93.9	0	0	0	111.1	V54 T55 S56 P191 K220 K221 L543 I549	V54-F189 PolarHBondContact O-N 3.03Å; T55-F189 WeakPolarHBondContact CA-O 3.29Å; T55-F189 HydrophobicContact CG2-CD1 4.11Å; S56-F189 PolarHBondContact N-O 2.89Å; F189-P191 HydrophobicContact CE1-CG 4.05Å; F189-K220 VanDerWaalsContact CA-O 3.31Å; F189-K220 WeakPolarHBondContact CA-O 3.29Å; F189-K220 HydrophobicContact CD2-CB 4.21Å; F189-K220 HydrophobicContact CE2-CB 3.92Å; F189-K220 HydrophobicContact CE2-CD 4.35Å; F189-K220 HydrophobicContact CZ-CD 4.33Å; F189-K221 HydrophobicContact CD2-CG 4.08Å; F189-L543 HydrophobicContact CE1-CD2 4.21Å; F189-I549 HydrophobicContact CD1-CD1 4.39Å; F189-I549 HydrophobicContact CD1-CG1 4.06Å; F189-I549 HydrophobicContact CE1-CD1 3.98Å; F189-I549 HydrophobicContact CE1-CG1 4.16Å; F189-I549 HydrophobicContact CZ-CD1 4.36Å
190	E	92.2	Very high	94.5	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.			trans	-126.8	115.8	-179.3	-69	-66.7	172.2	0	0	110.2	S56 R57 I188 Q192 G193 I194 K220 Y252 V254	S56-E190 WeakPolarHBondContact CA-OE2 3.32Å; R57-E190 WeakPolarHBondContact CD-OE2 3.37Å; R57-E190 IonicContact CZ-OE2 2.72Å; R57-E190 PolarHBondContact N-OE1 3.5Å; R57-E190 IonicContact NE-OE2 2.67Å; R57-E190 IonicContact NH1-OE2 2.7Å; R57-E190 PolarHBondContact NH1-OE2 3.42Å; I188-E190 HydrophobicContact CG2-CG 4.08Å; E190-Q192 PolarHBondContact O-N 3.48Å; E190-Q192 VanDerWaalsContact O-N 3.14Å; E190-G193 PolarHBondContact O-N 3.42Å; E190-I194 HydrophobicContact CB-CG1 4.1Å; E190-I194 HydrophobicContact CG-CG1 4.22Å; E190-K220 PolarHBondContact N-O 2.86Å; E190-K220 VanDerWaalsContact O-CB 3.3Å; E190-K220 WeakPolarHBondContact O-CB 3.32Å; E190-K220 WeakPolarHBondContact O-CG 3.46Å; E190-Y252 HydrophobicContact CG-CE2 3.77Å; E190-Y252 WeakPolarHBondContact OE1-CE2 3.09Å; E190-Y252 PolarHBondContact OE1-OH 2.93Å; E190-V254 HydrophobicContact CB-CG1 3.77Å; E190-V254 HydrophobicContact CG-CG1 3.62Å
191	P	86.8	Confident	94.5	Very high	16 Å²	16	28.6 Å²	28.6	10%	0.104	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-31.9	-177.8	-31	38	0	0	0	114.6	S56 F189 G193 K220 L543	S56-P191 VanDerWaalsContact OG-CD 3.24Å; S56-P191 WeakPolarHBondContact OG-CD 3.31Å; S56-P191 WeakPolarHBondContact OG-CG 3.36Å; F189-P191 HydrophobicContact CE1-CG 4.05Å; P191-G193 VanDerWaalsContact C-N 3.26Å; P191-G193 PolarHBondContact O-N 2.96Å; P191-K220 WeakPolarHBondContact O-CE 3.47Å; P191-K220 PolarHBondContact O-NZ 2.76Å; P191-L543 HydrophobicContact CG-CD2 4.47Å
192	Q	88.6	Confident	94.3	Very high	37 Å²	37	26.6 Å²	26.6	17%	0.173	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-12.7	177	-66.5	176.2	-85.8	0	0	113.3	E190 V254 N255 N261	E190-Q192 PolarHBondContact O-N 3.48Å; E190-Q192 VanDerWaalsContact O-N 3.14Å; Q192-V254 HydrophobicContact CB-CB 4.3Å; Q192-N255 PolarHBondContact NE2-O 3.04Å; Q192-N255 WeakPolarHBondContact O-CB 3.35Å; Q192-N255 PolarHBondContact O-ND2 3.37Å; Q192-N261 HydrophobicContact CG-CB 4.12Å
193	G	92.1	Very high	93.9	Very high	4 Å²	4	26.5 Å²	26.5	4%	0.041	15%	0.148	C	C	.	.			trans	87.5	150.1	-169.1	0	0	0	0	0	112.5	E190 P191 G219 V254 N255	E190-G193 PolarHBondContact O-N 3.42Å; P191-G193 VanDerWaalsContact C-N 3.26Å; P191-G193 PolarHBondContact O-N 2.96Å; G193-G219 CarbonylContact C-O 3.59Å; G193-G219 VanDerWaalsContact CA-O 3.28Å; G193-G219 WeakPolarHBondContact CA-O 3.47Å; G193-V254 CarbonylContact O-C 3.58Å; G193-V254 WeakPolarHBondContact O-CA 3.16Å; G193-V254 WeakPolarHBondContact O-CB 3.32Å; G193-N255 PolarHBondContact O-N 3.3Å
194	I	95.8	Very high	93.3	Very high	7 Å²	7	26.9 Å²	26.9	4%	0.036	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.6	179.2	-59.4	175.7	0	0	0	108.3	I188 E190 M196 L197 F217 G219 G222	I188-I194 HydrophobicContact CB-CD1 4.13Å; I188-I194 HydrophobicContact CG2-CD1 3.84Å; E190-I194 HydrophobicContact CB-CG1 4.1Å; E190-I194 HydrophobicContact CG-CG1 4.22Å; I194-M196 VanDerWaalsContact CG2-O 3.24Å; I194-M196 WeakPolarHBondContact CG2-O 3.36Å; I194-L197 HydrophobicContact CG2-CB 4.28Å; I194-F217 HydrophobicContact CB-CD2 3.96Å; I194-F217 HydrophobicContact CD1-CB 4.41Å; I194-F217 HydrophobicContact CG2-CB 4.34Å; I194-F217 HydrophobicContact CG2-CD2 3.75Å; I194-F217 HydrophobicContact CG2-CE2 4.27Å; I194-F217 HydrophobicContact CG2-CG 4.13Å; I194-F217 WeakPolarHBondContact O-CE2 3.48Å; I194-G219 PolarHBondContact N-O 3.43Å; I194-G222 VanDerWaalsContact CD1-N 3.26Å
195	S	96.2	Very high	92.5	Very high	50 Å²	50	31.7 Å²	31.7	35%	0.35	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-34.2	179.7	59.6	0	0	0	0	112.2	D253 V254 N255	S195-D253 PolarHBondContact N-O 2.92Å; S195-D253 PolarHBondContact OG-O 2.99Å; S195-D253 VanDerWaalsContact OG-O 3.11Å; S195-V254 PolarHBondContact OG-O 3.44Å; S195-V254 VanDerWaalsContact OG-O 3.07Å; S195-N255 WeakPolarHBondContact CA-OD1 3.15Å; S195-N255 VanDerWaalsContact CB-OD1 3.25Å; S195-N255 WeakPolarHBondContact CB-OD1 3.41Å
196	M	96.7	Very high	91.5	Very high	56 Å²	56	33.9 Å²	33.9	28%	0.276	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	150.5	175.2	59.4	166.3	-77.7	0	0	110.7	K166 I194 Y252 D253	K166-M196 HydrophobicContact CD-CE 3.77Å; K166-M196 HydrophobicContact CD-SD 4.09Å; K166-M196 HydrophobicContact CG-CE 4.34Å; K166-M196 HydrophobicContact CG-SD 4.16Å; I194-M196 VanDerWaalsContact CG2-O 3.24Å; I194-M196 WeakPolarHBondContact CG2-O 3.36Å; M196-Y252 VanDerWaalsContact O-CA 3.23Å; M196-Y252 WeakPolarHBondContact O-CA 3.42Å; M196-Y252 VanDerWaalsContact O-CB 3.23Å; M196-Y252 WeakPolarHBondContact O-CB 3.46Å; M196-D253 HydrophobicContact CG-CB 4.1Å; M196-D253 PolarHBondContact O-N 2.77Å
197	L	97.6	Very high	90.6	Very high	17 Å²	17	41.3 Å²	41.3	9%	0.089	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	127.7	171.9	176	62.8	0	0	0	109.3	I188 I194 F217 V224 I250 T251	I188-L197 HydrophobicContact CD1-CD1 3.64Å; I194-L197 HydrophobicContact CG2-CB 4.28Å; L197-F217 HydrophobicContact CB-CB 4.27Å; L197-F217 HydrophobicContact CB-CD1 3.65Å; L197-F217 HydrophobicContact CB-CE1 4.2Å; L197-F217 HydrophobicContact CB-CG 4.05Å; L197-F217 HydrophobicContact CD2-CB 3.95Å; L197-F217 HydrophobicContact CD2-CD1 4.44Å; L197-V224 HydrophobicContact CD1-CG2 4.06Å; L197-V224 HydrophobicContact CD2-CG2 3.96Å; L197-V224 HydrophobicContact CG-CG2 4.23Å; L197-I250 HydrophobicContact CD1-CG2 3.82Å; L197-T251 CarbonylContact C-O 3.45Å
198	D	96.6	Very high	89.6	Confident	47 Å²	47	45.3 Å²	45.3	25%	0.251	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	157	174	-151.1	-4.9	0	0	0	111.4	K215 I250 T251	D198-K215 IonicContact OD1-NZ 3.1Å; D198-K215 PolarHBondContact OD1-NZ 2.94Å; D198-I250 WeakPolarHBondContact O-CA 3.38Å; D198-T251 PolarHBondContact N-O 2.83Å; D198-T251 PolarHBondContact O-N 3.12Å
199	A	95.1	Very high	88.7	Confident	5 Å²	5	45.3 Å²	45.3	4%	0.041	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	127	175.2	0	0	0	0	0	108.9	L213 V224 T249 I250	A199-L213 HydrophobicContact CB-CD1 4.24Å; A199-L213 HydrophobicContact CB-CD2 4.27Å; A199-L213 WeakPolarHBondContact O-CD2 3.33Å; A199-V224 HydrophobicContact CB-CG1 3.69Å; A199-V224 HydrophobicContact CB-CG2 4.35Å; A199-T249 WeakPolarHBondContact CA-O 3.39Å; A199-I250 HydrophobicContact CB-CG1 4.34Å
200	E	92.8	Very high	88.2	Confident	131 Å²	131	46.5 Å²	46.5	61%	0.612	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130	148	-179.6	-63.7	-173.6	167.5	0	0	109.4	T249	E200-T249 PolarHBondContact N-O 2.88Å; E200-T249 PolarHBondContact O-N 3.39Å
201	A	91.3	Very high	88	Confident	14 Å²	14	50.2 Å²	50.2	12%	0.116	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	129.5	172.5	0	0	0	0	0	111.3	F203 I204 D247 F248	A201-F203 HydrophobicContact CB-CD1 4.3Å; A201-F203 HydrophobicContact CB-CD2 4.39Å; A201-F203 HydrophobicContact CB-CE1 3.85Å; A201-F203 HydrophobicContact CB-CE2 3.95Å; A201-F203 HydrophobicContact CB-CZ 3.67Å; A201-F203 PolarHBondContact O-N 2.69Å; A201-F203 VanDerWaalsContact O-N 3.08Å; A201-I204 HydrophobicContact CB-CD1 3.7Å; A201-I204 HydrophobicContact CB-CG1 3.87Å; A201-I204 PolarHBondContact O-N 3.01Å; A201-D247 CarbonylContact C-O 3.48Å; A201-D247 WeakPolarHBondContact CA-O 3.46Å; A201-F248 HydrophobicContact CB-CB 4.44Å; A201-F248 HydrophobicContact CB-CD2 3.65Å; A201-F248 HydrophobicContact CB-CE2 4.29Å; A201-F248 HydrophobicContact CB-CG 4.34Å
202	S	90.3	Very high	88.2	Confident	80 Å²	80	50 Å²	50	56%	0.559	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-20	-172.5	72.3	0	0	0	0	113.5	G246 D247	S202-G246 WeakPolarHBondContact OG-CA 3.17Å; S202-D247 PolarHBondContact N-O 2.97Å; S202-D247 PolarHBondContact OG-N 3.5Å
203	F	87.5	Confident	88.5	Confident	9 Å²	9	49.9 Å²	49.9	4%	0.039	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-6.1	179.9	53.6	-97.9	0	0	0	113.9	V173 A201 T205 L209 F226 L243 L244 F248	V173-F203 HydrophobicContact CB-CE1 3.72Å; V173-F203 HydrophobicContact CB-CZ 3.99Å; V173-F203 HydrophobicContact CG1-CE1 4.2Å; V173-F203 HydrophobicContact CG1-CZ 4.08Å; V173-F203 HydrophobicContact CG2-CE1 4.12Å; V173-F203 HydrophobicContact CG2-CZ 4.16Å; A201-F203 HydrophobicContact CB-CD1 4.3Å; A201-F203 HydrophobicContact CB-CD2 4.39Å; A201-F203 HydrophobicContact CB-CE1 3.85Å; A201-F203 HydrophobicContact CB-CE2 3.95Å; A201-F203 HydrophobicContact CB-CZ 3.67Å; A201-F203 PolarHBondContact O-N 2.69Å; A201-F203 VanDerWaalsContact O-N 3.08Å; F203-T205 PolarHBondContact O-N 3Å; F203-L209 HydrophobicContact CD2-CD2 4.23Å; F203-F226 HydrophobicContact CE2-CE1 4.04Å; F203-F226 AromaticContact CE2-CZ 3.93Å; F203-F226 HydrophobicContact CE2-CZ 3.93Å; F203-F226 HydrophobicContact CZ-CE1 4.39Å; F203-L243 VanDerWaalsContact CB-O 3.27Å; F203-L243 WeakPolarHBondContact CB-O 3.46Å; F203-L244 HydrophobicContact CD2-CD2 3.82Å; F203-L244 HydrophobicContact CE2-CD2 3.52Å; F203-L244 HydrophobicContact CZ-CD2 4.34Å; F203-F248 HydrophobicContact CE1-CB 4.48Å; F203-F248 HydrophobicContact CZ-CD2 4.15Å
204	I	84.8	Confident	88.7	Confident	47 Å²	47	53 Å²	53	24%	0.241	31%	0.31	C	S	.	.			trans	-75	93.9	171.7	-65.7	173.3	0	0	0	107.9	A201 L209 L213 F226	A201-I204 HydrophobicContact CB-CD1 3.7Å; A201-I204 HydrophobicContact CB-CG1 3.87Å; A201-I204 PolarHBondContact O-N 3.01Å; I204-L209 HydrophobicContact CG1-CD2 4.39Å; I204-L209 HydrophobicContact CG1-CG 4.23Å; I204-L213 HydrophobicContact CD1-CB 4.4Å; I204-L213 HydrophobicContact CD1-CD2 4.07Å; I204-F226 HydrophobicContact CD1-CE2 4.33Å
205	T	79.3	Confident	88.7	Confident	102 Å²	102	57.9 Å²	57.9	63%	0.626	33%	0.33	S	S	*	.			trans	-104.4	-5.9	-175.6	51.8	0	0	0	0	113.4	F203	F203-T205 PolarHBondContact O-N 3Å
206	N	77.1	Confident	88.7	Confident	64 Å²	64	59 Å²	59	34%	0.342	34%	0.338	S	S	.	.	S	Bend	trans	-148.2	158.2	-179.3	65.2	58.9	0	0	0	112.1	L208 L209 G210	N206-L208 PolarHBondContact O-N 2.62Å; N206-L208 WeakPolarHBondContact OD1-CB 3.35Å; N206-L208 PolarHBondContact OD1-N 2.67Å; N206-L208 VanDerWaalsContact OD1-N 3.16Å; N206-L209 PolarHBondContact O-N 2.9Å; N206-L209 WeakPolarHBondContact OD1-CB 3.42Å; N206-L209 PolarHBondContact OD1-N 3.09Å; N206-G210 PolarHBondContact O-N 3.25Å
207	D	79	Confident	88.7	Confident	156 Å²	156	60.7 Å²	60.7	83%	0.834	34%	0.344	S	S	*	.	H	α-helix	trans	-63.1	-29.1	-178.3	-61.6	-21.5	0	0	0	112.9	G210 S211	D207-G210 PolarHBondContact O-N 3.39Å; D207-S211 WeakPolarHBondContact O-CB 3.05Å; D207-S211 PolarHBondContact O-N 3.25Å
208	L	74.3	Confident	88.5	Confident	108 Å²	108	64.7 Å²	64.7	57%	0.565	37%	0.373	S	S	*	.	H	α-helix	trans	-66.4	-43.7	-179	-179	65.6	0	0	0	111.2	N206 S211 Q232	N206-L208 PolarHBondContact O-N 2.62Å; N206-L208 WeakPolarHBondContact OD1-CB 3.35Å; N206-L208 PolarHBondContact OD1-N 2.67Å; N206-L208 VanDerWaalsContact OD1-N 3.16Å; L208-S211 PolarHBondContact O-OG 2.98Å; L208-Q232 HydrophobicContact CD1-CG 4.38Å; L208-Q232 HydrophobicContact CG-CG 4.07Å; L208-Q232 PolarHBondContact O-NE2 3.09Å
209	L	77.4	Confident	88.3	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-74.4	-35.8	173.5	-172.7	56.9	0	0	0	111.1	F203 I204 N206 S211 A212 F226 P228 Q232 L243 L244	F203-L209 HydrophobicContact CD2-CD2 4.23Å; I204-L209 HydrophobicContact CG1-CD2 4.39Å; I204-L209 HydrophobicContact CG1-CG 4.23Å; N206-L209 PolarHBondContact O-N 2.9Å; N206-L209 WeakPolarHBondContact OD1-CB 3.42Å; N206-L209 PolarHBondContact OD1-N 3.09Å; L209-S211 VanDerWaalsContact C-N 3.27Å; L209-S211 PolarHBondContact O-N 3.03Å; L209-A212 WeakPolarHBondContact O-CB 3.23Å; L209-A212 PolarHBondContact O-N 2.8Å; L209-A212 VanDerWaalsContact O-N 3.13Å; L209-F226 HydrophobicContact CD1-CE2 4.14Å; L209-F226 HydrophobicContact CD1-CZ 3.87Å; L209-F226 HydrophobicContact CG-CZ 4.41Å; L209-P228 HydrophobicContact CD1-CB 3.85Å; L209-Q232 HydrophobicContact CD1-CB 4.11Å; L209-L243 HydrophobicContact CD2-CB 4.36Å; L209-L244 HydrophobicContact CD1-CD2 4.37Å; L209-L244 HydrophobicContact CD2-CD2 4.49Å
210	G	79.9	Confident	88.1	Confident	26 Å²	26	68.3 Å²	68.3	27%	0.268	40%	0.399	S	S	.	.	H	α-helix	trans	-59.7	-34.5	174.6	0	0	0	0	0	113.4	N206 D207 A212 L213	N206-G210 PolarHBondContact O-N 3.25Å; D207-G210 PolarHBondContact O-N 3.39Å; G210-A212 PolarHBondContact O-N 2.84Å; G210-A212 VanDerWaalsContact O-N 3.15Å; G210-L213 WeakPolarHBondContact O-CB 3.27Å; G210-L213 PolarHBondContact O-N 2.82Å
211	S	88.9	Confident	88.2	Confident	78 Å²	78	65.2 Å²	65.2	55%	0.545	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-16.3	177	73	0	0	0	0	114.4	D207 L208 L209 L213 Q232	D207-S211 WeakPolarHBondContact O-CB 3.05Å; D207-S211 PolarHBondContact O-N 3.25Å; L208-S211 PolarHBondContact O-OG 2.98Å; L209-S211 VanDerWaalsContact C-N 3.27Å; L209-S211 PolarHBondContact O-N 3.03Å; S211-L213 VanDerWaalsContact C-N 3.32Å; S211-Q232 PolarHBondContact OG-NE2 2.77Å
212	A	91.2	Very high	88.4	Confident	11 Å²	11	64.6 Å²	64.6	9%	0.091	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-13.3	174.9	0	0	0	0	0	113.1	L209 G210 F226 K227 P228	L209-A212 WeakPolarHBondContact O-CB 3.23Å; L209-A212 PolarHBondContact O-N 2.8Å; L209-A212 VanDerWaalsContact O-N 3.13Å; G210-A212 PolarHBondContact O-N 2.84Å; G210-A212 VanDerWaalsContact O-N 3.15Å; A212-F226 HydrophobicContact CB-CD2 4.08Å; A212-F226 HydrophobicContact CB-CE2 3.91Å; A212-F226 WeakPolarHBondContact O-CA 3.34Å; A212-K227 PolarHBondContact O-N 3Å; A212-K227 VanDerWaalsContact O-N 3.16Å; A212-P228 HydrophobicContact CB-CB 3.97Å
213	L	94.9	Very high	88.7	Confident	35 Å²	35	63.2 Å²	63.2	18%	0.183	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	124.1	177.1	-179.8	62.2	0	0	0	110.1	A199 I204 G210 S211 V224 F226 F248	A199-L213 HydrophobicContact CB-CD1 4.24Å; A199-L213 HydrophobicContact CB-CD2 4.27Å; A199-L213 WeakPolarHBondContact O-CD2 3.33Å; I204-L213 HydrophobicContact CD1-CB 4.4Å; I204-L213 HydrophobicContact CD1-CD2 4.07Å; G210-L213 WeakPolarHBondContact O-CB 3.27Å; G210-L213 PolarHBondContact O-N 2.82Å; S211-L213 VanDerWaalsContact C-N 3.32Å; L213-V224 HydrophobicContact CD1-CG1 3.95Å; L213-F226 HydrophobicContact CB-CD2 4Å; L213-F226 HydrophobicContact CD1-CB 4.04Å; L213-F226 HydrophobicContact CD1-CD2 4.46Å; L213-F248 HydrophobicContact CD1-CE2 4Å; L213-F248 HydrophobicContact CD1-CZ 3.69Å
214	T	95.9	Very high	89.2	Confident	71 Å²	71	62.8 Å²	62.8	44%	0.436	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	134.9	176.8	52.9	0	0	0	0	108.9	V224 S225	T214-V224 WeakPolarHBondContact O-CA 3.48Å; T214-S225 PolarHBondContact N-O 2.89Å; T214-S225 PolarHBondContact O-N 3.1Å; T214-S225 WeakPolarHBondContact OG1-CB 3.2Å; T214-S225 PolarHBondContact OG1-O 3.22Å; T214-S225 PolarHBondContact OG1-OG 2.77Å
215	K	95.3	Very high	89.8	Confident	109 Å²	109	61.2 Å²	61.2	47%	0.474	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	136.5	177.3	63.2	-171.6	178.4	-167.7	0	109.4	D198 H223 V224	D198-K215 IonicContact OD1-NZ 3.1Å; D198-K215 PolarHBondContact OD1-NZ 2.94Å; K215-H223 WeakPolarHBondContact CA-O 3.41Å; K215-V224 HydrophobicContact CB-CG2 4.35Å
216	S	96.3	Very high	90.7	Very high	72 Å²	72	56.3 Å²	56.3	50%	0.503	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	146.3	177.1	62.4	0	0	0	0	109.8	G222 H223	S216-G222 CarbonylContact O-C 3.57Å; S216-G222 WeakPolarHBondContact O-CA 3.23Å; S216-H223 PolarHBondContact N-O 2.88Å; S216-H223 PolarHBondContact O-N 3.48Å
217	F	96.5	Very high	91.6	Very high	93 Å²	93	57.8 Å²	57.8	41%	0.408	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	150.6	170.5	70.5	-78.5	0	0	0	110.1	I194 L197 K221	I194-F217 HydrophobicContact CB-CD2 3.96Å; I194-F217 HydrophobicContact CD1-CB 4.41Å; I194-F217 HydrophobicContact CG2-CB 4.34Å; I194-F217 HydrophobicContact CG2-CD2 3.75Å; I194-F217 HydrophobicContact CG2-CE2 4.27Å; I194-F217 HydrophobicContact CG2-CG 4.13Å; I194-F217 WeakPolarHBondContact O-CE2 3.48Å; L197-F217 HydrophobicContact CB-CB 4.27Å; L197-F217 HydrophobicContact CB-CD1 3.65Å; L197-F217 HydrophobicContact CB-CE1 4.2Å; L197-F217 HydrophobicContact CB-CG 4.05Å; L197-F217 HydrophobicContact CD2-CB 3.95Å; L197-F217 HydrophobicContact CD2-CD1 4.44Å; F217-K221 CarbonylContact C-O 3.6Å; F217-K221 WeakPolarHBondContact CA-O 3.47Å; F217-K221 WeakPolarHBondContact CB-O 3.23Å
218	S	94.2	Very high	92.3	Very high	100 Å²	100	50.6 Å²	50.6	70%	0.699	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-153.6	122.7	176.3	-172.3	0	0	0	0	109.9	K220 K221	S218-K220 PolarHBondContact O-N 2.93Å; S218-K221 PolarHBondContact N-O 3.03Å; S218-K221 PolarHBondContact O-N 2.79Å; S218-K221 VanDerWaalsContact O-N 3.08Å
219	G	92.6	Very high	93.1	Very high	48 Å²	48	48.1 Å²	48.1	50%	0.495	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	-113.5	-177.9	0	0	0	0	0	111.2	G193 I194	G193-G219 CarbonylContact C-O 3.59Å; G193-G219 VanDerWaalsContact CA-O 3.28Å; G193-G219 WeakPolarHBondContact CA-O 3.47Å; I194-G219 PolarHBondContact N-O 3.43Å
220	K	91.1	Very high	93.7	Very high	80 Å²	80	50.4 Å²	50.4	35%	0.348	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-11	-176.6	-58.3	-175.6	-178	-167.9	0	114.5	F189 E190 P191 S218	F189-K220 VanDerWaalsContact CA-O 3.31Å; F189-K220 WeakPolarHBondContact CA-O 3.29Å; F189-K220 HydrophobicContact CD2-CB 4.21Å; F189-K220 HydrophobicContact CE2-CB 3.92Å; F189-K220 HydrophobicContact CE2-CD 4.35Å; F189-K220 HydrophobicContact CZ-CD 4.33Å; E190-K220 PolarHBondContact N-O 2.86Å; E190-K220 VanDerWaalsContact O-CB 3.3Å; E190-K220 WeakPolarHBondContact O-CB 3.32Å; E190-K220 WeakPolarHBondContact O-CG 3.46Å; P191-K220 WeakPolarHBondContact O-CE 3.47Å; P191-K220 PolarHBondContact O-NZ 2.76Å; S218-K220 PolarHBondContact O-N 2.93Å
221	K	93.7	Very high	94.1	Very high	66 Å²	66	54.5 Å²	54.5	29%	0.287	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131.2	-169.3	-67.5	176.4	-178.5	170.7	0	111.4	I188 F189 F217 S218 E545 Y548	I188-K221 CarbonylContact O-C 3.54Å; I188-K221 WeakPolarHBondContact O-CA 3.33Å; F189-K221 HydrophobicContact CD2-CG 4.08Å; F217-K221 CarbonylContact C-O 3.6Å; F217-K221 WeakPolarHBondContact CA-O 3.47Å; F217-K221 WeakPolarHBondContact CB-O 3.23Å; S218-K221 PolarHBondContact N-O 3.03Å; S218-K221 PolarHBondContact O-N 2.79Å; S218-K221 VanDerWaalsContact O-N 3.08Å; K221-E545 WeakPolarHBondContact CE-OE2 3.43Å; K221-E545 IonicContact NZ-OE2 2.68Å; K221-E545 PolarHBondContact NZ-OE2 2.52Å; K221-Y548 HydrophobicContact CD-CD2 3.9Å; K221-Y548 HydrophobicContact CD-CE1 4.35Å; K221-Y548 HydrophobicContact CD-CE2 3.69Å; K221-Y548 HydrophobicContact CD-CG 4.3Å; K221-Y548 VanDerWaalsContact CE-CD2 3.48Å; K221-Y548 HydrophobicContact CG-CD1 4.49Å; K221-Y548 HydrophobicContact CG-CG 4.5Å
222	G	95.6	Very high	94.1	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	146.3	171.3	0	0	0	0	0	109.8	I188 I194 S216	I188-G222 PolarHBondContact N-O 3.07Å; I188-G222 PolarHBondContact O-N 3.4Å; I194-G222 VanDerWaalsContact CD1-N 3.26Å; S216-G222 CarbonylContact O-C 3.57Å; S216-G222 WeakPolarHBondContact O-CA 3.23Å
223	H	97.6	Very high	94	Very high	52 Å²	52	51.8 Å²	51.8	24%	0.241	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	127.8	176.3	-175.1	74.3	0	0	0	109.8	D185 V186 D187 K215 S216 S225	D185-H223 IonicContact OD1-CE1 2.7Å; D185-H223 IonicContact OD2-CE1 2.75Å; D185-H223 PolarHBondContact OD2-CE1 3.06Å; D185-H223 IonicContact OD2-NE2 2.78Å; V186-H223 CarbonylContact O-C 3.48Å; V186-H223 WeakPolarHBondContact O-CA 3.35Å; D187-H223 IonicContact OD1-CE1 2.66Å; D187-H223 IonicContact OD1-CG 3.7Å; D187-H223 IonicContact OD1-ND1 2.74Å; D187-H223 PolarHBondContact OD1-ND1 3.34Å; K215-H223 WeakPolarHBondContact CA-O 3.41Å; S216-H223 PolarHBondContact N-O 2.88Å; S216-H223 PolarHBondContact O-N 3.48Å; H223-S225 WeakPolarHBondContact NE2-CB 3.39Å
224	V	97.9	Very high	93.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	124.4	172.9	-178.9	0	0	0	0	108	V186 L197 A199 L213 T214 K215 F248 I250	V186-V224 HydrophobicContact CB-CB 4.28Å; V186-V224 PolarHBondContact N-O 3.26Å; V186-V224 PolarHBondContact O-N 2.78Å; L197-V224 HydrophobicContact CD1-CG2 4.06Å; L197-V224 HydrophobicContact CD2-CG2 3.96Å; L197-V224 HydrophobicContact CG-CG2 4.23Å; A199-V224 HydrophobicContact CB-CG1 3.69Å; A199-V224 HydrophobicContact CB-CG2 4.35Å; L213-V224 HydrophobicContact CD1-CG1 3.95Å; T214-V224 WeakPolarHBondContact O-CA 3.48Å; K215-V224 HydrophobicContact CB-CG2 4.35Å; V224-F248 HydrophobicContact CG1-CE1 4.28Å; V224-F248 HydrophobicContact CG1-CZ 4.12Å; V224-I250 HydrophobicContact CB-CD1 4.38Å; V224-I250 HydrophobicContact CG1-CD1 4.38Å; V224-I250 HydrophobicContact CG2-CG2 4.22Å
225	S	97.3	Very high	93	Very high	13 Å²	13	50.8 Å²	50.8	9%	0.091	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.4	179.5	138.8	0	0	0	0	110	I184 T214 H223 K227	I184-S225 CarbonylContact O-C 3.49Å; I184-S225 WeakPolarHBondContact O-CA 3.31Å; T214-S225 PolarHBondContact N-O 2.89Å; T214-S225 PolarHBondContact O-N 3.1Å; T214-S225 WeakPolarHBondContact OG1-CB 3.2Å; T214-S225 PolarHBondContact OG1-O 3.22Å; T214-S225 PolarHBondContact OG1-OG 2.77Å; H223-S225 WeakPolarHBondContact NE2-CB 3.39Å; S225-K227 WeakPolarHBondContact OG-CE 3.41Å
226	F	97.2	Very high	92.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	109.2	174.9	177.1	-112.9	0	0	0	109.8	F182 E183 I184 F203 I204 L209 A212 L213 P228 L244 F248	F182-F226 HydrophobicContact CD1-CD1 4.28Å; F182-F226 HydrophobicContact CD1-CE1 4.17Å; F182-F226 AromaticContact CE1-CD1 3.89Å; F182-F226 HydrophobicContact CE1-CD1 3.89Å; F182-F226 AromaticContact CE1-CE1 3.86Å; F182-F226 HydrophobicContact CE1-CE1 3.86Å; E183-F226 WeakPolarHBondContact CA-O 3.35Å; I184-F226 HydrophobicContact CB-CB 4.21Å; I184-F226 HydrophobicContact CD1-CD1 4.06Å; I184-F226 HydrophobicContact CG1-CD1 4.3Å; I184-F226 PolarHBondContact N-O 3.33Å; I184-F226 PolarHBondContact O-N 3.35Å; F203-F226 HydrophobicContact CE2-CE1 4.04Å; F203-F226 AromaticContact CE2-CZ 3.93Å; F203-F226 HydrophobicContact CE2-CZ 3.93Å; F203-F226 HydrophobicContact CZ-CE1 4.39Å; I204-F226 HydrophobicContact CD1-CE2 4.33Å; L209-F226 HydrophobicContact CD1-CE2 4.14Å; L209-F226 HydrophobicContact CD1-CZ 3.87Å; L209-F226 HydrophobicContact CG-CZ 4.41Å; A212-F226 HydrophobicContact CB-CD2 4.08Å; A212-F226 HydrophobicContact CB-CE2 3.91Å; A212-F226 WeakPolarHBondContact O-CA 3.34Å; L213-F226 HydrophobicContact CB-CD2 4Å; L213-F226 HydrophobicContact CD1-CB 4.04Å; L213-F226 HydrophobicContact CD1-CD2 4.46Å; F226-P228 HydrophobicContact CD1-CG 4.27Å; F226-P228 HydrophobicContact CE1-CB 4.48Å; F226-P228 HydrophobicContact CE1-CG 3.63Å; F226-P228 HydrophobicContact CE2-CB 4.36Å; F226-P228 HydrophobicContact CE2-CG 4.3Å; F226-P228 HydrophobicContact CZ-CB 4.02Å; F226-P228 HydrophobicContact CZ-CG 3.65Å; F226-L244 HydrophobicContact CE1-CD2 3.88Å; F226-L244 HydrophobicContact CZ-CD2 3.85Å; F226-F248 HydrophobicContact CB-CE2 3.81Å; F226-F248 HydrophobicContact CB-CZ 4.03Å; F226-F248 HydrophobicContact CD1-CE2 4.14Å; F226-F248 HydrophobicContact CD2-CE2 4.48Å; F226-F248 AromaticContact CG-CE2 3.91Å; F226-F248 HydrophobicContact CG-CE2 3.91Å
227	K	95.7	Very high	91.4	Very high	95 Å²	95	50 Å²	50	41%	0.413	29%	0.285	S	S	.	.			trans	-132.5	69	-171.4	-60.8	-177	-162.6	-167.3	0	111.3	E183 D185 A212 S225	E183-K227 HydrophobicContact CB-CG 4.3Å; E183-K227 HydrophobicContact CG-CD 4.08Å; E183-K227 HydrophobicContact CG-CG 3.94Å; E183-K227 WeakPolarHBondContact OE1-CE 3.21Å; E183-K227 IonicContact OE1-NZ 2.74Å; E183-K227 PolarHBondContact OE1-NZ 3.05Å; D185-K227 WeakPolarHBondContact OD2-CE 3.48Å; D185-K227 IonicContact OD2-NZ 2.68Å; D185-K227 PolarHBondContact OD2-NZ 2.79Å; A212-K227 PolarHBondContact O-N 3Å; A212-K227 VanDerWaalsContact O-N 3.16Å; S225-K227 WeakPolarHBondContact OG-CE 3.41Å
228	P	94.9	Very high	90.5	Very high	4 Å²	4	51.6 Å²	51.6	3%	0.026	30%	0.302	C	S	.	.			trans	-73.1	136.2	-176.8	32.2	-37.1	0	0	0	112.2	F182 L209 A212 F226 Q232 Q233 L244	F182-P228 HydrophobicContact CB-CG 4.43Å; F182-P228 HydrophobicContact CD1-CG 3.88Å; L209-P228 HydrophobicContact CD1-CB 3.85Å; A212-P228 HydrophobicContact CB-CB 3.97Å; F226-P228 HydrophobicContact CD1-CG 4.27Å; F226-P228 HydrophobicContact CE1-CB 4.48Å; F226-P228 HydrophobicContact CE1-CG 3.63Å; F226-P228 HydrophobicContact CE2-CB 4.36Å; F226-P228 HydrophobicContact CE2-CG 4.3Å; F226-P228 HydrophobicContact CZ-CB 4.02Å; F226-P228 HydrophobicContact CZ-CG 3.65Å; P228-Q232 HydrophobicContact CB-CB 4.1Å; P228-Q233 HydrophobicContact CB-CG 4.06Å; P228-Q233 HydrophobicContact CG-CG 4.04Å; P228-Q233 PolarHBondContact O-NE2 2.86Å; P228-Q233 VanDerWaalsContact O-NE2 3.15Å; P228-L244 HydrophobicContact CG-CD1 4.26Å
229	S	91.9	Very high	89.8	Confident	56 Å²	56	48.5 Å²	48.5	39%	0.392	28%	0.28	S	S	.	.			trans	-65.9	163.2	169	80.5	0	0	0	0	111.5	D231 Q232 Q233	S229-D231 PolarHBondContact O-N 3.45Å; S229-D231 PolarHBondContact OG-N 2.92Å; S229-Q232 WeakPolarHBondContact O-CB 3.49Å; S229-Q232 PolarHBondContact O-N 2.84Å; S229-Q232 VanDerWaalsContact O-N 3.15Å; S229-Q232 WeakPolarHBondContact OG-CG 3.19Å; S229-Q232 PolarHBondContact OG-N 3.43Å; S229-Q232 PolarHBondContact OG-OE1 3.22Å; S229-Q233 WeakPolarHBondContact O-CG 3.28Å; S229-Q233 PolarHBondContact O-N 3.13Å; S229-Q233 VanDerWaalsContact O-N 3.08Å
230	L	89.6	Confident	89.1	Confident	48 Å²	48	51.3 Å²	51.3	25%	0.251	29%	0.288	S	S	.	.	H	α-helix	trans	-54	-41.3	175	-79.9	170.4	0	0	0	112.4	L178 I179 K180 Q233 R234	L178-L230 HydrophobicContact CB-CD2 4.03Å; I179-L230 WeakPolarHBondContact O-CD2 3.26Å; K180-L230 HydrophobicContact CG-CD1 4.16Å; K180-L230 HydrophobicContact CG-CD2 4.46Å; L230-Q233 WeakPolarHBondContact O-CB 3.39Å; L230-Q233 PolarHBondContact O-N 3.17Å; L230-R234 WeakPolarHBondContact O-CG 3.38Å; L230-R234 PolarHBondContact O-N 2.85Å
231	D	87.6	Confident	88.6	Confident	113 Å²	113	52.6 Å²	52.6	60%	0.604	30%	0.299	S	S	*	.	H	α-helix	trans	-70.1	-34.9	-178.8	-65.6	-28.4	0	0	0	112	S229 Q233 R234	S229-D231 PolarHBondContact O-N 3.45Å; S229-D231 PolarHBondContact OG-N 2.92Å; D231-Q233 VanDerWaalsContact C-N 3.27Å; D231-Q233 PolarHBondContact O-N 3.1Å; D231-R234 PolarHBondContact O-N 2.83Å; D231-R234 IonicContact OD1-NE 3.66Å
232	Q	89	Confident	88.2	Confident	31 Å²	31	50.5 Å²	50.5	15%	0.145	29%	0.293	C	S	.	.	H	α-helix	trans	-65.6	-31.8	173.7	-72.1	172.5	-46.1	0	0	111.9	L208 L209 S211 P228 S229 R234	L208-Q232 HydrophobicContact CD1-CG 4.38Å; L208-Q232 HydrophobicContact CG-CG 4.07Å; L208-Q232 PolarHBondContact O-NE2 3.09Å; L209-Q232 HydrophobicContact CD1-CB 4.11Å; S211-Q232 PolarHBondContact OG-NE2 2.77Å; P228-Q232 HydrophobicContact CB-CB 4.1Å; S229-Q232 WeakPolarHBondContact O-CB 3.49Å; S229-Q232 PolarHBondContact O-N 2.84Å; S229-Q232 VanDerWaalsContact O-N 3.15Å; S229-Q232 WeakPolarHBondContact OG-CG 3.19Å; S229-Q232 PolarHBondContact OG-N 3.43Å; S229-Q232 PolarHBondContact OG-OE1 3.22Å; Q232-R234 VanDerWaalsContact C-N 3.34Å
233	Q	89.9	Confident	87.8	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-73.6	-21.1	178.6	-66.6	172.8	40.8	0	0	113.5	L178 I179 P228 S229 L230 D231 S242 L243 L244	L178-Q233 HydrophobicContact CD2-CB 3.77Å; I179-Q233 VanDerWaalsContact N-OE1 3.07Å; I179-Q233 PolarHBondContact O-NE2 3.39Å; I179-Q233 PolarHBondContact O-OE1 3.05Å; P228-Q233 HydrophobicContact CB-CG 4.06Å; P228-Q233 HydrophobicContact CG-CG 4.04Å; P228-Q233 PolarHBondContact O-NE2 2.86Å; P228-Q233 VanDerWaalsContact O-NE2 3.15Å; S229-Q233 WeakPolarHBondContact O-CG 3.28Å; S229-Q233 PolarHBondContact O-N 3.13Å; S229-Q233 VanDerWaalsContact O-N 3.08Å; L230-Q233 WeakPolarHBondContact O-CB 3.39Å; L230-Q233 PolarHBondContact O-N 3.17Å; D231-Q233 VanDerWaalsContact C-N 3.27Å; D231-Q233 PolarHBondContact O-N 3.1Å; Q233-S242 CarbonylContact O-C 3.52Å; Q233-S242 WeakPolarHBondContact O-CA 3.26Å; Q233-L243 PolarHBondContact O-N 3.49Å; Q233-L244 HydrophobicContact CG-CD1 3.77Å; Q233-L244 HydrophobicContact CG-CG 4.08Å
234	R	87.5	Confident	87.4	Confident	33 Å²	33	50.1 Å²	50.1	13%	0.125	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-72.7	140.4	-172.6	-69.3	177.5	-171.1	-108.6	10.1	112.3	E37 L178 L230 D231 Q232 C236 C239 L243	E37-R234 IonicContact OE1-CZ 2.66Å; E37-R234 IonicContact OE1-NH1 3.13Å; E37-R234 IonicContact OE1-NH2 2.76Å; E37-R234 PolarHBondContact OE1-NH2 2.9Å; E37-R234 IonicContact OE2-NH2 3.12Å; L178-R234 HydrophobicContact CD1-CG 3.99Å; L178-R234 HydrophobicContact CD2-CG 4.16Å; L230-R234 WeakPolarHBondContact O-CG 3.38Å; L230-R234 PolarHBondContact O-N 2.85Å; D231-R234 PolarHBondContact O-N 2.83Å; D231-R234 IonicContact OD1-NE 3.66Å; Q232-R234 VanDerWaalsContact C-N 3.34Å; R234-C236 VanDerWaalsContact C-N 3.31Å; R234-C236 WeakPolarHBondContact CB-O 3.29Å; R234-C236 PolarHBondContact O-N 3.36Å; R234-C239 PolarHBondContact NH1-O 3.47Å; R234-L243 VanDerWaalsContact O-CD1 3.24Å; R234-L243 WeakPolarHBondContact O-CD1 3.47Å
235	S	82.4	Confident	87	Confident	53 Å²	53	54.6 Å²	54.6	37%	0.371	32%	0.316	S	S	.	.	S	Bend	trans	-70.8	-26.3	172.5	59.9	0	0	0	0	114.1	C239 D241	S235-C239 VanDerWaalsContact OG-CB 3.27Å; S235-C239 WeakPolarHBondContact OG-CB 3.39Å; S235-D241 PolarHBondContact N-O 3.39Å
236	C	79.3	Confident	86.7	Confident	41 Å²	41	54.2 Å²	54.2	28%	0.277	31%	0.314	S	S	.	.	S	Bend	trans	-153.3	162.4	172	85.5	0	0	0	0	110.3	R234 T238 C239	R234-C236 VanDerWaalsContact C-N 3.31Å; R234-C236 WeakPolarHBondContact CB-O 3.29Å; R234-C236 PolarHBondContact O-N 3.36Å; C236-T238 PolarHBondContact O-N 2.7Å; C236-C239 HydrophobicContact CB-CB 4.01Å; C236-C239 WeakPolarHBondContact CB-SG 3.33Å; C236-C239 PolarHBondContact O-N 3.39Å; C236-C239 WeakPolarHBondContact SG-CB 3.33Å; C236-C239 PolarHBondContact SG-N 2.88Å; C236-C239 CovalentContact SG-SG 2.04Å; C236-C239 PolarHBondContact SG-SG 3.42Å
237	P	77.6	Confident	86.5	Confident	123 Å²	123	56.4 Å²	56.4	80%	0.799	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-27.2	-174.8	-28.6	35.7	0	0	0	115.4
238	T	78.4	Confident	86.4	Confident	126 Å²	126	51.9 Å²	51.9	77%	0.773	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	1.6	-178.8	55.2	0	0	0	0	113.8	C236	C236-T238 PolarHBondContact O-N 2.7Å
239	C	79.8	Confident	86.4	Confident	36 Å²	36	53.2 Å²	53.2	24%	0.243	31%	0.314	C	S	.	.			trans	-78.6	150.9	-175.9	-69.5	0	0	0	0	111.2	R234 S235 C236	R234-C239 PolarHBondContact NH1-O 3.47Å; S235-C239 VanDerWaalsContact OG-CB 3.27Å; S235-C239 WeakPolarHBondContact OG-CB 3.39Å; C236-C239 HydrophobicContact CB-CB 4.01Å; C236-C239 WeakPolarHBondContact CB-SG 3.33Å; C236-C239 PolarHBondContact O-N 3.39Å; C236-C239 WeakPolarHBondContact SG-CB 3.33Å; C236-C239 PolarHBondContact SG-N 2.88Å; C236-C239 CovalentContact SG-SG 2.04Å; C236-C239 PolarHBondContact SG-SG 3.42Å
240	T	77.3	Confident	86.7	Confident	106 Å²	106	50.6 Å²	50.6	65%	0.65	30%	0.295	S	S	*	.			trans	-96.1	-7.7	173.6	49.8	0	0	0	0	113.1	L178	L178-T240 WeakPolarHBondContact CG-O 3.43Å
241	D	81.1	Confident	87.1	Confident	107 Å²	107	49.3 Å²	49.3	57%	0.572	29%	0.29	S	S	*	.	S	Bend	trans	-89.3	146.9	-176.9	-54.4	-30.2	0	0	0	111.1	S235	S235-D241 PolarHBondContact N-O 3.39Å
242	S	84.9	Confident	87.5	Confident	23 Å²	23	44 Å²	44	16%	0.161	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-92.4	139.2	179.4	-168.8	0	0	0	0	111.7	Q233 L244	Q233-S242 CarbonylContact O-C 3.52Å; Q233-S242 WeakPolarHBondContact O-CA 3.26Å; S242-L244 WeakPolarHBondContact OG-CB 3.22Å; S242-L244 PolarHBondContact OG-N 2.9Å; S242-L244 VanDerWaalsContact OG-N 3.17Å
243	L	87	Confident	87.9	Confident	44 Å²	44	43 Å²	43	23%	0.23	26%	0.257	C	S	.	.	S	Bend	trans	-73.4	-16.8	166.8	-71.8	174.8	0	0	0	112.5	F203 L209 Q233 R234 N245	F203-L243 VanDerWaalsContact CB-O 3.27Å; F203-L243 WeakPolarHBondContact CB-O 3.46Å; L209-L243 HydrophobicContact CD2-CB 4.36Å; Q233-L243 PolarHBondContact O-N 3.49Å; R234-L243 VanDerWaalsContact O-CD1 3.24Å; R234-L243 WeakPolarHBondContact O-CD1 3.47Å; L243-N245 PolarHBondContact O-N 3.42Å
244	L	89.6	Confident	88.2	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	26%	0.258	C	S	.	.			trans	-70	83.1	179.3	-58.5	-172.8	0	0	0	109.2	V173 P175 F182 F203 L209 F226 P228 Q233 S242	V173-L244 HydrophobicContact CG1-CB 4.01Å; P175-L244 WeakPolarHBondContact CD-O 3.46Å; P175-L244 HydrophobicContact CG-CB 3.56Å; P175-L244 HydrophobicContact CG-CD1 4.1Å; P175-L244 HydrophobicContact CG-CG 4.44Å; F182-L244 HydrophobicContact CB-CD1 4.47Å; F182-L244 HydrophobicContact CD1-CD1 3.75Å; F182-L244 HydrophobicContact CD2-CD1 4.07Å; F182-L244 HydrophobicContact CE1-CD1 3.95Å; F182-L244 HydrophobicContact CE2-CD1 4.26Å; F182-L244 HydrophobicContact CG-CD1 3.81Å; F182-L244 HydrophobicContact CZ-CD1 4.22Å; F203-L244 HydrophobicContact CD2-CD2 3.82Å; F203-L244 HydrophobicContact CE2-CD2 3.52Å; F203-L244 HydrophobicContact CZ-CD2 4.34Å; L209-L244 HydrophobicContact CD1-CD2 4.37Å; L209-L244 HydrophobicContact CD2-CD2 4.49Å; F226-L244 HydrophobicContact CE1-CD2 3.88Å; F226-L244 HydrophobicContact CZ-CD2 3.85Å; P228-L244 HydrophobicContact CG-CD1 4.26Å; Q233-L244 HydrophobicContact CG-CD1 3.77Å; Q233-L244 HydrophobicContact CG-CG 4.08Å; S242-L244 WeakPolarHBondContact OG-CB 3.22Å; S242-L244 PolarHBondContact OG-N 2.9Å; S242-L244 VanDerWaalsContact OG-N 3.17Å
245	N	89.6	Confident	88.5	Confident	94 Å²	94	44.4 Å²	44.4	50%	0.503	27%	0.267	S	S	.	.			trans	-151.2	96.9	178.4	-175.9	7	0	0	0	109.6	V173 Q174 L243	V173-N245 CarbonylContact O-C 3.57Å; V173-N245 VanDerWaalsContact O-CA 3.25Å; V173-N245 WeakPolarHBondContact O-CA 3.27Å; Q174-N245 WeakPolarHBondContact CG-OD1 3.38Å; L243-N245 PolarHBondContact O-N 3.42Å
246	G	90.8	Very high	88.9	Confident	5 Å²	5	43.1 Å²	43.1	5%	0.052	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.6	-148.6	177.7	0	0	0	0	0	112.1	V173 S202	V173-G246 PolarHBondContact N-O 2.95Å; V173-G246 PolarHBondContact O-N 2.91Å; S202-G246 WeakPolarHBondContact OG-CA 3.17Å
247	D	91.9	Very high	89.1	Confident	46 Å²	46	50.4 Å²	50.4	25%	0.246	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	136	-164.9	-60.3	2.2	0	0	0	108.6	Y170 K172 A201 S202	Y170-D247 HydrophobicContact CE2-CB 3.73Å; Y170-D247 WeakPolarHBondContact CE2-OD2 3.28Å; Y170-D247 PolarHBondContact OH-OD1 2.63Å; Y170-D247 PolarHBondContact OH-OD2 2.96Å; K172-D247 WeakPolarHBondContact CD-OD1 3.39Å; K172-D247 IonicContact NZ-OD1 3.21Å; K172-D247 PolarHBondContact NZ-OD1 3.14Å; A201-D247 CarbonylContact C-O 3.48Å; A201-D247 WeakPolarHBondContact CA-O 3.46Å; S202-D247 PolarHBondContact N-O 2.97Å; S202-D247 PolarHBondContact OG-N 3.5Å
248	F	94.9	Very high	89.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	109.8	173.4	-169.8	-77.2	0	0	0	107.8	L171 V173 I184 A201 F203 L213 V224 F226 I250	L171-F248 HydrophobicContact CB-CB 4.25Å; L171-F248 HydrophobicContact CD1-CD1 4.35Å; L171-F248 PolarHBondContact N-O 3.37Å; L171-F248 PolarHBondContact O-N 3.48Å; V173-F248 HydrophobicContact CG2-CB 3.88Å; I184-F248 HydrophobicContact CD1-CB 4.42Å; I184-F248 HydrophobicContact CD1-CD1 4.34Å; I184-F248 HydrophobicContact CD1-CD2 3.85Å; I184-F248 HydrophobicContact CD1-CE2 4.17Å; I184-F248 HydrophobicContact CD1-CG 3.95Å; I184-F248 HydrophobicContact CG2-CE1 4.27Å; A201-F248 HydrophobicContact CB-CB 4.44Å; A201-F248 HydrophobicContact CB-CD2 3.65Å; A201-F248 HydrophobicContact CB-CE2 4.29Å; A201-F248 HydrophobicContact CB-CG 4.34Å; F203-F248 HydrophobicContact CE1-CB 4.48Å; F203-F248 HydrophobicContact CZ-CD2 4.15Å; L213-F248 HydrophobicContact CD1-CE2 4Å; L213-F248 HydrophobicContact CD1-CZ 3.69Å; V224-F248 HydrophobicContact CG1-CE1 4.28Å; V224-F248 HydrophobicContact CG1-CZ 4.12Å; F226-F248 HydrophobicContact CB-CE2 3.81Å; F226-F248 HydrophobicContact CB-CZ 4.03Å; F226-F248 HydrophobicContact CD1-CE2 4.14Å; F226-F248 HydrophobicContact CD2-CE2 4.48Å; F226-F248 AromaticContact CG-CE2 3.91Å; F226-F248 HydrophobicContact CG-CE2 3.91Å; F248-I250 HydrophobicContact CD1-CD1 4.43Å; F248-I250 HydrophobicContact CD1-CG1 4.09Å; F248-I250 HydrophobicContact CE1-CD1 3.93Å; F248-I250 HydrophobicContact CE1-CG1 3.68Å
249	T	95.2	Very high	89.8	Confident	33 Å²	33	42.5 Å²	42.5	20%	0.202	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.4	-172.7	-54.9	0	0	0	0	109.4	M169 A199 E200 T251	M169-T249 WeakPolarHBondContact O-CA 3.31Å; A199-T249 WeakPolarHBondContact CA-O 3.39Å; E200-T249 PolarHBondContact N-O 2.88Å; E200-T249 PolarHBondContact O-N 3.39Å; T249-T251 HydrophobicContact CG2-CG2 3.87Å
250	I	96.8	Very high	90.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.5	172.5	-57.3	168.6	0	0	0	107.1	M169 V186 I188 L197 D198 A199 V224 F248	M169-I250 HydrophobicContact CB-CB 4.31Å; M169-I250 PolarHBondContact N-O 2.84Å; M169-I250 PolarHBondContact O-N 2.76Å; M169-I250 HydrophobicContact SD-CD1 4.35Å; V186-I250 HydrophobicContact CB-CD1 3.84Å; V186-I250 HydrophobicContact CG1-CD1 3.87Å; V186-I250 HydrophobicContact CG2-CD1 3.45Å; V186-I250 VanDerWaalsContact CG2-CD1 3.45Å; I188-I250 HydrophobicContact CD1-CG2 4.2Å; L197-I250 HydrophobicContact CD1-CG2 3.82Å; D198-I250 WeakPolarHBondContact O-CA 3.38Å; A199-I250 HydrophobicContact CB-CG1 4.34Å; V224-I250 HydrophobicContact CB-CD1 4.38Å; V224-I250 HydrophobicContact CG1-CD1 4.38Å; V224-I250 HydrophobicContact CG2-CG2 4.22Å; F248-I250 HydrophobicContact CD1-CD1 4.43Å; F248-I250 HydrophobicContact CD1-CG1 4.09Å; F248-I250 HydrophobicContact CE1-CD1 3.93Å; F248-I250 HydrophobicContact CE1-CG1 3.68Å
251	T	97.4	Very high	90.8	Very high	22 Å²	22	37.2 Å²	37.2	14%	0.135	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	135.1	177.6	69.6	0	0	0	0	110.4	Y167 E168 L197 D198 T249	Y167-T251 VanDerWaalsContact O-CA 3.3Å; Y167-T251 WeakPolarHBondContact O-CA 3.22Å; E168-T251 HydrophobicContact CG-CG2 4Å; L197-T251 CarbonylContact C-O 3.45Å; D198-T251 PolarHBondContact N-O 2.83Å; D198-T251 PolarHBondContact O-N 3.12Å; T249-T251 HydrophobicContact CG2-CG2 3.87Å
252	Y	97.8	Very high	91.2	Very high	1 Å²	1	32.3 Å²	32.3	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	166	177.2	79.7	-82.9	0	0	0	110.9	V54 L160 Y167 I188 E190 M196 V254	V54-Y252 HydrophobicContact CG1-CE1 4.35Å; V54-Y252 VanDerWaalsContact CG1-OH 3.31Å; V54-Y252 WeakPolarHBondContact CG1-OH 3.43Å; L160-Y252 HydrophobicContact CD1-CE1 3.67Å; Y167-Y252 HydrophobicContact CD2-CD2 4.06Å; Y167-Y252 HydrophobicContact CD2-CE1 4.22Å; Y167-Y252 AromaticContact CD2-CE2 3.7Å; Y167-Y252 HydrophobicContact CD2-CE2 3.7Å; Y167-Y252 HydrophobicContact CD2-CG 4.46Å; Y167-Y252 AromaticContact CD2-CZ 3.8Å; Y167-Y252 WeakPolarHBondContact CD2-O 3.42Å; Y167-Y252 HydrophobicContact CE2-CE2 4.24Å; Y167-Y252 HydrophobicContact CG-CE1 4.21Å; Y167-Y252 HydrophobicContact CG-CE2 4.42Å; Y167-Y252 PolarHBondContact N-O 2.84Å; Y167-Y252 PolarHBondContact O-N 2.91Å; Y167-Y252 VanDerWaalsContact O-N 3.1Å; I188-Y252 HydrophobicContact CD1-CD1 4.14Å; I188-Y252 HydrophobicContact CD1-CG 4.38Å; I188-Y252 HydrophobicContact CG2-CD2 4.35Å; I188-Y252 HydrophobicContact CG2-CE2 4.1Å; E190-Y252 HydrophobicContact CG-CE2 3.77Å; E190-Y252 WeakPolarHBondContact OE1-CE2 3.09Å; E190-Y252 PolarHBondContact OE1-OH 2.93Å; M196-Y252 VanDerWaalsContact O-CA 3.23Å; M196-Y252 WeakPolarHBondContact O-CA 3.42Å; M196-Y252 VanDerWaalsContact O-CB 3.23Å; M196-Y252 WeakPolarHBondContact O-CB 3.46Å; Y252-V254 HydrophobicContact CE2-CG1 4.31Å
253	D	97.1	Very high	91.4	Very high	10 Å²	10	31.2 Å²	31.2	5%	0.053	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	170.8	164.4	-164.1	17.2	0	0	0	108.8	R162 G165 Y167 S195 M196 R256	R162-D253 IonicContact CZ-OD1 2.84Å; R162-D253 IonicContact CZ-OD2 3.6Å; R162-D253 IonicContact NE-OD1 3.74Å; R162-D253 PolarHBondContact NE-OD1 3.27Å; R162-D253 VanDerWaalsContact NE-OD1 3.17Å; R162-D253 IonicContact NE-OD2 3.83Å; R162-D253 PolarHBondContact NE-OD2 3.46Å; R162-D253 IonicContact NH2-OD1 3.13Å; R162-D253 IonicContact NH2-OD2 2.71Å; R162-D253 PolarHBondContact NH2-OD2 2.82Å; G165-D253 VanDerWaalsContact O-CG 3.29Å; Y167-D253 WeakPolarHBondContact CE2-OD1 3.43Å; S195-D253 PolarHBondContact N-O 2.92Å; S195-D253 PolarHBondContact OG-O 2.99Å; S195-D253 VanDerWaalsContact OG-O 3.11Å; M196-D253 HydrophobicContact CG-CB 4.1Å; M196-D253 PolarHBondContact O-N 2.77Å; D253-R256 IonicContact OD1-CZ 2.7Å; D253-R256 IonicContact OD1-NE 2.87Å; D253-R256 IonicContact OD1-NH2 3.47Å; D253-R256 PolarHBondContact OD1-NH2 3.01Å; D253-R256 IonicContact OD2-NE 2.7Å
254	V	95.6	Very high	91.2	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.012	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	165.1	-178.9	-60.5	0	0	0	0	111.9	R57 Y167 E190 Q192 G193 S195 Y252 R256	R57-V254 VanDerWaalsContact NH2-CG2 3.32Å; Y167-V254 HydrophobicContact CE2-CG1 4.37Å; E190-V254 HydrophobicContact CB-CG1 3.77Å; E190-V254 HydrophobicContact CG-CG1 3.62Å; Q192-V254 HydrophobicContact CB-CB 4.3Å; G193-V254 CarbonylContact O-C 3.58Å; G193-V254 WeakPolarHBondContact O-CA 3.16Å; G193-V254 WeakPolarHBondContact O-CB 3.32Å; S195-V254 PolarHBondContact OG-O 3.44Å; S195-V254 VanDerWaalsContact OG-O 3.07Å; Y252-V254 HydrophobicContact CE2-CG1 4.31Å; V254-R256 HydrophobicContact CG2-CG 4.21Å
255	N	94.3	Very high	90.8	Very high	60 Å²	60	30.9 Å²	30.9	32%	0.321	17%	0.167	S	C	.	.			trans	-71.2	139.6	168.4	-57.6	-42.3	0	0	0	110.2	Q192 G193 S195	Q192-N255 PolarHBondContact NE2-O 3.04Å; Q192-N255 WeakPolarHBondContact O-CB 3.35Å; Q192-N255 PolarHBondContact O-ND2 3.37Å; G193-N255 PolarHBondContact O-N 3.3Å; S195-N255 WeakPolarHBondContact CA-OD1 3.15Å; S195-N255 VanDerWaalsContact CB-OD1 3.25Å; S195-N255 WeakPolarHBondContact CB-OD1 3.41Å
256	R	90.3	Very high	90.2	Very high	26 Å²	26	30.5 Å²	30.5	10%	0.098	17%	0.165	C	C	.	.			trans	-128.3	56.3	-174.9	-62	-173.9	-176.9	-84.4	-7	111.6	R162 Y167 D253 V254 S258 Q276 E500	R162-R256 VanDerWaalsContact NE-NH2 3.1Å; Y167-R256 PolarHBondContact OH-NH2 3.16Å; D253-R256 IonicContact OD1-CZ 2.7Å; D253-R256 IonicContact OD1-NE 2.87Å; D253-R256 IonicContact OD1-NH2 3.47Å; D253-R256 PolarHBondContact OD1-NH2 3.01Å; D253-R256 IonicContact OD2-NE 2.7Å; V254-R256 HydrophobicContact CG2-CG 4.21Å; R256-S258 VanDerWaalsContact C-N 3.28Å; R256-Q276 HydrophobicContact CB-CG 4.13Å; R256-E500 IonicContact CZ-OE1 3.74Å; R256-E500 IonicContact NH1-OE1 2.78Å; R256-E500 PolarHBondContact NH1-OE1 2.8Å; R256-E500 IonicContact NH2-OE1 3.78Å; R256-E500 PolarHBondContact NH2-OE1 3.1Å
257	E	84.8	Confident	89.8	Confident	194 Å²	194	30.9 Å²	30.9	91%	0.907	17%	0.169	S	C	*	.	S	Bend	trans	-69.1	-29.9	175.1	-62.1	-177.2	177.5	0	0	112
258	S	85.4	Confident	89.7	Confident	44 Å²	44	29.5 Å²	29.5	31%	0.308	16%	0.161	S	C	.	.	S	Bend	trans	-106.9	144.2	173.4	-171.6	0	0	0	0	111.1	R256 G260 E532	R256-S258 VanDerWaalsContact C-N 3.28Å; S258-G260 VanDerWaalsContact C-N 3.31Å; S258-G260 WeakPolarHBondContact CB-O 3.4Å; S258-G260 PolarHBondContact OG-O 3.41Å; S258-G260 VanDerWaalsContact OG-O 3.07Å; S258-E532 PolarHBondContact OG-OE1 2.78Å; S258-E532 PolarHBondContact OG-OE2 3.36Å
259	P	85.1	Confident	89.4	Confident	40 Å²	40	29.5 Å²	29.5	26%	0.26	16%	0.161	S	C	.	.	S	Bend	trans	-65.8	-30.7	175.4	26.7	-35.8	0	0	0	113.6	F273 A274 P275 F530	P259-F273 HydrophobicContact CB-CE2 4.33Å; P259-F273 WeakPolarHBondContact O-CD2 3.3Å; P259-A274 CarbonylContact O-C 3.51Å; P259-A274 PolarHBondContact O-N 2.88Å; P259-P275 HydrophobicContact CB-CB 3.82Å; P259-F530 HydrophobicContact CB-CD1 3.71Å; P259-F530 HydrophobicContact CB-CE1 4.04Å; P259-F530 HydrophobicContact CB-CG 4.2Å; P259-F530 HydrophobicContact CG-CB 4.22Å; P259-F530 HydrophobicContact CG-CD1 3.53Å; P259-F530 HydrophobicContact CG-CE1 4.2Å; P259-F530 HydrophobicContact CG-CG 4.14Å
260	G	88.5	Confident	89.3	Confident	2 Å²	2	28 Å²	28	2%	0.021	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	158.6	175.3	0	0	0	0	0	112.8	S258 F272 E532	S258-G260 VanDerWaalsContact C-N 3.31Å; S258-G260 WeakPolarHBondContact CB-O 3.4Å; S258-G260 PolarHBondContact OG-O 3.41Å; S258-G260 VanDerWaalsContact OG-O 3.07Å; G260-F272 CarbonylContact C-O 3.57Å; G260-F272 WeakPolarHBondContact CA-O 3.45Å; G260-E532 WeakPolarHBondContact CA-OE1 3.38Å; G260-E532 PolarHBondContact N-OE1 2.87Å; G260-E532 VanDerWaalsContact N-OE1 3.1Å
261	N	89.7	Confident	89.2	Confident	29 Å²	29	28 Å²	28	16%	0.155	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	108.5	171	-178.6	-115.4	0	0	0	110.3	Q192 Q263 H271 F272	Q192-N261 HydrophobicContact CG-CB 4.12Å; N261-Q263 WeakPolarHBondContact OD1-CG 3.29Å; N261-Q263 PolarHBondContact OD1-NE2 2.9Å; N261-H271 WeakPolarHBondContact O-CA 3.37Å; N261-F272 HydrophobicContact CB-CB 4.48Å; N261-F272 PolarHBondContact N-O 3.37Å; N261-F272 PolarHBondContact O-N 3.07Å
262	V	89.4	Confident	89.2	Confident	4 Å²	4	27 Å²	27	2%	0.024	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	130.9	175.7	178.2	0	0	0	0	109.3	I264 V270 H271 F515 A517 E532 V534 M539	V262-I264 HydrophobicContact CG1-CD1 4.34Å; V262-I264 HydrophobicContact CG1-CG1 4.12Å; V262-V270 CarbonylContact C-O 3.58Å; V262-V270 WeakPolarHBondContact CA-O 3.38Å; V262-H271 HydrophobicContact CG2-CB 3.96Å; V262-H271 VanDerWaalsContact CG2-CD2 3.4Å; V262-H271 WeakPolarHBondContact CG2-CD2 3.37Å; V262-H271 VanDerWaalsContact CG2-CG 3.49Å; V262-F515 HydrophobicContact CG1-CD1 3.73Å; V262-F515 HydrophobicContact CG1-CE1 3.77Å; V262-A517 HydrophobicContact CG2-CB 4.02Å; V262-E532 HydrophobicContact CG2-CB 4.19Å; V262-V534 HydrophobicContact CB-CG2 3.52Å; V262-V534 HydrophobicContact CG1-CG2 3.79Å; V262-V534 HydrophobicContact CG2-CG2 4.48Å; V262-M539 WeakPolarHBondContact O-CE 3.36Å
263	Q	87.6	Confident	89.1	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	135.7	178.3	-54.8	179.9	17.4	0	0	109.2	S56 N261 F269 V270 I554	S56-Q263 PolarHBondContact OG-NE2 3Å; S56-Q263 PolarHBondContact OG-OE1 3.09Å; N261-Q263 WeakPolarHBondContact OD1-CG 3.29Å; N261-Q263 PolarHBondContact OD1-NE2 2.9Å; Q263-F269 CarbonylContact O-C 3.55Å; Q263-F269 WeakPolarHBondContact O-CA 3.43Å; Q263-F269 WeakPolarHBondContact O-CB 3.42Å; Q263-V270 HydrophobicContact CB-CG1 3.96Å; Q263-V270 PolarHBondContact N-O 3.31Å; Q263-V270 PolarHBondContact O-N 3.13Å; Q263-I554 HydrophobicContact CB-CD1 3.97Å
264	I	83.8	Confident	89	Confident	11 Å²	11	26.6 Å²	26.6	6%	0.056	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	127.5	-174.3	-52.5	179.5	0	0	0	109	V262 Y268 F269 L507 F515 V534 M536	V262-I264 HydrophobicContact CG1-CD1 4.34Å; V262-I264 HydrophobicContact CG1-CG1 4.12Å; I264-Y268 CarbonylContact C-O 3.3Å; I264-Y268 WeakPolarHBondContact CA-O 3.3Å; I264-F269 HydrophobicContact CB-CB 4.48Å; I264-F269 HydrophobicContact CG1-CB 3.82Å; I264-L507 HydrophobicContact CG2-CD1 3.83Å; I264-F515 HydrophobicContact CD1-CB 3.38Å; I264-F515 HydrophobicContact CD1-CD1 3.88Å; I264-F515 HydrophobicContact CD1-CD2 4.14Å; I264-F515 HydrophobicContact CD1-CG 3.55Å; I264-V534 HydrophobicContact CD1-CB 4.5Å; I264-V534 HydrophobicContact CD1-CG1 4.4Å; I264-M536 HydrophobicContact CD1-CE 3.94Å; I264-M536 HydrophobicContact CD1-CG 4.28Å; I264-M536 HydrophobicContact CG2-CE 4.46Å; I264-M536 HydrophobicContact CG2-SD 4.29Å
265	V	80.1	Confident	88.9	Confident	25 Å²	25	26.9 Å²	26.9	15%	0.152	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	131.8	178.6	178.8	0	0	0	0	109.8	G267 Y268 L543 I554	V265-G267 VanDerWaalsContact C-N 3.27Å; V265-G267 PolarHBondContact O-N 3.47Å; V265-Y268 PolarHBondContact N-O 3.38Å; V265-Y268 PolarHBondContact O-N 3.06Å; V265-L543 HydrophobicContact CG2-CD1 3.19Å; V265-I554 HydrophobicContact CB-CB 4.41Å; V265-I554 HydrophobicContact CB-CD1 3.73Å; V265-I554 HydrophobicContact CB-CG1 4.15Å; V265-I554 HydrophobicContact CG2-CD1 3.41Å; V265-I554 VanDerWaalsContact CG2-CD1 3.41Å; V265-I554 HydrophobicContact CG2-CG1 4.12Å
266	N	77.4	Confident	88.7	Confident	86 Å²	86	29.7 Å²	29.7	46%	0.46	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	41.4	170.9	-59.2	-15.3	0	0	0	113.8	Y268 N552	N266-Y268 VanDerWaalsContact C-N 3.3Å; N266-Y268 VanDerWaalsContact O-CD2 3.24Å; N266-Y268 WeakPolarHBondContact O-CD2 3.33Å; N266-Y268 PolarHBondContact O-N 3.19Å; N266-N552 PolarHBondContact ND2-OD1 2.87Å
267	G	82.8	Confident	88.6	Confident	13 Å²	13	32.3 Å²	32.3	13%	0.134	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	8	-179.1	0	0	0	0	0	115.3	V265 H506 L507	V265-G267 VanDerWaalsContact C-N 3.27Å; V265-G267 PolarHBondContact O-N 3.47Å; G267-H506 PolarHBondContact O-CD2 2.99Å; G267-L507 WeakPolarHBondContact O-CB 3.25Å; G267-L507 PolarHBondContact O-N 2.73Å
268	Y	89	Confident	88.9	Confident	18 Å²	18	24.8 Å²	24.8	7%	0.071	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	151.3	172.9	-64.3	-91.5	0	0	0	110.7	I264 V265 N266 G505 H506 E555 W558	I264-Y268 CarbonylContact C-O 3.3Å; I264-Y268 WeakPolarHBondContact CA-O 3.3Å; V265-Y268 PolarHBondContact N-O 3.38Å; V265-Y268 PolarHBondContact O-N 3.06Å; N266-Y268 VanDerWaalsContact C-N 3.3Å; N266-Y268 VanDerWaalsContact O-CD2 3.24Å; N266-Y268 WeakPolarHBondContact O-CD2 3.33Å; N266-Y268 PolarHBondContact O-N 3.19Å; Y268-G505 CarbonylContact C-O 3.52Å; Y268-G505 WeakPolarHBondContact CA-O 3.11Å; Y268-H506 HydrophobicContact CD1-CB 3.91Å; Y268-H506 AromaticContact CD1-CD2 3.9Å; Y268-H506 HydrophobicContact CE1-CB 3.72Å; Y268-H506 AromaticContact CE1-CD2 3.4Å; Y268-H506 WeakPolarHBondContact CE1-CD2 3.18Å; Y268-H506 AromaticContact CE1-CG 3.61Å; Y268-H506 AromaticContact CZ-CD2 3.45Å; Y268-H506 VanDerWaalsContact CZ-CD2 3.45Å; Y268-H506 AromaticContact CZ-NE2 3.82Å; Y268-E555 HydrophobicContact CD1-CB 4.39Å; Y268-E555 HydrophobicContact CD1-CG 4.36Å; Y268-E555 HydrophobicContact CD2-CB 3.66Å; Y268-E555 HydrophobicContact CD2-CG 3.91Å; Y268-E555 HydrophobicContact CE1-CG 4Å; Y268-E555 HydrophobicContact CE2-CB 3.8Å; Y268-E555 HydrophobicContact CE2-CG 3.51Å; Y268-E555 HydrophobicContact CG-CB 3.98Å; Y268-E555 HydrophobicContact CG-CG 4.33Å; Y268-W558 HydrophobicContact CD1-CB 4.13Å; Y268-W558 AromaticContact CD1-CD2 3.95Å; Y268-W558 HydrophobicContact CD1-CD2 3.95Å; Y268-W558 HydrophobicContact CD1-CE3 4Å; Y268-W558 AromaticContact CD1-CG 4Å; Y268-W558 HydrophobicContact CD1-CG 4Å; Y268-W558 AromaticContact CE1-CD2 3.83Å; Y268-W558 HydrophobicContact CE1-CD2 3.83Å; Y268-W558 AromaticContact CE1-CE3 3.5Å; Y268-W558 HydrophobicContact CE1-CE3 3.5Å; Y268-W558 HydrophobicContact CE1-CG 4.37Å; Y268-W558 AromaticContact CE1-CZ3 3.92Å; Y268-W558 HydrophobicContact CE1-CZ3 3.92Å
269	F	90.2	Very high	89.3	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	155.8	173.7	78	-88.8	0	0	0	112.8	Q263 I264 Y479 I484 L487 A504 G505 L507 F515	Q263-F269 CarbonylContact O-C 3.55Å; Q263-F269 WeakPolarHBondContact O-CA 3.43Å; Q263-F269 WeakPolarHBondContact O-CB 3.42Å; I264-F269 HydrophobicContact CB-CB 4.48Å; I264-F269 HydrophobicContact CG1-CB 3.82Å; F269-Y479 AromaticContact CE2-CD1 3.97Å; F269-Y479 HydrophobicContact CE2-CD1 3.97Å; F269-Y479 AromaticContact CE2-CE1 3.62Å; F269-Y479 HydrophobicContact CE2-CE1 3.62Å; F269-Y479 HydrophobicContact CZ-CD1 4Å; F269-Y479 HydrophobicContact CZ-CE1 4.07Å; F269-Y479 HydrophobicContact CZ-CG 4.28Å; F269-I484 HydrophobicContact CE1-CD1 4.14Å; F269-I484 HydrophobicContact CE1-CG1 4.2Å; F269-I484 HydrophobicContact CZ-CD1 4.18Å; F269-L487 HydrophobicContact CE1-CD1 4.2Å; F269-L487 HydrophobicContact CE2-CD1 4.32Å; F269-L487 HydrophobicContact CZ-CD1 3.47Å; F269-L487 VanDerWaalsContact CZ-CD1 3.47Å; F269-A504 CarbonylContact O-C 3.45Å; F269-A504 VanDerWaalsContact O-CA 3.23Å; F269-A504 WeakPolarHBondContact O-CA 3.26Å; F269-G505 WeakPolarHBondContact CD1-O 3.49Å; F269-G505 VanDerWaalsContact CE1-CA 3.4Å; F269-G505 PolarHBondContact N-O 3.29Å; F269-G505 PolarHBondContact O-N 3.15Å; F269-L507 HydrophobicContact CD1-CD2 3.65Å; F269-L507 HydrophobicContact CD1-CG 4.04Å; F269-L507 HydrophobicContact CE1-CD2 3.92Å; F269-F515 HydrophobicContact CD1-CE2 4.35Å; F269-F515 HydrophobicContact CD1-CZ 4.06Å; F269-F515 HydrophobicContact CD2-CE1 4.26Å; F269-F515 HydrophobicContact CD2-CZ 4.04Å; F269-F515 HydrophobicContact CE1-CE2 4.34Å; F269-F515 AromaticContact CE1-CZ 3.95Å; F269-F515 HydrophobicContact CE1-CZ 3.95Å; F269-F515 HydrophobicContact CE2-CE1 4.39Å; F269-F515 AromaticContact CE2-CZ 3.96Å; F269-F515 HydrophobicContact CE2-CZ 3.96Å; F269-F515 HydrophobicContact CG-CZ 4.08Å; F269-F515 AromaticContact CZ-CZ 3.88Å; F269-F515 HydrophobicContact CZ-CZ 3.88Å
270	V	93.3	Very high	89.8	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	138.5	165.8	62.5	0	0	0	0	109.2	V262 Q263 F272 V502 V503 I554 L557	V262-V270 CarbonylContact C-O 3.58Å; V262-V270 WeakPolarHBondContact CA-O 3.38Å; Q263-V270 HydrophobicContact CB-CG1 3.96Å; Q263-V270 PolarHBondContact N-O 3.31Å; Q263-V270 PolarHBondContact O-N 3.13Å; V270-F272 HydrophobicContact CB-CE2 4.28Å; V270-F272 HydrophobicContact CB-CZ 4.41Å; V270-F272 HydrophobicContact CG1-CD2 4.35Å; V270-F272 HydrophobicContact CG1-CE2 3.5Å; V270-F272 HydrophobicContact CG1-CZ 3.89Å; V270-F272 HydrophobicContact CG2-CD2 4.33Å; V270-F272 HydrophobicContact CG2-CE1 4.01Å; V270-F272 HydrophobicContact CG2-CE2 3.78Å; V270-F272 HydrophobicContact CG2-CZ 3.59Å; V270-V502 HydrophobicContact CG2-CG1 3.6Å; V270-V503 CarbonylContact C-O 3.48Å; V270-V503 WeakPolarHBondContact CA-O 3.04Å; V270-I554 HydrophobicContact CB-CG2 4.4Å; V270-I554 HydrophobicContact CG1-CD1 4.28Å; V270-I554 HydrophobicContact CG1-CG2 4.31Å; V270-L557 HydrophobicContact CB-CD1 4.44Å; V270-L557 HydrophobicContact CB-CD2 4.22Å; V270-L557 HydrophobicContact CG1-CD1 4.45Å; V270-L557 HydrophobicContact CG2-CD1 4.08Å; V270-L557 HydrophobicContact CG2-CD2 3.76Å
271	H	94.8	Very high	90.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	111.2	178.3	-174.3	-178.2	0	0	0	108.8	N261 V262 M477 Y479 V502 V503 V519	N261-H271 WeakPolarHBondContact O-CA 3.37Å; V262-H271 HydrophobicContact CG2-CB 3.96Å; V262-H271 VanDerWaalsContact CG2-CD2 3.4Å; V262-H271 WeakPolarHBondContact CG2-CD2 3.37Å; V262-H271 VanDerWaalsContact CG2-CG 3.49Å; H271-M477 WeakPolarHBondContact ND1-CE 3.4Å; H271-Y479 HydrophobicContact CB-CE1 4.35Å; H271-Y479 AromaticContact ND1-CE1 3.64Å; H271-Y479 AromaticContact ND1-CZ 3.76Å; H271-Y479 PolarHBondContact ND1-OH 2.97Å; H271-V502 WeakPolarHBondContact O-CA 3.5Å; H271-V503 PolarHBondContact N-O 2.91Å; H271-V503 PolarHBondContact O-N 3.19Å; H271-V519 VanDerWaalsContact CE1-CG2 3.5Å; H271-V519 WeakPolarHBondContact CE1-CG2 3.38Å
272	F	95.6	Very high	90.3	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.009	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	125.3	172	-56.5	-81.9	0	0	0	109.2	S56 R57 G260 N261 V270 E500 V502 L557	S56-F272 WeakPolarHBondContact O-CZ 3.43Å; R57-F272 HydrophobicContact CB-CE1 4.3Å; R57-F272 HydrophobicContact CG-CE1 4.23Å; G260-F272 CarbonylContact C-O 3.57Å; G260-F272 WeakPolarHBondContact CA-O 3.45Å; N261-F272 HydrophobicContact CB-CB 4.48Å; N261-F272 PolarHBondContact N-O 3.37Å; N261-F272 PolarHBondContact O-N 3.07Å; V270-F272 HydrophobicContact CB-CE2 4.28Å; V270-F272 HydrophobicContact CB-CZ 4.41Å; V270-F272 HydrophobicContact CG1-CD2 4.35Å; V270-F272 HydrophobicContact CG1-CE2 3.5Å; V270-F272 HydrophobicContact CG1-CZ 3.89Å; V270-F272 HydrophobicContact CG2-CD2 4.33Å; V270-F272 HydrophobicContact CG2-CE1 4.01Å; V270-F272 HydrophobicContact CG2-CE2 3.78Å; V270-F272 HydrophobicContact CG2-CZ 3.59Å; F272-E500 HydrophobicContact CB-CG 4.47Å; F272-E500 WeakPolarHBondContact CD1-OE2 3.41Å; F272-V502 HydrophobicContact CD1-CB 4.46Å; F272-V502 HydrophobicContact CD1-CG1 3.93Å; F272-V502 HydrophobicContact CD1-CG2 3.82Å; F272-V502 HydrophobicContact CE1-CG1 3.79Å; F272-V502 HydrophobicContact CE1-CG2 4.16Å; F272-L557 HydrophobicContact CZ-CD1 4.23Å
273	F	96.4	Very high	90.6	Very high	1 Å²	1	26.1 Å²	26.1	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	117.5	179.6	177.4	-102.4	0	0	0	110.8	P259 P275 L472 V475 M477 I501 V519 F530	P259-F273 HydrophobicContact CB-CE2 4.33Å; P259-F273 WeakPolarHBondContact O-CD2 3.3Å; F273-P275 HydrophobicContact CE1-CG 3.96Å; F273-P275 HydrophobicContact CE2-CG 4.18Å; F273-P275 HydrophobicContact CZ-CG 3.64Å; F273-L472 HydrophobicContact CE1-CD1 3.86Å; F273-L472 HydrophobicContact CZ-CD1 3.87Å; F273-V475 HydrophobicContact CE1-CG1 4.24Å; F273-M477 HydrophobicContact CB-CE 3.26Å; F273-M477 HydrophobicContact CD1-CE 4.34Å; F273-M477 HydrophobicContact CD2-CE 4.44Å; F273-M477 HydrophobicContact CG-CE 3.8Å; F273-I501 HydrophobicContact CB-CB 4.37Å; F273-I501 HydrophobicContact CD1-CB 4.44Å; F273-I501 HydrophobicContact CD1-CD1 4.3Å; F273-I501 PolarHBondContact N-O 2.64Å; F273-I501 PolarHBondContact O-N 3.39Å; F273-V519 HydrophobicContact CD1-CG1 4.08Å; F273-V519 HydrophobicContact CD2-CB 4.2Å; F273-V519 HydrophobicContact CD2-CG1 4.03Å; F273-V519 HydrophobicContact CD2-CG2 3.94Å; F273-V519 HydrophobicContact CE1-CG1 3.75Å; F273-V519 HydrophobicContact CE2-CB 3.9Å; F273-V519 HydrophobicContact CE2-CG1 3.69Å; F273-V519 HydrophobicContact CE2-CG2 4.16Å; F273-V519 HydrophobicContact CG-CG1 4.2Å; F273-V519 HydrophobicContact CG-CG2 4.43Å; F273-V519 HydrophobicContact CZ-CB 4.22Å; F273-V519 HydrophobicContact CZ-CG1 3.54Å; F273-F530 HydrophobicContact CE2-CB 4.19Å; F273-F530 AromaticContact CE2-CD2 3.63Å; F273-F530 HydrophobicContact CE2-CD2 3.63Å; F273-F530 HydrophobicContact CE2-CE2 4.21Å; F273-F530 AromaticContact CE2-CG 3.98Å; F273-F530 HydrophobicContact CE2-CG 3.98Å; F273-F530 AromaticContact CZ-CD2 3.63Å; F273-F530 HydrophobicContact CZ-CD2 3.63Å; F273-F530 AromaticContact CZ-CE2 3.84Å; F273-F530 HydrophobicContact CZ-CE2 3.84Å; F273-F530 HydrophobicContact CZ-CG 4.41Å
274	A	95.5	Very high	91	Very high	2 Å²	2	26.1 Å²	26.1	2%	0.017	17%	0.165	C	C	.	.			trans	-157	78.9	176.7	0	0	0	0	0	110.5	P259 F495 E500	P259-A274 CarbonylContact O-C 3.51Å; P259-A274 PolarHBondContact O-N 2.88Å; A274-F495 HydrophobicContact CB-CE2 4.04Å; A274-F495 HydrophobicContact CB-CZ 3.91Å; A274-E500 HydrophobicContact CB-CB 4.11Å; A274-E500 HydrophobicContact CB-CG 4.01Å
275	P	93.6	Very high	91.6	Very high	7 Å²	7	25.7 Å²	25.7	5%	0.045	16%	0.163	C	C	.	.			trans	-63	145.4	177.6	26.5	-35.7	0	0	0	111.7	P259 F273 L278 L472 F495 F530	P259-P275 HydrophobicContact CB-CB 3.82Å; F273-P275 HydrophobicContact CE1-CG 3.96Å; F273-P275 HydrophobicContact CE2-CG 4.18Å; F273-P275 HydrophobicContact CZ-CG 3.64Å; P275-L278 HydrophobicContact CB-CD1 3.89Å; P275-L278 HydrophobicContact CB-CG 4.26Å; P275-L278 HydrophobicContact CG-CD1 3.61Å; P275-L278 HydrophobicContact CG-CG 4.47Å; P275-L472 HydrophobicContact CG-CD1 4.21Å; P275-F495 HydrophobicContact CG-CD1 4.11Å; P275-F495 HydrophobicContact CG-CE1 3.66Å; P275-F495 HydrophobicContact CG-CZ 4.29Å; P275-F530 HydrophobicContact CB-CZ 4.3Å
276	Q	88.9	Confident	92.4	Very high	119 Å²	119	24.5 Å²	24.5	56%	0.556	16%	0.156	S	C	*	.			trans	-107.4	155	176.7	-67	-170.5	-24.3	0	0	111.9	R256 L278	R256-Q276 HydrophobicContact CB-CG 4.13Å; Q276-L278 VanDerWaalsContact C-N 3.3Å; Q276-L278 PolarHBondContact O-N 2.8Å
277	G	87.8	Confident	93.4	Very high	82 Å²	82	20.5 Å²	20.5	85%	0.845	13%	0.134	S	C	*	.	S	Bend	trans	74.7	13.9	170.9	0	0	0	0	0	115.3
278	L	92.7	Very high	94.2	Very high	35 Å²	35	19.9 Å²	19.9	18%	0.183	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-74.2	141.8	174.1	-62.4	-177.4	0	0	0	110.9	P275 Q276 L471 L472 L528 F530	P275-L278 HydrophobicContact CB-CD1 3.89Å; P275-L278 HydrophobicContact CB-CG 4.26Å; P275-L278 HydrophobicContact CG-CD1 3.61Å; P275-L278 HydrophobicContact CG-CG 4.47Å; Q276-L278 VanDerWaalsContact C-N 3.3Å; Q276-L278 PolarHBondContact O-N 2.8Å; L278-L471 HydrophobicContact CB-CB 4.22Å; L278-L471 HydrophobicContact CB-CD1 4.47Å; L278-L471 HydrophobicContact CD1-CB 4.37Å; L278-L472 HydrophobicContact CD1-CD1 4.03Å; L278-L472 HydrophobicContact CD1-CD2 3.84Å; L278-L472 HydrophobicContact CD1-CG 3.81Å; L278-L528 HydrophobicContact CD1-CD1 4.44Å; L278-L528 HydrophobicContact CD2-CD1 3.96Å; L278-F530 HydrophobicContact CD1-CZ 4.44Å; L278-F530 HydrophobicContact CD2-CZ 4.43Å
279	P	93.9	Very high	94.6	Very high	85 Å²	85	19.1 Å²	19.1	55%	0.552	13%	0.125	S	C	*	.	P	Polyproline II helix	trans	-62.2	141.1	170.2	-20.5	32.3	0	0	0	111.4	A524	P279-A524 HydrophobicContact CB-CB 4.21Å
280	V	93.8	Very high	94.9	Very high	32 Å²	32	19.1 Å²	19.1	19%	0.194	13%	0.125	C	C	.	.	P	Polyproline II helix	trans	-69.3	132.1	176.8	-180	0	0	0	0	110.1	N469 L471	V280-N469 HydrophobicContact CG1-CB 4.35Å; V280-N469 HydrophobicContact CG2-CB 4.37Å; V280-L471 HydrophobicContact CB-CD2 4.45Å; V280-L471 HydrophobicContact CG2-CD2 3.8Å
281	V	95.1	Very high	95	Very high	3 Å²	3	19.7 Å²	19.7	2%	0.018	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-72.2	124.1	173.3	179	0	0	0	0	108.5	T387 P470 L471 T473 A524	V281-T387 HydrophobicContact CG1-CG2 4.23Å; V281-P470 HydrophobicContact CB-CG 4.35Å; V281-P470 WeakPolarHBondContact CB-O 3.07Å; V281-P470 PolarHBondContact N-O 2.81Å; V281-L471 WeakPolarHBondContact CG2-O 3.41Å; V281-T473 HydrophobicContact CG1-CG2 4.45Å; V281-A524 HydrophobicContact CG2-CB 4.2Å
282	P	95.1	Very high	95	Very high	26 Å²	26	19.7 Å²	19.7	17%	0.169	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-56.4	142	175.5	-25.1	34.2	0	0	0	111.6	E317 S386 T387	P282-E317 HydrophobicContact CB-CB 4.12Å; P282-E317 HydrophobicContact CG-CB 4.08Å; P282-S386 CarbonylContact O-C 3.48Å; P282-S386 WeakPolarHBondContact O-CA 3.25Å; P282-S386 VanDerWaalsContact O-CB 3.25Å; P282-S386 WeakPolarHBondContact O-CB 3.5Å; P282-T387 PolarHBondContact O-N 3.14Å
283	K	94.3	Very high	94.7	Very high	1 Å²	1	21.4 Å²	21.4	0%	0.004	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	145.2	-176.6	55.3	178.2	-178.1	-63.4	0	113.1	V285 D318 Y319 T387 I389 Y464 A468	K283-V285 HydrophobicContact CB-CG2 4.13Å; K283-V285 HydrophobicContact CD-CG2 3.77Å; K283-V285 HydrophobicContact CG-CG2 3.89Å; K283-D318 HydrophobicContact CG-CB 4.28Å; K283-D318 VanDerWaalsContact CG-OD1 3.23Å; K283-D318 WeakPolarHBondContact CG-OD1 3.24Å; K283-D318 PolarHBondContact N-OD1 2.85Å; K283-D318 IonicContact NZ-OD1 4Å; K283-D318 IonicContact NZ-OD2 2.63Å; K283-D318 PolarHBondContact NZ-OD2 2.94Å; K283-D318 WeakPolarHBondContact O-CA 3.45Å; K283-Y319 PolarHBondContact O-N 3.37Å; K283-T387 CarbonylContact C-O 3.51Å; K283-T387 VanDerWaalsContact CA-O 3.25Å; K283-T387 WeakPolarHBondContact CA-O 3.32Å; K283-T387 HydrophobicContact CB-CG2 4.19Å; K283-I389 HydrophobicContact CB-CD1 4.37Å; K283-Y464 WeakPolarHBondContact CE-OH 3.49Å; K283-A468 WeakPolarHBondContact CD-O 3.11Å; K283-A468 WeakPolarHBondContact CE-O 3.44Å; K283-A468 PolarHBondContact NZ-O 3Å
284	N	96.6	Very high	94.5	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	103.2	174.3	-47.5	-49.1	0	0	0	108.4	Y319 L336 L373 V382 S386 T387 S388 I389	N284-Y319 CarbonylContact C-O 3.52Å; N284-Y319 VanDerWaalsContact CA-O 3.32Å; N284-Y319 WeakPolarHBondContact CA-O 3.27Å; N284-L336 HydrophobicContact CB-CD1 3.94Å; N284-L373 HydrophobicContact CB-CD2 4.19Å; N284-L373 WeakPolarHBondContact O-CD2 3.21Å; N284-V382 HydrophobicContact CB-CG1 4.43Å; N284-V382 WeakPolarHBondContact OD1-CB 3.45Å; N284-V382 WeakPolarHBondContact OD1-CG1 3.35Å; N284-S386 PolarHBondContact ND2-OG 3.42Å; N284-T387 PolarHBondContact N-O 3.31Å; N284-S388 CarbonylContact O-C 3.38Å; N284-S388 WeakPolarHBondContact O-CA 3.32Å; N284-I389 PolarHBondContact O-N 3.03Å
285	V	96.6	Very high	94.4	Very high	1 Å²	1	24 Å²	24	1%	0.006	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	125	-169.1	-170.6	0	0	0	0	111.5	K283 F287 M314 Y319 L320 N321 I389 I391	K283-V285 HydrophobicContact CB-CG2 4.13Å; K283-V285 HydrophobicContact CD-CG2 3.77Å; K283-V285 HydrophobicContact CG-CG2 3.89Å; V285-F287 HydrophobicContact CB-CE2 4.18Å; V285-F287 HydrophobicContact CB-CZ 4.33Å; V285-F287 HydrophobicContact CG1-CD1 4.25Å; V285-F287 HydrophobicContact CG1-CD2 4.14Å; V285-F287 HydrophobicContact CG1-CE1 3.87Å; V285-F287 HydrophobicContact CG1-CE2 3.76Å; V285-F287 HydrophobicContact CG1-CG 4.38Å; V285-F287 HydrophobicContact CG1-CZ 3.6Å; V285-M314 HydrophobicContact CB-CE 4.34Å; V285-M314 HydrophobicContact CG2-CE 4.34Å; V285-Y319 PolarHBondContact N-O 2.92Å; V285-L320 VanDerWaalsContact O-CA 3.27Å; V285-L320 WeakPolarHBondContact O-CA 3.43Å; V285-N321 PolarHBondContact O-N 2.82Å; V285-N321 VanDerWaalsContact O-N 3.11Å; V285-I389 WeakPolarHBondContact CA-O 3.42Å; V285-I391 HydrophobicContact CG1-CD1 4.01Å; V285-I391 HydrophobicContact CG1-CG1 4.36Å
286	A	97.8	Very high	94.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	111.1	167.7	0	0	0	0	0	109.5	I323 L373 I389 I391	A286-I323 HydrophobicContact CB-CD1 3.85Å; A286-L373 HydrophobicContact CB-CD1 3.89Å; A286-L373 HydrophobicContact CB-CD2 4.05Å; A286-L373 HydrophobicContact CB-CG 3.92Å; A286-I389 PolarHBondContact N-O 3.13Å; A286-I391 PolarHBondContact O-N 3.23Å
287	F	98.1	Very high	94.4	Very high	2 Å²	2	22 Å²	22	1%	0.009	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	109.9	173.1	-64.6	-77.1	0	0	0	109.4	V285 I289 L307 I310 M314 L320 N321 F322 I323 I391 Y464	V285-F287 HydrophobicContact CB-CE2 4.18Å; V285-F287 HydrophobicContact CB-CZ 4.33Å; V285-F287 HydrophobicContact CG1-CD1 4.25Å; V285-F287 HydrophobicContact CG1-CD2 4.14Å; V285-F287 HydrophobicContact CG1-CE1 3.87Å; V285-F287 HydrophobicContact CG1-CE2 3.76Å; V285-F287 HydrophobicContact CG1-CG 4.38Å; V285-F287 HydrophobicContact CG1-CZ 3.6Å; F287-I289 HydrophobicContact CB-CD1 4.18Å; F287-I289 HydrophobicContact CB-CG1 4.16Å; F287-L307 HydrophobicContact CD1-CD2 4.1Å; F287-L307 HydrophobicContact CE1-CD2 4.44Å; F287-L307 HydrophobicContact CG-CD2 4.48Å; F287-I310 HydrophobicContact CE1-CG2 4.05Å; F287-I310 HydrophobicContact CZ-CG2 3.64Å; F287-M314 HydrophobicContact CE2-CE 3.57Å; F287-M314 HydrophobicContact CZ-CE 3.7Å; F287-L320 HydrophobicContact CE2-CB 4.38Å; F287-L320 HydrophobicContact CE2-CD1 4.48Å; F287-N321 PolarHBondContact N-O 2.87Å; F287-F322 HydrophobicContact CB-CD1 3.57Å; F287-F322 HydrophobicContact CB-CE1 3.84Å; F287-F322 HydrophobicContact CB-CG 4.49Å; F287-F322 HydrophobicContact CD2-CD1 4.06Å; F287-F322 AromaticContact CD2-CE1 3.63Å; F287-F322 HydrophobicContact CD2-CE1 3.63Å; F287-F322 HydrophobicContact CD2-CZ 4.03Å; F287-F322 HydrophobicContact CE2-CE1 4.37Å; F287-F322 HydrophobicContact CE2-CZ 4.45Å; F287-F322 HydrophobicContact CG-CD1 4.09Å; F287-F322 AromaticContact CG-CE1 3.83Å; F287-F322 HydrophobicContact CG-CE1 3.83Å; F287-I323 PolarHBondContact O-N 3.36Å; F287-I391 WeakPolarHBondContact CA-O 3.35Å; F287-I391 HydrophobicContact CD1-CB 4.21Å; F287-I391 HydrophobicContact CD1-CD1 4.47Å; F287-I391 HydrophobicContact CE1-CD1 3.92Å; F287-Y464 HydrophobicContact CE1-CE2 4.46Å; F287-Y464 HydrophobicContact CZ-CE2 4.25Å
288	V	98.3	Very high	94.6	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	99.3	-179.5	-174.9	0	0	0	0	108	I323 F325 L366 V390 I391 M392 L393	V288-I323 CarbonylContact C-O 3.46Å; V288-I323 WeakPolarHBondContact CA-O 3.32Å; V288-I323 HydrophobicContact CG2-CB 4.28Å; V288-I323 HydrophobicContact CG2-CD1 4.39Å; V288-F325 HydrophobicContact CG1-CD1 3.61Å; V288-F325 HydrophobicContact CG1-CE1 3.71Å; V288-L366 HydrophobicContact CB-CD2 4.49Å; V288-L366 HydrophobicContact CG1-CD2 4.29Å; V288-L366 HydrophobicContact CG2-CD2 4.49Å; V288-V390 HydrophobicContact CG2-CG1 3.88Å; V288-I391 PolarHBondContact N-O 2.71Å; V288-M392 HydrophobicContact CB-CB 4.18Å; V288-M392 HydrophobicContact CB-CG 4.08Å; V288-M392 HydrophobicContact CG1-CG 4.06Å; V288-M392 CarbonylContact O-C 3.53Å; V288-M392 WeakPolarHBondContact O-CA 3.34Å; V288-L393 PolarHBondContact O-N 2.87Å
289	I	97.9	Very high	94.6	Very high	3 Å²	3	24 Å²	24	2%	0.015	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.7	-166.1	-51.7	-60.5	0	0	0	110.5	F287 T303 L307 I323 L324 F325 L393	F287-I289 HydrophobicContact CB-CD1 4.18Å; F287-I289 HydrophobicContact CB-CG1 4.16Å; I289-T303 HydrophobicContact CG2-CG2 3.91Å; I289-L307 HydrophobicContact CD1-CD1 4.34Å; I289-L307 HydrophobicContact CD1-CD2 4.34Å; I289-L307 HydrophobicContact CG1-CD1 4.15Å; I289-I323 PolarHBondContact N-O 3.16Å; I289-L324 HydrophobicContact CB-CD2 3.95Å; I289-L324 WeakPolarHBondContact O-CA 3.42Å; I289-F325 WeakPolarHBondContact O-CD1 3.21Å; I289-F325 PolarHBondContact O-N 3.03Å; I289-L393 HydrophobicContact CD1-CB 4Å
290	D	96.6	Very high	94.6	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	127.2	171.3	-162.6	-22.9	0	0	0	110.1	S292 M295 F325 T360 L393 T394	D290-S292 WeakPolarHBondContact OD1-CA 3.33Å; D290-S292 WeakPolarHBondContact OD1-CB 3.47Å; D290-S292 PolarHBondContact OD1-N 3.4Å; D290-S292 PolarHBondContact OD1-OG 2.87Å; D290-M295 HydrophobicContact CB-CG 4.35Å; D290-F325 HydrophobicContact CB-CE1 3.99Å; D290-F325 HydrophobicContact CB-CE2 3.74Å; D290-F325 HydrophobicContact CB-CZ 3.44Å; D290-F325 VanDerWaalsContact CB-CZ 3.44Å; D290-T360 WeakPolarHBondContact OD2-CG2 3.4Å; D290-L393 WeakPolarHBondContact CB-O 3.46Å; D290-L393 PolarHBondContact N-O 3.34Å; D290-T394 WeakPolarHBondContact OD2-CB 3.5Å; D290-T394 PolarHBondContact OD2-OG1 2.92Å
291	I	96.3	Very high	94.6	Very high	11 Å²	11	24.6 Å²	24.6	6%	0.056	15%	0.147	C	C	.	.			trans	-122.7	26.5	172.7	58.4	159.2	0	0	0	110.7	L300 L324 F325 D356 K357	I291-L300 HydrophobicContact CG2-CD1 4.45Å; I291-L324 HydrophobicContact CD1-CB 3.83Å; I291-L324 HydrophobicContact CD1-CD1 4.17Å; I291-L324 HydrophobicContact CG1-CB 4.09Å; I291-L324 HydrophobicContact CG2-CB 4.37Å; I291-L324 HydrophobicContact CG2-CD1 4.41Å; I291-L324 HydrophobicContact CG2-CD2 4.08Å; I291-F325 WeakPolarHBondContact CG1-O 3.29Å; I291-F325 PolarHBondContact N-O 3.01Å; I291-D356 CarbonylContact O-C 3.6Å; I291-D356 VanDerWaalsContact O-CA 3.26Å; I291-D356 WeakPolarHBondContact O-CA 3.37Å; I291-K357 PolarHBondContact O-N 3.08Å
292	S	93.6	Very high	94.5	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.007	15%	0.147	C	C	.	.	S	Bend	trans	-62.9	162.6	176.9	62.6	0	0	0	0	112.2	D290 S294 M295 K357 M359 T360	D290-S292 WeakPolarHBondContact OD1-CA 3.33Å; D290-S292 WeakPolarHBondContact OD1-CB 3.47Å; D290-S292 PolarHBondContact OD1-N 3.4Å; D290-S292 PolarHBondContact OD1-OG 2.87Å; S292-S294 PolarHBondContact O-N 2.86Å; S292-S294 PolarHBondContact OG-OG 2.97Å; S292-M295 WeakPolarHBondContact O-CB 3.29Å; S292-M295 PolarHBondContact O-N 2.78Å; S292-K357 WeakPolarHBondContact CA-O 3.49Å; S292-M359 WeakPolarHBondContact CB-O 3.39Å; S292-T360 WeakPolarHBondContact CB-OG1 3.46Å
293	G	90.7	Very high	94.5	Very high	37 Å²	37	23.7 Å²	23.7	38%	0.381	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-59.7	-20.2	-178.4	0	0	0	0	0	114.6	M295 A296 G358	G293-M295 VanDerWaalsContact C-N 3.29Å; G293-A296 VanDerWaalsContact O-CB 3.31Å; G293-A296 WeakPolarHBondContact O-CB 3.28Å; G293-A296 PolarHBondContact O-N 2.89Å; G293-G358 PolarHBondContact N-O 3.36Å; G293-G358 VanDerWaalsContact N-O 3.08Å
294	S	90.8	Very high	94.5	Very high	58 Å²	58	25.6 Å²	25.6	41%	0.406	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-70.6	-25.2	174.8	43.3	0	0	0	0	113	S292 A296 K299 D395	S292-S294 PolarHBondContact O-N 2.86Å; S292-S294 PolarHBondContact OG-OG 2.97Å; S294-A296 PolarHBondContact O-N 3.48Å; S294-K299 WeakPolarHBondContact O-CE 3.41Å; S294-K299 PolarHBondContact O-NZ 3.11Å; S294-D395 WeakPolarHBondContact CB-OD2 3.34Å; S294-D395 VanDerWaalsContact O-OD2 3.04Å; S294-D395 VanDerWaalsContact OG-CG 3.32Å; S294-D395 PolarHBondContact OG-OD1 3.2Å; S294-D395 PolarHBondContact OG-OD2 3.16Å
295	M	93.3	Very high	94.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-72.4	-10.4	176.7	-69.5	-70	-73.8	0	0	113.2	D290 S292 G293 K299 L300 T303 L393 D395	D290-M295 HydrophobicContact CB-CG 4.35Å; S292-M295 WeakPolarHBondContact O-CB 3.29Å; S292-M295 PolarHBondContact O-N 2.78Å; G293-M295 VanDerWaalsContact C-N 3.29Å; M295-K299 HydrophobicContact CE-CB 4.4Å; M295-K299 HydrophobicContact SD-CB 4.15Å; M295-L300 HydrophobicContact CB-CB 4.39Å; M295-L300 WeakPolarHBondContact O-CB 3.25Å; M295-L300 PolarHBondContact O-N 3.42Å; M295-T303 WeakPolarHBondContact CE-OG1 3.31Å; M295-L393 HydrophobicContact CE-CD2 3.48Å; M295-L393 VanDerWaalsContact CE-CD2 3.48Å; M295-L393 HydrophobicContact SD-CD2 4.39Å; M295-D395 HydrophobicContact CG-CB 4.45Å; M295-D395 PolarHBondContact N-OD2 3.24Å; M295-D395 HydrophobicContact SD-CB 3.5Å; M295-D395 WeakPolarHBondContact SD-CB 3.49Å
296	A	91.9	Very high	94.2	Very high	44 Å²	44	30.6 Å²	30.6	36%	0.364	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	144	-176.1	0	0	0	0	0	113.5	G293 S294 D356	G293-A296 VanDerWaalsContact O-CB 3.31Å; G293-A296 WeakPolarHBondContact O-CB 3.28Å; G293-A296 PolarHBondContact O-N 2.89Å; S294-A296 PolarHBondContact O-N 3.48Å; A296-D356 HydrophobicContact CB-CB 4.25Å
297	G	91.9	Very high	94.1	Very high	40 Å²	40	31 Å²	31	41%	0.412	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.2	-131.3	-178.6	0	0	0	0	0	112.6	K299 L300 E301	G297-K299 VanDerWaalsContact C-N 3.32Å; G297-K299 PolarHBondContact O-N 3.16Å; G297-L300 PolarHBondContact O-N 3.02Å; G297-E301 WeakPolarHBondContact O-CG 3.44Å; G297-E301 PolarHBondContact O-N 3.03Å; G297-E301 VanDerWaalsContact O-N 3.12Å
298	R	91	Very high	94	Very high	136 Å²	136	32.6 Å²	32.6	51%	0.513	18%	0.182	S	C	.	.	H	α-helix	trans	-60.7	-35.8	-166.8	-161.4	-174.3	-171.5	161.5	12.6	113.8	E301 Q302	R298-E301 PolarHBondContact O-N 2.99Å; R298-Q302 HydrophobicContact CG-CG 4.14Å; R298-Q302 WeakPolarHBondContact O-CB 3.28Å; R298-Q302 VanDerWaalsContact O-CG 3.28Å; R298-Q302 WeakPolarHBondContact O-CG 3.47Å; R298-Q302 PolarHBondContact O-N 3.11Å; R298-Q302 PolarHBondContact O-OE1 3.19Å
299	K	92.8	Very high	93.6	Very high	24 Å²	24	38.5 Å²	38.5	10%	0.104	21%	0.205	C	C	.	.	H	α-helix	trans	-63.5	-48.3	-178.5	-75.7	-176.6	-78	-175.4	0	112	S294 M295 G297 T303 D395 F427 E452	S294-K299 WeakPolarHBondContact O-CE 3.41Å; S294-K299 PolarHBondContact O-NZ 3.11Å; M295-K299 HydrophobicContact CE-CB 4.4Å; M295-K299 HydrophobicContact SD-CB 4.15Å; G297-K299 VanDerWaalsContact C-N 3.32Å; G297-K299 PolarHBondContact O-N 3.16Å; K299-T303 VanDerWaalsContact O-CB 3.32Å; K299-T303 WeakPolarHBondContact O-CB 3.35Å; K299-T303 PolarHBondContact O-N 3.42Å; K299-T303 PolarHBondContact O-OG1 2.89Å; K299-D395 HydrophobicContact CD-CB 4.16Å; K299-D395 WeakPolarHBondContact CE-OD2 3.44Å; K299-D395 IonicContact NZ-OD2 3.87Å; K299-D395 PolarHBondContact NZ-OD2 3.39Å; K299-F427 HydrophobicContact CB-CE1 4.26Å; K299-F427 HydrophobicContact CB-CZ 4.3Å; K299-F427 HydrophobicContact CD-CD2 4.18Å; K299-F427 HydrophobicContact CD-CE2 4.45Å; K299-F427 HydrophobicContact CD-CG 4.46Å; K299-F427 HydrophobicContact CG-CD2 4.06Å; K299-F427 HydrophobicContact CG-CE1 4.38Å; K299-F427 HydrophobicContact CG-CE2 3.86Å; K299-F427 HydrophobicContact CG-CG 4.43Å; K299-F427 HydrophobicContact CG-CZ 4.02Å; K299-E452 HydrophobicContact CD-CG 4.07Å; K299-E452 HydrophobicContact CG-CG 4.26Å; K299-E452 IonicContact NZ-OE1 2.75Å
300	L	94.6	Very high	93.4	Very high	10 Å²	10	39 Å²	39	5%	0.052	21%	0.207	C	C	.	.	H	α-helix	trans	-67.1	-38.8	175.6	-176.1	60.9	0	0	0	111.7	I291 M295 G297 T303 K304 D356	I291-L300 HydrophobicContact CG2-CD1 4.45Å; M295-L300 HydrophobicContact CB-CB 4.39Å; M295-L300 WeakPolarHBondContact O-CB 3.25Å; M295-L300 PolarHBondContact O-N 3.42Å; G297-L300 PolarHBondContact O-N 3.02Å; L300-T303 PolarHBondContact O-N 2.79Å; L300-K304 VanDerWaalsContact O-CG 3.29Å; L300-K304 WeakPolarHBondContact O-CG 3.25Å; L300-K304 PolarHBondContact O-N 2.9Å; L300-D356 HydrophobicContact CD2-CB 4.23Å
301	E	93.8	Very high	93.2	Very high	119 Å²	119	39 Å²	39	56%	0.556	21%	0.207	S	C	*	.	H	α-helix	trans	-58.7	-51.2	174.5	-72.7	172.4	178.2	0	0	111.7	G297 R298 T303 K304 E305	G297-E301 WeakPolarHBondContact O-CG 3.44Å; G297-E301 PolarHBondContact O-N 3.03Å; G297-E301 VanDerWaalsContact O-N 3.12Å; R298-E301 PolarHBondContact O-N 2.99Å; E301-T303 VanDerWaalsContact C-N 3.33Å; E301-T303 PolarHBondContact O-N 3.26Å; E301-K304 WeakPolarHBondContact O-CB 3.45Å; E301-K304 PolarHBondContact O-N 2.88Å; E301-E305 WeakPolarHBondContact O-CG 3.44Å; E301-E305 PolarHBondContact O-N 3.28Å
302	Q	92.4	Very high	93	Very high	7 Å²	7	43.8 Å²	43.8	3%	0.033	23%	0.229	C	C	.	.	H	α-helix	trans	-65.5	-35.8	178.6	-71.6	174.1	-45.8	0	0	112.4	R298 E305 A306 F427 D453 A456	R298-Q302 HydrophobicContact CG-CG 4.14Å; R298-Q302 WeakPolarHBondContact O-CB 3.28Å; R298-Q302 VanDerWaalsContact O-CG 3.28Å; R298-Q302 WeakPolarHBondContact O-CG 3.47Å; R298-Q302 PolarHBondContact O-N 3.11Å; R298-Q302 PolarHBondContact O-OE1 3.19Å; Q302-E305 PolarHBondContact O-N 2.93Å; Q302-A306 WeakPolarHBondContact O-CB 3.46Å; Q302-A306 PolarHBondContact O-N 2.7Å; Q302-F427 HydrophobicContact CB-CZ 4.27Å; Q302-D453 PolarHBondContact NE2-O 2.73Å; Q302-A456 HydrophobicContact CB-CB 4.41Å
303	T	94.8	Very high	92.7	Very high	2 Å²	2	48 Å²	48	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-46	173.2	-60.3	0	0	0	0	110.7	I289 M295 K299 L300 E301 A306 L307 L393	I289-T303 HydrophobicContact CG2-CG2 3.91Å; M295-T303 WeakPolarHBondContact CE-OG1 3.31Å; K299-T303 VanDerWaalsContact O-CB 3.32Å; K299-T303 WeakPolarHBondContact O-CB 3.35Å; K299-T303 PolarHBondContact O-N 3.42Å; K299-T303 PolarHBondContact O-OG1 2.89Å; L300-T303 PolarHBondContact O-N 2.79Å; E301-T303 VanDerWaalsContact C-N 3.33Å; E301-T303 PolarHBondContact O-N 3.26Å; T303-A306 PolarHBondContact O-N 2.81Å; T303-L307 HydrophobicContact CG2-CD1 4.19Å; T303-L307 HydrophobicContact CG2-CG 4.48Å; T303-L307 WeakPolarHBondContact O-CB 3.24Å; T303-L307 VanDerWaalsContact O-CG 3.29Å; T303-L307 WeakPolarHBondContact O-CG 3.19Å; T303-L307 PolarHBondContact O-N 3.4Å; T303-L393 HydrophobicContact CG2-CD1 4.08Å; T303-L393 HydrophobicContact CG2-CD2 4.15Å
304	K	95.8	Very high	92.7	Very high	42 Å²	42	47 Å²	47	18%	0.183	24%	0.237	C	C	.	.	H	α-helix	trans	-61.7	-45.6	176	-72.9	174.2	176.2	-174.3	0	111.8	L300 E301 A306 L307 L308 V351 K352 M354	L300-K304 VanDerWaalsContact O-CG 3.29Å; L300-K304 WeakPolarHBondContact O-CG 3.25Å; L300-K304 PolarHBondContact O-N 2.9Å; E301-K304 WeakPolarHBondContact O-CB 3.45Å; E301-K304 PolarHBondContact O-N 2.88Å; K304-A306 PolarHBondContact O-N 3.14Å; K304-L307 PolarHBondContact O-N 2.85Å; K304-L308 WeakPolarHBondContact O-CB 3.35Å; K304-L308 WeakPolarHBondContact O-CG 3.41Å; K304-L308 PolarHBondContact O-N 2.89Å; K304-V351 HydrophobicContact CB-CG1 4.09Å; K304-V351 WeakPolarHBondContact CE-O 3.22Å; K304-V351 HydrophobicContact CG-CG1 4.15Å; K304-K352 PolarHBondContact NZ-O 2.91Å; K304-M354 WeakPolarHBondContact CE-O 3.33Å; K304-M354 PolarHBondContact NZ-O 2.62Å
305	E	93.5	Very high	92.8	Very high	104 Å²	104	47.9 Å²	47.9	49%	0.486	23%	0.234	S	C	.	.	H	α-helix	trans	-59.2	-46.4	178.4	-73.8	175.6	167.3	0	0	111.6	E301 Q302 L308 R309 D457	E301-E305 WeakPolarHBondContact O-CG 3.44Å; E301-E305 PolarHBondContact O-N 3.28Å; Q302-E305 PolarHBondContact O-N 2.93Å; E305-L308 PolarHBondContact O-N 2.77Å; E305-R309 PolarHBondContact O-N 3.35Å; E305-R309 VanDerWaalsContact O-N 3.09Å; E305-D457 HydrophobicContact CB-CB 4.43Å
306	A	93.1	Very high	92.9	Very high	2 Å²	2	53.2 Å²	53.2	2%	0.017	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-46.5	175.8	0	0	0	0	0	112.3	Q302 T303 K304 L308 R309 I310 L460	Q302-A306 WeakPolarHBondContact O-CB 3.46Å; Q302-A306 PolarHBondContact O-N 2.7Å; T303-A306 PolarHBondContact O-N 2.81Å; K304-A306 PolarHBondContact O-N 3.14Å; A306-L308 VanDerWaalsContact C-N 3.32Å; A306-L308 PolarHBondContact O-N 2.58Å; A306-R309 WeakPolarHBondContact O-CB 3.35Å; A306-R309 PolarHBondContact O-N 2.9Å; A306-R309 VanDerWaalsContact O-N 3.17Å; A306-I310 WeakPolarHBondContact O-CB 3.23Å; A306-I310 VanDerWaalsContact O-CG1 3.24Å; A306-I310 WeakPolarHBondContact O-CG1 3.41Å; A306-I310 PolarHBondContact O-N 3.46Å; A306-L460 HydrophobicContact CB-CB 3.47Å; A306-L460 VanDerWaalsContact CB-CB 3.47Å; A306-L460 HydrophobicContact CB-CD1 3.59Å; A306-L460 HydrophobicContact CB-CG 4.17Å
307	L	95.1	Very high	93	Very high	9 Å²	9	56.2 Å²	56.2	5%	0.047	27%	0.265	C	S	.	.	H	α-helix	trans	-61.6	-39.8	177.5	-71.8	179.3	0	0	0	112.2	F287 I289 T303 K304 R309 I310 L311 F322 V351 M354	F287-L307 HydrophobicContact CD1-CD2 4.1Å; F287-L307 HydrophobicContact CE1-CD2 4.44Å; F287-L307 HydrophobicContact CG-CD2 4.48Å; I289-L307 HydrophobicContact CD1-CD1 4.34Å; I289-L307 HydrophobicContact CD1-CD2 4.34Å; I289-L307 HydrophobicContact CG1-CD1 4.15Å; T303-L307 HydrophobicContact CG2-CD1 4.19Å; T303-L307 HydrophobicContact CG2-CG 4.48Å; T303-L307 WeakPolarHBondContact O-CB 3.24Å; T303-L307 VanDerWaalsContact O-CG 3.29Å; T303-L307 WeakPolarHBondContact O-CG 3.19Å; T303-L307 PolarHBondContact O-N 3.4Å; K304-L307 PolarHBondContact O-N 2.85Å; L307-R309 VanDerWaalsContact C-N 3.29Å; L307-R309 PolarHBondContact O-N 3.48Å; L307-I310 HydrophobicContact CD2-CD1 4.36Å; L307-I310 PolarHBondContact O-N 3.04Å; L307-L311 VanDerWaalsContact O-CG 3.29Å; L307-L311 WeakPolarHBondContact O-CG 3.4Å; L307-L311 PolarHBondContact O-N 3.37Å; L307-F322 HydrophobicContact CD1-CD1 4.41Å; L307-F322 HydrophobicContact CD1-CE1 4.01Å; L307-F322 HydrophobicContact CD2-CE1 3.99Å; L307-F322 HydrophobicContact CG-CE1 4.43Å; L307-V351 HydrophobicContact CB-CG1 3.91Å; L307-V351 HydrophobicContact CB-CG2 4.31Å; L307-V351 HydrophobicContact CD1-CG1 4.32Å; L307-M354 HydrophobicContact CD1-CE 4.02Å; L307-M354 HydrophobicContact CD1-SD 4.36Å
308	L	95.4	Very high	93.2	Very high	35 Å²	35	54.4 Å²	54.4	18%	0.183	25%	0.246	C	C	.	.	H	α-helix	trans	-62.3	-39	176.1	-71.9	172.5	0	0	0	111.7	K304 E305 A306 L311 E312 R348 V351 K352	K304-L308 WeakPolarHBondContact O-CB 3.35Å; K304-L308 WeakPolarHBondContact O-CG 3.41Å; K304-L308 PolarHBondContact O-N 2.89Å; E305-L308 PolarHBondContact O-N 2.77Å; A306-L308 VanDerWaalsContact C-N 3.32Å; A306-L308 PolarHBondContact O-N 2.58Å; L308-L311 PolarHBondContact O-N 2.89Å; L308-E312 PolarHBondContact O-N 2.94Å; L308-R348 HydrophobicContact CD2-CB 3.86Å; L308-R348 HydrophobicContact CD2-CG 3.84Å; L308-V351 HydrophobicContact CD2-CB 4.18Å; L308-V351 HydrophobicContact CD2-CG1 4.12Å; L308-V351 HydrophobicContact CG-CG1 4Å; L308-K352 HydrophobicContact CD1-CG 4.18Å; L308-K352 HydrophobicContact CD2-CG 4.37Å
309	R	91.3	Very high	93.5	Very high	124 Å²	124	49.8 Å²	49.8	47%	0.468	23%	0.229	S	C	.	.	H	α-helix	trans	-67.4	-44.9	175.8	-154	116.5	169.8	103.5	-2.6	112	E305 A306 L307 L311 E312 Q461	E305-R309 PolarHBondContact O-N 3.35Å; E305-R309 VanDerWaalsContact O-N 3.09Å; A306-R309 WeakPolarHBondContact O-CB 3.35Å; A306-R309 PolarHBondContact O-N 2.9Å; A306-R309 VanDerWaalsContact O-N 3.17Å; L307-R309 VanDerWaalsContact C-N 3.29Å; L307-R309 PolarHBondContact O-N 3.48Å; R309-L311 PolarHBondContact O-N 3.48Å; R309-E312 IonicContact NH1-OE2 3.19Å; R309-E312 PolarHBondContact NH1-OE2 3.27Å; R309-E312 WeakPolarHBondContact O-CA 3.47Å; R309-E312 VanDerWaalsContact O-CB 3.28Å; R309-E312 WeakPolarHBondContact O-CB 3.49Å; R309-E312 PolarHBondContact O-N 3.41Å; R309-Q461 HydrophobicContact CB-CG 3.95Å; R309-Q461 VanDerWaalsContact CD-CD 3.44Å; R309-Q461 HydrophobicContact CG-CG 3.92Å; R309-Q461 VanDerWaalsContact NE-OE1 3.08Å
310	I	92	Very high	93.7	Very high	13 Å²	13	48.7 Å²	48.7	7%	0.067	22%	0.224	C	C	.	.	H	α-helix	trans	-55.8	-40.1	175.4	-73.4	170.9	0	0	0	111.2	F287 A306 L307 E312 D313 M314 Y464	F287-I310 HydrophobicContact CE1-CG2 4.05Å; F287-I310 HydrophobicContact CZ-CG2 3.64Å; A306-I310 WeakPolarHBondContact O-CB 3.23Å; A306-I310 VanDerWaalsContact O-CG1 3.24Å; A306-I310 WeakPolarHBondContact O-CG1 3.41Å; A306-I310 PolarHBondContact O-N 3.46Å; L307-I310 HydrophobicContact CD2-CD1 4.36Å; L307-I310 PolarHBondContact O-N 3.04Å; I310-E312 PolarHBondContact O-N 2.81Å; I310-D313 PolarHBondContact O-N 2.92Å; I310-M314 PolarHBondContact O-N 3.14Å; I310-Y464 HydrophobicContact CB-CD1 4.18Å; I310-Y464 HydrophobicContact CB-CE1 4.29Å; I310-Y464 HydrophobicContact CB-CG 4.41Å; I310-Y464 HydrophobicContact CD1-CD1 4.46Å; I310-Y464 HydrophobicContact CD1-CD2 4.2Å; I310-Y464 HydrophobicContact CD1-CG 3.9Å; I310-Y464 HydrophobicContact CG1-CD1 3.7Å; I310-Y464 HydrophobicContact CG1-CD2 4.26Å; I310-Y464 HydrophobicContact CG1-CE1 4.31Å; I310-Y464 HydrophobicContact CG1-CG 3.65Å; I310-Y464 HydrophobicContact CG2-CD1 3.93Å; I310-Y464 HydrophobicContact CG2-CD2 4Å; I310-Y464 HydrophobicContact CG2-CE1 3.69Å; I310-Y464 HydrophobicContact CG2-CE2 3.78Å; I310-Y464 HydrophobicContact CG2-CG 4.07Å
311	L	94	Very high	93.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-17	175.9	-69.5	176.4	0	0	0	113.8	L307 L308 R309 M314 L320 F322 L344 A347 R348 V351	L307-L311 VanDerWaalsContact O-CG 3.29Å; L307-L311 WeakPolarHBondContact O-CG 3.4Å; L307-L311 PolarHBondContact O-N 3.37Å; L308-L311 PolarHBondContact O-N 2.89Å; R309-L311 PolarHBondContact O-N 3.48Å; L311-M314 HydrophobicContact CD2-SD 3.94Å; L311-L320 HydrophobicContact CD2-CD1 3.52Å; L311-F322 HydrophobicContact CD1-CZ 4.26Å; L311-F322 HydrophobicContact CD2-CE2 4.35Å; L311-F322 HydrophobicContact CD2-CZ 4.05Å; L311-F322 HydrophobicContact CG-CZ 4.38Å; L311-L344 HydrophobicContact CD2-CD2 3.9Å; L311-A347 HydrophobicContact CD1-CB 3.82Å; L311-A347 HydrophobicContact CD2-CB 4.18Å; L311-R348 HydrophobicContact CD1-CG 3.89Å; L311-V351 HydrophobicContact CD1-CG2 4.08Å
312	E	90.9	Very high	94.1	Very high	112 Å²	112	42.6 Å²	42.6	52%	0.523	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-29.8	172.9	-63.7	174.4	167	0	0	111.6	L308 R309 I310	L308-E312 PolarHBondContact O-N 2.94Å; R309-E312 IonicContact NH1-OE2 3.19Å; R309-E312 PolarHBondContact NH1-OE2 3.27Å; R309-E312 WeakPolarHBondContact O-CA 3.47Å; R309-E312 VanDerWaalsContact O-CB 3.28Å; R309-E312 WeakPolarHBondContact O-CB 3.49Å; R309-E312 PolarHBondContact O-N 3.41Å; I310-E312 PolarHBondContact O-N 2.81Å
313	D	87.6	Confident	94.3	Very high	91 Å²	91	42.2 Å²	42.2	49%	0.487	19%	0.194	S	C	.	.	S	Bend	trans	-94.4	-1	-176.4	-64.5	-29.5	0	0	0	113.8	I310	I310-D313 PolarHBondContact O-N 2.92Å
314	M	91.6	Very high	94.5	Very high	15 Å²	15	42.6 Å²	42.6	7%	0.074	20%	0.196	C	C	.	.			trans	-72.7	136.9	177.3	-75.3	-162.3	145.9	0	0	111.9	V285 F287 I310 L311 L320 A339 L344	V285-M314 HydrophobicContact CB-CE 4.34Å; V285-M314 HydrophobicContact CG2-CE 4.34Å; F287-M314 HydrophobicContact CE2-CE 3.57Å; F287-M314 HydrophobicContact CZ-CE 3.7Å; I310-M314 PolarHBondContact O-N 3.14Å; L311-M314 HydrophobicContact CD2-SD 3.94Å; M314-L320 HydrophobicContact CE-CB 3.97Å; M314-L320 HydrophobicContact CE-CD1 4.46Å; M314-L320 HydrophobicContact SD-CB 4.1Å; M314-L320 HydrophobicContact SD-CD1 3.84Å; M314-L320 HydrophobicContact SD-CD2 3.79Å; M314-L320 HydrophobicContact SD-CG 4.12Å; M314-A339 HydrophobicContact CB-CB 4.3Å; M314-L344 HydrophobicContact CB-CD2 4.24Å; M314-L344 HydrophobicContact SD-CD2 4.43Å
315	K	92.6	Very high	94.5	Very high	77 Å²	77	40.6 Å²	40.6	34%	0.335	19%	0.187	S	C	.	.			trans	-90.9	152.6	178.2	-56.8	-174.9	-178	-177.3	0	110.2	E317 D318 A339	K315-E317 WeakPolarHBondContact CB-OE2 3.3Å; K315-E317 PolarHBondContact O-N 3.32Å; K315-E317 VanDerWaalsContact O-N 3.16Å; K315-D318 PolarHBondContact N-OD2 3.18Å; K315-D318 VanDerWaalsContact O-CB 3.26Å; K315-D318 WeakPolarHBondContact O-CB 3.49Å; K315-D318 PolarHBondContact O-N 2.99Å; K315-A339 WeakPolarHBondContact O-CB 3.31Å
316	E	94.4	Very high	94.5	Very high	111 Å²	111	35.9 Å²	35.9	52%	0.519	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-23.7	-176.2	-170.6	171.7	178.6	0	0	112.8	D318 Q338	E316-D318 VanDerWaalsContact C-N 3.28Å; E316-D318 PolarHBondContact O-N 3.47Å; E316-Q338 WeakPolarHBondContact O-CG 3.02Å; E316-Q338 PolarHBondContact O-NE2 2.62Å
317	E	93.7	Very high	94.2	Very high	108 Å²	108	36.8 Å²	36.8	51%	0.505	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-12.3	174.9	-55.7	79.7	-173	0	0	113.6	P282 K315	P282-E317 HydrophobicContact CB-CB 4.12Å; P282-E317 HydrophobicContact CG-CB 4.08Å; K315-E317 WeakPolarHBondContact CB-OE2 3.3Å; K315-E317 PolarHBondContact O-N 3.32Å; K315-E317 VanDerWaalsContact O-N 3.16Å
318	D	95.9	Very high	94	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	20%	0.2	C	C	.	.			trans	-78.6	154.9	179.7	-63.3	-32.4	0	0	0	111.7	K283 K315 E316 Q338 A339	K283-D318 HydrophobicContact CG-CB 4.28Å; K283-D318 VanDerWaalsContact CG-OD1 3.23Å; K283-D318 WeakPolarHBondContact CG-OD1 3.24Å; K283-D318 PolarHBondContact N-OD1 2.85Å; K283-D318 IonicContact NZ-OD1 4Å; K283-D318 IonicContact NZ-OD2 2.63Å; K283-D318 PolarHBondContact NZ-OD2 2.94Å; K283-D318 WeakPolarHBondContact O-CA 3.45Å; K315-D318 PolarHBondContact N-OD2 3.18Å; K315-D318 VanDerWaalsContact O-CB 3.26Å; K315-D318 WeakPolarHBondContact O-CB 3.49Å; K315-D318 PolarHBondContact O-N 2.99Å; E316-D318 VanDerWaalsContact C-N 3.28Å; E316-D318 PolarHBondContact O-N 3.47Å; D318-Q338 CarbonylContact O-C 3.51Å; D318-Q338 WeakPolarHBondContact O-CA 3.25Å; D318-A339 HydrophobicContact CB-CB 4.35Å; D318-A339 WeakPolarHBondContact O-CB 3.39Å; D318-A339 PolarHBondContact O-N 3.37Å
319	Y	97.5	Very high	94	Very high	40 Å²	40	41.7 Å²	41.7	16%	0.157	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	140.8	174	-73.5	-108.4	0	0	0	109.8	K283 N284 V285 L336 V337 Q338 R381 V382 P383	K283-Y319 PolarHBondContact O-N 3.37Å; N284-Y319 CarbonylContact C-O 3.52Å; N284-Y319 VanDerWaalsContact CA-O 3.32Å; N284-Y319 WeakPolarHBondContact CA-O 3.27Å; V285-Y319 PolarHBondContact N-O 2.92Å; Y319-L336 HydrophobicContact CD1-CB 4.44Å; Y319-V337 CarbonylContact C-O 2.85Å; Y319-V337 VanDerWaalsContact CA-O 3.29Å; Y319-V337 WeakPolarHBondContact CA-O 3.44Å; Y319-Q338 HydrophobicContact CD1-CB 4.15Å; Y319-Q338 HydrophobicContact CE1-CB 3.78Å; Y319-Q338 HydrophobicContact CE1-CG 4.46Å; Y319-Q338 HydrophobicContact CE2-CB 4.36Å; Y319-Q338 HydrophobicContact CE2-CG 4.18Å; Y319-R381 WeakPolarHBondContact CE1-O 3.46Å; Y319-V382 HydrophobicContact CD1-CG1 3.95Å; Y319-V382 HydrophobicContact CD2-CG1 4.29Å; Y319-V382 HydrophobicContact CE1-CG1 4.42Å; Y319-V382 HydrophobicContact CG-CG1 3.88Å; Y319-P383 HydrophobicContact CE2-CG 4.07Å
320	L	97.4	Very high	94.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	161.7	-179.3	73.1	146.6	0	0	0	113.8	V285 F287 L311 M314 F322 W332 V337 A339 L344	V285-L320 VanDerWaalsContact O-CA 3.27Å; V285-L320 WeakPolarHBondContact O-CA 3.43Å; F287-L320 HydrophobicContact CE2-CB 4.38Å; F287-L320 HydrophobicContact CE2-CD1 4.48Å; L311-L320 HydrophobicContact CD2-CD1 3.52Å; M314-L320 HydrophobicContact CE-CB 3.97Å; M314-L320 HydrophobicContact CE-CD1 4.46Å; M314-L320 HydrophobicContact SD-CB 4.1Å; M314-L320 HydrophobicContact SD-CD1 3.84Å; M314-L320 HydrophobicContact SD-CD2 3.79Å; M314-L320 HydrophobicContact SD-CG 4.12Å; L320-F322 HydrophobicContact CD1-CE2 3.75Å; L320-F322 HydrophobicContact CD1-CZ 4.14Å; L320-W332 HydrophobicContact CD1-CZ3 4.42Å; L320-W332 HydrophobicContact CG-CZ3 4.49Å; L320-V337 PolarHBondContact N-O 2.97Å; L320-V337 WeakPolarHBondContact O-CG2 3.3Å; L320-V337 PolarHBondContact O-N 3.32Å; L320-A339 HydrophobicContact CD2-CB 3.74Å; L320-L344 HydrophobicContact CD2-CD2 4.33Å
321	N	98	Very high	94.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	160.4	158.7	-155.1	-14	0	0	0	111.2	V285 F287 K333 H335 L336 M372	V285-N321 PolarHBondContact O-N 2.82Å; V285-N321 VanDerWaalsContact O-N 3.11Å; F287-N321 PolarHBondContact N-O 2.87Å; N321-K333 PolarHBondContact ND2-O 3.45Å; N321-K333 PolarHBondContact OD1-N 3.19Å; N321-H335 PolarHBondContact ND2-O 3.34Å; N321-L336 HydrophobicContact CB-CD2 4.06Å; N321-M372 HydrophobicContact CB-SD 3.61Å; N321-M372 VanDerWaalsContact ND2-CE 3.29Å; N321-M372 WeakPolarHBondContact ND2-CE 3.29Å; N321-M372 PolarHBondContact ND2-SD 3.05Å
322	F	98.4	Very high	94.6	Very high	1 Å²	1	41.2 Å²	41.2	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	129	174.5	-64.1	-81.9	0	0	0	110.4	F287 L307 L311 L320 T331 W332 A347 F350 V351 M354	F287-F322 HydrophobicContact CB-CD1 3.57Å; F287-F322 HydrophobicContact CB-CE1 3.84Å; F287-F322 HydrophobicContact CB-CG 4.49Å; F287-F322 HydrophobicContact CD2-CD1 4.06Å; F287-F322 AromaticContact CD2-CE1 3.63Å; F287-F322 HydrophobicContact CD2-CE1 3.63Å; F287-F322 HydrophobicContact CD2-CZ 4.03Å; F287-F322 HydrophobicContact CE2-CE1 4.37Å; F287-F322 HydrophobicContact CE2-CZ 4.45Å; F287-F322 HydrophobicContact CG-CD1 4.09Å; F287-F322 AromaticContact CG-CE1 3.83Å; F287-F322 HydrophobicContact CG-CE1 3.83Å; L307-F322 HydrophobicContact CD1-CD1 4.41Å; L307-F322 HydrophobicContact CD1-CE1 4.01Å; L307-F322 HydrophobicContact CD2-CE1 3.99Å; L307-F322 HydrophobicContact CG-CE1 4.43Å; L311-F322 HydrophobicContact CD1-CZ 4.26Å; L311-F322 HydrophobicContact CD2-CE2 4.35Å; L311-F322 HydrophobicContact CD2-CZ 4.05Å; L311-F322 HydrophobicContact CG-CZ 4.38Å; L320-F322 HydrophobicContact CD1-CE2 3.75Å; L320-F322 HydrophobicContact CD1-CZ 4.14Å; F322-T331 WeakPolarHBondContact O-CA 3.48Å; F322-W332 HydrophobicContact CB-CB 4.14Å; F322-W332 HydrophobicContact CD2-CD2 4.38Å; F322-W332 AromaticContact CD2-CE3 3.86Å; F322-W332 HydrophobicContact CD2-CE3 3.86Å; F322-W332 HydrophobicContact CE2-CE3 4.4Å; F322-W332 PolarHBondContact O-N 3.36Å; F322-A347 HydrophobicContact CE2-CB 4.05Å; F322-F350 HydrophobicContact CB-CD1 4.16Å; F322-F350 HydrophobicContact CB-CE1 3.63Å; F322-F350 HydrophobicContact CD2-CD1 4.13Å; F322-F350 HydrophobicContact CD2-CE1 4.46Å; F322-F350 HydrophobicContact CG-CD1 4.28Å; F322-F350 HydrophobicContact CG-CE1 4.19Å; F322-V351 HydrophobicContact CE1-CG2 4.15Å; F322-V351 HydrophobicContact CE2-CG2 4.09Å; F322-V351 HydrophobicContact CZ-CG2 3.81Å; F322-M354 HydrophobicContact CD1-CE 4.06Å; F322-M354 HydrophobicContact CG-CE 4.29Å
323	I	98.3	Very high	94.9	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	108.5	174.4	-58	82.2	0	0	0	106.3	A286 F287 V288 I289 V329 S330 T331 R368	A286-I323 HydrophobicContact CB-CD1 3.85Å; F287-I323 PolarHBondContact O-N 3.36Å; V288-I323 CarbonylContact C-O 3.46Å; V288-I323 WeakPolarHBondContact CA-O 3.32Å; V288-I323 HydrophobicContact CG2-CB 4.28Å; V288-I323 HydrophobicContact CG2-CD1 4.39Å; I289-I323 PolarHBondContact N-O 3.16Å; I323-V329 HydrophobicContact CG2-CG1 3.66Å; I323-S330 CarbonylContact C-O 3.45Å; I323-S330 WeakPolarHBondContact CA-O 3.27Å; I323-T331 HydrophobicContact CG1-CG2 4.11Å; I323-T331 HydrophobicContact CG2-CG2 4.41Å; I323-R368 HydrophobicContact CG2-CB 4.22Å; I323-R368 HydrophobicContact CG2-CG 4.17Å
324	L	97.5	Very high	95.2	Very high	9 Å²	9	41.9 Å²	41.9	5%	0.047	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	129.3	177.3	-53.1	-176.1	0	0	0	108.9	I289 I291 V329 S330 F350 M354	I289-L324 HydrophobicContact CB-CD2 3.95Å; I289-L324 WeakPolarHBondContact O-CA 3.42Å; I291-L324 HydrophobicContact CD1-CB 3.83Å; I291-L324 HydrophobicContact CD1-CD1 4.17Å; I291-L324 HydrophobicContact CG1-CB 4.09Å; I291-L324 HydrophobicContact CG2-CB 4.37Å; I291-L324 HydrophobicContact CG2-CD1 4.41Å; I291-L324 HydrophobicContact CG2-CD2 4.08Å; L324-V329 WeakPolarHBondContact O-CA 3.45Å; L324-S330 PolarHBondContact N-O 3.28Å; L324-S330 PolarHBondContact O-N 3.46Å; L324-F350 HydrophobicContact CD1-CE1 3.9Å; L324-F350 HydrophobicContact CD1-CE2 4.46Å; L324-F350 HydrophobicContact CD1-CZ 3.51Å; L324-F350 HydrophobicContact CD2-CE1 4.36Å; L324-F350 HydrophobicContact CG-CE1 4.13Å; L324-F350 HydrophobicContact CG-CZ 3.94Å; L324-M354 HydrophobicContact CD1-CG 3.93Å; L324-M354 HydrophobicContact CD2-CE 3.77Å; L324-M354 HydrophobicContact CD2-CG 4.35Å; L324-M354 HydrophobicContact CD2-SD 3.89Å
325	F	96	Very high	95.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	140.6	176.1	69.3	-87.6	0	0	0	111.5	V288 I289 D290 I291 V329 T360 I362 M392	V288-F325 HydrophobicContact CG1-CD1 3.61Å; V288-F325 HydrophobicContact CG1-CE1 3.71Å; I289-F325 WeakPolarHBondContact O-CD1 3.21Å; I289-F325 PolarHBondContact O-N 3.03Å; D290-F325 HydrophobicContact CB-CE1 3.99Å; D290-F325 HydrophobicContact CB-CE2 3.74Å; D290-F325 HydrophobicContact CB-CZ 3.44Å; D290-F325 VanDerWaalsContact CB-CZ 3.44Å; I291-F325 WeakPolarHBondContact CG1-O 3.29Å; I291-F325 PolarHBondContact N-O 3.01Å; F325-V329 HydrophobicContact CB-CG2 4.28Å; F325-T360 HydrophobicContact CD2-CG2 4.31Å; F325-T360 HydrophobicContact CE2-CG2 3.8Å; F325-I362 HydrophobicContact CE2-CB 4.48Å; F325-I362 HydrophobicContact CE2-CG1 3.75Å; F325-I362 HydrophobicContact CZ-CG1 4.27Å; F325-M392 HydrophobicContact CE1-CG 4.32Å; F325-M392 HydrophobicContact CZ-SD 4.32Å
326	S	93.2	Very high	95.5	Very high	5 Å²	5	42.7 Å²	42.7	4%	0.035	22%	0.218	C	C	.	.	S	Bend	trans	-145.7	-125.6	170.1	55.1	0	0	0	0	108.5	D328 K357 M359 T360 N361	S326-D328 PolarHBondContact N-O 2.94Å; S326-D328 PolarHBondContact OG-O 2.92Å; S326-K357 WeakPolarHBondContact CB-O 3.14Å; S326-M359 VanDerWaalsContact C-C 3.45Å; S326-M359 CarbonylContact C-O 3.48Å; S326-M359 WeakPolarHBondContact CA-O 3.34Å; S326-M359 VanDerWaalsContact CB-O 3.29Å; S326-M359 WeakPolarHBondContact CB-O 3.29Å; S326-T360 CarbonylContact O-C 3.55Å; S326-N361 WeakPolarHBondContact O-CA 3.47Å; S326-N361 WeakPolarHBondContact O-CB 3.48Å; S326-N361 PolarHBondContact O-N 3.12Å
327	G	88	Confident	95.7	Very high	22 Å²	22	38.6 Å²	38.6	23%	0.227	20%	0.2	C	C	.	.	S	Bend	trans	-66.2	-29.7	163.4	0	0	0	0	0	112.6	M359	G327-M359 PolarHBondContact N-O 3.35Å
328	D	89.9	Confident	95.8	Very high	106 Å²	106	36.9 Å²	36.9	57%	0.567	19%	0.192	S	C	*	.	S	Bend	trans	-117.2	162.5	175	-55.8	-55.8	0	0	0	110.2	S326 K357	S326-D328 PolarHBondContact N-O 2.94Å; S326-D328 PolarHBondContact OG-O 2.92Å; D328-K357 IonicContact OD2-NZ 2.74Å
329	V	95.4	Very high	95.9	Very high	41 Å²	41	36.9 Å²	36.9	25%	0.248	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	128.5	173	-177	0	0	0	0	109.8	I323 L324 F325 D364 R368	I323-V329 HydrophobicContact CG2-CG1 3.66Å; L324-V329 WeakPolarHBondContact O-CA 3.45Å; F325-V329 HydrophobicContact CB-CG2 4.28Å; V329-D364 HydrophobicContact CG2-CB 3.66Å; V329-R368 HydrophobicContact CG1-CB 3.97Å; V329-R368 HydrophobicContact CG1-CG 4.05Å
330	S	95.2	Very high	95.9	Very high	59 Å²	59	36.2 Å²	36.2	41%	0.413	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	155.5	176.5	65	0	0	0	0	111	I323 L324	I323-S330 CarbonylContact C-O 3.45Å; I323-S330 WeakPolarHBondContact CA-O 3.27Å; L324-S330 PolarHBondContact N-O 3.28Å; L324-S330 PolarHBondContact O-N 3.46Å
331	T	97.1	Very high	95.8	Very high	33 Å²	33	40 Å²	40	20%	0.202	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	141.8	-177.6	56	0	0	0	0	110	F322 I323 K333 R368 M372	F322-T331 WeakPolarHBondContact O-CA 3.48Å; I323-T331 HydrophobicContact CG1-CG2 4.11Å; I323-T331 HydrophobicContact CG2-CG2 4.41Å; T331-K333 WeakPolarHBondContact CB-O 3.47Å; T331-K333 PolarHBondContact OG1-O 3.34Å; T331-R368 HydrophobicContact CG2-CG 3.89Å; T331-M372 HydrophobicContact CG2-CE 4Å
332	W	97.6	Very high	95.8	Very high	34 Å²	34	46 Å²	46	13%	0.129	25%	0.245	C	C	.	.	S	Bend	trans	-62.2	-49.1	176.6	169.9	42.5	0	0	0	112.1	L320 F322 V337 N343 E346 A347 F350	L320-W332 HydrophobicContact CD1-CZ3 4.42Å; L320-W332 HydrophobicContact CG-CZ3 4.49Å; F322-W332 HydrophobicContact CB-CB 4.14Å; F322-W332 HydrophobicContact CD2-CD2 4.38Å; F322-W332 AromaticContact CD2-CE3 3.86Å; F322-W332 HydrophobicContact CD2-CE3 3.86Å; F322-W332 HydrophobicContact CE2-CE3 4.4Å; F322-W332 PolarHBondContact O-N 3.36Å; W332-V337 HydrophobicContact CE3-CG2 4.36Å; W332-V337 HydrophobicContact CH2-CG2 3.69Å; W332-V337 HydrophobicContact CZ3-CG2 3.43Å; W332-V337 VanDerWaalsContact CZ3-CG2 3.43Å; W332-N343 VanDerWaalsContact CH2-O 3.32Å; W332-N343 WeakPolarHBondContact CH2-O 3.38Å; W332-E346 HydrophobicContact CZ2-CB 3.69Å; W332-A347 HydrophobicContact CE3-CB 4.48Å; W332-A347 HydrophobicContact CH2-CB 3.59Å; W332-A347 HydrophobicContact CZ2-CB 3.96Å; W332-A347 HydrophobicContact CZ3-CB 3.86Å; W332-F350 HydrophobicContact CB-CD1 3.73Å; W332-F350 HydrophobicContact CB-CD2 3.96Å; W332-F350 HydrophobicContact CB-CE1 3.63Å; W332-F350 HydrophobicContact CB-CE2 3.84Å; W332-F350 HydrophobicContact CB-CG 3.89Å; W332-F350 HydrophobicContact CB-CZ 3.66Å; W332-F350 AromaticContact CD1-CD2 3.37Å; W332-F350 AromaticContact CD1-CG 3.36Å; W332-F350 HydrophobicContact CD2-CG 4.49Å; W332-F350 HydrophobicContact CG-CB 4.07Å; W332-F350 AromaticContact CG-CD1 3.85Å; W332-F350 HydrophobicContact CG-CD1 3.85Å; W332-F350 AromaticContact CG-CD2 3.88Å; W332-F350 HydrophobicContact CG-CD2 3.88Å; W332-F350 HydrophobicContact CG-CE1 4.26Å; W332-F350 HydrophobicContact CG-CE2 4.27Å; W332-F350 AromaticContact CG-CG 3.64Å; W332-F350 HydrophobicContact CG-CG 3.64Å; W332-F350 HydrophobicContact CG-CZ 4.44Å
333	K	96.9	Very high	95.8	Very high	67 Å²	67	47.7 Å²	47.7	29%	0.291	25%	0.254	S	S	.	.	S	Bend	trans	-123.7	159.7	173.5	-62.1	-72.2	-175.6	171.8	0	110.2	N321 T331 H335 V337 E346	N321-K333 PolarHBondContact ND2-O 3.45Å; N321-K333 PolarHBondContact OD1-N 3.19Å; T331-K333 WeakPolarHBondContact CB-O 3.47Å; T331-K333 PolarHBondContact OG1-O 3.34Å; K333-H335 VanDerWaalsContact C-N 3.27Å; K333-H335 PolarHBondContact O-N 2.88Å; K333-V337 HydrophobicContact CB-CG1 4.07Å; K333-V337 HydrophobicContact CG-CG1 3.88Å; K333-E346 WeakPolarHBondContact CE-OE2 3.44Å; K333-E346 IonicContact NZ-OE2 2.95Å; K333-E346 PolarHBondContact NZ-OE2 3.47Å
334	E	94.1	Very high	95.7	Very high	151 Å²	151	48.5 Å²	48.5	71%	0.706	26%	0.259	S	S	*	.	S	Bend	trans	-69.8	-26.1	178	-65.6	-168.9	162.4	0	0	113.1
335	H	95.1	Very high	95.7	Very high	90 Å²	90	52.7 Å²	52.7	42%	0.417	28%	0.278	S	S	.	.	S	Bend	trans	-136.2	162.9	-175.5	-54.1	-41	0	0	0	110.3	N321 K333 V337 R381	N321-H335 PolarHBondContact ND2-O 3.34Å; K333-H335 VanDerWaalsContact C-N 3.27Å; K333-H335 PolarHBondContact O-N 2.88Å; H335-V337 PolarHBondContact O-N 3.44Å; H335-R381 PolarHBondContact CD2-NH1 3.17Å; H335-R381 PolarHBondContact CE1-NH1 3.41Å; H335-R381 PolarHBondContact ND1-NH1 3.09Å; H335-R381 PolarHBondContact NE2-NH1 3.37Å
336	L	96.8	Very high	95.8	Very high	19 Å²	19	56.9 Å²	56.9	10%	0.099	30%	0.297	C	S	.	.			trans	-55.5	138.2	168.4	-74.9	178	0	0	0	110.2	N284 Y319 N321 M372 L373 A376 V382	N284-L336 HydrophobicContact CB-CD1 3.94Å; Y319-L336 HydrophobicContact CD1-CB 4.44Å; N321-L336 HydrophobicContact CB-CD2 4.06Å; L336-M372 HydrophobicContact CD2-SD 4.42Å; L336-M372 HydrophobicContact CG-CG 4.29Å; L336-M372 HydrophobicContact CG-SD 4.48Å; L336-L373 HydrophobicContact CD1-CD2 3.82Å; L336-L373 HydrophobicContact CD2-CD2 4.03Å; L336-L373 HydrophobicContact CG-CD2 4.35Å; L336-A376 HydrophobicContact CD1-CB 3.59Å; L336-A376 HydrophobicContact CG-CB 4.28Å; L336-V382 HydrophobicContact CD1-CG1 3.76Å
337	V	96.9	Very high	96	Very high	25 Å²	25	56.6 Å²	56.6	15%	0.152	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	143.4	176.5	-63.8	0	0	0	0	110.1	Y319 L320 W332 K333 H335	Y319-V337 CarbonylContact C-O 2.85Å; Y319-V337 VanDerWaalsContact CA-O 3.29Å; Y319-V337 WeakPolarHBondContact CA-O 3.44Å; L320-V337 PolarHBondContact N-O 2.97Å; L320-V337 WeakPolarHBondContact O-CG2 3.3Å; L320-V337 PolarHBondContact O-N 3.32Å; W332-V337 HydrophobicContact CE3-CG2 4.36Å; W332-V337 HydrophobicContact CH2-CG2 3.69Å; W332-V337 HydrophobicContact CZ3-CG2 3.43Å; W332-V337 VanDerWaalsContact CZ3-CG2 3.43Å; K333-V337 HydrophobicContact CB-CG1 4.07Å; K333-V337 HydrophobicContact CG-CG1 3.88Å; H335-V337 PolarHBondContact O-N 3.44Å
338	Q	97.6	Very high	96.4	Very high	71 Å²	71	58.9 Å²	58.9	33%	0.332	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	142.5	174.5	-171.2	176.6	6.1	0	0	110.2	E316 D318 Y319 T340 N343	E316-Q338 WeakPolarHBondContact O-CG 3.02Å; E316-Q338 PolarHBondContact O-NE2 2.62Å; D318-Q338 CarbonylContact O-C 3.51Å; D318-Q338 WeakPolarHBondContact O-CA 3.25Å; Y319-Q338 HydrophobicContact CD1-CB 4.15Å; Y319-Q338 HydrophobicContact CE1-CB 3.78Å; Y319-Q338 HydrophobicContact CE1-CG 4.46Å; Y319-Q338 HydrophobicContact CE2-CB 4.36Å; Y319-Q338 HydrophobicContact CE2-CG 4.18Å; Q338-T340 HydrophobicContact CB-CG2 4.28Å; Q338-T340 HydrophobicContact CG-CG2 4.21Å; Q338-T340 PolarHBondContact O-N 3.1Å; Q338-N343 WeakPolarHBondContact O-CB 3.47Å; Q338-N343 PolarHBondContact O-ND2 3.41Å
339	A	97.1	Very high	96.8	Very high	2 Å²	2	57.8 Å²	57.8	2%	0.017	30%	0.295	C	S	.	.			trans	-75.7	49.9	-178.1	0	0	0	0	0	113.3	M314 K315 D318 L320 L344	M314-A339 HydrophobicContact CB-CB 4.3Å; K315-A339 WeakPolarHBondContact O-CB 3.31Å; D318-A339 HydrophobicContact CB-CB 4.35Å; D318-A339 WeakPolarHBondContact O-CB 3.39Å; D318-A339 PolarHBondContact O-N 3.37Å; L320-A339 HydrophobicContact CD2-CB 3.74Å; A339-L344 HydrophobicContact CB-CD1 4.47Å; A339-L344 HydrophobicContact CB-CD2 4.02Å; A339-L344 HydrophobicContact CB-CG 4.27Å; A339-L344 WeakPolarHBondContact O-CD1 3.24Å
340	T	97.3	Very high	96.9	Very high	25 Å²	25	57.7 Å²	57.7	15%	0.153	29%	0.291	C	S	.	.			trans	-67.4	156.5	172.9	80.3	0	0	0	0	110.6	Q338 E342 N343 L344	Q338-T340 HydrophobicContact CB-CG2 4.28Å; Q338-T340 HydrophobicContact CG-CG2 4.21Å; Q338-T340 PolarHBondContact O-N 3.1Å; T340-E342 WeakPolarHBondContact CB-OE2 3.35Å; T340-E342 PolarHBondContact O-N 2.95Å; T340-E342 VanDerWaalsContact O-N 3.13Å; T340-E342 PolarHBondContact OG1-OE2 3.48Å; T340-N343 PolarHBondContact O-N 3.25Å; T340-N343 VanDerWaalsContact O-N 3.09Å; T340-N343 PolarHBondContact OG1-N 3.03Å; T340-L344 WeakPolarHBondContact O-CG 3.23Å; T340-L344 PolarHBondContact O-N 3.04Å
341	P	96.5	Very high	97	Very high	81 Å²	81	54.9 Å²	54.9	53%	0.526	27%	0.271	S	S	.	.	H	α-helix	trans	-52.3	-36.8	178.2	-28.7	36.6	0	0	0	114	Q345	P341-Q345 WeakPolarHBondContact O-CB 3.49Å; P341-Q345 PolarHBondContact O-N 3.26Å; P341-Q345 VanDerWaalsContact O-N 3.1Å
342	E	97.3	Very high	97	Very high	125 Å²	125	59.5 Å²	59.5	58%	0.584	29%	0.289	S	S	*	.	H	α-helix	trans	-68.1	-49.1	177.2	-58.6	71.7	-153.8	0	0	111.4	T340 L344 Q345 E346	T340-E342 WeakPolarHBondContact CB-OE2 3.35Å; T340-E342 PolarHBondContact O-N 2.95Å; T340-E342 VanDerWaalsContact O-N 3.13Å; T340-E342 PolarHBondContact OG1-OE2 3.48Å; E342-L344 VanDerWaalsContact C-N 3.33Å; E342-L344 PolarHBondContact O-N 3.11Å; E342-Q345 PolarHBondContact O-N 3.43Å; E342-Q345 VanDerWaalsContact O-N 3.17Å; E342-E346 PolarHBondContact O-N 3Å
343	N	97.5	Very high	96.9	Very high	36 Å²	36	61.4 Å²	61.4	19%	0.193	31%	0.307	C	S	.	.	H	α-helix	trans	-64.8	-37.8	178.8	-75.7	-25.5	0	0	0	111.6	W332 Q338 T340 Q345 E346 A347	W332-N343 VanDerWaalsContact CH2-O 3.32Å; W332-N343 WeakPolarHBondContact CH2-O 3.38Å; Q338-N343 WeakPolarHBondContact O-CB 3.47Å; Q338-N343 PolarHBondContact O-ND2 3.41Å; T340-N343 PolarHBondContact O-N 3.25Å; T340-N343 VanDerWaalsContact O-N 3.09Å; T340-N343 PolarHBondContact OG1-N 3.03Å; N343-Q345 VanDerWaalsContact C-N 3.31Å; N343-Q345 PolarHBondContact O-N 3.29Å; N343-E346 PolarHBondContact O-N 2.92Å; N343-A347 VanDerWaalsContact O-CB 3.31Å; N343-A347 WeakPolarHBondContact O-CB 3.35Å; N343-A347 PolarHBondContact O-N 3.45Å
344	L	96.9	Very high	96.8	Very high	18 Å²	18	58.4 Å²	58.4	9%	0.094	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-37	174.5	-70.9	177.2	0	0	0	111.6	L311 M314 L320 A339 T340 E342 A347 R348	L311-L344 HydrophobicContact CD2-CD2 3.9Å; M314-L344 HydrophobicContact CB-CD2 4.24Å; M314-L344 HydrophobicContact SD-CD2 4.43Å; L320-L344 HydrophobicContact CD2-CD2 4.33Å; A339-L344 HydrophobicContact CB-CD1 4.47Å; A339-L344 HydrophobicContact CB-CD2 4.02Å; A339-L344 HydrophobicContact CB-CG 4.27Å; A339-L344 WeakPolarHBondContact O-CD1 3.24Å; T340-L344 WeakPolarHBondContact O-CG 3.23Å; T340-L344 PolarHBondContact O-N 3.04Å; E342-L344 VanDerWaalsContact C-N 3.33Å; E342-L344 PolarHBondContact O-N 3.11Å; L344-A347 WeakPolarHBondContact O-CB 3.2Å; L344-A347 PolarHBondContact O-N 3.42Å; L344-R348 VanDerWaalsContact O-CG 3.25Å; L344-R348 WeakPolarHBondContact O-CG 3.2Å; L344-R348 PolarHBondContact O-N 3.23Å
345	Q	96.8	Very high	96.7	Very high	96 Å²	96	58.3 Å²	58.3	45%	0.449	29%	0.294	S	S	.	.	H	α-helix	trans	-69.3	-39	175.6	-171.8	56.2	36.6	0	0	112.5	P341 E342 N343 T349	P341-Q345 WeakPolarHBondContact O-CB 3.49Å; P341-Q345 PolarHBondContact O-N 3.26Å; P341-Q345 VanDerWaalsContact O-N 3.1Å; E342-Q345 PolarHBondContact O-N 3.43Å; E342-Q345 VanDerWaalsContact O-N 3.17Å; N343-Q345 VanDerWaalsContact C-N 3.31Å; N343-Q345 PolarHBondContact O-N 3.29Å; Q345-T349 PolarHBondContact O-N 3.15Å; Q345-T349 PolarHBondContact O-OG1 3.42Å
346	E	97.9	Very high	96.4	Very high	88 Å²	88	57.7 Å²	57.7	41%	0.411	29%	0.293	S	S	.	.	H	α-helix	trans	-63.9	-42.8	171.3	-72.6	-172.7	-162	0	0	111.7	W332 K333 E342 N343 R348 T349 F350	W332-E346 HydrophobicContact CZ2-CB 3.69Å; K333-E346 WeakPolarHBondContact CE-OE2 3.44Å; K333-E346 IonicContact NZ-OE2 2.95Å; K333-E346 PolarHBondContact NZ-OE2 3.47Å; E342-E346 PolarHBondContact O-N 3Å; N343-E346 PolarHBondContact O-N 2.92Å; E346-R348 PolarHBondContact O-N 2.97Å; E346-T349 WeakPolarHBondContact O-CB 2.91Å; E346-T349 PolarHBondContact O-N 3.25Å; E346-T349 VanDerWaalsContact O-N 3.14Å; E346-F350 PolarHBondContact O-N 3.28Å
347	A	97.6	Very high	95.7	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-58.6	-46.6	175.9	0	0	0	0	0	111.6	L311 F322 W332 N343 L344 T349 F350 V351	L311-A347 HydrophobicContact CD1-CB 3.82Å; L311-A347 HydrophobicContact CD2-CB 4.18Å; F322-A347 HydrophobicContact CE2-CB 4.05Å; W332-A347 HydrophobicContact CE3-CB 4.48Å; W332-A347 HydrophobicContact CH2-CB 3.59Å; W332-A347 HydrophobicContact CZ2-CB 3.96Å; W332-A347 HydrophobicContact CZ3-CB 3.86Å; N343-A347 VanDerWaalsContact O-CB 3.31Å; N343-A347 WeakPolarHBondContact O-CB 3.35Å; N343-A347 PolarHBondContact O-N 3.45Å; L344-A347 WeakPolarHBondContact O-CB 3.2Å; L344-A347 PolarHBondContact O-N 3.42Å; A347-T349 VanDerWaalsContact C-N 3.25Å; A347-T349 PolarHBondContact O-N 2.95Å; A347-F350 WeakPolarHBondContact O-CB 3.47Å; A347-F350 PolarHBondContact O-N 3.01Å; A347-F350 VanDerWaalsContact O-N 3.14Å; A347-V351 VanDerWaalsContact O-CG2 3.29Å; A347-V351 WeakPolarHBondContact O-CG2 3.47Å; A347-V351 PolarHBondContact O-N 3.38Å
348	R	97.7	Very high	95.1	Very high	69 Å²	69	63.8 Å²	63.8	26%	0.26	33%	0.332	S	S	.	.	H	α-helix	trans	-58.6	-38.6	175.5	-72.8	170.1	-175.1	154.9	2.7	112.1	L308 L311 L344 E346 K352	L308-R348 HydrophobicContact CD2-CB 3.86Å; L308-R348 HydrophobicContact CD2-CG 3.84Å; L311-R348 HydrophobicContact CD1-CG 3.89Å; L344-R348 VanDerWaalsContact O-CG 3.25Å; L344-R348 WeakPolarHBondContact O-CG 3.2Å; L344-R348 PolarHBondContact O-N 3.23Å; E346-R348 PolarHBondContact O-N 2.97Å; R348-K352 VanDerWaalsContact O-CG 3.3Å; R348-K352 WeakPolarHBondContact O-CG 3.47Å; R348-K352 PolarHBondContact O-N 3.37Å; R348-K352 VanDerWaalsContact O-N 3.14Å
349	T	97.7	Very high	94.6	Very high	83 Å²	83	65.4 Å²	65.4	51%	0.509	34%	0.341	S	S	.	.	H	α-helix	trans	-67.3	-43.2	177.5	-54.1	0	0	0	0	110.6	Q345 E346 A347 K352 S353	Q345-T349 PolarHBondContact O-N 3.15Å; Q345-T349 PolarHBondContact O-OG1 3.42Å; E346-T349 WeakPolarHBondContact O-CB 2.91Å; E346-T349 PolarHBondContact O-N 3.25Å; E346-T349 VanDerWaalsContact O-N 3.14Å; A347-T349 VanDerWaalsContact C-N 3.25Å; A347-T349 PolarHBondContact O-N 2.95Å; T349-K352 PolarHBondContact O-N 3.25Å; T349-S353 PolarHBondContact O-N 3Å
350	F	97.9	Very high	94.3	Very high	39 Å²	39	65.5 Å²	65.5	17%	0.171	34%	0.342	C	S	.	.	H	α-helix	trans	-60.9	-48.8	175	178.7	-97.6	0	0	0	112.4	F322 L324 W332 E346 A347 K352 S353 M354	F322-F350 HydrophobicContact CB-CD1 4.16Å; F322-F350 HydrophobicContact CB-CE1 3.63Å; F322-F350 HydrophobicContact CD2-CD1 4.13Å; F322-F350 HydrophobicContact CD2-CE1 4.46Å; F322-F350 HydrophobicContact CG-CD1 4.28Å; F322-F350 HydrophobicContact CG-CE1 4.19Å; L324-F350 HydrophobicContact CD1-CE1 3.9Å; L324-F350 HydrophobicContact CD1-CE2 4.46Å; L324-F350 HydrophobicContact CD1-CZ 3.51Å; L324-F350 HydrophobicContact CD2-CE1 4.36Å; L324-F350 HydrophobicContact CG-CE1 4.13Å; L324-F350 HydrophobicContact CG-CZ 3.94Å; W332-F350 HydrophobicContact CB-CD1 3.73Å; W332-F350 HydrophobicContact CB-CD2 3.96Å; W332-F350 HydrophobicContact CB-CE1 3.63Å; W332-F350 HydrophobicContact CB-CE2 3.84Å; W332-F350 HydrophobicContact CB-CG 3.89Å; W332-F350 HydrophobicContact CB-CZ 3.66Å; W332-F350 AromaticContact CD1-CD2 3.37Å; W332-F350 AromaticContact CD1-CG 3.36Å; W332-F350 HydrophobicContact CD2-CG 4.49Å; W332-F350 HydrophobicContact CG-CB 4.07Å; W332-F350 AromaticContact CG-CD1 3.85Å; W332-F350 HydrophobicContact CG-CD1 3.85Å; W332-F350 AromaticContact CG-CD2 3.88Å; W332-F350 HydrophobicContact CG-CD2 3.88Å; W332-F350 HydrophobicContact CG-CE1 4.26Å; W332-F350 HydrophobicContact CG-CE2 4.27Å; W332-F350 AromaticContact CG-CG 3.64Å; W332-F350 HydrophobicContact CG-CG 3.64Å; W332-F350 HydrophobicContact CG-CZ 4.44Å; E346-F350 PolarHBondContact O-N 3.28Å; A347-F350 WeakPolarHBondContact O-CB 3.47Å; A347-F350 PolarHBondContact O-N 3.01Å; A347-F350 VanDerWaalsContact O-N 3.14Å; F350-K352 VanDerWaalsContact C-N 3.32Å; F350-K352 PolarHBondContact O-N 3.46Å; F350-S353 WeakPolarHBondContact CA-OG 3.33Å; F350-S353 PolarHBondContact O-N 3.26Å; F350-S353 PolarHBondContact O-OG 2.87Å; F350-M354 HydrophobicContact CD1-CE 3.87Å; F350-M354 HydrophobicContact CE1-CE 3.71Å; F350-M354 PolarHBondContact O-N 2.75Å
351	V	97.2	Very high	94.1	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-56.2	-45.7	177.7	173.9	0	0	0	0	111.3	K304 L307 L308 L311 F322 A347 S353 M354	K304-V351 HydrophobicContact CB-CG1 4.09Å; K304-V351 WeakPolarHBondContact CE-O 3.22Å; K304-V351 HydrophobicContact CG-CG1 4.15Å; L307-V351 HydrophobicContact CB-CG1 3.91Å; L307-V351 HydrophobicContact CB-CG2 4.31Å; L307-V351 HydrophobicContact CD1-CG1 4.32Å; L308-V351 HydrophobicContact CD2-CB 4.18Å; L308-V351 HydrophobicContact CD2-CG1 4.12Å; L308-V351 HydrophobicContact CG-CG1 4Å; L311-V351 HydrophobicContact CD1-CG2 4.08Å; F322-V351 HydrophobicContact CE1-CG2 4.15Å; F322-V351 HydrophobicContact CE2-CG2 4.09Å; F322-V351 HydrophobicContact CZ-CG2 3.81Å; A347-V351 VanDerWaalsContact O-CG2 3.29Å; A347-V351 WeakPolarHBondContact O-CG2 3.47Å; A347-V351 PolarHBondContact O-N 3.38Å; V351-S353 PolarHBondContact O-N 3.49Å; V351-M354 HydrophobicContact CB-CE 4.09Å; V351-M354 HydrophobicContact CG1-CE 4.33Å; V351-M354 HydrophobicContact CG2-CE 3.81Å; V351-M354 WeakPolarHBondContact O-CG 3.34Å; V351-M354 PolarHBondContact O-N 3.44Å
352	K	96.3	Very high	94.1	Very high	131 Å²	131	60.9 Å²	60.9	57%	0.57	31%	0.312	S	S	*	.	H	α-helix	trans	-61.6	-34.4	178.2	-73.4	173.8	-178.4	-177.5	0	112.5	K304 L308 R348 T349 F350 M354	K304-K352 PolarHBondContact NZ-O 2.91Å; L308-K352 HydrophobicContact CD1-CG 4.18Å; L308-K352 HydrophobicContact CD2-CG 4.37Å; R348-K352 VanDerWaalsContact O-CG 3.3Å; R348-K352 WeakPolarHBondContact O-CG 3.47Å; R348-K352 PolarHBondContact O-N 3.37Å; R348-K352 VanDerWaalsContact O-N 3.14Å; T349-K352 PolarHBondContact O-N 3.25Å; F350-K352 VanDerWaalsContact C-N 3.32Å; F350-K352 PolarHBondContact O-N 3.46Å; K352-M354 VanDerWaalsContact C-N 3.35Å
353	S	95.6	Very high	94.1	Very high	73 Å²	73	55.3 Å²	55.3	51%	0.51	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-4.7	-179.5	72.7	0	0	0	0	115.5	T349 F350 V351 E355	T349-S353 PolarHBondContact O-N 3Å; F350-S353 WeakPolarHBondContact CA-OG 3.33Å; F350-S353 PolarHBondContact O-N 3.26Å; F350-S353 PolarHBondContact O-OG 2.87Å; V351-S353 PolarHBondContact O-N 3.49Å; S353-E355 PolarHBondContact O-N 2.96Å
354	M	94.8	Very high	94	Very high	4 Å²	4	56.8 Å²	56.8	2%	0.02	29%	0.294	C	S	.	.			trans	-61.2	135.9	178.1	-60.4	174.9	-176.6	0	0	110.5	K304 L307 F322 L324 F350 V351 K352	K304-M354 WeakPolarHBondContact CE-O 3.33Å; K304-M354 PolarHBondContact NZ-O 2.62Å; L307-M354 HydrophobicContact CD1-CE 4.02Å; L307-M354 HydrophobicContact CD1-SD 4.36Å; F322-M354 HydrophobicContact CD1-CE 4.06Å; F322-M354 HydrophobicContact CG-CE 4.29Å; L324-M354 HydrophobicContact CD1-CG 3.93Å; L324-M354 HydrophobicContact CD2-CE 3.77Å; L324-M354 HydrophobicContact CD2-CG 4.35Å; L324-M354 HydrophobicContact CD2-SD 3.89Å; F350-M354 HydrophobicContact CD1-CE 3.87Å; F350-M354 HydrophobicContact CE1-CE 3.71Å; F350-M354 PolarHBondContact O-N 2.75Å; V351-M354 HydrophobicContact CB-CE 4.09Å; V351-M354 HydrophobicContact CG1-CE 4.33Å; V351-M354 HydrophobicContact CG2-CE 3.81Å; V351-M354 WeakPolarHBondContact O-CG 3.34Å; V351-M354 PolarHBondContact O-N 3.44Å; K352-M354 VanDerWaalsContact C-N 3.35Å
355	E	91.4	Very high	94	Very high	150 Å²	150	56 Å²	56	70%	0.701	29%	0.289	S	S	*	.			trans	-130.8	146.9	177	-69.1	-178	173.4	0	0	108.8	S353	S353-E355 PolarHBondContact O-N 2.96Å
356	D	89.1	Confident	94.1	Very high	76 Å²	76	51.4 Å²	51.4	41%	0.406	27%	0.268	S	S	.	.			trans	-68.2	141.3	175.7	64.4	-78.6	0	0	0	110.7	I291 A296 L300	I291-D356 CarbonylContact O-C 3.6Å; I291-D356 VanDerWaalsContact O-CA 3.26Å; I291-D356 WeakPolarHBondContact O-CA 3.37Å; A296-D356 HydrophobicContact CB-CB 4.25Å; L300-D356 HydrophobicContact CD2-CB 4.23Å
357	K	83.4	Confident	94.1	Very high	119 Å²	119	49.6 Å²	49.6	52%	0.517	26%	0.261	S	S	.	.			trans	-152.4	130	-176	-169	-175.2	179.1	-160.3	0	110.3	I291 S292 S326 D328	I291-K357 PolarHBondContact O-N 3.08Å; S292-K357 WeakPolarHBondContact CA-O 3.49Å; S326-K357 WeakPolarHBondContact CB-O 3.14Å; D328-K357 IonicContact OD2-NZ 2.74Å
358	G	82.5	Confident	94.1	Very high	54 Å²	54	54.6 Å²	54.6	56%	0.557	28%	0.28	S	S	*	.	S	Bend	trans	61.1	-141.1	156.8	0	0	0	0	0	116	G293	G293-G358 PolarHBondContact N-O 3.36Å; G293-G358 VanDerWaalsContact N-O 3.08Å
359	M	88.3	Confident	94.1	Very high	105 Å²	105	51.3 Å²	51.3	52%	0.517	27%	0.267	S	S	.	.			trans	-101.9	-159.1	-168.8	-59.2	-68.1	-99.7	0	0	110.8	S292 S326 G327 N399 V400	S292-M359 WeakPolarHBondContact CB-O 3.39Å; S326-M359 VanDerWaalsContact C-C 3.45Å; S326-M359 CarbonylContact C-O 3.48Å; S326-M359 WeakPolarHBondContact CA-O 3.34Å; S326-M359 VanDerWaalsContact CB-O 3.29Å; S326-M359 WeakPolarHBondContact CB-O 3.29Å; G327-M359 PolarHBondContact N-O 3.35Å; M359-N399 WeakPolarHBondContact CB-OD1 3.45Å; M359-V400 HydrophobicContact CB-CB 4.39Å; M359-V400 HydrophobicContact CB-CG2 3.38Å; M359-V400 HydrophobicContact CG-CG2 3.94Å
360	T	89.8	Confident	94.1	Very high	4 Å²	4	47.4 Å²	47.4	3%	0.025	24%	0.243	C	C	.	.			trans	-137.2	107.9	-169.5	-42.6	0	0	0	0	112.5	D290 S292 F325 S326 I362 N399 V400	D290-T360 WeakPolarHBondContact OD2-CG2 3.4Å; S292-T360 WeakPolarHBondContact CB-OG1 3.46Å; F325-T360 HydrophobicContact CD2-CG2 4.31Å; F325-T360 HydrophobicContact CE2-CG2 3.8Å; S326-T360 CarbonylContact O-C 3.55Å; T360-I362 HydrophobicContact CG2-CD1 4.42Å; T360-I362 HydrophobicContact CG2-CG1 3.94Å; T360-N399 WeakPolarHBondContact CA-OD1 3.38Å; T360-N399 PolarHBondContact N-OD1 2.94Å; T360-N399 PolarHBondContact O-N 2.92Å; T360-N399 PolarHBondContact O-OD1 2.96Å; T360-N399 PolarHBondContact OG1-ND2 3.21Å; T360-V400 PolarHBondContact O-N 3.42Å; T360-V400 VanDerWaalsContact O-N 3.09Å
361	N	94.5	Very high	94.1	Very high	8 Å²	8	47.8 Å²	47.8	4%	0.043	25%	0.251	C	S	.	.			trans	-114.2	77.5	179.1	-173.5	-10.1	0	0	0	111	S326 D364 G365 V400	S326-N361 WeakPolarHBondContact O-CA 3.47Å; S326-N361 WeakPolarHBondContact O-CB 3.48Å; S326-N361 PolarHBondContact O-N 3.12Å; N361-D364 PolarHBondContact ND2-OD2 2.87Å; N361-D364 WeakPolarHBondContact OD1-CB 3.35Å; N361-D364 PolarHBondContact OD1-N 2.9Å; N361-G365 PolarHBondContact O-N 2.88Å; N361-V400 WeakPolarHBondContact CA-O 3.45Å; N361-V400 HydrophobicContact CB-CB 4.23Å; N361-V400 HydrophobicContact CB-CG1 4.23Å; N361-V400 PolarHBondContact OD1-O 2.95Å
362	I	95	Very high	94.1	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-62.6	-43.4	-177.8	-62.4	-179.9	0	0	0	111.4	F325 T360 D364 G365 L366 T394 A398 F435	F325-I362 HydrophobicContact CE2-CB 4.48Å; F325-I362 HydrophobicContact CE2-CG1 3.75Å; F325-I362 HydrophobicContact CZ-CG1 4.27Å; T360-I362 HydrophobicContact CG2-CD1 4.42Å; T360-I362 HydrophobicContact CG2-CG1 3.94Å; I362-D364 PolarHBondContact O-N 3.06Å; I362-G365 PolarHBondContact O-N 3.34Å; I362-L366 HydrophobicContact CG2-CD1 3.7Å; I362-L366 HydrophobicContact CG2-CG 4.31Å; I362-L366 WeakPolarHBondContact O-CB 3.11Å; I362-L366 PolarHBondContact O-N 2.8Å; I362-T394 HydrophobicContact CD1-CG2 4.41Å; I362-A398 HydrophobicContact CB-CB 4.13Å; I362-A398 HydrophobicContact CD1-CB 4.06Å; I362-A398 HydrophobicContact CG1-CB 4.12Å; I362-F435 HydrophobicContact CD1-CE1 4.41Å
363	N	97.1	Very high	94.1	Very high	7 Å²	7	42 Å²	42	4%	0.037	23%	0.226	C	C	.	.	H	α-helix	trans	-57.3	-54.7	-175.2	-179.9	81.4	0	0	0	111.7	G365 L366 L367 E402 I408 N411	N363-G365 VanDerWaalsContact C-N 3.34Å; N363-G365 PolarHBondContact O-N 3.28Å; N363-L366 PolarHBondContact O-N 3.03Å; N363-L367 WeakPolarHBondContact ND2-CD1 3.47Å; N363-L367 WeakPolarHBondContact O-CB 3.2Å; N363-L367 VanDerWaalsContact O-CG 3.27Å; N363-L367 WeakPolarHBondContact O-CG 3.36Å; N363-L367 PolarHBondContact O-N 2.9Å; N363-E402 HydrophobicContact CB-CB 4.08Å; N363-I408 HydrophobicContact CB-CG1 4.15Å; N363-I408 HydrophobicContact CB-CG2 4.34Å; N363-N411 PolarHBondContact OD1-ND2 3.06Å
364	D	96.6	Very high	94.2	Very high	68 Å²	68	39.5 Å²	39.5	36%	0.364	21%	0.207	S	C	.	.	H	α-helix	trans	-73.3	-31.4	-174.5	-63	-12.4	0	0	0	111.4	V329 N361 I362 R368	V329-D364 HydrophobicContact CG2-CB 3.66Å; N361-D364 PolarHBondContact ND2-OD2 2.87Å; N361-D364 WeakPolarHBondContact OD1-CB 3.35Å; N361-D364 PolarHBondContact OD1-N 2.9Å; I362-D364 PolarHBondContact O-N 3.06Å; D364-R368 WeakPolarHBondContact O-CB 3.41Å; D364-R368 PolarHBondContact O-N 2.59Å
365	G	97	Very high	94.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.4	-51.5	173.1	0	0	0	0	0	111.7	N361 I362 N363 R368 G369	N361-G365 PolarHBondContact O-N 2.88Å; I362-G365 PolarHBondContact O-N 3.34Å; N363-G365 VanDerWaalsContact C-N 3.34Å; N363-G365 PolarHBondContact O-N 3.28Å; G365-R368 PolarHBondContact O-N 3.24Å; G365-G369 PolarHBondContact O-N 2.91Å; G365-G369 VanDerWaalsContact O-N 3.13Å
366	L	98	Very high	94.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-50.4	176.8	-77.4	172.7	0	0	0	111.6	V288 I362 N363 R368 G369 I370 V390 M392 V412 L422 M439	V288-L366 HydrophobicContact CB-CD2 4.49Å; V288-L366 HydrophobicContact CG1-CD2 4.29Å; V288-L366 HydrophobicContact CG2-CD2 4.49Å; I362-L366 HydrophobicContact CG2-CD1 3.7Å; I362-L366 HydrophobicContact CG2-CG 4.31Å; I362-L366 WeakPolarHBondContact O-CB 3.11Å; I362-L366 PolarHBondContact O-N 2.8Å; N363-L366 PolarHBondContact O-N 3.03Å; L366-R368 PolarHBondContact O-N 3.25Å; L366-G369 PolarHBondContact O-N 2.86Å; L366-G369 VanDerWaalsContact O-N 3.12Å; L366-I370 HydrophobicContact CB-CD1 4.27Å; L366-I370 WeakPolarHBondContact O-CB 3.48Å; L366-I370 WeakPolarHBondContact O-CD1 3.24Å; L366-I370 WeakPolarHBondContact O-CG1 3.36Å; L366-I370 PolarHBondContact O-N 3.42Å; L366-V390 HydrophobicContact CD2-CG1 4.17Å; L366-M392 HydrophobicContact CD2-CB 3.85Å; L366-M392 HydrophobicContact CD2-CG 3.85Å; L366-M392 HydrophobicContact CG-CG 4.38Å; L366-V412 HydrophobicContact CB-CG2 4.08Å; L366-V412 HydrophobicContact CD1-CG2 3.78Å; L366-L422 HydrophobicContact CD2-CD1 3.88Å; L366-M439 HydrophobicContact CD1-CE 4.28Å; L366-M439 HydrophobicContact CD1-SD 3.56Å; L366-M439 VanDerWaalsContact CD1-SD 3.56Å
367	L	98.1	Very high	94.6	Very high	50 Å²	50	40.8 Å²	40.8	26%	0.262	20%	0.203	S	C	.	.	H	α-helix	trans	-59.6	-35.5	-179.7	-70.6	179.8	0	0	0	112.1	N363 S371 N411 A415	N363-L367 WeakPolarHBondContact ND2-CD1 3.47Å; N363-L367 WeakPolarHBondContact O-CB 3.2Å; N363-L367 VanDerWaalsContact O-CG 3.27Å; N363-L367 WeakPolarHBondContact O-CG 3.36Å; N363-L367 PolarHBondContact O-N 2.9Å; L367-S371 WeakPolarHBondContact O-CB 3.39Å; L367-S371 PolarHBondContact O-N 3.12Å; L367-N411 HydrophobicContact CD1-CB 4.49Å; L367-N411 HydrophobicContact CD2-CB 4.36Å; L367-A415 HydrophobicContact CD2-CB 3.6Å
368	R	98.1	Very high	95.1	Very high	106 Å²	106	41 Å²	41	40%	0.4	21%	0.206	S	C	.	.	H	α-helix	trans	-66.1	-45.3	175.3	-178.7	56.3	175	-99.2	-2.2	112	I323 V329 T331 D364 G365 L366 M372	I323-R368 HydrophobicContact CG2-CB 4.22Å; I323-R368 HydrophobicContact CG2-CG 4.17Å; V329-R368 HydrophobicContact CG1-CB 3.97Å; V329-R368 HydrophobicContact CG1-CG 4.05Å; T331-R368 HydrophobicContact CG2-CG 3.89Å; D364-R368 WeakPolarHBondContact O-CB 3.41Å; D364-R368 PolarHBondContact O-N 2.59Å; G365-R368 PolarHBondContact O-N 3.24Å; L366-R368 PolarHBondContact O-N 3.25Å; R368-M372 WeakPolarHBondContact O-CB 3.29Å; R368-M372 PolarHBondContact O-N 3.15Å
369	G	97.6	Very high	95.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.6	-48.8	175.7	0	0	0	0	0	112.1	G365 L366 S371 M372 L373	G365-G369 PolarHBondContact O-N 2.91Å; G365-G369 VanDerWaalsContact O-N 3.13Å; L366-G369 PolarHBondContact O-N 2.86Å; L366-G369 VanDerWaalsContact O-N 3.12Å; G369-S371 PolarHBondContact O-N 2.78Å; G369-M372 WeakPolarHBondContact O-CB 3.44Å; G369-M372 PolarHBondContact O-N 2.89Å; G369-L373 PolarHBondContact O-N 2.84Å; G369-L373 VanDerWaalsContact O-N 3.09Å
370	I	98.1	Very high	96	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.4	-45.9	179	-65	158.9	0	0	0	111.1	L366 M372 L373 N374 V390 V412 A415 I416 F420	L366-I370 HydrophobicContact CB-CD1 4.27Å; L366-I370 WeakPolarHBondContact O-CB 3.48Å; L366-I370 WeakPolarHBondContact O-CD1 3.24Å; L366-I370 WeakPolarHBondContact O-CG1 3.36Å; L366-I370 PolarHBondContact O-N 3.42Å; I370-M372 VanDerWaalsContact C-N 3.28Å; I370-M372 PolarHBondContact O-N 2.66Å; I370-L373 PolarHBondContact O-N 2.95Å; I370-N374 PolarHBondContact O-N 3.13Å; I370-N374 PolarHBondContact O-ND2 2.88Å; I370-V390 HydrophobicContact CG1-CG2 4.11Å; I370-V412 HydrophobicContact CD1-CG1 4.01Å; I370-V412 HydrophobicContact CD1-CG2 4.44Å; I370-A415 HydrophobicContact CB-CB 4.47Å; I370-A415 HydrophobicContact CD1-CB 4.39Å; I370-A415 HydrophobicContact CG2-CB 3.67Å; I370-A415 WeakPolarHBondContact CG2-O 3.41Å; I370-I416 HydrophobicContact CD1-CD1 4.02Å; I370-I416 HydrophobicContact CD1-CG1 3.76Å; I370-I416 HydrophobicContact CG1-CD1 4.26Å; I370-I416 HydrophobicContact CG1-CG1 3.86Å; I370-I416 HydrophobicContact CG2-CG1 3.92Å; I370-F420 HydrophobicContact CG1-CE2 4.45Å; I370-F420 HydrophobicContact CG2-CE2 4.39Å; I370-F420 HydrophobicContact CG2-CZ 4.02Å
371	S	97.5	Very high	96.1	Very high	48 Å²	48	49.5 Å²	49.5	34%	0.336	23%	0.225	S	C	.	.	H	α-helix	trans	-60.5	-39.1	177	-177.2	0	0	0	0	111.8	L367 G369 N374 K375	L367-S371 WeakPolarHBondContact O-CB 3.39Å; L367-S371 PolarHBondContact O-N 3.12Å; G369-S371 PolarHBondContact O-N 2.78Å; S371-N374 PolarHBondContact O-N 2.88Å; S371-K375 WeakPolarHBondContact O-CB 3.44Å; S371-K375 VanDerWaalsContact O-CG 3.32Å; S371-K375 WeakPolarHBondContact O-CG 3.49Å; S371-K375 PolarHBondContact O-N 2.89Å
372	M	97.3	Very high	96.1	Very high	10 Å²	10	49.7 Å²	49.7	5%	0.049	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-43.6	177.8	-172.2	-179.5	-67.8	0	0	112.1	N321 T331 L336 R368 G369 I370 A376	N321-M372 HydrophobicContact CB-SD 3.61Å; N321-M372 VanDerWaalsContact ND2-CE 3.29Å; N321-M372 WeakPolarHBondContact ND2-CE 3.29Å; N321-M372 PolarHBondContact ND2-SD 3.05Å; T331-M372 HydrophobicContact CG2-CE 4Å; L336-M372 HydrophobicContact CD2-SD 4.42Å; L336-M372 HydrophobicContact CG-CG 4.29Å; L336-M372 HydrophobicContact CG-SD 4.48Å; R368-M372 WeakPolarHBondContact O-CB 3.29Å; R368-M372 PolarHBondContact O-N 3.15Å; G369-M372 WeakPolarHBondContact O-CB 3.44Å; G369-M372 PolarHBondContact O-N 2.89Å; I370-M372 VanDerWaalsContact C-N 3.28Å; I370-M372 PolarHBondContact O-N 2.66Å; M372-A376 WeakPolarHBondContact O-CB 3.3Å; M372-A376 PolarHBondContact O-N 2.78Å
373	L	97.3	Very high	95.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64	-46.7	175.9	-64.9	178.6	0	0	0	111.6	N284 A286 L336 G369 I370 A376 R377 V390 F420	N284-L373 HydrophobicContact CB-CD2 4.19Å; N284-L373 WeakPolarHBondContact O-CD2 3.21Å; A286-L373 HydrophobicContact CB-CD1 3.89Å; A286-L373 HydrophobicContact CB-CD2 4.05Å; A286-L373 HydrophobicContact CB-CG 3.92Å; L336-L373 HydrophobicContact CD1-CD2 3.82Å; L336-L373 HydrophobicContact CD2-CD2 4.03Å; L336-L373 HydrophobicContact CG-CD2 4.35Å; G369-L373 PolarHBondContact O-N 2.84Å; G369-L373 VanDerWaalsContact O-N 3.09Å; I370-L373 PolarHBondContact O-N 2.95Å; L373-A376 PolarHBondContact O-N 2.83Å; L373-R377 PolarHBondContact O-N 2.82Å; L373-V390 HydrophobicContact CD1-CG2 3.43Å; L373-V390 VanDerWaalsContact CD1-CG2 3.43Å; L373-F420 HydrophobicContact CB-CE1 4.14Å; L373-F420 HydrophobicContact CB-CZ 3.9Å; L373-F420 HydrophobicContact CD1-CD2 4.22Å; L373-F420 HydrophobicContact CD1-CE2 3.78Å; L373-F420 HydrophobicContact CD1-CZ 3.98Å
374	N	96.1	Very high	95.5	Very high	19 Å²	19	60 Å²	60	10%	0.102	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-49.5	178.2	-82.8	-40.9	0	0	0	111.8	I370 S371 A376 R377 E378 A415 K419	I370-N374 PolarHBondContact O-N 3.13Å; I370-N374 PolarHBondContact O-ND2 2.88Å; S371-N374 PolarHBondContact O-N 2.88Å; N374-A376 VanDerWaalsContact C-N 3.34Å; N374-A376 PolarHBondContact O-N 2.88Å; N374-R377 PolarHBondContact O-N 2.68Å; N374-E378 WeakPolarHBondContact O-CG 3.37Å; N374-E378 PolarHBondContact O-N 2.83Å; N374-A415 PolarHBondContact ND2-O 3.38Å; N374-K419 WeakPolarHBondContact OD1-CD 3.36Å; N374-K419 PolarHBondContact OD1-NZ 2.96Å; N374-K419 VanDerWaalsContact OD1-NZ 3.07Å
375	K	96.1	Very high	95.2	Very high	108 Å²	108	62.3 Å²	62.3	47%	0.47	28%	0.283	S	S	.	.	H	α-helix	trans	-60.9	-41.9	178.3	-76	-178.6	179.4	-176	0	112.4	S371 R377 E378 E379	S371-K375 WeakPolarHBondContact O-CB 3.44Å; S371-K375 VanDerWaalsContact O-CG 3.32Å; S371-K375 WeakPolarHBondContact O-CG 3.49Å; S371-K375 PolarHBondContact O-N 2.89Å; K375-R377 PolarHBondContact O-N 2.82Å; K375-E378 PolarHBondContact O-N 3.02Å; K375-E379 VanDerWaalsContact O-CB 3.25Å; K375-E379 WeakPolarHBondContact O-CB 3.48Å; K375-E379 VanDerWaalsContact O-CG 3.3Å; K375-E379 WeakPolarHBondContact O-CG 3.5Å; K375-E379 PolarHBondContact O-N 3.36Å
376	A	95.8	Very high	95.1	Very high	6 Å²	6	63.4 Å²	63.4	5%	0.05	29%	0.29	C	S	.	.	H	α-helix	trans	-60.4	-37	179	0	0	0	0	0	112.2	L336 M372 L373 N374 H380 R381 V382	L336-A376 HydrophobicContact CD1-CB 3.59Å; L336-A376 HydrophobicContact CG-CB 4.28Å; M372-A376 WeakPolarHBondContact O-CB 3.3Å; M372-A376 PolarHBondContact O-N 2.78Å; L373-A376 PolarHBondContact O-N 2.83Å; N374-A376 VanDerWaalsContact C-N 3.34Å; N374-A376 PolarHBondContact O-N 2.88Å; A376-H380 PolarHBondContact O-N 2.97Å; A376-R381 PolarHBondContact O-N 3Å; A376-V382 HydrophobicContact CB-CG1 4.02Å; A376-V382 HydrophobicContact CB-CG2 4.39Å
377	R	93.4	Very high	94.9	Very high	143 Å²	143	63.9 Å²	63.9	54%	0.54	29%	0.293	S	S	.	.	H	α-helix	trans	-71.7	-47.8	174.4	-172.2	174.2	-178.7	175.1	1.2	112.2	L373 N374 K375 E379 H380	L373-R377 PolarHBondContact O-N 2.82Å; N374-R377 PolarHBondContact O-N 2.68Å; K375-R377 PolarHBondContact O-N 2.82Å; R377-E379 VanDerWaalsContact C-N 3.29Å; R377-E379 PolarHBondContact O-N 2.89Å; R377-H380 PolarHBondContact O-N 3.16Å; R377-H380 VanDerWaalsContact O-N 3.15Å
378	E	93.4	Very high	94.8	Very high	123 Å²	123	61.9 Å²	61.9	58%	0.575	28%	0.283	S	S	*	.	H	α-helix	trans	-60.7	-38	179.3	-72	166.5	-168.6	0	0	112.3	N374 K375 H380	N374-E378 WeakPolarHBondContact O-CG 3.37Å; N374-E378 PolarHBondContact O-N 2.83Å; K375-E378 PolarHBondContact O-N 3.02Å; E378-H380 VanDerWaalsContact C-N 3.31Å; E378-H380 PolarHBondContact O-CE1 3.33Å; E378-H380 PolarHBondContact O-ND1 2.9Å
379	E	95.3	Very high	94.6	Very high	92 Å²	92	56.9 Å²	56.9	43%	0.43	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	6.1	179.6	-62.2	175.2	178.5	0	0	113.2	K375 R377 R381	K375-E379 VanDerWaalsContact O-CB 3.25Å; K375-E379 WeakPolarHBondContact O-CB 3.48Å; K375-E379 VanDerWaalsContact O-CG 3.3Å; K375-E379 WeakPolarHBondContact O-CG 3.5Å; K375-E379 PolarHBondContact O-N 3.36Å; R377-E379 VanDerWaalsContact C-N 3.29Å; R377-E379 PolarHBondContact O-N 2.89Å; E379-R381 HydrophobicContact CB-CG 4.04Å; E379-R381 PolarHBondContact O-N 2.84Å; E379-R381 IonicContact OE2-CZ 2.79Å; E379-R381 IonicContact OE2-NE 3.64Å; E379-R381 PolarHBondContact OE2-NE 3.44Å; E379-R381 IonicContact OE2-NH1 3.56Å; E379-R381 PolarHBondContact OE2-NH1 3.45Å; E379-R381 IonicContact OE2-NH2 3.74Å; E379-R381 PolarHBondContact OE2-NH2 2.9Å
380	H	93	Very high	94.6	Very high	139 Å²	139	56.9 Å²	56.9	64%	0.644	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	37.1	179	-54.7	70.4	0	0	0	113.5	A376 R377 E378	A376-H380 PolarHBondContact O-N 2.97Å; R377-H380 PolarHBondContact O-N 3.16Å; R377-H380 VanDerWaalsContact O-N 3.15Å; E378-H380 VanDerWaalsContact C-N 3.31Å; E378-H380 PolarHBondContact O-CE1 3.33Å; E378-H380 PolarHBondContact O-ND1 2.9Å
381	R	92.6	Very high	94.6	Very high	111 Å²	111	57.3 Å²	57.3	42%	0.419	27%	0.266	S	S	.	.			trans	-88.9	-9	179	-66.8	-176.6	178.6	174.9	3.4	113.9	Y319 H335 A376 E379	Y319-R381 WeakPolarHBondContact CE1-O 3.46Å; H335-R381 PolarHBondContact CD2-NH1 3.17Å; H335-R381 PolarHBondContact CE1-NH1 3.41Å; H335-R381 PolarHBondContact ND1-NH1 3.09Å; H335-R381 PolarHBondContact NE2-NH1 3.37Å; A376-R381 PolarHBondContact O-N 3Å; E379-R381 HydrophobicContact CB-CG 4.04Å; E379-R381 PolarHBondContact O-N 2.84Å; E379-R381 IonicContact OE2-CZ 2.79Å; E379-R381 IonicContact OE2-NE 3.64Å; E379-R381 PolarHBondContact OE2-NE 3.44Å; E379-R381 IonicContact OE2-NH1 3.56Å; E379-R381 PolarHBondContact OE2-NH1 3.45Å; E379-R381 IonicContact OE2-NH2 3.74Å; E379-R381 PolarHBondContact OE2-NH2 2.9Å
382	V	94.5	Very high	94.6	Very high	13 Å²	13	55 Å²	55	8%	0.079	25%	0.25	C	S	.	.	S	Bend	trans	-122.4	156.3	175	-67.7	0	0	0	0	109	N284 Y319 L336 A376	N284-V382 HydrophobicContact CB-CG1 4.43Å; N284-V382 WeakPolarHBondContact OD1-CB 3.45Å; N284-V382 WeakPolarHBondContact OD1-CG1 3.35Å; Y319-V382 HydrophobicContact CD1-CG1 3.95Å; Y319-V382 HydrophobicContact CD2-CG1 4.29Å; Y319-V382 HydrophobicContact CE1-CG1 4.42Å; Y319-V382 HydrophobicContact CG-CG1 3.88Å; L336-V382 HydrophobicContact CD1-CG1 3.76Å; A376-V382 HydrophobicContact CB-CG1 4.02Å; A376-V382 HydrophobicContact CB-CG2 4.39Å
383	P	91.9	Very high	94.6	Very high	52 Å²	52	54.8 Å²	54.8	34%	0.338	25%	0.249	S	C	.	.			trans	-57.9	142.2	-179.9	-23	32.8	0	0	0	112.4	Y319 R385 S386	Y319-P383 HydrophobicContact CE2-CG 4.07Å; P383-R385 VanDerWaalsContact C-N 3.28Å; P383-R385 PolarHBondContact O-N 3.14Å; P383-S386 WeakPolarHBondContact O-CB 3.5Å; P383-S386 PolarHBondContact O-N 3.17Å; P383-S386 PolarHBondContact O-OG 3.33Å
384	E	88.8	Confident	94.6	Very high	171 Å²	171	54.8 Å²	54.8	80%	0.799	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-37.3	179.6	-70.8	-173.7	169.5	0	0	112.9	S386	E384-S386 VanDerWaalsContact C-N 3.3Å; E384-S386 PolarHBondContact O-N 2.86Å
385	R	90.4	Very high	94.4	Very high	118 Å²	118	54 Å²	54	45%	0.445	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	48.3	175.5	-71	-169	161.5	146.6	-8.1	112.3	P383 A524 A525 D527	P383-R385 VanDerWaalsContact C-N 3.28Å; P383-R385 PolarHBondContact O-N 3.14Å; R385-A524 WeakPolarHBondContact CD-O 3.46Å; R385-A525 PolarHBondContact NH1-O 2.89Å; R385-D527 IonicContact NH2-OD1 2.88Å
386	S	93.4	Very high	94	Very high	22 Å²	22	49.3 Å²	49.3	15%	0.154	23%	0.228	C	C	.	.			trans	-118.2	158.8	170.5	64.9	0	0	0	0	110.4	P282 N284 P383 E384	P282-S386 CarbonylContact O-C 3.48Å; P282-S386 WeakPolarHBondContact O-CA 3.25Å; P282-S386 VanDerWaalsContact O-CB 3.25Å; P282-S386 WeakPolarHBondContact O-CB 3.5Å; N284-S386 PolarHBondContact ND2-OG 3.42Å; P383-S386 WeakPolarHBondContact O-CB 3.5Å; P383-S386 PolarHBondContact O-N 3.17Å; P383-S386 PolarHBondContact O-OG 3.33Å; E384-S386 VanDerWaalsContact C-N 3.3Å; E384-S386 PolarHBondContact O-N 2.86Å
387	T	94	Very high	93.7	Very high	10 Å²	10	52.9 Å²	52.9	6%	0.061	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	134	176.4	-173.6	0	0	0	0	112.1	V281 P282 K283 N284 P470 T473 H494	V281-T387 HydrophobicContact CG1-CG2 4.23Å; P282-T387 PolarHBondContact O-N 3.14Å; K283-T387 CarbonylContact C-O 3.51Å; K283-T387 VanDerWaalsContact CA-O 3.25Å; K283-T387 WeakPolarHBondContact CA-O 3.32Å; K283-T387 HydrophobicContact CB-CG2 4.19Å; N284-T387 PolarHBondContact N-O 3.31Å; T387-P470 HydrophobicContact CG2-CB 4.22Å; T387-P470 HydrophobicContact CG2-CG 3.68Å; T387-T473 HydrophobicContact CG2-CG2 4.41Å; T387-H494 PolarHBondContact OG1-CE1 3.12Å; T387-H494 PolarHBondContact OG1-NE2 3.4Å
388	S	95.3	Very high	93.4	Very high	8 Å²	8	46.8 Å²	46.8	6%	0.056	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	147.7	171.5	-68.7	0	0	0	0	111.1	N284 F420	N284-S388 CarbonylContact O-C 3.38Å; N284-S388 WeakPolarHBondContact O-CA 3.32Å; S388-F420 VanDerWaalsContact CB-CD1 3.47Å; S388-F420 WeakPolarHBondContact O-CB 3.49Å
389	I	95.4	Very high	93.1	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	136.3	176	-55.9	177.6	0	0	0	108.6	K283 N284 V285 A286 I391 P421 Y423	K283-I389 HydrophobicContact CB-CD1 4.37Å; N284-I389 PolarHBondContact O-N 3.03Å; V285-I389 WeakPolarHBondContact CA-O 3.42Å; A286-I389 PolarHBondContact N-O 3.13Å; I389-I391 HydrophobicContact CG2-CD1 4.49Å; I389-I391 HydrophobicContact CG2-CG1 3.99Å; I389-P421 HydrophobicContact CG1-CG 4.28Å; I389-P421 HydrophobicContact CG2-CG 4.44Å; I389-Y423 HydrophobicContact CG2-CD2 3.56Å; I389-Y423 HydrophobicContact CG2-CE2 3.63Å
390	V	97.5	Very high	92.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	128	167.1	-176.7	0	0	0	0	108.8	V288 L366 I370 L373 F420 P421 L422 Y423	V288-V390 HydrophobicContact CG2-CG1 3.88Å; L366-V390 HydrophobicContact CD2-CG1 4.17Å; I370-V390 HydrophobicContact CG1-CG2 4.11Å; L373-V390 HydrophobicContact CD1-CG2 3.43Å; L373-V390 VanDerWaalsContact CD1-CG2 3.43Å; V390-F420 HydrophobicContact CG2-CD2 4.04Å; V390-F420 HydrophobicContact CG2-CE2 3.64Å; V390-P421 PolarHBondContact N-O 2.79Å; V390-P421 VanDerWaalsContact N-O 3.09Å; V390-L422 HydrophobicContact CB-CD1 3.7Å; V390-L422 HydrophobicContact CG1-CD1 3.46Å; V390-L422 VanDerWaalsContact CG1-CD1 3.46Å; V390-Y423 PolarHBondContact O-N 3.15Å
391	I	97.6	Very high	92.7	Very high	8 Å²	8	38.2 Å²	38.2	4%	0.041	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	113.5	171.8	-59.8	172.7	0	0	0	107.1	V285 A286 F287 V288 I389 Y423 L425 F463 Y464 V467	V285-I391 HydrophobicContact CG1-CD1 4.01Å; V285-I391 HydrophobicContact CG1-CG1 4.36Å; A286-I391 PolarHBondContact O-N 3.23Å; F287-I391 WeakPolarHBondContact CA-O 3.35Å; F287-I391 HydrophobicContact CD1-CB 4.21Å; F287-I391 HydrophobicContact CD1-CD1 4.47Å; F287-I391 HydrophobicContact CE1-CD1 3.92Å; V288-I391 PolarHBondContact N-O 2.71Å; I389-I391 HydrophobicContact CG2-CD1 4.49Å; I389-I391 HydrophobicContact CG2-CG1 3.99Å; I391-Y423 WeakPolarHBondContact CA-O 3.4Å; I391-Y423 HydrophobicContact CG1-CD2 4.33Å; I391-L425 HydrophobicContact CG2-CD1 3.9Å; I391-L425 HydrophobicContact CG2-CG 4.4Å; I391-F463 HydrophobicContact CD1-CE1 4.19Å; I391-F463 HydrophobicContact CG1-CE1 4.38Å; I391-F463 HydrophobicContact CG2-CE1 3.86Å; I391-F463 HydrophobicContact CG2-CZ 4.49Å; I391-Y464 HydrophobicContact CD1-CD2 3.95Å; I391-Y464 HydrophobicContact CD1-CE2 4.2Å; I391-V467 HydrophobicContact CD1-CG2 4.41Å
392	M	97.9	Very high	92.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	140.5	177.4	-171.9	-87	-69.2	0	0	110.6	V288 F325 L366 T394 L422 Y423 N424 L425 L436	V288-M392 HydrophobicContact CB-CB 4.18Å; V288-M392 HydrophobicContact CB-CG 4.08Å; V288-M392 HydrophobicContact CG1-CG 4.06Å; V288-M392 CarbonylContact O-C 3.53Å; V288-M392 WeakPolarHBondContact O-CA 3.34Å; F325-M392 HydrophobicContact CE1-CG 4.32Å; F325-M392 HydrophobicContact CZ-SD 4.32Å; L366-M392 HydrophobicContact CD2-CB 3.85Å; L366-M392 HydrophobicContact CD2-CG 3.85Å; L366-M392 HydrophobicContact CG-CG 4.38Å; M392-T394 HydrophobicContact CE-CG2 3.96Å; M392-T394 HydrophobicContact SD-CG2 3.6Å; M392-T394 VanDerWaalsContact SD-CG2 3.6Å; M392-L422 HydrophobicContact CB-CD1 4.4Å; M392-Y423 PolarHBondContact N-O 3.13Å; M392-N424 HydrophobicContact CE-CB 4.06Å; M392-N424 VanDerWaalsContact CE-OD1 3.24Å; M392-N424 WeakPolarHBondContact CE-OD1 3.3Å; M392-L425 WeakPolarHBondContact O-CB 3.38Å; M392-L425 PolarHBondContact O-N 2.77Å; M392-L436 HydrophobicContact CE-CD2 3.61Å
393	L	97.6	Very high	92.7	Very high	5 Å²	5	38 Å²	38	3%	0.026	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	128.9	173.4	-177.9	152	0	0	0	109.9	V288 I289 D290 M295 T303 L425 F427 L460	V288-L393 PolarHBondContact O-N 2.87Å; I289-L393 HydrophobicContact CD1-CB 4Å; D290-L393 WeakPolarHBondContact CB-O 3.46Å; D290-L393 PolarHBondContact N-O 3.34Å; M295-L393 HydrophobicContact CE-CD2 3.48Å; M295-L393 VanDerWaalsContact CE-CD2 3.48Å; M295-L393 HydrophobicContact SD-CD2 4.39Å; T303-L393 HydrophobicContact CG2-CD1 4.08Å; T303-L393 HydrophobicContact CG2-CD2 4.15Å; L393-L425 WeakPolarHBondContact CA-O 3.36Å; L393-L425 HydrophobicContact CB-CB 4.21Å; L393-L425 HydrophobicContact CD1-CB 4.43Å; L393-L425 HydrophobicContact CD1-CD1 4.45Å; L393-L425 HydrophobicContact CG-CB 4.28Å; L393-F427 HydrophobicContact CD1-CD1 4.4Å; L393-F427 HydrophobicContact CD2-CD1 4.28Å; L393-L460 HydrophobicContact CD1-CD1 4.14Å; L393-L460 HydrophobicContact CD1-CD2 3.56Å
394	T	95.5	Very high	92.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	151	177.6	-174.7	0	0	0	0	111.8	D290 I362 M392 G396 L425 F427 L436	D290-T394 WeakPolarHBondContact OD2-CB 3.5Å; D290-T394 PolarHBondContact OD2-OG1 2.92Å; I362-T394 HydrophobicContact CD1-CG2 4.41Å; M392-T394 HydrophobicContact CE-CG2 3.96Å; M392-T394 HydrophobicContact SD-CG2 3.6Å; M392-T394 VanDerWaalsContact SD-CG2 3.6Å; T394-G396 PolarHBondContact OG1-N 3.27Å; T394-G396 PolarHBondContact OG1-O 3.42Å; T394-G396 VanDerWaalsContact OG1-O 3.1Å; T394-L425 PolarHBondContact N-O 2.91Å; T394-F427 PolarHBondContact O-N 3.5Å; T394-L436 HydrophobicContact CG2-CD1 3.81Å; T394-L436 HydrophobicContact CG2-CD2 4.21Å
395	D	92.3	Very high	92.8	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.016	20%	0.204	C	C	.	.	S	Bend	trans	-111.5	5.8	175.3	78	-27.7	0	0	0	114.2	S294 M295 K299 F427	S294-D395 WeakPolarHBondContact CB-OD2 3.34Å; S294-D395 VanDerWaalsContact O-OD2 3.04Å; S294-D395 VanDerWaalsContact OG-CG 3.32Å; S294-D395 PolarHBondContact OG-OD1 3.2Å; S294-D395 PolarHBondContact OG-OD2 3.16Å; M295-D395 HydrophobicContact CG-CB 4.45Å; M295-D395 PolarHBondContact N-OD2 3.24Å; M295-D395 HydrophobicContact SD-CB 3.5Å; M295-D395 WeakPolarHBondContact SD-CB 3.49Å; K299-D395 HydrophobicContact CD-CB 4.16Å; K299-D395 WeakPolarHBondContact CE-OD2 3.44Å; K299-D395 IonicContact NZ-OD2 3.87Å; K299-D395 PolarHBondContact NZ-OD2 3.39Å; D395-F427 VanDerWaalsContact CA-O 3.28Å; D395-F427 WeakPolarHBondContact CA-O 3.23Å; D395-F427 HydrophobicContact CB-CB 4.09Å; D395-F427 VanDerWaalsContact CB-O 3.32Å; D395-F427 WeakPolarHBondContact CB-O 3.35Å
396	G	89.1	Confident	92.8	Very high	10 Å²	10	38 Å²	38	10%	0.103	22%	0.215	C	C	.	.	S	Bend	trans	-156	177.4	-173.7	0	0	0	0	0	114.2	T394	T394-G396 PolarHBondContact OG1-N 3.27Å; T394-G396 PolarHBondContact OG1-O 3.42Å; T394-G396 VanDerWaalsContact OG1-O 3.1Å
397	D	89.4	Confident	92.9	Very high	80 Å²	80	40 Å²	40	43%	0.428	22%	0.221	S	C	.	.			trans	-87.1	154.7	179.4	-64.2	-36.9	0	0	0	112.3	N399 N432	D397-N399 PolarHBondContact O-N 2.93Å; D397-N432 VanDerWaalsContact OD1-CB 3.31Å; D397-N432 WeakPolarHBondContact OD1-CB 3.39Å; D397-N432 PolarHBondContact OD1-N 3.06Å
398	A	87.4	Confident	93	Very high	15 Å²	15	39.5 Å²	39.5	12%	0.124	22%	0.218	C	C	.	.			trans	-61.3	125.8	174.4	0	0	0	0	0	111.3	I362 S403 I408	I362-A398 HydrophobicContact CB-CB 4.13Å; I362-A398 HydrophobicContact CD1-CB 4.06Å; I362-A398 HydrophobicContact CG1-CB 4.12Å; A398-S403 WeakPolarHBondContact O-CB 3.47Å; A398-I408 HydrophobicContact CB-CD1 3.77Å
399	N	86.4	Confident	92.9	Very high	78 Å²	78	40.1 Å²	40.1	42%	0.417	22%	0.22	S	C	.	.			trans	-134.5	-5.3	-176	61.4	33.2	0	0	0	113.9	M359 T360 D397	M359-N399 WeakPolarHBondContact CB-OD1 3.45Å; T360-N399 WeakPolarHBondContact CA-OD1 3.38Å; T360-N399 PolarHBondContact N-OD1 2.94Å; T360-N399 PolarHBondContact O-N 2.92Å; T360-N399 PolarHBondContact O-OD1 2.96Å; T360-N399 PolarHBondContact OG1-ND2 3.21Å; D397-N399 PolarHBondContact O-N 2.93Å
400	V	89.1	Confident	92.9	Very high	44 Å²	44	43.5 Å²	43.5	27%	0.267	24%	0.235	S	C	.	.	S	Bend	trans	-130.4	144.8	172.6	170.4	0	0	0	0	109.5	M359 T360 N361	M359-V400 HydrophobicContact CB-CB 4.39Å; M359-V400 HydrophobicContact CB-CG2 3.38Å; M359-V400 HydrophobicContact CG-CG2 3.94Å; T360-V400 PolarHBondContact O-N 3.42Å; T360-V400 VanDerWaalsContact O-N 3.09Å; N361-V400 WeakPolarHBondContact CA-O 3.45Å; N361-V400 HydrophobicContact CB-CB 4.23Å; N361-V400 HydrophobicContact CB-CG1 4.23Å; N361-V400 PolarHBondContact OD1-O 2.95Å
401	G	91.1	Very high	92.9	Very high	53 Å²	53	45.2 Å²	45.2	55%	0.546	24%	0.244	S	C	.	.	S	Bend	trans	78.6	-141.2	-174.2	0	0	0	0	0	111.6
402	E	95.4	Very high	92.9	Very high	57 Å²	57	44.8 Å²	44.8	27%	0.266	24%	0.243	S	C	.	.			trans	-75.2	121.2	169.3	179.6	58	-99.9	0	0	109.5	N363 R404 K407 I408	N363-E402 HydrophobicContact CB-CB 4.08Å; E402-R404 WeakPolarHBondContact OE1-CB 3.29Å; E402-R404 WeakPolarHBondContact OE1-CG 3.31Å; E402-R404 PolarHBondContact OE1-N 2.65Å; E402-K407 HydrophobicContact CG-CB 4.04Å; E402-K407 HydrophobicContact CG-CG 3.92Å; E402-K407 WeakPolarHBondContact OE2-CG 3.35Å; E402-I408 HydrophobicContact CG-CG1 3.94Å; E402-I408 WeakPolarHBondContact O-CD1 3.4Å
403	S	90.8	Very high	92.7	Very high	61 Å²	61	50.4 Å²	50.4	43%	0.427	26%	0.264	S	S	.	.			trans	-115.7	-4.5	-176.3	57.7	0	0	0	0	113.6	A398 P405	A398-S403 WeakPolarHBondContact O-CB 3.47Å; S403-P405 VanDerWaalsContact O-CD 3.3Å; S403-P405 WeakPolarHBondContact O-CD 3.26Å
404	R	92.6	Very high	92.7	Very high	145 Å²	145	55.1 Å²	55.1	55%	0.547	29%	0.289	S	S	.	.			trans	-77.7	117.2	179.1	-64.8	172.2	55.1	-166.9	-6.8	110.4	E402 E406 K407 I408	E402-R404 WeakPolarHBondContact OE1-CB 3.29Å; E402-R404 WeakPolarHBondContact OE1-CG 3.31Å; E402-R404 PolarHBondContact OE1-N 2.65Å; R404-E406 PolarHBondContact O-N 2.65Å; R404-K407 HydrophobicContact CB-CB 4.08Å; R404-K407 PolarHBondContact O-N 3.14Å; R404-I408 WeakPolarHBondContact O-CG1 3.28Å; R404-I408 PolarHBondContact O-N 3.24Å
405	P	91.1	Very high	92.7	Very high	55 Å²	55	56.5 Å²	56.5	36%	0.357	30%	0.301	S	S	.	.	H	α-helix	trans	-48.6	-52.3	-177.6	-33.3	39.3	0	0	0	114.1	S403 K407 I408 Q409 F435	S403-P405 VanDerWaalsContact O-CD 3.3Å; S403-P405 WeakPolarHBondContact O-CD 3.26Å; P405-K407 VanDerWaalsContact C-N 3.27Å; P405-K407 PolarHBondContact O-N 2.84Å; P405-I408 PolarHBondContact O-N 3.49Å; P405-Q409 WeakPolarHBondContact O-CG 3.3Å; P405-Q409 PolarHBondContact O-N 2.72Å; P405-Q409 PolarHBondContact O-OE1 3.43Å; P405-F435 HydrophobicContact CB-CD2 3.49Å; P405-F435 VanDerWaalsContact CB-CD2 3.49Å; P405-F435 HydrophobicContact CB-CE2 3.84Å; P405-F435 HydrophobicContact CB-CG 4.12Å; P405-F435 HydrophobicContact CG-CD2 4.37Å; P405-F435 WeakPolarHBondContact O-CE2 3.28Å
406	E	90.5	Very high	92.9	Very high	141 Å²	141	56.4 Å²	56.4	66%	0.659	30%	0.3	S	S	*	.	H	α-helix	trans	-58.3	-37.3	-179.4	-62.7	174	176	0	0	112.8	R404 E410	R404-E406 PolarHBondContact O-N 2.65Å; E406-E410 WeakPolarHBondContact O-CB 3.49Å; E406-E410 PolarHBondContact O-N 2.88Å
407	K	94.8	Very high	93.1	Very high	65 Å²	65	58.4 Å²	58.4	28%	0.283	32%	0.32	S	S	.	.	H	α-helix	trans	-76.1	-37.8	-178.7	-170.8	63.4	-168.4	169	0	111.6	E402 R404 P405 E410 N411	E402-K407 HydrophobicContact CG-CB 4.04Å; E402-K407 HydrophobicContact CG-CG 3.92Å; E402-K407 WeakPolarHBondContact OE2-CG 3.35Å; R404-K407 HydrophobicContact CB-CB 4.08Å; R404-K407 PolarHBondContact O-N 3.14Å; P405-K407 VanDerWaalsContact C-N 3.27Å; P405-K407 PolarHBondContact O-N 2.84Å; K407-E410 WeakPolarHBondContact CD-OE2 3.48Å; K407-E410 IonicContact NZ-OE1 3.04Å; K407-E410 IonicContact NZ-OE2 3.81Å; K407-E410 PolarHBondContact NZ-OE2 3.24Å; K407-E410 PolarHBondContact O-N 3.03Å; K407-N411 WeakPolarHBondContact CE-OD1 3.42Å; K407-N411 WeakPolarHBondContact O-CB 3.47Å; K407-N411 PolarHBondContact O-N 3.4Å; K407-N411 PolarHBondContact O-ND2 3.47Å; K407-N411 PolarHBondContact O-OD1 2.85Å
408	I	95.3	Very high	93.1	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.3	-46.4	174.3	-57.2	171.6	0	0	0	109.7	N363 A398 E402 R404 P405 E410 N411 V412 F435 M439	N363-I408 HydrophobicContact CB-CG1 4.15Å; N363-I408 HydrophobicContact CB-CG2 4.34Å; A398-I408 HydrophobicContact CB-CD1 3.77Å; E402-I408 HydrophobicContact CG-CG1 3.94Å; E402-I408 WeakPolarHBondContact O-CD1 3.4Å; R404-I408 WeakPolarHBondContact O-CG1 3.28Å; R404-I408 PolarHBondContact O-N 3.24Å; P405-I408 PolarHBondContact O-N 3.49Å; I408-E410 VanDerWaalsContact C-N 3.35Å; I408-E410 PolarHBondContact O-N 2.93Å; I408-N411 PolarHBondContact O-N 3.44Å; I408-V412 HydrophobicContact CG2-CG2 4.17Å; I408-V412 WeakPolarHBondContact O-CB 3.47Å; I408-V412 VanDerWaalsContact O-CG2 3.25Å; I408-V412 WeakPolarHBondContact O-CG2 3.47Å; I408-V412 PolarHBondContact O-N 3.39Å; I408-F435 HydrophobicContact CB-CE2 4.13Å; I408-F435 HydrophobicContact CB-CZ 4.05Å; I408-F435 HydrophobicContact CD1-CE2 4.5Å; I408-F435 HydrophobicContact CD1-CZ 3.88Å; I408-F435 HydrophobicContact CG2-CE2 4.4Å; I408-F435 HydrophobicContact CG2-CZ 3.99Å; I408-M439 HydrophobicContact CB-CE 4.44Å; I408-M439 HydrophobicContact CG2-CE 3.66Å
409	Q	94.4	Very high	93.2	Very high	21 Å²	21	59.5 Å²	59.5	10%	0.098	33%	0.328	C	S	.	.	H	α-helix	trans	-55.9	-48.9	175.2	-71.6	173.5	-83.9	0	0	111.3	P405 N411 V412 R413 F435 N438 M439 E442	P405-Q409 WeakPolarHBondContact O-CG 3.3Å; P405-Q409 PolarHBondContact O-N 2.72Å; P405-Q409 PolarHBondContact O-OE1 3.43Å; Q409-N411 PolarHBondContact O-N 3.23Å; Q409-V412 PolarHBondContact O-N 3.32Å; Q409-R413 VanDerWaalsContact O-CB 3.23Å; Q409-R413 WeakPolarHBondContact O-CB 3.4Å; Q409-R413 PolarHBondContact O-N 3.31Å; Q409-F435 HydrophobicContact CG-CD2 4.13Å; Q409-F435 HydrophobicContact CG-CE2 3.99Å; Q409-N438 VanDerWaalsContact NE2-CB 3.3Å; Q409-M439 HydrophobicContact CG-CB 4.03Å; Q409-M439 HydrophobicContact CG-CE 4.39Å; Q409-M439 HydrophobicContact CG-CG 4.3Å; Q409-E442 PolarHBondContact NE2-OE1 2.86Å
410	E	94.8	Very high	93.5	Very high	72 Å²	72	56 Å²	56	34%	0.336	31%	0.309	S	S	.	.	H	α-helix	trans	-59	-47.4	177	-169.4	-162.2	166	0	0	112.2	E406 K407 I408 R413 N414	E406-E410 WeakPolarHBondContact O-CB 3.49Å; E406-E410 PolarHBondContact O-N 2.88Å; K407-E410 WeakPolarHBondContact CD-OE2 3.48Å; K407-E410 IonicContact NZ-OE1 3.04Å; K407-E410 IonicContact NZ-OE2 3.81Å; K407-E410 PolarHBondContact NZ-OE2 3.24Å; K407-E410 PolarHBondContact O-N 3.03Å; I408-E410 VanDerWaalsContact C-N 3.35Å; I408-E410 PolarHBondContact O-N 2.93Å; E410-R413 PolarHBondContact O-N 3.19Å; E410-N414 WeakPolarHBondContact O-CB 3.2Å; E410-N414 PolarHBondContact O-N 2.99Å; E410-N414 PolarHBondContact O-ND2 2.91Å
411	N	97.3	Very high	93.7	Very high	36 Å²	36	53.9 Å²	53.9	19%	0.193	30%	0.296	C	S	.	.	H	α-helix	trans	-60.6	-47.2	179.7	-69.9	-16.2	0	0	0	111.4	N363 L367 K407 I408 Q409 N414 A415	N363-N411 PolarHBondContact OD1-ND2 3.06Å; L367-N411 HydrophobicContact CD1-CB 4.49Å; L367-N411 HydrophobicContact CD2-CB 4.36Å; K407-N411 WeakPolarHBondContact CE-OD1 3.42Å; K407-N411 WeakPolarHBondContact O-CB 3.47Å; K407-N411 PolarHBondContact O-N 3.4Å; K407-N411 PolarHBondContact O-ND2 3.47Å; K407-N411 PolarHBondContact O-OD1 2.85Å; I408-N411 PolarHBondContact O-N 3.44Å; Q409-N411 PolarHBondContact O-N 3.23Å; N411-N414 PolarHBondContact O-N 2.94Å; N411-A415 VanDerWaalsContact O-CB 3.28Å; N411-A415 WeakPolarHBondContact O-CB 3.39Å; N411-A415 PolarHBondContact O-N 2.86Å
412	V	97.2	Very high	94	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.2	-48.7	180	168.9	0	0	0	0	110.6	L366 I370 I408 Q409 N414 A415 I416 L422 M439	L366-V412 HydrophobicContact CB-CG2 4.08Å; L366-V412 HydrophobicContact CD1-CG2 3.78Å; I370-V412 HydrophobicContact CD1-CG1 4.01Å; I370-V412 HydrophobicContact CD1-CG2 4.44Å; I408-V412 HydrophobicContact CG2-CG2 4.17Å; I408-V412 WeakPolarHBondContact O-CB 3.47Å; I408-V412 VanDerWaalsContact O-CG2 3.25Å; I408-V412 WeakPolarHBondContact O-CG2 3.47Å; I408-V412 PolarHBondContact O-N 3.39Å; Q409-V412 PolarHBondContact O-N 3.32Å; V412-N414 VanDerWaalsContact C-N 3.33Å; V412-N414 PolarHBondContact O-N 3.33Å; V412-A415 PolarHBondContact O-N 2.7Å; V412-A415 VanDerWaalsContact O-N 3.14Å; V412-I416 HydrophobicContact CG1-CD1 3.84Å; V412-I416 HydrophobicContact CG1-CG1 4.48Å; V412-I416 WeakPolarHBondContact O-CG1 3.37Å; V412-I416 PolarHBondContact O-N 3.12Å; V412-L422 HydrophobicContact CG1-CD2 3.72Å; V412-M439 HydrophobicContact CB-CG 4.46Å; V412-M439 HydrophobicContact CB-SD 4.37Å; V412-M439 HydrophobicContact CG1-CG 4.13Å; V412-M439 HydrophobicContact CG1-SD 4.16Å; V412-M439 HydrophobicContact CG2-SD 4.07Å
413	R	95.3	Very high	94.1	Very high	118 Å²	118	49 Å²	49	45%	0.445	26%	0.258	S	S	.	.	H	α-helix	trans	-57.4	-45.5	177.6	-175.4	-178	64.6	-178.6	-4.8	112	Q409 E410 A415 G417 N443	Q409-R413 VanDerWaalsContact O-CB 3.23Å; Q409-R413 WeakPolarHBondContact O-CB 3.4Å; Q409-R413 PolarHBondContact O-N 3.31Å; E410-R413 PolarHBondContact O-N 3.19Å; R413-A415 VanDerWaalsContact C-N 3.34Å; R413-A415 PolarHBondContact O-N 2.67Å; R413-G417 PolarHBondContact O-N 3.34Å; R413-N443 WeakPolarHBondContact CA-OD1 3.39Å
414	N	96.7	Very high	94.4	Very high	103 Å²	103	46 Å²	46	55%	0.551	24%	0.238	S	C	*	.	H	α-helix	trans	-66.8	-36.4	178.1	-69.4	-16.8	0	0	0	112.2	E410 N411 V412	E410-N414 WeakPolarHBondContact O-CB 3.2Å; E410-N414 PolarHBondContact O-N 2.99Å; E410-N414 PolarHBondContact O-ND2 2.91Å; N411-N414 PolarHBondContact O-N 2.94Å; V412-N414 VanDerWaalsContact C-N 3.33Å; V412-N414 PolarHBondContact O-N 3.33Å
415	A	96.9	Very high	94.6	Very high	30 Å²	30	39.4 Å²	39.4	25%	0.248	21%	0.214	C	C	.	.	H	α-helix	trans	-73.3	-37	180	0	0	0	0	0	112.8	L367 I370 N374 N411 V412 R413	L367-A415 HydrophobicContact CD2-CB 3.6Å; I370-A415 HydrophobicContact CB-CB 4.47Å; I370-A415 HydrophobicContact CD1-CB 4.39Å; I370-A415 HydrophobicContact CG2-CB 3.67Å; I370-A415 WeakPolarHBondContact CG2-O 3.41Å; N374-A415 PolarHBondContact ND2-O 3.38Å; N411-A415 VanDerWaalsContact O-CB 3.28Å; N411-A415 WeakPolarHBondContact O-CB 3.39Å; N411-A415 PolarHBondContact O-N 2.86Å; V412-A415 PolarHBondContact O-N 2.7Å; V412-A415 VanDerWaalsContact O-N 3.14Å; R413-A415 VanDerWaalsContact C-N 3.34Å; R413-A415 PolarHBondContact O-N 2.67Å
416	I	96.1	Very high	94.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-74.9	-45.3	176	-68	178.4	0	0	0	110.4	I370 V412 G418 K419 F420 L422 N443	I370-I416 HydrophobicContact CD1-CD1 4.02Å; I370-I416 HydrophobicContact CD1-CG1 3.76Å; I370-I416 HydrophobicContact CG1-CD1 4.26Å; I370-I416 HydrophobicContact CG1-CG1 3.86Å; I370-I416 HydrophobicContact CG2-CG1 3.92Å; V412-I416 HydrophobicContact CG1-CD1 3.84Å; V412-I416 HydrophobicContact CG1-CG1 4.48Å; V412-I416 WeakPolarHBondContact O-CG1 3.37Å; V412-I416 PolarHBondContact O-N 3.12Å; I416-G418 VanDerWaalsContact C-N 3.28Å; I416-G418 PolarHBondContact O-N 3.41Å; I416-K419 WeakPolarHBondContact O-CB 3.18Å; I416-K419 VanDerWaalsContact O-CG 3.31Å; I416-K419 WeakPolarHBondContact O-CG 3.41Å; I416-K419 PolarHBondContact O-N 3.5Å; I416-F420 HydrophobicContact CD1-CE2 4.38Å; I416-F420 HydrophobicContact CG1-CD2 4.46Å; I416-F420 HydrophobicContact CG1-CE2 3.89Å; I416-F420 HydrophobicContact CG1-CZ 4.46Å; I416-F420 HydrophobicContact CG2-CD2 4.16Å; I416-F420 HydrophobicContact CG2-CE2 4.25Å; I416-F420 VanDerWaalsContact CG2-O 3.22Å; I416-F420 WeakPolarHBondContact CG2-O 3.37Å; I416-L422 HydrophobicContact CD1-CB 3.95Å; I416-L422 HydrophobicContact CD1-CD2 4.45Å; I416-N443 HydrophobicContact CD1-CB 3.92Å; I416-N443 WeakPolarHBondContact CD1-OD1 3.49Å
417	G	93.1	Very high	95	Very high	52 Å²	52	30.1 Å²	30.1	54%	0.536	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	35.6	178.8	0	0	0	0	0	113.5	R413 K419	R413-G417 PolarHBondContact O-N 3.34Å; G417-K419 PolarHBondContact O-N 2.87Å
418	G	89.3	Confident	94.7	Very high	32 Å²	32	27 Å²	27	33%	0.33	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	8	-179.7	0	0	0	0	0	115.6	I416	I416-G418 VanDerWaalsContact C-N 3.28Å; I416-G418 PolarHBondContact O-N 3.41Å
419	K	89.8	Confident	94.2	Very high	87 Å²	87	32.5 Å²	32.5	38%	0.378	18%	0.181	S	C	.	.	S	Bend	trans	-75.3	-30.8	-173.1	-65.3	174.6	-172.3	174.9	0	114.3	N374 I416 G417 Q493	N374-K419 WeakPolarHBondContact OD1-CD 3.36Å; N374-K419 PolarHBondContact OD1-NZ 2.96Å; N374-K419 VanDerWaalsContact OD1-NZ 3.07Å; I416-K419 WeakPolarHBondContact O-CB 3.18Å; I416-K419 VanDerWaalsContact O-CG 3.31Å; I416-K419 WeakPolarHBondContact O-CG 3.41Å; I416-K419 PolarHBondContact O-N 3.5Å; G417-K419 PolarHBondContact O-N 2.87Å; K419-Q493 PolarHBondContact O-NE2 2.94Å
420	F	91.3	Very high	93.7	Very high	3 Å²	3	37.4 Å²	37.4	1%	0.013	21%	0.208	C	C	.	.	S	Bend	trans	-158.7	156.9	-174.7	43.7	-99.2	0	0	0	112.5	I370 L373 S388 V390 I416	I370-F420 HydrophobicContact CG1-CE2 4.45Å; I370-F420 HydrophobicContact CG2-CE2 4.39Å; I370-F420 HydrophobicContact CG2-CZ 4.02Å; L373-F420 HydrophobicContact CB-CE1 4.14Å; L373-F420 HydrophobicContact CB-CZ 3.9Å; L373-F420 HydrophobicContact CD1-CD2 4.22Å; L373-F420 HydrophobicContact CD1-CE2 3.78Å; L373-F420 HydrophobicContact CD1-CZ 3.98Å; S388-F420 VanDerWaalsContact CB-CD1 3.47Å; S388-F420 WeakPolarHBondContact O-CB 3.49Å; V390-F420 HydrophobicContact CG2-CD2 4.04Å; V390-F420 HydrophobicContact CG2-CE2 3.64Å; I416-F420 HydrophobicContact CD1-CE2 4.38Å; I416-F420 HydrophobicContact CG1-CD2 4.46Å; I416-F420 HydrophobicContact CG1-CE2 3.89Å; I416-F420 HydrophobicContact CG1-CZ 4.46Å; I416-F420 HydrophobicContact CG2-CD2 4.16Å; I416-F420 HydrophobicContact CG2-CE2 4.25Å; I416-F420 VanDerWaalsContact CG2-O 3.22Å; I416-F420 WeakPolarHBondContact CG2-O 3.37Å
421	P	94.7	Very high	93.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.196	C	C	.	.			trans	-71.9	145.8	-178.9	28.7	-37.1	0	0	0	113	I389 V390 Y423 N443 H494	I389-P421 HydrophobicContact CG1-CG 4.28Å; I389-P421 HydrophobicContact CG2-CG 4.44Å; V390-P421 PolarHBondContact N-O 2.79Å; V390-P421 VanDerWaalsContact N-O 3.09Å; P421-Y423 HydrophobicContact CB-CE1 4.35Å; P421-Y423 HydrophobicContact CB-CE2 3.91Å; P421-Y423 HydrophobicContact CG-CE2 3.87Å; P421-N443 VanDerWaalsContact CA-O 3.26Å; P421-N443 WeakPolarHBondContact CA-O 3.5Å; P421-H494 WeakPolarHBondContact CD-CE1 3.27Å
422	L	96.4	Very high	93	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	119	164.9	172.3	62.7	0	0	0	109.9	L366 V390 M392 V412 I416 N424 M439 A440 N443 G445	L366-L422 HydrophobicContact CD2-CD1 3.88Å; V390-L422 HydrophobicContact CB-CD1 3.7Å; V390-L422 HydrophobicContact CG1-CD1 3.46Å; V390-L422 VanDerWaalsContact CG1-CD1 3.46Å; M392-L422 HydrophobicContact CB-CD1 4.4Å; V412-L422 HydrophobicContact CG1-CD2 3.72Å; I416-L422 HydrophobicContact CD1-CB 3.95Å; I416-L422 HydrophobicContact CD1-CD2 4.45Å; L422-N424 WeakPolarHBondContact CD1-OD1 3.44Å; L422-N424 WeakPolarHBondContact CG-OD1 3.39Å; L422-M439 HydrophobicContact CD2-CG 3.83Å; L422-M439 HydrophobicContact CD2-SD 3.75Å; L422-A440 WeakPolarHBondContact O-CB 3.14Å; L422-N443 HydrophobicContact CB-CB 3.91Å; L422-N443 PolarHBondContact N-O 2.87Å; L422-G445 WeakPolarHBondContact O-CA 3.4Å
423	Y	97.3	Very high	92.7	Very high	7 Å²	7	36.9 Å²	36.9	3%	0.027	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	125.7	172	-59.4	-64.5	0	0	0	110.8	I389 V390 I391 M392 P421 F446 F463 V467 Y496	I389-Y423 HydrophobicContact CG2-CD2 3.56Å; I389-Y423 HydrophobicContact CG2-CE2 3.63Å; V390-Y423 PolarHBondContact O-N 3.15Å; I391-Y423 WeakPolarHBondContact CA-O 3.4Å; I391-Y423 HydrophobicContact CG1-CD2 4.33Å; M392-Y423 PolarHBondContact N-O 3.13Å; P421-Y423 HydrophobicContact CB-CE1 4.35Å; P421-Y423 HydrophobicContact CB-CE2 3.91Å; P421-Y423 HydrophobicContact CG-CE2 3.87Å; Y423-F446 WeakPolarHBondContact CA-O 3.33Å; Y423-F446 AromaticContact CD1-CD1 3.75Å; Y423-F446 HydrophobicContact CD1-CD1 3.75Å; Y423-F446 HydrophobicContact CD1-CD2 4.47Å; Y423-F446 AromaticContact CD1-CE1 3.73Å; Y423-F446 HydrophobicContact CD1-CE1 3.73Å; Y423-F446 HydrophobicContact CD1-CE2 4.45Å; Y423-F446 HydrophobicContact CD1-CG 4.13Å; Y423-F446 HydrophobicContact CD1-CZ 4.1Å; Y423-F446 AromaticContact CE1-CD1 3.46Å; Y423-F446 HydrophobicContact CE1-CD1 3.46Å; Y423-F446 VanDerWaalsContact CE1-CD1 3.46Å; Y423-F446 AromaticContact CE1-CE1 3.36Å; Y423-F446 HydrophobicContact CE1-CE1 3.36Å; Y423-F446 HydrophobicContact CE1-CG 4.28Å; Y423-F446 HydrophobicContact CE1-CZ 4.13Å; Y423-F463 VanDerWaalsContact CB-CZ 3.45Å; Y423-F463 HydrophobicContact CD1-CE2 4.34Å; Y423-F463 HydrophobicContact CD1-CZ 4.37Å; Y423-F463 HydrophobicContact CD2-CZ 4.24Å; Y423-F463 HydrophobicContact CG-CE2 4.2Å; Y423-F463 AromaticContact CG-CZ 3.78Å; Y423-F463 HydrophobicContact CG-CZ 3.78Å; Y423-V467 HydrophobicContact CD1-CG1 4.48Å; Y423-V467 HydrophobicContact CD2-CB 4.46Å; Y423-V467 HydrophobicContact CD2-CG1 4.27Å; Y423-V467 HydrophobicContact CD2-CG2 4.45Å; Y423-V467 HydrophobicContact CE1-CG1 4.07Å; Y423-V467 HydrophobicContact CE2-CB 3.97Å; Y423-V467 HydrophobicContact CE2-CG1 3.8Å; Y423-V467 HydrophobicContact CE2-CG2 4.42Å; Y423-Y496 WeakPolarHBondContact OH-CE2 3.32Å; Y423-Y496 PolarHBondContact OH-OH 2.88Å
424	N	97.1	Very high	92.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	123.3	-177.8	-71.6	-26	0	0	0	110.9	M392 L422 L436 A440 F446 A447 R448	M392-N424 HydrophobicContact CE-CB 4.06Å; M392-N424 VanDerWaalsContact CE-OD1 3.24Å; M392-N424 WeakPolarHBondContact CE-OD1 3.3Å; L422-N424 WeakPolarHBondContact CD1-OD1 3.44Å; L422-N424 WeakPolarHBondContact CG-OD1 3.39Å; N424-L436 HydrophobicContact CB-CB 4.04Å; N424-L436 PolarHBondContact ND2-O 2.8Å; N424-A440 HydrophobicContact CB-CB 4.41Å; N424-F446 PolarHBondContact N-O 2.83Å; N424-A447 HydrophobicContact CB-CB 4.12Å; N424-A447 CarbonylContact O-C 3.52Å; N424-A447 WeakPolarHBondContact O-CA 3.44Å; N424-R448 PolarHBondContact O-N 2.93Å
425	L	97.1	Very high	92.2	Very high	6 Å²	6	29.1 Å²	29.1	3%	0.031	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	105.8	178.6	-54.7	179.7	0	0	0	109.2	I391 M392 L393 T394 R448 I450 L460 F463	I391-L425 HydrophobicContact CG2-CD1 3.9Å; I391-L425 HydrophobicContact CG2-CG 4.4Å; M392-L425 WeakPolarHBondContact O-CB 3.38Å; M392-L425 PolarHBondContact O-N 2.77Å; L393-L425 WeakPolarHBondContact CA-O 3.36Å; L393-L425 HydrophobicContact CB-CB 4.21Å; L393-L425 HydrophobicContact CD1-CB 4.43Å; L393-L425 HydrophobicContact CD1-CD1 4.45Å; L393-L425 HydrophobicContact CG-CB 4.28Å; T394-L425 PolarHBondContact N-O 2.91Å; L425-R448 WeakPolarHBondContact CA-O 3.21Å; L425-R448 HydrophobicContact CD2-CB 3.88Å; L425-I450 HydrophobicContact CB-CG1 4.24Å; L425-L460 HydrophobicContact CD1-CD2 3.68Å; L425-F463 HydrophobicContact CD1-CD1 3.64Å; L425-F463 HydrophobicContact CD1-CE1 3.79Å; L425-F463 HydrophobicContact CD1-CG 4.35Å; L425-F463 HydrophobicContact CD2-CB 4.48Å; L425-F463 HydrophobicContact CD2-CD1 3.69Å; L425-F463 HydrophobicContact CD2-CD2 3.71Å; L425-F463 HydrophobicContact CD2-CE1 3.84Å; L425-F463 HydrophobicContact CD2-CE2 3.84Å; L425-F463 HydrophobicContact CD2-CG 3.64Å; L425-F463 HydrophobicContact CD2-CZ 3.93Å; L425-F463 HydrophobicContact CG-CD1 4.22Å; L425-F463 HydrophobicContact CG-CE1 4.17Å
426	G	95.8	Very high	92.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	108	177.1	0	0	0	0	0	110.8	L431 R448 R449 I450	G426-L431 VanDerWaalsContact CA-CD2 3.48Å; G426-R448 PolarHBondContact N-O 2.91Å; G426-R449 CarbonylContact O-C 3.5Å; G426-R449 WeakPolarHBondContact O-CA 3.38Å; G426-I450 PolarHBondContact O-N 2.79Å
427	F	94.5	Very high	91.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	110.8	-178.8	-151.8	147.6	0	0	0	110.8	K299 Q302 L393 T394 D395 I450 E452 A456 L460	K299-F427 HydrophobicContact CB-CE1 4.26Å; K299-F427 HydrophobicContact CB-CZ 4.3Å; K299-F427 HydrophobicContact CD-CD2 4.18Å; K299-F427 HydrophobicContact CD-CE2 4.45Å; K299-F427 HydrophobicContact CD-CG 4.46Å; K299-F427 HydrophobicContact CG-CD2 4.06Å; K299-F427 HydrophobicContact CG-CE1 4.38Å; K299-F427 HydrophobicContact CG-CE2 3.86Å; K299-F427 HydrophobicContact CG-CG 4.43Å; K299-F427 HydrophobicContact CG-CZ 4.02Å; Q302-F427 HydrophobicContact CB-CZ 4.27Å; L393-F427 HydrophobicContact CD1-CD1 4.4Å; L393-F427 HydrophobicContact CD2-CD1 4.28Å; T394-F427 PolarHBondContact O-N 3.5Å; D395-F427 VanDerWaalsContact CA-O 3.28Å; D395-F427 WeakPolarHBondContact CA-O 3.23Å; D395-F427 HydrophobicContact CB-CB 4.09Å; D395-F427 VanDerWaalsContact CB-O 3.32Å; D395-F427 WeakPolarHBondContact CB-O 3.35Å; F427-I450 HydrophobicContact CD1-CG2 4.33Å; F427-I450 HydrophobicContact CD2-CB 4.28Å; F427-I450 HydrophobicContact CD2-CG2 4.03Å; F427-I450 HydrophobicContact CE1-CG2 4.3Å; F427-I450 HydrophobicContact CE2-CG2 3.97Å; F427-I450 HydrophobicContact CG-CB 4.26Å; F427-I450 HydrophobicContact CG-CG2 4.2Å; F427-I450 HydrophobicContact CZ-CG2 4.13Å; F427-E452 HydrophobicContact CD2-CG 3.89Å; F427-E452 HydrophobicContact CE2-CG 3.9Å; F427-A456 HydrophobicContact CE2-CB 3.91Å; F427-A456 HydrophobicContact CZ-CB 3.59Å; F427-L460 HydrophobicContact CE1-CD1 4.31Å
428	G	88.6	Confident	91.9	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.01	15%	0.151	C	C	.	.	S	Bend	trans	89.6	-162	178.1	0	0	0	0	0	113.5	R449 I450 E452	G428-R449 PolarHBondContact O-NH1 3.33Å; G428-I450 PolarHBondContact N-O 3.03Å; G428-E452 WeakPolarHBondContact CA-OE1 3.24Å
429	N	84.4	Confident	92.1	Very high	114 Å²	114	26.7 Å²	26.7	61%	0.61	14%	0.135	S	C	*	.	S	Bend	trans	-111.3	-5.8	-175.3	-66.4	-30	0	0	0	113.6	L431	N429-L431 PolarHBondContact O-N 2.85Å
430	N	84.4	Confident	92.3	Very high	124 Å²	124	22.5 Å²	22.5	66%	0.663	12%	0.117	S	C	*	.	S	Bend	trans	-90.6	40.1	-174	-62.1	-38.8	0	0	0	112.8
431	L	87.7	Confident	92.3	Very high	15 Å²	15	23.9 Å²	23.9	8%	0.079	13%	0.125	C	C	.	.	S	Bend	trans	-146.5	154.2	-177.7	64.5	88.2	0	0	0	111.1	G426 N429 Y433 L436	G426-L431 VanDerWaalsContact CA-CD2 3.48Å; N429-L431 PolarHBondContact O-N 2.85Å; L431-Y433 HydrophobicContact CD1-CD2 4.23Å; L431-Y433 PolarHBondContact O-N 2.98Å; L431-Y433 VanDerWaalsContact O-N 3.12Å; L431-L436 HydrophobicContact CD1-CD1 3.7Å; L431-L436 HydrophobicContact CD1-CG 4.35Å
432	N	89.9	Confident	92.2	Very high	64 Å²	64	26.1 Å²	26.1	34%	0.342	14%	0.135	S	C	.	.			trans	-76.7	94	172.1	-173.5	-18	0	0	0	110.5	D397 N434 F435 L436	D397-N432 VanDerWaalsContact OD1-CB 3.31Å; D397-N432 WeakPolarHBondContact OD1-CB 3.39Å; D397-N432 PolarHBondContact OD1-N 3.06Å; N432-N434 PolarHBondContact OD1-N 3.4Å; N432-F435 HydrophobicContact CB-CB 4.03Å; N432-F435 WeakPolarHBondContact O-CB 3.49Å; N432-F435 PolarHBondContact O-N 3.44Å; N432-F435 PolarHBondContact OD1-N 3.48Å; N432-L436 PolarHBondContact O-N 3.17Å
433	Y	90.7	Very high	92	Very high	18 Å²	18	26.2 Å²	26.2	7%	0.071	14%	0.135	C	C	.	.	H	α-helix	trans	-71.5	-34.8	-175.9	-174.8	-99.2	0	0	0	112.8	L431 F435 L436 E437 A447 R448 R449	L431-Y433 HydrophobicContact CD1-CD2 4.23Å; L431-Y433 PolarHBondContact O-N 2.98Å; L431-Y433 VanDerWaalsContact O-N 3.12Å; Y433-F435 PolarHBondContact O-N 3.32Å; Y433-L436 WeakPolarHBondContact O-CB 3.31Å; Y433-L436 PolarHBondContact O-N 2.86Å; Y433-E437 HydrophobicContact CE1-CB 4.35Å; Y433-E437 WeakPolarHBondContact O-CB 3.32Å; Y433-E437 PolarHBondContact O-N 2.82Å; Y433-A447 HydrophobicContact CE2-CB 4.12Å; Y433-A447 VanDerWaalsContact OH-C 3.3Å; Y433-A447 PolarHBondContact OH-O 2.71Å; Y433-A447 VanDerWaalsContact OH-O 3.05Å; Y433-R448 WeakPolarHBondContact OH-CA 3.47Å; Y433-R448 PolarHBondContact OH-N 2.78Å; Y433-R449 HydrophobicContact CD2-CB 4.25Å; Y433-R449 HydrophobicContact CE2-CB 3.76Å; Y433-R449 PolarHBondContact OH-N 3.08Å
434	N	89.6	Confident	91.7	Very high	49 Å²	49	31 Å²	31	26%	0.262	16%	0.158	S	C	.	.	H	α-helix	trans	-56.4	-41	172.7	-81.7	-24.1	0	0	0	112.4	N432 L436 E437 N438 D622	N432-N434 PolarHBondContact OD1-N 3.4Å; N434-L436 VanDerWaalsContact C-N 3.33Å; N434-L436 PolarHBondContact O-N 3.41Å; N434-E437 PolarHBondContact O-N 3.49Å; N434-N438 VanDerWaalsContact O-CB 3.28Å; N434-N438 WeakPolarHBondContact O-CB 3.33Å; N434-N438 PolarHBondContact O-N 3.16Å; N434-N438 PolarHBondContact O-ND2 2.91Å; N434-D622 PolarHBondContact ND2-OD2 3.07Å; N434-D622 PolarHBondContact OD1-OD2 2.92Å
435	F	92.1	Very high	91.5	Very high	10 Å²	10	31.4 Å²	31.4	4%	0.044	16%	0.162	C	C	.	.	H	α-helix	trans	-60.6	-44.4	175.5	160.4	-115.7	0	0	0	111.5	I362 P405 I408 Q409 N432 Y433 M439	I362-F435 HydrophobicContact CD1-CE1 4.41Å; P405-F435 HydrophobicContact CB-CD2 3.49Å; P405-F435 VanDerWaalsContact CB-CD2 3.49Å; P405-F435 HydrophobicContact CB-CE2 3.84Å; P405-F435 HydrophobicContact CB-CG 4.12Å; P405-F435 HydrophobicContact CG-CD2 4.37Å; P405-F435 WeakPolarHBondContact O-CE2 3.28Å; I408-F435 HydrophobicContact CB-CE2 4.13Å; I408-F435 HydrophobicContact CB-CZ 4.05Å; I408-F435 HydrophobicContact CD1-CE2 4.5Å; I408-F435 HydrophobicContact CD1-CZ 3.88Å; I408-F435 HydrophobicContact CG2-CE2 4.4Å; I408-F435 HydrophobicContact CG2-CZ 3.99Å; Q409-F435 HydrophobicContact CG-CD2 4.13Å; Q409-F435 HydrophobicContact CG-CE2 3.99Å; N432-F435 HydrophobicContact CB-CB 4.03Å; N432-F435 WeakPolarHBondContact O-CB 3.49Å; N432-F435 PolarHBondContact O-N 3.44Å; N432-F435 PolarHBondContact OD1-N 3.48Å; Y433-F435 PolarHBondContact O-N 3.32Å; F435-M439 HydrophobicContact CD2-CE 4.11Å; F435-M439 HydrophobicContact CE1-CE 3.87Å; F435-M439 HydrophobicContact CE2-CE 3.23Å; F435-M439 HydrophobicContact CZ-CE 3.09Å; F435-M439 VanDerWaalsContact O-CB 3.3Å; F435-M439 WeakPolarHBondContact O-CB 3.45Å; F435-M439 PolarHBondContact O-N 2.77Å; F435-M439 VanDerWaalsContact O-N 3.12Å
436	L	94.6	Very high	91.2	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-66.8	-41.9	177	-61.7	-169.4	0	0	0	112.5	M392 T394 N424 L431 N432 Y433 N434 A440 A447	M392-L436 HydrophobicContact CE-CD2 3.61Å; T394-L436 HydrophobicContact CG2-CD1 3.81Å; T394-L436 HydrophobicContact CG2-CD2 4.21Å; N424-L436 HydrophobicContact CB-CB 4.04Å; N424-L436 PolarHBondContact ND2-O 2.8Å; L431-L436 HydrophobicContact CD1-CD1 3.7Å; L431-L436 HydrophobicContact CD1-CG 4.35Å; N432-L436 PolarHBondContact O-N 3.17Å; Y433-L436 WeakPolarHBondContact O-CB 3.31Å; Y433-L436 PolarHBondContact O-N 2.86Å; N434-L436 VanDerWaalsContact C-N 3.33Å; N434-L436 PolarHBondContact O-N 3.41Å; L436-A440 WeakPolarHBondContact O-CB 3.45Å; L436-A440 PolarHBondContact O-N 3.39Å; L436-A447 HydrophobicContact CB-CB 4.35Å
437	E	92.3	Very high	91.1	Very high	27 Å²	27	34.3 Å²	34.3	13%	0.126	18%	0.177	C	C	.	.	H	α-helix	trans	-63.6	-53.4	179.4	-168.4	-173.9	-150.3	0	0	110.9	Y433 N434 M439 A440 L441 A447 K571	Y433-E437 HydrophobicContact CE1-CB 4.35Å; Y433-E437 WeakPolarHBondContact O-CB 3.32Å; Y433-E437 PolarHBondContact O-N 2.82Å; N434-E437 PolarHBondContact O-N 3.49Å; E437-M439 VanDerWaalsContact C-N 3.31Å; E437-M439 PolarHBondContact O-N 2.88Å; E437-A440 PolarHBondContact O-N 3.5Å; E437-A440 VanDerWaalsContact O-N 3.12Å; E437-L441 HydrophobicContact CG-CD1 4.06Å; E437-L441 HydrophobicContact CG-CG 4.4Å; E437-L441 WeakPolarHBondContact O-CB 3.43Å; E437-L441 VanDerWaalsContact O-CG 3.3Å; E437-L441 WeakPolarHBondContact O-CG 3.45Å; E437-L441 PolarHBondContact O-N 2.74Å; E437-A447 VanDerWaalsContact CA-CB 3.5Å; E437-A447 HydrophobicContact CB-CB 4.03Å; E437-A447 HydrophobicContact CG-CB 4.38Å; E437-K571 IonicContact OE1-NZ 3.34Å; E437-K571 PolarHBondContact OE1-NZ 2.82Å; E437-K571 IonicContact OE2-NZ 2.69Å; E437-K571 PolarHBondContact OE2-NZ 3.3Å
438	N	91.6	Very high	91	Very high	33 Å²	33	37.5 Å²	37.5	18%	0.176	19%	0.189	C	C	.	.	H	α-helix	trans	-59.2	-42.9	179.1	-66.9	-14.7	0	0	0	111.4	Q409 N434 A440 L441 E442 N572	Q409-N438 VanDerWaalsContact NE2-CB 3.3Å; N434-N438 VanDerWaalsContact O-CB 3.28Å; N434-N438 WeakPolarHBondContact O-CB 3.33Å; N434-N438 PolarHBondContact O-N 3.16Å; N434-N438 PolarHBondContact O-ND2 2.91Å; N438-A440 VanDerWaalsContact C-N 3.34Å; N438-A440 PolarHBondContact O-N 2.83Å; N438-L441 PolarHBondContact O-N 3.05Å; N438-E442 WeakPolarHBondContact O-CB 3.29Å; N438-E442 WeakPolarHBondContact O-CG 3.4Å; N438-E442 PolarHBondContact O-N 2.91Å; N438-N572 WeakPolarHBondContact CB-OD1 3.39Å; N438-N572 PolarHBondContact OD1-OD1 3.21Å
439	M	94.2	Very high	91.2	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.2	-40.4	176.9	-170.2	-167.2	-59.6	0	0	112.6	L366 I408 Q409 V412 L422 F435 E437 N443	L366-M439 HydrophobicContact CD1-CE 4.28Å; L366-M439 HydrophobicContact CD1-SD 3.56Å; L366-M439 VanDerWaalsContact CD1-SD 3.56Å; I408-M439 HydrophobicContact CB-CE 4.44Å; I408-M439 HydrophobicContact CG2-CE 3.66Å; Q409-M439 HydrophobicContact CG-CB 4.03Å; Q409-M439 HydrophobicContact CG-CE 4.39Å; Q409-M439 HydrophobicContact CG-CG 4.3Å; V412-M439 HydrophobicContact CB-CG 4.46Å; V412-M439 HydrophobicContact CB-SD 4.37Å; V412-M439 HydrophobicContact CG1-CG 4.13Å; V412-M439 HydrophobicContact CG1-SD 4.16Å; V412-M439 HydrophobicContact CG2-SD 4.07Å; L422-M439 HydrophobicContact CD2-CG 3.83Å; L422-M439 HydrophobicContact CD2-SD 3.75Å; F435-M439 HydrophobicContact CD2-CE 4.11Å; F435-M439 HydrophobicContact CE1-CE 3.87Å; F435-M439 HydrophobicContact CE2-CE 3.23Å; F435-M439 HydrophobicContact CZ-CE 3.09Å; F435-M439 VanDerWaalsContact O-CB 3.3Å; F435-M439 WeakPolarHBondContact O-CB 3.45Å; F435-M439 PolarHBondContact O-N 2.77Å; F435-M439 VanDerWaalsContact O-N 3.12Å; E437-M439 VanDerWaalsContact C-N 3.31Å; E437-M439 PolarHBondContact O-N 2.88Å; M439-N443 PolarHBondContact O-ND2 2.82Å
440	A	94.8	Very high	91.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-69.1	-44.6	177.9	0	0	0	0	0	111.4	L422 N424 L436 E437 N438 E442 N443 H444 G445 A447	L422-A440 WeakPolarHBondContact O-CB 3.14Å; N424-A440 HydrophobicContact CB-CB 4.41Å; L436-A440 WeakPolarHBondContact O-CB 3.45Å; L436-A440 PolarHBondContact O-N 3.39Å; E437-A440 PolarHBondContact O-N 3.5Å; E437-A440 VanDerWaalsContact O-N 3.12Å; N438-A440 VanDerWaalsContact C-N 3.34Å; N438-A440 PolarHBondContact O-N 2.83Å; A440-E442 PolarHBondContact O-N 2.91Å; A440-N443 CarbonylContact O-C 3.58Å; A440-N443 VanDerWaalsContact O-C 3.3Å; A440-N443 WeakPolarHBondContact O-CA 3.4Å; A440-N443 PolarHBondContact O-N 2.83Å; A440-H444 PolarHBondContact O-N 2.91Å; A440-G445 CarbonylContact C-O 3.53Å; A440-G445 CarbonylContact O-C 3.58Å; A440-G445 PolarHBondContact O-N 2.94Å; A440-A447 HydrophobicContact CB-CB 4.44Å
441	L	91.5	Very high	91.8	Very high	31 Å²	31	31.1 Å²	31.1	16%	0.162	15%	0.147	C	C	.	.	H	α-helix	trans	-61.1	-41.2	178.9	-70.9	178.6	0	0	0	112.6	E437 N438 N443 H444 E568 K571 N572	E437-L441 HydrophobicContact CG-CD1 4.06Å; E437-L441 HydrophobicContact CG-CG 4.4Å; E437-L441 WeakPolarHBondContact O-CB 3.43Å; E437-L441 VanDerWaalsContact O-CG 3.3Å; E437-L441 WeakPolarHBondContact O-CG 3.45Å; E437-L441 PolarHBondContact O-N 2.74Å; N438-L441 PolarHBondContact O-N 3.05Å; L441-N443 PolarHBondContact O-N 2.82Å; L441-N443 VanDerWaalsContact O-N 3.13Å; L441-H444 PolarHBondContact O-N 3.03Å; L441-E568 HydrophobicContact CD1-CG 4.08Å; L441-E568 HydrophobicContact CD2-CG 4.1Å; L441-E568 WeakPolarHBondContact CD2-OE1 3.02Å; L441-K571 HydrophobicContact CD1-CD 4.26Å; L441-N572 WeakPolarHBondContact CB-ND2 3.16Å
442	E	91.1	Very high	91.8	Very high	48 Å²	48	35.1 Å²	35.1	22%	0.224	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.2	174.5	-76.5	177.2	-146.2	0	0	113.5	Q409 N438 A440	Q409-E442 PolarHBondContact NE2-OE1 2.86Å; N438-E442 WeakPolarHBondContact O-CB 3.29Å; N438-E442 WeakPolarHBondContact O-CG 3.4Å; N438-E442 PolarHBondContact O-N 2.91Å; A440-E442 PolarHBondContact O-N 2.91Å
443	N	93.4	Very high	91.6	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.7	33.2	-175	-67.7	-79.8	0	0	0	111.8	R413 I416 P421 L422 M439 A440 L441 G445	R413-N443 WeakPolarHBondContact CA-OD1 3.39Å; I416-N443 HydrophobicContact CD1-CB 3.92Å; I416-N443 WeakPolarHBondContact CD1-OD1 3.49Å; P421-N443 VanDerWaalsContact CA-O 3.26Å; P421-N443 WeakPolarHBondContact CA-O 3.5Å; L422-N443 HydrophobicContact CB-CB 3.91Å; L422-N443 PolarHBondContact N-O 2.87Å; M439-N443 PolarHBondContact O-ND2 2.82Å; A440-N443 CarbonylContact O-C 3.58Å; A440-N443 VanDerWaalsContact O-C 3.3Å; A440-N443 WeakPolarHBondContact O-CA 3.4Å; A440-N443 PolarHBondContact O-N 2.83Å; L441-N443 PolarHBondContact O-N 2.82Å; L441-N443 VanDerWaalsContact O-N 3.13Å; N443-G445 PolarHBondContact O-N 3.02Å; N443-G445 VanDerWaalsContact O-N 3.07Å
444	H	90.9	Very high	91.3	Very high	108 Å²	108	38.5 Å²	38.5	50%	0.5	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	22.3	174.8	-51.3	-67.7	0	0	0	115.4	A440 L441 Q493	A440-H444 PolarHBondContact O-N 2.91Å; L441-H444 PolarHBondContact O-N 3.03Å; H444-Q493 HydrophobicContact CB-CB 4.23Å
445	G	91.9	Very high	91.1	Very high	9 Å²	9	38.4 Å²	38.4	9%	0.093	19%	0.191	C	C	.	.			trans	-121.2	-166.1	172.5	0	0	0	0	0	111.6	L422 A440 N443	L422-G445 WeakPolarHBondContact O-CA 3.4Å; A440-G445 CarbonylContact C-O 3.53Å; A440-G445 CarbonylContact O-C 3.58Å; A440-G445 PolarHBondContact O-N 2.94Å; N443-G445 PolarHBondContact O-N 3.02Å; N443-G445 VanDerWaalsContact O-N 3.07Å
446	F	91.8	Very high	90.8	Very high	54 Å²	54	38 Å²	38	24%	0.237	19%	0.189	C	C	.	.			trans	-138.3	157.8	177.5	61.2	-95.4	0	0	0	111	Y423 N424 F463 V467	Y423-F446 WeakPolarHBondContact CA-O 3.33Å; Y423-F446 AromaticContact CD1-CD1 3.75Å; Y423-F446 HydrophobicContact CD1-CD1 3.75Å; Y423-F446 HydrophobicContact CD1-CD2 4.47Å; Y423-F446 AromaticContact CD1-CE1 3.73Å; Y423-F446 HydrophobicContact CD1-CE1 3.73Å; Y423-F446 HydrophobicContact CD1-CE2 4.45Å; Y423-F446 HydrophobicContact CD1-CG 4.13Å; Y423-F446 HydrophobicContact CD1-CZ 4.1Å; Y423-F446 AromaticContact CE1-CD1 3.46Å; Y423-F446 HydrophobicContact CE1-CD1 3.46Å; Y423-F446 VanDerWaalsContact CE1-CD1 3.46Å; Y423-F446 AromaticContact CE1-CE1 3.36Å; Y423-F446 HydrophobicContact CE1-CE1 3.36Å; Y423-F446 HydrophobicContact CE1-CG 4.28Å; Y423-F446 HydrophobicContact CE1-CZ 4.13Å; N424-F446 PolarHBondContact N-O 2.83Å; F446-F463 AromaticContact CE2-CD2 3.79Å; F446-F463 HydrophobicContact CE2-CD2 3.79Å; F446-F463 AromaticContact CE2-CE2 3.51Å; F446-F463 HydrophobicContact CE2-CE2 3.51Å; F446-F463 HydrophobicContact CZ-CD2 4.05Å; F446-F463 AromaticContact CZ-CE2 3.63Å; F446-F463 HydrophobicContact CZ-CE2 3.63Å; F446-V467 HydrophobicContact CE1-CG1 4.13Å; F446-V467 HydrophobicContact CZ-CG1 4.02Å
447	A	92.9	Very high	90.2	Very high	13 Å²	13	39.3 Å²	39.3	11%	0.107	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	150.5	169.5	0	0	0	0	0	111.1	N424 Y433 L436 E437 A440	N424-A447 HydrophobicContact CB-CB 4.12Å; N424-A447 CarbonylContact O-C 3.52Å; N424-A447 WeakPolarHBondContact O-CA 3.44Å; Y433-A447 HydrophobicContact CE2-CB 4.12Å; Y433-A447 VanDerWaalsContact OH-C 3.3Å; Y433-A447 PolarHBondContact OH-O 2.71Å; Y433-A447 VanDerWaalsContact OH-O 3.05Å; L436-A447 HydrophobicContact CB-CB 4.35Å; E437-A447 VanDerWaalsContact CA-CB 3.5Å; E437-A447 HydrophobicContact CB-CB 4.03Å; E437-A447 HydrophobicContact CG-CB 4.38Å; A440-A447 HydrophobicContact CB-CB 4.44Å
448	R	92.9	Very high	90	Very high	66 Å²	66	43 Å²	43	25%	0.249	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	131	172.9	-175.6	166.4	-65.7	179.7	3.8	110.4	N424 L425 G426 Y433 I450 F463 E466	N424-R448 PolarHBondContact O-N 2.93Å; L425-R448 WeakPolarHBondContact CA-O 3.21Å; L425-R448 HydrophobicContact CD2-CB 3.88Å; G426-R448 PolarHBondContact N-O 2.91Å; Y433-R448 WeakPolarHBondContact OH-CA 3.47Å; Y433-R448 PolarHBondContact OH-N 2.78Å; R448-I450 HydrophobicContact CG-CD1 4.35Å; R448-F463 HydrophobicContact CB-CD2 4.43Å; R448-E466 IonicContact CZ-OE2 3.92Å; R448-E466 IonicContact NH1-OE2 3.44Å; R448-E466 PolarHBondContact NH1-OE2 3.05Å; R448-E466 IonicContact NH2-OE1 3.56Å; R448-E466 PolarHBondContact NH2-OE1 3.35Å; R448-E466 VanDerWaalsContact NH2-OE1 3.16Å; R448-E466 IonicContact NH2-OE2 3.17Å; R448-E466 PolarHBondContact NH2-OE2 3.33Å
449	R	92.6	Very high	89.9	Confident	46 Å²	46	43 Å²	43	17%	0.174	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	131.2	171.6	-166	174	-66.5	-98	16.4	110.1	G426 G428 Y433 Y451	G426-R449 CarbonylContact O-C 3.5Å; G426-R449 WeakPolarHBondContact O-CA 3.38Å; G428-R449 PolarHBondContact O-NH1 3.33Å; Y433-R449 HydrophobicContact CD2-CB 4.25Å; Y433-R449 HydrophobicContact CE2-CB 3.76Å; Y433-R449 PolarHBondContact OH-N 3.08Å; R449-Y451 HydrophobicContact CB-CE2 4.39Å
450	I	92.9	Very high	89.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	115.8	172.7	-53.2	-61.1	0	0	0	106.9	L425 G426 F427 G428 R448 A456 Q459 L460	L425-I450 HydrophobicContact CB-CG1 4.24Å; G426-I450 PolarHBondContact O-N 2.79Å; F427-I450 HydrophobicContact CD1-CG2 4.33Å; F427-I450 HydrophobicContact CD2-CB 4.28Å; F427-I450 HydrophobicContact CD2-CG2 4.03Å; F427-I450 HydrophobicContact CE1-CG2 4.3Å; F427-I450 HydrophobicContact CE2-CG2 3.97Å; F427-I450 HydrophobicContact CG-CB 4.26Å; F427-I450 HydrophobicContact CG-CG2 4.2Å; F427-I450 HydrophobicContact CZ-CG2 4.13Å; G428-I450 PolarHBondContact N-O 3.03Å; R448-I450 HydrophobicContact CG-CD1 4.35Å; I450-A456 HydrophobicContact CG2-CB 3.99Å; I450-Q459 HydrophobicContact CD1-CB 4.09Å; I450-Q459 HydrophobicContact CG2-CB 4.33Å; I450-L460 HydrophobicContact CD1-CD2 3.76Å; I450-L460 HydrophobicContact CD1-CG 4.21Å; I450-L460 HydrophobicContact CG1-CD2 3.67Å; I450-L460 HydrophobicContact CG1-CG 4.31Å; I450-L460 HydrophobicContact CG2-CD2 4.31Å; I450-L460 HydrophobicContact CG2-CG 4.1Å
451	Y	88.6	Confident	89.2	Confident	59 Å²	59	44.1 Å²	44.1	23%	0.231	22%	0.22	C	C	.	.			trans	-82.4	133.6	-175.8	-65	-92.1	0	0	0	110.6	R133 R449 D453 Q459	R133-Y451 HydrophobicContact CB-CD2 4.29Å; R133-Y451 HydrophobicContact CB-CE1 4.49Å; R133-Y451 HydrophobicContact CB-CE2 3.7Å; R133-Y451 HydrophobicContact CG-CD1 4Å; R133-Y451 HydrophobicContact CG-CD2 3.66Å; R133-Y451 HydrophobicContact CG-CE1 3.9Å; R133-Y451 HydrophobicContact CG-CE2 3.54Å; R133-Y451 HydrophobicContact CG-CG 3.88Å; R449-Y451 HydrophobicContact CB-CE2 4.39Å; Y451-D453 VanDerWaalsContact C-N 3.29Å; Y451-D453 PolarHBondContact O-N 3.39Å; Y451-Q459 PolarHBondContact O-NE2 3.49Å; Y451-Q459 VanDerWaalsContact O-NE2 3.14Å
452	E	86.7	Confident	89	Confident	99 Å²	99	43.3 Å²	43.3	46%	0.463	22%	0.219	S	C	.	.	S	Bend	trans	-68	79.2	177.8	-70.6	-179.2	-145.5	0	0	112	K299 F427 G428	K299-E452 HydrophobicContact CD-CG 4.07Å; K299-E452 HydrophobicContact CG-CG 4.26Å; K299-E452 IonicContact NZ-OE1 2.75Å; F427-E452 HydrophobicContact CD2-CG 3.89Å; F427-E452 HydrophobicContact CE2-CG 3.9Å; G428-E452 WeakPolarHBondContact CA-OE1 3.24Å
453	D	85.9	Confident	89	Confident	76 Å²	76	41.1 Å²	41.1	41%	0.406	21%	0.209	S	C	.	.	S	Bend	trans	-144.4	-179.7	-175.3	-153.4	-19.2	0	0	0	110.7	R133 Q302 Y451 D455 A456	R133-D453 IonicContact NH2-OD2 3.6Å; R133-D453 PolarHBondContact NH2-OD2 3.21Å; Q302-D453 PolarHBondContact NE2-O 2.73Å; Y451-D453 VanDerWaalsContact C-N 3.29Å; Y451-D453 PolarHBondContact O-N 3.39Å; D453-D455 PolarHBondContact O-N 3.44Å; D453-A456 PolarHBondContact O-N 3.4Å
454	S	84.2	Confident	88.8	Confident	77 Å²	77	41.3 Å²	41.3	54%	0.538	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-16.1	-177.5	57.3	0	0	0	0	115.7
455	D	85.4	Confident	88.6	Confident	48 Å²	48	40 Å²	40	26%	0.257	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	14.8	-177.4	71	-32.3	0	0	0	113.3	R133 D453 D457 L458 Q459	R133-D455 IonicContact CZ-OD1 3.65Å; R133-D455 IonicContact CZ-OD2 3.72Å; R133-D455 IonicContact NH1-OD1 3.82Å; R133-D455 PolarHBondContact NH1-OD1 3.19Å; R133-D455 VanDerWaalsContact NH1-OD1 3.13Å; R133-D455 IonicContact NH1-OD2 2.97Å; R133-D455 PolarHBondContact NH1-OD2 3.43Å; R133-D455 IonicContact NH2-OD1 2.77Å; R133-D455 PolarHBondContact NH2-OD1 3.31Å; R133-D455 IonicContact NH2-OD2 2.64Å; D453-D455 PolarHBondContact O-N 3.44Å; D455-D457 VanDerWaalsContact C-N 3.27Å; D455-D457 PolarHBondContact O-N 2.95Å; D455-L458 HydrophobicContact CB-CB 4.48Å; D455-L458 HydrophobicContact CB-CD1 4.35Å; D455-L458 WeakPolarHBondContact O-CB 3.46Å; D455-L458 PolarHBondContact O-N 2.92Å; D455-L458 VanDerWaalsContact O-N 3.08Å; D455-Q459 WeakPolarHBondContact O-CG 3.3Å; D455-Q459 PolarHBondContact O-N 2.89Å; D455-Q459 PolarHBondContact OD1-NE2 2.96Å
456	A	86.1	Confident	88.4	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-33.8	-176.6	0	0	0	0	0	113.3	Q302 F427 I450 D453 Q459 L460	Q302-A456 HydrophobicContact CB-CB 4.41Å; F427-A456 HydrophobicContact CE2-CB 3.91Å; F427-A456 HydrophobicContact CZ-CB 3.59Å; I450-A456 HydrophobicContact CG2-CB 3.99Å; D453-A456 PolarHBondContact O-N 3.4Å; A456-Q459 WeakPolarHBondContact O-CB 3.16Å; A456-Q459 PolarHBondContact O-N 2.95Å; A456-L460 VanDerWaalsContact O-CG 3.31Å; A456-L460 WeakPolarHBondContact O-CG 3.4Å; A456-L460 PolarHBondContact O-N 3.42Å
457	D	82.9	Confident	88.3	Confident	31 Å²	31	39.3 Å²	39.3	17%	0.166	20%	0.199	C	C	.	.	H	α-helix	trans	-61.3	-43	171.8	64.5	-48.8	0	0	0	111.6	E305 D455 L460 Q461	E305-D457 HydrophobicContact CB-CB 4.43Å; D455-D457 VanDerWaalsContact C-N 3.27Å; D455-D457 PolarHBondContact O-N 2.95Å; D457-L460 PolarHBondContact O-N 2.93Å; D457-Q461 VanDerWaalsContact O-CG 3.24Å; D457-Q461 WeakPolarHBondContact O-CG 3.22Å; D457-Q461 PolarHBondContact O-N 3.19Å; D457-Q461 PolarHBondContact O-NE2 3.29Å
458	L	87	Confident	88.1	Confident	103 Å²	103	38.9 Å²	38.9	54%	0.539	20%	0.196	S	C	.	.	H	α-helix	trans	-68.5	-35.8	175.5	-62.7	177.4	0	0	0	112.1	D455 L460 Q461 G462	D455-L458 HydrophobicContact CB-CB 4.48Å; D455-L458 HydrophobicContact CB-CD1 4.35Å; D455-L458 WeakPolarHBondContact O-CB 3.46Å; D455-L458 PolarHBondContact O-N 2.92Å; D455-L458 VanDerWaalsContact O-N 3.08Å; L458-L460 VanDerWaalsContact C-N 3.35Å; L458-Q461 PolarHBondContact O-N 3.15Å; L458-G462 PolarHBondContact O-N 3.3Å
459	Q	90.1	Very high	88	Confident	34 Å²	34	37.9 Å²	37.9	16%	0.159	20%	0.195	C	C	.	.	H	α-helix	trans	-62.2	-43.3	174.1	-69	173.2	69.1	0	0	111.3	R133 I450 Y451 D455 A456 F463	R133-Q459 VanDerWaalsContact NH1-CD 3.27Å; I450-Q459 HydrophobicContact CD1-CB 4.09Å; I450-Q459 HydrophobicContact CG2-CB 4.33Å; Y451-Q459 PolarHBondContact O-NE2 3.49Å; Y451-Q459 VanDerWaalsContact O-NE2 3.14Å; D455-Q459 WeakPolarHBondContact O-CG 3.3Å; D455-Q459 PolarHBondContact O-N 2.89Å; D455-Q459 PolarHBondContact OD1-NE2 2.96Å; A456-Q459 WeakPolarHBondContact O-CB 3.16Å; A456-Q459 PolarHBondContact O-N 2.95Å; Q459-F463 PolarHBondContact O-N 3.04Å
460	L	88.4	Confident	88	Confident	6 Å²	6	35.7 Å²	35.7	3%	0.031	19%	0.187	C	C	.	.	H	α-helix	trans	-66.6	-43.2	176.7	-71.5	169.4	0	0	0	112	A306 L393 L425 F427 I450 A456 D457 L458 F463 Y464	A306-L460 HydrophobicContact CB-CB 3.47Å; A306-L460 VanDerWaalsContact CB-CB 3.47Å; A306-L460 HydrophobicContact CB-CD1 3.59Å; A306-L460 HydrophobicContact CB-CG 4.17Å; L393-L460 HydrophobicContact CD1-CD1 4.14Å; L393-L460 HydrophobicContact CD1-CD2 3.56Å; L425-L460 HydrophobicContact CD1-CD2 3.68Å; F427-L460 HydrophobicContact CE1-CD1 4.31Å; I450-L460 HydrophobicContact CD1-CD2 3.76Å; I450-L460 HydrophobicContact CD1-CG 4.21Å; I450-L460 HydrophobicContact CG1-CD2 3.67Å; I450-L460 HydrophobicContact CG1-CG 4.31Å; I450-L460 HydrophobicContact CG2-CD2 4.31Å; I450-L460 HydrophobicContact CG2-CG 4.1Å; A456-L460 VanDerWaalsContact O-CG 3.31Å; A456-L460 WeakPolarHBondContact O-CG 3.4Å; A456-L460 PolarHBondContact O-N 3.42Å; D457-L460 PolarHBondContact O-N 2.93Å; L458-L460 VanDerWaalsContact C-N 3.35Å; L460-F463 WeakPolarHBondContact O-CB 3.33Å; L460-F463 PolarHBondContact O-N 3.02Å; L460-Y464 PolarHBondContact O-N 2.69Å
461	Q	87	Confident	88.1	Confident	18 Å²	18	35.9 Å²	35.9	8%	0.084	19%	0.188	C	C	.	.	H	α-helix	trans	-61.3	-48.9	174.8	-72.8	164.7	41.3	0	0	111.2	R309 D457 L458 F463 Y464 E465	R309-Q461 HydrophobicContact CB-CG 3.95Å; R309-Q461 VanDerWaalsContact CD-CD 3.44Å; R309-Q461 HydrophobicContact CG-CG 3.92Å; R309-Q461 VanDerWaalsContact NE-OE1 3.08Å; D457-Q461 VanDerWaalsContact O-CG 3.24Å; D457-Q461 WeakPolarHBondContact O-CG 3.22Å; D457-Q461 PolarHBondContact O-N 3.19Å; D457-Q461 PolarHBondContact O-NE2 3.29Å; L458-Q461 PolarHBondContact O-N 3.15Å; Q461-F463 PolarHBondContact O-N 2.92Å; Q461-Y464 PolarHBondContact O-N 3.46Å; Q461-E465 WeakPolarHBondContact O-CG 3.48Å; Q461-E465 PolarHBondContact O-N 3.24Å
462	G	87.1	Confident	88.4	Confident	14 Å²	14	33 Å²	33	14%	0.144	18%	0.177	C	C	.	.	H	α-helix	trans	-61.7	-32.2	178.6	0	0	0	0	0	113.3	L458	L458-G462 PolarHBondContact O-N 3.3Å
463	F	90.5	Very high	88.8	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.009	16%	0.163	C	C	.	.	H	α-helix	trans	-64.8	-50	168.6	164.4	-95.6	0	0	0	112.3	I391 Y423 L425 F446 R448 Q459 L460 Q461 E465 E466 V467	I391-F463 HydrophobicContact CD1-CE1 4.19Å; I391-F463 HydrophobicContact CG1-CE1 4.38Å; I391-F463 HydrophobicContact CG2-CE1 3.86Å; I391-F463 HydrophobicContact CG2-CZ 4.49Å; Y423-F463 VanDerWaalsContact CB-CZ 3.45Å; Y423-F463 HydrophobicContact CD1-CE2 4.34Å; Y423-F463 HydrophobicContact CD1-CZ 4.37Å; Y423-F463 HydrophobicContact CD2-CZ 4.24Å; Y423-F463 HydrophobicContact CG-CE2 4.2Å; Y423-F463 AromaticContact CG-CZ 3.78Å; Y423-F463 HydrophobicContact CG-CZ 3.78Å; L425-F463 HydrophobicContact CD1-CD1 3.64Å; L425-F463 HydrophobicContact CD1-CE1 3.79Å; L425-F463 HydrophobicContact CD1-CG 4.35Å; L425-F463 HydrophobicContact CD2-CB 4.48Å; L425-F463 HydrophobicContact CD2-CD1 3.69Å; L425-F463 HydrophobicContact CD2-CD2 3.71Å; L425-F463 HydrophobicContact CD2-CE1 3.84Å; L425-F463 HydrophobicContact CD2-CE2 3.84Å; L425-F463 HydrophobicContact CD2-CG 3.64Å; L425-F463 HydrophobicContact CD2-CZ 3.93Å; L425-F463 HydrophobicContact CG-CD1 4.22Å; L425-F463 HydrophobicContact CG-CE1 4.17Å; F446-F463 AromaticContact CE2-CD2 3.79Å; F446-F463 HydrophobicContact CE2-CD2 3.79Å; F446-F463 AromaticContact CE2-CE2 3.51Å; F446-F463 HydrophobicContact CE2-CE2 3.51Å; F446-F463 HydrophobicContact CZ-CD2 4.05Å; F446-F463 AromaticContact CZ-CE2 3.63Å; F446-F463 HydrophobicContact CZ-CE2 3.63Å; R448-F463 HydrophobicContact CB-CD2 4.43Å; Q459-F463 PolarHBondContact O-N 3.04Å; L460-F463 WeakPolarHBondContact O-CB 3.33Å; L460-F463 PolarHBondContact O-N 3.02Å; Q461-F463 PolarHBondContact O-N 2.92Å; F463-E465 VanDerWaalsContact C-N 3.33Å; F463-E465 PolarHBondContact O-N 3.35Å; F463-E466 WeakPolarHBondContact O-CB 3.3Å; F463-E466 PolarHBondContact O-N 3.25Å; F463-E466 VanDerWaalsContact O-N 3.16Å; F463-V467 HydrophobicContact CE1-CG2 4.05Å; F463-V467 HydrophobicContact CE2-CG1 4.3Å; F463-V467 HydrophobicContact CE2-CG2 4.47Å; F463-V467 HydrophobicContact CZ-CG1 4.38Å; F463-V467 HydrophobicContact CZ-CG2 3.88Å
464	Y	89	Confident	89.1	Confident	4 Å²	4	27.5 Å²	27.5	2%	0.016	16%	0.159	C	C	.	.	H	α-helix	trans	-62.5	-42.7	-177.5	-178.2	-106	0	0	0	111.5	K283 F287 I310 I391 L460 Q461 E466 V467 A468	K283-Y464 WeakPolarHBondContact CE-OH 3.49Å; F287-Y464 HydrophobicContact CE1-CE2 4.46Å; F287-Y464 HydrophobicContact CZ-CE2 4.25Å; I310-Y464 HydrophobicContact CB-CD1 4.18Å; I310-Y464 HydrophobicContact CB-CE1 4.29Å; I310-Y464 HydrophobicContact CB-CG 4.41Å; I310-Y464 HydrophobicContact CD1-CD1 4.46Å; I310-Y464 HydrophobicContact CD1-CD2 4.2Å; I310-Y464 HydrophobicContact CD1-CG 3.9Å; I310-Y464 HydrophobicContact CG1-CD1 3.7Å; I310-Y464 HydrophobicContact CG1-CD2 4.26Å; I310-Y464 HydrophobicContact CG1-CE1 4.31Å; I310-Y464 HydrophobicContact CG1-CG 3.65Å; I310-Y464 HydrophobicContact CG2-CD1 3.93Å; I310-Y464 HydrophobicContact CG2-CD2 4Å; I310-Y464 HydrophobicContact CG2-CE1 3.69Å; I310-Y464 HydrophobicContact CG2-CE2 3.78Å; I310-Y464 HydrophobicContact CG2-CG 4.07Å; I391-Y464 HydrophobicContact CD1-CD2 3.95Å; I391-Y464 HydrophobicContact CD1-CE2 4.2Å; L460-Y464 PolarHBondContact O-N 2.69Å; Q461-Y464 PolarHBondContact O-N 3.46Å; Y464-E466 PolarHBondContact O-N 3.4Å; Y464-E466 VanDerWaalsContact O-N 3.11Å; Y464-V467 CarbonylContact O-C 3.35Å; Y464-V467 PolarHBondContact O-N 3.08Å; Y464-A468 HydrophobicContact CD1-CB 3.83Å; Y464-A468 HydrophobicContact CE1-CB 3.59Å; Y464-A468 HydrophobicContact CE2-CB 4.41Å; Y464-A468 HydrophobicContact CG-CB 4.36Å; Y464-A468 WeakPolarHBondContact O-CA 3.39Å; Y464-A468 WeakPolarHBondContact O-CB 3.46Å; Y464-A468 PolarHBondContact O-N 2.88Å
465	E	87	Confident	89.7	Confident	80 Å²	80	23.9 Å²	23.9	37%	0.374	13%	0.134	S	C	.	.	H	α-helix	trans	-54.2	-31.6	176.6	-73.7	173.7	-153.6	0	0	113.4	K164 Q461 F463	K164-E465 WeakPolarHBondContact CE-OE2 3.47Å; K164-E465 IonicContact NZ-OE2 2.98Å; K164-E465 PolarHBondContact NZ-OE2 3.11Å; Q461-E465 WeakPolarHBondContact O-CG 3.48Å; Q461-E465 PolarHBondContact O-N 3.24Å; F463-E465 VanDerWaalsContact C-N 3.33Å; F463-E465 PolarHBondContact O-N 3.35Å
466	E	88.1	Confident	90.2	Very high	48 Å²	48	25.8 Å²	25.8	22%	0.224	14%	0.141	C	C	.	.	H	α-helix	trans	-71.8	-30.5	178.2	-171.9	175.9	157.5	0	0	113	H163 R448 F463 Y464 Y496	H163-E466 IonicContact CE1-OE1 3Å; H163-E466 IonicContact ND1-OE1 3.16Å; R448-E466 IonicContact CZ-OE2 3.92Å; R448-E466 IonicContact NH1-OE2 3.44Å; R448-E466 PolarHBondContact NH1-OE2 3.05Å; R448-E466 IonicContact NH2-OE1 3.56Å; R448-E466 PolarHBondContact NH2-OE1 3.35Å; R448-E466 VanDerWaalsContact NH2-OE1 3.16Å; R448-E466 IonicContact NH2-OE2 3.17Å; R448-E466 PolarHBondContact NH2-OE2 3.33Å; F463-E466 WeakPolarHBondContact O-CB 3.3Å; F463-E466 PolarHBondContact O-N 3.25Å; F463-E466 VanDerWaalsContact O-N 3.16Å; Y464-E466 PolarHBondContact O-N 3.4Å; Y464-E466 VanDerWaalsContact O-N 3.11Å; E466-Y496 WeakPolarHBondContact O-CB 3.29Å; E466-Y496 VanDerWaalsContact O-CG 3.32Å
467	V	89.3	Confident	90.7	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.012	14%	0.141	C	C	.	.	H	α-helix	trans	-112.3	-2	-176.4	-58	0	0	0	0	113.5	I391 Y423 F446 F463 Y464 Y496	I391-V467 HydrophobicContact CD1-CG2 4.41Å; Y423-V467 HydrophobicContact CD1-CG1 4.48Å; Y423-V467 HydrophobicContact CD2-CB 4.46Å; Y423-V467 HydrophobicContact CD2-CG1 4.27Å; Y423-V467 HydrophobicContact CD2-CG2 4.45Å; Y423-V467 HydrophobicContact CE1-CG1 4.07Å; Y423-V467 HydrophobicContact CE2-CB 3.97Å; Y423-V467 HydrophobicContact CE2-CG1 3.8Å; Y423-V467 HydrophobicContact CE2-CG2 4.42Å; F446-V467 HydrophobicContact CE1-CG1 4.13Å; F446-V467 HydrophobicContact CZ-CG1 4.02Å; F463-V467 HydrophobicContact CE1-CG2 4.05Å; F463-V467 HydrophobicContact CE2-CG1 4.3Å; F463-V467 HydrophobicContact CE2-CG2 4.47Å; F463-V467 HydrophobicContact CZ-CG1 4.38Å; F463-V467 HydrophobicContact CZ-CG2 3.88Å; Y464-V467 CarbonylContact O-C 3.35Å; Y464-V467 PolarHBondContact O-N 3.08Å; V467-Y496 HydrophobicContact CB-CE1 4.12Å; V467-Y496 HydrophobicContact CG1-CE2 4.47Å; V467-Y496 WeakPolarHBondContact O-CE1 3.45Å
468	A	87.5	Confident	91.3	Very high	4 Å²	4	27.4 Å²	27.4	3%	0.033	15%	0.147	C	C	.	.	S	Bend	trans	-73.5	-29.4	-171.7	0	0	0	0	0	113.7	K283 Y464 P470	K283-A468 WeakPolarHBondContact CD-O 3.11Å; K283-A468 WeakPolarHBondContact CE-O 3.44Å; K283-A468 PolarHBondContact NZ-O 3Å; Y464-A468 HydrophobicContact CD1-CB 3.83Å; Y464-A468 HydrophobicContact CE1-CB 3.59Å; Y464-A468 HydrophobicContact CE2-CB 4.41Å; Y464-A468 HydrophobicContact CG-CB 4.36Å; Y464-A468 WeakPolarHBondContact O-CA 3.39Å; Y464-A468 WeakPolarHBondContact O-CB 3.46Å; Y464-A468 PolarHBondContact O-N 2.88Å; A468-P470 VanDerWaalsContact C-CD 3.46Å; A468-P470 VanDerWaalsContact O-CD 3.3Å; A468-P470 WeakPolarHBondContact O-CD 3.33Å
469	N	90.9	Very high	91.5	Very high	45 Å²	45	23.6 Å²	23.6	24%	0.241	13%	0.126	C	C	.	.			trans	-123	71.4	-169.4	-65	-55.7	0	0	0	111.6	V280 L471 Y496 D497	V280-N469 HydrophobicContact CG1-CB 4.35Å; V280-N469 HydrophobicContact CG2-CB 4.37Å; N469-L471 PolarHBondContact O-N 2.82Å; N469-Y496 WeakPolarHBondContact O-CA 3.47Å; N469-D497 HydrophobicContact CB-CB 3.83Å; N469-D497 PolarHBondContact O-N 2.82Å
470	P	93.8	Very high	91.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	130.8	172.1	27.4	-31.5	0	0	0	110.1	V281 T387 A468 Y496	V281-P470 HydrophobicContact CB-CG 4.35Å; V281-P470 WeakPolarHBondContact CB-O 3.07Å; V281-P470 PolarHBondContact N-O 2.81Å; T387-P470 HydrophobicContact CG2-CB 4.22Å; T387-P470 HydrophobicContact CG2-CG 3.68Å; A468-P470 VanDerWaalsContact C-CD 3.46Å; A468-P470 VanDerWaalsContact O-CD 3.3Å; A468-P470 WeakPolarHBondContact O-CD 3.33Å; P470-Y496 HydrophobicContact CB-CD1 3.99Å; P470-Y496 HydrophobicContact CB-CE1 3.8Å; P470-Y496 HydrophobicContact CG-CE1 4.38Å
471	L	94.7	Very high	90.6	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.016	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-33.7	178.7	-61.3	-175.3	0	0	0	112.2	L278 V280 V281 N469 F495 D497	L278-L471 HydrophobicContact CB-CB 4.22Å; L278-L471 HydrophobicContact CB-CD1 4.47Å; L278-L471 HydrophobicContact CD1-CB 4.37Å; V280-L471 HydrophobicContact CB-CD2 4.45Å; V280-L471 HydrophobicContact CG2-CD2 3.8Å; V281-L471 WeakPolarHBondContact CG2-O 3.41Å; N469-L471 PolarHBondContact O-N 2.82Å; L471-F495 HydrophobicContact CB-CD1 3.91Å; L471-F495 HydrophobicContact CB-CE1 4.24Å; L471-F495 HydrophobicContact CD1-CD1 4.32Å; L471-F495 HydrophobicContact CD1-CE1 3.8Å; L471-F495 PolarHBondContact N-O 3.09Å; L471-D497 HydrophobicContact CD1-CB 3.81Å; L471-D497 HydrophobicContact CD2-CB 4.15Å; L471-D497 HydrophobicContact CG-CB 3.95Å
472	L	95.6	Very high	90	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	152.9	174	-58.3	168.8	0	0	0	110.1	F273 P275 L278 V475 H494 F495 H522 L528 F530	F273-L472 HydrophobicContact CE1-CD1 3.86Å; F273-L472 HydrophobicContact CZ-CD1 3.87Å; P275-L472 HydrophobicContact CG-CD1 4.21Å; L278-L472 HydrophobicContact CD1-CD1 4.03Å; L278-L472 HydrophobicContact CD1-CD2 3.84Å; L278-L472 HydrophobicContact CD1-CG 3.81Å; L472-V475 HydrophobicContact CB-CG2 3.7Å; L472-V475 HydrophobicContact CD1-CG2 4.34Å; L472-H494 WeakPolarHBondContact O-CA 3.45Å; L472-F495 HydrophobicContact CB-CB 4.12Å; L472-F495 HydrophobicContact CD1-CD1 4.29Å; L472-F495 HydrophobicContact CG-CD1 4.44Å; L472-F495 PolarHBondContact N-O 3.35Å; L472-F495 PolarHBondContact O-N 2.73Å; L472-H522 WeakPolarHBondContact CA-O 3.24Å; L472-L528 HydrophobicContact CD2-CB 4.5Å; L472-L528 HydrophobicContact CD2-CD1 3.68Å; L472-F530 HydrophobicContact CD1-CE2 4.17Å
473	T	94.3	Very high	89.5	Confident	27 Å²	27	39.3 Å²	39.3	17%	0.166	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	153.2	170.2	61.9	0	0	0	0	111	V281 T387 V475 Q493 H522	V281-T473 HydrophobicContact CG1-CG2 4.45Å; T387-T473 HydrophobicContact CG2-CG2 4.41Å; T473-V475 PolarHBondContact O-N 3.27Å; T473-Q493 CarbonylContact C-O 2.91Å; T473-Q493 WeakPolarHBondContact CA-O 3.46Å; T473-H522 PolarHBondContact N-O 3.16Å; T473-H522 PolarHBondContact O-N 3.46Å; T473-H522 WeakPolarHBondContact OG1-CB 3.24Å; T473-H522 PolarHBondContact OG1-O 2.98Å
474	G	93.1	Very high	89.1	Confident	32 Å²	32	40.8 Å²	40.8	33%	0.33	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	58	49.3	179.7	0	0	0	0	0	112.3	E476 Q493	G474-E476 PolarHBondContact O-N 2.79Å; G474-Q493 PolarHBondContact N-O 2.83Å
475	V	96.1	Very high	88.9	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	121.5	-178.7	-176.7	0	0	0	0	109.3	F273 L472 T473 T491 Y492 F495 I501 V519 K520	F273-V475 HydrophobicContact CE1-CG1 4.24Å; L472-V475 HydrophobicContact CB-CG2 3.7Å; L472-V475 HydrophobicContact CD1-CG2 4.34Å; T473-V475 PolarHBondContact O-N 3.27Å; V475-T491 CarbonylContact O-C 3.55Å; V475-T491 WeakPolarHBondContact O-CA 2.93Å; V475-Y492 PolarHBondContact N-O 3.32Å; V475-Y492 PolarHBondContact O-N 3.06Å; V475-F495 HydrophobicContact CG2-CB 4.03Å; V475-I501 HydrophobicContact CB-CD1 4.22Å; V475-I501 HydrophobicContact CG1-CD1 3.89Å; V475-I501 HydrophobicContact CG2-CD1 4.41Å; V475-V519 HydrophobicContact CG1-CG1 3.76Å; V475-K520 CarbonylContact C-O 3.5Å; V475-K520 VanDerWaalsContact CA-O 3.25Å; V475-K520 WeakPolarHBondContact CA-O 3.27Å
476	E	96.9	Very high	88.9	Confident	87 Å²	87	43 Å²	43	41%	0.407	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	126.6	178.4	-179.9	170.5	-162.1	0	0	109.6	G474 E478 T491 V519 K520	G474-E476 PolarHBondContact O-N 2.79Å; E476-E478 HydrophobicContact CG-CG 4.17Å; E476-T491 HydrophobicContact CB-CG2 4.4Å; E476-T491 HydrophobicContact CG-CG2 4.08Å; E476-V519 CarbonylContact O-C 3.49Å; E476-V519 WeakPolarHBondContact O-CA 3.35Å; E476-K520 PolarHBondContact N-O 2.78Å; E476-K520 PolarHBondContact O-N 3.41Å
477	M	95.9	Very high	89.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	109.5	178.3	-53.9	-177.1	106.5	0	0	109.2	H271 F273 Y479 N490 I501 V503 D518 V519	H271-M477 WeakPolarHBondContact ND1-CE 3.4Å; F273-M477 HydrophobicContact CB-CE 3.26Å; F273-M477 HydrophobicContact CD1-CE 4.34Å; F273-M477 HydrophobicContact CD2-CE 4.44Å; F273-M477 HydrophobicContact CG-CE 3.8Å; M477-Y479 HydrophobicContact CB-CE2 3.72Å; M477-Y479 WeakPolarHBondContact O-CD2 3.48Å; M477-Y479 WeakPolarHBondContact O-CE2 3.44Å; M477-N490 HydrophobicContact CB-CB 4.31Å; M477-N490 PolarHBondContact N-O 2.75Å; M477-N490 PolarHBondContact O-ND2 2.78Å; M477-I501 HydrophobicContact CE-CG2 4.15Å; M477-I501 HydrophobicContact SD-CG2 3.54Å; M477-I501 VanDerWaalsContact SD-CG2 3.54Å; M477-V503 HydrophobicContact SD-CB 4.17Å; M477-V503 HydrophobicContact SD-CG2 3.23Å; M477-V503 WeakPolarHBondContact SD-CG2 2.98Å; M477-D518 CarbonylContact C-O 3.59Å; M477-D518 WeakPolarHBondContact CA-O 3.46Å; M477-V519 HydrophobicContact CE-CG1 4.31Å; M477-V519 HydrophobicContact CE-CG2 3.59Å; M477-V519 HydrophobicContact CG-CG1 4.06Å; M477-V519 HydrophobicContact CG-CG2 4.11Å
478	E	94.3	Very high	89.5	Confident	65 Å²	65	43.9 Å²	43.9	30%	0.304	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	134.1	-178	-67.7	179	-173.6	0	0	110.5	E476 D518 K520	E476-E478 HydrophobicContact CG-CG 4.17Å; E478-D518 HydrophobicContact CB-CB 4.34Å; E478-D518 PolarHBondContact N-O 3.02Å; E478-D518 PolarHBondContact O-N 2.81Å; E478-K520 WeakPolarHBondContact OE1-CE 3.28Å; E478-K520 IonicContact OE1-NZ 2.72Å; E478-K520 PolarHBondContact OE1-NZ 2.84Å; E478-K520 WeakPolarHBondContact OE2-CE 3.23Å; E478-K520 IonicContact OE2-NZ 2.87Å; E478-K520 PolarHBondContact OE2-NZ 3.12Å
479	Y	91.6	Very high	89.8	Confident	24 Å²	24	47.2 Å²	47.2	9%	0.094	26%	0.256	C	S	.	.			trans	-133.5	159.1	178.8	-52.6	-84.4	0	0	0	110.1	F269 H271 M477 E481 I484 L487 N490 V503 F515 A517	F269-Y479 AromaticContact CE2-CD1 3.97Å; F269-Y479 HydrophobicContact CE2-CD1 3.97Å; F269-Y479 AromaticContact CE2-CE1 3.62Å; F269-Y479 HydrophobicContact CE2-CE1 3.62Å; F269-Y479 HydrophobicContact CZ-CD1 4Å; F269-Y479 HydrophobicContact CZ-CE1 4.07Å; F269-Y479 HydrophobicContact CZ-CG 4.28Å; H271-Y479 HydrophobicContact CB-CE1 4.35Å; H271-Y479 AromaticContact ND1-CE1 3.64Å; H271-Y479 AromaticContact ND1-CZ 3.76Å; H271-Y479 PolarHBondContact ND1-OH 2.97Å; M477-Y479 HydrophobicContact CB-CE2 3.72Å; M477-Y479 WeakPolarHBondContact O-CD2 3.48Å; M477-Y479 WeakPolarHBondContact O-CE2 3.44Å; Y479-E481 PolarHBondContact O-N 3.43Å; Y479-E481 VanDerWaalsContact O-N 3.07Å; Y479-I484 HydrophobicContact CD2-CD1 4.46Å; Y479-I484 HydrophobicContact CG-CD1 3.98Å; Y479-L487 HydrophobicContact CD2-CD1 4.06Å; Y479-L487 HydrophobicContact CD2-CD2 3.84Å; Y479-L487 HydrophobicContact CE2-CD1 4.12Å; Y479-L487 HydrophobicContact CE2-CD2 4.22Å; Y479-N490 HydrophobicContact CE2-CB 4.16Å; Y479-V503 HydrophobicContact CE2-CG1 3.76Å; Y479-V503 VanDerWaalsContact OH-CB 3.3Å; Y479-V503 WeakPolarHBondContact OH-CB 3.1Å; Y479-V503 WeakPolarHBondContact OH-CG1 3.49Å; Y479-F515 AromaticContact CD1-CE1 3.89Å; Y479-F515 HydrophobicContact CD1-CE1 3.89Å; Y479-F515 AromaticContact CD1-CZ 3.65Å; Y479-F515 HydrophobicContact CD1-CZ 3.65Å; Y479-F515 HydrophobicContact CE1-CE1 4.33Å; Y479-F515 HydrophobicContact CE1-CZ 4.37Å; Y479-F515 HydrophobicContact CG-CZ 4.47Å; Y479-A517 HydrophobicContact CD1-CB 3.79Å; Y479-A517 HydrophobicContact CE1-CB 3.68Å
480	P	85.8	Confident	90	Very high	56 Å²	56	47.2 Å²	47.2	36%	0.364	26%	0.256	S	S	.	.			trans	-67.5	109.5	-178.7	-17.6	32.3	0	0	0	111	N482 A483 K516	P480-N482 VanDerWaalsContact C-N 3.26Å; P480-N482 PolarHBondContact O-N 2.89Å; P480-A483 HydrophobicContact CB-CB 4.25Å; P480-A483 WeakPolarHBondContact O-CB 3.32Å; P480-A483 PolarHBondContact O-N 2.98Å; P480-K516 VanDerWaalsContact CD-O 3.29Å; P480-K516 WeakPolarHBondContact CD-O 3.45Å
481	E	74.6	Confident	90	Very high	175 Å²	175	50.6 Å²	50.6	82%	0.818	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-54.7	-39.5	-174.1	-67.3	-175.5	171	0	0	113.3	Y479 A483 I484	Y479-E481 PolarHBondContact O-N 3.43Å; Y479-E481 VanDerWaalsContact O-N 3.07Å; E481-A483 PolarHBondContact O-N 3.24Å; E481-A483 VanDerWaalsContact O-N 3.07Å; E481-I484 PolarHBondContact O-N 2.92Å
482	N	74.8	Confident	89.9	Confident	157 Å²	157	52.6 Å²	52.6	84%	0.84	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-67.5	-8.9	-179.3	-64.5	-35.6	0	0	0	113.9	P480	P480-N482 VanDerWaalsContact C-N 3.26Å; P480-N482 PolarHBondContact O-N 2.89Å
483	A	75	Confident	89.7	Confident	13 Å²	13	55.4 Å²	55.4	11%	0.107	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-106.1	-3.4	-175.6	0	0	0	0	0	113.7	P480 E481 L507 V508	P480-A483 HydrophobicContact CB-CB 4.25Å; P480-A483 WeakPolarHBondContact O-CB 3.32Å; P480-A483 PolarHBondContact O-N 2.98Å; E481-A483 PolarHBondContact O-N 3.24Å; E481-A483 VanDerWaalsContact O-N 3.07Å; A483-L507 CarbonylContact O-C 3.55Å; A483-L507 WeakPolarHBondContact O-CA 3.3Å; A483-L507 WeakPolarHBondContact O-CD2 3.5Å; A483-V508 VanDerWaalsContact C-CG2 3.5Å; A483-V508 PolarHBondContact O-N 2.73Å
484	I	83.8	Confident	89.6	Confident	33 Å²	33	54.9 Å²	54.9	17%	0.169	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.3	-169.2	-61.2	171.2	0	0	0	112.4	F269 Y479 E481 G486 L487 H506 L507	F269-I484 HydrophobicContact CE1-CD1 4.14Å; F269-I484 HydrophobicContact CE1-CG1 4.2Å; F269-I484 HydrophobicContact CZ-CD1 4.18Å; Y479-I484 HydrophobicContact CD2-CD1 4.46Å; Y479-I484 HydrophobicContact CG-CD1 3.98Å; E481-I484 PolarHBondContact O-N 2.92Å; I484-G486 WeakPolarHBondContact CG2-O 3.28Å; I484-L487 HydrophobicContact CD1-CD1 4.32Å; I484-L487 HydrophobicContact CG2-CB 4.01Å; I484-L487 HydrophobicContact CG2-CD1 4.44Å; I484-H506 CarbonylContact C-O 3.53Å; I484-H506 WeakPolarHBondContact CA-O 3.46Å; I484-L507 HydrophobicContact CG1-CD2 4.18Å
485	L	84.9	Confident	89.6	Confident	109 Å²	109	53.5 Å²	53.5	57%	0.571	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	-27.9	173.5	-70.2	175.9	0	0	0	113.4	H506 L507 V508	L485-H506 HydrophobicContact CB-CB 4.44Å; L485-H506 VanDerWaalsContact CD1-CE1 3.41Å; L485-H506 WeakPolarHBondContact CD1-CE1 3.27Å; L485-H506 PolarHBondContact N-O 2.78Å; L485-L507 WeakPolarHBondContact CD1-O 3.37Å; L485-V508 HydrophobicContact CD2-CB 4.45Å; L485-V508 HydrophobicContact CD2-CG2 3.71Å; L485-V508 HydrophobicContact CG-CB 4.26Å; L485-V508 HydrophobicContact CG-CG2 3.64Å
486	G	86.4	Confident	89.5	Confident	22 Å²	22	54.5 Å²	54.5	23%	0.227	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	137.6	178.3	0	0	0	0	0	110.9	I484 G505 H506	I484-G486 WeakPolarHBondContact CG2-O 3.28Å; G486-G505 CarbonylContact O-C 3.57Å; G486-G505 WeakPolarHBondContact O-CA 3.49Å; G486-H506 PolarHBondContact N-O 2.77Å; G486-H506 PolarHBondContact O-N 2.76Å
487	L	93.6	Very high	89.2	Confident	61 Å²	61	54.8 Å²	54.8	32%	0.319	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	138.7	-175.6	-165.8	64	0	0	0	109.7	F269 Y479 I484 N490 V503	F269-L487 HydrophobicContact CE1-CD1 4.2Å; F269-L487 HydrophobicContact CE2-CD1 4.32Å; F269-L487 HydrophobicContact CZ-CD1 3.47Å; F269-L487 VanDerWaalsContact CZ-CD1 3.47Å; Y479-L487 HydrophobicContact CD2-CD1 4.06Å; Y479-L487 HydrophobicContact CD2-CD2 3.84Å; Y479-L487 HydrophobicContact CE2-CD1 4.12Å; Y479-L487 HydrophobicContact CE2-CD2 4.22Å; I484-L487 HydrophobicContact CD1-CD1 4.32Å; I484-L487 HydrophobicContact CG2-CB 4.01Å; I484-L487 HydrophobicContact CG2-CD1 4.44Å; L487-N490 HydrophobicContact CD2-CB 4Å; L487-V503 HydrophobicContact CD1-CG1 3.8Å; L487-V503 HydrophobicContact CG-CG1 4.31Å
488	T	95.6	Very high	89	Confident	7 Å²	7	55.1 Å²	55.1	4%	0.043	29%	0.29	C	S	.	.			trans	-71.5	177.2	167.4	60.4	0	0	0	0	110.7	N490 V503 A504 L561 Q565	T488-N490 PolarHBondContact O-N 2.95Å; T488-V503 WeakPolarHBondContact OG1-CA 3.33Å; T488-V503 WeakPolarHBondContact OG1-CG1 3.48Å; T488-A504 HydrophobicContact CG2-CB 4.13Å; T488-A504 WeakPolarHBondContact CG2-O 3.28Å; T488-A504 PolarHBondContact N-O 2.8Å; T488-A504 PolarHBondContact OG1-N 3.46Å; T488-A504 PolarHBondContact OG1-O 3.42Å; T488-L561 HydrophobicContact CG2-CB 3.95Å; T488-Q565 VanDerWaalsContact CA-OE1 3.29Å; T488-Q565 VanDerWaalsContact CB-OE1 3.22Å
489	Q	93.6	Very high	89	Confident	74 Å²	74	53.3 Å²	53.3	35%	0.346	28%	0.284	S	S	.	.			trans	-47.9	132.2	169.8	179.4	174.2	-16.9	0	0	110.7	T491 Y492 V503	Q489-T491 WeakPolarHBondContact CG-O 3.38Å; Q489-T491 PolarHBondContact NE2-O 2.63Å; Q489-Y492 HydrophobicContact CG-CE1 4.22Å; Q489-Y492 HydrophobicContact CG-CE2 4.36Å; Q489-Y492 PolarHBondContact O-OH 3.42Å; Q489-Y492 VanDerWaalsContact O-OH 3.1Å; Q489-V503 VanDerWaalsContact O-CG2 3.27Å; Q489-V503 WeakPolarHBondContact O-CG2 3.39Å
490	N	95	Very high	89.2	Confident	46 Å²	46	53.5 Å²	53.5	25%	0.246	29%	0.286	C	S	.	.			trans	-126.6	2.3	-177.6	70	-38.1	0	0	0	112.9	M477 Y479 L487 T488 V503	M477-N490 HydrophobicContact CB-CB 4.31Å; M477-N490 PolarHBondContact N-O 2.75Å; M477-N490 PolarHBondContact O-ND2 2.78Å; Y479-N490 HydrophobicContact CE2-CB 4.16Å; L487-N490 HydrophobicContact CD2-CB 4Å; T488-N490 PolarHBondContact O-N 2.95Å; N490-V503 HydrophobicContact CB-CG1 4.4Å
491	T	94	Very high	89.6	Confident	71 Å²	71	51.2 Å²	51.2	44%	0.436	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	133.1	175.9	52.9	0	0	0	0	110	V475 E476 Q489	V475-T491 CarbonylContact O-C 3.55Å; V475-T491 WeakPolarHBondContact O-CA 2.93Å; E476-T491 HydrophobicContact CB-CG2 4.4Å; E476-T491 HydrophobicContact CG-CG2 4.08Å; Q489-T491 WeakPolarHBondContact CG-O 3.38Å; Q489-T491 PolarHBondContact NE2-O 2.63Å
492	Y	92.8	Very high	90.7	Very high	44 Å²	44	44 Å²	44	17%	0.173	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	132.2	-175.5	-61.8	-93.5	0	0	0	109.9	V475 Q489 H494 I501 V502 V503	V475-Y492 PolarHBondContact N-O 3.32Å; V475-Y492 PolarHBondContact O-N 3.06Å; Q489-Y492 HydrophobicContact CG-CE1 4.22Å; Q489-Y492 HydrophobicContact CG-CE2 4.36Å; Q489-Y492 PolarHBondContact O-OH 3.42Å; Q489-Y492 VanDerWaalsContact O-OH 3.1Å; Y492-H494 VanDerWaalsContact C-N 3.27Å; Y492-H494 PolarHBondContact O-N 3.33Å; Y492-I501 HydrophobicContact CD1-CG1 4.41Å; Y492-I501 HydrophobicContact CD2-CD1 3.98Å; Y492-I501 HydrophobicContact CD2-CG1 4.29Å; Y492-I501 HydrophobicContact CD2-CG2 3.68Å; Y492-I501 HydrophobicContact CE1-CG2 4.4Å; Y492-I501 HydrophobicContact CE2-CG2 3.33Å; Y492-I501 HydrophobicContact CG-CD1 3.92Å; Y492-I501 HydrophobicContact CG-CG1 4.2Å; Y492-I501 HydrophobicContact CG-CG2 4.36Å; Y492-V502 PolarHBondContact OH-O 2.79Å; Y492-V503 HydrophobicContact CE2-CG2 3.99Å
493	Q	91.1	Very high	91.8	Very high	59 Å²	59	36.6 Å²	36.6	28%	0.276	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	-32.9	-177.3	-167.2	66.7	-1.3	0	0	112.2	K419 H444 T473 G474	K419-Q493 PolarHBondContact O-NE2 2.94Å; H444-Q493 HydrophobicContact CB-CB 4.23Å; T473-Q493 CarbonylContact C-O 2.91Å; T473-Q493 WeakPolarHBondContact CA-O 3.46Å; G474-Q493 PolarHBondContact N-O 2.83Å
494	H	92.4	Very high	92.7	Very high	16 Å²	16	36 Å²	36	7%	0.074	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	146.8	-175.9	-68.7	87.4	0	0	0	111.4	T387 P421 L472 Y492 Y496	T387-H494 PolarHBondContact OG1-CE1 3.12Å; T387-H494 PolarHBondContact OG1-NE2 3.4Å; P421-H494 WeakPolarHBondContact CD-CE1 3.27Å; L472-H494 WeakPolarHBondContact O-CA 3.45Å; Y492-H494 VanDerWaalsContact C-N 3.27Å; Y492-H494 PolarHBondContact O-N 3.33Å; H494-Y496 HydrophobicContact CB-CD2 4.1Å; H494-Y496 HydrophobicContact CB-CE1 4.21Å; H494-Y496 HydrophobicContact CB-CE2 3.44Å; H494-Y496 VanDerWaalsContact CB-CE2 3.44Å; H494-Y496 VanDerWaalsContact CB-CZ 3.49Å; H494-Y496 AromaticContact CG-CZ 3.77Å
495	F	94.1	Very high	93.2	Very high	3 Å²	3	34.4 Å²	34.4	1%	0.013	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.5	159.1	171	-108.5	0	0	0	108.3	A274 P275 L471 L472 V475 I501	A274-F495 HydrophobicContact CB-CE2 4.04Å; A274-F495 HydrophobicContact CB-CZ 3.91Å; P275-F495 HydrophobicContact CG-CD1 4.11Å; P275-F495 HydrophobicContact CG-CE1 3.66Å; P275-F495 HydrophobicContact CG-CZ 4.29Å; L471-F495 HydrophobicContact CB-CD1 3.91Å; L471-F495 HydrophobicContact CB-CE1 4.24Å; L471-F495 HydrophobicContact CD1-CD1 4.32Å; L471-F495 HydrophobicContact CD1-CE1 3.8Å; L471-F495 PolarHBondContact N-O 3.09Å; L472-F495 HydrophobicContact CB-CB 4.12Å; L472-F495 HydrophobicContact CD1-CD1 4.29Å; L472-F495 HydrophobicContact CG-CD1 4.44Å; L472-F495 PolarHBondContact N-O 3.35Å; L472-F495 PolarHBondContact O-N 2.73Å; V475-F495 HydrophobicContact CG2-CB 4.03Å; F495-I501 HydrophobicContact CB-CD1 4.04Å; F495-I501 HydrophobicContact CD2-CD1 4.05Å; F495-I501 HydrophobicContact CD2-CG1 4.13Å; F495-I501 HydrophobicContact CG-CD1 4.44Å
496	Y	93	Very high	93.5	Very high	22 Å²	22	31.6 Å²	31.6	9%	0.086	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	147.9	-176	-65.7	-76.1	0	0	0	111.8	Y423 E466 V467 N469 P470 H494 G498 S499	Y423-Y496 WeakPolarHBondContact OH-CE2 3.32Å; Y423-Y496 PolarHBondContact OH-OH 2.88Å; E466-Y496 WeakPolarHBondContact O-CB 3.29Å; E466-Y496 VanDerWaalsContact O-CG 3.32Å; V467-Y496 HydrophobicContact CB-CE1 4.12Å; V467-Y496 HydrophobicContact CG1-CE2 4.47Å; V467-Y496 WeakPolarHBondContact O-CE1 3.45Å; N469-Y496 WeakPolarHBondContact O-CA 3.47Å; P470-Y496 HydrophobicContact CB-CD1 3.99Å; P470-Y496 HydrophobicContact CB-CE1 3.8Å; P470-Y496 HydrophobicContact CG-CE1 4.38Å; H494-Y496 HydrophobicContact CB-CD2 4.1Å; H494-Y496 HydrophobicContact CB-CE1 4.21Å; H494-Y496 HydrophobicContact CB-CE2 3.44Å; H494-Y496 VanDerWaalsContact CB-CE2 3.44Å; H494-Y496 VanDerWaalsContact CB-CZ 3.49Å; H494-Y496 AromaticContact CG-CZ 3.77Å; Y496-G498 PolarHBondContact O-N 2.85Å; Y496-S499 PolarHBondContact N-OG 3.16Å; Y496-S499 WeakPolarHBondContact O-CB 3.43Å; Y496-S499 PolarHBondContact O-N 2.91Å; Y496-S499 VanDerWaalsContact O-N 3.09Å; Y496-S499 PolarHBondContact O-OG 2.76Å
497	D	91.9	Very high	93.5	Very high	93 Å²	93	30.9 Å²	30.9	50%	0.497	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	139	173.2	-169.5	20.1	0	0	0	111	N469 L471 S499	N469-D497 HydrophobicContact CB-CB 3.83Å; N469-D497 PolarHBondContact O-N 2.82Å; L471-D497 HydrophobicContact CD1-CB 3.81Å; L471-D497 HydrophobicContact CD2-CB 4.15Å; L471-D497 HydrophobicContact CG-CB 3.95Å; D497-S499 PolarHBondContact O-N 2.92Å
498	G	90.9	Very high	92.7	Very high	8 Å²	8	32 Å²	32	8%	0.082	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	0.7	-175.5	0	0	0	0	0	116	K164 G165 Y496	K164-G498 PolarHBondContact N-O 2.77Å; G165-G498 VanDerWaalsContact N-CA 3.33Å; G165-G498 PolarHBondContact N-O 3.09Å; Y496-G498 PolarHBondContact O-N 2.85Å
499	S	93.6	Very high	91.3	Very high	27 Å²	27	33.4 Å²	33.4	19%	0.189	19%	0.185	C	C	.	.			trans	-92.4	-176.7	171.8	77	0	0	0	0	112.1	R162 Y496 D497	R162-S499 PolarHBondContact NH1-O 2.97Å; Y496-S499 PolarHBondContact N-OG 3.16Å; Y496-S499 WeakPolarHBondContact O-CB 3.43Å; Y496-S499 PolarHBondContact O-N 2.91Å; Y496-S499 VanDerWaalsContact O-N 3.09Å; Y496-S499 PolarHBondContact O-OG 2.76Å; D497-S499 PolarHBondContact O-N 2.92Å
500	E	95.5	Very high	89.6	Confident	28 Å²	28	37.2 Å²	37.2	13%	0.131	20%	0.203	C	C	.	.			trans	-149.3	137.7	171.5	-175.9	169.5	-103	0	0	109.2	R57 R162 Y167 R256 F272 A274 V502	R57-E500 IonicContact NE-OE2 3.81Å; R57-E500 IonicContact NH2-OE1 3.77Å; R57-E500 PolarHBondContact NH2-OE1 3.41Å; R162-E500 HydrophobicContact CB-CB 3.92Å; Y167-E500 PolarHBondContact OH-OE1 3.34Å; Y167-E500 PolarHBondContact OH-OE2 2.97Å; R256-E500 IonicContact CZ-OE1 3.74Å; R256-E500 IonicContact NH1-OE1 2.78Å; R256-E500 PolarHBondContact NH1-OE1 2.8Å; R256-E500 IonicContact NH2-OE1 3.78Å; R256-E500 PolarHBondContact NH2-OE1 3.1Å; F272-E500 HydrophobicContact CB-CG 4.47Å; F272-E500 WeakPolarHBondContact CD1-OE2 3.41Å; A274-E500 HydrophobicContact CB-CB 4.11Å; A274-E500 HydrophobicContact CB-CG 4.01Å; E500-V502 HydrophobicContact CG-CG2 4.2Å
501	I	96	Very high	87.6	Confident	8 Å²	8	42.8 Å²	42.8	4%	0.041	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	133.7	169	-72.1	169.3	0	0	0	108.2	F273 V475 M477 Y492 F495 V503	F273-I501 HydrophobicContact CB-CB 4.37Å; F273-I501 HydrophobicContact CD1-CB 4.44Å; F273-I501 HydrophobicContact CD1-CD1 4.3Å; F273-I501 PolarHBondContact N-O 2.64Å; F273-I501 PolarHBondContact O-N 3.39Å; V475-I501 HydrophobicContact CB-CD1 4.22Å; V475-I501 HydrophobicContact CG1-CD1 3.89Å; V475-I501 HydrophobicContact CG2-CD1 4.41Å; M477-I501 HydrophobicContact CE-CG2 4.15Å; M477-I501 HydrophobicContact SD-CG2 3.54Å; M477-I501 VanDerWaalsContact SD-CG2 3.54Å; Y492-I501 HydrophobicContact CD1-CG1 4.41Å; Y492-I501 HydrophobicContact CD2-CD1 3.98Å; Y492-I501 HydrophobicContact CD2-CG1 4.29Å; Y492-I501 HydrophobicContact CD2-CG2 3.68Å; Y492-I501 HydrophobicContact CE1-CG2 4.4Å; Y492-I501 HydrophobicContact CE2-CG2 3.33Å; Y492-I501 HydrophobicContact CG-CD1 3.92Å; Y492-I501 HydrophobicContact CG-CG1 4.2Å; Y492-I501 HydrophobicContact CG-CG2 4.36Å; F495-I501 HydrophobicContact CB-CD1 4.04Å; F495-I501 HydrophobicContact CD2-CD1 4.05Å; F495-I501 HydrophobicContact CD2-CG1 4.13Å; F495-I501 HydrophobicContact CG-CD1 4.44Å; I501-V503 HydrophobicContact CG2-CG2 4.19Å
502	V	96.8	Very high	85.9	Confident	24 Å²	24	41.6 Å²	41.6	15%	0.145	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	121	179.2	-169.5	0	0	0	0	109.5	L159 V270 H271 F272 Y492 E500 L561	L159-V502 HydrophobicContact CD2-CG1 4.42Å; V270-V502 HydrophobicContact CG2-CG1 3.6Å; H271-V502 WeakPolarHBondContact O-CA 3.5Å; F272-V502 HydrophobicContact CD1-CB 4.46Å; F272-V502 HydrophobicContact CD1-CG1 3.93Å; F272-V502 HydrophobicContact CD1-CG2 3.82Å; F272-V502 HydrophobicContact CE1-CG1 3.79Å; F272-V502 HydrophobicContact CE1-CG2 4.16Å; Y492-V502 PolarHBondContact OH-O 2.79Å; E500-V502 HydrophobicContact CG-CG2 4.2Å; V502-L561 HydrophobicContact CB-CD1 4.38Å; V502-L561 HydrophobicContact CG1-CD1 3.8Å
503	V	96.9	Very high	84.4	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	133.3	175.5	179.9	0	0	0	0	109.2	V270 H271 M477 Y479 L487 T488 Q489 N490 Y492 I501	V270-V503 CarbonylContact C-O 3.48Å; V270-V503 WeakPolarHBondContact CA-O 3.04Å; H271-V503 PolarHBondContact N-O 2.91Å; H271-V503 PolarHBondContact O-N 3.19Å; M477-V503 HydrophobicContact SD-CB 4.17Å; M477-V503 HydrophobicContact SD-CG2 3.23Å; M477-V503 WeakPolarHBondContact SD-CG2 2.98Å; Y479-V503 HydrophobicContact CE2-CG1 3.76Å; Y479-V503 VanDerWaalsContact OH-CB 3.3Å; Y479-V503 WeakPolarHBondContact OH-CB 3.1Å; Y479-V503 WeakPolarHBondContact OH-CG1 3.49Å; L487-V503 HydrophobicContact CD1-CG1 3.8Å; L487-V503 HydrophobicContact CG-CG1 4.31Å; T488-V503 WeakPolarHBondContact OG1-CA 3.33Å; T488-V503 WeakPolarHBondContact OG1-CG1 3.48Å; Q489-V503 VanDerWaalsContact O-CG2 3.27Å; Q489-V503 WeakPolarHBondContact O-CG2 3.39Å; N490-V503 HydrophobicContact CB-CG1 4.4Å; Y492-V503 HydrophobicContact CE2-CG2 3.99Å; I501-V503 HydrophobicContact CG2-CG2 4.19Å
504	A	95.7	Very high	83.5	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	151.6	176.9	0	0	0	0	0	110.8	F269 T488 L557 W558 L561	F269-A504 CarbonylContact O-C 3.45Å; F269-A504 VanDerWaalsContact O-CA 3.23Å; F269-A504 WeakPolarHBondContact O-CA 3.26Å; T488-A504 HydrophobicContact CG2-CB 4.13Å; T488-A504 WeakPolarHBondContact CG2-O 3.28Å; T488-A504 PolarHBondContact N-O 2.8Å; T488-A504 PolarHBondContact OG1-N 3.46Å; T488-A504 PolarHBondContact OG1-O 3.42Å; A504-L557 HydrophobicContact CB-CD2 4Å; A504-W558 HydrophobicContact CB-CB 3.97Å; A504-W558 HydrophobicContact CB-CG 4.4Å; A504-L561 HydrophobicContact CB-CD1 4.07Å
505	G	93.1	Very high	82.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	167.8	176.3	0	0	0	0	0	114.6	Y268 F269 G486	Y268-G505 CarbonylContact C-O 3.52Å; Y268-G505 WeakPolarHBondContact CA-O 3.11Å; F269-G505 WeakPolarHBondContact CD1-O 3.49Å; F269-G505 VanDerWaalsContact CE1-CA 3.4Å; F269-G505 PolarHBondContact N-O 3.29Å; F269-G505 PolarHBondContact O-N 3.15Å; G486-G505 CarbonylContact O-C 3.57Å; G486-G505 WeakPolarHBondContact O-CA 3.49Å
506	H	91	Very high	82.7	Confident	51 Å²	51	50.2 Å²	50.2	24%	0.236	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	130.5	178.6	178.2	-144.8	0	0	0	108.8	G267 Y268 I484 L485 G486 W558	G267-H506 PolarHBondContact O-CD2 2.99Å; Y268-H506 HydrophobicContact CD1-CB 3.91Å; Y268-H506 AromaticContact CD1-CD2 3.9Å; Y268-H506 HydrophobicContact CE1-CB 3.72Å; Y268-H506 AromaticContact CE1-CD2 3.4Å; Y268-H506 WeakPolarHBondContact CE1-CD2 3.18Å; Y268-H506 AromaticContact CE1-CG 3.61Å; Y268-H506 AromaticContact CZ-CD2 3.45Å; Y268-H506 VanDerWaalsContact CZ-CD2 3.45Å; Y268-H506 AromaticContact CZ-NE2 3.82Å; I484-H506 CarbonylContact C-O 3.53Å; I484-H506 WeakPolarHBondContact CA-O 3.46Å; L485-H506 HydrophobicContact CB-CB 4.44Å; L485-H506 VanDerWaalsContact CD1-CE1 3.41Å; L485-H506 WeakPolarHBondContact CD1-CE1 3.27Å; L485-H506 PolarHBondContact N-O 2.78Å; G486-H506 PolarHBondContact N-O 2.77Å; G486-H506 PolarHBondContact O-N 2.76Å; H506-W558 HydrophobicContact CB-CZ2 4.31Å
507	L	87.5	Confident	82.6	Confident	6 Å²	6	49.2 Å²	49.2	3%	0.031	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	153.8	-172.1	-58.5	173.9	0	0	0	112.6	I264 G267 F269 A483 I484 L485 G509 F515	I264-L507 HydrophobicContact CG2-CD1 3.83Å; G267-L507 WeakPolarHBondContact O-CB 3.25Å; G267-L507 PolarHBondContact O-N 2.73Å; F269-L507 HydrophobicContact CD1-CD2 3.65Å; F269-L507 HydrophobicContact CD1-CG 4.04Å; F269-L507 HydrophobicContact CE1-CD2 3.92Å; A483-L507 CarbonylContact O-C 3.55Å; A483-L507 WeakPolarHBondContact O-CA 3.3Å; A483-L507 WeakPolarHBondContact O-CD2 3.5Å; I484-L507 HydrophobicContact CG1-CD2 4.18Å; L485-L507 WeakPolarHBondContact CD1-O 3.37Å; L507-G509 PolarHBondContact O-N 2.98Å; L507-F515 HydrophobicContact CD2-CD2 4.23Å; L507-F515 HydrophobicContact CD2-CE2 3.69Å
508	V	77.2	Confident	82.7	Confident	84 Å²	84	46.1 Å²	46.1	51%	0.509	26%	0.26	S	S	.	.	S	Bend	trans	-73.9	-6.6	-176.4	-179.9	0	0	0	0	113.5	A483 L485	A483-V508 VanDerWaalsContact C-CG2 3.5Å; A483-V508 PolarHBondContact O-N 2.73Å; L485-V508 HydrophobicContact CD2-CB 4.45Å; L485-V508 HydrophobicContact CD2-CG2 3.71Å; L485-V508 HydrophobicContact CG-CB 4.26Å; L485-V508 HydrophobicContact CG-CG2 3.64Å
509	G	64.8	Low	83	Confident	37 Å²	37	45.8 Å²	45.8	38%	0.381	26%	0.256	S	S	.	.			trans	169.3	171.6	175	0	0	0	0	0	112.5	L507 D511	L507-G509 PolarHBondContact O-N 2.98Å; G509-D511 VanDerWaalsContact C-N 3.3Å; G509-D511 PolarHBondContact O-N 2.87Å
510	E	57.9	Low	83.1	Confident	155 Å²	155	48.1 Å²	48.1	72%	0.724	26%	0.263	S	S	*	.	S	Bend	trans	-78.9	-7.5	-179.6	-65.7	-177.8	165.4	0	0	113.8	V512	E510-V512 PolarHBondContact O-N 3.09Å
511	D	53	Low	83.2	Confident	162 Å²	162	47 Å²	47	87%	0.866	26%	0.259	S	S	*	.			trans	-91.3	30.3	-167.7	-85.8	-28.7	0	0	0	115.4	G509	G509-D511 VanDerWaalsContact C-N 3.3Å; G509-D511 PolarHBondContact O-N 2.87Å
512	V	58.2	Low	83.1	Confident	47 Å²	47	51 Å²	51	29%	0.285	28%	0.277	S	S	.	.			trans	-97.9	110.8	172.9	-176.2	0	0	0	0	108.7	E510 S514 M536	E510-V512 PolarHBondContact O-N 3.09Å; V512-S514 WeakPolarHBondContact CG1-O 3.44Å; V512-S514 PolarHBondContact O-N 2.89Å; V512-M536 HydrophobicContact CB-CE 3.6Å; V512-M536 HydrophobicContact CG1-CE 4.02Å; V512-M536 WeakPolarHBondContact O-CE 3.25Å
513	N	62.7	Low	83	Confident	128 Å²	128	50.1 Å²	50.1	68%	0.684	27%	0.273	S	S	*	.	S	Bend	trans	-70.7	-18.9	-178.5	-76.5	-44.9	0	0	0	113.8
514	S	70.3	Confident	82.8	Confident	88 Å²	88	51.4 Å²	51.4	62%	0.615	28%	0.284	S	S	*	.			trans	-150.7	124.8	-178.5	58.8	0	0	0	0	110.4	V512	V512-S514 WeakPolarHBondContact CG1-O 3.44Å; V512-S514 PolarHBondContact O-N 2.89Å
515	F	81.8	Confident	82.5	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.009	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	123.9	175.5	-174.1	-92.6	0	0	0	109.5	V262 I264 F269 Y479 L507 A517 V534 M536	V262-F515 HydrophobicContact CG1-CD1 3.73Å; V262-F515 HydrophobicContact CG1-CE1 3.77Å; I264-F515 HydrophobicContact CD1-CB 3.38Å; I264-F515 HydrophobicContact CD1-CD1 3.88Å; I264-F515 HydrophobicContact CD1-CD2 4.14Å; I264-F515 HydrophobicContact CD1-CG 3.55Å; F269-F515 HydrophobicContact CD1-CE2 4.35Å; F269-F515 HydrophobicContact CD1-CZ 4.06Å; F269-F515 HydrophobicContact CD2-CE1 4.26Å; F269-F515 HydrophobicContact CD2-CZ 4.04Å; F269-F515 HydrophobicContact CE1-CE2 4.34Å; F269-F515 AromaticContact CE1-CZ 3.95Å; F269-F515 HydrophobicContact CE1-CZ 3.95Å; F269-F515 HydrophobicContact CE2-CE1 4.39Å; F269-F515 AromaticContact CE2-CZ 3.96Å; F269-F515 HydrophobicContact CE2-CZ 3.96Å; F269-F515 HydrophobicContact CG-CZ 4.08Å; F269-F515 AromaticContact CZ-CZ 3.88Å; F269-F515 HydrophobicContact CZ-CZ 3.88Å; Y479-F515 AromaticContact CD1-CE1 3.89Å; Y479-F515 HydrophobicContact CD1-CE1 3.89Å; Y479-F515 AromaticContact CD1-CZ 3.65Å; Y479-F515 HydrophobicContact CD1-CZ 3.65Å; Y479-F515 HydrophobicContact CE1-CE1 4.33Å; Y479-F515 HydrophobicContact CE1-CZ 4.37Å; Y479-F515 HydrophobicContact CG-CZ 4.47Å; L507-F515 HydrophobicContact CD2-CD2 4.23Å; L507-F515 HydrophobicContact CD2-CE2 3.69Å; F515-A517 HydrophobicContact CE1-CB 4.24Å; F515-V534 PolarHBondContact N-O 2.7Å; F515-V534 PolarHBondContact O-N 3.12Å; F515-M536 HydrophobicContact CB-CE 4.11Å
516	K	88	Confident	82.6	Confident	85 Å²	85	58.6 Å²	58.6	37%	0.37	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	131.5	178.8	-174.7	-177.2	-175.7	-138.1	0	109.6	P480 D518 T531 E532 E533	P480-K516 VanDerWaalsContact CD-O 3.29Å; P480-K516 WeakPolarHBondContact CD-O 3.45Å; K516-D518 WeakPolarHBondContact CE-OD1 3.4Å; K516-D518 WeakPolarHBondContact CE-OD2 3.28Å; K516-D518 VanDerWaalsContact NZ-CG 3.34Å; K516-D518 IonicContact NZ-OD1 3.12Å; K516-D518 PolarHBondContact NZ-OD1 2.87Å; K516-D518 VanDerWaalsContact NZ-OD1 3.12Å; K516-D518 IonicContact NZ-OD2 2.72Å; K516-D518 PolarHBondContact NZ-OD2 2.84Å; K516-T531 HydrophobicContact CD-CG2 4.37Å; K516-T531 HydrophobicContact CG-CG2 4.26Å; K516-E532 WeakPolarHBondContact CA-O 3.16Å; K516-E533 HydrophobicContact CB-CG 4.45Å; K516-E533 HydrophobicContact CG-CG 4.09Å
517	A	91.7	Very high	82.8	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.7	171.3	0	0	0	0	0	109.6	V262 Y479 F515 E532	V262-A517 HydrophobicContact CG2-CB 4.02Å; Y479-A517 HydrophobicContact CD1-CB 3.79Å; Y479-A517 HydrophobicContact CE1-CB 3.68Å; F515-A517 HydrophobicContact CE1-CB 4.24Å; A517-E532 PolarHBondContact N-O 3.2Å; A517-E532 PolarHBondContact O-N 3.13Å
518	D	94.3	Very high	83.2	Confident	29 Å²	29	62 Å²	62	16%	0.155	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	131.2	175.8	-71.7	-37.9	0	0	0	109.1	M477 E478 K516 F530 T531	M477-D518 CarbonylContact C-O 3.59Å; M477-D518 WeakPolarHBondContact CA-O 3.46Å; E478-D518 HydrophobicContact CB-CB 4.34Å; E478-D518 PolarHBondContact N-O 3.02Å; E478-D518 PolarHBondContact O-N 2.81Å; K516-D518 WeakPolarHBondContact CE-OD1 3.4Å; K516-D518 WeakPolarHBondContact CE-OD2 3.28Å; K516-D518 VanDerWaalsContact NZ-CG 3.34Å; K516-D518 IonicContact NZ-OD1 3.12Å; K516-D518 PolarHBondContact NZ-OD1 2.87Å; K516-D518 VanDerWaalsContact NZ-OD1 3.12Å; K516-D518 IonicContact NZ-OD2 2.72Å; K516-D518 PolarHBondContact NZ-OD2 2.84Å; D518-F530 CarbonylContact C-O 3.59Å; D518-F530 WeakPolarHBondContact CA-O 3.37Å; D518-T531 WeakPolarHBondContact OD1-CB 3.01Å; D518-T531 VanDerWaalsContact OD1-CG2 3.31Å; D518-T531 WeakPolarHBondContact OD1-CG2 3.33Å; D518-T531 PolarHBondContact OD1-OG1 2.77Å
519	V	96.8	Very high	84	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	117.2	175.6	-172.7	0	0	0	0	109.1	H271 F273 V475 E476 M477 T529 F530	H271-V519 VanDerWaalsContact CE1-CG2 3.5Å; H271-V519 WeakPolarHBondContact CE1-CG2 3.38Å; F273-V519 HydrophobicContact CD1-CG1 4.08Å; F273-V519 HydrophobicContact CD2-CB 4.2Å; F273-V519 HydrophobicContact CD2-CG1 4.03Å; F273-V519 HydrophobicContact CD2-CG2 3.94Å; F273-V519 HydrophobicContact CE1-CG1 3.75Å; F273-V519 HydrophobicContact CE2-CB 3.9Å; F273-V519 HydrophobicContact CE2-CG1 3.69Å; F273-V519 HydrophobicContact CE2-CG2 4.16Å; F273-V519 HydrophobicContact CG-CG1 4.2Å; F273-V519 HydrophobicContact CG-CG2 4.43Å; F273-V519 HydrophobicContact CZ-CB 4.22Å; F273-V519 HydrophobicContact CZ-CG1 3.54Å; V475-V519 HydrophobicContact CG1-CG1 3.76Å; E476-V519 CarbonylContact O-C 3.49Å; E476-V519 WeakPolarHBondContact O-CA 3.35Å; M477-V519 HydrophobicContact CE-CG1 4.31Å; M477-V519 HydrophobicContact CE-CG2 3.59Å; M477-V519 HydrophobicContact CG-CG1 4.06Å; M477-V519 HydrophobicContact CG-CG2 4.11Å; V519-T529 CarbonylContact O-C 3.53Å; V519-T529 VanDerWaalsContact O-CA 3.3Å; V519-T529 WeakPolarHBondContact O-CA 3.49Å; V519-F530 HydrophobicContact CB-CB 4.34Å; V519-F530 PolarHBondContact N-O 3.14Å; V519-F530 PolarHBondContact O-N 3.17Å
520	K	97.1	Very high	85.5	Confident	76 Å²	76	62.1 Å²	62.1	33%	0.33	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	148.6	179.5	-63.1	176.3	-172	163.5	0	110	V475 E476 E478 L528 T529	V475-K520 CarbonylContact C-O 3.5Å; V475-K520 VanDerWaalsContact CA-O 3.25Å; V475-K520 WeakPolarHBondContact CA-O 3.27Å; E476-K520 PolarHBondContact N-O 2.78Å; E476-K520 PolarHBondContact O-N 3.41Å; E478-K520 WeakPolarHBondContact OE1-CE 3.28Å; E478-K520 IonicContact OE1-NZ 2.72Å; E478-K520 PolarHBondContact OE1-NZ 2.84Å; E478-K520 WeakPolarHBondContact OE2-CE 3.23Å; E478-K520 IonicContact OE2-NZ 2.87Å; E478-K520 PolarHBondContact OE2-NZ 3.12Å; K520-L528 WeakPolarHBondContact CA-O 3.48Å; K520-T529 HydrophobicContact CG-CG2 4.11Å
521	G	96.1	Very high	87.1	Confident	5 Å²	5	58.1 Å²	58.1	5%	0.052	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174	165.6	172.7	0	0	0	0	0	112.9	L528	G521-L528 PolarHBondContact N-O 2.85Å; G521-L528 PolarHBondContact O-N 3.36Å
522	H	95.1	Very high	88.8	Confident	93 Å²	93	51.9 Å²	51.9	43%	0.431	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	115.6	179.3	-55	-68	0	0	0	110.3	L472 T473 D527	L472-H522 WeakPolarHBondContact CA-O 3.24Å; T473-H522 PolarHBondContact N-O 3.16Å; T473-H522 PolarHBondContact O-N 3.46Å; T473-H522 WeakPolarHBondContact OG1-CB 3.24Å; T473-H522 PolarHBondContact OG1-O 2.98Å; H522-D527 IonicContact CE1-OD1 2.65Å; H522-D527 IonicContact CG-OD1 2.88Å; H522-D527 VanDerWaalsContact ND1-CG 3.33Å; H522-D527 IonicContact ND1-OD1 2.66Å; H522-D527 PolarHBondContact ND1-OD1 3.34Å; H522-D527 IonicContact ND1-OD2 3.98Å
523	G	94.1	Very high	90	Very high	5 Å²	5	56.7 Å²	56.7	5%	0.052	31%	0.313	C	S	.	.			trans	-91.4	177.3	172.8	0	0	0	0	0	112.8	A525 N526	G523-A525 VanDerWaalsContact C-N 3.29Å; G523-A525 PolarHBondContact O-N 3.36Å; G523-N526 WeakPolarHBondContact CA-O 3.4Å; G523-N526 PolarHBondContact N-O 3.45Å
524	A	92.3	Very high	90.8	Very high	27 Å²	27	51.4 Å²	51.4	22%	0.223	29%	0.286	C	S	.	.	S	Bend	trans	-62.1	-34.2	-177.5	0	0	0	0	0	113.3	P279 V281 R385	P279-A524 HydrophobicContact CB-CB 4.21Å; V281-A524 HydrophobicContact CG2-CB 4.2Å; R385-A524 WeakPolarHBondContact CD-O 3.46Å
525	A	90.6	Very high	90.9	Very high	70 Å²	70	51.3 Å²	51.3	58%	0.579	28%	0.278	S	S	*	.	S	Bend	trans	-112.8	-21	-173.4	0	0	0	0	0	114.5	R385 G523	R385-A525 PolarHBondContact NH1-O 2.89Å; G523-A525 VanDerWaalsContact C-N 3.29Å; G523-A525 PolarHBondContact O-N 3.36Å
526	N	93.6	Very high	90.2	Very high	81 Å²	81	52.4 Å²	52.4	43%	0.433	28%	0.283	S	S	.	.	S	Bend	trans	-163.8	163.3	-175.8	57.7	-22.5	0	0	0	111	G523	G523-N526 WeakPolarHBondContact CA-O 3.4Å; G523-N526 PolarHBondContact N-O 3.45Å
527	D	95.6	Very high	89.2	Confident	94 Å²	94	55.3 Å²	55.3	50%	0.503	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	141.3	167	-56.5	-19.9	0	0	0	108.3	R385 H522	R385-D527 IonicContact NH2-OD1 2.88Å; H522-D527 IonicContact CE1-OD1 2.65Å; H522-D527 IonicContact CG-OD1 2.88Å; H522-D527 VanDerWaalsContact ND1-CG 3.33Å; H522-D527 IonicContact ND1-OD1 2.66Å; H522-D527 PolarHBondContact ND1-OD1 3.34Å; H522-D527 IonicContact ND1-OD2 3.98Å
528	L	95.5	Very high	88	Confident	34 Å²	34	62.3 Å²	62.3	18%	0.178	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	144	-173.1	-65.8	171	0	0	0	109.7	L278 L472 K520 G521 F530	L278-L528 HydrophobicContact CD1-CD1 4.44Å; L278-L528 HydrophobicContact CD2-CD1 3.96Å; L472-L528 HydrophobicContact CD2-CB 4.5Å; L472-L528 HydrophobicContact CD2-CD1 3.68Å; K520-L528 WeakPolarHBondContact CA-O 3.48Å; G521-L528 PolarHBondContact N-O 2.85Å; G521-L528 PolarHBondContact O-N 3.36Å; L528-F530 HydrophobicContact CB-CE2 3.92Å; L528-F530 HydrophobicContact CB-CZ 4.14Å; L528-F530 HydrophobicContact CD1-CZ 4.26Å
529	T	95.9	Very high	86.7	Confident	86 Å²	86	62.3 Å²	62.3	53%	0.528	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	126.6	173.5	-56.3	0	0	0	0	108.2	V519 K520	V519-T529 CarbonylContact O-C 3.53Å; V519-T529 VanDerWaalsContact O-CA 3.3Å; V519-T529 WeakPolarHBondContact O-CA 3.49Å; K520-T529 HydrophobicContact CG-CG2 4.11Å
530	F	94.4	Very high	85.2	Confident	37 Å²	37	67.9 Å²	67.9	16%	0.162	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	129.4	176.2	-54.6	-82.4	0	0	0	108	P259 F273 P275 L278 L472 D518 V519 L528	P259-F530 HydrophobicContact CB-CD1 3.71Å; P259-F530 HydrophobicContact CB-CE1 4.04Å; P259-F530 HydrophobicContact CB-CG 4.2Å; P259-F530 HydrophobicContact CG-CB 4.22Å; P259-F530 HydrophobicContact CG-CD1 3.53Å; P259-F530 HydrophobicContact CG-CE1 4.2Å; P259-F530 HydrophobicContact CG-CG 4.14Å; F273-F530 HydrophobicContact CE2-CB 4.19Å; F273-F530 AromaticContact CE2-CD2 3.63Å; F273-F530 HydrophobicContact CE2-CD2 3.63Å; F273-F530 HydrophobicContact CE2-CE2 4.21Å; F273-F530 AromaticContact CE2-CG 3.98Å; F273-F530 HydrophobicContact CE2-CG 3.98Å; F273-F530 AromaticContact CZ-CD2 3.63Å; F273-F530 HydrophobicContact CZ-CD2 3.63Å; F273-F530 AromaticContact CZ-CE2 3.84Å; F273-F530 HydrophobicContact CZ-CE2 3.84Å; F273-F530 HydrophobicContact CZ-CG 4.41Å; P275-F530 HydrophobicContact CB-CZ 4.3Å; L278-F530 HydrophobicContact CD1-CZ 4.44Å; L278-F530 HydrophobicContact CD2-CZ 4.43Å; L472-F530 HydrophobicContact CD1-CE2 4.17Å; D518-F530 CarbonylContact C-O 3.59Å; D518-F530 WeakPolarHBondContact CA-O 3.37Å; V519-F530 HydrophobicContact CB-CB 4.34Å; V519-F530 PolarHBondContact N-O 3.14Å; V519-F530 PolarHBondContact O-N 3.17Å; L528-F530 HydrophobicContact CB-CE2 3.92Å; L528-F530 HydrophobicContact CB-CZ 4.14Å; L528-F530 HydrophobicContact CD1-CZ 4.26Å
531	T	92.4	Very high	83.6	Confident	72 Å²	72	71.6 Å²	71.6	44%	0.442	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	122.9	-179	-67	0	0	0	0	108.6	K516 D518 E533	K516-T531 HydrophobicContact CD-CG2 4.37Å; K516-T531 HydrophobicContact CG-CG2 4.26Å; D518-T531 WeakPolarHBondContact OD1-CB 3.01Å; D518-T531 VanDerWaalsContact OD1-CG2 3.31Å; D518-T531 WeakPolarHBondContact OD1-CG2 3.33Å; D518-T531 PolarHBondContact OD1-OG1 2.77Å; T531-E533 HydrophobicContact CG2-CG 4.27Å
532	E	88.3	Confident	82.1	Confident	31 Å²	31	72.8 Å²	72.8	15%	0.145	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	127.9	174.4	-60.3	-63.7	150.1	0	0	109.1	S258 G260 V262 K516 A517	S258-E532 PolarHBondContact OG-OE1 2.78Å; S258-E532 PolarHBondContact OG-OE2 3.36Å; G260-E532 WeakPolarHBondContact CA-OE1 3.38Å; G260-E532 PolarHBondContact N-OE1 2.87Å; G260-E532 VanDerWaalsContact N-OE1 3.1Å; V262-E532 HydrophobicContact CG2-CB 4.19Å; K516-E532 WeakPolarHBondContact CA-O 3.16Å; A517-E532 PolarHBondContact N-O 3.2Å; A517-E532 PolarHBondContact O-N 3.13Å
533	E	84.5	Confident	80.5	Confident	148 Å²	148	69.5 Å²	69.5	69%	0.692	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	126	174.5	-69.2	-173.7	175.3	0	0	109.3	K516 T531	K516-E533 HydrophobicContact CB-CG 4.45Å; K516-E533 HydrophobicContact CG-CG 4.09Å; T531-E533 HydrophobicContact CG2-CG 4.27Å
534	V	79.1	Confident	78.9	Confident	17 Å²	17	75.5 Å²	75.5	10%	0.103	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	126	-178.1	-175.1	0	0	0	0	110.9	V262 I264 F515 M539	V262-V534 HydrophobicContact CB-CG2 3.52Å; V262-V534 HydrophobicContact CG1-CG2 3.79Å; V262-V534 HydrophobicContact CG2-CG2 4.48Å; I264-V534 HydrophobicContact CD1-CB 4.5Å; I264-V534 HydrophobicContact CD1-CG1 4.4Å; F515-V534 PolarHBondContact N-O 2.7Å; F515-V534 PolarHBondContact O-N 3.12Å; V534-M539 HydrophobicContact CG1-CB 4.49Å; V534-M539 HydrophobicContact CG1-CE 4.21Å
535	D	71.7	Confident	77.3	Confident	85 Å²	85	78.5 Å²	78.5	46%	0.455	40%	0.402	S	S	.	.			trans	-85	114.2	161.2	-172.1	-33.3	0	0	0	109.4	K537 E538 M539	D535-K537 VanDerWaalsContact C-N 3.28Å; D535-K537 PolarHBondContact O-N 3.08Å; D535-K537 WeakPolarHBondContact OD1-CB 3.24Å; D535-K537 PolarHBondContact OD1-N 3.26Å; D535-E538 HydrophobicContact CB-CB 4.41Å; D535-E538 PolarHBondContact O-N 3.44Å; D535-M539 PolarHBondContact O-N 2.64Å
536	M	68.3	Low	75.6	Confident	25 Å²	25	85 Å²	85	12%	0.123	41%	0.411	C	S	.	.	H	α-helix	trans	-64.1	-30.3	-177.4	-65	-166.7	-165.4	0	0	113.4	I264 V512 F515 M539 E540	I264-M536 HydrophobicContact CD1-CE 3.94Å; I264-M536 HydrophobicContact CD1-CG 4.28Å; I264-M536 HydrophobicContact CG2-CE 4.46Å; I264-M536 HydrophobicContact CG2-SD 4.29Å; V512-M536 HydrophobicContact CB-CE 3.6Å; V512-M536 HydrophobicContact CG1-CE 4.02Å; V512-M536 WeakPolarHBondContact O-CE 3.25Å; F515-M536 HydrophobicContact CB-CE 4.11Å; M536-M539 PolarHBondContact O-N 3.25Å; M536-E540 WeakPolarHBondContact O-CG 3.5Å; M536-E540 PolarHBondContact O-N 3.15Å
537	K	65.4	Low	73.7	Confident	146 Å²	146	87.7 Å²	87.7	64%	0.635	43%	0.426	S	S	*	.	H	α-helix	trans	-72.9	-34.4	-176.6	-66.2	-179.9	-178.9	172.3	0	112	D535 K541	D535-K537 VanDerWaalsContact C-N 3.28Å; D535-K537 PolarHBondContact O-N 3.08Å; D535-K537 WeakPolarHBondContact OD1-CB 3.24Å; D535-K537 PolarHBondContact OD1-N 3.26Å; K537-K541 WeakPolarHBondContact O-CB 3.49Å; K537-K541 PolarHBondContact O-N 3.44Å
538	E	66.3	Low	71.5	Confident	148 Å²	148	86.5 Å²	86.5	69%	0.692	42%	0.415	S	S	*	.	H	α-helix	trans	-70.5	-39.2	174.5	-168.9	172.5	-176.3	0	0	110.9	D535 K541 A542	D535-E538 HydrophobicContact CB-CB 4.41Å; D535-E538 PolarHBondContact O-N 3.44Å; E538-K541 PolarHBondContact O-N 2.99Å; E538-A542 PolarHBondContact O-N 3.09Å
539	M	67.3	Low	69.9	Low	29 Å²	29	86.1 Å²	86.1	14%	0.143	41%	0.412	C	S	.	.	H	α-helix	trans	-66.1	-47	176.8	-169.1	62.2	66.1	0	0	112.4	V262 V534 D535 M536 K541 A542 L543	V262-M539 WeakPolarHBondContact O-CE 3.36Å; V534-M539 HydrophobicContact CG1-CB 4.49Å; V534-M539 HydrophobicContact CG1-CE 4.21Å; D535-M539 PolarHBondContact O-N 2.64Å; M536-M539 PolarHBondContact O-N 3.25Å; M539-K541 VanDerWaalsContact C-N 3.25Å; M539-K541 PolarHBondContact O-N 2.9Å; M539-A542 WeakPolarHBondContact O-CB 3.14Å; M539-A542 PolarHBondContact O-N 3.43Å; M539-A542 VanDerWaalsContact O-N 3.1Å; M539-L543 HydrophobicContact CG-CD1 3.98Å; M539-L543 WeakPolarHBondContact O-CG 3.45Å; M539-L543 PolarHBondContact O-N 3.34Å; M539-L543 VanDerWaalsContact O-N 3.15Å; M539-L543 HydrophobicContact SD-CD1 4.3Å
540	E	65.4	Low	68.3	Low	117 Å²	117	83.3 Å²	83.3	55%	0.547	39%	0.393	S	S	.	.	H	α-helix	trans	-57.1	-40.7	175.6	-80.2	-176.3	171	0	0	111.9	M536 L543 Q544	M536-E540 WeakPolarHBondContact O-CG 3.5Å; M536-E540 PolarHBondContact O-N 3.15Å; E540-L543 PolarHBondContact O-N 3.19Å; E540-Q544 WeakPolarHBondContact O-CG 3.03Å; E540-Q544 PolarHBondContact O-N 2.85Å
541	K	64.9	Low	66.9	Low	153 Å²	153	84.5 Å²	84.5	67%	0.665	42%	0.416	S	S	*	.	H	α-helix	trans	-66.9	-37.1	177.3	-169.4	-179.7	178.6	-174.4	0	112.3	K537 E538 M539 L543 Q544	K537-K541 WeakPolarHBondContact O-CB 3.49Å; K537-K541 PolarHBondContact O-N 3.44Å; E538-K541 PolarHBondContact O-N 2.99Å; M539-K541 VanDerWaalsContact C-N 3.25Å; M539-K541 PolarHBondContact O-N 2.9Å; K541-L543 PolarHBondContact O-N 3.31Å; K541-Q544 PolarHBondContact O-N 3.33Å
542	A	63.1	Low	66.2	Low	31 Å²	31	84.6 Å²	84.6	26%	0.256	41%	0.414	S	S	.	.	H	α-helix	trans	-67.2	-20.6	175.2	0	0	0	0	0	113.2	E538 M539	E538-A542 PolarHBondContact O-N 3.09Å; M539-A542 WeakPolarHBondContact O-CB 3.14Å; M539-A542 PolarHBondContact O-N 3.43Å; M539-A542 VanDerWaalsContact O-N 3.1Å
543	L	62.8	Low	66.1	Low	23 Å²	23	83.2 Å²	83.2	12%	0.12	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	6.1	-178.1	-62.5	171.6	0	0	0	113.5	F189 P191 V265 M539 E540 K541 E545 I549 Y553	F189-L543 HydrophobicContact CE1-CD2 4.21Å; P191-L543 HydrophobicContact CG-CD2 4.47Å; V265-L543 HydrophobicContact CG2-CD1 3.19Å; M539-L543 HydrophobicContact CG-CD1 3.98Å; M539-L543 WeakPolarHBondContact O-CG 3.45Å; M539-L543 PolarHBondContact O-N 3.34Å; M539-L543 VanDerWaalsContact O-N 3.15Å; M539-L543 HydrophobicContact SD-CD1 4.3Å; E540-L543 PolarHBondContact O-N 3.19Å; K541-L543 PolarHBondContact O-N 3.31Å; L543-E545 PolarHBondContact O-N 2.81Å; L543-I549 HydrophobicContact CB-CD1 4.29Å; L543-I549 HydrophobicContact CD2-CD1 4.01Å; L543-I549 WeakPolarHBondContact O-CD1 3.23Å; L543-Y553 WeakPolarHBondContact CD2-OH 3.46Å
544	Q	60.3	Low	66.3	Low	131 Å²	131	76.2 Å²	76.2	61%	0.612	38%	0.375	S	S	*	.			trans	-75.3	-4.2	173.4	-76.9	175.4	3.8	0	0	114.1	E540 K541 R546	E540-Q544 WeakPolarHBondContact O-CG 3.03Å; E540-Q544 PolarHBondContact O-N 2.85Å; K541-Q544 PolarHBondContact O-N 3.33Å; Q544-R546 VanDerWaalsContact C-N 3.26Å; Q544-R546 PolarHBondContact O-N 2.74Å
545	E	58.6	Low	66.9	Low	91 Å²	91	77 Å²	77	43%	0.425	38%	0.377	S	S	.	.			trans	-76.9	72.6	174.8	-65	-168.2	-175.3	0	0	111.7	K221 L543 D547	K221-E545 WeakPolarHBondContact CE-OE2 3.43Å; K221-E545 IonicContact NZ-OE2 2.68Å; K221-E545 PolarHBondContact NZ-OE2 2.52Å; L543-E545 PolarHBondContact O-N 2.81Å; E545-D547 VanDerWaalsContact C-N 3.3Å; E545-D547 PolarHBondContact O-N 2.91Å; E545-D547 VanDerWaalsContact O-N 3.16Å
546	R	54.8	Low	67.9	Low	205 Å²	205	75.2 Å²	75.2	77%	0.774	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-18.5	-165.9	-70.8	-178.7	179.8	-172.1	-1.4	117	Q544 Y548	Q544-R546 VanDerWaalsContact C-N 3.26Å; Q544-R546 PolarHBondContact O-N 2.74Å; R546-Y548 VanDerWaalsContact C-N 3.31Å; R546-Y548 PolarHBondContact O-N 3.19Å
547	D	52.3	Low	69.2	Low	139 Å²	139	74 Å²	74	74%	0.743	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-24.2	-174.2	-64.5	-29.7	0	0	0	113.1	E545	E545-D547 VanDerWaalsContact C-N 3.3Å; E545-D547 PolarHBondContact O-N 2.91Å; E545-D547 VanDerWaalsContact O-N 3.16Å
548	Y	49.9	Very low	70.6	Confident	69 Å²	69	68.1 Å²	68.1	27%	0.271	33%	0.332	S	S	.	.	S	Bend	trans	-107	-3.5	-175	-71.9	-90	0	0	0	114.5	T55 D187 K221 R546	T55-Y548 PolarHBondContact OG1-O 2.74Å; D187-Y548 HydrophobicContact CB-CD1 4.03Å; D187-Y548 HydrophobicContact CB-CE1 4.21Å; K221-Y548 HydrophobicContact CD-CD2 3.9Å; K221-Y548 HydrophobicContact CD-CE1 4.35Å; K221-Y548 HydrophobicContact CD-CE2 3.69Å; K221-Y548 HydrophobicContact CD-CG 4.3Å; K221-Y548 VanDerWaalsContact CE-CD2 3.48Å; K221-Y548 HydrophobicContact CG-CD1 4.49Å; K221-Y548 HydrophobicContact CG-CG 4.5Å; R546-Y548 VanDerWaalsContact C-N 3.31Å; R546-Y548 PolarHBondContact O-N 3.19Å
549	I	61.3	Low	72	Confident	25 Å²	25	61 Å²	61	13%	0.128	30%	0.299	C	S	.	.			trans	-113.3	125.2	-175.1	-61.8	169.5	0	0	0	108.1	T55 F189 L543 Y553	T55-I549 HydrophobicContact CG2-CG1 4.18Å; T55-I549 HydrophobicContact CG2-CG2 4.28Å; F189-I549 HydrophobicContact CD1-CD1 4.39Å; F189-I549 HydrophobicContact CD1-CG1 4.06Å; F189-I549 HydrophobicContact CE1-CD1 3.98Å; F189-I549 HydrophobicContact CE1-CG1 4.16Å; F189-I549 HydrophobicContact CZ-CD1 4.36Å; L543-I549 HydrophobicContact CB-CD1 4.29Å; L543-I549 HydrophobicContact CD2-CD1 4.01Å; L543-I549 WeakPolarHBondContact O-CD1 3.23Å; I549-Y553 HydrophobicContact CG2-CD1 3.57Å; I549-Y553 HydrophobicContact CG2-CE1 3.52Å
550	F	63.5	Low	73.4	Confident	27 Å²	27	59.7 Å²	59.7	12%	0.118	29%	0.292	C	S	.	.			trans	-90.6	116.2	173.2	66.7	-84	0	0	0	110.4	K53 F58 H60 Y553	K53-F550 HydrophobicContact CB-CD1 4.27Å; F58-F550 HydrophobicContact CB-CZ 4.49Å; F58-F550 HydrophobicContact CD1-CE1 4.42Å; F58-F550 AromaticContact CD1-CE2 3.84Å; F58-F550 HydrophobicContact CD1-CE2 3.84Å; F58-F550 AromaticContact CD1-CZ 3.32Å; F58-F550 HydrophobicContact CD1-CZ 3.32Å; F58-F550 AromaticContact CE1-CE2 3.92Å; F58-F550 HydrophobicContact CE1-CE2 3.92Å; F58-F550 AromaticContact CE1-CZ 3.82Å; F58-F550 HydrophobicContact CE1-CZ 3.82Å; F58-F550 HydrophobicContact CG-CZ 4.24Å; H60-F550 HydrophobicContact CB-CD1 4.04Å; H60-F550 HydrophobicContact CB-CD2 4.2Å; H60-F550 HydrophobicContact CB-CE1 3.79Å; H60-F550 HydrophobicContact CB-CE2 3.96Å; H60-F550 HydrophobicContact CB-CG 4.21Å; H60-F550 HydrophobicContact CB-CZ 3.69Å; F550-Y553 WeakPolarHBondContact O-CB 3.2Å; F550-Y553 PolarHBondContact O-N 3.06Å
551	G	63.8	Low	74.8	Confident	63 Å²	63	55 Å²	55	65%	0.649	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	38.2	-137.4	165.6	0	0	0	0	0	117.2	Y553	G551-Y553 VanDerWaalsContact C-N 3.28Å; G551-Y553 PolarHBondContact O-N 2.74Å; G551-Y553 VanDerWaalsContact O-N 3.14Å
552	N	78.4	Confident	76.3	Confident	73 Å²	73	48.7 Å²	48.7	39%	0.39	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	54	179.5	-65.2	-9.4	0	0	0	112.2	N266 I554 E555 R556	N266-N552 PolarHBondContact ND2-OD1 2.87Å; N552-I554 VanDerWaalsContact C-N 3.34Å; N552-I554 PolarHBondContact O-N 2.98Å; N552-E555 HydrophobicContact CB-CB 3.95Å; N552-E555 WeakPolarHBondContact CB-OE2 3.35Å; N552-E555 PolarHBondContact ND2-OE2 3.13Å; N552-E555 WeakPolarHBondContact O-CB 3.15Å; N552-E555 PolarHBondContact O-N 3.35Å; N552-R556 PolarHBondContact O-N 2.93Å
553	Y	85.8	Confident	77.9	Confident	3 Å²	3	47.2 Å²	47.2	1%	0.012	23%	0.233	C	C	.	.	H	α-helix	trans	-59.8	-36.4	-173.8	70.9	-82	0	0	0	113.9	T55 L543 I549 F550 G551 R556 L557	T55-Y553 HydrophobicContact CG2-CD1 4.02Å; T55-Y553 HydrophobicContact CG2-CD2 3.83Å; T55-Y553 HydrophobicContact CG2-CE1 3.92Å; T55-Y553 HydrophobicContact CG2-CE2 3.71Å; T55-Y553 HydrophobicContact CG2-CG 3.98Å; L543-Y553 WeakPolarHBondContact CD2-OH 3.46Å; I549-Y553 HydrophobicContact CG2-CD1 3.57Å; I549-Y553 HydrophobicContact CG2-CE1 3.52Å; F550-Y553 WeakPolarHBondContact O-CB 3.2Å; F550-Y553 PolarHBondContact O-N 3.06Å; G551-Y553 VanDerWaalsContact C-N 3.28Å; G551-Y553 PolarHBondContact O-N 2.74Å; G551-Y553 VanDerWaalsContact O-N 3.14Å; Y553-R556 PolarHBondContact O-N 2.83Å; Y553-L557 VanDerWaalsContact O-CB 3.26Å; Y553-L557 WeakPolarHBondContact O-CB 3.44Å; Y553-L557 PolarHBondContact O-N 2.94Å
554	I	89.1	Confident	79.3	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-66.8	-40.6	177.5	-57.9	-166.9	0	0	0	111.3	Q263 V265 V270 N552 R556 L557 W558	Q263-I554 HydrophobicContact CB-CD1 3.97Å; V265-I554 HydrophobicContact CB-CB 4.41Å; V265-I554 HydrophobicContact CB-CD1 3.73Å; V265-I554 HydrophobicContact CB-CG1 4.15Å; V265-I554 HydrophobicContact CG2-CD1 3.41Å; V265-I554 VanDerWaalsContact CG2-CD1 3.41Å; V265-I554 HydrophobicContact CG2-CG1 4.12Å; V270-I554 HydrophobicContact CB-CG2 4.4Å; V270-I554 HydrophobicContact CG1-CD1 4.28Å; V270-I554 HydrophobicContact CG1-CG2 4.31Å; N552-I554 VanDerWaalsContact C-N 3.34Å; N552-I554 PolarHBondContact O-N 2.98Å; I554-R556 VanDerWaalsContact C-N 3.34Å; I554-R556 PolarHBondContact O-N 3.27Å; I554-L557 PolarHBondContact O-N 2.81Å; I554-W558 WeakPolarHBondContact O-CB 3.36Å; I554-W558 PolarHBondContact O-N 2.86Å
555	E	91.8	Very high	80.9	Confident	33 Å²	33	43.4 Å²	43.4	15%	0.154	21%	0.214	C	C	.	.	H	α-helix	trans	-60.8	-45.3	174.4	178.9	-176.9	178	0	0	110.8	Y268 N552 W558 A559 Y592	Y268-E555 HydrophobicContact CD1-CB 4.39Å; Y268-E555 HydrophobicContact CD1-CG 4.36Å; Y268-E555 HydrophobicContact CD2-CB 3.66Å; Y268-E555 HydrophobicContact CD2-CG 3.91Å; Y268-E555 HydrophobicContact CE1-CG 4Å; Y268-E555 HydrophobicContact CE2-CB 3.8Å; Y268-E555 HydrophobicContact CE2-CG 3.51Å; Y268-E555 HydrophobicContact CG-CB 3.98Å; Y268-E555 HydrophobicContact CG-CG 4.33Å; N552-E555 HydrophobicContact CB-CB 3.95Å; N552-E555 WeakPolarHBondContact CB-OE2 3.35Å; N552-E555 PolarHBondContact ND2-OE2 3.13Å; N552-E555 WeakPolarHBondContact O-CB 3.15Å; N552-E555 PolarHBondContact O-N 3.35Å; E555-W558 PolarHBondContact O-N 2.81Å; E555-A559 WeakPolarHBondContact O-CB 3.33Å; E555-A559 PolarHBondContact O-N 2.93Å; E555-Y592 HydrophobicContact CG-CE1 3.69Å; E555-Y592 WeakPolarHBondContact CG-OH 3.46Å; E555-Y592 VanDerWaalsContact OE1-CE1 3.27Å; E555-Y592 WeakPolarHBondContact OE1-CE1 3.27Å; E555-Y592 PolarHBondContact OE1-OH 2.85Å
556	R	93.5	Very high	82.6	Confident	47 Å²	47	39.8 Å²	39.8	18%	0.177	20%	0.198	C	C	.	.	H	α-helix	trans	-67.5	-36.5	178.4	-64.9	-170.8	69.4	71	9.1	112.1	F58 T90 E157 N552 Y553 I554 A559 Y560 Y592 F594	F58-R556 HydrophobicContact CE1-CB 3.67Å; F58-R556 HydrophobicContact CZ-CB 4.14Å; T90-R556 VanDerWaalsContact CG2-NH2 3.29Å; E157-R556 VanDerWaalsContact CD-NE 3.34Å; E157-R556 IonicContact OE1-CZ 3.06Å; E157-R556 IonicContact OE1-NE 3.76Å; E157-R556 PolarHBondContact OE1-NE 2.73Å; E157-R556 VanDerWaalsContact OE1-NE 3.12Å; E157-R556 IonicContact OE1-NH2 3.97Å; E157-R556 IonicContact OE2-CZ 3.76Å; E157-R556 IonicContact OE2-NE 3.23Å; E157-R556 PolarHBondContact OE2-NE 2.89Å; E157-R556 IonicContact OE2-NH2 3.58Å; E157-R556 PolarHBondContact OE2-NH2 2.83Å; N552-R556 PolarHBondContact O-N 2.93Å; Y553-R556 PolarHBondContact O-N 2.83Å; I554-R556 VanDerWaalsContact C-N 3.34Å; I554-R556 PolarHBondContact O-N 3.27Å; R556-A559 PolarHBondContact O-N 2.7Å; R556-Y560 VanDerWaalsContact O-CB 3.29Å; R556-Y560 WeakPolarHBondContact O-CB 3.31Å; R556-Y560 PolarHBondContact O-N 3.33Å; R556-Y592 HydrophobicContact CG-CD1 4.41Å; R556-Y592 PolarHBondContact NH1-O 3.32Å; R556-Y592 VanDerWaalsContact NH1-O 3.15Å; R556-Y592 PolarHBondContact NH2-O 3.17Å; R556-Y592 VanDerWaalsContact NH2-O 3.11Å; R556-F594 VanDerWaalsContact NH2-CE1 3.28Å
557	L	94.4	Very high	84.4	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.4	-48.6	172.7	-176.1	167.4	0	0	0	110.5	F58 L159 V270 F272 A504 Y553 I554 A559 Y560 L561	F58-L557 HydrophobicContact CB-CD1 4.19Å; F58-L557 HydrophobicContact CD1-CB 4.38Å; F58-L557 HydrophobicContact CD2-CB 4.3Å; F58-L557 HydrophobicContact CD2-CG 4.46Å; F58-L557 HydrophobicContact CG-CB 4.17Å; L159-L557 HydrophobicContact CD1-CD1 3.89Å; L159-L557 HydrophobicContact CD1-CG 4.08Å; V270-L557 HydrophobicContact CB-CD1 4.44Å; V270-L557 HydrophobicContact CB-CD2 4.22Å; V270-L557 HydrophobicContact CG1-CD1 4.45Å; V270-L557 HydrophobicContact CG2-CD1 4.08Å; V270-L557 HydrophobicContact CG2-CD2 3.76Å; F272-L557 HydrophobicContact CZ-CD1 4.23Å; A504-L557 HydrophobicContact CB-CD2 4Å; Y553-L557 VanDerWaalsContact O-CB 3.26Å; Y553-L557 WeakPolarHBondContact O-CB 3.44Å; Y553-L557 PolarHBondContact O-N 2.94Å; I554-L557 PolarHBondContact O-N 2.81Å; L557-A559 VanDerWaalsContact C-N 3.31Å; L557-A559 PolarHBondContact O-N 3.45Å; L557-Y560 PolarHBondContact O-N 3.18Å; L557-L561 HydrophobicContact CD2-CD1 3.55Å; L557-L561 HydrophobicContact CD2-CG 4.14Å; L557-L561 PolarHBondContact O-N 2.69Å
558	W	95.5	Very high	86.1	Confident	22 Å²	22	28.6 Å²	28.6	8%	0.083	15%	0.15	C	C	.	.	H	α-helix	trans	-57.1	-46.2	175.1	166.6	78.5	0	0	0	111.2	Y268 A504 H506 I554 E555 L561 T562 L588 Y592	Y268-W558 HydrophobicContact CD1-CB 4.13Å; Y268-W558 AromaticContact CD1-CD2 3.95Å; Y268-W558 HydrophobicContact CD1-CD2 3.95Å; Y268-W558 HydrophobicContact CD1-CE3 4Å; Y268-W558 AromaticContact CD1-CG 4Å; Y268-W558 HydrophobicContact CD1-CG 4Å; Y268-W558 AromaticContact CE1-CD2 3.83Å; Y268-W558 HydrophobicContact CE1-CD2 3.83Å; Y268-W558 AromaticContact CE1-CE3 3.5Å; Y268-W558 HydrophobicContact CE1-CE3 3.5Å; Y268-W558 HydrophobicContact CE1-CG 4.37Å; Y268-W558 AromaticContact CE1-CZ3 3.92Å; Y268-W558 HydrophobicContact CE1-CZ3 3.92Å; A504-W558 HydrophobicContact CB-CB 3.97Å; A504-W558 HydrophobicContact CB-CG 4.4Å; H506-W558 HydrophobicContact CB-CZ2 4.31Å; I554-W558 WeakPolarHBondContact O-CB 3.36Å; I554-W558 PolarHBondContact O-N 2.86Å; E555-W558 PolarHBondContact O-N 2.81Å; W558-L561 PolarHBondContact O-N 2.91Å; W558-T562 PolarHBondContact NE1-OG1 2.92Å; W558-T562 WeakPolarHBondContact O-CB 3.43Å; W558-T562 PolarHBondContact O-N 3.27Å; W558-T562 PolarHBondContact O-OG1 2.98Å; W558-L588 HydrophobicContact CH2-CD2 4Å; W558-L588 HydrophobicContact CZ3-CD2 4.13Å; W558-Y592 HydrophobicContact CZ3-CE2 4.15Å
559	A	95.4	Very high	88	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.6	-45.8	177.6	0	0	0	0	0	111.8	E555 R556 L557 T562 I563 Y592 F594	E555-A559 WeakPolarHBondContact O-CB 3.33Å; E555-A559 PolarHBondContact O-N 2.93Å; R556-A559 PolarHBondContact O-N 2.7Å; L557-A559 VanDerWaalsContact C-N 3.31Å; L557-A559 PolarHBondContact O-N 3.45Å; A559-T562 PolarHBondContact O-N 3.17Å; A559-I563 WeakPolarHBondContact O-CB 3.4Å; A559-I563 WeakPolarHBondContact O-CD1 3.29Å; A559-I563 WeakPolarHBondContact O-CG1 3.47Å; A559-I563 PolarHBondContact O-N 2.98Å; A559-Y592 HydrophobicContact CB-CD1 4.05Å; A559-Y592 HydrophobicContact CB-CD2 3.34Å; A559-Y592 HydrophobicContact CB-CE1 4.15Å; A559-Y592 HydrophobicContact CB-CE2 3.45Å; A559-Y592 VanDerWaalsContact CB-CE2 3.45Å; A559-Y592 HydrophobicContact CB-CG 3.67Å; A559-F594 HydrophobicContact CB-CE2 4.14Å
560	Y	96.1	Very high	89.3	Confident	1 Å²	1	33.1 Å²	33.1	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-56.3	-53.4	176.4	173.6	-84	0	0	0	111.3	F58 T86 F88 L159 R556 L557 T562 I563 E564	F58-Y560 HydrophobicContact CE2-CD2 4.28Å; F58-Y560 HydrophobicContact CE2-CG 4.07Å; T86-Y560 WeakPolarHBondContact O-CE2 3.4Å; T86-Y560 PolarHBondContact O-OH 3.43Å; F88-Y560 AromaticContact CD2-CD2 3.38Å; F88-Y560 HydrophobicContact CD2-CD2 3.38Å; F88-Y560 AromaticContact CD2-CE2 3.61Å; F88-Y560 HydrophobicContact CD2-CE2 3.61Å; F88-Y560 HydrophobicContact CD2-CG 4.41Å; F88-Y560 AromaticContact CE2-CD2 3.6Å; F88-Y560 HydrophobicContact CE2-CD2 3.6Å; F88-Y560 AromaticContact CE2-CE2 3.72Å; F88-Y560 HydrophobicContact CE2-CE2 3.72Å; F88-Y560 HydrophobicContact CE2-CG 4.34Å; F88-Y560 HydrophobicContact CG-CD2 4.35Å; F88-Y560 HydrophobicContact CG-CE2 4.27Å; F88-Y560 HydrophobicContact CZ-CE2 4.5Å; L159-Y560 HydrophobicContact CB-CD1 3.79Å; L159-Y560 HydrophobicContact CB-CE1 3.53Å; R556-Y560 VanDerWaalsContact O-CB 3.29Å; R556-Y560 WeakPolarHBondContact O-CB 3.31Å; R556-Y560 PolarHBondContact O-N 3.33Å; L557-Y560 PolarHBondContact O-N 3.18Å; Y560-T562 PolarHBondContact O-N 2.74Å; Y560-I563 PolarHBondContact O-N 3.06Å; Y560-E564 HydrophobicContact CD1-CG 4.41Å; Y560-E564 HydrophobicContact CE1-CG 3.95Å; Y560-E564 PolarHBondContact O-N 3.07Å
561	L	95.9	Very high	90.3	Very high	17 Å²	17	35.6 Å²	35.6	9%	0.089	18%	0.179	C	C	.	.	H	α-helix	trans	-63.9	-41.1	180	-80.6	-178.8	0	0	0	112.2	L159 T488 V502 A504 L557 W558 E564 Q565	L159-L561 HydrophobicContact CD2-CD1 3.86Å; L159-L561 HydrophobicContact CD2-CD2 3.44Å; L159-L561 VanDerWaalsContact CD2-CD2 3.44Å; L159-L561 HydrophobicContact CD2-CG 3.69Å; T488-L561 HydrophobicContact CG2-CB 3.95Å; V502-L561 HydrophobicContact CB-CD1 4.38Å; V502-L561 HydrophobicContact CG1-CD1 3.8Å; A504-L561 HydrophobicContact CB-CD1 4.07Å; L557-L561 HydrophobicContact CD2-CD1 3.55Å; L557-L561 HydrophobicContact CD2-CG 4.14Å; L557-L561 PolarHBondContact O-N 2.69Å; W558-L561 PolarHBondContact O-N 2.91Å; L561-E564 PolarHBondContact O-N 2.63Å; L561-Q565 WeakPolarHBondContact O-CB 3.21Å; L561-Q565 WeakPolarHBondContact O-CG 3.16Å; L561-Q565 PolarHBondContact O-N 2.66Å
562	T	96.3	Very high	91.1	Very high	22 Å²	22	34.7 Å²	34.7	14%	0.135	16%	0.16	C	C	.	.	H	α-helix	trans	-64.1	-44	178.9	-59.1	0	0	0	0	110.6	W558 A559 Y560 Q565 L566 L588	W558-T562 PolarHBondContact NE1-OG1 2.92Å; W558-T562 WeakPolarHBondContact O-CB 3.43Å; W558-T562 PolarHBondContact O-N 3.27Å; W558-T562 PolarHBondContact O-OG1 2.98Å; A559-T562 PolarHBondContact O-N 3.17Å; Y560-T562 PolarHBondContact O-N 2.74Å; T562-Q565 PolarHBondContact O-N 2.89Å; T562-L566 HydrophobicContact CG2-CD1 3.94Å; T562-L566 HydrophobicContact CG2-CG 4.33Å; T562-L566 WeakPolarHBondContact O-CB 3.32Å; T562-L566 WeakPolarHBondContact O-CG 3.42Å; T562-L566 PolarHBondContact O-N 3.3Å; T562-L588 HydrophobicContact CG2-CD1 3.64Å
563	I	95.8	Very high	91.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.7	-47.6	176.6	-70.7	164.2	0	0	0	111	F88 A559 Y560 Q565 L566 L567 L588 F594 T596	F88-I563 HydrophobicContact CE2-CB 4.5Å; F88-I563 HydrophobicContact CE2-CG2 4.05Å; F88-I563 HydrophobicContact CZ-CG2 4.07Å; A559-I563 WeakPolarHBondContact O-CB 3.4Å; A559-I563 WeakPolarHBondContact O-CD1 3.29Å; A559-I563 WeakPolarHBondContact O-CG1 3.47Å; A559-I563 PolarHBondContact O-N 2.98Å; Y560-I563 PolarHBondContact O-N 3.06Å; I563-Q565 VanDerWaalsContact C-N 3.34Å; I563-Q565 PolarHBondContact O-N 3.08Å; I563-L566 PolarHBondContact O-N 3.25Å; I563-L567 HydrophobicContact CG2-CD1 3.81Å; I563-L567 HydrophobicContact CG2-CG 4.29Å; I563-L567 WeakPolarHBondContact O-CB 3.38Å; I563-L567 VanDerWaalsContact O-CG 3.24Å; I563-L567 WeakPolarHBondContact O-CG 3.29Å; I563-L567 PolarHBondContact O-N 3.34Å; I563-L588 HydrophobicContact CD1-CB 3.89Å; I563-L588 HydrophobicContact CG1-CB 3.71Å; I563-L588 HydrophobicContact CG1-CD1 4.33Å; I563-F594 HydrophobicContact CD1-CD2 3.6Å; I563-F594 HydrophobicContact CD1-CE2 4.29Å; I563-F594 HydrophobicContact CD1-CG 4.49Å; I563-T596 HydrophobicContact CG2-CG2 3.95Å
564	E	93.8	Very high	91.4	Very high	49 Å²	49	38.2 Å²	38.2	23%	0.229	17%	0.174	C	C	.	.	H	α-helix	trans	-54.3	-50.2	176.3	-77.9	-102.8	111.8	0	0	110.9	F88 K161 Y560 L561 L566 L567 E568	F88-E564 HydrophobicContact CE2-CG 4.3Å; F88-E564 HydrophobicContact CZ-CG 4.14Å; K161-E564 IonicContact NZ-OE2 3.36Å; Y560-E564 HydrophobicContact CD1-CG 4.41Å; Y560-E564 HydrophobicContact CE1-CG 3.95Å; Y560-E564 PolarHBondContact O-N 3.07Å; L561-E564 PolarHBondContact O-N 2.63Å; E564-L566 PolarHBondContact O-N 2.74Å; E564-L567 PolarHBondContact O-N 2.77Å; E564-E568 PolarHBondContact O-N 3.26Å
565	Q	93.3	Very high	91.5	Very high	24 Å²	24	40.6 Å²	40.6	11%	0.112	20%	0.199	C	C	.	.	H	α-helix	trans	-67.7	-34.7	-179.1	-70.4	179.5	3.7	0	0	113.3	T488 L561 T562 I563 K569	T488-Q565 VanDerWaalsContact CA-OE1 3.29Å; T488-Q565 VanDerWaalsContact CB-OE1 3.22Å; L561-Q565 WeakPolarHBondContact O-CB 3.21Å; L561-Q565 WeakPolarHBondContact O-CG 3.16Å; L561-Q565 PolarHBondContact O-N 2.66Å; T562-Q565 PolarHBondContact O-N 2.89Å; I563-Q565 VanDerWaalsContact C-N 3.34Å; I563-Q565 PolarHBondContact O-N 3.08Å; Q565-K569 WeakPolarHBondContact O-CB 3.46Å; Q565-K569 VanDerWaalsContact O-CG 3.28Å; Q565-K569 WeakPolarHBondContact O-CG 3.44Å; Q565-K569 PolarHBondContact O-N 3.39Å
566	L	94.4	Very high	91.4	Very high	15 Å²	15	46.9 Å²	46.9	8%	0.079	23%	0.228	C	C	.	.	H	α-helix	trans	-66.6	-41.7	173.8	-73.5	170.6	0	0	0	111.2	T562 I563 E564 E568 R570 L581 Q584 A585 L588	T562-L566 HydrophobicContact CG2-CD1 3.94Å; T562-L566 HydrophobicContact CG2-CG 4.33Å; T562-L566 WeakPolarHBondContact O-CB 3.32Å; T562-L566 WeakPolarHBondContact O-CG 3.42Å; T562-L566 PolarHBondContact O-N 3.3Å; I563-L566 PolarHBondContact O-N 3.25Å; E564-L566 PolarHBondContact O-N 2.74Å; L566-E568 VanDerWaalsContact C-N 3.33Å; L566-R570 WeakPolarHBondContact O-CB 3.46Å; L566-R570 PolarHBondContact O-N 2.7Å; L566-L581 HydrophobicContact CD2-CD2 3.6Å; L566-Q584 HydrophobicContact CD1-CB 4Å; L566-Q584 HydrophobicContact CD2-CB 4.48Å; L566-A585 HydrophobicContact CB-CB 3.97Å; L566-A585 HydrophobicContact CD1-CB 4.26Å; L566-L588 HydrophobicContact CD1-CD1 3.93Å
567	L	91.4	Very high	91.3	Very high	21 Å²	21	50.5 Å²	50.5	11%	0.11	25%	0.247	C	C	.	.	H	α-helix	trans	-65.1	-37.3	177	-70.1	171.7	0	0	0	111.8	I563 E564 A585 P597 L598	I563-L567 HydrophobicContact CG2-CD1 3.81Å; I563-L567 HydrophobicContact CG2-CG 4.29Å; I563-L567 WeakPolarHBondContact O-CB 3.38Å; I563-L567 VanDerWaalsContact O-CG 3.24Å; I563-L567 WeakPolarHBondContact O-CG 3.29Å; I563-L567 PolarHBondContact O-N 3.34Å; E564-L567 PolarHBondContact O-N 2.77Å; L567-A585 HydrophobicContact CD2-CB 4.33Å; L567-P597 HydrophobicContact CD1-CG 4.17Å; L567-L598 HydrophobicContact CD2-CD1 3.96Å; L567-L598 HydrophobicContact CD2-CG 4.05Å
568	E	88.8	Confident	91.1	Very high	88 Å²	88	54.3 Å²	54.3	41%	0.411	26%	0.264	S	S	.	.	H	α-helix	trans	-68.1	-51.1	175.3	-170.7	175.5	178.2	0	0	111.7	L441 E564 L566 R570 K571	L441-E568 HydrophobicContact CD1-CG 4.08Å; L441-E568 HydrophobicContact CD2-CG 4.1Å; L441-E568 WeakPolarHBondContact CD2-OE1 3.02Å; E564-E568 PolarHBondContact O-N 3.26Å; L566-E568 VanDerWaalsContact C-N 3.33Å; E568-R570 PolarHBondContact O-N 3.44Å; E568-K571 WeakPolarHBondContact O-CB 3.11Å; E568-K571 PolarHBondContact O-N 3.03Å
569	K	89.4	Confident	90.9	Very high	117 Å²	117	60 Å²	60	51%	0.509	29%	0.291	S	S	.	.	H	α-helix	trans	-56.6	-37.8	175	-75.1	175.2	179.9	178.6	0	112.1	Q565 K571 N572 A573 L581	Q565-K569 WeakPolarHBondContact O-CB 3.46Å; Q565-K569 VanDerWaalsContact O-CG 3.28Å; Q565-K569 WeakPolarHBondContact O-CG 3.44Å; Q565-K569 PolarHBondContact O-N 3.39Å; K569-K571 PolarHBondContact O-N 2.96Å; K569-N572 PolarHBondContact O-N 3.5Å; K569-A573 PolarHBondContact O-N 3.01Å; K569-L581 HydrophobicContact CB-CD1 4Å; K569-L581 HydrophobicContact CB-CD2 4.4Å
570	R	89.6	Confident	90.8	Very high	73 Å²	73	64.3 Å²	64.3	28%	0.275	31%	0.314	S	S	.	.	H	α-helix	trans	-61.1	-26.3	177.5	176.6	-175.2	174	-111.4	-0.3	113.3	L566 E568 N572 K578 L581 T582	L566-R570 WeakPolarHBondContact O-CB 3.46Å; L566-R570 PolarHBondContact O-N 2.7Å; E568-R570 PolarHBondContact O-N 3.44Å; R570-N572 VanDerWaalsContact C-N 3.33Å; R570-N572 PolarHBondContact O-N 3.3Å; R570-K578 HydrophobicContact CG-CG 4.02Å; R570-L581 HydrophobicContact CB-CB 4.24Å; R570-T582 VanDerWaalsContact CD-OG1 3.32Å; R570-T582 WeakPolarHBondContact CD-OG1 3.43Å; R570-T582 PolarHBondContact NE-OG1 2.64Å
571	K	84.3	Confident	90.7	Very high	79 Å²	79	65.1 Å²	65.1	34%	0.343	32%	0.319	S	S	.	.	H	α-helix	trans	-63.1	-40.2	-179.7	-65.9	-173.1	178.9	-170.7	0	111.9	E437 L441 E568 K569	E437-K571 IonicContact OE1-NZ 3.34Å; E437-K571 PolarHBondContact OE1-NZ 2.82Å; E437-K571 IonicContact OE2-NZ 2.69Å; E437-K571 PolarHBondContact OE2-NZ 3.3Å; L441-K571 HydrophobicContact CD1-CD 4.26Å; E568-K571 WeakPolarHBondContact O-CB 3.11Å; E568-K571 PolarHBondContact O-N 3.03Å; K569-K571 PolarHBondContact O-N 2.96Å
572	N	81.1	Confident	90.5	Very high	44 Å²	44	66 Å²	66	24%	0.235	33%	0.325	C	S	.	.	H	α-helix	trans	-98.1	-5	-177.5	-64.2	-19.8	0	0	0	114	N438 L441 K569 R570 H574	N438-N572 WeakPolarHBondContact CB-OD1 3.39Å; N438-N572 PolarHBondContact OD1-OD1 3.21Å; L441-N572 WeakPolarHBondContact CB-ND2 3.16Å; K569-N572 PolarHBondContact O-N 3.5Å; R570-N572 VanDerWaalsContact C-N 3.33Å; R570-N572 PolarHBondContact O-N 3.3Å; N572-H574 PolarHBondContact O-CD2 3.26Å
573	A	85.9	Confident	90.4	Very high	4 Å²	4	67.6 Å²	67.6	3%	0.033	34%	0.34	C	S	.	.			trans	-80.8	151.8	178.3	0	0	0	0	0	112.3	K569 E577 K578 L581	K569-A573 PolarHBondContact O-N 3.01Å; A573-E577 HydrophobicContact CB-CB 4.4Å; A573-E577 HydrophobicContact CB-CG 4.04Å; A573-K578 HydrophobicContact CB-CB 3.99Å; A573-K578 HydrophobicContact CB-CG 4.46Å; A573-K578 WeakPolarHBondContact O-CD 3.11Å; A573-L581 HydrophobicContact CB-CD1 3.63Å
574	H	84.8	Confident	90.3	Very high	145 Å²	145	71.7 Å²	71.7	67%	0.671	36%	0.36	S	S	*	.			trans	-131.9	156.6	178.5	-59.2	-79.2	0	0	0	111.7	N572 E576 E577	N572-H574 PolarHBondContact O-CD2 3.26Å; H574-E576 PolarHBondContact O-N 2.87Å; H574-E577 PolarHBondContact O-N 2.85Å
575	G	90.3	Very high	90.3	Very high	51 Å²	51	69.4 Å²	69.4	53%	0.526	35%	0.349	S	S	.	.	H	α-helix	trans	56.7	-135.9	176.1	0	0	0	0	0	113.8	E577 K578 E579	G575-E577 VanDerWaalsContact C-N 3.3Å; G575-E577 PolarHBondContact O-N 2.79Å; G575-K578 WeakPolarHBondContact O-CB 3.48Å; G575-K578 PolarHBondContact O-N 2.99Å; G575-K578 VanDerWaalsContact O-N 3.16Å; G575-E579 PolarHBondContact O-N 2.78Å
576	E	89.8	Confident	90.3	Very high	166 Å²	166	69.7 Å²	69.7	78%	0.776	35%	0.351	S	S	*	.	H	α-helix	trans	-60	-35.6	-176.3	-172.4	177.5	-176.7	0	0	113.1	H574 K578 E579 N580	H574-E576 PolarHBondContact O-N 2.87Å; E576-K578 VanDerWaalsContact C-N 3.34Å; E576-K578 PolarHBondContact O-N 2.97Å; E576-E579 PolarHBondContact O-N 2.59Å; E576-N580 WeakPolarHBondContact O-CB 3.23Å; E576-N580 PolarHBondContact O-N 3.38Å
577	E	91	Very high	90.4	Very high	122 Å²	122	74.1 Å²	74.1	57%	0.57	38%	0.375	S	S	*	.	H	α-helix	trans	-61.6	-44.5	176.8	-174.8	-176.6	-178.4	0	0	111	A573 H574 G575 E579 N580 L581	A573-E577 HydrophobicContact CB-CB 4.4Å; A573-E577 HydrophobicContact CB-CG 4.04Å; H574-E577 PolarHBondContact O-N 2.85Å; G575-E577 VanDerWaalsContact C-N 3.3Å; G575-E577 PolarHBondContact O-N 2.79Å; E577-E579 VanDerWaalsContact C-N 3.33Å; E577-E579 PolarHBondContact O-N 2.86Å; E577-N580 PolarHBondContact O-N 2.91Å; E577-L581 HydrophobicContact CG-CD1 4.09Å; E577-L581 WeakPolarHBondContact O-CB 3.37Å; E577-L581 VanDerWaalsContact O-CG 3.28Å; E577-L581 WeakPolarHBondContact O-CG 3.42Å; E577-L581 PolarHBondContact O-N 3.1Å
578	K	90.8	Very high	90.6	Very high	80 Å²	80	74 Å²	74	35%	0.348	37%	0.374	S	S	.	.	H	α-helix	trans	-63.3	-41.1	177.6	-168.5	179.6	-167.7	153	0	111.6	R570 A573 G575 E576 T582	R570-K578 HydrophobicContact CG-CG 4.02Å; A573-K578 HydrophobicContact CB-CB 3.99Å; A573-K578 HydrophobicContact CB-CG 4.46Å; A573-K578 WeakPolarHBondContact O-CD 3.11Å; G575-K578 WeakPolarHBondContact O-CB 3.48Å; G575-K578 PolarHBondContact O-N 2.99Å; G575-K578 VanDerWaalsContact O-N 3.16Å; E576-K578 VanDerWaalsContact C-N 3.34Å; E576-K578 PolarHBondContact O-N 2.97Å; K578-T582 VanDerWaalsContact O-CB 3.32Å; K578-T582 WeakPolarHBondContact O-CB 3.26Å; K578-T582 PolarHBondContact O-N 3.41Å; K578-T582 PolarHBondContact O-OG1 2.64Å
579	E	91.2	Very high	90.8	Very high	141 Å²	141	69.9 Å²	69.9	66%	0.659	36%	0.355	S	S	*	.	H	α-helix	trans	-63.9	-45	177.7	-69.4	178.6	-178.8	0	0	111.2	G575 E576 E577 T582 A583	G575-E579 PolarHBondContact O-N 2.78Å; E576-E579 PolarHBondContact O-N 2.59Å; E577-E579 VanDerWaalsContact C-N 3.33Å; E577-E579 PolarHBondContact O-N 2.86Å; E579-T582 WeakPolarHBondContact O-CB 3.27Å; E579-T582 PolarHBondContact O-N 2.65Å; E579-A583 PolarHBondContact O-N 3.02Å
580	N	93.5	Very high	90.9	Very high	91 Å²	91	67.2 Å²	67.2	49%	0.487	35%	0.346	S	S	.	.	H	α-helix	trans	-63.4	-47.6	177.5	-171.5	3.6	0	0	0	112	E576 E577 T582 A583 Q584	E576-N580 WeakPolarHBondContact O-CB 3.23Å; E576-N580 PolarHBondContact O-N 3.38Å; E577-N580 PolarHBondContact O-N 2.91Å; N580-T582 VanDerWaalsContact C-N 3.27Å; N580-T582 PolarHBondContact O-N 2.85Å; N580-A583 PolarHBondContact O-N 2.68Å; N580-Q584 WeakPolarHBondContact O-CG 3.29Å; N580-Q584 PolarHBondContact O-N 3.3Å; N580-Q584 PolarHBondContact OD1-NE2 3.35Å
581	L	93.5	Very high	91.1	Very high	18 Å²	18	69 Å²	69	9%	0.094	36%	0.355	C	S	.	.	H	α-helix	trans	-59.7	-39.3	175.3	-69.7	170.7	0	0	0	111.7	L566 K569 R570 A573 E577 A585	L566-L581 HydrophobicContact CD2-CD2 3.6Å; K569-L581 HydrophobicContact CB-CD1 4Å; K569-L581 HydrophobicContact CB-CD2 4.4Å; R570-L581 HydrophobicContact CB-CB 4.24Å; A573-L581 HydrophobicContact CB-CD1 3.63Å; E577-L581 HydrophobicContact CG-CD1 4.09Å; E577-L581 WeakPolarHBondContact O-CB 3.37Å; E577-L581 VanDerWaalsContact O-CG 3.28Å; E577-L581 WeakPolarHBondContact O-CG 3.42Å; E577-L581 PolarHBondContact O-N 3.1Å; L581-A585 WeakPolarHBondContact O-CB 2.86Å; L581-A585 PolarHBondContact O-N 3.45Å
582	T	92.1	Very high	91.5	Very high	35 Å²	35	65.6 Å²	65.6	22%	0.215	34%	0.341	C	S	.	.	H	α-helix	trans	-63.6	-44.8	176.1	-56.9	0	0	0	0	111.2	R570 K578 E579 N580 L586 L598	R570-T582 VanDerWaalsContact CD-OG1 3.32Å; R570-T582 WeakPolarHBondContact CD-OG1 3.43Å; R570-T582 PolarHBondContact NE-OG1 2.64Å; K578-T582 VanDerWaalsContact O-CB 3.32Å; K578-T582 WeakPolarHBondContact O-CB 3.26Å; K578-T582 PolarHBondContact O-N 3.41Å; K578-T582 PolarHBondContact O-OG1 2.64Å; E579-T582 WeakPolarHBondContact O-CB 3.27Å; E579-T582 PolarHBondContact O-N 2.65Å; N580-T582 VanDerWaalsContact C-N 3.27Å; N580-T582 PolarHBondContact O-N 2.85Å; T582-L586 VanDerWaalsContact O-CB 3.25Å; T582-L586 WeakPolarHBondContact O-CB 3.48Å; T582-L586 PolarHBondContact O-N 2.04Å; T582-L598 HydrophobicContact CG2-CD1 4.09Å; T582-L598 HydrophobicContact CG2-CD2 3.94Å; T582-L598 WeakPolarHBondContact O-CD1 3.37Å
583	A	93.3	Very high	92	Very high	56 Å²	56	68.4 Å²	68.4	46%	0.463	35%	0.352	S	S	.	.	H	α-helix	trans	-64.4	-44.8	179.4	0	0	0	0	0	112.3	E579 N580 L586 D587	E579-A583 PolarHBondContact O-N 3.02Å; N580-A583 PolarHBondContact O-N 2.68Å; A583-L586 PolarHBondContact O-N 3.28Å; A583-D587 WeakPolarHBondContact O-CB 3.1Å; A583-D587 PolarHBondContact O-N 2.87Å
584	Q	94.3	Very high	92.3	Very high	87 Å²	87	68.2 Å²	68.2	41%	0.407	35%	0.351	S	S	.	.	H	α-helix	trans	-62.9	-46	177.2	-70.1	178.6	44.9	0	0	112.1	L566 N580 L586 D587 L588	L566-Q584 HydrophobicContact CD1-CB 4Å; L566-Q584 HydrophobicContact CD2-CB 4.48Å; N580-Q584 WeakPolarHBondContact O-CG 3.29Å; N580-Q584 PolarHBondContact O-N 3.3Å; N580-Q584 PolarHBondContact OD1-NE2 3.35Å; Q584-L586 VanDerWaalsContact C-N 3.33Å; Q584-L586 PolarHBondContact O-N 3.37Å; Q584-D587 PolarHBondContact O-N 3.26Å; Q584-L588 PolarHBondContact O-N 2.87Å; Q584-L588 VanDerWaalsContact O-N 3.1Å
585	A	94.6	Very high	92.5	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.2	-40.7	177.6	0	0	0	0	0	111.6	L566 L567 L581 S589 L598	L566-A585 HydrophobicContact CB-CB 3.97Å; L566-A585 HydrophobicContact CD1-CB 4.26Å; L567-A585 HydrophobicContact CD2-CB 4.33Å; L581-A585 WeakPolarHBondContact O-CB 2.86Å; L581-A585 PolarHBondContact O-N 3.45Å; A585-S589 VanDerWaalsContact O-CB 3.25Å; A585-S589 WeakPolarHBondContact O-CB 3.34Å; A585-S589 PolarHBondContact O-N 3.03Å; A585-S589 PolarHBondContact O-OG 3.21Å; A585-L598 HydrophobicContact CB-CD1 3.61Å
586	L	92.9	Very high	92.4	Very high	31 Å²	31	59 Å²	59	16%	0.162	30%	0.295	C	S	.	.	H	α-helix	trans	-63.5	-47.4	176.2	177.3	60.5	0	0	0	111.9	E107 T582 A583 Q584 S589 L590 L598 T599	E107-L586 HydrophobicContact CB-CD1 4.3Å; E107-L586 HydrophobicContact CG-CD1 4.11Å; E107-L586 HydrophobicContact CG-CD2 4.06Å; T582-L586 VanDerWaalsContact O-CB 3.25Å; T582-L586 WeakPolarHBondContact O-CB 3.48Å; T582-L586 PolarHBondContact O-N 2.04Å; A583-L586 PolarHBondContact O-N 3.28Å; Q584-L586 VanDerWaalsContact C-N 3.33Å; Q584-L586 PolarHBondContact O-N 3.37Å; L586-S589 WeakPolarHBondContact O-CB 3.1Å; L586-S589 PolarHBondContact O-N 2.64Å; L586-L590 HydrophobicContact CD1-CD1 3.93Å; L586-L590 HydrophobicContact CD1-CG 4.05Å; L586-L590 HydrophobicContact CG-CD1 4.05Å; L586-L590 WeakPolarHBondContact O-CG 2.75Å; L586-L590 PolarHBondContact O-N 3.23Å; L586-L598 HydrophobicContact CB-CD1 4.24Å; L586-L598 HydrophobicContact CD1-CB 4.22Å; L586-T599 HydrophobicContact CD1-CG2 3.59Å
587	D	95.6	Very high	92.2	Very high	107 Å²	107	53 Å²	53	57%	0.572	27%	0.27	S	S	*	.	H	α-helix	trans	-59.5	-48.9	-180	-177.2	68.9	0	0	0	111.7	A583 Q584 S589 L590 K591	A583-D587 WeakPolarHBondContact O-CB 3.1Å; A583-D587 PolarHBondContact O-N 2.87Å; Q584-D587 PolarHBondContact O-N 3.26Å; D587-S589 VanDerWaalsContact C-N 3.34Å; D587-S589 PolarHBondContact O-N 2.71Å; D587-L590 PolarHBondContact O-N 3.2Å; D587-K591 WeakPolarHBondContact O-CB 3.39Å; D587-K591 PolarHBondContact O-N 2.79Å
588	L	94.8	Very high	91.8	Very high	20 Å²	20	48.1 Å²	48.1	11%	0.105	25%	0.247	C	C	.	.	H	α-helix	trans	-62.2	-41.8	175.3	-71.8	174.1	0	0	0	111.8	W558 T562 I563 L566 Q584 L590 K591 Y592	W558-L588 HydrophobicContact CH2-CD2 4Å; W558-L588 HydrophobicContact CZ3-CD2 4.13Å; T562-L588 HydrophobicContact CG2-CD1 3.64Å; I563-L588 HydrophobicContact CD1-CB 3.89Å; I563-L588 HydrophobicContact CG1-CB 3.71Å; I563-L588 HydrophobicContact CG1-CD1 4.33Å; L566-L588 HydrophobicContact CD1-CD1 3.93Å; Q584-L588 PolarHBondContact O-N 2.87Å; Q584-L588 VanDerWaalsContact O-N 3.1Å; L588-L590 VanDerWaalsContact C-N 3.32Å; L588-L590 PolarHBondContact O-N 3.19Å; L588-K591 PolarHBondContact O-N 3.09Å; L588-Y592 HydrophobicContact CD2-CD2 4.4Å; L588-Y592 HydrophobicContact CD2-CE2 3.97Å; L588-Y592 WeakPolarHBondContact O-CD2 3.31Å; L588-Y592 PolarHBondContact O-N 3.47Å
589	S	93.9	Very high	91.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.9	-42.1	178.7	-60.6	0	0	0	0	111.7	A585 L586 D587 H593 F594 T596	A585-S589 VanDerWaalsContact O-CB 3.25Å; A585-S589 WeakPolarHBondContact O-CB 3.34Å; A585-S589 PolarHBondContact O-N 3.03Å; A585-S589 PolarHBondContact O-OG 3.21Å; L586-S589 WeakPolarHBondContact O-CB 3.1Å; L586-S589 PolarHBondContact O-N 2.64Å; D587-S589 VanDerWaalsContact C-N 3.34Å; D587-S589 PolarHBondContact O-N 2.71Å; S589-H593 CarbonylContact O-C 3.54Å; S589-H593 WeakPolarHBondContact O-CA 3.25Å; S589-H593 PolarHBondContact O-N 3.36Å; S589-F594 PolarHBondContact O-N 3.31Å; S589-T596 VanDerWaalsContact OG-CG2 3.23Å; S589-T596 WeakPolarHBondContact OG-CG2 3.35Å; S589-T596 PolarHBondContact OG-OG1 2.83Å
590	L	91.5	Very high	90.9	Very high	62 Å²	62	37.6 Å²	37.6	33%	0.325	20%	0.199	S	C	.	.	H	α-helix	trans	-70	-45	176.6	-67.8	172.8	0	0	0	111.7	V105 L586 D587 L588 Y592 H593 T599	V105-L590 HydrophobicContact CG1-CD2 4.43Å; L586-L590 HydrophobicContact CD1-CD1 3.93Å; L586-L590 HydrophobicContact CD1-CG 4.05Å; L586-L590 HydrophobicContact CG-CD1 4.05Å; L586-L590 WeakPolarHBondContact O-CG 2.75Å; L586-L590 PolarHBondContact O-N 3.23Å; D587-L590 PolarHBondContact O-N 3.2Å; L588-L590 VanDerWaalsContact C-N 3.32Å; L588-L590 PolarHBondContact O-N 3.19Å; L590-Y592 VanDerWaalsContact C-N 3.34Å; L590-Y592 PolarHBondContact O-N 2.91Å; L590-H593 PolarHBondContact O-N 3.02Å; L590-T599 HydrophobicContact CD2-CG2 3.81Å; L590-T599 HydrophobicContact CG-CG2 4.09Å
591	K	94.5	Very high	90.1	Very high	109 Å²	109	33.3 Å²	33.3	47%	0.474	18%	0.177	S	C	.	.	H	α-helix	trans	-56.6	-46	178.8	-177.1	-175.9	176.5	-158.8	0	112	D587 L588 H593	D587-K591 WeakPolarHBondContact O-CB 3.39Å; D587-K591 PolarHBondContact O-N 2.79Å; L588-K591 PolarHBondContact O-N 3.09Å; K591-H593 PolarHBondContact O-ND1 2.84Å
592	Y	92.1	Very high	88.9	Confident	9 Å²	9	32.5 Å²	32.5	4%	0.035	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	2.6	-177.4	-68.4	-77.2	0	0	0	114.2	E555 R556 W558 A559 L588 L590 F594	E555-Y592 HydrophobicContact CG-CE1 3.69Å; E555-Y592 WeakPolarHBondContact CG-OH 3.46Å; E555-Y592 VanDerWaalsContact OE1-CE1 3.27Å; E555-Y592 WeakPolarHBondContact OE1-CE1 3.27Å; E555-Y592 PolarHBondContact OE1-OH 2.85Å; R556-Y592 HydrophobicContact CG-CD1 4.41Å; R556-Y592 PolarHBondContact NH1-O 3.32Å; R556-Y592 VanDerWaalsContact NH1-O 3.15Å; R556-Y592 PolarHBondContact NH2-O 3.17Å; R556-Y592 VanDerWaalsContact NH2-O 3.11Å; W558-Y592 HydrophobicContact CZ3-CE2 4.15Å; A559-Y592 HydrophobicContact CB-CD1 4.05Å; A559-Y592 HydrophobicContact CB-CD2 3.34Å; A559-Y592 HydrophobicContact CB-CE1 4.15Å; A559-Y592 HydrophobicContact CB-CE2 3.45Å; A559-Y592 VanDerWaalsContact CB-CE2 3.45Å; A559-Y592 HydrophobicContact CB-CG 3.67Å; L588-Y592 HydrophobicContact CD2-CD2 4.4Å; L588-Y592 HydrophobicContact CD2-CE2 3.97Å; L588-Y592 WeakPolarHBondContact O-CD2 3.31Å; L588-Y592 PolarHBondContact O-N 3.47Å; L590-Y592 VanDerWaalsContact C-N 3.34Å; L590-Y592 PolarHBondContact O-N 2.91Å; Y592-F594 VanDerWaalsContact C-N 3.27Å; Y592-F594 HydrophobicContact CG-CE2 4.27Å; Y592-F594 PolarHBondContact O-N 3.13Å
593	H	91.3	Very high	87.8	Confident	103 Å²	103	31.4 Å²	31.4	48%	0.477	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	35.5	-179.1	-55.2	74	0	0	0	113.1	T90 V105 S589 L590 K591	T90-H593 VanDerWaalsContact CA-O 3.31Å; T90-H593 WeakPolarHBondContact CA-O 3.47Å; V105-H593 HydrophobicContact CB-CB 4.47Å; V105-H593 HydrophobicContact CG2-CB 4.1Å; V105-H593 WeakPolarHBondContact CG2-O 3.21Å; S589-H593 CarbonylContact O-C 3.54Å; S589-H593 WeakPolarHBondContact O-CA 3.25Å; S589-H593 PolarHBondContact O-N 3.36Å; L590-H593 PolarHBondContact O-N 3.02Å; K591-H593 PolarHBondContact O-ND1 2.84Å
594	F	92.3	Very high	86.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.			trans	-82.8	130.8	174.6	-71	-55.4	0	0	0	110.7	F88 T90 E157 R556 A559 I563 S589 Y592 T596 T599	F88-F594 HydrophobicContact CB-CB 4.06Å; F88-F594 HydrophobicContact CB-CD1 3.43Å; F88-F594 VanDerWaalsContact CB-CD1 3.43Å; F88-F594 HydrophobicContact CB-CE1 4.16Å; F88-F594 HydrophobicContact CB-CG 4.04Å; F88-F594 HydrophobicContact CD2-CB 4.14Å; F88-F594 AromaticContact CD2-CD1 3.92Å; F88-F594 HydrophobicContact CD2-CD1 3.92Å; F88-F594 HydrophobicContact CD2-CD2 4.43Å; F88-F594 HydrophobicContact CD2-CE1 4.4Å; F88-F594 AromaticContact CD2-CG 3.93Å; F88-F594 HydrophobicContact CD2-CG 3.93Å; F88-F594 HydrophobicContact CG-CB 4.22Å; F88-F594 HydrophobicContact CG-CD1 4.11Å; F88-F594 HydrophobicContact CG-CG 4.32Å; T90-F594 HydrophobicContact CG2-CD1 3.44Å; T90-F594 VanDerWaalsContact CG2-CD1 3.44Å; T90-F594 HydrophobicContact CG2-CE1 3.4Å; T90-F594 VanDerWaalsContact CG2-CE1 3.4Å; E157-F594 HydrophobicContact CB-CE1 4.36Å; E157-F594 VanDerWaalsContact OE2-CE1 3.31Å; E157-F594 WeakPolarHBondContact OE2-CE1 3.26Å; R556-F594 VanDerWaalsContact NH2-CE1 3.28Å; A559-F594 HydrophobicContact CB-CE2 4.14Å; I563-F594 HydrophobicContact CD1-CD2 3.6Å; I563-F594 HydrophobicContact CD1-CE2 4.29Å; I563-F594 HydrophobicContact CD1-CG 4.49Å; S589-F594 PolarHBondContact O-N 3.31Å; Y592-F594 VanDerWaalsContact C-N 3.27Å; Y592-F594 HydrophobicContact CG-CE2 4.27Å; Y592-F594 PolarHBondContact O-N 3.13Å; F594-T596 HydrophobicContact CB-CG2 3.79Å; F594-T596 PolarHBondContact O-N 2.85Å; F594-T599 PolarHBondContact O-OG1 2.97Å
595	V	89.2	Confident	84.1	Confident	3 Å²	3	31 Å²	31	2%	0.018	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-80.4	110.8	165.6	-179.3	0	0	0	0	108.4	F88 I89 V105 T599 M601 K618	F88-V595 VanDerWaalsContact CD1-O 3.29Å; F88-V595 WeakPolarHBondContact CD1-O 3.49Å; I89-V595 HydrophobicContact CB-CB 4Å; I89-V595 HydrophobicContact CB-CG2 3.94Å; I89-V595 HydrophobicContact CG2-CG2 4.22Å; I89-V595 WeakPolarHBondContact O-CG2 3.4Å; I89-V595 PolarHBondContact O-N 2.95Å; V105-V595 HydrophobicContact CG2-CG2 4.1Å; V595-T599 WeakPolarHBondContact CA-OG1 3.2Å; V595-M601 HydrophobicContact CG2-CB 3.73Å; V595-M601 HydrophobicContact CG2-CE 4.01Å; V595-K618 HydrophobicContact CG1-CB 4.4Å
596	T	88.1	Confident	81.6	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.			trans	-126.8	178.7	-174.4	74.7	0	0	0	0	109.4	F88 I563 S589 F594 L598 T599 K618	F88-T596 HydrophobicContact CD1-CG2 4.15Å; F88-T596 HydrophobicContact CE1-CG2 4.01Å; F88-T596 HydrophobicContact CE2-CG2 4.47Å; F88-T596 HydrophobicContact CG-CG2 4.45Å; F88-T596 HydrophobicContact CZ-CG2 4.22Å; I563-T596 HydrophobicContact CG2-CG2 3.95Å; S589-T596 VanDerWaalsContact OG-CG2 3.23Å; S589-T596 WeakPolarHBondContact OG-CG2 3.35Å; S589-T596 PolarHBondContact OG-OG1 2.83Å; F594-T596 HydrophobicContact CB-CG2 3.79Å; F594-T596 PolarHBondContact O-N 2.85Å; T596-L598 PolarHBondContact O-N 2.8Å; T596-L598 PolarHBondContact OG1-N 3.36Å; T596-T599 PolarHBondContact N-OG1 3.14Å; T596-T599 PolarHBondContact O-N 2.84Å; T596-T599 VanDerWaalsContact O-N 3.12Å; T596-T599 PolarHBondContact OG1-OG1 2.72Å; T596-T599 VanDerWaalsContact OG1-OG1 3.14Å; T596-K618 VanDerWaalsContact C-CB 3.41Å; T596-K618 WeakPolarHBondContact O-CB 3.34Å
597	P	85.1	Confident	79	Confident	40 Å²	40	42.1 Å²	42.1	26%	0.26	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-13.5	175.8	-24.7	37.6	0	0	0	114.2	K108 L567 K618	K108-P597 WeakPolarHBondContact CD-O 3.44Å; K108-P597 PolarHBondContact NZ-O 3.49Å; L567-P597 HydrophobicContact CD1-CG 4.17Å; P597-K618 HydrophobicContact CG-CD 4.41Å; P597-K618 HydrophobicContact CG-CG 4.47Å
598	L	83.9	Confident	76	Confident	18 Å²	18	43.4 Å²	43.4	9%	0.094	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-11.8	-180	-55.9	179	0	0	0	113.9	K108 L567 T582 A585 L586 T596	K108-L598 WeakPolarHBondContact CB-O 3.21Å; K108-L598 PolarHBondContact N-O 2.77Å; L567-L598 HydrophobicContact CD2-CD1 3.96Å; L567-L598 HydrophobicContact CD2-CG 4.05Å; T582-L598 HydrophobicContact CG2-CD1 4.09Å; T582-L598 HydrophobicContact CG2-CD2 3.94Å; T582-L598 WeakPolarHBondContact O-CD1 3.37Å; A585-L598 HydrophobicContact CB-CD1 3.61Å; L586-L598 HydrophobicContact CB-CD1 4.24Å; L586-L598 HydrophobicContact CD1-CB 4.22Å; T596-L598 PolarHBondContact O-N 2.8Å; T596-L598 PolarHBondContact OG1-N 3.36Å
599	T	83	Confident	73.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	158.9	-174.6	51.7	0	0	0	0	112	V105 K106 L586 L590 F594 V595 T596	V105-T599 HydrophobicContact CG1-CG2 4.27Å; K106-T599 CarbonylContact O-C 3.45Å; K106-T599 VanDerWaalsContact O-CA 3.24Å; K106-T599 WeakPolarHBondContact O-CA 3.28Å; K106-T599 WeakPolarHBondContact O-CB 3.25Å; L586-T599 HydrophobicContact CD1-CG2 3.59Å; L590-T599 HydrophobicContact CD2-CG2 3.81Å; L590-T599 HydrophobicContact CG-CG2 4.09Å; F594-T599 PolarHBondContact O-OG1 2.97Å; V595-T599 WeakPolarHBondContact CA-OG1 3.2Å; T596-T599 PolarHBondContact N-OG1 3.14Å; T596-T599 PolarHBondContact O-N 2.84Å; T596-T599 VanDerWaalsContact O-N 3.12Å; T596-T599 PolarHBondContact OG1-OG1 2.72Å; T596-T599 VanDerWaalsContact OG1-OG1 3.14Å
600	S	78.9	Confident	70.6	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	140.8	-175.9	-65.5	0	0	0	0	109.7	V105 K106 K108 A616 D617	V105-S600 CarbonylContact C-O 3.54Å; V105-S600 WeakPolarHBondContact CA-O 3.36Å; K106-S600 PolarHBondContact N-O 2.92Å; K106-S600 PolarHBondContact O-N 3.43Å; K108-S600 WeakPolarHBondContact CA-OG 3.3Å; S600-A616 CarbonylContact C-O 3.57Å; S600-A616 WeakPolarHBondContact CA-O 3.31Å; S600-D617 WeakPolarHBondContact CB-OD1 3.48Å; S600-D617 PolarHBondContact OG-OD1 3.06Å
601	M	77.6	Confident	68.2	Low	2 Å²	2	57.1 Å²	57.1	1%	0.01	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	138.2	177.9	-177	176.7	-71.2	0	0	111.3	I89 F92 N104 V105 V595 I615 A616	I89-M601 HydrophobicContact CG2-CE 3.85Å; I89-M601 HydrophobicContact CG2-SD 4.27Å; F92-M601 HydrophobicContact CB-SD 3.48Å; F92-M601 WeakPolarHBondContact CB-SD 3.32Å; N104-M601 CarbonylContact O-C 3.6Å; N104-M601 WeakPolarHBondContact O-CA 3.1Å; V105-M601 HydrophobicContact CG2-CB 4.23Å; V105-M601 HydrophobicContact CG2-CE 3.58Å; V105-M601 HydrophobicContact CG2-CG 4.37Å; V595-M601 HydrophobicContact CG2-CB 3.73Å; V595-M601 HydrophobicContact CG2-CE 4.01Å; M601-I615 CarbonylContact O-C 3.57Å; M601-I615 WeakPolarHBondContact O-CA 3.42Å; M601-A616 HydrophobicContact CB-CB 4.24Å; M601-A616 PolarHBondContact N-O 3.44Å; M601-A616 PolarHBondContact O-N 3.43Å
602	V	67.8	Low	65.8	Low	1 Å²	1	54.1 Å²	54.1	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	124.9	-178.2	-172.2	0	0	0	0	111.7	G103 N104 K106 A111 R613 A614 I615	G103-V602 WeakPolarHBondContact CA-O 3.27Å; N104-V602 PolarHBondContact N-O 3.05Å; N104-V602 PolarHBondContact O-N 2.89Å; K106-V602 HydrophobicContact CD-CG2 4.32Å; A111-V602 HydrophobicContact CB-CG2 3.64Å; V602-R613 HydrophobicContact CG1-CB 3.76Å; V602-R613 HydrophobicContact CG1-CG 3.73Å; V602-A614 CarbonylContact C-O 3.55Å; V602-A614 WeakPolarHBondContact CA-O 3.4Å; V602-I615 HydrophobicContact CB-CD1 4.39Å; V602-I615 HydrophobicContact CB-CG1 4.26Å; V602-I615 HydrophobicContact CG1-CD1 4Å; V602-I615 HydrophobicContact CG1-CG1 3.92Å; V602-I615 HydrophobicContact CG2-CD1 3.64Å; V602-I615 HydrophobicContact CG2-CG1 3.84Å; V602-I615 HydrophobicContact CG2-CG2 4.47Å
603	V	69.1	Low	63.7	Low	12 Å²	12	56.1 Å²	56.1	7%	0.073	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.9	178.8	-172.5	0	0	0	0	110.1	F92 L94 R613 A614	F92-V603 HydrophobicContact CD1-CG2 3.42Å; F92-V603 VanDerWaalsContact CD1-CG2 3.42Å; F92-V603 HydrophobicContact CE1-CG2 3.77Å; L94-V603 HydrophobicContact CB-CG1 4.3Å; V603-R613 CarbonylContact O-C 3.59Å; V603-R613 VanDerWaalsContact O-CA 3.24Å; V603-R613 WeakPolarHBondContact O-CA 3.25Å; V603-A614 HydrophobicContact CB-CB 4.2Å; V603-A614 PolarHBondContact N-O 2.95Å; V603-A614 PolarHBondContact O-N 3.15Å
604	T	56.8	Low	61.4	Low	44 Å²	44	51.7 Å²	51.7	27%	0.27	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	132.3	-177.9	47.4	0	0	0	0	113	Y101 E612 R613	Y101-T604 WeakPolarHBondContact CD1-O 3.41Å; T604-E612 VanDerWaalsContact CA-O 3.25Å; T604-E612 WeakPolarHBondContact CA-O 3.39Å; T604-E612 WeakPolarHBondContact CG2-O 3.5Å; T604-R613 HydrophobicContact CG2-CG 3.46Å; T604-R613 VanDerWaalsContact CG2-CG 3.46Å
605	K	53.6	Low	58.9	Low	91 Å²	91	52.1 Å²	52.1	40%	0.396	27%	0.27	S	S	.	.			trans	-100.5	128.6	168.1	176.2	175.8	177.6	-149.7	0	110.1	Y101 E612	Y101-K605 HydrophobicContact CD1-CB 4.15Å; Y101-K605 HydrophobicContact CD1-CG 4.35Å; Y101-K605 HydrophobicContact CE1-CB 4.04Å; Y101-K605 HydrophobicContact CE1-CG 3.72Å; Y101-K605 HydrophobicContact CE2-CD 4.34Å; Y101-K605 HydrophobicContact CE2-CG 4.21Å; Y101-K605 HydrophobicContact CG-CB 4.46Å; K605-E612 HydrophobicContact CB-CB 4.36Å; K605-E612 VanDerWaalsContact CB-OE2 3.25Å; K605-E612 WeakPolarHBondContact CB-OE2 3.36Å; K605-E612 WeakPolarHBondContact CD-OE2 3.43Å; K605-E612 VanDerWaalsContact CG-OE2 3.27Å; K605-E612 WeakPolarHBondContact CG-OE2 3.5Å
606	P	41.6	Very low	56.5	Low	105 Å²	105	52.1 Å²	52.1	68%	0.682	27%	0.27	S	S	*	.			trans	-88.5	-4.1	-164.7	-14.4	31.1	0	0	0	120.2	Y101	Y101-P606 HydrophobicContact CD1-CG 4.47Å; Y101-P606 HydrophobicContact CE1-CG 4.3Å
607	E	38.4	Very low	54.4	Low	158 Å²	158	54.1 Å²	54.1	74%	0.738	28%	0.281	S	S	*	.			trans	-136.9	111.8	-179.3	-61.7	-175.6	174.8	0	0	107.8
608	D	33	Very low	52.3	Low	134 Å²	134	53.1 Å²	53.1	72%	0.717	27%	0.273	S	S	*	.	S	Bend	cis	-122.6	146.6	45.7	-70.2	-54.5	0	0	0	114.6
609	N	33.6	Very low	50.5	Low	163 Å²	163	54 Å²	54	87%	0.872	28%	0.279	S	S	*	.	S	Bend	trans	11.9	103.5	173.5	-87.7	-14.9	0	0	0	118.1
610	E	41.4	Very low	48.5	Very low	167 Å²	167	55.9 Å²	55.9	78%	0.78	30%	0.299	S	S	*	.	S	Bend	trans	48.3	111.6	169.3	-66.4	-168	170.3	0	0	118.3
611	D	41.2	Very low	46.8	Very low	40 Å²	40	61 Å²	61	21%	0.214	32%	0.323	C	S	.	.			trans	77.4	82.7	162.2	-65.8	-38.8	0	0	0	118.3	K117 Q121 K123 R613	K117-D611 WeakPolarHBondContact CE-OD2 3.25Å; K117-D611 IonicContact NZ-OD2 2.89Å; K117-D611 PolarHBondContact NZ-OD2 2.97Å; Q121-D611 PolarHBondContact OE1-O 3.47Å; K123-D611 WeakPolarHBondContact CD-O 3.47Å; K123-D611 PolarHBondContact NZ-O 3.3Å; D611-R613 IonicContact OD1-CZ 3.85Å; D611-R613 IonicContact OD1-NE 3.9Å; D611-R613 IonicContact OD1-NH1 2.98Å; D611-R613 PolarHBondContact OD1-NH1 2.78Å; D611-R613 IonicContact OD1-NH2 3.16Å; D611-R613 PolarHBondContact OD1-NH2 3.16Å
612	E	44.2	Very low	45	Very low	47 Å²	47	63.8 Å²	63.8	22%	0.22	34%	0.338	C	S	.	.			trans	-109.1	122.8	160.5	-47.5	-166.3	147.9	0	0	110	K123 T604 K605	K123-E612 HydrophobicContact CD-CB 4.34Å; K123-E612 HydrophobicContact CD-CG 4.12Å; T604-E612 VanDerWaalsContact CA-O 3.25Å; T604-E612 WeakPolarHBondContact CA-O 3.39Å; T604-E612 WeakPolarHBondContact CG2-O 3.5Å; K605-E612 HydrophobicContact CB-CB 4.36Å; K605-E612 VanDerWaalsContact CB-OE2 3.25Å; K605-E612 WeakPolarHBondContact CB-OE2 3.36Å; K605-E612 WeakPolarHBondContact CD-OE2 3.43Å; K605-E612 VanDerWaalsContact CG-OE2 3.27Å; K605-E612 WeakPolarHBondContact CG-OE2 3.5Å
613	R	47.7	Very low	43.1	Very low	51 Å²	51	68.2 Å²	68.2	19%	0.192	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	134.6	-173.2	-74	177.6	-172.1	146.7	11	114.8	Q114 A118 V602 V603 T604 D611	Q114-R613 VanDerWaalsContact CD-NH1 3.33Å; A118-R613 HydrophobicContact CB-CB 4.13Å; A118-R613 VanDerWaalsContact CB-O 3.29Å; A118-R613 WeakPolarHBondContact CB-O 3.28Å; V602-R613 HydrophobicContact CG1-CB 3.76Å; V602-R613 HydrophobicContact CG1-CG 3.73Å; V603-R613 CarbonylContact O-C 3.59Å; V603-R613 VanDerWaalsContact O-CA 3.24Å; V603-R613 WeakPolarHBondContact O-CA 3.25Å; T604-R613 HydrophobicContact CG2-CG 3.46Å; T604-R613 VanDerWaalsContact CG2-CG 3.46Å; D611-R613 IonicContact OD1-CZ 3.85Å; D611-R613 IonicContact OD1-NE 3.9Å; D611-R613 IonicContact OD1-NH1 2.98Å; D611-R613 PolarHBondContact OD1-NH1 2.78Å; D611-R613 IonicContact OD1-NH2 3.16Å; D611-R613 PolarHBondContact OD1-NH2 3.16Å
614	A	42.6	Very low	41.2	Very low	10 Å²	10	76.8 Å²	76.8	8%	0.083	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	140.6	170.4	0	0	0	0	0	111.9	V602 V603	V602-A614 CarbonylContact C-O 3.55Å; V602-A614 WeakPolarHBondContact CA-O 3.4Å; V603-A614 HydrophobicContact CB-CB 4.2Å; V603-A614 PolarHBondContact N-O 2.95Å; V603-A614 PolarHBondContact O-N 3.15Å
615	I	40.5	Very low	39.7	Very low	8 Å²	8	78 Å²	78	4%	0.041	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143.7	-167.6	-57.2	-159.6	0	0	0	114	A111 Q114 Y115 G126 L127 M601 V602 D617	A111-I615 HydrophobicContact CB-CD1 4.12Å; A111-I615 HydrophobicContact CB-CG2 4.16Å; A111-I615 WeakPolarHBondContact O-CD1 3.13Å; Q114-I615 HydrophobicContact CB-CD1 4.1Å; Y115-I615 HydrophobicContact CD2-CB 3.84Å; Y115-I615 HydrophobicContact CD2-CD1 4.48Å; Y115-I615 HydrophobicContact CD2-CG1 4.08Å; Y115-I615 HydrophobicContact CG-CB 4.42Å; Y115-I615 HydrophobicContact CG-CD1 4.42Å; Y115-I615 HydrophobicContact CG-CG1 4.49Å; Y115-I615 VanDerWaalsContact N-CD1 3.29Å; G126-I615 CarbonylContact C-O 3.59Å; L127-I615 PolarHBondContact N-O 3.03Å; M601-I615 CarbonylContact O-C 3.57Å; M601-I615 WeakPolarHBondContact O-CA 3.42Å; V602-I615 HydrophobicContact CB-CD1 4.39Å; V602-I615 HydrophobicContact CB-CG1 4.26Å; V602-I615 HydrophobicContact CG1-CD1 4Å; V602-I615 HydrophobicContact CG1-CG1 3.92Å; V602-I615 HydrophobicContact CG2-CD1 3.64Å; V602-I615 HydrophobicContact CG2-CG1 3.84Å; V602-I615 HydrophobicContact CG2-CG2 4.47Å; I615-D617 WeakPolarHBondContact CG2-OD1 2.96Å
616	A	38.1	Very low	38.4	Very low	4 Å²	4	80.2 Å²	80.2	3%	0.033	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	125.2	175.2	0	0	0	0	0	110.9	V128 F138 S600 M601	V128-A616 HydrophobicContact CG2-CB 3.55Å; F138-A616 HydrophobicContact CD2-CB 4.14Å; F138-A616 HydrophobicContact CE2-CB 3.47Å; F138-A616 VanDerWaalsContact CE2-CB 3.47Å; F138-A616 HydrophobicContact CZ-CB 4.4Å; S600-A616 CarbonylContact C-O 3.57Å; S600-A616 WeakPolarHBondContact CA-O 3.31Å; M601-A616 HydrophobicContact CB-CB 4.24Å; M601-A616 PolarHBondContact N-O 3.44Å; M601-A616 PolarHBondContact O-N 3.43Å
617	D	44.6	Very low	37.5	Very low	42 Å²	42	81.1 Å²	81.1	23%	0.225	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	149.9	-174.8	-73.5	9.9	0	0	0	110.8	V128 S600 I615 P619	V128-D617 WeakPolarHBondContact CB-O 3.34Å; V128-D617 VanDerWaalsContact CG1-O 3.3Å; V128-D617 WeakPolarHBondContact CG1-O 3.28Å; S600-D617 WeakPolarHBondContact CB-OD1 3.48Å; S600-D617 PolarHBondContact OG-OD1 3.06Å; I615-D617 WeakPolarHBondContact CG2-OD1 2.96Å; D617-P619 WeakPolarHBondContact O-CD 3.48Å
618	K	40.3	Very low	36.9	Very low	18 Å²	18	80.4 Å²	80.4	8%	0.078	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-78.3	121.2	162.2	-167.6	157.6	-177.7	156.5	0	109.4	K85 A87 F88 K108 V595 T596 P597	K85-K618 WeakPolarHBondContact O-CE 3.34Å; K85-K618 PolarHBondContact O-NZ 3.49Å; A87-K618 PolarHBondContact O-NZ 3.16Å; A87-K618 VanDerWaalsContact O-NZ 3.13Å; F88-K618 HydrophobicContact CD1-CD 3.89Å; F88-K618 VanDerWaalsContact CD1-NZ 3.34Å; F88-K618 HydrophobicContact CE1-CD 3.79Å; K108-K618 PolarHBondContact NZ-O 2.82Å; V595-K618 HydrophobicContact CG1-CB 4.4Å; T596-K618 VanDerWaalsContact C-CB 3.41Å; T596-K618 WeakPolarHBondContact O-CB 3.34Å; P597-K618 HydrophobicContact CG-CD 4.41Å; P597-K618 HydrophobicContact CG-CG 4.47Å
619	P	45.9	Very low	36.5	Very low	37 Å²	37	79.2 Å²	79.2	24%	0.24	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-65.1	136.9	174.3	24.9	-29.8	0	0	0	110.2	E136 D617	E136-P619 HydrophobicContact CG-CG 4.08Å; E136-P619 WeakPolarHBondContact OE2-CD 3.28Å; D617-P619 WeakPolarHBondContact O-CD 3.48Å
620	G	41.4	Very low	36.2	Very low	40 Å²	40	77.7 Å²	77.7	41%	0.412	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-82.7	155.5	165.9	0	0	0	0	0	109.8	D622	G620-D622 PolarHBondContact O-N 2.64Å; G620-D622 VanDerWaalsContact O-N 3.13Å
621	E	44	Very low	35.5	Very low	106 Å²	106	74.7 Å²	74.7	50%	0.495	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-15.3	177.6	-72.9	-162.2	135.2	0	0	113.5
622	D	39.6	Very low	34.7	Very low	61 Å²	61	81.6 Å²	81.6	33%	0.326	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.2	54.2	179	-53.2	-89.5	0	0	0	115	N434 G620 E624	N434-D622 PolarHBondContact ND2-OD2 3.07Å; N434-D622 PolarHBondContact OD1-OD2 2.92Å; G620-D622 PolarHBondContact O-N 2.64Å; G620-D622 VanDerWaalsContact O-N 3.13Å; D622-E624 PolarHBondContact O-N 2.81Å
623	A	27.6	Very low	33.9	Very low	95 Å²	95	84.2 Å²	84.2	79%	0.785	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	5.6	161.6	0	0	0	0	0	113.8
624	E	29.7	Very low	32.8	Very low	191 Å²	191	93 Å²	93	89%	0.893	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137	51.3	178.7	-68.2	-169	157.8	0	0	113.9	D622	D622-E624 PolarHBondContact O-N 2.81Å
625	A	24.8	Very low	32.1	Very low	71 Å²	71	100.5 Å²	100.5	59%	0.587	60%	0.597	S	S	*	*			trans	-159	106	162.1	0	0	0	0	0	113.1
626	T	25.9	Very low	31.3	Very low	136 Å²	136	106.9 Å²	106.9	83%	0.834	64%	0.636	S	S	*	*			trans	-98.5	127.8	162.2	44.8	0	0	0	0	110.2
627	P	24	Very low	30.9	Very low	124 Å²	124	112 Å²	112	81%	0.805	67%	0.671	S	S	*	*			trans	-85.8	141.1	178.1	23.8	-15	0	0	0	111.9
628	V	24.8	Very low	30	Very low	144 Å²	144	121 Å²	121	87%	0.873	70%	0.704	S	S	*	*			trans	-107.7	114.5	170.3	-173.5	0	0	0	0	108.1
629	S	24.2	Very low	29.2	Very low	109 Å²	109	128.4 Å²	128.4	76%	0.762	74%	0.739	S	S	*	*			trans	-80.5	144.7	172.5	-59.3	0	0	0	0	111.5
630	P	28.5	Very low	28.9	Very low	130 Å²	130	131.6 Å²	131.6	84%	0.844	76%	0.759	S	S	*	*			trans	-94.4	137.2	-179.2	34.9	-29.4	0	0	0	111.7
631	A	25.1	Very low	28.4	Very low	105 Å²	105	135.6 Å²	135.6	87%	0.868	78%	0.778	S	S	*	*			trans	-113.4	125.2	164.8	0	0	0	0	0	110.3
632	M	25.8	Very low	28.3	Very low	184 Å²	184	139.1 Å²	139.1	91%	0.906	80%	0.795	S	S	*	*			trans	-63.5	152.4	179.6	-82.6	-172.7	-171.8	0	0	114
633	S	26	Very low	27.7	Very low	102 Å²	102	143.6 Å²	143.6	71%	0.713	82%	0.819	S	S	*	*			trans	-52.8	141.9	169	49.8	0	0	0	0	116.5
634	Y	25.9	Very low	28	Very low	235 Å²	235	142.3 Å²	142.3	92%	0.922	80%	0.803	S	S	*	*			trans	-126	132.3	143.8	-79.8	-80.3	0	0	0	110.4
635	L	28	Very low	28	Very low	169 Å²	169	144.1 Å²	144.1	89%	0.885	80%	0.803	S	S	*	*			trans	-71	134.2	175.7	-77.6	145.5	0	0	0	111
636	T	23.8	Very low	28.4	Very low	142 Å²	142	145.3 Å²	145.3	87%	0.871	79%	0.793	S	S	*	*			trans	-163.3	133.9	130.8	26.2	0	0	0	0	112.4
637	S	29.5	Very low	28.5	Very low	111 Å²	111	149.1 Å²	149.1	78%	0.776	79%	0.793	S	S	*	*			trans	-37	131.1	176.6	52.2	0	0	0	0	119.2
638	Y	24.3	Very low	29	Very low	231 Å²	231	144.3 Å²	144.3	91%	0.906	76%	0.761	S	S	*	*			trans	-160.7	136.9	134.7	-144	-100.9	0	0	0	110.8
639	Q	25.5	Very low	29.3	Very low	173 Å²	173	142.7 Å²	142.7	81%	0.808	75%	0.748	S	S	*	*			trans	-115.8	161.5	175.1	-116.2	-165.7	-17.9	0	0	109.4
640	P	38.6	Very low	30.2	Very low	104 Å²	104	138.6 Å²	138.6	68%	0.675	72%	0.723	S	S	*	*				-109.8	-173.3	-112.3	39.1	-27.7	0	0	0	113.8
641	P	30.7	Very low	31	Very low	125 Å²	125	135 Å²	135	81%	0.812	70%	0.696	S	S	*	*				-137	137.4	116.7	26.9	-8.9	0	0	0	115.8
642	Q	41.6	Very low	32.4	Very low	180 Å²	180	130.8 Å²	130.8	84%	0.841	66%	0.66	S	S	*	*			trans	28.1	110.9	150.5	-56.2	-155.9	-13.9	0	0	120.2
643	N	27.3	Very low	34.2	Very low	154 Å²	154	123.2 Å²	123.2	82%	0.824	62%	0.623	S	S	*	*			trans	-165.1	163.1	144.2	-108.5	-8.6	0	0	0	112.6
644	P	33.7	Very low	36.8	Very low	69 Å²	69	118.7 Å²	118.7	45%	0.448	59%	0.59	S	S	.	*			trans	-74.3	140.9	-147.6	29.2	-34.7	0	0	0	114	Y646	P644-Y646 HydrophobicContact CG-CE2 4Å; P644-Y646 PolarHBondContact O-N 2.97Å
645	Y	29.6	Very low	39.6	Very low	229 Å²	229	109.6 Å²	109.6	90%	0.898	56%	0.557	S	S	*	*			trans	-76.4	117.8	-177.7	-63.3	-86.9	0	0	0	111.6
646	Y	34.8	Very low	42.3	Very low	95 Å²	95	102.1 Å²	102.1	37%	0.373	52%	0.518	S	S	.	.			trans	-106.2	98.9	167.1	-62.3	-80	0	0	0	109.8	P644 H871	P644-Y646 HydrophobicContact CG-CE2 4Å; P644-Y646 PolarHBondContact O-N 2.97Å; Y646-H871 AromaticContact CD1-CE1 3.61Å; Y646-H871 AromaticContact CD1-ND1 3.65Å; Y646-H871 AromaticContact CD1-NE2 3.97Å; Y646-H871 HydrophobicContact CE1-CB 4.41Å; Y646-H871 AromaticContact CE1-CG 3.93Å
647	Y	28	Very low	45	Very low	217 Å²	217	100 Å²	100	85%	0.851	50%	0.498	S	S	*	.			trans	-92.7	107.1	168.3	-137.4	-92.6	0	0	0	107.5	D649	Y647-D649 HydrophobicContact CD1-CB 4.2Å; Y647-D649 HydrophobicContact CE1-CB 4.35Å
648	V	34.4	Very low	47.2	Very low	22 Å²	22	95.2 Å²	95.2	13%	0.133	46%	0.464	C	S	.	.			trans	-106.9	96.1	173.8	-166.9	0	0	0	0	108.1	K833 F869	V648-K833 PolarHBondContact O-NZ 3.38Å; V648-F869 HydrophobicContact CG1-CD2 4.07Å; V648-F869 HydrophobicContact CG1-CE2 4.21Å; V648-F869 HydrophobicContact CG1-CG 4.23Å; V648-F869 HydrophobicContact CG1-CZ 4.49Å
649	D	30.9	Very low	49.1	Very low	111 Å²	111	89.1 Å²	89.1	59%	0.594	45%	0.453	S	S	*	.			trans	-141	102	174.1	-160.6	28.1	0	0	0	109.9	Y647 K707	Y647-D649 HydrophobicContact CD1-CB 4.2Å; Y647-D649 HydrophobicContact CE1-CB 4.35Å; D649-K707 WeakPolarHBondContact O-CE 3.45Å; D649-K707 PolarHBondContact O-NZ 2.74Å
650	G	42.7	Very low	51	Low	23 Å²	23	90.3 Å²	90.3	24%	0.237	46%	0.459	C	S	.	.	S	Bend	trans	154.9	140.9	-178.7	0	0	0	0	0	112	Q852	G650-Q852 PolarHBondContact O-OE1 2.83Å
651	D	45.8	Very low	52.6	Low	53 Å²	53	89 Å²	89	28%	0.283	44%	0.442	S	S	.	.			trans	-57.4	133.1	173.5	-73.8	-26.3	0	0	0	109.3
652	P	54.2	Low	54.4	Low	17 Å²	17	91.3 Å²	91.3	11%	0.11	45%	0.448	C	S	.	.			trans	-74.4	149.8	-173.2	32.2	-39.2	0	0	0	110.2	F654 I655 C666 N668 Q852 F869	P652-F654 PolarHBondContact O-N 3.01Å; P652-I655 HydrophobicContact CG-CD1 3.89Å; P652-I655 HydrophobicContact CG-CG1 3.49Å; P652-I655 VanDerWaalsContact CG-CG1 3.49Å; P652-C666 HydrophobicContact CB-CB 4Å; P652-C666 HydrophobicContact CG-CB 4.07Å; P652-N668 WeakPolarHBondContact CA-OD1 3.47Å; P652-Q852 HydrophobicContact CG-CB 3.83Å; P652-Q852 HydrophobicContact CG-CG 3.7Å; P652-F869 HydrophobicContact CB-CE2 4.31Å
653	H	63.5	Low	56.1	Low	26 Å²	26	84.8 Å²	84.8	12%	0.12	42%	0.419	C	S	.	.	S	Bend	trans	-63.9	-30.9	174.2	-68.5	-170.8	0	0	0	111.7	F667 N668 I669 T708	H653-F667 PolarHBondContact N-O 2.78Å; H653-N668 PolarHBondContact N-OD1 2.88Å; H653-I669 PolarHBondContact CE1-O 3.29Å; H653-I669 PolarHBondContact ND1-N 3.03Å; H653-I669 VanDerWaalsContact ND1-N 3.16Å; H653-I669 PolarHBondContact ND1-O 2.65Å; H653-T708 PolarHBondContact CE1-OG1 2.78Å; H653-T708 PolarHBondContact NE2-O 2.89Å; H653-T708 PolarHBondContact NE2-OG1 3.08Å
654	F	80.6	Confident	58.9	Low	7 Å²	7	77.7 Å²	77.7	3%	0.031	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	130.4	-175.2	-56.4	-71	0	0	0	111.2	P652 I656 C666 F667 I669 L679 F710 L810 L811	P652-F654 PolarHBondContact O-N 3.01Å; F654-I656 HydrophobicContact CB-CD1 4.45Å; F654-C666 WeakPolarHBondContact O-CA 3.44Å; F654-C666 WeakPolarHBondContact O-CB 3.46Å; F654-F667 HydrophobicContact CB-CD1 3.92Å; F654-F667 HydrophobicContact CB-CE1 3.55Å; F654-F667 HydrophobicContact CB-CE2 4.32Å; F654-F667 HydrophobicContact CB-CG 4.44Å; F654-F667 HydrophobicContact CB-CZ 3.77Å; F654-F667 AromaticContact CD2-CD2 3.88Å; F654-F667 HydrophobicContact CD2-CD2 3.88Å; F654-F667 HydrophobicContact CD2-CE1 4.18Å; F654-F667 AromaticContact CD2-CE2 3.36Å; F654-F667 HydrophobicContact CD2-CE2 3.36Å; F654-F667 HydrophobicContact CD2-CG 4.47Å; F654-F667 AromaticContact CD2-CZ 3.53Å; F654-F667 HydrophobicContact CD2-CZ 3.53Å; F654-F667 AromaticContact CE2-CE2 3.96Å; F654-F667 HydrophobicContact CE2-CE2 3.96Å; F654-F667 HydrophobicContact CE2-CZ 4.31Å; F654-F667 HydrophobicContact CG-CE1 4.07Å; F654-F667 HydrophobicContact CG-CE2 4.06Å; F654-F667 AromaticContact CG-CZ 3.73Å; F654-F667 HydrophobicContact CG-CZ 3.73Å; F654-F667 PolarHBondContact N-O 3.47Å; F654-F667 VanDerWaalsContact N-O 3.12Å; F654-F667 PolarHBondContact O-N 3.41Å; F654-F667 VanDerWaalsContact O-N 3.16Å; F654-I669 HydrophobicContact CD2-CG1 4.32Å; F654-I669 HydrophobicContact CE2-CB 4.4Å; F654-I669 HydrophobicContact CE2-CG1 3.68Å; F654-L679 HydrophobicContact CE1-CD2 3.93Å; F654-L679 HydrophobicContact CZ-CD2 3.82Å; F654-F710 HydrophobicContact CE1-CE2 4.21Å; F654-F710 HydrophobicContact CE1-CZ 4.24Å; F654-F710 HydrophobicContact CZ-CE2 4.11Å; F654-F710 AromaticContact CZ-CZ 3.82Å; F654-F710 HydrophobicContact CZ-CZ 3.82Å; F654-L810 HydrophobicContact CE2-CD1 4.45Å; F654-L810 HydrophobicContact CZ-CB 4.4Å; F654-L810 HydrophobicContact CZ-CD1 4.13Å; F654-L811 HydrophobicContact CB-CD2 4.37Å; F654-L811 HydrophobicContact CD1-CD1 4.01Å; F654-L811 HydrophobicContact CD1-CD2 3.39Å; F654-L811 HydrophobicContact CD1-CG 3.7Å; F654-L811 HydrophobicContact CE1-CD1 3.96Å; F654-L811 HydrophobicContact CE1-CD2 4Å; F654-L811 HydrophobicContact CE1-CG 3.75Å; F654-L811 HydrophobicContact CG-CD2 4.19Å
655	I	84.2	Confident	61.6	Low	43 Å²	43	74.4 Å²	74.4	22%	0.221	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	112.9	169.5	-56.1	176.6	0	0	0	106.6	P652 A664 Q852 V865	P652-I655 HydrophobicContact CG-CD1 3.89Å; P652-I655 HydrophobicContact CG-CG1 3.49Å; P652-I655 VanDerWaalsContact CG-CG1 3.49Å; I655-A664 HydrophobicContact CG2-CB 4.13Å; I655-Q852 HydrophobicContact CD1-CB 4.02Å; I655-V865 HydrophobicContact CG2-CG1 4.09Å
656	I	85.4	Confident	64.4	Low	13 Å²	13	63.5 Å²	63.5	7%	0.067	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	113.1	-178.9	-49.2	-57.4	0	0	0	108.2	F654 A664 L665 F667 L811 F814 F818	F654-I656 HydrophobicContact CB-CD1 4.45Å; I656-A664 WeakPolarHBondContact O-CA 3.42Å; I656-L665 HydrophobicContact CB-CB 4.45Å; I656-L665 PolarHBondContact N-O 2.98Å; I656-L665 PolarHBondContact O-N 2.67Å; I656-F667 HydrophobicContact CD1-CE1 4.45Å; I656-F667 HydrophobicContact CG1-CE1 4.1Å; I656-L811 HydrophobicContact CD1-CD2 3.49Å; I656-L811 VanDerWaalsContact CD1-CD2 3.49Å; I656-F814 HydrophobicContact CD1-CD2 3.83Å; I656-F814 HydrophobicContact CD1-CE2 4.37Å; I656-F814 HydrophobicContact CD1-CG 4.42Å; I656-F814 HydrophobicContact CG1-CD2 4.1Å; I656-F814 HydrophobicContact CG1-CE2 4.37Å; I656-F814 HydrophobicContact CG1-CG 4.49Å; I656-F814 HydrophobicContact CG2-CB 3.88Å; I656-F814 HydrophobicContact CG2-CD1 4.41Å; I656-F814 HydrophobicContact CG2-CD2 4.43Å; I656-F814 HydrophobicContact CG2-CG 4Å; I656-F818 HydrophobicContact CG2-CE1 4Å; I656-F818 HydrophobicContact CG2-CZ 3.95Å
657	Q	80.3	Confident	67	Low	97 Å²	97	59 Å²	59	45%	0.453	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-91.6	127	170.8	-72.3	-176.7	-17.8	0	0	109.1	A664	Q657-A664 HydrophobicContact CG-CB 4.28Å
658	V	74.9	Confident	69.7	Low	11 Å²	11	49.9 Å²	49.9	7%	0.067	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-100.8	123.9	177.4	-176	0	0	0	0	107.7	K661 F818 F820	V658-K661 HydrophobicContact CB-CB 4.3Å; V658-K661 HydrophobicContact CB-CG 4.15Å; V658-K661 HydrophobicContact CG1-CG 4.04Å; V658-K661 PolarHBondContact O-N 2.75Å; V658-F818 VanDerWaalsContact CG1-O 3.24Å; V658-F818 WeakPolarHBondContact CG1-O 3.43Å; V658-F818 HydrophobicContact CG2-CD1 4.46Å; V658-F818 HydrophobicContact CG2-CE1 3.58Å; V658-F818 HydrophobicContact CG2-CE2 3.94Å; V658-F818 HydrophobicContact CG2-CZ 3.27Å; V658-F820 HydrophobicContact CB-CD1 4.45Å; V658-F820 HydrophobicContact CB-CE1 3.9Å; V658-F820 HydrophobicContact CG1-CE1 4.43Å; V658-F820 HydrophobicContact CG2-CD1 3.95Å; V658-F820 HydrophobicContact CG2-CE1 3.58Å
659	P	64.6	Low	72	Confident	102 Å²	102	48.8 Å²	48.8	66%	0.662	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	141.9	173.6	-25.3	34.4	0	0	0	110.8	K661	P659-K661 VanDerWaalsContact C-N 3.27Å; P659-K661 PolarHBondContact O-N 2.87Å
660	E	65	Low	74.2	Confident	199 Å²	199	46.6 Å²	46.6	93%	0.93	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.8	10.7	178.5	-47.3	173.4	-177.8	0	0	115.9
661	K	72.7	Confident	76.2	Confident	77 Å²	77	47.4 Å²	47.4	34%	0.335	25%	0.245	S	C	.	.			trans	-119.9	136.2	173.6	-60.9	-70.6	175.3	157.6	0	111.2	V658 P659 D663 D819 F820	V658-K661 HydrophobicContact CB-CB 4.3Å; V658-K661 HydrophobicContact CB-CG 4.15Å; V658-K661 HydrophobicContact CG1-CG 4.04Å; V658-K661 PolarHBondContact O-N 2.75Å; P659-K661 VanDerWaalsContact C-N 3.27Å; P659-K661 PolarHBondContact O-N 2.87Å; K661-D663 PolarHBondContact O-N 3.31Å; K661-D819 WeakPolarHBondContact CE-OD1 3.47Å; K661-D819 IonicContact NZ-OD1 3.51Å; K661-D819 PolarHBondContact NZ-OD1 2.74Å; K661-F820 HydrophobicContact CB-CE1 4.28Å; K661-F820 HydrophobicContact CB-CZ 4.24Å; K661-F820 HydrophobicContact CG-CE1 4.04Å; K661-F820 HydrophobicContact CG-CZ 4.28Å; K661-F820 PolarHBondContact NZ-O 2.81Å
662	D	68.6	Low	78	Confident	173 Å²	173	47.2 Å²	47.2	93%	0.925	25%	0.251	S	S	*	.	S	Bend	trans	-72	-19.1	176.8	-63.1	-41.4	0	0	0	113
663	D	76.8	Confident	79.5	Confident	43 Å²	43	49.2 Å²	49.2	23%	0.23	26%	0.264	C	S	.	.	S	Bend	trans	-110.7	137.9	-175.2	-72.3	-28.7	0	0	0	112.3	K661 F820 R849 W868	K661-D663 PolarHBondContact O-N 3.31Å; D663-F820 HydrophobicContact CB-CZ 4.43Å; D663-F820 WeakPolarHBondContact O-CZ 3.47Å; D663-R849 IonicContact OD1-CZ 2.58Å; D663-R849 IonicContact OD1-NH1 2.7Å; D663-R849 PolarHBondContact OD1-NH1 2.57Å; D663-R849 IonicContact OD1-NH2 3.37Å; D663-R849 PolarHBondContact OD1-NH2 2.73Å; D663-R849 IonicContact OD2-CZ 3.46Å; D663-R849 IonicContact OD2-NH1 2.62Å; D663-R849 PolarHBondContact OD2-NH1 3.2Å; D663-W868 PolarHBondContact OD2-NE1 3.17Å
664	A	87.3	Confident	80.5	Confident	5 Å²	5	49.8 Å²	49.8	4%	0.041	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	159.1	171.4	0	0	0	0	0	112	I655 I656 Q657 V865 C867 W868	I655-A664 HydrophobicContact CG2-CB 4.13Å; I656-A664 WeakPolarHBondContact O-CA 3.42Å; Q657-A664 HydrophobicContact CG-CB 4.28Å; A664-V865 HydrophobicContact CB-CG1 3.83Å; A664-C867 HydrophobicContact CB-CB 3.93Å; A664-C867 CarbonylContact O-C 3.56Å; A664-C867 WeakPolarHBondContact O-CA 3.41Å; A664-C867 VanDerWaalsContact O-CB 3.31Å; A664-C867 WeakPolarHBondContact O-CB 3.43Å; A664-W868 PolarHBondContact O-N 2.9Å
665	L	89.4	Confident	81	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	141.6	168.4	-59.6	-178.7	0	0	0	109.7	I656 F818 F820 L838 W868 L877	I656-L665 HydrophobicContact CB-CB 4.45Å; I656-L665 PolarHBondContact N-O 2.98Å; I656-L665 PolarHBondContact O-N 2.67Å; L665-F818 HydrophobicContact CD1-CE2 3.97Å; L665-F818 HydrophobicContact CD1-CZ 4.22Å; L665-F820 HydrophobicContact CD1-CD1 3.87Å; L665-F820 HydrophobicContact CD1-CE1 4.13Å; L665-F820 HydrophobicContact CD1-CG 4.21Å; L665-F820 HydrophobicContact CD2-CD1 4.5Å; L665-F820 HydrophobicContact CD2-CD2 4.26Å; L665-F820 HydrophobicContact CD2-CE1 4.26Å; L665-F820 HydrophobicContact CD2-CE2 4.01Å; L665-F820 HydrophobicContact CD2-CG 4.49Å; L665-F820 HydrophobicContact CD2-CZ 4.01Å; L665-F820 HydrophobicContact CG-CD1 4.22Å; L665-F820 HydrophobicContact CG-CE1 3.97Å; L665-F820 HydrophobicContact CG-CZ 4.17Å; L665-L838 HydrophobicContact CD1-CD2 4.35Å; L665-L838 HydrophobicContact CD2-CD1 4.01Å; L665-L838 HydrophobicContact CD2-CD2 3.94Å; L665-W868 HydrophobicContact CD2-CB 3.99Å; L665-L877 HydrophobicContact CB-CD2 4.46Å; L665-L877 HydrophobicContact CD1-CD1 3.65Å; L665-L877 HydrophobicContact CD1-CD2 4.41Å
666	C	89.1	Confident	81.4	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	145.6	178.2	52.6	0	0	0	0	112.2	P652 F654 C867 W868 F869 V870	P652-C666 HydrophobicContact CB-CB 4Å; P652-C666 HydrophobicContact CG-CB 4.07Å; F654-C666 WeakPolarHBondContact O-CA 3.44Å; F654-C666 WeakPolarHBondContact O-CB 3.46Å; C666-C867 HydrophobicContact CB-CB 3.74Å; C666-C867 WeakPolarHBondContact CB-SG 3.44Å; C666-C867 WeakPolarHBondContact SG-CB 3.48Å; C666-C867 CovalentContact SG-SG 2.04Å; C666-C867 PolarHBondContact SG-SG 2.83Å; C666-W868 PolarHBondContact N-O 2.98Å; C666-F869 HydrophobicContact CB-CD2 4.46Å; C666-F869 CarbonylContact O-C 3.56Å; C666-F869 VanDerWaalsContact O-CA 3.29Å; C666-F869 WeakPolarHBondContact O-CA 3.42Å; C666-F869 VanDerWaalsContact SG-CA 3.57Å; C666-V870 PolarHBondContact O-N 2.9Å
667	F	88.3	Confident	81.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	162.2	178.2	67.9	-81	0	0	0	111.6	H653 F654 I656 I669 F814 V870 L877 I878	H653-F667 PolarHBondContact N-O 2.78Å; F654-F667 HydrophobicContact CB-CD1 3.92Å; F654-F667 HydrophobicContact CB-CE1 3.55Å; F654-F667 HydrophobicContact CB-CE2 4.32Å; F654-F667 HydrophobicContact CB-CG 4.44Å; F654-F667 HydrophobicContact CB-CZ 3.77Å; F654-F667 AromaticContact CD2-CD2 3.88Å; F654-F667 HydrophobicContact CD2-CD2 3.88Å; F654-F667 HydrophobicContact CD2-CE1 4.18Å; F654-F667 AromaticContact CD2-CE2 3.36Å; F654-F667 HydrophobicContact CD2-CE2 3.36Å; F654-F667 HydrophobicContact CD2-CG 4.47Å; F654-F667 AromaticContact CD2-CZ 3.53Å; F654-F667 HydrophobicContact CD2-CZ 3.53Å; F654-F667 AromaticContact CE2-CE2 3.96Å; F654-F667 HydrophobicContact CE2-CE2 3.96Å; F654-F667 HydrophobicContact CE2-CZ 4.31Å; F654-F667 HydrophobicContact CG-CE1 4.07Å; F654-F667 HydrophobicContact CG-CE2 4.06Å; F654-F667 AromaticContact CG-CZ 3.73Å; F654-F667 HydrophobicContact CG-CZ 3.73Å; F654-F667 PolarHBondContact N-O 3.47Å; F654-F667 VanDerWaalsContact N-O 3.12Å; F654-F667 PolarHBondContact O-N 3.41Å; F654-F667 VanDerWaalsContact O-N 3.16Å; I656-F667 HydrophobicContact CD1-CE1 4.45Å; I656-F667 HydrophobicContact CG1-CE1 4.1Å; F667-I669 HydrophobicContact CD2-CD1 4.01Å; F667-I669 HydrophobicContact CD2-CG1 4.3Å; F667-I669 HydrophobicContact CE2-CD1 3.89Å; F667-I669 HydrophobicContact CE2-CG1 4.03Å; F667-F814 HydrophobicContact CE1-CE2 4.27Å; F667-F814 HydrophobicContact CZ-CE2 4.4Å; F667-V870 HydrophobicContact CB-CB 4.25Å; F667-L877 HydrophobicContact CD1-CD2 3.78Å; F667-L877 HydrophobicContact CE1-CD2 4.13Å; F667-I878 HydrophobicContact CE2-CG2 4.01Å; F667-I878 HydrophobicContact CZ-CG2 3.92Å
668	N	84	Confident	82.5	Confident	25 Å²	25	47.4 Å²	47.4	13%	0.134	26%	0.263	C	S	.	.			trans	-113.9	155.9	176.3	-70.8	-10.9	0	0	0	110.8	P652 H653 F869 N873	P652-N668 WeakPolarHBondContact CA-OD1 3.47Å; H653-N668 PolarHBondContact N-OD1 2.88Å; N668-F869 HydrophobicContact CB-CZ 4.27Å; N668-N873 VanDerWaalsContact O-CA 3.23Å; N668-N873 WeakPolarHBondContact O-CA 3.45Å; N668-N873 PolarHBondContact O-OD1 3.36Å
669	I	83.4	Confident	83.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.26	C	S	.	.			trans	-122.3	97.3	166.8	-59.3	-63.1	0	0	0	107.4	H653 F654 F667 E671 L677 L810 N873 H882	H653-I669 PolarHBondContact CE1-O 3.29Å; H653-I669 PolarHBondContact ND1-N 3.03Å; H653-I669 VanDerWaalsContact ND1-N 3.16Å; H653-I669 PolarHBondContact ND1-O 2.65Å; F654-I669 HydrophobicContact CD2-CG1 4.32Å; F654-I669 HydrophobicContact CE2-CB 4.4Å; F654-I669 HydrophobicContact CE2-CG1 3.68Å; F667-I669 HydrophobicContact CD2-CD1 4.01Å; F667-I669 HydrophobicContact CD2-CG1 4.3Å; F667-I669 HydrophobicContact CE2-CD1 3.89Å; F667-I669 HydrophobicContact CE2-CG1 4.03Å; I669-E671 HydrophobicContact CG2-CG 3.95Å; I669-E671 PolarHBondContact O-N 3.13Å; I669-E671 VanDerWaalsContact O-N 3.16Å; I669-L677 HydrophobicContact CB-CD1 3.97Å; I669-L677 HydrophobicContact CG2-CD1 3.63Å; I669-L677 HydrophobicContact CG2-CD2 4.27Å; I669-L810 HydrophobicContact CG1-CD1 4.37Å; I669-N873 HydrophobicContact CD1-CB 3.9Å; I669-N873 WeakPolarHBondContact CD1-O 3.24Å; I669-H882 HydrophobicContact CD1-CB 3.64Å; I669-H882 HydrophobicContact CG2-CB 4.28Å
670	N	78.4	Confident	84.8	Confident	64 Å²	64	42 Å²	42	34%	0.342	23%	0.228	S	C	.	.			trans	-91.8	67.2	-171.9	-62.7	-46.3	0	0	0	111.8	T708 N873	N670-T708 PolarHBondContact OD1-OG1 2.69Å; N670-N873 PolarHBondContact N-OD1 3.25Å; N670-N873 VanDerWaalsContact N-OD1 3.14Å
671	E	84.3	Confident	86.2	Confident	41 Å²	41	36 Å²	36	19%	0.192	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-87.4	168.6	177.4	-81.9	-62	155.9	0	0	113.4	I669 T675 I693 H882 I886	I669-E671 HydrophobicContact CG2-CG 3.95Å; I669-E671 PolarHBondContact O-N 3.13Å; I669-E671 VanDerWaalsContact O-N 3.16Å; E671-T675 HydrophobicContact CB-CG2 3.87Å; E671-T675 HydrophobicContact CG-CG2 4.14Å; E671-I693 HydrophobicContact CB-CD1 3.88Å; E671-H882 IonicContact OE1-CD2 3.87Å; E671-H882 PolarHBondContact OE1-CD2 3.23Å; E671-H882 IonicContact OE1-NE2 3.65Å; E671-H882 PolarHBondContact OE1-NE2 3.28Å; E671-I886 HydrophobicContact CG-CD1 4.35Å
672	A	82.7	Confident	87.2	Confident	49 Å²	49	32.3 Å²	32.3	41%	0.405	18%	0.184	S	C	.	.	P	Polyproline II helix	trans	-59.5	138.6	176.5	0	0	0	0	0	111.8	G674 T675	A672-G674 PolarHBondContact O-N 3.45Å; A672-T675 VanDerWaalsContact O-CB 3.23Å; A672-T675 WeakPolarHBondContact O-CB 3.37Å; A672-T675 PolarHBondContact O-N 2.85Å; A672-T675 PolarHBondContact O-OG1 3.28Å
673	P	85.2	Confident	88.1	Confident	59 Å²	59	27.7 Å²	27.7	38%	0.383	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	131.5	171.7	-26.8	35.5	0	0	0	111
674	G	85	Confident	88.7	Confident	37 Å²	37	29.1 Å²	29.1	38%	0.381	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	103.1	-21.1	-172.3	0	0	0	0	0	113.8	A672 Q692 I693	A672-G674 PolarHBondContact O-N 3.45Å; G674-Q692 PolarHBondContact O-NE2 2.66Å; G674-I693 PolarHBondContact N-O 2.82Å
675	T	91	Very high	88.7	Confident	25 Å²	25	30.9 Å²	30.9	15%	0.153	18%	0.184	C	C	.	.			trans	-61.3	134.2	174.1	-62.3	0	0	0	0	110.6	E671 A672 L677 Q692 I693 I886	E671-T675 HydrophobicContact CB-CG2 3.87Å; E671-T675 HydrophobicContact CG-CG2 4.14Å; A672-T675 VanDerWaalsContact O-CB 3.23Å; A672-T675 WeakPolarHBondContact O-CB 3.37Å; A672-T675 PolarHBondContact O-N 2.85Å; A672-T675 PolarHBondContact O-OG1 3.28Å; T675-L677 HydrophobicContact CG2-CD2 4.11Å; T675-Q692 WeakPolarHBondContact O-CA 2.96Å; T675-I693 PolarHBondContact O-N 2.81Å; T675-I886 HydrophobicContact CG2-CB 4.48Å; T675-I886 HydrophobicContact CG2-CD1 3.95Å; T675-I886 HydrophobicContact CG2-CG1 3.83Å; T675-I886 HydrophobicContact CG2-CG2 3.94Å
676	V	93.6	Very high	88.6	Confident	9 Å²	9	31.5 Å²	31.5	6%	0.055	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.7	176.7	-170.4	0	0	0	0	109.2	N690 G691 Q692 I886 V887 N889 L890	V676-N690 HydrophobicContact CG1-CB 3.99Å; V676-G691 WeakPolarHBondContact CA-O 3.39Å; V676-Q692 HydrophobicContact CG2-CB 4.12Å; V676-Q692 HydrophobicContact CG2-CG 4.03Å; V676-I886 WeakPolarHBondContact O-CA 3.38Å; V676-V887 HydrophobicContact CB-CG2 3.87Å; V676-V887 HydrophobicContact CG1-CG2 3.55Å; V676-V887 PolarHBondContact O-N 3.3Å; V676-N889 WeakPolarHBondContact CG1-O 3.29Å; V676-L890 HydrophobicContact CG1-CD1 4.06Å
677	L	93.3	Very high	88.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	137.9	-177.8	-62.1	178.3	0	0	0	111.1	I669 T675 L679 N690 G691 I693 L810 Y885 I886	I669-L677 HydrophobicContact CB-CD1 3.97Å; I669-L677 HydrophobicContact CG2-CD1 3.63Å; I669-L677 HydrophobicContact CG2-CD2 4.27Å; T675-L677 HydrophobicContact CG2-CD2 4.11Å; L677-L679 HydrophobicContact CB-CD2 4.21Å; L677-L679 PolarHBondContact O-N 3.26Å; L677-N690 CarbonylContact O-C 3.51Å; L677-N690 VanDerWaalsContact O-CA 3.25Å; L677-N690 WeakPolarHBondContact O-CA 3.39Å; L677-G691 PolarHBondContact N-O 3.01Å; L677-G691 PolarHBondContact O-N 2.97Å; L677-I693 HydrophobicContact CD1-CD1 3.46Å; L677-I693 VanDerWaalsContact CD1-CD1 3.46Å; L677-I693 HydrophobicContact CD1-CG1 4.2Å; L677-I693 HydrophobicContact CG-CD1 4.05Å; L677-L810 HydrophobicContact CB-CD1 3.86Å; L677-L810 HydrophobicContact CD1-CD1 3.87Å; L677-L810 HydrophobicContact CD2-CD1 4.36Å; L677-L810 HydrophobicContact CG-CD1 4.26Å; L677-Y885 CarbonylContact C-O 3.59Å; L677-Y885 WeakPolarHBondContact CA-O 3.17Å; L677-I886 HydrophobicContact CD2-CG1 3.86Å
678	R	95.3	Very high	89	Confident	77 Å²	77	33.1 Å²	33.1	29%	0.291	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	108.8	171.3	-176.8	168.1	-71.2	165.4	9.9	110.6	Q681 N690 L810 Y885 V887	R678-Q681 VanDerWaalsContact CD-OE1 3.27Å; R678-Q681 HydrophobicContact CG-CB 4.31Å; R678-N690 WeakPolarHBondContact CA-OD1 3.48Å; R678-L810 PolarHBondContact O-N 3.14Å; R678-Y885 PolarHBondContact N-O 3.35Å; R678-V887 HydrophobicContact CB-CG1 3.95Å; R678-V887 VanDerWaalsContact NH2-CG1 3.32Å
679	L	93.8	Very high	89.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-48	-177.7	-53	-173.1	0	0	0	111.1	F654 L677 V689 F710 L713 F795 G809 L810 L811 G812	F654-L679 HydrophobicContact CE1-CD2 3.93Å; F654-L679 HydrophobicContact CZ-CD2 3.82Å; L677-L679 HydrophobicContact CB-CD2 4.21Å; L677-L679 PolarHBondContact O-N 3.26Å; L679-V689 WeakPolarHBondContact CA-O 3.47Å; L679-V689 HydrophobicContact CB-CB 4.46Å; L679-V689 HydrophobicContact CB-CG1 4.31Å; L679-V689 WeakPolarHBondContact CB-O 3.27Å; L679-V689 HydrophobicContact CD1-CG1 4.26Å; L679-V689 PolarHBondContact N-O 3.24Å; L679-F710 HydrophobicContact CD1-CE1 4.36Å; L679-F710 HydrophobicContact CD1-CZ 4.14Å; L679-F710 HydrophobicContact CD2-CE1 4.14Å; L679-F710 HydrophobicContact CD2-CZ 3.73Å; L679-L713 HydrophobicContact CD1-CD2 3.89Å; L679-F795 HydrophobicContact CD1-CD1 4.35Å; L679-G809 CarbonylContact O-C 3.52Å; L679-L810 HydrophobicContact CD2-CD1 4.23Å; L679-L810 PolarHBondContact O-N 2.77Å; L679-L811 HydrophobicContact CB-CD1 4.45Å; L679-L811 PolarHBondContact O-N 2.84Å; L679-G812 PolarHBondContact O-N 2.81Å
680	I	94.3	Very high	90.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	135.6	-178.5	-56.2	170	0	0	0	108.5	T688 V689 F775 F795 V797 M803 T807 H808 L811 F815	I680-T688 CarbonylContact O-C 3.44Å; I680-T688 WeakPolarHBondContact O-CA 3.19Å; I680-V689 HydrophobicContact CB-CB 4.01Å; I680-V689 HydrophobicContact CB-CG2 4.12Å; I680-V689 HydrophobicContact CD1-CB 4.42Å; I680-V689 HydrophobicContact CD1-CG2 4.17Å; I680-V689 HydrophobicContact CG1-CB 4.39Å; I680-V689 PolarHBondContact N-O 2.93Å; I680-V689 VanDerWaalsContact N-O 3.13Å; I680-V689 PolarHBondContact O-N 3.27Å; I680-F775 HydrophobicContact CD1-CE1 3.67Å; I680-F775 HydrophobicContact CD1-CZ 3.88Å; I680-F795 HydrophobicContact CD1-CE1 3.82Å; I680-F795 HydrophobicContact CD1-CZ 3.9Å; I680-V797 HydrophobicContact CD1-CG2 4.41Å; I680-M803 HydrophobicContact CG2-CE 3.56Å; I680-T807 HydrophobicContact CG2-CG2 3.96Å; I680-H808 CarbonylContact C-O 3.57Å; I680-H808 WeakPolarHBondContact CA-O 3.23Å; I680-L811 HydrophobicContact CG1-CB 4.22Å; I680-F815 HydrophobicContact CD1-CE2 3.82Å; I680-F815 HydrophobicContact CD1-CZ 3.61Å; I680-F815 HydrophobicContact CG1-CE2 4.18Å; I680-F815 HydrophobicContact CG1-CZ 4.05Å; I680-F815 HydrophobicContact CG2-CE2 4.25Å
681	Q	94.1	Very high	90.8	Very high	71 Å²	71	29 Å²	29	33%	0.332	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	117.9	168	179.8	174.7	23.5	0	0	108.7	R678 T807 H808	R678-Q681 VanDerWaalsContact CD-OE1 3.27Å; R678-Q681 HydrophobicContact CG-CB 4.31Å; Q681-T807 WeakPolarHBondContact O-CA 3.23Å; Q681-H808 PolarHBondContact N-O 2.88Å; Q681-H808 PolarHBondContact O-N 3.47Å
682	D	92.8	Very high	91.2	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	106.7	172.9	-179.1	0.7	0	0	0	109.4	V684 T685 G686 L687 M803 S804 T807	D682-V684 PolarHBondContact O-N 3.3Å; D682-V684 WeakPolarHBondContact OD1-CB 3.31Å; D682-V684 PolarHBondContact OD1-N 3.1Å; D682-T685 WeakPolarHBondContact CB-OG1 3.47Å; D682-T685 WeakPolarHBondContact OD2-CB 3.49Å; D682-T685 WeakPolarHBondContact OD2-CG2 3.36Å; D682-T685 PolarHBondContact OD2-OG1 2.96Å; D682-G686 WeakPolarHBondContact O-CA 3.3Å; D682-G686 PolarHBondContact O-N 3.22Å; D682-L687 PolarHBondContact N-O 2.91Å; D682-L687 PolarHBondContact O-N 2.95Å; D682-M803 HydrophobicContact CB-CE 3.8Å; D682-S804 VanDerWaalsContact CG-OG 3.31Å; D682-S804 VanDerWaalsContact OD1-CB 3.25Å; D682-S804 WeakPolarHBondContact OD1-CB 3.47Å; D682-S804 PolarHBondContact OD1-OG 3.18Å; D682-S804 PolarHBondContact OD2-N 3.18Å; D682-T807 HydrophobicContact CB-CG2 4.34Å
683	P	89.3	Confident	91.5	Very high	75 Å²	75	27 Å²	27	49%	0.487	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-21.1	-178.2	29.1	-34.5	0	0	0	112.9	Q806	P683-Q806 WeakPolarHBondContact CD-O 3.39Å; P683-Q806 HydrophobicContact CG-CB 3.77Å
684	V	88.8	Confident	91.4	Very high	74 Å²	74	26.2 Å²	26.2	45%	0.448	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-43.5	-176.4	-179.9	0	0	0	0	111.1	D682 Q719 S804 Q806	D682-V684 PolarHBondContact O-N 3.3Å; D682-V684 WeakPolarHBondContact OD1-CB 3.31Å; D682-V684 PolarHBondContact OD1-N 3.1Å; V684-Q719 PolarHBondContact O-NE2 3.29Å; V684-S804 WeakPolarHBondContact CG2-OG 3.31Å; V684-Q806 HydrophobicContact CG2-CB 4.38Å; V684-Q806 HydrophobicContact CG2-CG 4.45Å
685	T	86.3	Confident	91	Very high	41 Å²	41	25 Å²	25	25%	0.252	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-11.2	178	59.5	0	0	0	0	113	D682 L687 N717 Q719	D682-T685 WeakPolarHBondContact CB-OG1 3.47Å; D682-T685 WeakPolarHBondContact OD2-CB 3.49Å; D682-T685 WeakPolarHBondContact OD2-CG2 3.36Å; D682-T685 PolarHBondContact OD2-OG1 2.96Å; T685-L687 PolarHBondContact O-N 2.79Å; T685-L687 WeakPolarHBondContact OG1-CB 3.43Å; T685-N717 PolarHBondContact O-ND2 3.24Å; T685-N717 VanDerWaalsContact O-ND2 3.07Å; T685-N717 PolarHBondContact O-OD1 3.12Å; T685-Q719 PolarHBondContact O-OE1 2.86Å
686	G	87.9	Confident	90	Very high	13 Å²	13	25 Å²	25	13%	0.134	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	9.8	-175.8	0	0	0	0	0	113.9	D682 N717 A718	D682-G686 WeakPolarHBondContact O-CA 3.3Å; D682-G686 PolarHBondContact O-N 3.22Å; G686-N717 WeakPolarHBondContact O-CA 3.34Å; G686-A718 PolarHBondContact O-N 3.42Å
687	L	91.8	Very high	88.7	Confident	3 Å²	3	29 Å²	29	2%	0.016	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	129	-177.9	178.5	67.8	0	0	0	111.2	D682 T685 I715 A716 F769 V773 F775 M803	D682-L687 PolarHBondContact N-O 2.91Å; D682-L687 PolarHBondContact O-N 2.95Å; T685-L687 PolarHBondContact O-N 2.79Å; T685-L687 WeakPolarHBondContact OG1-CB 3.43Å; L687-I715 HydrophobicContact CD1-CG2 4.15Å; L687-A716 CarbonylContact C-O 3.59Å; L687-A716 WeakPolarHBondContact CA-O 3.32Å; L687-F769 HydrophobicContact CD1-CD2 4.26Å; L687-F769 HydrophobicContact CD1-CE1 4.22Å; L687-F769 HydrophobicContact CD1-CE2 3.68Å; L687-F769 HydrophobicContact CD1-CZ 3.66Å; L687-V773 HydrophobicContact CD2-CG1 4.34Å; L687-F775 HydrophobicContact CD1-CE2 4.27Å; L687-F775 HydrophobicContact CD2-CE2 3.63Å; L687-F775 HydrophobicContact CD2-CZ 3.68Å; L687-F775 HydrophobicContact CG-CE2 4.48Å; L687-M803 HydrophobicContact CD2-CE 3.95Å; L687-M803 HydrophobicContact CD2-SD 3.94Å
688	T	93.8	Very high	87.1	Confident	31 Å²	31	36.3 Å²	36.3	19%	0.19	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	133.8	174.5	-57.5	0	0	0	0	110.2	I680 A716	I680-T688 CarbonylContact O-C 3.44Å; I680-T688 WeakPolarHBondContact O-CA 3.19Å; T688-A716 PolarHBondContact N-O 3.48Å; T688-A716 PolarHBondContact O-N 2.84Å
689	V	95.2	Very high	84.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	120.6	173.4	-174.7	0	0	0	0	109.5	L679 I680 G714 I715 F775 F795	L679-V689 WeakPolarHBondContact CA-O 3.47Å; L679-V689 HydrophobicContact CB-CB 4.46Å; L679-V689 HydrophobicContact CB-CG1 4.31Å; L679-V689 WeakPolarHBondContact CB-O 3.27Å; L679-V689 HydrophobicContact CD1-CG1 4.26Å; L679-V689 PolarHBondContact N-O 3.24Å; I680-V689 HydrophobicContact CB-CB 4.01Å; I680-V689 HydrophobicContact CB-CG2 4.12Å; I680-V689 HydrophobicContact CD1-CB 4.42Å; I680-V689 HydrophobicContact CD1-CG2 4.17Å; I680-V689 HydrophobicContact CG1-CB 4.39Å; I680-V689 PolarHBondContact N-O 2.93Å; I680-V689 VanDerWaalsContact N-O 3.13Å; I680-V689 PolarHBondContact O-N 3.27Å; V689-G714 VanDerWaalsContact CA-O 3.31Å; V689-G714 WeakPolarHBondContact CA-O 3.4Å; V689-I715 HydrophobicContact CG1-CG1 4.13Å; V689-I715 HydrophobicContact CG2-CG1 4.23Å; V689-I715 HydrophobicContact CG2-CG2 4.21Å; V689-F775 HydrophobicContact CG2-CE2 4.41Å; V689-F795 HydrophobicContact CB-CZ 4.5Å; V689-F795 HydrophobicContact CG1-CD2 4.45Å; V689-F795 HydrophobicContact CG1-CE1 4.37Å; V689-F795 HydrophobicContact CG1-CE2 3.89Å; V689-F795 HydrophobicContact CG1-CZ 3.84Å; V689-F795 HydrophobicContact CG2-CZ 4.27Å
690	N	96	Very high	82.8	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	148.5	176.6	-59.8	-41.8	0	0	0	110.4	V676 L677 R678 L713 G714 L890	V676-N690 HydrophobicContact CG1-CB 3.99Å; L677-N690 CarbonylContact O-C 3.51Å; L677-N690 VanDerWaalsContact O-CA 3.25Å; L677-N690 WeakPolarHBondContact O-CA 3.39Å; R678-N690 WeakPolarHBondContact CA-OD1 3.48Å; N690-L713 WeakPolarHBondContact O-CA 3.38Å; N690-G714 PolarHBondContact N-O 3.19Å; N690-G714 PolarHBondContact O-N 3.29Å; N690-L890 HydrophobicContact CB-CD1 4.11Å; N690-L890 WeakPolarHBondContact CB-O 3.25Å; N690-L890 PolarHBondContact ND2-O 2.94Å; N690-L890 WeakPolarHBondContact O-CD1 3.43Å
691	G	93.5	Very high	80.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	132	178.7	0	0	0	0	0	112.6	V676 L677 K712	V676-G691 WeakPolarHBondContact CA-O 3.39Å; L677-G691 PolarHBondContact N-O 3.01Å; L677-G691 PolarHBondContact O-N 2.97Å; G691-K712 CarbonylContact C-O 3.59Å; G691-K712 WeakPolarHBondContact CA-O 3.45Å
692	Q	92.6	Very high	78.2	Confident	47 Å²	47	46.2 Å²	46.2	22%	0.22	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	128.7	175.7	-171.8	173.6	35.1	0	0	111.1	G674 T675 V676 G711 K712	G674-Q692 PolarHBondContact O-NE2 2.66Å; T675-Q692 WeakPolarHBondContact O-CA 2.96Å; V676-Q692 HydrophobicContact CG2-CB 4.12Å; V676-Q692 HydrophobicContact CG2-CG 4.03Å; Q692-G711 PolarHBondContact O-N 2.9Å; Q692-K712 HydrophobicContact CB-CB 4.1Å; Q692-K712 PolarHBondContact N-O 3.21Å
693	I	87.3	Confident	76.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	139.1	179.4	-70.7	171	0	0	0	111.5	E671 G674 T675 L677 T708 Y709 F710	E671-I693 HydrophobicContact CB-CD1 3.88Å; G674-I693 PolarHBondContact N-O 2.82Å; T675-I693 PolarHBondContact O-N 2.81Å; L677-I693 HydrophobicContact CD1-CD1 3.46Å; L677-I693 VanDerWaalsContact CD1-CD1 3.46Å; L677-I693 HydrophobicContact CD1-CG1 4.2Å; L677-I693 HydrophobicContact CG-CD1 4.05Å; I693-T708 HydrophobicContact CG2-CG2 3.68Å; I693-Y709 CarbonylContact C-O 3.47Å; I693-Y709 VanDerWaalsContact CA-O 3.3Å; I693-Y709 WeakPolarHBondContact CA-O 3.39Å; I693-F710 HydrophobicContact CG1-CE1 4.39Å
694	V	84.8	Confident	74.1	Confident	42 Å²	42	55.5 Å²	55.5	26%	0.255	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	148.8	167.1	-64.6	0	0	0	0	110.3	T708 Y709	V694-T708 CarbonylContact O-C 3.59Å; V694-T708 WeakPolarHBondContact O-CA 3.45Å; V694-Y709 WeakPolarHBondContact CG2-O 3.31Å; V694-Y709 PolarHBondContact N-O 3.29Å; V694-Y709 PolarHBondContact O-N 3.04Å
695	G	76	Confident	72.2	Confident	12 Å²	12	56.1 Å²	56.1	12%	0.124	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	164.5	174.7	0	0	0	0	0	112.7
696	D	70.5	Confident	71.1	Confident	25 Å²	25	57.7 Å²	57.7	13%	0.134	31%	0.313	C	S	.	.			trans	-63.2	166.9	167.4	67.4	-10.9	0	0	0	112.8	R698 K707 Y709	D696-R698 PolarHBondContact O-N 3.34Å; D696-K707 HydrophobicContact CB-CB 4.43Å; D696-K707 PolarHBondContact N-O 2.73Å; D696-K707 VanDerWaalsContact N-O 3.14Å; D696-Y709 HydrophobicContact CB-CE2 4.39Å
697	K	64.6	Low	70.2	Confident	93 Å²	93	60 Å²	60	40%	0.404	32%	0.32	S	S	.	.	S	Bend	trans	-68	-18.2	-175.3	-67.9	-177.6	-179.1	164.5	0	113.4	H786 V788 H789 R790	K697-H786 WeakPolarHBondContact CD-O 3.47Å; K697-H786 PolarHBondContact NZ-O 2.81Å; K697-V788 WeakPolarHBondContact CB-O 3.38Å; K697-V788 PolarHBondContact N-O 2.92Å; K697-H789 WeakPolarHBondContact CE-O 3.29Å; K697-H789 PolarHBondContact NZ-O 3.17Å; K697-R790 HydrophobicContact CD-CG 4.15Å; K697-R790 HydrophobicContact CG-CG 3.32Å
698	R	60.6	Low	69.4	Low	154 Å²	154	60.1 Å²	60.1	58%	0.581	32%	0.32	S	S	*	.	S	Bend	trans	-94.4	101.3	-179.3	-69.5	-175.2	179.5	-175.8	-1.2	108.3	D696 S700 P787	D696-R698 PolarHBondContact O-N 3.34Å; R698-S700 VanDerWaalsContact C-N 3.26Å; R698-S700 PolarHBondContact O-N 3.29Å; R698-P787 PolarHBondContact NE-O 2.84Å
699	S	49.7	Very low	68.9	Low	108 Å²	108	59.6 Å²	59.6	76%	0.755	32%	0.315	S	S	*	.			trans	-67.4	84.3	174.7	57.9	0	0	0	0	110.6
700	S	49.3	Very low	68.6	Low	34 Å²	34	60.2 Å²	60.2	24%	0.238	32%	0.318	C	S	.	.			trans	-70.8	131.6	164.3	-171.8	0	0	0	0	108.4	R698 D702 T705 R706	R698-S700 VanDerWaalsContact C-N 3.26Å; R698-S700 PolarHBondContact O-N 3.29Å; S700-D702 PolarHBondContact OG-N 2.92Å; S700-T705 PolarHBondContact OG-OG1 2.82Å; S700-R706 PolarHBondContact O-NH2 2.86Å
701	P	45.2	Very low	68.1	Low	134 Å²	134	60.3 Å²	60.3	87%	0.87	32%	0.32	S	S	*	.	S	Bend	trans	-74.1	-14	173	11.6	-3.8	0	0	0	112.9
702	D	47.2	Very low	68.1	Low	79 Å²	79	64 Å²	64	42%	0.422	34%	0.336	S	S	.	.			trans	-91.7	118.2	-178.8	-166	-4.1	0	0	0	110.7	S700 K704 T705	S700-D702 PolarHBondContact OG-N 2.92Å; D702-K704 PolarHBondContact O-N 2.92Å; D702-K704 VanDerWaalsContact O-N 3.11Å; D702-K704 PolarHBondContact OD1-N 3.5Å; D702-T705 PolarHBondContact O-N 2.79Å; D702-T705 PolarHBondContact O-OG1 2.04Å
703	S	48.6	Very low	68.2	Low	84 Å²	84	61.8 Å²	61.8	59%	0.587	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-61.1	-20.1	179.9	61.4	0	0	0	0	112.8
704	K	46.3	Very low	68.6	Low	188 Å²	188	61.8 Å²	61.8	82%	0.817	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-79.9	-12.1	-176.7	-64.8	-179.6	178.8	-179.2	0	115.1	D702	D702-K704 PolarHBondContact O-N 2.92Å; D702-K704 VanDerWaalsContact O-N 3.11Å; D702-K704 PolarHBondContact OD1-N 3.5Å
705	T	49.6	Very low	69	Low	87 Å²	87	59.8 Å²	59.8	53%	0.534	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-119.5	4.7	-179.3	54.2	0	0	0	0	113.7	S700 D702 K707	S700-T705 PolarHBondContact OG-OG1 2.82Å; D702-T705 PolarHBondContact O-N 2.79Å; D702-T705 PolarHBondContact O-OG1 2.04Å; T705-K707 PolarHBondContact O-N 3.45Å
706	R	61.9	Low	69.8	Low	73 Å²	73	60.1 Å²	60.1	28%	0.275	32%	0.315	S	S	.	.			trans	-83.7	116.2	-173.9	-175.7	177.7	-93.5	176	-5.1	110.5	S700 T708	S700-R706 PolarHBondContact O-NH2 2.86Å; R706-T708 HydrophobicContact CG-CG2 4.1Å
707	K	69	Low	70.7	Confident	62 Å²	62	59.4 Å²	59.4	27%	0.27	31%	0.312	S	S	.	.			trans	-80	130.9	169.6	-62.3	-170.6	-172.6	-165.2	0	109.3	D649 D696 T705 Y709	D649-K707 WeakPolarHBondContact O-CE 3.45Å; D649-K707 PolarHBondContact O-NZ 2.74Å; D696-K707 HydrophobicContact CB-CB 4.43Å; D696-K707 PolarHBondContact N-O 2.73Å; D696-K707 VanDerWaalsContact N-O 3.14Å; T705-K707 PolarHBondContact O-N 3.45Å; K707-Y709 HydrophobicContact CB-CE2 4.16Å
708	T	76.7	Confident	71.7	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.031	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	158.4	-178.5	46.8	0	0	0	0	110.5	H653 N670 I693 V694 R706	H653-T708 PolarHBondContact CE1-OG1 2.78Å; H653-T708 PolarHBondContact NE2-O 2.89Å; H653-T708 PolarHBondContact NE2-OG1 3.08Å; N670-T708 PolarHBondContact OD1-OG1 2.69Å; I693-T708 HydrophobicContact CG2-CG2 3.68Å; V694-T708 CarbonylContact O-C 3.59Å; V694-T708 WeakPolarHBondContact O-CA 3.45Å; R706-T708 HydrophobicContact CG-CG2 4.1Å
709	Y	83.4	Confident	72.9	Confident	20 Å²	20	58.3 Å²	58.3	8%	0.078	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	167.1	-179	-49.6	-90.2	0	0	0	110.1	I693 V694 D696 K707 H789 F792	I693-Y709 CarbonylContact C-O 3.47Å; I693-Y709 VanDerWaalsContact CA-O 3.3Å; I693-Y709 WeakPolarHBondContact CA-O 3.39Å; V694-Y709 WeakPolarHBondContact CG2-O 3.31Å; V694-Y709 PolarHBondContact N-O 3.29Å; V694-Y709 PolarHBondContact O-N 3.04Å; D696-Y709 HydrophobicContact CB-CE2 4.39Å; K707-Y709 HydrophobicContact CB-CE2 4.16Å; Y709-H789 AromaticContact CZ-ND1 3.78Å; Y709-H789 PolarHBondContact OH-CE1 2.8Å; Y709-H789 PolarHBondContact OH-ND1 2.78Å; Y709-F792 HydrophobicContact CD1-CB 4.36Å; Y709-F792 HydrophobicContact CD1-CD1 4.02Å; Y709-F792 AromaticContact CD1-CD2 3.92Å; Y709-F792 HydrophobicContact CD1-CD2 3.92Å; Y709-F792 HydrophobicContact CD1-CE1 4.26Å; Y709-F792 HydrophobicContact CD1-CE2 4.17Å; Y709-F792 AromaticContact CD1-CG 3.84Å; Y709-F792 HydrophobicContact CD1-CG 3.84Å; Y709-F792 HydrophobicContact CD1-CZ 4.33Å; Y709-F792 HydrophobicContact CE1-CD1 4.45Å; Y709-F792 HydrophobicContact CE1-CE1 4.37Å; Y709-F792 HydrophobicContact CG-CB 4.02Å; Y709-F792 HydrophobicContact CG-CD1 4.34Å; Y709-F792 HydrophobicContact CG-CD2 4.39Å; Y709-F792 HydrophobicContact CG-CG 4.01Å
710	F	87.8	Confident	74.3	Confident	13 Å²	13	56.1 Å²	56.1	6%	0.057	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	122.5	168.5	-69.3	-68.3	0	0	0	111.1	F654 L679 I693 L713 L793	F654-F710 HydrophobicContact CE1-CE2 4.21Å; F654-F710 HydrophobicContact CE1-CZ 4.24Å; F654-F710 HydrophobicContact CZ-CE2 4.11Å; F654-F710 AromaticContact CZ-CZ 3.82Å; F654-F710 HydrophobicContact CZ-CZ 3.82Å; L679-F710 HydrophobicContact CD1-CE1 4.36Å; L679-F710 HydrophobicContact CD1-CZ 4.14Å; L679-F710 HydrophobicContact CD2-CE1 4.14Å; L679-F710 HydrophobicContact CD2-CZ 3.73Å; I693-F710 HydrophobicContact CG1-CE1 4.39Å; F710-L713 HydrophobicContact CB-CD2 4.48Å; F710-L713 HydrophobicContact CD1-CD2 4.4Å; F710-L713 HydrophobicContact CG-CD2 4.35Å; F710-L793 HydrophobicContact CB-CB 4.46Å; F710-L793 PolarHBondContact O-N 3.32Å
711	G	86.1	Confident	75.8	Confident	7 Å²	7	60.4 Å²	60.4	7%	0.072	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-22.8	174.7	0	0	0	0	0	113.4	Q692	Q692-G711 PolarHBondContact O-N 2.9Å
712	K	93.3	Very high	77.8	Confident	78 Å²	78	54.4 Å²	54.4	34%	0.339	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	144.4	174.6	-50.3	-171.4	-173.4	172.3	0	111	G691 Q692 V726 T727 L890	G691-K712 CarbonylContact C-O 3.59Å; G691-K712 WeakPolarHBondContact CA-O 3.45Å; Q692-K712 HydrophobicContact CB-CB 4.1Å; Q692-K712 PolarHBondContact N-O 3.21Å; K712-V726 CarbonylContact C-O 3.54Å; K712-V726 VanDerWaalsContact CA-O 3.25Å; K712-V726 WeakPolarHBondContact CA-O 2.99Å; K712-T727 HydrophobicContact CD-CG2 4.11Å; K712-T727 HydrophobicContact CG-CG2 3.99Å; K712-L890 HydrophobicContact CB-CD2 4.21Å
713	L	94.9	Very high	79.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	135	172.6	-68.1	162.3	0	0	0	109.2	L679 N690 F710 E725 V726 V777 L793 F795	L679-L713 HydrophobicContact CD1-CD2 3.89Å; N690-L713 WeakPolarHBondContact O-CA 3.38Å; F710-L713 HydrophobicContact CB-CD2 4.48Å; F710-L713 HydrophobicContact CD1-CD2 4.4Å; F710-L713 HydrophobicContact CG-CD2 4.35Å; L713-E725 WeakPolarHBondContact O-CA 3.14Å; L713-V726 HydrophobicContact CB-CB 4.34Å; L713-V726 PolarHBondContact N-O 2.8Å; L713-V726 PolarHBondContact O-N 2.89Å; L713-V777 HydrophobicContact CD1-CG1 3.61Å; L713-V777 HydrophobicContact CD1-CG2 4.19Å; L713-L793 HydrophobicContact CD1-CB 3.99Å; L713-L793 HydrophobicContact CD1-CD1 4.15Å; L713-L793 HydrophobicContact CG-CD1 4.25Å; L713-F795 HydrophobicContact CD1-CB 3.89Å; L713-F795 HydrophobicContact CD1-CD2 4.18Å; L713-F795 HydrophobicContact CD1-CG 4.46Å; L713-F795 HydrophobicContact CD2-CB 4.28Å
714	G	94.8	Very high	82	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.9	170.6	0	0	0	0	0	109.3	V689 N690 V724 F891	V689-G714 VanDerWaalsContact CA-O 3.31Å; V689-G714 WeakPolarHBondContact CA-O 3.4Å; N690-G714 PolarHBondContact N-O 3.19Å; N690-G714 PolarHBondContact O-N 3.29Å; G714-V724 WeakPolarHBondContact CA-O 3.38Å; G714-F891 VanDerWaalsContact CA-CE1 3.45Å
715	I	94.3	Very high	84.4	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	121.8	172.6	-55.2	169.7	0	0	0	106.6	L687 V689 F722 V724 V767 F769 V777 F795	L687-I715 HydrophobicContact CD1-CG2 4.15Å; V689-I715 HydrophobicContact CG1-CG1 4.13Å; V689-I715 HydrophobicContact CG2-CG1 4.23Å; V689-I715 HydrophobicContact CG2-CG2 4.21Å; I715-F722 HydrophobicContact CG2-CE1 4.2Å; I715-V724 HydrophobicContact CB-CG1 3.69Å; I715-V724 HydrophobicContact CD1-CG1 4.38Å; I715-V724 HydrophobicContact CG1-CG1 4.38Å; I715-V724 HydrophobicContact CG2-CG1 4.49Å; I715-V724 PolarHBondContact N-O 2.96Å; I715-V724 PolarHBondContact O-N 3.27Å; I715-V767 HydrophobicContact CD1-CG2 4.38Å; I715-F769 HydrophobicContact CG2-CE2 4.07Å; I715-F769 HydrophobicContact CG2-CZ 3.83Å; I715-V777 HydrophobicContact CD1-CG2 4.36Å; I715-F795 HydrophobicContact CD1-CE2 4.24Å
716	A	92.3	Very high	86.5	Confident	19 Å²	19	38.4 Å²	38.4	16%	0.157	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	147.1	179.6	0	0	0	0	0	111.4	L687 T688 F722 Q723 F891	L687-A716 CarbonylContact C-O 3.59Å; L687-A716 WeakPolarHBondContact CA-O 3.32Å; T688-A716 PolarHBondContact N-O 3.48Å; T688-A716 PolarHBondContact O-N 2.84Å; A716-F722 CarbonylContact C-O 3.52Å; A716-F722 VanDerWaalsContact CA-O 3.24Å; A716-F722 WeakPolarHBondContact CA-O 3.31Å; A716-Q723 HydrophobicContact CB-CB 4.5Å; A716-Q723 HydrophobicContact CB-CG 4.39Å; A716-F891 HydrophobicContact CB-CD1 3.9Å; A716-F891 HydrophobicContact CB-CE1 4.26Å
717	N	89.6	Confident	88	Confident	10 Å²	10	35.5 Å²	35.5	5%	0.053	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	111.3	168.7	-171.9	-44.3	0	0	0	109.4	T685 G686 Q719 M720 D721 F722 F769	T685-N717 PolarHBondContact O-ND2 3.24Å; T685-N717 VanDerWaalsContact O-ND2 3.07Å; T685-N717 PolarHBondContact O-OD1 3.12Å; G686-N717 WeakPolarHBondContact O-CA 3.34Å; N717-Q719 PolarHBondContact O-N 2.85Å; N717-Q719 WeakPolarHBondContact OD1-CB 3.08Å; N717-Q719 PolarHBondContact OD1-N 3.24Å; N717-M720 HydrophobicContact CB-CB 4.28Å; N717-M720 HydrophobicContact CB-CG 4.45Å; N717-M720 PolarHBondContact O-N 2.78Å; N717-M720 PolarHBondContact OD1-N 3.12Å; N717-D721 PolarHBondContact O-N 2.86Å; N717-F722 HydrophobicContact CB-CB 4.48Å; N717-F722 PolarHBondContact N-O 3.19Å; N717-F722 PolarHBondContact O-N 3.2Å; N717-F769 HydrophobicContact CB-CE1 3.94Å
718	A	85	Confident	89	Confident	91 Å²	91	34 Å²	34	75%	0.752	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-24.4	-176.4	0	0	0	0	0	113.7	G686	G686-A718 PolarHBondContact O-N 3.42Å
719	Q	85.2	Confident	89.4	Confident	133 Å²	133	41.3 Å²	41.3	62%	0.621	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	-19.4	-179.7	-61	-180	5.1	0	0	112.5	V684 T685 N717	V684-Q719 PolarHBondContact O-NE2 3.29Å; T685-Q719 PolarHBondContact O-OE1 2.86Å; N717-Q719 PolarHBondContact O-N 2.85Å; N717-Q719 WeakPolarHBondContact OD1-CB 3.08Å; N717-Q719 PolarHBondContact OD1-N 3.24Å
720	M	80.3	Confident	89.8	Confident	62 Å²	62	44.9 Å²	44.9	31%	0.305	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	5.5	-175.7	-58	-175.6	75.6	0	0	113.8	N717 F722 D753 L755 F769	N717-M720 HydrophobicContact CB-CB 4.28Å; N717-M720 HydrophobicContact CB-CG 4.45Å; N717-M720 PolarHBondContact O-N 2.78Å; N717-M720 PolarHBondContact OD1-N 3.12Å; M720-F722 HydrophobicContact CB-CB 4.22Å; M720-F722 PolarHBondContact O-N 2.88Å; M720-F722 VanDerWaalsContact O-N 3.17Å; M720-D753 WeakPolarHBondContact CE-O 3.31Å; M720-L755 HydrophobicContact CE-CB 3.7Å; M720-F769 HydrophobicContact SD-CD1 4.06Å
721	D	81	Confident	90	Very high	124 Å²	124	44.3 Å²	44.3	66%	0.663	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.1	41.1	-172.3	-165.1	35.7	0	0	0	112.1	N717	N717-D721 PolarHBondContact O-N 2.86Å
722	F	86.6	Confident	90.3	Very high	7 Å²	7	44.3 Å²	44.3	3%	0.031	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	129.3	-175.4	172.2	-96.7	0	0	0	110	I715 A716 N717 M720 V724 L733 L755 V767 F769	I715-F722 HydrophobicContact CG2-CE1 4.2Å; A716-F722 CarbonylContact C-O 3.52Å; A716-F722 VanDerWaalsContact CA-O 3.24Å; A716-F722 WeakPolarHBondContact CA-O 3.31Å; N717-F722 HydrophobicContact CB-CB 4.48Å; N717-F722 PolarHBondContact N-O 3.19Å; N717-F722 PolarHBondContact O-N 3.2Å; M720-F722 HydrophobicContact CB-CB 4.22Å; M720-F722 PolarHBondContact O-N 2.88Å; M720-F722 VanDerWaalsContact O-N 3.17Å; F722-V724 HydrophobicContact CE1-CB 4.35Å; F722-V724 HydrophobicContact CE1-CG1 3.75Å; F722-V724 HydrophobicContact CZ-CB 3.91Å; F722-V724 HydrophobicContact CZ-CG1 3.57Å; F722-L733 HydrophobicContact CD2-CD1 3.69Å; F722-L733 HydrophobicContact CE2-CD1 3.23Å; F722-L733 HydrophobicContact CZ-CD1 4.08Å; F722-L755 HydrophobicContact CB-CD2 4.36Å; F722-L755 HydrophobicContact CD2-CD1 4.45Å; F722-L755 HydrophobicContact CD2-CD2 3.2Å; F722-L755 HydrophobicContact CD2-CG 4.44Å; F722-L755 HydrophobicContact CE1-CD1 4.41Å; F722-L755 HydrophobicContact CE2-CD1 4.21Å; F722-L755 HydrophobicContact CE2-CD2 3.45Å; F722-L755 VanDerWaalsContact CE2-CD2 3.45Å; F722-L755 HydrophobicContact CE2-CG 4.39Å; F722-L755 HydrophobicContact CG-CD2 3.79Å; F722-L755 HydrophobicContact CZ-CD1 4.19Å; F722-L755 HydrophobicContact CZ-CD2 4.24Å; F722-V767 HydrophobicContact CE1-CG1 4.38Å; F722-V767 HydrophobicContact CZ-CG1 4.18Å; F722-F769 AromaticContact CD1-CE1 3.86Å; F722-F769 HydrophobicContact CD1-CE1 3.86Å; F722-F769 AromaticContact CD1-CZ 3.94Å; F722-F769 HydrophobicContact CD1-CZ 3.94Å; F722-F769 HydrophobicContact CE1-CE1 4.08Å; F722-F769 AromaticContact CE1-CZ 3.73Å; F722-F769 HydrophobicContact CE1-CZ 3.73Å
723	Q	90.8	Very high	90.1	Very high	62 Å²	62	41 Å²	41	29%	0.29	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	128.1	175.4	-176.1	-175.7	-2.8	0	0	109.4	A716 W734 F891	A716-Q723 HydrophobicContact CB-CB 4.5Å; A716-Q723 HydrophobicContact CB-CG 4.39Å; Q723-W734 HydrophobicContact CB-CB 4.2Å; Q723-W734 HydrophobicContact CB-CE3 4.43Å; Q723-W734 HydrophobicContact CG-CE3 4.06Å; Q723-W734 PolarHBondContact N-O 3.33Å; Q723-W734 PolarHBondContact O-N 2.97Å; Q723-F891 HydrophobicContact CB-CE1 4.48Å; Q723-F891 HydrophobicContact CG-CD1 3.45Å; Q723-F891 VanDerWaalsContact CG-CD1 3.45Å; Q723-F891 HydrophobicContact CG-CD2 4.33Å; Q723-F891 HydrophobicContact CG-CE1 3.23Å; Q723-F891 HydrophobicContact CG-CE2 4.14Å; Q723-F891 HydrophobicContact CG-CG 3.97Å; Q723-F891 HydrophobicContact CG-CZ 3.59Å; Q723-F891 VanDerWaalsContact NE2-CE2 3.28Å
724	V	93.3	Very high	89.6	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	128.6	175.2	64.4	0	0	0	0	111	G714 I715 F722 V726 I731 T732 L733 M757 F891	G714-V724 WeakPolarHBondContact CA-O 3.38Å; I715-V724 HydrophobicContact CB-CG1 3.69Å; I715-V724 HydrophobicContact CD1-CG1 4.38Å; I715-V724 HydrophobicContact CG1-CG1 4.38Å; I715-V724 HydrophobicContact CG2-CG1 4.49Å; I715-V724 PolarHBondContact N-O 2.96Å; I715-V724 PolarHBondContact O-N 3.27Å; F722-V724 HydrophobicContact CE1-CB 4.35Å; F722-V724 HydrophobicContact CE1-CG1 3.75Å; F722-V724 HydrophobicContact CZ-CB 3.91Å; F722-V724 HydrophobicContact CZ-CG1 3.57Å; V724-V726 HydrophobicContact CG2-CG2 4.24Å; V724-I731 HydrophobicContact CG2-CG2 3.82Å; V724-T732 CarbonylContact C-O 3.42Å; V724-T732 VanDerWaalsContact CA-O 3.31Å; V724-T732 WeakPolarHBondContact CA-O 3.48Å; V724-T732 WeakPolarHBondContact CG2-O 3.49Å; V724-L733 HydrophobicContact CB-CD1 4.2Å; V724-M757 HydrophobicContact CG2-SD 4.2Å; V724-F891 WeakPolarHBondContact O-CZ 3.03Å
725	E	95.5	Very high	88.3	Confident	40 Å²	40	46.2 Å²	46.2	19%	0.187	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	123.2	171.5	-179.2	-177.5	97	0	0	108.4	L713 T727 I731 T732 W734 L890 F891	L713-E725 WeakPolarHBondContact O-CA 3.14Å; E725-T727 HydrophobicContact CG-CG2 4.06Å; E725-I731 CarbonylContact O-C 3.51Å; E725-I731 WeakPolarHBondContact O-CA 3.38Å; E725-T732 PolarHBondContact N-O 2.76Å; E725-T732 PolarHBondContact O-N 2.8Å; E725-W734 HydrophobicContact CB-CH2 3.61Å; E725-W734 HydrophobicContact CB-CZ3 3.41Å; E725-W734 VanDerWaalsContact CB-CZ3 3.41Å; E725-L890 HydrophobicContact CG-CD2 3.94Å; E725-F891 HydrophobicContact CB-CE2 4.04Å; E725-F891 HydrophobicContact CB-CZ 3.95Å
726	V	94.9	Very high	86.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.4	177.8	-172.2	0	0	0	0	107.9	K712 L713 V724 I731 W744 M765 V777 L793	K712-V726 CarbonylContact C-O 3.54Å; K712-V726 VanDerWaalsContact CA-O 3.25Å; K712-V726 WeakPolarHBondContact CA-O 2.99Å; L713-V726 HydrophobicContact CB-CB 4.34Å; L713-V726 PolarHBondContact N-O 2.8Å; L713-V726 PolarHBondContact O-N 2.89Å; V724-V726 HydrophobicContact CG2-CG2 4.24Å; V726-I731 HydrophobicContact CG1-CG1 4.2Å; V726-W744 HydrophobicContact CG1-CH2 3.89Å; V726-W744 HydrophobicContact CG1-CZ2 3.5Å; V726-W744 VanDerWaalsContact CG1-CZ2 3.5Å; V726-M765 HydrophobicContact CG2-CE 3.25Å; V726-M765 HydrophobicContact CG2-SD 4.06Å; V726-V777 HydrophobicContact CG1-CG1 3.86Å; V726-L793 HydrophobicContact CB-CD1 4.36Å; V726-L793 HydrophobicContact CG1-CD1 4Å; V726-L793 HydrophobicContact CG1-CD2 4.33Å; V726-L793 VanDerWaalsContact O-CD1 3.3Å; V726-L793 WeakPolarHBondContact O-CD1 3.39Å
727	T	93.6	Very high	84.7	Confident	12 Å²	12	59.2 Å²	59.2	7%	0.074	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	169.1	173.5	70.3	0	0	0	0	109.3	K712 E725 E729 K730 W744	K712-T727 HydrophobicContact CD-CG2 4.11Å; K712-T727 HydrophobicContact CG-CG2 3.99Å; E725-T727 HydrophobicContact CG-CG2 4.06Å; T727-E729 PolarHBondContact O-N 2.77Å; T727-E729 PolarHBondContact OG1-N 2.81Å; T727-K730 PolarHBondContact N-O 2.78Å; T727-K730 WeakPolarHBondContact OG1-CG 3.26Å; T727-K730 PolarHBondContact OG1-N 2.81Å; T727-K730 PolarHBondContact OG1-O 2.97Å; T727-W744 PolarHBondContact O-NE1 3.28Å
728	T	88.7	Confident	83.6	Confident	32 Å²	32	64 Å²	64	20%	0.196	34%	0.337	C	S	.	.	S	Bend	trans	-65.2	-15.9	175.6	54.6	0	0	0	0	113.7	L779 D791 L793	T728-L779 HydrophobicContact CG2-CD1 4.02Å; T728-D791 HydrophobicContact CG2-CB 3.95Å; T728-D791 WeakPolarHBondContact CG2-O 3.49Å; T728-L793 HydrophobicContact CG2-CD2 4.16Å; T728-L793 HydrophobicContact CG2-CG 4.09Å
729	E	86.3	Confident	83.4	Confident	158 Å²	158	62.7 Å²	62.7	74%	0.738	32%	0.321	S	S	*	.	S	Bend	trans	-105	-40.1	-176.9	-63.5	179.4	179.8	0	0	112.9	T727	T727-E729 PolarHBondContact O-N 2.77Å; T727-E729 PolarHBondContact OG1-N 2.81Å
730	K	90.9	Very high	83.4	Confident	95 Å²	95	59.1 Å²	59.1	41%	0.413	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	158	-172.3	63.5	177.8	-178.3	173.4	0	113	T727 T741 F742	T727-K730 PolarHBondContact N-O 2.78Å; T727-K730 WeakPolarHBondContact OG1-CG 3.26Å; T727-K730 PolarHBondContact OG1-N 2.81Å; T727-K730 PolarHBondContact OG1-O 2.97Å; K730-T741 HydrophobicContact CB-CG2 4.02Å; K730-T741 HydrophobicContact CD-CG2 3.93Å; K730-T741 HydrophobicContact CG-CG2 4.45Å; K730-F742 WeakPolarHBondContact CA-O 3.41Å
731	I	92.9	Very high	83.8	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	119.9	175.3	-59.2	165.5	0	0	0	107.4	V724 E725 V726 T741 F742 W744 I759 M765	V724-I731 HydrophobicContact CG2-CG2 3.82Å; E725-I731 CarbonylContact O-C 3.51Å; E725-I731 WeakPolarHBondContact O-CA 3.38Å; V726-I731 HydrophobicContact CG1-CG1 4.2Å; I731-T741 CarbonylContact O-C 3.52Å; I731-T741 WeakPolarHBondContact O-CA 3.4Å; I731-F742 HydrophobicContact CB-CB 4.38Å; I731-F742 PolarHBondContact N-O 2.77Å; I731-F742 PolarHBondContact O-N 2.71Å; I731-W744 HydrophobicContact CD1-CD2 4.06Å; I731-W744 HydrophobicContact CD1-CE3 4.11Å; I731-W744 HydrophobicContact CD1-CH2 4.22Å; I731-W744 HydrophobicContact CD1-CZ2 4.18Å; I731-W744 HydrophobicContact CD1-CZ3 4.19Å; I731-W744 HydrophobicContact CG1-CZ2 4.22Å; I731-I759 HydrophobicContact CB-CD1 4.39Å; I731-I759 HydrophobicContact CD1-CD1 3.77Å; I731-I759 HydrophobicContact CD1-CG1 3.98Å; I731-I759 HydrophobicContact CD1-CG2 4.09Å; I731-I759 HydrophobicContact CG2-CD1 4.26Å; I731-M765 HydrophobicContact CD1-CB 4.37Å; I731-M765 HydrophobicContact CD1-SD 4.11Å; I731-M765 HydrophobicContact CG2-SD 3.71Å
732	T	91.5	Very high	84.2	Confident	8 Å²	8	56.1 Å²	56.1	5%	0.049	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	120.4	-179	-47.1	0	0	0	0	109.5	V724 E725 W734 P739 S740	V724-T732 CarbonylContact C-O 3.42Å; V724-T732 VanDerWaalsContact CA-O 3.31Å; V724-T732 WeakPolarHBondContact CA-O 3.48Å; V724-T732 WeakPolarHBondContact CG2-O 3.49Å; E725-T732 PolarHBondContact N-O 2.76Å; E725-T732 PolarHBondContact O-N 2.8Å; T732-W734 HydrophobicContact CG2-CD2 4.24Å; T732-W734 HydrophobicContact CG2-CE3 4.21Å; T732-W734 HydrophobicContact CG2-CH2 3.52Å; T732-W734 HydrophobicContact CG2-CZ2 3.53Å; T732-W734 HydrophobicContact CG2-CZ3 3.88Å; T732-W734 WeakPolarHBondContact O-CZ3 3.31Å; T732-P739 HydrophobicContact CG2-CB 4.09Å; T732-S740 CarbonylContact C-O 3.49Å; T732-S740 WeakPolarHBondContact CA-O 3.1Å
733	L	89.6	Confident	84.3	Confident	7 Å²	7	58 Å²	58	4%	0.037	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.6	177.6	175.8	65.6	0	0	0	109.6	F722 V724 N735 P739 S740 F742 V750 M757	F722-L733 HydrophobicContact CD2-CD1 3.69Å; F722-L733 HydrophobicContact CE2-CD1 3.23Å; F722-L733 HydrophobicContact CZ-CD1 4.08Å; V724-L733 HydrophobicContact CB-CD1 4.2Å; L733-N735 HydrophobicContact CD1-CB 4.37Å; L733-N735 HydrophobicContact CD2-CB 4.32Å; L733-N735 HydrophobicContact CG-CB 4.1Å; L733-P739 WeakPolarHBondContact O-CA 3.27Å; L733-S740 PolarHBondContact N-O 3.06Å; L733-S740 PolarHBondContact O-N 3Å; L733-F742 HydrophobicContact CB-CE2 4.05Å; L733-F742 HydrophobicContact CD2-CE2 4.42Å; L733-V750 HydrophobicContact CD2-CG1 4.25Å; L733-V750 HydrophobicContact CD2-CG2 4.4Å; L733-M757 HydrophobicContact CD2-CE 3.9Å
734	W	85.7	Confident	83.9	Confident	79 Å²	79	55.5 Å²	55.5	30%	0.299	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	109.3	166.6	-62.6	-101.8	0	0	0	107.9	Q723 E725 T732 P739 F891	Q723-W734 HydrophobicContact CB-CB 4.2Å; Q723-W734 HydrophobicContact CB-CE3 4.43Å; Q723-W734 HydrophobicContact CG-CE3 4.06Å; Q723-W734 PolarHBondContact N-O 3.33Å; Q723-W734 PolarHBondContact O-N 2.97Å; E725-W734 HydrophobicContact CB-CH2 3.61Å; E725-W734 HydrophobicContact CB-CZ3 3.41Å; E725-W734 VanDerWaalsContact CB-CZ3 3.41Å; T732-W734 HydrophobicContact CG2-CD2 4.24Å; T732-W734 HydrophobicContact CG2-CE3 4.21Å; T732-W734 HydrophobicContact CG2-CH2 3.52Å; T732-W734 HydrophobicContact CG2-CZ2 3.53Å; T732-W734 HydrophobicContact CG2-CZ3 3.88Å; T732-W734 WeakPolarHBondContact O-CZ3 3.31Å; W734-P739 HydrophobicContact CD2-CB 4.49Å; W734-P739 HydrophobicContact CG-CB 4.23Å; W734-F891 HydrophobicContact CZ3-CE2 4.43Å; W734-F891 HydrophobicContact CZ3-CZ 4.41Å
735	N	65.6	Low	83.3	Confident	31 Å²	31	59.7 Å²	59.7	17%	0.166	32%	0.321	C	S	.	.			trans	-146.2	105.5	175.9	-178.9	-5.4	0	0	0	105.4	L733 Q752	L733-N735 HydrophobicContact CD1-CB 4.37Å; L733-N735 HydrophobicContact CD2-CB 4.32Å; L733-N735 HydrophobicContact CG-CB 4.1Å; N735-Q752 PolarHBondContact ND2-OE1 2.9Å; N735-Q752 PolarHBondContact OD1-OE1 2.79Å; N735-Q752 VanDerWaalsContact OD1-OE1 3.14Å
736	R	59	Low	82.1	Confident	183 Å²	183	60.8 Å²	60.8	69%	0.691	33%	0.329	S	S	*	.	S	Bend	trans	70.4	174.9	-167.3	-45.9	174.9	-176.3	-172.1	-2.1	113.4	V738	R736-V738 PolarHBondContact O-N 3.34Å
737	A	53	Low	81.5	Confident	109 Å²	109	65.5 Å²	65.5	90%	0.901	36%	0.358	S	S	*	.	S	Bend	trans	-58.3	-2.8	-161.7	0	0	0	0	0	118.4
738	V	65.5	Low	80.8	Confident	110 Å²	110	66.4 Å²	66.4	67%	0.667	36%	0.363	S	S	*	.	S	Bend	trans	-135.1	127.3	178.7	-174.9	0	0	0	0	110.8	R736	R736-V738 PolarHBondContact O-N 3.34Å
739	P	82.3	Confident	80.5	Confident	65 Å²	65	69 Å²	69	42%	0.422	38%	0.379	S	S	.	.			trans	-70.6	138.1	178	25.7	-31.4	0	0	0	112.7	T732 L733 W734	T732-P739 HydrophobicContact CG2-CB 4.09Å; L733-P739 WeakPolarHBondContact O-CA 3.27Å; W734-P739 HydrophobicContact CD2-CB 4.49Å; W734-P739 HydrophobicContact CG-CB 4.23Å
740	S	84.9	Confident	80.2	Confident	58 Å²	58	63.1 Å²	63.1	41%	0.406	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.7	171.1	-63.1	0	0	0	0	110.1	T732 L733	T732-S740 CarbonylContact C-O 3.49Å; T732-S740 WeakPolarHBondContact CA-O 3.1Å; L733-S740 PolarHBondContact N-O 3.06Å; L733-S740 PolarHBondContact O-N 3Å
741	T	89.3	Confident	79.7	Confident	85 Å²	85	63.7 Å²	63.7	52%	0.521	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.5	178.7	-55	0	0	0	0	110.4	K730 I731	K730-T741 HydrophobicContact CB-CG2 4.02Å; K730-T741 HydrophobicContact CD-CG2 3.93Å; K730-T741 HydrophobicContact CG-CG2 4.45Å; I731-T741 CarbonylContact O-C 3.52Å; I731-T741 WeakPolarHBondContact O-CA 3.4Å
742	F	88.3	Confident	78.6	Confident	38 Å²	38	66.2 Å²	66.2	17%	0.167	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	151.8	-179.7	-51.5	-76.8	0	0	0	111	K730 I731 L733 V748 M757 I759	K730-F742 WeakPolarHBondContact CA-O 3.41Å; I731-F742 HydrophobicContact CB-CB 4.38Å; I731-F742 PolarHBondContact N-O 2.77Å; I731-F742 PolarHBondContact O-N 2.71Å; L733-F742 HydrophobicContact CB-CE2 4.05Å; L733-F742 HydrophobicContact CD2-CE2 4.42Å; F742-V748 HydrophobicContact CD1-CB 4.49Å; F742-V748 HydrophobicContact CD1-CG1 4.31Å; F742-V748 HydrophobicContact CD1-CG2 3.81Å; F742-V748 HydrophobicContact CE1-CG1 3.88Å; F742-V748 HydrophobicContact CE1-CG2 4.12Å; F742-V748 HydrophobicContact CZ-CG1 4.24Å; F742-M757 HydrophobicContact CD2-CE 4.41Å; F742-M757 HydrophobicContact CE2-CE 4.08Å; F742-I759 HydrophobicContact CB-CD1 3.61Å; F742-I759 HydrophobicContact CD2-CD1 3.97Å; F742-I759 HydrophobicContact CG-CD1 3.82Å
743	S	87.9	Confident	77.5	Confident	45 Å²	45	72.8 Å²	72.8	32%	0.315	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	153.7	170.6	-175.8	0	0	0	0	111	L745 D746	S743-L745 PolarHBondContact O-N 3.34Å; S743-L745 PolarHBondContact OG-N 2.77Å; S743-D746 WeakPolarHBondContact CB-OD2 3.37Å; S743-D746 PolarHBondContact N-OD2 2.84Å; S743-D746 WeakPolarHBondContact O-CB 3.35Å; S743-D746 PolarHBondContact O-N 2.79Å
744	W	83.6	Confident	76.6	Confident	10 Å²	10	75 Å²	75	4%	0.038	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-9.5	168.5	-69.4	101.6	0	0	0	114.3	V726 T727 I731 K762 M765 V777 L779 L793	V726-W744 HydrophobicContact CG1-CH2 3.89Å; V726-W744 HydrophobicContact CG1-CZ2 3.5Å; V726-W744 VanDerWaalsContact CG1-CZ2 3.5Å; T727-W744 PolarHBondContact O-NE1 3.28Å; I731-W744 HydrophobicContact CD1-CD2 4.06Å; I731-W744 HydrophobicContact CD1-CE3 4.11Å; I731-W744 HydrophobicContact CD1-CH2 4.22Å; I731-W744 HydrophobicContact CD1-CZ2 4.18Å; I731-W744 HydrophobicContact CD1-CZ3 4.19Å; I731-W744 HydrophobicContact CG1-CZ2 4.22Å; W744-K762 PolarHBondContact O-N 3.12Å; W744-M765 HydrophobicContact CH2-CB 4.45Å; W744-M765 HydrophobicContact CZ3-CB 4.29Å; W744-V777 HydrophobicContact CH2-CG1 4.3Å; W744-L779 HydrophobicContact CB-CD2 4.04Å; W744-L779 HydrophobicContact CD2-CB 3.97Å; W744-L779 HydrophobicContact CD2-CD2 3.78Å; W744-L779 HydrophobicContact CD2-CG 4.41Å; W744-L779 HydrophobicContact CE3-CB 3.94Å; W744-L779 HydrophobicContact CE3-CD2 4.41Å; W744-L779 HydrophobicContact CG-CD2 3.59Å; W744-L779 HydrophobicContact CH2-CB 4Å; W744-L779 HydrophobicContact CZ2-CB 4.02Å; W744-L779 HydrophobicContact CZ3-CB 3.96Å; W744-L793 HydrophobicContact CH2-CD2 4.31Å; W744-L793 HydrophobicContact CZ2-CD2 3.73Å
745	L	79.9	Confident	76.4	Confident	88 Å²	88	71.8 Å²	71.8	46%	0.461	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-10.3	173.6	-65.8	177.7	0	0	0	113.7	S743 R761 K762	S743-L745 PolarHBondContact O-N 3.34Å; S743-L745 PolarHBondContact OG-N 2.77Å; L745-R761 VanDerWaalsContact O-CD 3.3Å; L745-R761 WeakPolarHBondContact O-CD 3.44Å; L745-R761 WeakPolarHBondContact O-CG 3.36Å; L745-R761 PolarHBondContact O-NE 3.16Å; L745-K762 HydrophobicContact CD2-CD 4.21Å; L745-K762 VanDerWaalsContact CD2-CE 3.43Å; L745-K762 HydrophobicContact CD2-CG 3.76Å
746	D	70.6	Confident	77.4	Confident	64 Å²	64	72.3 Å²	72.3	34%	0.342	43%	0.431	S	S	.	.			trans	-82.7	157	-178.5	-58.4	-32.1	0	0	0	110.9	S743 V748	S743-D746 WeakPolarHBondContact CB-OD2 3.37Å; S743-D746 PolarHBondContact N-OD2 2.84Å; S743-D746 WeakPolarHBondContact O-CB 3.35Å; S743-D746 PolarHBondContact O-N 2.79Å; D746-V748 HydrophobicContact CB-CG2 3.86Å
747	T	82.6	Confident	78.9	Confident	99 Å²	99	63.6 Å²	63.6	61%	0.607	40%	0.398	S	S	*	.			trans	-120.5	107	168.3	-56.5	0	0	0	0	107.6	I759 R761	T747-I759 WeakPolarHBondContact CA-O 3.48Å; T747-R761 WeakPolarHBondContact OG1-CB 3.39Å
748	V	78.6	Confident	80.5	Confident	31 Å²	31	62 Å²	62	19%	0.188	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	135.7	-169.5	-176.3	0	0	0	0	109	F742 D746 V750 M758 I759	F742-V748 HydrophobicContact CD1-CB 4.49Å; F742-V748 HydrophobicContact CD1-CG1 4.31Å; F742-V748 HydrophobicContact CD1-CG2 3.81Å; F742-V748 HydrophobicContact CE1-CG1 3.88Å; F742-V748 HydrophobicContact CE1-CG2 4.12Å; F742-V748 HydrophobicContact CZ-CG1 4.24Å; D746-V748 HydrophobicContact CB-CG2 3.86Å; V748-V750 HydrophobicContact CG1-CG2 3.9Å; V748-M758 CarbonylContact O-C 3.54Å; V748-M758 VanDerWaalsContact O-CA 3.32Å; V748-M758 WeakPolarHBondContact O-CA 3.32Å; V748-I759 HydrophobicContact CB-CB 4.42Å; V748-I759 HydrophobicContact CB-CD1 4.33Å; V748-I759 PolarHBondContact N-O 3.49Å; V748-I759 PolarHBondContact O-N 2.97Å
749	T	83.5	Confident	81.6	Confident	87 Å²	87	56.8 Å²	56.8	53%	0.534	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	121.4	169.5	-56.2	0	0	0	0	108.3	T751 M757	T749-T751 HydrophobicContact CG2-CG2 4.19Å; T749-M757 CarbonylContact C-O 3.59Å; T749-M757 WeakPolarHBondContact CA-O 3.4Å
750	V	79.6	Confident	81.4	Confident	33 Å²	33	55.7 Å²	55.7	20%	0.2	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	123.8	177	-176.9	0	0	0	0	107.8	L733 V748 S756 M757	L733-V750 HydrophobicContact CD2-CG1 4.25Å; L733-V750 HydrophobicContact CD2-CG2 4.4Å; V748-V750 HydrophobicContact CG1-CG2 3.9Å; V750-S756 CarbonylContact O-C 3.39Å; V750-S756 WeakPolarHBondContact O-CA 3.47Å; V750-M757 HydrophobicContact CB-CB 4.37Å; V750-M757 HydrophobicContact CB-CE 4.34Å; V750-M757 HydrophobicContact CG2-CE 3.8Å; V750-M757 PolarHBondContact N-O 3.48Å; V750-M757 PolarHBondContact O-N 2.6Å
751	T	80.6	Confident	81.2	Confident	108 Å²	108	60.3 Å²	60.3	66%	0.663	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.1	125.8	178.3	52.6	0	0	0	0	110.3	T749 L755	T749-T751 HydrophobicContact CG2-CG2 4.19Å; T751-L755 WeakPolarHBondContact CA-O 3.3Å
752	Q	70.1	Confident	80.3	Confident	53 Å²	53	62.9 Å²	62.9	25%	0.248	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	126.3	176.3	178.7	175	-11.1	0	0	110.9	N735 G754 L755	N735-Q752 PolarHBondContact ND2-OE1 2.9Å; N735-Q752 PolarHBondContact OD1-OE1 2.79Å; N735-Q752 VanDerWaalsContact OD1-OE1 3.14Å; Q752-G754 VanDerWaalsContact C-N 3.34Å; Q752-G754 PolarHBondContact O-N 2.9Å; Q752-G754 VanDerWaalsContact O-N 3.08Å; Q752-L755 PolarHBondContact N-O 2.84Å; Q752-L755 WeakPolarHBondContact O-CA 3.32Å; Q752-L755 WeakPolarHBondContact O-CB 3.28Å; Q752-L755 PolarHBondContact O-N 3.12Å
753	D	66.6	Low	79.5	Confident	146 Å²	146	67.6 Å²	67.6	78%	0.781	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	36.4	56.5	168.5	-60.1	-30.1	0	0	0	115.2	M720	M720-D753 WeakPolarHBondContact CE-O 3.31Å
754	G	72.1	Confident	79.5	Confident	53 Å²	53	66.6 Å²	66.6	55%	0.546	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	4.1	179.2	0	0	0	0	0	115.1	Q752 F769 G770	Q752-G754 VanDerWaalsContact C-N 3.34Å; Q752-G754 PolarHBondContact O-N 2.9Å; Q752-G754 VanDerWaalsContact O-N 3.08Å; G754-F769 CarbonylContact O-C 3.57Å; G754-G770 WeakPolarHBondContact O-CA 3.27Å; G754-G770 PolarHBondContact O-N 2.97Å
755	L	81.9	Confident	79.8	Confident	11 Å²	11	66.1 Å²	66.1	6%	0.058	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	135.2	169.3	166.3	79.4	0	0	0	109.8	M720 F722 T751 Q752 V767 S768 F769	M720-L755 HydrophobicContact CE-CB 3.7Å; F722-L755 HydrophobicContact CB-CD2 4.36Å; F722-L755 HydrophobicContact CD2-CD1 4.45Å; F722-L755 HydrophobicContact CD2-CD2 3.2Å; F722-L755 HydrophobicContact CD2-CG 4.44Å; F722-L755 HydrophobicContact CE1-CD1 4.41Å; F722-L755 HydrophobicContact CE2-CD1 4.21Å; F722-L755 HydrophobicContact CE2-CD2 3.45Å; F722-L755 VanDerWaalsContact CE2-CD2 3.45Å; F722-L755 HydrophobicContact CE2-CG 4.39Å; F722-L755 HydrophobicContact CG-CD2 3.79Å; F722-L755 HydrophobicContact CZ-CD1 4.19Å; F722-L755 HydrophobicContact CZ-CD2 4.24Å; T751-L755 WeakPolarHBondContact CA-O 3.3Å; Q752-L755 PolarHBondContact N-O 2.84Å; Q752-L755 WeakPolarHBondContact O-CA 3.32Å; Q752-L755 WeakPolarHBondContact O-CB 3.28Å; Q752-L755 PolarHBondContact O-N 3.12Å; L755-V767 HydrophobicContact CD1-CG1 3.95Å; L755-S768 CarbonylContact C-O 3.52Å; L755-S768 WeakPolarHBondContact CA-O 3.44Å; L755-F769 HydrophobicContact CD1-CD1 3.71Å; L755-F769 HydrophobicContact CD1-CE1 3.57Å; L755-F769 HydrophobicContact CD1-CG 4.31Å; L755-F769 HydrophobicContact CD1-CZ 4.04Å
756	S	86.7	Confident	80.3	Confident	42 Å²	42	63.4 Å²	63.4	29%	0.294	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.8	167.3	77.2	0	0	0	0	111.2	V750 V767 S768	V750-S756 CarbonylContact O-C 3.39Å; V750-S756 WeakPolarHBondContact O-CA 3.47Å; S756-V767 CarbonylContact O-C 3.58Å; S756-V767 WeakPolarHBondContact O-CA 3.46Å; S756-S768 PolarHBondContact N-O 3.06Å; S756-S768 PolarHBondContact O-N 3.29Å; S756-S768 WeakPolarHBondContact OG-CB 3.25Å
757	M	89.3	Confident	81.3	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.005	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.6	169.8	178.5	-176.2	81.6	0	0	109.5	V724 L733 F742 T749 V750 I759 M765 V766 V767	V724-M757 HydrophobicContact CG2-SD 4.2Å; L733-M757 HydrophobicContact CD2-CE 3.9Å; F742-M757 HydrophobicContact CD2-CE 4.41Å; F742-M757 HydrophobicContact CE2-CE 4.08Å; T749-M757 CarbonylContact C-O 3.59Å; T749-M757 WeakPolarHBondContact CA-O 3.4Å; V750-M757 HydrophobicContact CB-CB 4.37Å; V750-M757 HydrophobicContact CB-CE 4.34Å; V750-M757 HydrophobicContact CG2-CE 3.8Å; V750-M757 PolarHBondContact N-O 3.48Å; V750-M757 PolarHBondContact O-N 2.6Å; M757-I759 HydrophobicContact CE-CD1 4.34Å; M757-M765 HydrophobicContact CG-CG 4.2Å; M757-M765 HydrophobicContact CG-SD 4.18Å; M757-M765 HydrophobicContact SD-SD 3.94Å; M757-V766 CarbonylContact C-O 3.51Å; M757-V766 VanDerWaalsContact CA-O 3.31Å; M757-V766 WeakPolarHBondContact CA-O 3.47Å; M757-V767 HydrophobicContact CG-CG2 4.1Å
758	M	87.3	Confident	81.6	Confident	76 Å²	76	56.5 Å²	56.5	37%	0.374	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	125.5	178.3	-170.2	178.4	-161	0	0	110.3	V748 M765 V766	V748-M758 CarbonylContact O-C 3.54Å; V748-M758 VanDerWaalsContact O-CA 3.32Å; V748-M758 WeakPolarHBondContact O-CA 3.32Å; M758-M765 CarbonylContact O-C 3.5Å; M758-M765 VanDerWaalsContact O-CA 3.3Å; M758-M765 WeakPolarHBondContact O-CA 3.43Å; M758-V766 HydrophobicContact CB-CB 4.41Å; M758-V766 PolarHBondContact N-O 3.07Å; M758-V766 PolarHBondContact O-N 3.1Å
759	I	88.1	Confident	81.9	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	115.6	171.7	-58.2	170.6	0	0	0	107.4	I731 F742 T747 V748 M757 M765	I731-I759 HydrophobicContact CB-CD1 4.39Å; I731-I759 HydrophobicContact CD1-CD1 3.77Å; I731-I759 HydrophobicContact CD1-CG1 3.98Å; I731-I759 HydrophobicContact CD1-CG2 4.09Å; I731-I759 HydrophobicContact CG2-CD1 4.26Å; F742-I759 HydrophobicContact CB-CD1 3.61Å; F742-I759 HydrophobicContact CD2-CD1 3.97Å; F742-I759 HydrophobicContact CG-CD1 3.82Å; T747-I759 WeakPolarHBondContact CA-O 3.48Å; V748-I759 HydrophobicContact CB-CB 4.42Å; V748-I759 HydrophobicContact CB-CD1 4.33Å; V748-I759 PolarHBondContact N-O 3.49Å; V748-I759 PolarHBondContact O-N 2.97Å; M757-I759 HydrophobicContact CE-CD1 4.34Å; I759-M765 HydrophobicContact CG1-CG 4Å; I759-M765 HydrophobicContact CG1-SD 4.49Å
760	N	78.3	Confident	81.5	Confident	42 Å²	42	53.8 Å²	53.8	23%	0.225	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	116	175.6	-65.7	-49.4	0	0	0	109.5	K762 K763 N764	N760-K762 PolarHBondContact O-N 2.79Å; N760-K763 HydrophobicContact CB-CB 3.99Å; N760-K763 PolarHBondContact O-N 3.41Å; N760-N764 WeakPolarHBondContact CB-O 3.44Å; N760-N764 WeakPolarHBondContact CB-OD1 3.49Å; N760-N764 PolarHBondContact N-O 3.35Å; N760-N764 PolarHBondContact ND2-OD1 2.77Å; N760-N764 PolarHBondContact O-N 2.8Å
761	R	80.6	Confident	80.8	Confident	154 Å²	154	58.4 Å²	58.4	58%	0.581	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.2	123.4	-176.5	178.4	172.3	-165.4	-157.7	2	112.4	L745 T747 K763	L745-R761 VanDerWaalsContact O-CD 3.3Å; L745-R761 WeakPolarHBondContact O-CD 3.44Å; L745-R761 WeakPolarHBondContact O-CG 3.36Å; L745-R761 PolarHBondContact O-NE 3.16Å; T747-R761 WeakPolarHBondContact OG1-CB 3.39Å; R761-K763 PolarHBondContact O-N 3.32Å
762	K	70.6	Confident	80	Confident	139 Å²	139	53.6 Å²	53.6	60%	0.604	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	12.8	-179.9	-61.4	-175.5	175.7	-176.7	0	115.7	W744 L745 N760	W744-K762 PolarHBondContact O-N 3.12Å; L745-K762 HydrophobicContact CD2-CD 4.21Å; L745-K762 VanDerWaalsContact CD2-CE 3.43Å; L745-K762 HydrophobicContact CD2-CG 3.76Å; N760-K762 PolarHBondContact O-N 2.79Å
763	K	71.9	Confident	80.6	Confident	137 Å²	137	51.4 Å²	51.4	60%	0.596	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.3	-71.4	-178.6	-96.3	-174.7	171.7	-177.6	0	111.6	N760 R761	N760-K763 HydrophobicContact CB-CB 3.99Å; N760-K763 PolarHBondContact O-N 3.41Å; R761-K763 PolarHBondContact O-N 3.32Å
764	N	86.3	Confident	81.7	Confident	24 Å²	24	45.8 Å²	45.8	13%	0.128	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.7	170.2	-171.7	58.1	24.4	0	0	0	111.7	N760 V776 V777 V778	N760-N764 WeakPolarHBondContact CB-O 3.44Å; N760-N764 WeakPolarHBondContact CB-OD1 3.49Å; N760-N764 PolarHBondContact N-O 3.35Å; N760-N764 PolarHBondContact ND2-OD1 2.77Å; N760-N764 PolarHBondContact O-N 2.8Å; N764-V776 HydrophobicContact CB-CG1 3.87Å; N764-V777 CarbonylContact C-O 3.59Å; N764-V777 VanDerWaalsContact CA-O 3.28Å; N764-V777 WeakPolarHBondContact CA-O 3Å; N764-V777 WeakPolarHBondContact CB-O 3.47Å; N764-V778 HydrophobicContact CB-CG2 4.08Å
765	M	91.2	Very high	82.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	129.7	166.9	-177.4	-171.7	72.2	0	0	109	V726 I731 W744 M757 M758 I759 V767 V776 V777	V726-M765 HydrophobicContact CG2-CE 3.25Å; V726-M765 HydrophobicContact CG2-SD 4.06Å; I731-M765 HydrophobicContact CD1-CB 4.37Å; I731-M765 HydrophobicContact CD1-SD 4.11Å; I731-M765 HydrophobicContact CG2-SD 3.71Å; W744-M765 HydrophobicContact CH2-CB 4.45Å; W744-M765 HydrophobicContact CZ3-CB 4.29Å; M757-M765 HydrophobicContact CG-CG 4.2Å; M757-M765 HydrophobicContact CG-SD 4.18Å; M757-M765 HydrophobicContact SD-SD 3.94Å; M758-M765 CarbonylContact O-C 3.5Å; M758-M765 VanDerWaalsContact O-CA 3.3Å; M758-M765 WeakPolarHBondContact O-CA 3.43Å; I759-M765 HydrophobicContact CG1-CG 4Å; I759-M765 HydrophobicContact CG1-SD 4.49Å; M765-V767 HydrophobicContact CE-CG2 3.6Å; M765-V767 HydrophobicContact CG-CG2 4.35Å; M765-V767 HydrophobicContact SD-CG2 4.27Å; M765-V776 CarbonylContact O-C 3.57Å; M765-V776 WeakPolarHBondContact O-CA 3.43Å; M765-V777 HydrophobicContact CB-CB 4.48Å; M765-V777 HydrophobicContact CE-CB 4.23Å; M765-V777 HydrophobicContact CE-CG2 3.84Å; M765-V777 PolarHBondContact N-O 2.86Å; M765-V777 PolarHBondContact O-N 2.81Å
766	V	90.5	Very high	82.9	Confident	31 Å²	31	43.4 Å²	43.4	19%	0.188	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.2	176	-169.8	0	0	0	0	108.7	M757 M758 T774 F775 V776	M757-V766 CarbonylContact C-O 3.51Å; M757-V766 VanDerWaalsContact CA-O 3.31Å; M757-V766 WeakPolarHBondContact CA-O 3.47Å; M758-V766 HydrophobicContact CB-CB 4.41Å; M758-V766 PolarHBondContact N-O 3.07Å; M758-V766 PolarHBondContact O-N 3.1Å; V766-T774 HydrophobicContact CG1-CG2 3.78Å; V766-F775 CarbonylContact C-O 3.53Å; V766-F775 WeakPolarHBondContact CA-O 3.19Å; V766-V776 HydrophobicContact CG1-CG2 4.17Å; V766-V776 HydrophobicContact CG2-CG2 4.14Å
767	V	90.3	Very high	83.1	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	122.7	175	-173.8	0	0	0	0	108.2	I715 F722 L755 S756 M757 M765 F769 T774 F775	I715-V767 HydrophobicContact CD1-CG2 4.38Å; F722-V767 HydrophobicContact CE1-CG1 4.38Å; F722-V767 HydrophobicContact CZ-CG1 4.18Å; L755-V767 HydrophobicContact CD1-CG1 3.95Å; S756-V767 CarbonylContact O-C 3.58Å; S756-V767 WeakPolarHBondContact O-CA 3.46Å; M757-V767 HydrophobicContact CG-CG2 4.1Å; M765-V767 HydrophobicContact CE-CG2 3.6Å; M765-V767 HydrophobicContact CG-CG2 4.35Å; M765-V767 HydrophobicContact SD-CG2 4.27Å; V767-F769 HydrophobicContact CG1-CD2 4.33Å; V767-F769 HydrophobicContact CG1-CE2 3.61Å; V767-F769 HydrophobicContact CG1-CZ 3.84Å; V767-T774 WeakPolarHBondContact O-CA 3.24Å; V767-F775 PolarHBondContact N-O 3.27Å; V767-F775 PolarHBondContact O-N 3.39Å
768	S	89.4	Confident	83	Confident	18 Å²	18	41.4 Å²	41.4	13%	0.126	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	132.4	179.6	-50	0	0	0	0	110.6	L755 S756 V773 T774	L755-S768 CarbonylContact C-O 3.52Å; L755-S768 WeakPolarHBondContact CA-O 3.44Å; S756-S768 PolarHBondContact N-O 3.06Å; S756-S768 PolarHBondContact O-N 3.29Å; S756-S768 WeakPolarHBondContact OG-CB 3.25Å; S768-V773 CarbonylContact C-O 3.47Å; S768-V773 WeakPolarHBondContact CA-O 3.33Å; S768-T774 WeakPolarHBondContact OG-CG2 3.29Å; S768-T774 PolarHBondContact OG-OG1 2.85Å; S768-T774 VanDerWaalsContact OG-OG1 3.12Å
769	F	85.8	Confident	82.9	Confident	22 Å²	22	38.7 Å²	38.7	10%	0.096	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	92.9	174	-59.2	-93	0	0	0	108.5	L687 I715 N717 M720 F722 G754 L755 V767 G772 V773 F775	L687-F769 HydrophobicContact CD1-CD2 4.26Å; L687-F769 HydrophobicContact CD1-CE1 4.22Å; L687-F769 HydrophobicContact CD1-CE2 3.68Å; L687-F769 HydrophobicContact CD1-CZ 3.66Å; I715-F769 HydrophobicContact CG2-CE2 4.07Å; I715-F769 HydrophobicContact CG2-CZ 3.83Å; N717-F769 HydrophobicContact CB-CE1 3.94Å; M720-F769 HydrophobicContact SD-CD1 4.06Å; F722-F769 AromaticContact CD1-CE1 3.86Å; F722-F769 HydrophobicContact CD1-CE1 3.86Å; F722-F769 AromaticContact CD1-CZ 3.94Å; F722-F769 HydrophobicContact CD1-CZ 3.94Å; F722-F769 HydrophobicContact CE1-CE1 4.08Å; F722-F769 AromaticContact CE1-CZ 3.73Å; F722-F769 HydrophobicContact CE1-CZ 3.73Å; G754-F769 CarbonylContact O-C 3.57Å; L755-F769 HydrophobicContact CD1-CD1 3.71Å; L755-F769 HydrophobicContact CD1-CE1 3.57Å; L755-F769 HydrophobicContact CD1-CG 4.31Å; L755-F769 HydrophobicContact CD1-CZ 4.04Å; V767-F769 HydrophobicContact CG1-CD2 4.33Å; V767-F769 HydrophobicContact CG1-CE2 3.61Å; V767-F769 HydrophobicContact CG1-CZ 3.84Å; F769-G772 PolarHBondContact O-N 2.83Å; F769-V773 HydrophobicContact CB-CB 4.47Å; F769-V773 PolarHBondContact N-O 3.28Å; F769-V773 PolarHBondContact O-N 3.26Å; F769-F775 HydrophobicContact CD2-CD2 4.36Å; F769-F775 HydrophobicContact CD2-CE2 4.12Å; F769-F775 AromaticContact CE2-CD2 3.99Å; F769-F775 HydrophobicContact CE2-CD2 3.99Å; F769-F775 AromaticContact CE2-CE2 3.9Å; F769-F775 HydrophobicContact CE2-CE2 3.9Å
770	G	73.9	Confident	82.6	Confident	38 Å²	38	39.5 Å²	39.5	39%	0.392	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	-151	178.8	0	0	0	0	0	112.2	G754 G772	G754-G770 WeakPolarHBondContact O-CA 3.27Å; G754-G770 PolarHBondContact O-N 2.97Å; G770-G772 PolarHBondContact O-N 2.81Å
771	D	64.6	Low	82.4	Confident	130 Å²	130	43.5 Å²	43.5	70%	0.695	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	23.3	172.8	-56.6	-26.4	0	0	0	112.2	H801 R802	D771-H801 PolarHBondContact O-CE1 3.18Å; D771-H801 PolarHBondContact O-NE2 3.14Å; D771-R802 PolarHBondContact O-NE 3.16Å
772	G	64.4	Low	81.8	Confident	7 Å²	7	37.6 Å²	37.6	7%	0.072	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.5	-30.9	-162.7	0	0	0	0	0	117.4	F769 G770 R802	F769-G772 PolarHBondContact O-N 2.83Å; G770-G772 PolarHBondContact O-N 2.81Å; G772-R802 PolarHBondContact O-N 3.31Å
773	V	83.5	Confident	81.2	Confident	8 Å²	8	39 Å²	39	5%	0.048	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	128.4	-173.9	-168.5	0	0	0	0	110.8	L687 S768 F769 F775 D799 M803	L687-V773 HydrophobicContact CD2-CG1 4.34Å; S768-V773 CarbonylContact C-O 3.47Å; S768-V773 WeakPolarHBondContact CA-O 3.33Å; F769-V773 HydrophobicContact CB-CB 4.47Å; F769-V773 PolarHBondContact N-O 3.28Å; F769-V773 PolarHBondContact O-N 3.26Å; V773-F775 HydrophobicContact CG1-CD1 4.42Å; V773-F775 HydrophobicContact CG1-CD2 4.41Å; V773-F775 HydrophobicContact CG1-CE1 3.62Å; V773-F775 HydrophobicContact CG1-CE2 3.61Å; V773-F775 HydrophobicContact CG1-CZ 3.16Å; V773-D799 WeakPolarHBondContact CA-O 3.35Å; V773-M803 HydrophobicContact CB-SD 4.19Å; V773-M803 HydrophobicContact CG1-CG 4.35Å; V773-M803 HydrophobicContact CG1-SD 3.76Å; V773-M803 HydrophobicContact CG2-CG 3.82Å; V773-M803 HydrophobicContact CG2-SD 3.29Å; V773-M803 WeakPolarHBondContact CG2-SD 3.44Å
774	T	88.8	Confident	80.3	Confident	28 Å²	28	42.3 Å²	42.3	17%	0.172	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	129.3	175.9	-62.5	0	0	0	0	111.5	V766 V767 S768 V798 D799	V766-T774 HydrophobicContact CG1-CG2 3.78Å; V767-T774 WeakPolarHBondContact O-CA 3.24Å; S768-T774 WeakPolarHBondContact OG-CG2 3.29Å; S768-T774 PolarHBondContact OG-OG1 2.85Å; S768-T774 VanDerWaalsContact OG-OG1 3.12Å; T774-V798 HydrophobicContact CG2-CB 4.07Å; T774-V798 HydrophobicContact CG2-CG1 4.49Å; T774-V798 HydrophobicContact CG2-CG2 4.44Å; T774-V798 PolarHBondContact O-N 3.38Å; T774-D799 PolarHBondContact N-O 2.99Å; T774-D799 PolarHBondContact O-N 3.15Å
775	F	90.2	Very high	78.7	Confident	1 Å²	1	50.3 Å²	50.3	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	146.6	175.9	-53.3	-56.2	0	0	0	111.4	I680 L687 V689 V766 V767 F769 V773 F795 Y796 V797	I680-F775 HydrophobicContact CD1-CE1 3.67Å; I680-F775 HydrophobicContact CD1-CZ 3.88Å; L687-F775 HydrophobicContact CD1-CE2 4.27Å; L687-F775 HydrophobicContact CD2-CE2 3.63Å; L687-F775 HydrophobicContact CD2-CZ 3.68Å; L687-F775 HydrophobicContact CG-CE2 4.48Å; V689-F775 HydrophobicContact CG2-CE2 4.41Å; V766-F775 CarbonylContact C-O 3.53Å; V766-F775 WeakPolarHBondContact CA-O 3.19Å; V767-F775 PolarHBondContact N-O 3.27Å; V767-F775 PolarHBondContact O-N 3.39Å; F769-F775 HydrophobicContact CD2-CD2 4.36Å; F769-F775 HydrophobicContact CD2-CE2 4.12Å; F769-F775 AromaticContact CE2-CD2 3.99Å; F769-F775 HydrophobicContact CE2-CD2 3.99Å; F769-F775 AromaticContact CE2-CE2 3.9Å; F769-F775 HydrophobicContact CE2-CE2 3.9Å; V773-F775 HydrophobicContact CG1-CD1 4.42Å; V773-F775 HydrophobicContact CG1-CD2 4.41Å; V773-F775 HydrophobicContact CG1-CE1 3.62Å; V773-F775 HydrophobicContact CG1-CE2 3.61Å; V773-F775 HydrophobicContact CG1-CZ 3.16Å; F775-F795 HydrophobicContact CB-CE2 3.87Å; F775-F795 HydrophobicContact CB-CZ 4.12Å; F775-F795 HydrophobicContact CD1-CE1 4.32Å; F775-F795 HydrophobicContact CD1-CE2 4.16Å; F775-F795 AromaticContact CD1-CZ 3.52Å; F775-F795 HydrophobicContact CD1-CZ 3.52Å; F775-F795 HydrophobicContact CD2-CZ 4.44Å; F775-F795 AromaticContact CE1-CZ 4Å; F775-F795 HydrophobicContact CE1-CZ 4Å; F775-F795 AromaticContact CG-CE2 3.96Å; F775-F795 HydrophobicContact CG-CE2 3.96Å; F775-F795 AromaticContact CG-CZ 3.76Å; F775-F795 HydrophobicContact CG-CZ 3.76Å; F775-Y796 CarbonylContact C-O 3.45Å; F775-Y796 WeakPolarHBondContact CA-O 3.3Å; F775-V797 HydrophobicContact CD1-CB 4.48Å; F775-V797 HydrophobicContact CD1-CG1 4.34Å; F775-V797 HydrophobicContact CD1-CG2 4.15Å; F775-V797 HydrophobicContact CE1-CG1 4.16Å; F775-V797 HydrophobicContact CE1-CG2 4.16Å
776	V	89.8	Confident	77.2	Confident	13 Å²	13	51.9 Å²	51.9	8%	0.079	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	126.7	172.7	176.9	0	0	0	0	108.8	N764 M765 V766 V778 Y796 V798	N764-V776 HydrophobicContact CB-CG1 3.87Å; M765-V776 CarbonylContact O-C 3.57Å; M765-V776 WeakPolarHBondContact O-CA 3.43Å; V766-V776 HydrophobicContact CG1-CG2 4.17Å; V766-V776 HydrophobicContact CG2-CG2 4.14Å; V776-V778 HydrophobicContact CG1-CG2 3.99Å; V776-Y796 PolarHBondContact N-O 3.44Å; V776-Y796 PolarHBondContact O-N 3.21Å; V776-V798 HydrophobicContact CB-CG2 4.2Å; V776-V798 HydrophobicContact CG2-CG2 3.4Å; V776-V798 VanDerWaalsContact CG2-CG2 3.4Å
777	V	89.4	Confident	75.3	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	120.7	172.1	-171.8	0	0	0	0	108.9	L713 I715 V726 W744 N764 M765 L793 G794 F795	L713-V777 HydrophobicContact CD1-CG1 3.61Å; L713-V777 HydrophobicContact CD1-CG2 4.19Å; I715-V777 HydrophobicContact CD1-CG2 4.36Å; V726-V777 HydrophobicContact CG1-CG1 3.86Å; W744-V777 HydrophobicContact CH2-CG1 4.3Å; N764-V777 CarbonylContact C-O 3.59Å; N764-V777 VanDerWaalsContact CA-O 3.28Å; N764-V777 WeakPolarHBondContact CA-O 3Å; N764-V777 WeakPolarHBondContact CB-O 3.47Å; M765-V777 HydrophobicContact CB-CB 4.48Å; M765-V777 HydrophobicContact CE-CB 4.23Å; M765-V777 HydrophobicContact CE-CG2 3.84Å; M765-V777 PolarHBondContact N-O 2.86Å; M765-V777 PolarHBondContact O-N 2.81Å; V777-L793 HydrophobicContact CG1-CB 4.37Å; V777-L793 HydrophobicContact CG1-CD2 4.39Å; V777-G794 CarbonylContact C-O 3.51Å; V777-G794 VanDerWaalsContact CA-O 3.29Å; V777-G794 WeakPolarHBondContact CA-O 3.44Å; V777-F795 HydrophobicContact CG2-CD2 4.09Å
778	V	87.2	Confident	73.8	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	134	-179.5	-177.7	0	0	0	0	109.4	N764 V776 L793 G794 Y796 A859	N764-V778 HydrophobicContact CB-CG2 4.08Å; V776-V778 HydrophobicContact CG1-CG2 3.99Å; V778-L793 WeakPolarHBondContact O-CA 3.42Å; V778-G794 PolarHBondContact N-O 2.82Å; V778-G794 PolarHBondContact O-N 2.6Å; V778-Y796 HydrophobicContact CB-CD2 4.46Å; V778-Y796 HydrophobicContact CB-CE2 3.86Å; V778-Y796 HydrophobicContact CG2-CD2 3.74Å; V778-Y796 HydrophobicContact CG2-CE2 3.48Å; V778-Y796 VanDerWaalsContact CG2-CE2 3.48Å; V778-A859 HydrophobicContact CG1-CB 4.01Å
779	L	86.4	Confident	72.7	Confident	18 Å²	18	56.7 Å²	56.7	9%	0.094	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	117.6	170.8	177	65.8	0	0	0	109.7	T728 W744 Q781 L793	T728-L779 HydrophobicContact CG2-CD1 4.02Å; W744-L779 HydrophobicContact CB-CD2 4.04Å; W744-L779 HydrophobicContact CD2-CB 3.97Å; W744-L779 HydrophobicContact CD2-CD2 3.78Å; W744-L779 HydrophobicContact CD2-CG 4.41Å; W744-L779 HydrophobicContact CE3-CB 3.94Å; W744-L779 HydrophobicContact CE3-CD2 4.41Å; W744-L779 HydrophobicContact CG-CD2 3.59Å; W744-L779 HydrophobicContact CH2-CB 4Å; W744-L779 HydrophobicContact CZ2-CB 4.02Å; W744-L779 HydrophobicContact CZ3-CB 3.96Å; L779-Q781 HydrophobicContact CD2-CG 3.65Å; L779-Q781 HydrophobicContact CG-CG 3.77Å; L779-L793 HydrophobicContact CD1-CD2 3.9Å
780	H	81.4	Confident	72.1	Confident	17 Å²	17	62.6 Å²	62.6	8%	0.079	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	103.5	171.8	-63.5	-78.2	0	0	0	109.5	D791 F792 Y855	H780-D791 VanDerWaalsContact O-CA 3.31Å; H780-D791 WeakPolarHBondContact O-CA 3.35Å; H780-F792 HydrophobicContact CB-CD1 3.83Å; H780-F792 HydrophobicContact CB-CD2 3.98Å; H780-F792 HydrophobicContact CB-CE1 3.51Å; H780-F792 HydrophobicContact CB-CE2 3.68Å; H780-F792 HydrophobicContact CB-CG 4.05Å; H780-F792 HydrophobicContact CB-CZ 3.44Å; H780-F792 VanDerWaalsContact CB-CZ 3.44Å; H780-F792 AromaticContact CD2-CD2 3.7Å; H780-F792 AromaticContact CD2-CE2 3.26Å; H780-F792 WeakPolarHBondContact CD2-CE2 3.38Å; H780-F792 AromaticContact CD2-CZ 3.84Å; H780-F792 AromaticContact CG-CE2 3.47Å; H780-F792 VanDerWaalsContact CG-CE2 3.47Å; H780-F792 AromaticContact CG-CZ 3.52Å; H780-F792 PolarHBondContact N-O 2.87Å; H780-F792 PolarHBondContact O-N 2.78Å; H780-Y855 AromaticContact CE1-CD1 3.7Å; H780-Y855 AromaticContact CE1-CD2 3.47Å; H780-Y855 VanDerWaalsContact CE1-CD2 3.47Å; H780-Y855 WeakPolarHBondContact CE1-CD2 3.49Å; H780-Y855 AromaticContact CE1-CE1 3.87Å; H780-Y855 AromaticContact CE1-CE2 3.62Å; H780-Y855 AromaticContact CE1-CG 3.48Å; H780-Y855 VanDerWaalsContact CE1-CG 3.48Å; H780-Y855 AromaticContact CE1-CZ 3.8Å
781	Q	73.7	Confident	72.5	Confident	127 Å²	127	63.7 Å²	63.7	59%	0.593	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-86.9	118.7	179.2	-63.1	-169.5	-44.2	0	0	110.4	L779	L779-Q781 HydrophobicContact CD2-CG 3.65Å; L779-Q781 HydrophobicContact CG-CG 3.77Å
782	V	67.5	Low	73.6	Confident	29 Å²	29	58.8 Å²	58.8	18%	0.176	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-95.2	142.8	176.6	178.5	0	0	0	0	108.5	K784 H786 H789 R790 D791 F792	V782-K784 PolarHBondContact O-N 3.08Å; V782-H786 HydrophobicContact CG1-CB 3.3Å; V782-H789 HydrophobicContact CB-CB 4.46Å; V782-H789 HydrophobicContact CG1-CB 3.79Å; V782-H789 HydrophobicContact CG2-CB 3.91Å; V782-R790 VanDerWaalsContact CG2-O 3.27Å; V782-R790 WeakPolarHBondContact CG2-O 3.39Å; V782-D791 PolarHBondContact N-OD1 3.05Å; V782-F792 HydrophobicContact CG2-CE1 4.5Å
783	W	58	Low	74.6	Confident	168 Å²	168	58.6 Å²	58.6	64%	0.636	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-55.5	137.9	-179.6	76.2	62.8	0	0	0	111.1	K785 H786	W783-K785 VanDerWaalsContact NE1-C 3.29Å; W783-K785 PolarHBondContact NE1-O 3.35Å; W783-K785 PolarHBondContact O-N 2.92Å; W783-H786 VanDerWaalsContact CD1-CA 3.44Å; W783-H786 HydrophobicContact CD2-CB 4.21Å; W783-H786 AromaticContact CD2-CD2 3.6Å; W783-H786 AromaticContact CE2-CD2 3.3Å; W783-H786 AromaticContact CE2-CG 3.69Å; W783-H786 AromaticContact CE3-CD2 3.94Å; W783-H786 HydrophobicContact CG-CB 4.06Å; W783-H786 AromaticContact CH2-CD2 3.67Å; W783-H786 AromaticContact CH2-NE2 3.75Å; W783-H786 HydrophobicContact CZ2-CB 4.37Å; W783-H786 AromaticContact CZ2-CD2 3.31Å; W783-H786 WeakPolarHBondContact CZ2-CD2 3.37Å; W783-H786 AromaticContact CZ2-CG 3.86Å; W783-H786 AromaticContact CZ2-NE2 3.69Å; W783-H786 AromaticContact CZ3-CD2 3.98Å; W783-H786 AromaticContact NE1-CD2 3.95Å; W783-H786 AromaticContact NE1-CG 3.89Å; W783-H786 WeakPolarHBondContact O-CB 3.32Å; W783-H786 PolarHBondContact O-N 2.76Å
784	K	53.9	Low	74.8	Confident	207 Å²	207	58.7 Å²	58.7	90%	0.9	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-33.8	-168.2	-78	-176	174.8	-179.6	0	114.6	V782	V782-K784 PolarHBondContact O-N 3.08Å
785	K	53.1	Low	74.8	Confident	193 Å²	193	58.5 Å²	58.5	84%	0.839	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	20.4	178.2	-63.2	-173.2	179	179.5	0	115.2	W783	W783-K785 VanDerWaalsContact NE1-C 3.29Å; W783-K785 PolarHBondContact NE1-O 3.35Å; W783-K785 PolarHBondContact O-N 2.92Å
786	H	58.8	Low	74.6	Confident	33 Å²	33	60.1 Å²	60.1	15%	0.153	28%	0.275	C	S	.	.			trans	-67	127.5	-174.9	-161.5	-61	0	0	0	111.3	K697 V782 W783 V788 H789	K697-H786 WeakPolarHBondContact CD-O 3.47Å; K697-H786 PolarHBondContact NZ-O 2.81Å; V782-H786 HydrophobicContact CG1-CB 3.3Å; W783-H786 VanDerWaalsContact CD1-CA 3.44Å; W783-H786 HydrophobicContact CD2-CB 4.21Å; W783-H786 AromaticContact CD2-CD2 3.6Å; W783-H786 AromaticContact CE2-CD2 3.3Å; W783-H786 AromaticContact CE2-CG 3.69Å; W783-H786 AromaticContact CE3-CD2 3.94Å; W783-H786 HydrophobicContact CG-CB 4.06Å; W783-H786 AromaticContact CH2-CD2 3.67Å; W783-H786 AromaticContact CH2-NE2 3.75Å; W783-H786 HydrophobicContact CZ2-CB 4.37Å; W783-H786 AromaticContact CZ2-CD2 3.31Å; W783-H786 WeakPolarHBondContact CZ2-CD2 3.37Å; W783-H786 AromaticContact CZ2-CG 3.86Å; W783-H786 AromaticContact CZ2-NE2 3.69Å; W783-H786 AromaticContact CZ3-CD2 3.98Å; W783-H786 AromaticContact NE1-CD2 3.95Å; W783-H786 AromaticContact NE1-CG 3.89Å; W783-H786 WeakPolarHBondContact O-CB 3.32Å; W783-H786 PolarHBondContact O-N 2.76Å; H786-V788 PolarHBondContact ND1-N 2.75Å; H786-V788 PolarHBondContact O-N 2.89Å; H786-V788 VanDerWaalsContact O-N 3.12Å; H786-H789 AromaticContact CE1-CD2 3.27Å; H786-H789 PolarHBondContact CE1-CD2 3.37Å; H786-H789 AromaticContact ND1-CD2 3.85Å; H786-H789 PolarHBondContact ND1-N 2.98Å; H786-H789 VanDerWaalsContact ND1-N 3.19Å; H786-H789 AromaticContact NE2-CD2 3.64Å
787	P	50.9	Low	74.4	Confident	74 Å²	74	60.8 Å²	60.8	48%	0.481	28%	0.279	S	S	.	.	S	Bend	trans	-74.1	0.9	-172.3	27.8	-35.8	0	0	0	114.7	R698	R698-P787 PolarHBondContact NE-O 2.84Å
788	V	59.3	Low	74.1	Confident	27 Å²	27	64.8 Å²	64.8	16%	0.164	30%	0.304	C	S	.	.	S	Bend	trans	-145	-60	-167.6	-174.7	0	0	0	0	110.8	K697 H786	K697-V788 WeakPolarHBondContact CB-O 3.38Å; K697-V788 PolarHBondContact N-O 2.92Å; H786-V788 PolarHBondContact ND1-N 2.75Å; H786-V788 PolarHBondContact O-N 2.89Å; H786-V788 VanDerWaalsContact O-N 3.12Å
789	H	65.3	Low	73.8	Confident	50 Å²	50	67.4 Å²	67.4	23%	0.231	32%	0.317	C	S	.	.			trans	-85	153.2	-174.3	-56.8	-70.2	0	0	0	113.4	K697 Y709 V782 H786	K697-H789 WeakPolarHBondContact CE-O 3.29Å; K697-H789 PolarHBondContact NZ-O 3.17Å; Y709-H789 AromaticContact CZ-ND1 3.78Å; Y709-H789 PolarHBondContact OH-CE1 2.8Å; Y709-H789 PolarHBondContact OH-ND1 2.78Å; V782-H789 HydrophobicContact CB-CB 4.46Å; V782-H789 HydrophobicContact CG1-CB 3.79Å; V782-H789 HydrophobicContact CG2-CB 3.91Å; H786-H789 AromaticContact CE1-CD2 3.27Å; H786-H789 PolarHBondContact CE1-CD2 3.37Å; H786-H789 AromaticContact ND1-CD2 3.85Å; H786-H789 PolarHBondContact ND1-N 2.98Å; H786-H789 VanDerWaalsContact ND1-N 3.19Å; H786-H789 AromaticContact NE2-CD2 3.64Å
790	R	74.8	Confident	73.5	Confident	146 Å²	146	68 Å²	68	55%	0.551	32%	0.323	S	S	*	.			trans	-116.5	162.9	169.1	-54.8	-173.7	86.4	167.7	2.3	108	K697 V782 F792	K697-R790 HydrophobicContact CD-CG 4.15Å; K697-R790 HydrophobicContact CG-CG 3.32Å; V782-R790 VanDerWaalsContact CG2-O 3.27Å; V782-R790 WeakPolarHBondContact CG2-O 3.39Å; R790-F792 WeakPolarHBondContact O-CD1 3.19Å
791	D	82.6	Confident	73.3	Confident	61 Å²	61	72.6 Å²	72.6	33%	0.326	35%	0.345	S	S	.	.			trans	-56	142.5	169.4	-60.4	-12.8	0	0	0	109.7	T728 H780 V782	T728-D791 HydrophobicContact CG2-CB 3.95Å; T728-D791 WeakPolarHBondContact CG2-O 3.49Å; H780-D791 VanDerWaalsContact O-CA 3.31Å; H780-D791 WeakPolarHBondContact O-CA 3.35Å; V782-D791 PolarHBondContact N-OD1 3.05Å
792	F	85.9	Confident	73.2	Confident	27 Å²	27	73.9 Å²	73.9	12%	0.118	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	169.2	179.9	66.7	-87.1	0	0	0	111.4	Y709 H780 V782 R790	Y709-F792 HydrophobicContact CD1-CB 4.36Å; Y709-F792 HydrophobicContact CD1-CD1 4.02Å; Y709-F792 AromaticContact CD1-CD2 3.92Å; Y709-F792 HydrophobicContact CD1-CD2 3.92Å; Y709-F792 HydrophobicContact CD1-CE1 4.26Å; Y709-F792 HydrophobicContact CD1-CE2 4.17Å; Y709-F792 AromaticContact CD1-CG 3.84Å; Y709-F792 HydrophobicContact CD1-CG 3.84Å; Y709-F792 HydrophobicContact CD1-CZ 4.33Å; Y709-F792 HydrophobicContact CE1-CD1 4.45Å; Y709-F792 HydrophobicContact CE1-CE1 4.37Å; Y709-F792 HydrophobicContact CG-CB 4.02Å; Y709-F792 HydrophobicContact CG-CD1 4.34Å; Y709-F792 HydrophobicContact CG-CD2 4.39Å; Y709-F792 HydrophobicContact CG-CG 4.01Å; H780-F792 HydrophobicContact CB-CD1 3.83Å; H780-F792 HydrophobicContact CB-CD2 3.98Å; H780-F792 HydrophobicContact CB-CE1 3.51Å; H780-F792 HydrophobicContact CB-CE2 3.68Å; H780-F792 HydrophobicContact CB-CG 4.05Å; H780-F792 HydrophobicContact CB-CZ 3.44Å; H780-F792 VanDerWaalsContact CB-CZ 3.44Å; H780-F792 AromaticContact CD2-CD2 3.7Å; H780-F792 AromaticContact CD2-CE2 3.26Å; H780-F792 WeakPolarHBondContact CD2-CE2 3.38Å; H780-F792 AromaticContact CD2-CZ 3.84Å; H780-F792 AromaticContact CG-CE2 3.47Å; H780-F792 VanDerWaalsContact CG-CE2 3.47Å; H780-F792 AromaticContact CG-CZ 3.52Å; H780-F792 PolarHBondContact N-O 2.87Å; H780-F792 PolarHBondContact O-N 2.78Å; V782-F792 HydrophobicContact CG2-CE1 4.5Å; R790-F792 WeakPolarHBondContact O-CD1 3.19Å
793	L	87.1	Confident	73.9	Confident	3 Å²	3	73.1 Å²	73.1	2%	0.016	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	133.7	-178.2	-58.4	176	0	0	0	110.6	F710 L713 V726 T728 W744 V777 V778 L779	F710-L793 HydrophobicContact CB-CB 4.46Å; F710-L793 PolarHBondContact O-N 3.32Å; L713-L793 HydrophobicContact CD1-CB 3.99Å; L713-L793 HydrophobicContact CD1-CD1 4.15Å; L713-L793 HydrophobicContact CG-CD1 4.25Å; V726-L793 HydrophobicContact CB-CD1 4.36Å; V726-L793 HydrophobicContact CG1-CD1 4Å; V726-L793 HydrophobicContact CG1-CD2 4.33Å; V726-L793 VanDerWaalsContact O-CD1 3.3Å; V726-L793 WeakPolarHBondContact O-CD1 3.39Å; T728-L793 HydrophobicContact CG2-CD2 4.16Å; T728-L793 HydrophobicContact CG2-CG 4.09Å; W744-L793 HydrophobicContact CH2-CD2 4.31Å; W744-L793 HydrophobicContact CZ2-CD2 3.73Å; V777-L793 HydrophobicContact CG1-CB 4.37Å; V777-L793 HydrophobicContact CG1-CD2 4.39Å; V778-L793 WeakPolarHBondContact O-CA 3.42Å; L779-L793 HydrophobicContact CD1-CD2 3.9Å
794	G	87.1	Confident	75.3	Confident	9 Å²	9	66 Å²	66	9%	0.093	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	134.4	165	0	0	0	0	0	110	V777 V778	V777-G794 CarbonylContact C-O 3.51Å; V777-G794 VanDerWaalsContact CA-O 3.29Å; V777-G794 WeakPolarHBondContact CA-O 3.44Å; V778-G794 PolarHBondContact N-O 2.82Å; V778-G794 PolarHBondContact O-N 2.6Å
795	F	88.2	Confident	76.8	Confident	25 Å²	25	60.2 Å²	60.2	11%	0.11	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	123.5	176.1	178.1	-97.8	0	0	0	109.8	L679 I680 V689 L713 I715 F775 V777 V797 L811	L679-F795 HydrophobicContact CD1-CD1 4.35Å; I680-F795 HydrophobicContact CD1-CE1 3.82Å; I680-F795 HydrophobicContact CD1-CZ 3.9Å; V689-F795 HydrophobicContact CB-CZ 4.5Å; V689-F795 HydrophobicContact CG1-CD2 4.45Å; V689-F795 HydrophobicContact CG1-CE1 4.37Å; V689-F795 HydrophobicContact CG1-CE2 3.89Å; V689-F795 HydrophobicContact CG1-CZ 3.84Å; V689-F795 HydrophobicContact CG2-CZ 4.27Å; L713-F795 HydrophobicContact CD1-CB 3.89Å; L713-F795 HydrophobicContact CD1-CD2 4.18Å; L713-F795 HydrophobicContact CD1-CG 4.46Å; L713-F795 HydrophobicContact CD2-CB 4.28Å; I715-F795 HydrophobicContact CD1-CE2 4.24Å; F775-F795 HydrophobicContact CB-CE2 3.87Å; F775-F795 HydrophobicContact CB-CZ 4.12Å; F775-F795 HydrophobicContact CD1-CE1 4.32Å; F775-F795 HydrophobicContact CD1-CE2 4.16Å; F775-F795 AromaticContact CD1-CZ 3.52Å; F775-F795 HydrophobicContact CD1-CZ 3.52Å; F775-F795 HydrophobicContact CD2-CZ 4.44Å; F775-F795 AromaticContact CE1-CZ 4Å; F775-F795 HydrophobicContact CE1-CZ 4Å; F775-F795 AromaticContact CG-CE2 3.96Å; F775-F795 HydrophobicContact CG-CE2 3.96Å; F775-F795 AromaticContact CG-CZ 3.76Å; F775-F795 HydrophobicContact CG-CZ 3.76Å; V777-F795 HydrophobicContact CG2-CD2 4.09Å; F795-V797 HydrophobicContact CE1-CG2 3.93Å; F795-L811 HydrophobicContact CD1-CD1 3.86Å; F795-L811 HydrophobicContact CE1-CD1 4.03Å
796	Y	86.5	Confident	78.5	Confident	34 Å²	34	57.3 Å²	57.3	13%	0.133	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	137	-174.1	-57.2	-85.5	0	0	0	111.4	F775 V776 V778 Y855 R856	F775-Y796 CarbonylContact C-O 3.45Å; F775-Y796 WeakPolarHBondContact CA-O 3.3Å; V776-Y796 PolarHBondContact N-O 3.44Å; V776-Y796 PolarHBondContact O-N 3.21Å; V778-Y796 HydrophobicContact CB-CD2 4.46Å; V778-Y796 HydrophobicContact CB-CE2 3.86Å; V778-Y796 HydrophobicContact CG2-CD2 3.74Å; V778-Y796 HydrophobicContact CG2-CE2 3.48Å; V778-Y796 VanDerWaalsContact CG2-CE2 3.48Å; Y796-Y855 WeakPolarHBondContact OH-CB 3.42Å; Y796-Y855 WeakPolarHBondContact OH-CD2 3.42Å; Y796-R856 HydrophobicContact CD1-CG 3.36Å; Y796-R856 HydrophobicContact CE1-CG 4.21Å; Y796-R856 HydrophobicContact CG-CG 3.54Å
797	V	85.6	Confident	80.1	Confident	27 Å²	27	56.2 Å²	56.2	16%	0.164	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	117.2	173.9	-173.4	0	0	0	0	107.1	I680 F775 F795 F815	I680-V797 HydrophobicContact CD1-CG2 4.41Å; F775-V797 HydrophobicContact CD1-CB 4.48Å; F775-V797 HydrophobicContact CD1-CG1 4.34Å; F775-V797 HydrophobicContact CD1-CG2 4.15Å; F775-V797 HydrophobicContact CE1-CG1 4.16Å; F775-V797 HydrophobicContact CE1-CG2 4.16Å; F795-V797 HydrophobicContact CE1-CG2 3.93Å; V797-F815 HydrophobicContact CB-CE1 4.37Å; V797-F815 HydrophobicContact CB-CZ 4.29Å; V797-F815 HydrophobicContact CG1-CE1 4.05Å; V797-F815 HydrophobicContact CG1-CZ 3.83Å; V797-F815 HydrophobicContact CG2-CE1 3.92Å; V797-F815 HydrophobicContact CG2-CZ 3.62Å
798	V	83	Confident	82.1	Confident	85 Å²	85	56.4 Å²	56.4	52%	0.515	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	-42.2	179.3	177.1	0	0	0	0	110	T774 V776	T774-V798 HydrophobicContact CG2-CB 4.07Å; T774-V798 HydrophobicContact CG2-CG1 4.49Å; T774-V798 HydrophobicContact CG2-CG2 4.44Å; T774-V798 PolarHBondContact O-N 3.38Å; V776-V798 HydrophobicContact CB-CG2 4.2Å; V776-V798 HydrophobicContact CG2-CG2 3.4Å; V776-V798 VanDerWaalsContact CG2-CG2 3.4Å
799	D	81.4	Confident	83.7	Confident	55 Å²	55	55.2 Å²	55.2	29%	0.294	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	134.1	179.5	-166.2	-2.1	0	0	0	110.2	V773 T774 H801	V773-D799 WeakPolarHBondContact CA-O 3.35Å; T774-D799 PolarHBondContact N-O 2.99Å; T774-D799 PolarHBondContact O-N 3.15Å; D799-H801 IonicContact OD1-CE1 2.7Å; D799-H801 IonicContact OD1-CG 3.58Å; D799-H801 PolarHBondContact OD1-N 3.46Å; D799-H801 IonicContact OD1-ND1 3.91Å; D799-H801 PolarHBondContact OD1-ND1 3.42Å; D799-H801 IonicContact OD2-CE1 4Å; D799-H801 PolarHBondContact OD2-CE1 3.33Å; D799-H801 IonicContact OD2-ND1 2.71Å; D799-H801 PolarHBondContact OD2-ND1 2.96Å
800	S	80.5	Confident	84.9	Confident	31 Å²	31	52.9 Å²	52.9	22%	0.217	27%	0.267	C	S	.	.			trans	-136.7	11.6	178.7	62.7	0	0	0	0	112.6	R802 M803	S800-R802 PolarHBondContact O-N 2.86Å; S800-M803 WeakPolarHBondContact O-CB 3.47Å; S800-M803 WeakPolarHBondContact O-CG 3.33Å; S800-M803 PolarHBondContact O-N 3.12Å
801	H	75.4	Confident	85.6	Confident	114 Å²	114	46.6 Å²	46.6	53%	0.528	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-14.4	-168	75.3	-81.1	0	0	0	114.9	D771 D799	D771-H801 PolarHBondContact O-CE1 3.18Å; D771-H801 PolarHBondContact O-NE2 3.14Å; D799-H801 IonicContact OD1-CE1 2.7Å; D799-H801 IonicContact OD1-CG 3.58Å; D799-H801 PolarHBondContact OD1-N 3.46Å; D799-H801 IonicContact OD1-ND1 3.91Å; D799-H801 PolarHBondContact OD1-ND1 3.42Å; D799-H801 IonicContact OD2-CE1 4Å; D799-H801 PolarHBondContact OD2-CE1 3.33Å; D799-H801 IonicContact OD2-ND1 2.71Å; D799-H801 PolarHBondContact OD2-ND1 2.96Å
802	R	72.8	Confident	85.8	Confident	154 Å²	154	43.7 Å²	43.7	58%	0.581	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.9	14.9	174	-51.5	-170	-177.6	-175.8	-0.5	114.4	D771 G772 S800	D771-R802 PolarHBondContact O-NE 3.16Å; G772-R802 PolarHBondContact O-N 3.31Å; S800-R802 PolarHBondContact O-N 2.86Å
803	M	82.9	Confident	86	Confident	13 Å²	13	43.4 Å²	43.4	6%	0.064	23%	0.228	C	C	.	.	S	Bend	trans	-62.7	143.5	168.6	-70.2	-68.1	-72.2	0	0	109.7	I680 D682 L687 V773 S800 T807 F815	I680-M803 HydrophobicContact CG2-CE 3.56Å; D682-M803 HydrophobicContact CB-CE 3.8Å; L687-M803 HydrophobicContact CD2-CE 3.95Å; L687-M803 HydrophobicContact CD2-SD 3.94Å; V773-M803 HydrophobicContact CB-SD 4.19Å; V773-M803 HydrophobicContact CG1-CG 4.35Å; V773-M803 HydrophobicContact CG1-SD 3.76Å; V773-M803 HydrophobicContact CG2-CG 3.82Å; V773-M803 HydrophobicContact CG2-SD 3.29Å; V773-M803 WeakPolarHBondContact CG2-SD 3.44Å; S800-M803 WeakPolarHBondContact O-CB 3.47Å; S800-M803 WeakPolarHBondContact O-CG 3.33Å; S800-M803 PolarHBondContact O-N 3.12Å; M803-T807 HydrophobicContact CE-CG2 3.37Å; M803-F815 HydrophobicContact CB-CD2 4.18Å; M803-F815 HydrophobicContact CE-CD2 4.17Å; M803-F815 HydrophobicContact CE-CE2 4.06Å; M803-F815 HydrophobicContact CG-CD2 3.82Å; M803-F815 HydrophobicContact CG-CE2 4.19Å
804	S	86.1	Confident	86.1	Confident	18 Å²	18	44.1 Å²	44.1	13%	0.126	23%	0.231	C	C	.	.			trans	-67.3	154.3	-177.6	92	0	0	0	0	111.6	D682 V684 Q806 T807	D682-S804 VanDerWaalsContact CG-OG 3.31Å; D682-S804 VanDerWaalsContact OD1-CB 3.25Å; D682-S804 WeakPolarHBondContact OD1-CB 3.47Å; D682-S804 PolarHBondContact OD1-OG 3.18Å; D682-S804 PolarHBondContact OD2-N 3.18Å; V684-S804 WeakPolarHBondContact CG2-OG 3.31Å; S804-Q806 PolarHBondContact O-N 2.97Å; S804-Q806 PolarHBondContact OG-N 2.83Å; S804-Q806 VanDerWaalsContact OG-N 3.12Å; S804-T807 PolarHBondContact N-OG1 3.5Å; S804-T807 VanDerWaalsContact O-CB 3.23Å; S804-T807 WeakPolarHBondContact O-CB 3.43Å; S804-T807 PolarHBondContact O-N 3.01Å; S804-T807 PolarHBondContact O-OG1 3.23Å
805	A	85.2	Confident	86.1	Confident	86 Å²	86	45.4 Å²	45.4	71%	0.711	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-11.8	172.9	0	0	0	0	0	113.5
806	Q	89.3	Confident	85.7	Confident	132 Å²	132	48 Å²	48	62%	0.617	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	4.9	175.6	-59	-176.2	33.3	0	0	112.7	P683 V684 S804 H808	P683-Q806 WeakPolarHBondContact CD-O 3.39Å; P683-Q806 HydrophobicContact CG-CB 3.77Å; V684-Q806 HydrophobicContact CG2-CB 4.38Å; V684-Q806 HydrophobicContact CG2-CG 4.45Å; S804-Q806 PolarHBondContact O-N 2.97Å; S804-Q806 PolarHBondContact OG-N 2.83Å; S804-Q806 VanDerWaalsContact OG-N 3.12Å; Q806-H808 PolarHBondContact O-N 2.77Å
807	T	92.8	Very high	85.2	Confident	9 Å²	9	52.3 Å²	52.3	6%	0.055	28%	0.279	C	S	.	.			trans	-64.6	129.9	177.7	-59.2	0	0	0	0	110.6	I680 Q681 D682 M803 S804 F815	I680-T807 HydrophobicContact CG2-CG2 3.96Å; Q681-T807 WeakPolarHBondContact O-CA 3.23Å; D682-T807 HydrophobicContact CB-CG2 4.34Å; M803-T807 HydrophobicContact CE-CG2 3.37Å; S804-T807 PolarHBondContact N-OG1 3.5Å; S804-T807 VanDerWaalsContact O-CB 3.23Å; S804-T807 WeakPolarHBondContact O-CB 3.43Å; S804-T807 PolarHBondContact O-N 3.01Å; S804-T807 PolarHBondContact O-OG1 3.23Å; T807-F815 HydrophobicContact CG2-CD2 3.89Å; T807-F815 HydrophobicContact CG2-CE2 4.38Å
808	H	93.4	Very high	85.1	Confident	78 Å²	78	52.7 Å²	52.7	36%	0.361	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-141.2	-164.2	180	-150.4	-28.7	0	0	0	111.3	I680 Q681 Q806 G812 D879 Y885	I680-H808 CarbonylContact C-O 3.57Å; I680-H808 WeakPolarHBondContact CA-O 3.23Å; Q681-H808 PolarHBondContact N-O 2.88Å; Q681-H808 PolarHBondContact O-N 3.47Å; Q806-H808 PolarHBondContact O-N 2.77Å; H808-G812 WeakPolarHBondContact O-CA 3.45Å; H808-D879 IonicContact CE1-OD2 3.11Å; H808-D879 IonicContact NE2-OD2 3.06Å; H808-Y885 PolarHBondContact CE1-OH 2.91Å
809	G	91.6	Very high	85.1	Confident	3 Å²	3	52.9 Å²	52.9	3%	0.031	28%	0.276	C	S	.	.	S	Bend	trans	101.4	177.1	-165.7	0	0	0	0	0	113.3	L679 L811 Q813 Y885	L679-G809 CarbonylContact O-C 3.52Å; G809-L811 VanDerWaalsContact C-N 3.26Å; G809-L811 PolarHBondContact O-N 2.94Å; G809-Q813 PolarHBondContact O-N 2.88Å; G809-Q813 PolarHBondContact O-NE2 2.84Å; G809-Y885 VanDerWaalsContact C-CE1 3.45Å
810	L	90.3	Very high	85.5	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-36.4	-178.7	-76.5	171.8	0	0	0	113.1	F654 I669 L677 R678 L679 Q813 F814 I878 Y885	F654-L810 HydrophobicContact CE2-CD1 4.45Å; F654-L810 HydrophobicContact CZ-CB 4.4Å; F654-L810 HydrophobicContact CZ-CD1 4.13Å; I669-L810 HydrophobicContact CG1-CD1 4.37Å; L677-L810 HydrophobicContact CB-CD1 3.86Å; L677-L810 HydrophobicContact CD1-CD1 3.87Å; L677-L810 HydrophobicContact CD2-CD1 4.36Å; L677-L810 HydrophobicContact CG-CD1 4.26Å; R678-L810 PolarHBondContact O-N 3.14Å; L679-L810 HydrophobicContact CD2-CD1 4.23Å; L679-L810 PolarHBondContact O-N 2.77Å; L810-Q813 PolarHBondContact O-NE2 2.8Å; L810-F814 VanDerWaalsContact O-CE2 3.23Å; L810-F814 WeakPolarHBondContact O-CE2 3.45Å; L810-I878 HydrophobicContact CD2-CD1 4.22Å; L810-Y885 HydrophobicContact CD2-CD1 4.17Å; L810-Y885 HydrophobicContact CD2-CD2 3.49Å; L810-Y885 VanDerWaalsContact CD2-CD2 3.49Å; L810-Y885 HydrophobicContact CD2-CE2 3.95Å; L810-Y885 HydrophobicContact CD2-CG 3.61Å; L810-Y885 HydrophobicContact CG-CD1 3.93Å; L810-Y885 HydrophobicContact CG-CD2 4.07Å; L810-Y885 HydrophobicContact CG-CG 3.62Å
811	L	89.8	Confident	85.9	Confident	15 Å²	15	55.3 Å²	55.3	8%	0.079	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-40.6	176	-74.9	178.1	0	0	0	112.1	F654 I656 L679 I680 F795 G809 Q813 F814	F654-L811 HydrophobicContact CB-CD2 4.37Å; F654-L811 HydrophobicContact CD1-CD1 4.01Å; F654-L811 HydrophobicContact CD1-CD2 3.39Å; F654-L811 HydrophobicContact CD1-CG 3.7Å; F654-L811 HydrophobicContact CE1-CD1 3.96Å; F654-L811 HydrophobicContact CE1-CD2 4Å; F654-L811 HydrophobicContact CE1-CG 3.75Å; F654-L811 HydrophobicContact CG-CD2 4.19Å; I656-L811 HydrophobicContact CD1-CD2 3.49Å; I656-L811 VanDerWaalsContact CD1-CD2 3.49Å; L679-L811 HydrophobicContact CB-CD1 4.45Å; L679-L811 PolarHBondContact O-N 2.84Å; I680-L811 HydrophobicContact CG1-CB 4.22Å; F795-L811 HydrophobicContact CD1-CD1 3.86Å; F795-L811 HydrophobicContact CE1-CD1 4.03Å; G809-L811 VanDerWaalsContact C-N 3.26Å; G809-L811 PolarHBondContact O-N 2.94Å; L811-Q813 PolarHBondContact O-N 2.94Å; L811-Q813 VanDerWaalsContact O-N 3.14Å; L811-F814 PolarHBondContact O-N 2.69Å
812	G	88.1	Confident	86.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-59.9	-29.2	-172	0	0	0	0	0	114.4	L679 H808 F814 F815	L679-G812 PolarHBondContact O-N 2.81Å; H808-G812 WeakPolarHBondContact O-CA 3.45Å; G812-F814 PolarHBondContact O-N 2.87Å; G812-F814 VanDerWaalsContact O-N 3.15Å; G812-F815 WeakPolarHBondContact O-CB 3.29Å; G812-F815 PolarHBondContact O-N 2.81Å; G812-F815 VanDerWaalsContact O-N 3.12Å
813	Q	89.9	Confident	87.4	Confident	20 Å²	20	48.5 Å²	48.5	9%	0.093	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-61.8	-19.4	175.7	70.3	-175.7	-70.7	0	0	114.1	G809 L810 L811 K841 D879 Y885	G809-Q813 PolarHBondContact O-N 2.88Å; G809-Q813 PolarHBondContact O-NE2 2.84Å; L810-Q813 PolarHBondContact O-NE2 2.8Å; L811-Q813 PolarHBondContact O-N 2.94Å; L811-Q813 VanDerWaalsContact O-N 3.14Å; Q813-K841 VanDerWaalsContact OE1-NZ 3.08Å; Q813-D879 PolarHBondContact OE1-OD2 3.04Å; Q813-Y885 PolarHBondContact NE2-OH 3.14Å
814	F	88.9	Confident	87.7	Confident	18 Å²	18	52.4 Å²	52.4	8%	0.079	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-98.3	3.4	-179.9	-56.6	-65.3	0	0	0	113	I656 F667 L810 L811 G812 F818 L877 I878	I656-F814 HydrophobicContact CD1-CD2 3.83Å; I656-F814 HydrophobicContact CD1-CE2 4.37Å; I656-F814 HydrophobicContact CD1-CG 4.42Å; I656-F814 HydrophobicContact CG1-CD2 4.1Å; I656-F814 HydrophobicContact CG1-CE2 4.37Å; I656-F814 HydrophobicContact CG1-CG 4.49Å; I656-F814 HydrophobicContact CG2-CB 3.88Å; I656-F814 HydrophobicContact CG2-CD1 4.41Å; I656-F814 HydrophobicContact CG2-CD2 4.43Å; I656-F814 HydrophobicContact CG2-CG 4Å; F667-F814 HydrophobicContact CE1-CE2 4.27Å; F667-F814 HydrophobicContact CZ-CE2 4.4Å; L810-F814 VanDerWaalsContact O-CE2 3.23Å; L810-F814 WeakPolarHBondContact O-CE2 3.45Å; L811-F814 PolarHBondContact O-N 2.69Å; G812-F814 PolarHBondContact O-N 2.87Å; G812-F814 VanDerWaalsContact O-N 3.15Å; F814-F818 HydrophobicContact CB-CD1 4.49Å; F814-F818 HydrophobicContact CB-CE1 3.95Å; F814-F818 AromaticContact CD1-CD1 3.97Å; F814-F818 HydrophobicContact CD1-CD1 3.97Å; F814-F818 AromaticContact CD1-CE1 3.49Å; F814-F818 HydrophobicContact CD1-CE1 3.49Å; F814-F818 VanDerWaalsContact CD1-CE1 3.49Å; F814-F818 HydrophobicContact CD1-CE2 4.3Å; F814-F818 AromaticContact CD1-CZ 3.67Å; F814-F818 HydrophobicContact CD1-CZ 3.67Å; F814-F818 HydrophobicContact CE1-CE1 4.43Å; F814-F818 HydrophobicContact CE1-CZ 4.2Å; F814-F818 HydrophobicContact CG-CE1 4.12Å; F814-L877 HydrophobicContact CE1-CD1 4.05Å; F814-L877 HydrophobicContact CE1-CG 4.15Å; F814-L877 HydrophobicContact CZ-CD1 4.31Å; F814-L877 HydrophobicContact CZ-CD2 4.38Å; F814-L877 HydrophobicContact CZ-CG 3.9Å; F814-I878 HydrophobicContact CE2-CG2 4.38Å; F814-I878 HydrophobicContact CZ-CG2 4.17Å
815	F	85.8	Confident	87.8	Confident	37 Å²	37	56.9 Å²	56.9	16%	0.162	30%	0.299	C	S	.	.	S	Bend	trans	-78.7	-13.5	176.1	-65.7	-4	0	0	0	112.7	I680 V797 M803 T807 G812	I680-F815 HydrophobicContact CD1-CE2 3.82Å; I680-F815 HydrophobicContact CD1-CZ 3.61Å; I680-F815 HydrophobicContact CG1-CE2 4.18Å; I680-F815 HydrophobicContact CG1-CZ 4.05Å; I680-F815 HydrophobicContact CG2-CE2 4.25Å; V797-F815 HydrophobicContact CB-CE1 4.37Å; V797-F815 HydrophobicContact CB-CZ 4.29Å; V797-F815 HydrophobicContact CG1-CE1 4.05Å; V797-F815 HydrophobicContact CG1-CZ 3.83Å; V797-F815 HydrophobicContact CG2-CE1 3.92Å; V797-F815 HydrophobicContact CG2-CZ 3.62Å; M803-F815 HydrophobicContact CB-CD2 4.18Å; M803-F815 HydrophobicContact CE-CD2 4.17Å; M803-F815 HydrophobicContact CE-CE2 4.06Å; M803-F815 HydrophobicContact CG-CD2 3.82Å; M803-F815 HydrophobicContact CG-CE2 4.19Å; T807-F815 HydrophobicContact CG2-CD2 3.89Å; T807-F815 HydrophobicContact CG2-CE2 4.38Å; G812-F815 WeakPolarHBondContact O-CB 3.29Å; G812-F815 PolarHBondContact O-N 2.81Å; G812-F815 VanDerWaalsContact O-N 3.12Å
816	Q	81.1	Confident	87.9	Confident	80 Å²	80	56.4 Å²	56.4	37%	0.374	28%	0.279	S	S	.	.	S	Bend	trans	-92.8	145.4	167.6	-60.6	-56.6	-52.2	0	0	109.7	F818	Q816-F818 PolarHBondContact O-N 2.92Å
817	P	76.2	Confident	87.7	Confident	124 Å²	124	56 Å²	56	81%	0.805	29%	0.288	S	S	*	.			trans	-55.6	130.5	178.3	-24.6	33.6	0	0	0	111.9
818	F	83.9	Confident	86.9	Confident	34 Å²	34	56.2 Å²	56.2	15%	0.149	29%	0.292	C	S	.	.			trans	-137.6	151.6	171.3	75.4	-79.5	0	0	0	109.3	I656 V658 L665 F814 Q816 F820 V840 L877	I656-F818 HydrophobicContact CG2-CE1 4Å; I656-F818 HydrophobicContact CG2-CZ 3.95Å; V658-F818 VanDerWaalsContact CG1-O 3.24Å; V658-F818 WeakPolarHBondContact CG1-O 3.43Å; V658-F818 HydrophobicContact CG2-CD1 4.46Å; V658-F818 HydrophobicContact CG2-CE1 3.58Å; V658-F818 HydrophobicContact CG2-CE2 3.94Å; V658-F818 HydrophobicContact CG2-CZ 3.27Å; L665-F818 HydrophobicContact CD1-CE2 3.97Å; L665-F818 HydrophobicContact CD1-CZ 4.22Å; F814-F818 HydrophobicContact CB-CD1 4.49Å; F814-F818 HydrophobicContact CB-CE1 3.95Å; F814-F818 AromaticContact CD1-CD1 3.97Å; F814-F818 HydrophobicContact CD1-CD1 3.97Å; F814-F818 AromaticContact CD1-CE1 3.49Å; F814-F818 HydrophobicContact CD1-CE1 3.49Å; F814-F818 VanDerWaalsContact CD1-CE1 3.49Å; F814-F818 HydrophobicContact CD1-CE2 4.3Å; F814-F818 AromaticContact CD1-CZ 3.67Å; F814-F818 HydrophobicContact CD1-CZ 3.67Å; F814-F818 HydrophobicContact CE1-CE1 4.43Å; F814-F818 HydrophobicContact CE1-CZ 4.2Å; F814-F818 HydrophobicContact CG-CE1 4.12Å; Q816-F818 PolarHBondContact O-N 2.92Å; F818-F820 HydrophobicContact CE2-CD1 4.29Å; F818-V840 HydrophobicContact CD2-CG2 4.07Å; F818-V840 HydrophobicContact CE2-CG2 4.12Å; F818-L877 HydrophobicContact CE2-CD1 4.48Å
819	D	82.5	Confident	85.9	Confident	89 Å²	89	56.5 Å²	56.5	48%	0.476	30%	0.303	S	S	.	.			trans	-111.1	151.3	-179.7	-170.1	24.2	0	0	0	111	K661	K661-D819 WeakPolarHBondContact CE-OD1 3.47Å; K661-D819 IonicContact NZ-OD1 3.51Å; K661-D819 PolarHBondContact NZ-OD1 2.74Å
820	F	89.5	Confident	84.8	Confident	9 Å²	9	59 Å²	59	4%	0.039	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	155.4	170.2	73.2	-94.2	0	0	0	111.4	V658 K661 D663 L665 F818 V822 L838 M839 V840	V658-F820 HydrophobicContact CB-CD1 4.45Å; V658-F820 HydrophobicContact CB-CE1 3.9Å; V658-F820 HydrophobicContact CG1-CE1 4.43Å; V658-F820 HydrophobicContact CG2-CD1 3.95Å; V658-F820 HydrophobicContact CG2-CE1 3.58Å; K661-F820 HydrophobicContact CB-CE1 4.28Å; K661-F820 HydrophobicContact CB-CZ 4.24Å; K661-F820 HydrophobicContact CG-CE1 4.04Å; K661-F820 HydrophobicContact CG-CZ 4.28Å; K661-F820 PolarHBondContact NZ-O 2.81Å; D663-F820 HydrophobicContact CB-CZ 4.43Å; D663-F820 WeakPolarHBondContact O-CZ 3.47Å; L665-F820 HydrophobicContact CD1-CD1 3.87Å; L665-F820 HydrophobicContact CD1-CE1 4.13Å; L665-F820 HydrophobicContact CD1-CG 4.21Å; L665-F820 HydrophobicContact CD2-CD1 4.5Å; L665-F820 HydrophobicContact CD2-CD2 4.26Å; L665-F820 HydrophobicContact CD2-CE1 4.26Å; L665-F820 HydrophobicContact CD2-CE2 4.01Å; L665-F820 HydrophobicContact CD2-CG 4.49Å; L665-F820 HydrophobicContact CD2-CZ 4.01Å; L665-F820 HydrophobicContact CG-CD1 4.22Å; L665-F820 HydrophobicContact CG-CE1 3.97Å; L665-F820 HydrophobicContact CG-CZ 4.17Å; F818-F820 HydrophobicContact CE2-CD1 4.29Å; F820-V822 HydrophobicContact CD2-CG2 3.9Å; F820-V822 HydrophobicContact CE2-CG2 3.81Å; F820-L838 HydrophobicContact CB-CD1 3.76Å; F820-L838 HydrophobicContact CD2-CD1 3.26Å; F820-L838 HydrophobicContact CE2-CD1 4.08Å; F820-L838 HydrophobicContact CG-CD1 3.77Å; F820-M839 CarbonylContact C-O 3.53Å; F820-M839 VanDerWaalsContact CA-O 3.25Å; F820-M839 WeakPolarHBondContact CA-O 3.3Å; F820-V840 HydrophobicContact CB-CB 3.92Å; F820-V840 HydrophobicContact CB-CG2 3.99Å
821	K	89.1	Confident	83.8	Confident	128 Å²	128	65 Å²	65	56%	0.557	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	132.7	176	-67	-177.4	-179.5	178.3	0	110.3	L838 M839	K821-L838 CarbonylContact O-C 3.57Å; K821-L838 WeakPolarHBondContact O-CA 3.33Å; K821-M839 HydrophobicContact CB-CB 4.5Å; K821-M839 PolarHBondContact N-O 3.19Å; K821-M839 PolarHBondContact O-N 2.82Å
822	V	90	Very high	82.9	Confident	40 Å²	40	69.6 Å²	69.6	24%	0.242	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.2	172	-178.3	0	0	0	0	108.6	F820 A836 T837 L838 W868	F820-V822 HydrophobicContact CD2-CG2 3.9Å; F820-V822 HydrophobicContact CE2-CG2 3.81Å; V822-A836 HydrophobicContact CG1-CB 3.48Å; V822-A836 VanDerWaalsContact CG1-CB 3.48Å; V822-T837 WeakPolarHBondContact CA-O 3.39Å; V822-L838 HydrophobicContact CG2-CD1 3.61Å; V822-W868 HydrophobicContact CG1-CD2 4.24Å; V822-W868 HydrophobicContact CG1-CH2 4.31Å; V822-W868 HydrophobicContact CG1-CZ2 3.78Å; V822-W868 HydrophobicContact CG2-CG 4.24Å
823	F	88.6	Confident	82.6	Confident	85 Å²	85	72.2 Å²	72.2	37%	0.373	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	175.1	177.9	58.4	-85.6	0	0	0	109.9	I825 T837 M839	F823-I825 PolarHBondContact O-N 3.04Å; F823-T837 HydrophobicContact CD2-CG2 4.43Å; F823-T837 HydrophobicContact CE1-CG2 4.1Å; F823-T837 HydrophobicContact CE2-CG2 3.71Å; F823-T837 HydrophobicContact CZ-CG2 3.52Å; F823-T837 PolarHBondContact N-O 3.1Å; F823-T837 WeakPolarHBondContact O-CA 3.43Å; F823-T837 WeakPolarHBondContact O-CB 3.46Å; F823-T837 PolarHBondContact O-N 3.11Å; F823-M839 HydrophobicContact CE1-CB 3.83Å; F823-M839 HydrophobicContact CE1-CE 4.02Å; F823-M839 HydrophobicContact CZ-CE 3.98Å
824	D	88.8	Confident	82.5	Confident	96 Å²	96	73.1 Å²	73.1	51%	0.513	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	57.1	51.5	178.2	-175.1	34.8	0	0	0	112.6	R826 T837	D824-R826 PolarHBondContact O-N 3.46Å; D824-R826 PolarHBondContact O-NH1 2.7Å; D824-R826 IonicContact OD1-NH1 3.87Å; D824-R826 IonicContact OD2-CZ 3.6Å; D824-R826 IonicContact OD2-NH1 3.16Å; D824-R826 PolarHBondContact OD2-NH1 3.25Å; D824-T837 PolarHBondContact OD2-OG1 3.03Å
825	I	89.1	Confident	82.5	Confident	111 Å²	111	73.1 Å²	73.1	57%	0.569	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	122.9	176.4	-55.9	176.1	0	0	0	108.4	F823 P834 D835 A836 W868	F823-I825 PolarHBondContact O-N 3.04Å; I825-P834 HydrophobicContact CG2-CB 3.83Å; I825-P834 HydrophobicContact CG2-CG 4.42Å; I825-D835 CarbonylContact C-O 3.57Å; I825-D835 WeakPolarHBondContact CA-O 3.21Å; I825-A836 HydrophobicContact CG1-CB 3.98Å; I825-W868 HydrophobicContact CD1-CH2 4.38Å; I825-W868 HydrophobicContact CD1-CZ2 4.36Å; I825-W868 HydrophobicContact CG1-CH2 4.31Å
826	R	88	Confident	82.8	Confident	77 Å²	77	71.4 Å²	71.4	29%	0.291	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	156	-174.8	56.3	-179	171.8	-93.4	7	110.5	D824 G828 P834 D835 T837	D824-R826 PolarHBondContact O-N 3.46Å; D824-R826 PolarHBondContact O-NH1 2.7Å; D824-R826 IonicContact OD1-NH1 3.87Å; D824-R826 IonicContact OD2-CZ 3.6Å; D824-R826 IonicContact OD2-NH1 3.16Å; D824-R826 PolarHBondContact OD2-NH1 3.25Å; R826-G828 PolarHBondContact O-N 3.37Å; R826-P834 CarbonylContact O-C 3.58Å; R826-P834 WeakPolarHBondContact O-CA 3.36Å; R826-P834 WeakPolarHBondContact O-CB 3.31Å; R826-D835 HydrophobicContact CG-CB 4.05Å; R826-D835 PolarHBondContact N-O 3.13Å; R826-D835 PolarHBondContact O-N 3.14Å; R826-T837 PolarHBondContact NH1-OG1 2.97Å
827	P	84.1	Confident	83.3	Confident	122 Å²	122	67.7 Å²	67.7	79%	0.792	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.4	125.2	173.2	-23.9	34.2	0	0	0	110.5
828	G	76.6	Confident	84.1	Confident	15 Å²	15	61.8 Å²	61.8	16%	0.155	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-177	174.2	0	0	0	0	0	111.7	R826 D830 K833 D835	R826-G828 PolarHBondContact O-N 3.37Å; G828-D830 PolarHBondContact O-N 3.09Å; G828-K833 WeakPolarHBondContact CA-O 3.42Å; G828-D835 WeakPolarHBondContact CA-OD2 3.47Å
829	S	71.2	Confident	84.4	Confident	83 Å²	83	64.3 Å²	64.3	58%	0.58	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	-28.2	178.6	-62.8	0	0	0	0	113.2
830	D	69.1	Low	84.7	Confident	57 Å²	57	60.1 Å²	60.1	31%	0.305	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	121.7	167.7	177.9	-19.1	0	0	0	107.6	G828 T832 K833	G828-D830 PolarHBondContact O-N 3.09Å; D830-T832 PolarHBondContact O-N 3.46Å; D830-T832 WeakPolarHBondContact OD1-CB 3.25Å; D830-T832 PolarHBondContact OD1-N 3.15Å; D830-T832 PolarHBondContact OD1-OG1 3.28Å; D830-T832 PolarHBondContact OD2-OG1 3.38Å; D830-K833 HydrophobicContact CB-CB 4.11Å; D830-K833 HydrophobicContact CB-CD 4.26Å; D830-K833 HydrophobicContact CB-CG 4.27Å; D830-K833 CarbonylContact O-C 3.57Å; D830-K833 PolarHBondContact O-N 3.23Å; D830-K833 IonicContact OD2-NZ 3.96Å
831	P	69.4	Low	84.4	Confident	124 Å²	124	62.9 Å²	62.9	81%	0.805	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-21.7	-179.4	-24.6	33.4	0	0	0	114.2
832	T	70.3	Confident	84.1	Confident	113 Å²	113	64.7 Å²	64.7	69%	0.693	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-8.1	177.7	69.6	0	0	0	0	113.6	D830	D830-T832 PolarHBondContact O-N 3.46Å; D830-T832 WeakPolarHBondContact OD1-CB 3.25Å; D830-T832 PolarHBondContact OD1-N 3.15Å; D830-T832 PolarHBondContact OD1-OG1 3.28Å; D830-T832 PolarHBondContact OD2-OG1 3.38Å
833	K	81.6	Confident	83.9	Confident	55 Å²	55	67.6 Å²	67.6	24%	0.239	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	84.9	-177.3	-61.1	179.6	-175	165.8	0	109.9	V648 G828 D830 T848 R849	V648-K833 PolarHBondContact O-NZ 3.38Å; G828-K833 WeakPolarHBondContact CA-O 3.42Å; D830-K833 HydrophobicContact CB-CB 4.11Å; D830-K833 HydrophobicContact CB-CD 4.26Å; D830-K833 HydrophobicContact CB-CG 4.27Å; D830-K833 CarbonylContact O-C 3.57Å; D830-K833 PolarHBondContact O-N 3.23Å; D830-K833 IonicContact OD2-NZ 3.96Å; K833-T848 HydrophobicContact CB-CG2 3.8Å; K833-R849 VanDerWaalsContact CB-O 3.31Å; K833-R849 WeakPolarHBondContact CB-O 3.21Å; K833-R849 WeakPolarHBondContact CG-O 3.35Å
834	P	88	Confident	84	Confident	39 Å²	39	70 Å²	70	25%	0.253	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	144.4	178.6	24.1	-34.1	0	0	0	111.8	I825 R826 R849	I825-P834 HydrophobicContact CG2-CB 3.83Å; I825-P834 HydrophobicContact CG2-CG 4.42Å; R826-P834 CarbonylContact O-C 3.58Å; R826-P834 WeakPolarHBondContact O-CA 3.36Å; R826-P834 WeakPolarHBondContact O-CB 3.31Å; P834-R849 HydrophobicContact CG-CB 3.73Å; P834-R849 HydrophobicContact CG-CG 4.29Å; P834-R849 WeakPolarHBondContact O-CB 3.45Å; P834-R849 PolarHBondContact O-N 3.31Å
835	D	89.4	Confident	84.1	Confident	18 Å²	18	66.8 Å²	66.8	10%	0.096	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	153.5	168.9	-70.4	-23.8	0	0	0	109.8	I825 R826 G828 V847 T848	I825-D835 CarbonylContact C-O 3.57Å; I825-D835 WeakPolarHBondContact CA-O 3.21Å; R826-D835 HydrophobicContact CG-CB 4.05Å; R826-D835 PolarHBondContact N-O 3.13Å; R826-D835 PolarHBondContact O-N 3.14Å; G828-D835 WeakPolarHBondContact CA-OD2 3.47Å; D835-V847 CarbonylContact C-O 3.52Å; D835-V847 VanDerWaalsContact CA-O 3.25Å; D835-V847 WeakPolarHBondContact CA-O 3.47Å; D835-T848 WeakPolarHBondContact OD1-CB 3.2Å; D835-T848 WeakPolarHBondContact OD1-CG2 3.47Å; D835-T848 PolarHBondContact OD1-OG1 3.37Å
836	A	92.2	Very high	84.2	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	167.9	175.2	0	0	0	0	0	111.3	V822 I825 T846 V847 W868	V822-A836 HydrophobicContact CG1-CB 3.48Å; V822-A836 VanDerWaalsContact CG1-CB 3.48Å; I825-A836 HydrophobicContact CG1-CB 3.98Å; A836-T846 WeakPolarHBondContact O-CA 3.46Å; A836-V847 HydrophobicContact CB-CG2 4.13Å; A836-V847 PolarHBondContact N-O 3.44Å; A836-V847 WeakPolarHBondContact O-CG2 3.46Å; A836-V847 PolarHBondContact O-N 3.32Å; A836-W868 HydrophobicContact CB-CE3 4.1Å; A836-W868 HydrophobicContact CB-CH2 3.62Å; A836-W868 HydrophobicContact CB-CZ2 4.31Å; A836-W868 HydrophobicContact CB-CZ3 3.49Å; A836-W868 VanDerWaalsContact CB-CZ3 3.49Å
837	T	91.7	Very high	84.3	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.018	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	117.8	172.2	-59.3	0	0	0	0	109.5	V822 F823 D824 R826 Q844 L845	V822-T837 WeakPolarHBondContact CA-O 3.39Å; F823-T837 HydrophobicContact CD2-CG2 4.43Å; F823-T837 HydrophobicContact CE1-CG2 4.1Å; F823-T837 HydrophobicContact CE2-CG2 3.71Å; F823-T837 HydrophobicContact CZ-CG2 3.52Å; F823-T837 PolarHBondContact N-O 3.1Å; F823-T837 WeakPolarHBondContact O-CA 3.43Å; F823-T837 WeakPolarHBondContact O-CB 3.46Å; F823-T837 PolarHBondContact O-N 3.11Å; D824-T837 PolarHBondContact OD2-OG1 3.03Å; R826-T837 PolarHBondContact NH1-OG1 2.97Å; T837-Q844 HydrophobicContact CG2-CG 3.37Å; T837-Q844 VanDerWaalsContact CG2-NE2 3.33Å; T837-L845 CarbonylContact C-O 3.57Å; T837-L845 WeakPolarHBondContact CA-O 3.49Å
838	L	92.9	Very high	84.5	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	122.8	173.2	176.7	71.8	0	0	0	109.7	L665 F820 K821 V822 V840 L845 V847 V870	L665-L838 HydrophobicContact CD1-CD2 4.35Å; L665-L838 HydrophobicContact CD2-CD1 4.01Å; L665-L838 HydrophobicContact CD2-CD2 3.94Å; F820-L838 HydrophobicContact CB-CD1 3.76Å; F820-L838 HydrophobicContact CD2-CD1 3.26Å; F820-L838 HydrophobicContact CE2-CD1 4.08Å; F820-L838 HydrophobicContact CG-CD1 3.77Å; K821-L838 CarbonylContact O-C 3.57Å; K821-L838 WeakPolarHBondContact O-CA 3.33Å; V822-L838 HydrophobicContact CG2-CD1 3.61Å; L838-V840 HydrophobicContact CD2-CB 4.38Å; L838-V840 HydrophobicContact CD2-CG1 3.88Å; L838-V840 HydrophobicContact CG-CB 4.25Å; L838-V840 HydrophobicContact CG-CG1 4.06Å; L838-L845 HydrophobicContact CB-CB 4.33Å; L838-L845 HydrophobicContact CD2-CD1 4.3Å; L838-L845 PolarHBondContact N-O 2.96Å; L838-L845 PolarHBondContact O-N 3.19Å; L838-V847 HydrophobicContact CB-CB 4.38Å; L838-V847 HydrophobicContact CB-CG1 3.59Å; L838-V847 HydrophobicContact CB-CG2 3.83Å; L838-V847 HydrophobicContact CD2-CG1 3.74Å; L838-V847 HydrophobicContact CG-CG1 4.28Å; L838-V870 HydrophobicContact CD2-CG2 3.96Å
839	M	89.8	Confident	85.1	Confident	86 Å²	86	57.5 Å²	57.5	42%	0.424	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	114.7	167.9	-177.2	-179.3	-67.1	0	0	109.3	F820 K821 F823 H843	F820-M839 CarbonylContact C-O 3.53Å; F820-M839 VanDerWaalsContact CA-O 3.25Å; F820-M839 WeakPolarHBondContact CA-O 3.3Å; K821-M839 HydrophobicContact CB-CB 4.5Å; K821-M839 PolarHBondContact N-O 3.19Å; K821-M839 PolarHBondContact O-N 2.82Å; F823-M839 HydrophobicContact CE1-CB 3.83Å; F823-M839 HydrophobicContact CE1-CE 4.02Å; F823-M839 HydrophobicContact CZ-CE 3.98Å; M839-H843 VanDerWaalsContact CA-O 3.31Å; M839-H843 WeakPolarHBondContact CA-O 3.28Å
840	V	89.3	Confident	85.5	Confident	2 Å²	2	54 Å²	54	1%	0.012	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	135.5	-176.9	62.9	0	0	0	0	109	F818 F820 L838 N842 H843 L845 L877	F818-V840 HydrophobicContact CD2-CG2 4.07Å; F818-V840 HydrophobicContact CE2-CG2 4.12Å; F820-V840 HydrophobicContact CB-CB 3.92Å; F820-V840 HydrophobicContact CB-CG2 3.99Å; L838-V840 HydrophobicContact CD2-CB 4.38Å; L838-V840 HydrophobicContact CD2-CG1 3.88Å; L838-V840 HydrophobicContact CG-CB 4.25Å; L838-V840 HydrophobicContact CG-CG1 4.06Å; V840-N842 PolarHBondContact O-N 3.12Å; V840-N842 VanDerWaalsContact O-N 3.1Å; V840-H843 PolarHBondContact N-O 2.85Å; V840-H843 WeakPolarHBondContact O-CA 3.23Å; V840-H843 WeakPolarHBondContact O-CB 3.13Å; V840-H843 PolarHBondContact O-N 2.73Å; V840-L845 HydrophobicContact CG1-CD1 3.72Å; V840-L845 HydrophobicContact CG1-CG 4.46Å; V840-L877 HydrophobicContact CG1-CD1 4.17Å; V840-L877 HydrophobicContact CG2-CD1 3.93Å
841	K	84	Confident	85.9	Confident	67 Å²	67	54.5 Å²	54.5	29%	0.291	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	40.6	-179.3	-62.8	177	177.3	179.7	0	114	Q813 H843 L877 D879	Q813-K841 VanDerWaalsContact OE1-NZ 3.08Å; K841-H843 PolarHBondContact O-CE1 3.04Å; K841-H843 PolarHBondContact O-N 3.37Å; K841-H843 PolarHBondContact O-ND1 3.42Å; K841-L877 PolarHBondContact NZ-O 3.49Å; K841-D879 IonicContact NZ-OD1 3.84Å; K841-D879 PolarHBondContact NZ-OD1 2.93Å; K841-D879 IonicContact NZ-OD2 2.75Å
842	N	82.8	Confident	86.2	Confident	166 Å²	166	49.4 Å²	49.4	89%	0.888	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	12	-174	-62.2	-18.7	0	0	0	116.3	V840	V840-N842 PolarHBondContact O-N 3.12Å; V840-N842 VanDerWaalsContact O-N 3.1Å
843	H	85.6	Confident	86.2	Confident	101 Å²	101	47.8 Å²	47.8	47%	0.468	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	147.8	171.9	-61.8	90.1	0	0	0	110.4	M839 V840 K841 L845	M839-H843 VanDerWaalsContact CA-O 3.31Å; M839-H843 WeakPolarHBondContact CA-O 3.28Å; V840-H843 PolarHBondContact N-O 2.85Å; V840-H843 WeakPolarHBondContact O-CA 3.23Å; V840-H843 WeakPolarHBondContact O-CB 3.13Å; V840-H843 PolarHBondContact O-N 2.73Å; K841-H843 PolarHBondContact O-CE1 3.04Å; K841-H843 PolarHBondContact O-N 3.37Å; K841-H843 PolarHBondContact O-ND1 3.42Å; H843-L845 HydrophobicContact CB-CD2 4.33Å; H843-L845 HydrophobicContact CB-CG 4.48Å
844	Q	90.1	Very high	85.6	Confident	136 Å²	136	45.8 Å²	45.8	64%	0.636	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	115	173.6	-173.4	177.8	-15.7	0	0	108.9	T837	T837-Q844 HydrophobicContact CG2-CG 3.37Å; T837-Q844 VanDerWaalsContact CG2-NE2 3.33Å
845	L	91.1	Very high	84.6	Confident	27 Å²	27	45.1 Å²	45.1	14%	0.141	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	146.2	-174.5	-53.1	177.3	0	0	0	110.1	T837 L838 V840 H843 V870 L877	T837-L845 CarbonylContact C-O 3.57Å; T837-L845 WeakPolarHBondContact CA-O 3.49Å; L838-L845 HydrophobicContact CB-CB 4.33Å; L838-L845 HydrophobicContact CD2-CD1 4.3Å; L838-L845 PolarHBondContact N-O 2.96Å; L838-L845 PolarHBondContact O-N 3.19Å; V840-L845 HydrophobicContact CG1-CD1 3.72Å; V840-L845 HydrophobicContact CG1-CG 4.46Å; H843-L845 HydrophobicContact CB-CD2 4.33Å; H843-L845 HydrophobicContact CB-CG 4.48Å; L845-V870 HydrophobicContact CD1-CG1 4.02Å; L845-L877 HydrophobicContact CD1-CB 4.28Å
846	T	90.3	Very high	83.4	Confident	65 Å²	65	48.5 Å²	48.5	40%	0.399	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	127.4	166.7	-60.6	0	0	0	0	108.6	A836	A836-T846 WeakPolarHBondContact O-CA 3.46Å
847	V	90.9	Very high	81.9	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	152	-177.9	-65.6	0	0	0	0	110.9	D835 A836 L838 W868 F869 V870	D835-V847 CarbonylContact C-O 3.52Å; D835-V847 VanDerWaalsContact CA-O 3.25Å; D835-V847 WeakPolarHBondContact CA-O 3.47Å; A836-V847 HydrophobicContact CB-CG2 4.13Å; A836-V847 PolarHBondContact N-O 3.44Å; A836-V847 WeakPolarHBondContact O-CG2 3.46Å; A836-V847 PolarHBondContact O-N 3.32Å; L838-V847 HydrophobicContact CB-CB 4.38Å; L838-V847 HydrophobicContact CB-CG1 3.59Å; L838-V847 HydrophobicContact CB-CG2 3.83Å; L838-V847 HydrophobicContact CD2-CG1 3.74Å; L838-V847 HydrophobicContact CG-CG1 4.28Å; V847-W868 HydrophobicContact CB-CB 4.08Å; V847-W868 HydrophobicContact CB-CE3 4.33Å; V847-W868 HydrophobicContact CG2-CB 3.96Å; V847-W868 HydrophobicContact CG2-CD2 4Å; V847-W868 HydrophobicContact CG2-CE3 3.64Å; V847-W868 HydrophobicContact CG2-CG 4.17Å; V847-W868 HydrophobicContact CG2-CZ3 4.43Å; V847-F869 VanDerWaalsContact CA-O 3.27Å; V847-F869 WeakPolarHBondContact CA-O 3.38Å; V847-F869 WeakPolarHBondContact CB-O 3.25Å; V847-V870 HydrophobicContact CG1-CG2 3.86Å
848	T	89.1	Confident	80.4	Confident	7 Å²	7	59.7 Å²	59.7	4%	0.043	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	134.2	-179.7	-55.7	0	0	0	0	110.2	K833 D835 G850 F869 H871	K833-T848 HydrophobicContact CB-CG2 3.8Å; D835-T848 WeakPolarHBondContact OD1-CB 3.2Å; D835-T848 WeakPolarHBondContact OD1-CG2 3.47Å; D835-T848 PolarHBondContact OD1-OG1 3.37Å; T848-G850 PolarHBondContact O-N 2.96Å; T848-F869 PolarHBondContact N-O 3.04Å; T848-F869 VanDerWaalsContact N-O 3.12Å; T848-F869 WeakPolarHBondContact O-CB 3.5Å; T848-F869 PolarHBondContact O-N 3.16Å; T848-H871 PolarHBondContact OG1-NE2 2.85Å
849	R	87.8	Confident	78.6	Confident	58 Å²	58	61 Å²	61	22%	0.219	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	130.2	178.3	-167.6	69.6	168.8	-178.9	6.6	110.4	D663 K833 P834 V866 W868	D663-R849 IonicContact OD1-CZ 2.58Å; D663-R849 IonicContact OD1-NH1 2.7Å; D663-R849 PolarHBondContact OD1-NH1 2.57Å; D663-R849 IonicContact OD1-NH2 3.37Å; D663-R849 PolarHBondContact OD1-NH2 2.73Å; D663-R849 IonicContact OD2-CZ 3.46Å; D663-R849 IonicContact OD2-NH1 2.62Å; D663-R849 PolarHBondContact OD2-NH1 3.2Å; K833-R849 VanDerWaalsContact CB-O 3.31Å; K833-R849 WeakPolarHBondContact CB-O 3.21Å; K833-R849 WeakPolarHBondContact CG-O 3.35Å; P834-R849 HydrophobicContact CG-CB 3.73Å; P834-R849 HydrophobicContact CG-CG 4.29Å; P834-R849 WeakPolarHBondContact O-CB 3.45Å; P834-R849 PolarHBondContact O-N 3.31Å; R849-V866 HydrophobicContact CG-CG1 4.21Å; R849-W868 HydrophobicContact CB-CE3 4.01Å; R849-W868 HydrophobicContact CB-CH2 4.01Å; R849-W868 HydrophobicContact CB-CZ3 3.59Å; R849-W868 HydrophobicContact CG-CH2 4.39Å; R849-W868 HydrophobicContact CG-CZ3 4.37Å
850	G	80.1	Confident	76.7	Confident	11 Å²	11	61.7 Å²	61.7	11%	0.113	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	157.7	176.9	0	0	0	0	0	112.9	T848 V866 C867	T848-G850 PolarHBondContact O-N 2.96Å; G850-V866 WeakPolarHBondContact O-CA 3.42Å; G850-V866 WeakPolarHBondContact O-CG1 3.46Å; G850-C867 PolarHBondContact N-O 2.93Å; G850-C867 PolarHBondContact O-N 2.88Å
851	S	78.1	Confident	75.3	Confident	67 Å²	67	67.1 Å²	67.1	47%	0.469	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	130.4	169.4	-179.8	0	0	0	0	108.7
852	Q	75.3	Confident	74.1	Confident	16 Å²	16	64.3 Å²	64.3	8%	0.075	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	161.8	-177	-57.8	-61	-2.8	0	0	110.7	G650 P652 I655 K864 V865 C867	G650-Q852 PolarHBondContact O-OE1 2.83Å; P652-Q852 HydrophobicContact CG-CB 3.83Å; P652-Q852 HydrophobicContact CG-CG 3.7Å; I655-Q852 HydrophobicContact CD1-CB 4.02Å; Q852-K864 CarbonylContact O-C 3.59Å; Q852-K864 WeakPolarHBondContact O-CA 3.31Å; Q852-V865 PolarHBondContact N-O 2.84Å; Q852-V865 PolarHBondContact O-N 3.39Å; Q852-C867 WeakPolarHBondContact CG-SG 3.46Å
853	K	70.7	Confident	73.5	Confident	80 Å²	80	60.9 Å²	60.9	35%	0.348	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	129.6	-179.5	-70.5	-173	170.6	-157.2	0	112.2	Y855 I861 M863	K853-Y855 HydrophobicContact CB-CD2 4.2Å; K853-Y855 HydrophobicContact CB-CE2 3.45Å; K853-Y855 VanDerWaalsContact CB-CE2 3.45Å; K853-Y855 HydrophobicContact CD-CE1 4.35Å; K853-Y855 HydrophobicContact CD-CE2 4.42Å; K853-Y855 WeakPolarHBondContact CD-OH 3.35Å; K853-I861 PolarHBondContact NZ-O 3.29Å; K853-M863 CarbonylContact C-O 3.55Å; K853-M863 WeakPolarHBondContact CA-O 3.43Å
854	D	68.9	Low	72.9	Confident	13 Å²	13	64 Å²	64	7%	0.07	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	120.3	172	179.7	-4.5	0	0	0	109.9	R856 M863 V865	D854-R856 WeakPolarHBondContact OD1-CB 3.25Å; D854-R856 VanDerWaalsContact OD1-CG 3.27Å; D854-R856 WeakPolarHBondContact OD1-CG 3.37Å; D854-R856 PolarHBondContact OD1-N 2.85Å; D854-R856 IonicContact OD1-NE 3.77Å; D854-R856 PolarHBondContact OD1-NE 2.83Å; D854-R856 VanDerWaalsContact OD1-NE 3.13Å; D854-R856 IonicContact OD2-CZ 2.78Å; D854-R856 VanDerWaalsContact OD2-CZ 3.25Å; D854-R856 IonicContact OD2-NE 2.69Å; D854-R856 PolarHBondContact OD2-NE 3.13Å; D854-R856 IonicContact OD2-NH2 3.08Å; D854-R856 PolarHBondContact OD2-NH2 3.43Å; D854-M863 PolarHBondContact N-O 3.34Å; D854-M863 PolarHBondContact O-N 2.83Å; D854-V865 HydrophobicContact CB-CB 4.46Å; D854-V865 HydrophobicContact CB-CG2 3.45Å; D854-V865 VanDerWaalsContact CB-CG2 3.45Å
855	Y	67.5	Low	72.2	Confident	24 Å²	24	58.5 Å²	58.5	9%	0.094	30%	0.301	C	S	.	.			trans	-102.1	12.4	-171.4	-60.2	-98.3	0	0	0	113.5	H780 Y796 K853 K857 D858	H780-Y855 AromaticContact CE1-CD1 3.7Å; H780-Y855 AromaticContact CE1-CD2 3.47Å; H780-Y855 VanDerWaalsContact CE1-CD2 3.47Å; H780-Y855 WeakPolarHBondContact CE1-CD2 3.49Å; H780-Y855 AromaticContact CE1-CE1 3.87Å; H780-Y855 AromaticContact CE1-CE2 3.62Å; H780-Y855 AromaticContact CE1-CG 3.48Å; H780-Y855 VanDerWaalsContact CE1-CG 3.48Å; H780-Y855 AromaticContact CE1-CZ 3.8Å; Y796-Y855 WeakPolarHBondContact OH-CB 3.42Å; Y796-Y855 WeakPolarHBondContact OH-CD2 3.42Å; K853-Y855 HydrophobicContact CB-CD2 4.2Å; K853-Y855 HydrophobicContact CB-CE2 3.45Å; K853-Y855 VanDerWaalsContact CB-CE2 3.45Å; K853-Y855 HydrophobicContact CD-CE1 4.35Å; K853-Y855 HydrophobicContact CD-CE2 4.42Å; K853-Y855 WeakPolarHBondContact CD-OH 3.35Å; Y855-K857 PolarHBondContact O-N 2.81Å; Y855-D858 CarbonylContact O-C 3.56Å
856	R	63.8	Low	71.8	Confident	90 Å²	90	60.3 Å²	60.3	34%	0.34	31%	0.313	S	S	.	.	S	Bend	trans	-62.2	-39.6	180	-74.5	-179.9	-66	165.7	7.1	114.2	Y796 D854	Y796-R856 HydrophobicContact CD1-CG 3.36Å; Y796-R856 HydrophobicContact CE1-CG 4.21Å; Y796-R856 HydrophobicContact CG-CG 3.54Å; D854-R856 WeakPolarHBondContact OD1-CB 3.25Å; D854-R856 VanDerWaalsContact OD1-CG 3.27Å; D854-R856 WeakPolarHBondContact OD1-CG 3.37Å; D854-R856 PolarHBondContact OD1-N 2.85Å; D854-R856 IonicContact OD1-NE 3.77Å; D854-R856 PolarHBondContact OD1-NE 2.83Å; D854-R856 VanDerWaalsContact OD1-NE 3.13Å; D854-R856 IonicContact OD2-CZ 2.78Å; D854-R856 VanDerWaalsContact OD2-CZ 3.25Å; D854-R856 IonicContact OD2-NE 2.69Å; D854-R856 PolarHBondContact OD2-NE 3.13Å; D854-R856 IonicContact OD2-NH2 3.08Å; D854-R856 PolarHBondContact OD2-NH2 3.43Å
857	K	59.6	Low	71.8	Confident	181 Å²	181	57.2 Å²	57.2	79%	0.787	29%	0.294	S	S	*	.	S	Bend	trans	-93.7	-32.9	-177.5	-66.6	-175.8	-179.8	175.5	0	113	Y855 M863	Y855-K857 PolarHBondContact O-N 2.81Å; K857-M863 HydrophobicContact CB-SD 3.78Å; K857-M863 HydrophobicContact CD-SD 3.61Å; K857-M863 HydrophobicContact CG-SD 4.16Å
858	D	60.6	Low	71.7	Confident	56 Å²	56	57.6 Å²	57.6	30%	0.299	30%	0.296	S	S	.	.			trans	-138.4	105.6	175.6	-172.4	-24.5	0	0	0	110.4	Y855 S860 I861 G862	Y855-D858 CarbonylContact O-C 3.56Å; D858-S860 PolarHBondContact O-N 2.86Å; D858-S860 WeakPolarHBondContact OD1-CA 3.23Å; D858-S860 WeakPolarHBondContact OD1-CB 3.47Å; D858-S860 PolarHBondContact OD1-N 2.83Å; D858-S860 PolarHBondContact OD1-OG 2.95Å; D858-I861 PolarHBondContact OD1-N 2.99Å; D858-I861 VanDerWaalsContact OD1-N 3.16Å; D858-G862 WeakPolarHBondContact O-CA 3.45Å; D858-G862 PolarHBondContact O-N 2.99Å; D858-G862 VanDerWaalsContact O-N 3.16Å
859	A	54.9	Low	71.7	Confident	28 Å²	28	58 Å²	58	23%	0.231	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-13.6	-179.1	0	0	0	0	0	114.1	V778	V778-A859 HydrophobicContact CG1-CB 4.01Å
860	S	51.3	Low	71.8	Confident	101 Å²	101	55.5 Å²	55.5	71%	0.706	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-38.5	-174.7	63.7	0	0	0	0	113.5	D858	D858-S860 PolarHBondContact O-N 2.86Å; D858-S860 WeakPolarHBondContact OD1-CA 3.23Å; D858-S860 WeakPolarHBondContact OD1-CB 3.47Å; D858-S860 PolarHBondContact OD1-N 2.83Å; D858-S860 PolarHBondContact OD1-OG 2.95Å
861	I	59	Low	72	Confident	115 Å²	115	56 Å²	56	59%	0.59	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-36.4	-175.9	-59.4	173.6	0	0	0	111.5	K853 D858	K853-I861 PolarHBondContact NZ-O 3.29Å; D858-I861 PolarHBondContact OD1-N 2.99Å; D858-I861 VanDerWaalsContact OD1-N 3.16Å
862	G	58.5	Low	72.3	Confident	9 Å²	9	58 Å²	58	9%	0.093	29%	0.293	C	S	.	.			trans	71.9	129.7	-171.7	0	0	0	0	0	112.2	D858	D858-G862 WeakPolarHBondContact O-CA 3.45Å; D858-G862 PolarHBondContact O-N 2.99Å; D858-G862 VanDerWaalsContact O-N 3.16Å
863	M	70.1	Confident	72.7	Confident	94 Å²	94	58.8 Å²	58.8	46%	0.463	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	137.2	175.1	-70.5	-172.2	68.2	0	0	110.8	K853 D854 K857 V865	K853-M863 CarbonylContact C-O 3.55Å; K853-M863 WeakPolarHBondContact CA-O 3.43Å; D854-M863 PolarHBondContact N-O 3.34Å; D854-M863 PolarHBondContact O-N 2.83Å; K857-M863 HydrophobicContact CB-SD 3.78Å; K857-M863 HydrophobicContact CD-SD 3.61Å; K857-M863 HydrophobicContact CG-SD 4.16Å; M863-V865 PolarHBondContact O-N 2.89Å
864	K	72.6	Confident	73.4	Confident	167 Å²	167	55 Å²	55	73%	0.726	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	118.9	173.5	-71	-177.9	-177.8	175.4	0	110.1	Q852	Q852-K864 CarbonylContact O-C 3.59Å; Q852-K864 WeakPolarHBondContact O-CA 3.31Å
865	V	77.1	Confident	74.2	Confident	20 Å²	20	59.8 Å²	59.8	12%	0.121	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	125.2	170.8	176.9	0	0	0	0	108	I655 A664 Q852 D854 M863	I655-V865 HydrophobicContact CG2-CG1 4.09Å; A664-V865 HydrophobicContact CB-CG1 3.83Å; Q852-V865 PolarHBondContact N-O 2.84Å; Q852-V865 PolarHBondContact O-N 3.39Å; D854-V865 HydrophobicContact CB-CB 4.46Å; D854-V865 HydrophobicContact CB-CG2 3.45Å; D854-V865 VanDerWaalsContact CB-CG2 3.45Å; M863-V865 PolarHBondContact O-N 2.89Å
866	V	82.8	Confident	75	Confident	65 Å²	65	59.3 Å²	59.3	39%	0.394	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	129.5	173.3	-163.7	0	0	0	0	108.4	R849 G850	R849-V866 HydrophobicContact CG-CG1 4.21Å; G850-V866 WeakPolarHBondContact O-CA 3.42Å; G850-V866 WeakPolarHBondContact O-CG1 3.46Å
867	C	88.3	Confident	76.3	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	157.2	-177.7	64.1	0	0	0	0	112.4	A664 C666 G850 Q852	A664-C867 HydrophobicContact CB-CB 3.93Å; A664-C867 CarbonylContact O-C 3.56Å; A664-C867 WeakPolarHBondContact O-CA 3.41Å; A664-C867 VanDerWaalsContact O-CB 3.31Å; A664-C867 WeakPolarHBondContact O-CB 3.43Å; C666-C867 HydrophobicContact CB-CB 3.74Å; C666-C867 WeakPolarHBondContact CB-SG 3.44Å; C666-C867 WeakPolarHBondContact SG-CB 3.48Å; C666-C867 CovalentContact SG-SG 2.04Å; C666-C867 PolarHBondContact SG-SG 2.83Å; G850-C867 PolarHBondContact N-O 2.93Å; G850-C867 PolarHBondContact O-N 2.88Å; Q852-C867 WeakPolarHBondContact CG-SG 3.46Å
868	W	90.4	Very high	77.8	Confident	7 Å²	7	46.7 Å²	46.7	3%	0.027	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	114.4	166.4	-68.3	107.9	0	0	0	109.3	D663 A664 L665 C666 V822 I825 A836 V847 R849 V870	D663-W868 PolarHBondContact OD2-NE1 3.17Å; A664-W868 PolarHBondContact O-N 2.9Å; L665-W868 HydrophobicContact CD2-CB 3.99Å; C666-W868 PolarHBondContact N-O 2.98Å; V822-W868 HydrophobicContact CG1-CD2 4.24Å; V822-W868 HydrophobicContact CG1-CH2 4.31Å; V822-W868 HydrophobicContact CG1-CZ2 3.78Å; V822-W868 HydrophobicContact CG2-CG 4.24Å; I825-W868 HydrophobicContact CD1-CH2 4.38Å; I825-W868 HydrophobicContact CD1-CZ2 4.36Å; I825-W868 HydrophobicContact CG1-CH2 4.31Å; A836-W868 HydrophobicContact CB-CE3 4.1Å; A836-W868 HydrophobicContact CB-CH2 3.62Å; A836-W868 HydrophobicContact CB-CZ2 4.31Å; A836-W868 HydrophobicContact CB-CZ3 3.49Å; A836-W868 VanDerWaalsContact CB-CZ3 3.49Å; V847-W868 HydrophobicContact CB-CB 4.08Å; V847-W868 HydrophobicContact CB-CE3 4.33Å; V847-W868 HydrophobicContact CG2-CB 3.96Å; V847-W868 HydrophobicContact CG2-CD2 4Å; V847-W868 HydrophobicContact CG2-CE3 3.64Å; V847-W868 HydrophobicContact CG2-CG 4.17Å; V847-W868 HydrophobicContact CG2-CZ3 4.43Å; R849-W868 HydrophobicContact CB-CE3 4.01Å; R849-W868 HydrophobicContact CB-CH2 4.01Å; R849-W868 HydrophobicContact CB-CZ3 3.59Å; R849-W868 HydrophobicContact CG-CH2 4.39Å; R849-W868 HydrophobicContact CG-CZ3 4.37Å; W868-V870 PolarHBondContact O-N 3.48Å
869	F	88.6	Confident	79.2	Confident	17 Å²	17	47.2 Å²	47.2	8%	0.075	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	118.7	-178.7	-164.8	-85.5	0	0	0	110.4	V648 P652 C666 N668 V847 T848 H871	V648-F869 HydrophobicContact CG1-CD2 4.07Å; V648-F869 HydrophobicContact CG1-CE2 4.21Å; V648-F869 HydrophobicContact CG1-CG 4.23Å; V648-F869 HydrophobicContact CG1-CZ 4.49Å; P652-F869 HydrophobicContact CB-CE2 4.31Å; C666-F869 HydrophobicContact CB-CD2 4.46Å; C666-F869 CarbonylContact O-C 3.56Å; C666-F869 VanDerWaalsContact O-CA 3.29Å; C666-F869 WeakPolarHBondContact O-CA 3.42Å; C666-F869 VanDerWaalsContact SG-CA 3.57Å; N668-F869 HydrophobicContact CB-CZ 4.27Å; V847-F869 VanDerWaalsContact CA-O 3.27Å; V847-F869 WeakPolarHBondContact CA-O 3.38Å; V847-F869 WeakPolarHBondContact CB-O 3.25Å; T848-F869 PolarHBondContact N-O 3.04Å; T848-F869 VanDerWaalsContact N-O 3.12Å; T848-F869 WeakPolarHBondContact O-CB 3.5Å; T848-F869 PolarHBondContact O-N 3.16Å; F869-H871 AromaticContact CD1-CE1 3.78Å; F869-H871 AromaticContact CD1-ND1 3.64Å; F869-H871 AromaticContact CE1-ND1 3.88Å
870	V	88.9	Confident	80.8	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.024	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	119.2	174.1	-173.9	0	0	0	0	109	C666 F667 L838 L845 V847 W868 L877	C666-V870 PolarHBondContact O-N 2.9Å; F667-V870 HydrophobicContact CB-CB 4.25Å; L838-V870 HydrophobicContact CD2-CG2 3.96Å; L845-V870 HydrophobicContact CD1-CG1 4.02Å; V847-V870 HydrophobicContact CG1-CG2 3.86Å; W868-V870 PolarHBondContact O-N 3.48Å; V870-L877 HydrophobicContact CB-CD2 4.31Å; V870-L877 HydrophobicContact CG1-CB 4.12Å; V870-L877 HydrophobicContact CG2-CB 4.48Å; V870-L877 HydrophobicContact CG2-CD2 3.85Å
871	H	85	Confident	82.5	Confident	22 Å²	22	46.4 Å²	46.4	10%	0.102	25%	0.254	C	S	.	.			trans	-75.7	-179.1	-178.6	-61.1	-68.6	0	0	0	112.2	Y646 T848 F869 N873 G874	Y646-H871 AromaticContact CD1-CE1 3.61Å; Y646-H871 AromaticContact CD1-ND1 3.65Å; Y646-H871 AromaticContact CD1-NE2 3.97Å; Y646-H871 HydrophobicContact CE1-CB 4.41Å; Y646-H871 AromaticContact CE1-CG 3.93Å; T848-H871 PolarHBondContact OG1-NE2 2.85Å; F869-H871 AromaticContact CD1-CE1 3.78Å; F869-H871 AromaticContact CD1-ND1 3.64Å; F869-H871 AromaticContact CE1-ND1 3.88Å; H871-N873 PolarHBondContact O-N 3.36Å; H871-G874 PolarHBondContact O-N 3.07Å
872	N	83.6	Confident	83.8	Confident	110 Å²	110	42.9 Å²	42.9	59%	0.588	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	54.4	49.9	172.1	-59	-17	0	0	0	114.6	G874 E875	N872-G874 PolarHBondContact O-N 3.05Å; N872-G874 VanDerWaalsContact O-N 3.15Å; N872-E875 HydrophobicContact CB-CB 4.16Å; N872-E875 VanDerWaalsContact O-CB 3.28Å; N872-E875 WeakPolarHBondContact O-CB 3.27Å; N872-E875 PolarHBondContact O-N 3.32Å; N872-E875 VanDerWaalsContact O-N 3.09Å
873	N	84.7	Confident	85.3	Confident	32 Å²	32	45.7 Å²	45.7	17%	0.171	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	55.3	32.2	179	-66.1	-20.4	0	0	0	114.4	N668 I669 N670 H871 E875 H882	N668-N873 VanDerWaalsContact O-CA 3.23Å; N668-N873 WeakPolarHBondContact O-CA 3.45Å; N668-N873 PolarHBondContact O-OD1 3.36Å; I669-N873 HydrophobicContact CD1-CB 3.9Å; I669-N873 WeakPolarHBondContact CD1-O 3.24Å; N670-N873 PolarHBondContact N-OD1 3.25Å; N670-N873 VanDerWaalsContact N-OD1 3.14Å; H871-N873 PolarHBondContact O-N 3.36Å; N873-E875 VanDerWaalsContact C-N 3.3Å; N873-E875 PolarHBondContact O-N 3.35Å; N873-H882 HydrophobicContact CB-CB 4.21Å; N873-H882 PolarHBondContact ND2-CE1 2.83Å; N873-H882 PolarHBondContact ND2-NE2 3.17Å; N873-H882 VanDerWaalsContact ND2-NE2 3.13Å
874	G	84.9	Confident	86.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	75	16.2	179.3	0	0	0	0	0	114.3	H871 N872 G876 L877 I878	H871-G874 PolarHBondContact O-N 3.07Å; N872-G874 PolarHBondContact O-N 3.05Å; N872-G874 VanDerWaalsContact O-N 3.15Å; G874-G876 PolarHBondContact O-N 2.81Å; G874-L877 WeakPolarHBondContact O-CB 3.49Å; G874-L877 PolarHBondContact O-N 3.24Å; G874-I878 PolarHBondContact O-N 2.63Å
875	E	85.7	Confident	87.3	Confident	113 Å²	113	39.3 Å²	39.3	53%	0.528	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	130.3	178.3	-174.8	175.9	-163.2	0	0	111.7	N872 N873 L877	N872-E875 HydrophobicContact CB-CB 4.16Å; N872-E875 VanDerWaalsContact O-CB 3.28Å; N872-E875 WeakPolarHBondContact O-CB 3.27Å; N872-E875 PolarHBondContact O-N 3.32Å; N872-E875 VanDerWaalsContact O-N 3.09Å; N873-E875 VanDerWaalsContact C-N 3.3Å; N873-E875 PolarHBondContact O-N 3.35Å; E875-L877 PolarHBondContact O-N 2.81Å
876	G	85.4	Confident	88.1	Confident	14 Å²	14	41.6 Å²	41.6	14%	0.144	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	-12.4	-176.1	0	0	0	0	0	115.5	G874	G874-G876 PolarHBondContact O-N 2.81Å
877	L	90.2	Very high	88.6	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-46.8	167.1	175.3	66.3	0	0	0	110.9	L665 F667 F814 F818 V840 K841 L845 V870 G874 E875	L665-L877 HydrophobicContact CB-CD2 4.46Å; L665-L877 HydrophobicContact CD1-CD1 3.65Å; L665-L877 HydrophobicContact CD1-CD2 4.41Å; F667-L877 HydrophobicContact CD1-CD2 3.78Å; F667-L877 HydrophobicContact CE1-CD2 4.13Å; F814-L877 HydrophobicContact CE1-CD1 4.05Å; F814-L877 HydrophobicContact CE1-CG 4.15Å; F814-L877 HydrophobicContact CZ-CD1 4.31Å; F814-L877 HydrophobicContact CZ-CD2 4.38Å; F814-L877 HydrophobicContact CZ-CG 3.9Å; F818-L877 HydrophobicContact CE2-CD1 4.48Å; V840-L877 HydrophobicContact CG1-CD1 4.17Å; V840-L877 HydrophobicContact CG2-CD1 3.93Å; K841-L877 PolarHBondContact NZ-O 3.49Å; L845-L877 HydrophobicContact CD1-CB 4.28Å; V870-L877 HydrophobicContact CB-CD2 4.31Å; V870-L877 HydrophobicContact CG1-CB 4.12Å; V870-L877 HydrophobicContact CG2-CB 4.48Å; V870-L877 HydrophobicContact CG2-CD2 3.85Å; G874-L877 WeakPolarHBondContact O-CB 3.49Å; G874-L877 PolarHBondContact O-N 3.24Å; E875-L877 PolarHBondContact O-N 2.81Å
878	I	91.6	Very high	88.7	Confident	7 Å²	7	45.1 Å²	45.1	4%	0.036	26%	0.26	C	S	.	.	S	Bend	trans	-80.7	150.9	175.5	67.9	-178.7	0	0	0	110.9	F667 L810 F814 G874 H882 Y885	F667-I878 HydrophobicContact CE2-CG2 4.01Å; F667-I878 HydrophobicContact CZ-CG2 3.92Å; L810-I878 HydrophobicContact CD2-CD1 4.22Å; F814-I878 HydrophobicContact CE2-CG2 4.38Å; F814-I878 HydrophobicContact CZ-CG2 4.17Å; G874-I878 PolarHBondContact O-N 2.63Å; I878-H882 HydrophobicContact CD1-CB 4.02Å; I878-Y885 HydrophobicContact CD1-CE2 4.25Å
879	D	89.6	Confident	88.7	Confident	66 Å²	66	48.9 Å²	48.9	35%	0.353	28%	0.281	S	S	.	.	S	Bend	trans	-70.7	128.2	171.8	-59.6	-31.1	0	0	0	109.7	H808 Q813 K841 Y885	H808-D879 IonicContact CE1-OD2 3.11Å; H808-D879 IonicContact NE2-OD2 3.06Å; Q813-D879 PolarHBondContact OE1-OD2 3.04Å; K841-D879 IonicContact NZ-OD1 3.84Å; K841-D879 PolarHBondContact NZ-OD1 2.93Å; K841-D879 IonicContact NZ-OD2 2.75Å; D879-Y885 VanDerWaalsContact O-CE2 3.3Å; D879-Y885 WeakPolarHBondContact O-CE2 3.3Å; D879-Y885 PolarHBondContact O-OH 3.38Å
880	G	88.3	Confident	88.8	Confident	52 Å²	52	49 Å²	49	54%	0.536	28%	0.282	S	S	.	.	S	Bend	trans	73.1	-142.7	-176.2	0	0	0	0	0	113.1
881	V	87.9	Confident	88.8	Confident	61 Å²	61	53 Å²	53	37%	0.37	30%	0.299	S	S	.	.			trans	-122	154.5	176	-67.7	0	0	0	0	111	T883 D884 Y885	V881-T883 VanDerWaalsContact CG2-OG1 3.29Å; V881-T883 WeakPolarHBondContact CG2-OG1 3.36Å; V881-T883 PolarHBondContact O-N 3.11Å; V881-D884 WeakPolarHBondContact CG2-OD2 3.48Å; V881-D884 PolarHBondContact N-OD2 2.91Å; V881-D884 VanDerWaalsContact O-CB 3.27Å; V881-D884 WeakPolarHBondContact O-CB 3.46Å; V881-D884 PolarHBondContact O-N 3.06Å; V881-Y885 WeakPolarHBondContact O-CD2 3.4Å
882	H	85.8	Confident	89	Confident	40 Å²	40	54.5 Å²	54.5	19%	0.185	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-55.2	-29.1	-176.3	62.1	-73.4	0	0	0	114.5	I669 E671 N873 I878 D884 Y885	I669-H882 HydrophobicContact CD1-CB 3.64Å; I669-H882 HydrophobicContact CG2-CB 4.28Å; E671-H882 IonicContact OE1-CD2 3.87Å; E671-H882 PolarHBondContact OE1-CD2 3.23Å; E671-H882 IonicContact OE1-NE2 3.65Å; E671-H882 PolarHBondContact OE1-NE2 3.28Å; N873-H882 HydrophobicContact CB-CB 4.21Å; N873-H882 PolarHBondContact ND2-CE1 2.83Å; N873-H882 PolarHBondContact ND2-NE2 3.17Å; N873-H882 VanDerWaalsContact ND2-NE2 3.13Å; I878-H882 HydrophobicContact CD1-CB 4.02Å; H882-D884 PolarHBondContact O-N 2.92Å; H882-Y885 PolarHBondContact O-N 2.8Å
883	T	89.8	Confident	89.3	Confident	68 Å²	68	51.6 Å²	51.6	42%	0.417	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-67	-22.8	177.2	52.1	0	0	0	0	113.6	V881 Y885 I886	V881-T883 VanDerWaalsContact CG2-OG1 3.29Å; V881-T883 WeakPolarHBondContact CG2-OG1 3.36Å; V881-T883 PolarHBondContact O-N 3.11Å; T883-Y885 PolarHBondContact O-N 3.3Å; T883-I886 HydrophobicContact CG2-CD1 4.11Å; T883-I886 WeakPolarHBondContact O-CB 3.44Å; T883-I886 PolarHBondContact O-N 3.36Å
884	D	91.6	Very high	89.6	Confident	108 Å²	108	52.7 Å²	52.7	58%	0.578	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-67.3	-18.8	178	-59	-26.3	0	0	0	112	V881 H882	V881-D884 WeakPolarHBondContact CG2-OD2 3.48Å; V881-D884 PolarHBondContact N-OD2 2.91Å; V881-D884 VanDerWaalsContact O-CB 3.27Å; V881-D884 WeakPolarHBondContact O-CB 3.46Å; V881-D884 PolarHBondContact O-N 3.06Å; H882-D884 PolarHBondContact O-N 2.92Å
885	Y	93.6	Very high	89.8	Confident	20 Å²	20	55.8 Å²	55.8	8%	0.078	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-97.2	3.4	-179.9	-57.7	-88.2	0	0	0	113	L677 R678 H808 G809 L810 Q813 I878 D879 V881 H882 T883	L677-Y885 CarbonylContact C-O 3.59Å; L677-Y885 WeakPolarHBondContact CA-O 3.17Å; R678-Y885 PolarHBondContact N-O 3.35Å; H808-Y885 PolarHBondContact CE1-OH 2.91Å; G809-Y885 VanDerWaalsContact C-CE1 3.45Å; L810-Y885 HydrophobicContact CD2-CD1 4.17Å; L810-Y885 HydrophobicContact CD2-CD2 3.49Å; L810-Y885 VanDerWaalsContact CD2-CD2 3.49Å; L810-Y885 HydrophobicContact CD2-CE2 3.95Å; L810-Y885 HydrophobicContact CD2-CG 3.61Å; L810-Y885 HydrophobicContact CG-CD1 3.93Å; L810-Y885 HydrophobicContact CG-CD2 4.07Å; L810-Y885 HydrophobicContact CG-CG 3.62Å; Q813-Y885 PolarHBondContact NE2-OH 3.14Å; I878-Y885 HydrophobicContact CD1-CE2 4.25Å; D879-Y885 VanDerWaalsContact O-CE2 3.3Å; D879-Y885 WeakPolarHBondContact O-CE2 3.3Å; D879-Y885 PolarHBondContact O-OH 3.38Å; V881-Y885 WeakPolarHBondContact O-CD2 3.4Å; H882-Y885 PolarHBondContact O-N 2.8Å; T883-Y885 PolarHBondContact O-N 3.3Å
886	I	93.5	Very high	90.1	Very high	67 Å²	67	52.2 Å²	52.2	34%	0.344	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	128.9	177.1	-63.4	174.2	0	0	0	109.6	E671 T675 V676 L677 T883	E671-I886 HydrophobicContact CG-CD1 4.35Å; T675-I886 HydrophobicContact CG2-CB 4.48Å; T675-I886 HydrophobicContact CG2-CD1 3.95Å; T675-I886 HydrophobicContact CG2-CG1 3.83Å; T675-I886 HydrophobicContact CG2-CG2 3.94Å; V676-I886 WeakPolarHBondContact O-CA 3.38Å; L677-I886 HydrophobicContact CD2-CG1 3.86Å; T883-I886 HydrophobicContact CG2-CD1 4.11Å; T883-I886 WeakPolarHBondContact O-CB 3.44Å; T883-I886 PolarHBondContact O-N 3.36Å
887	V	93.9	Very high	90.4	Very high	12 Å²	12	54.7 Å²	54.7	7%	0.073	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	152	179.6	-65.6	0	0	0	0	110.7	V676 R678 N889	V676-V887 HydrophobicContact CB-CG2 3.87Å; V676-V887 HydrophobicContact CG1-CG2 3.55Å; V676-V887 PolarHBondContact O-N 3.3Å; R678-V887 HydrophobicContact CB-CG1 3.95Å; R678-V887 VanDerWaalsContact NH2-CG1 3.32Å; V887-N889 VanDerWaalsContact C-N 3.3Å; V887-N889 WeakPolarHBondContact CG2-O 3.48Å; V887-N889 PolarHBondContact O-N 3.02Å
888	P	89.7	Confident	90.4	Very high	128 Å²	128	58.6 Å²	58.6	83%	0.831	34%	0.339	S	S	*	.	S	Bend	trans	-72.8	-21.6	-172.8	28.3	-35.7	0	0	0	113.7
889	N	91	Very high	90.3	Very high	86 Å²	86	62.6 Å²	62.6	46%	0.46	36%	0.362	S	S	.	.	S	Bend	trans	-152.5	171.9	-173.6	62.1	5.7	0	0	0	111.2	V676 V887 F891	V676-N889 WeakPolarHBondContact CG1-O 3.29Å; V887-N889 VanDerWaalsContact C-N 3.3Å; V887-N889 WeakPolarHBondContact CG2-O 3.48Å; V887-N889 PolarHBondContact O-N 3.02Å; N889-F891 PolarHBondContact ND2-O 3.01Å; N889-F891 PolarHBondContact OD1-O 3.19Å
890	L	89.3	Confident	90.4	Very high	18 Å²	18	62.3 Å²	62.3	9%	0.094	36%	0.363	C	S	.	.			trans	-77.7	-20.4	-176	-164.1	64.7	0	0	0	113.6	V676 N690 K712 E725	V676-L890 HydrophobicContact CG1-CD1 4.06Å; N690-L890 HydrophobicContact CB-CD1 4.11Å; N690-L890 WeakPolarHBondContact CB-O 3.25Å; N690-L890 PolarHBondContact ND2-O 2.94Å; N690-L890 WeakPolarHBondContact O-CD1 3.43Å; K712-L890 HydrophobicContact CB-CD2 4.21Å; E725-L890 HydrophobicContact CG-CD2 3.94Å
891	F	90.4	Very high	90.6	Very high	88 Å²	88	63.3 Å²	63.3	39%	0.386	35%	0.347	S	S	.	.			trans	-139.7	0	-175.3	-61.6	-76.1	0	0	0	112.8	G714 A716 Q723 V724 E725 W734 N889	G714-F891 VanDerWaalsContact CA-CE1 3.45Å; A716-F891 HydrophobicContact CB-CD1 3.9Å; A716-F891 HydrophobicContact CB-CE1 4.26Å; Q723-F891 HydrophobicContact CB-CE1 4.48Å; Q723-F891 HydrophobicContact CG-CD1 3.45Å; Q723-F891 VanDerWaalsContact CG-CD1 3.45Å; Q723-F891 HydrophobicContact CG-CD2 4.33Å; Q723-F891 HydrophobicContact CG-CE1 3.23Å; Q723-F891 HydrophobicContact CG-CE2 4.14Å; Q723-F891 HydrophobicContact CG-CG 3.97Å; Q723-F891 HydrophobicContact CG-CZ 3.59Å; Q723-F891 VanDerWaalsContact NE2-CE2 3.28Å; V724-F891 WeakPolarHBondContact O-CZ 3.03Å; E725-F891 HydrophobicContact CB-CE2 4.04Å; E725-F891 HydrophobicContact CB-CZ 3.95Å; W734-F891 HydrophobicContact CZ3-CE2 4.43Å; W734-F891 HydrophobicContact CZ3-CZ 4.41Å; N889-F891 PolarHBondContact ND2-O 3.01Å; N889-F891 PolarHBondContact OD1-O 3.19Å

Retrieved 891 of 891 residues in 6549.8 ms (Link to these results)

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